#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 0.05 -0.24 1.61 0.15 -1.26 -5.13 113.70 108.89 2dip s SER 2 Ca 0.00 -0.74 -0.29 0.00 0.70 0.00 0.00 55.95 55.62 2dip s SER 2 Cb 0.00 0.40 0.01 0.00 -1.71 0.00 0.00 66.02 64.72 2dip s SER 2 CO 0.00 -0.82 1.07 -0.55 1.20 0.00 0.00 173.24 174.14 2dip s SER 3 N -2.91 7.05 -0.47 5.45 0.15 -1.26 -5.00 113.70 116.70 2dip s SER 3 Ca 0.11 1.35 0.01 0.00 0.70 0.00 0.00 55.95 58.12 2dip s SER 3 Cb 0.04 -2.54 0.12 0.00 -1.71 0.00 0.00 66.02 61.93 2dip s SER 3 CO -0.05 -0.72 0.23 -0.83 1.20 0.00 0.00 173.24 173.07 2dip s GLY 4 N 1.39 2.23 0.12 9.45 0.00 -1.26 -5.08 107.32 114.17 2dip s GLY 4 Ca 0.46 -2.92 -0.31 0.00 0.00 0.00 0.00 44.72 41.94 2dip s GLY 4 CO 0.09 1.02 1.61 -0.56 0.00 0.00 0.00 173.10 175.26 2dip s SER 5 N 0.70 6.59 1.40 1.64 0.01 -1.26 -4.98 113.70 117.80 2dip s SER 5 Ca 0.14 2.57 -0.21 0.00 1.31 0.00 0.00 55.95 59.75 2dip s SER 5 Cb -0.22 -2.58 0.36 0.00 0.21 0.00 0.00 66.02 63.79 2dip s SER 5 CO -0.04 -0.86 0.93 -0.94 0.41 0.00 0.00 173.24 172.75 2dip s SER 6 N 1.74 -0.90 0.00 2.44 1.04 -1.26 -4.95 113.70 111.80 2dip s SER 6 Ca 0.72 0.97 0.00 0.00 0.48 0.00 0.00 55.95 58.12 2dip s SER 6 Cb -0.42 -1.41 0.00 0.00 0.10 0.00 0.00 66.02 64.29 2dip s SER 6 CO 0.32 -5.28 0.00 0.61 0.98 0.00 0.00 173.24 169.87 2dip n GLY 7 N 1.44 -1.85 2.93 7.32 0.00 -1.26 -5.04 105.19 108.73 2dip n GLY 7 Ca 0.11 0.70 -0.16 0.00 0.00 0.00 0.00 46.02 46.67 2dip n GLY 7 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2dip n LEU 8 N -0.04 -2.97 -3.62 0.99 7.94 -1.26 -5.01 117.00 113.03 2dip n LEU 8 Ca 0.00 -0.37 -0.01 0.00 -1.11 0.00 0.00 56.01 54.52 2dip n LEU 8 Cb 0.00 -2.23 -0.06 0.00 0.53 0.00 0.00 43.42 41.65 2dip n LEU 8 CO 0.00 0.45 0.73 -0.70 -1.11 0.00 0.00 177.39 176.76 2dip s GLU 9 N -5.89 0.31 -0.31 1.96 2.12 -1.26 -5.14 118.70 110.49 2dip s GLU 9 Ca 0.40 0.56 -0.01 0.00 0.36 0.00 0.00 54.97 56.28 2dip s GLU 9 Cb -0.18 0.09 0.06 0.00 0.26 0.00 0.00 34.13 34.37 2dip s GLU 9 CO 0.50 -0.07 0.02 -1.21 -0.54 0.00 0.00 175.26 173.95 2dip s GLU 10 N 1.38 2.29 0.31 4.30 2.02 -1.26 -5.08 118.70 122.66 2dip s GLU 10 Ca -0.08 -1.39 -0.03 0.00 0.02 0.00 0.00 54.97 53.49 2dip s GLU 10 Cb -0.04 -3.20 -0.01 0.00 0.10 0.00 0.00 34.13 30.99 2dip s GLU 10 CO -0.14 -0.69 0.41 -0.06 0.02 0.00 0.00 175.26 174.79 2dip s PHE 11 N 1.20 1.06 -1.83 1.61 0.40 -1.26 -4.90 117.98 114.26 2dip s PHE 11 Ca -0.03 -1.27 -0.22 0.00 -0.60 0.00 0.00 56.93 54.81 2dip s PHE 11 Cb -0.20 -0.18 0.21 0.00 0.51 0.00 0.00 43.02 43.36 2dip s PHE 11 CO -0.02 -1.02 0.62 1.63 0.70 0.00 0.00 175.22 177.13 2dip n LYS 12 N -0.51 -1.36 -2.23 0.44 4.01 -1.26 -4.83 118.16 112.41 2dip n LYS 12 Ca 0.02 0.20 -0.42 0.00 -0.51 0.00 0.00 58.31 57.60 2dip n LYS 12 Cb 0.62 -4.77 -0.03 0.00 -0.51 0.00 0.00 35.03 30.34 2dip n LYS 12 CO 0.00 0.00 0.00 1.21 -1.11 0.00 0.00 177.40 177.50 2dip s ASN 13 N -3.31 6.90 1.27 4.39 3.84 -1.26 -5.00 114.94 121.76 2dip s ASN 13 Ca 0.78 2.31 -0.19 0.00 0.21 0.00 0.00 52.86 55.97 2dip s ASN 13 Cb -0.45 -2.60 0.29 0.00 -0.55 0.00 0.00 41.25 37.94 2dip s ASN 13 CO 1.00 -0.57 0.65 -1.20 -2.79 0.00 0.00 177.10 174.20 2dip n SER 14 N 3.37 -3.36 -3.76 -4.21 7.64 -1.26 -5.06 113.62 106.98 2dip n SER 14 Ca 0.09 -0.57 -0.13 0.00 1.01 0.00 0.00 58.87 59.26 2dip n SER 14 Cb 0.43 -0.96 -0.08 0.00 -1.01 0.00 0.00 64.21 62.59 2dip n SER 14 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2dip s SER 15 N -2.54 -0.19 -0.44 6.43 0.15 -1.26 -5.10 113.70 110.76 2dip s SER 15 Ca 0.57 0.06 -0.29 0.00 0.70 0.00 0.00 55.95 56.99 2dip s SER 15 Cb -0.12 0.32 -0.09 0.00 -1.71 0.00 0.00 66.02 64.42 2dip s SER 15 CO 0.51 -0.47 2.35 0.29 1.20 0.00 0.00 173.24 177.12 2dip n LYS 16 N 1.19 1.18 -3.80 5.44 5.02 -1.26 -4.90 118.16 121.04 2dip n LYS 16 Ca -0.21 0.20 -0.13 0.00 -2.02 0.00 0.00 58.31 56.16 2dip n LYS 16 Cb 0.56 -2.96 -0.09 0.00 -0.02 0.00 0.00 35.03 32.52 2dip n LYS 16 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2dip s LEU 17 N 9.75 1.08 -0.07 -0.35 1.43 -1.26 -5.13 118.68 124.13 2dip s LEU 17 Ca 1.06 -0.01 -0.30 0.00 -1.03 0.00 0.00 54.13 53.85 2dip s LEU 17 Cb -0.49 1.08 -0.03 0.00 0.03 0.00 0.00 46.19 46.78 2dip s LEU 17 CO 0.36 -0.42 1.18 -0.69 0.23 0.00 0.00 176.35 177.01 2dip s VAL 18 N -1.35 4.31 0.02 -1.59 1.01 -1.26 -5.03 120.40 116.51 2dip s VAL 18 Ca -0.14 1.63 0.06 0.00 0.00 0.00 0.00 61.98 63.53 2dip s VAL 18 Cb -0.06 -4.05 -0.03 0.00 0.00 0.00 0.00 36.38 32.24 2dip s VAL 18 CO 0.03 -0.01 -0.16 0.00 0.00 0.00 0.00 175.10 174.96 2dip s ALA 19 N 2.29 2.65 0.61 5.51 0.00 -1.26 -5.13 121.76 126.42 2dip s ALA 19 Ca 0.55 -1.13 -0.12 0.00 0.00 0.00 0.00 51.96 51.26 2dip s ALA 19 Cb -0.24 -0.83 -0.04 0.00 0.00 0.00 0.00 23.12 22.01 2dip s ALA 19 CO 0.21 0.57 1.02 0.00 0.00 0.00 0.00 175.76 177.57 2dip s ALA 20 N -0.89 3.08 -0.54 0.00 0.00 -1.26 -5.02 121.76 117.14 2dip s ALA 20 Ca 0.14 -0.04 -0.17 0.00 0.00 0.00 0.00 51.96 51.89 2dip s ALA 20 Cb -0.11 -3.09 0.10 0.00 0.00 0.00 0.00 23.12 20.02 2dip s ALA 20 CO 0.04 -0.64 0.56 0.00 0.00 0.00 0.00 175.76 175.72 2dip s ALA 21 N -3.09 3.51 0.11 0.00 0.00 -1.26 -5.04 121.76 115.99 2dip s ALA 21 Ca 0.56 -2.22 0.08 0.00 0.00 0.00 0.00 51.96 50.38 2dip s ALA 21 Cb -0.11 -3.32 -0.04 0.00 0.00 0.00 0.00 23.12 19.65 2dip s ALA 21 CO 0.51 -2.06 -0.20 -1.83 0.00 0.00 0.00 175.76 172.18 2dip s GLU 22 N 2.12 1.12 -1.21 0.00 1.03 -1.26 -5.07 118.70 115.42 2dip s GLU 22 Ca 0.08 -1.19 -0.15 0.00 0.03 0.00 0.00 54.97 53.74 2dip s GLU 22 Cb -0.25 -1.30 0.15 0.00 -0.80 0.00 0.00 34.13 31.92 2dip s GLU 22 CO 0.06 0.29 1.47 0.15 -1.33 0.00 0.00 175.26 175.91 2dip s LYS 23 N -2.08 4.05 -0.29 -4.83 -0.14 -1.26 -4.88 119.74 110.31 2dip s LYS 23 Ca 0.07 -2.43 -0.21 0.00 -1.36 0.00 0.00 55.97 52.05 2dip s LYS 23 Cb -0.09 -5.14 0.18 0.00 -1.68 0.00 0.00 37.83 31.09 2dip s LYS 23 CO 0.04 -1.86 1.23 -2.00 -0.76 0.00 0.00 175.35 172.00 2dip s GLU 24 N 2.14 0.19 -0.40 1.68 2.12 -1.26 -5.08 118.70 118.09 2dip s GLU 24 Ca 0.44 0.27 -0.39 0.00 0.36 0.00 0.00 54.97 55.65 2dip s GLU 24 Cb -0.02 0.07 -0.15 0.00 0.26 0.00 0.00 34.13 34.29 2dip s GLU 24 CO 0.01 -0.03 2.12 0.54 -0.54 0.00 0.00 175.26 177.35 2dip n ARG 25 N 2.55 0.65 -0.06 4.30 3.00 -1.26 -4.77 116.66 121.07 2dip n ARG 25 Ca -0.14 0.19 -0.07 0.00 -0.01 0.00 0.00 57.85 57.82 2dip n ARG 25 Cb 0.57 -2.04 -0.09 0.00 0.00 0.00 0.00 32.46 30.90 2dip n ARG 25 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 177.63 179.10 2dip n LEU 26 N 8.41 0.69 -4.32 0.55 -0.00 -1.26 -5.05 117.00 116.03 2dip n LEU 26 Ca 0.45 -0.02 -0.17 0.00 -0.00 0.00 0.00 56.01 56.27 2dip n LEU 26 Cb 0.11 0.10 -0.10 0.00 -0.00 0.00 0.00 43.42 43.53 2dip n LEU 26 CO 0.81 0.39 -0.33 1.51 -0.00 0.00 0.00 177.39 179.77 2dip s ASP 27 N -4.65 1.76 -0.07 1.45 -4.77 -1.26 -5.03 116.67 104.11 2dip s ASP 27 Ca -0.09 -1.20 -0.00 0.00 -3.30 0.00 0.00 52.55 47.96 2dip s ASP 27 Cb 0.04 0.02 0.05 0.00 -1.09 0.00 0.00 42.92 41.94 2dip s ASP 27 CO 0.44 -0.51 1.94 0.29 0.70 0.00 0.00 175.17 178.04 2dip n LYS 28 N -0.39 1.17 -0.64 2.11 4.76 -1.26 -3.97 118.16 119.94 2dip n LYS 28 Ca -0.05 -0.33 0.02 0.00 -2.87 0.00 0.00 58.31 55.08 2dip n LYS 28 Cb 0.64 -1.13 0.20 0.00 -1.84 0.00 0.00 35.03 32.90 2dip n LYS 28 CO 0.00 0.00 0.00 1.58 -1.37 0.00 0.00 177.40 177.61 2dip n HIS 29 N 1.20 0.43 -0.14 2.13 -0.00 -1.26 -4.72 115.22 112.86 2dip n HIS 29 Ca 0.06 -1.49 -0.11 0.00 0.46 0.00 0.00 57.72 56.64 2dip n HIS 29 Cb 0.52 -0.34 -0.02 0.00 -0.12 0.00 0.00 29.99 30.04 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 0.96 0.80 0.00 0.27 -0.00 -1.94 -3.41 115.31 111.99 2dip h LEU 30 Ca 0.08 -0.37 0.00 0.00 -0.00 0.00 0.00 57.88 57.59 2dip h LEU 30 Cb 1.26 -0.22 0.00 0.00 -0.00 0.00 0.00 40.66 41.70 2dip h LEU 30 CO 0.15 0.99 0.00 0.61 -0.00 0.00 0.00 178.44 180.19 2dip n GLY 31 N -0.16 1.19 2.86 0.83 0.00 -1.26 -4.32 105.19 104.33 2dip n GLY 31 Ca -0.01 0.72 -0.12 0.00 0.00 0.00 0.00 46.02 46.61 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 0.84 -0.61 1.01 -1.26 -5.14 121.20 116.04 2dip s ILE 32 Ca 0.00 0.02 -0.11 0.00 0.00 0.00 0.00 60.65 60.56 2dip s ILE 32 Cb 0.00 -0.02 0.09 0.00 0.01 0.00 0.00 42.46 42.55 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 0.09 1.75 0.58 2.79 0.04 -1.26 -4.78 135.00 134.21 2dip s PRO 33 Ca -0.01 0.99 -0.18 0.00 0.04 0.00 0.00 61.00 61.85 2dip s PRO 33 Cb -0.01 -1.85 -0.04 0.00 0.04 0.00 0.00 34.50 32.64 2dip s PRO 33 CO -0.00 -1.95 1.10 0.00 0.04 0.00 0.00 177.00 176.19 2dip n ASN 35 N -1.72 0.52 0.00 0.00 4.13 0.26 -3.22 115.26 115.23 2dip n ASN 35 Ca 0.10 -0.14 0.00 0.00 1.68 0.00 0.00 54.58 56.23 2dip n ASN 35 Cb 0.52 1.09 0.00 0.00 -1.54 0.00 0.00 39.78 39.85 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 -2.12 0.00 0.16 6.41 5.15 -1.26 -4.66 115.26 118.94 2dip n ASN 36 Ca 0.00 0.08 0.05 0.00 -0.60 0.00 0.00 54.58 54.10 2dip n ASN 36 Cb 0.48 -0.31 0.15 0.00 -0.53 0.00 0.00 39.78 39.57 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 -3.29 -3.00 -2.31 0.00 4.76 -1.20 -4.96 118.16 108.16 2dip n LYS 38 Ca 0.01 0.43 -0.43 0.00 -2.87 0.00 0.00 58.31 55.46 2dip n LYS 38 Cb 0.64 -4.26 -0.02 0.00 -1.84 0.00 0.00 35.03 29.55 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 -5.32 4.22 -0.12 1.97 0.74 -1.26 -4.65 119.66 115.24 2dip s GLN 39 Ca 0.20 1.81 -0.05 0.00 0.05 0.00 0.00 55.36 57.37 2dip s GLN 39 Cb -0.09 -3.83 0.06 0.00 1.10 0.00 0.00 33.01 30.25 2dip s GLN 39 CO 0.25 -0.75 0.26 0.12 -0.55 0.00 0.00 175.29 174.62 2dip s PHE 40 N 3.65 -0.38 0.98 1.67 5.36 -1.26 -3.18 117.98 124.82 2dip s PHE 40 Ca 0.60 0.88 -0.12 0.00 -0.96 0.00 0.00 56.93 57.33 2dip s PHE 40 Cb -0.25 0.01 0.18 0.00 -0.34 0.00 0.00 43.02 42.62 2dip s PHE 40 CO 0.19 -0.29 1.09 -1.25 -1.46 0.00 0.00 175.22 173.50 2dip s PRO 41 N 1.83 0.55 -1.16 10.12 0.04 -1.26 -4.88 135.00 140.24 2dip s PRO 41 Ca -0.04 0.57 -0.10 0.00 0.04 0.00 0.00 61.00 61.47 2dip s PRO 41 Cb -0.11 -1.75 0.24 0.00 0.04 0.00 0.00 34.50 32.92 2dip s PRO 41 CO -0.09 -2.66 1.35 -0.89 0.04 0.00 0.00 177.00 174.76 2dip n ILE 42 N -4.13 4.58 -0.33 0.56 5.41 -1.24 -4.87 119.36 119.33 2dip n ILE 42 Ca 0.05 -5.18 0.14 0.00 1.00 0.00 0.00 62.75 58.76 2dip n ILE 42 Cb 0.57 -2.45 0.28 0.00 -0.71 0.00 0.00 39.64 37.33 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 6.51 0.03 0.00 0.38 3.07 -1.89 -3.40 114.58 119.27 2dip h GLU 43 Ca 0.25 -0.00 -0.39 0.00 -0.50 0.00 0.00 59.36 58.71 2dip h GLU 43 Cb 0.81 -0.01 0.19 0.00 -0.84 0.00 0.00 28.75 28.90 2dip h GLU 43 CO 1.20 0.02 0.12 0.41 -1.40 0.00 0.00 179.01 179.36 2dip n GLY 44 N -1.48 -2.76 3.23 -3.84 0.00 -1.26 -5.00 105.19 94.08 2dip n GLY 44 Ca 0.22 -1.50 -0.28 0.00 0.00 0.00 0.00 46.02 44.46 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 -4.79 -2.36 -4.09 1.61 4.76 -1.26 -4.65 118.16 107.37 2dip n LYS 45 Ca 0.15 -0.68 -0.32 0.00 -2.87 0.00 0.00 58.31 54.58 2dip n LYS 45 Cb 0.58 -1.74 -0.16 0.00 -1.84 0.00 0.00 35.03 31.88 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 1.23 2.54 -0.04 0.00 1.51 -0.70 -2.75 117.35 119.13 2dip s TYR 47 Ca -0.01 -0.26 -0.14 0.00 -1.01 0.00 0.00 57.07 55.65 2dip s TYR 47 Cb -0.16 -1.23 0.03 0.00 -0.11 0.00 0.00 41.96 40.49 2dip s TYR 47 CO -0.10 0.52 0.33 -1.59 -1.11 0.00 0.00 175.55 173.60 2dip s LYS 48 N -2.87 0.61 -0.17 -0.62 -2.85 -1.08 -0.25 119.74 112.51 2dip s LYS 48 Ca 0.24 -0.02 -0.22 0.00 -1.00 0.00 0.00 55.97 54.97 2dip s LYS 48 Cb -0.08 0.28 -0.02 0.00 -2.06 0.00 0.00 37.83 35.94 2dip s LYS 48 CO 0.14 -0.15 0.67 0.00 0.10 0.00 0.00 175.35 176.11 2dip n THR 50 N 4.57 0.88 0.00 0.00 -2.24 0.37 -3.74 114.28 114.11 2dip n THR 50 Ca -0.00 -0.55 0.00 0.00 -2.27 0.00 0.00 64.05 61.23 2dip n THR 50 Cb 0.50 -0.10 0.00 0.00 -2.10 0.00 0.00 70.33 68.63 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 0.38 2.85 -1.89 -0.78 1.02 -1.26 -4.95 120.64 116.01 2dip n GLU 51 Ca 0.12 0.00 -0.12 0.00 -0.02 0.00 0.00 57.16 57.14 2dip n GLU 51 Cb 0.49 -0.92 0.06 0.00 -0.02 0.00 0.00 31.44 31.05 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 -1.41 2.39 -1.36 0.00 -1.09 -1.26 -4.72 121.20 113.75 2dip s ILE 53 Ca 0.36 -0.90 -0.03 0.00 -2.23 0.00 0.00 60.65 57.86 2dip s ILE 53 Cb -0.02 -1.95 -0.00 0.00 -1.58 0.00 0.00 42.46 38.91 2dip s ILE 53 CO 0.24 0.55 0.50 -0.62 -1.23 0.00 0.00 174.94 174.38 2dip n GLU 54 N 3.52 -3.26 -5.01 2.79 1.02 -1.26 -4.97 120.64 113.47 2dip n GLU 54 Ca -0.19 0.44 -0.30 0.00 -0.02 0.00 0.00 57.16 57.09 2dip n GLU 54 Cb 0.53 -4.56 -0.17 0.00 -0.02 0.00 0.00 31.44 27.22 2dip n GLU 54 CO 0.00 0.00 0.00 -0.47 1.18 0.00 0.00 177.13 177.84 2dip s TYR 55 N -3.86 2.27 -0.06 -0.32 6.14 -1.26 -5.02 117.35 115.24 2dip s TYR 55 Ca 0.06 -0.93 -0.06 0.00 0.64 0.00 0.00 57.07 56.78 2dip s TYR 55 Cb -0.02 -1.55 0.02 0.00 0.42 0.00 0.00 41.96 40.83 2dip s TYR 55 CO 0.88 -0.39 0.17 -1.01 0.64 0.00 0.00 175.55 175.83 2dip s HIS 56 N 0.46 -0.17 0.46 4.97 3.76 -1.26 -2.63 115.29 120.88 2dip s HIS 56 Ca -0.17 0.40 0.04 0.00 -0.15 0.00 0.00 55.06 55.18 2dip s HIS 56 Cb -0.17 0.05 -0.04 0.00 1.11 0.00 0.00 32.58 33.53 2dip s HIS 56 CO 0.07 -0.11 0.02 -0.51 -0.85 0.00 0.00 174.74 173.35 2dip s LEU 57 N -0.07 2.48 0.24 0.89 1.43 0.66 0.90 118.68 125.22 2dip s LEU 57 Ca -0.02 -1.54 0.11 0.00 -1.03 0.00 0.00 54.13 51.66 2dip s LEU 57 Cb -0.02 -0.73 -0.05 0.00 0.03 0.00 0.00 46.19 45.42 2dip s LEU 57 CO 0.00 -0.70 -0.20 0.00 0.23 0.00 0.00 176.35 175.69 2dip h GLN 59 N 2.57 0.26 0.22 0.00 5.75 -1.81 0.22 115.11 122.33 2dip h GLN 59 Ca -0.41 -0.02 -0.01 0.00 -0.15 0.00 0.00 58.65 58.06 2dip h GLN 59 Cb 1.24 -0.06 0.00 0.00 1.07 0.00 0.00 27.48 29.73 2dip h GLN 59 CO 0.57 0.17 -0.11 1.49 -2.65 0.00 0.00 178.83 178.31 2dip h GLU 60 N 0.27 -0.29 -0.70 1.69 4.81 -1.95 -1.77 114.58 116.64 2dip h GLU 60 Ca 0.74 0.02 0.19 0.00 -0.13 0.00 0.00 59.36 60.18 2dip h GLU 60 Cb 1.87 0.07 -0.03 0.00 0.63 0.00 0.00 28.75 31.28 2dip h GLU 60 CO -0.53 -0.19 0.49 0.00 -0.73 0.00 0.00 179.01 178.05 2dip h PHE 62 N 0.10 0.51 -0.11 0.00 3.57 -0.45 -2.28 116.94 118.28 2dip h PHE 62 Ca 0.34 -0.08 0.03 0.00 3.53 0.00 0.00 57.97 61.79 2dip h PHE 62 Cb 1.19 -0.14 -0.00 0.00 2.79 0.00 0.00 35.95 39.79 2dip h PHE 62 CO -0.00 0.60 0.18 0.22 -2.23 0.00 0.00 178.31 177.07 2dip h ASP 63 N 0.44 0.00 1.36 0.41 3.58 0.28 0.35 116.42 122.83 2dip h ASP 63 Ca 0.08 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.53 2dip h ASP 63 Cb 0.51 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.56 2dip h ASP 63 CO 0.03 0.00 -0.33 -1.28 -2.88 0.00 0.00 179.24 174.78 2dip h SER 64 N 0.00 0.00 -6.38 2.28 0.87 -1.48 -3.47 113.55 105.37 2dip h SER 64 Ca 0.05 -0.06 -0.49 0.00 -1.23 0.00 0.00 61.79 60.06 2dip h SER 64 Cb 0.40 0.00 -0.06 0.00 -0.44 0.00 0.00 62.40 62.30 2dip h SER 64 CO -0.00 0.03 -0.77 -1.22 -0.53 0.00 0.00 176.83 174.34 2dip n TYR 65 N -2.48 -2.19 0.04 2.24 4.02 0.12 -4.90 117.16 114.01 2dip n TYR 65 Ca 0.04 0.89 -0.03 0.00 -0.01 0.00 0.00 57.90 58.78 2dip n TYR 65 Cb 0.47 -3.82 -0.02 0.00 -0.02 0.00 0.00 39.34 35.96 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 -4.92 0.54 -0.00 0.00 -0.00 -1.26 -3.72 115.22 105.86 2dip n HIS 67 Ca -0.03 0.17 0.19 0.00 -0.00 0.00 0.00 57.72 58.05 2dip n HIS 67 Cb 0.09 -0.77 0.39 0.00 -0.00 0.00 0.00 29.99 29.70 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 -1.67 0.27 -0.00 -1.94 0.19 115.31 112.16 2dip h LEU 68 Ca 0.00 0.00 0.35 0.00 -0.00 0.00 0.00 57.88 58.23 2dip h LEU 68 Cb 0.58 0.00 -0.08 0.00 -0.00 0.00 0.00 40.66 41.16 2dip h LEU 68 CO 0.00 0.00 0.83 0.28 -0.00 0.00 0.00 178.44 179.55 2dip h SER 69 N 0.00 0.20 -1.73 -0.43 0.02 -1.80 -3.41 113.55 106.40 2dip h SER 69 Ca 0.30 0.05 -0.44 0.00 -0.84 0.00 0.00 61.79 60.86 2dip h SER 69 Cb 2.32 0.03 0.04 0.00 0.14 0.00 0.00 62.40 64.92 2dip h SER 69 CO -0.00 -0.00 -0.12 -1.00 -1.14 0.00 0.00 176.83 174.57 2dip s HIS 70 N -5.19 2.43 -0.65 3.45 3.76 0.66 -5.03 115.29 114.73 2dip s HIS 70 Ca -0.07 -0.33 -0.28 0.00 -0.15 0.00 0.00 55.06 54.24 2dip s HIS 70 Cb 0.25 -2.53 0.02 0.00 1.11 0.00 0.00 32.58 31.43 2dip s HIS 70 CO 0.81 -0.84 1.31 0.99 -0.85 0.00 0.00 174.74 176.16 2dip s THR 71 N -2.62 3.81 0.37 1.30 2.01 -1.26 -4.98 115.64 114.26 2dip s THR 71 Ca 0.58 0.61 0.07 0.00 0.31 0.00 0.00 61.69 63.27 2dip s THR 71 Cb -0.09 -4.72 -0.01 0.00 0.01 0.00 0.00 72.50 67.69 2dip s THR 71 CO 0.37 -1.51 0.44 -0.36 -0.69 0.00 0.00 174.62 172.87 2dip s PHE 72 N 5.71 2.94 -0.12 4.92 0.40 -1.26 -0.48 117.98 130.08 2dip s PHE 72 Ca 0.42 -0.32 -0.07 0.00 -0.60 0.00 0.00 56.93 56.37 2dip s PHE 72 Cb -0.09 -2.07 0.05 0.00 0.51 0.00 0.00 43.02 41.42 2dip s PHE 72 CO 0.21 -0.08 0.29 0.95 0.70 0.00 0.00 175.22 177.29 2dip s THR 73 N -2.29 -0.03 0.09 0.64 -4.23 -0.81 -3.92 115.64 105.09 2dip s THR 73 Ca 0.47 0.11 0.03 0.00 -1.18 0.00 0.00 61.69 61.12 2dip s THR 73 Cb -0.08 -0.44 -0.04 0.00 1.34 0.00 0.00 72.50 73.28 2dip s THR 73 CO 0.30 0.04 0.10 0.72 -0.54 0.00 0.00 174.62 175.24 2dip s PHE 74 N 1.08 3.21 0.59 3.99 -0.71 -1.06 -2.65 117.98 122.44 2dip s PHE 74 Ca -0.08 0.08 0.09 0.00 -1.04 0.00 0.00 56.93 55.99 2dip s PHE 74 Cb -0.08 -1.62 0.09 0.00 -1.21 0.00 0.00 43.02 40.20 2dip s PHE 74 CO -0.08 0.53 0.77 1.03 -1.34 0.00 0.00 175.22 176.13 2dip s ARG 75 N -2.50 2.22 0.26 1.99 0.52 -1.11 -0.17 118.95 120.15 2dip s ARG 75 Ca 0.30 -1.76 0.03 0.00 -0.52 0.00 0.00 55.73 53.77 2dip s ARG 75 Cb -0.12 -2.55 -0.05 0.00 0.52 0.00 0.00 34.95 32.75 2dip s ARG 75 CO 0.23 -0.92 0.04 -1.21 0.02 0.00 0.00 175.30 173.46 2dip s GLU 76 N -4.66 1.41 0.98 3.54 2.02 -1.26 -4.77 118.70 115.97 2dip s GLU 76 Ca 0.58 -1.75 -0.15 0.00 0.02 0.00 0.00 54.97 53.68 2dip s GLU 76 Cb -0.05 -0.54 -0.02 0.00 0.10 0.00 0.00 34.13 33.62 2dip s GLU 76 CO 0.37 -0.18 -0.08 0.36 0.02 0.00 0.00 175.26 175.75 2dip n LYS 77 N -0.48 -0.32 -0.89 1.61 2.85 -1.26 -4.60 118.16 115.06 2dip n LYS 77 Ca -0.03 -0.07 -0.29 0.00 -1.05 0.00 0.00 58.31 56.87 2dip n LYS 77 Cb 0.65 -1.55 0.02 0.00 -0.65 0.00 0.00 35.03 33.50 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 -0.32 0.00 -3.28 -1.58 5.12 -1.26 -2.94 116.66 112.40 2dip n ARG 78 Ca 0.03 0.00 -0.17 0.00 -1.93 0.00 0.00 57.85 55.78 2dip n ARG 78 Cb 0.56 -0.77 0.06 0.00 -1.16 0.00 0.00 32.46 31.16 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 2.18 -4.36 -3.94 0.55 3.02 -1.26 -5.02 115.26 106.43 2dip n ASN 79 Ca 0.04 -0.44 -0.09 0.00 -0.03 0.00 0.00 54.58 54.05 2dip n ASN 79 Cb 0.38 -4.06 -0.06 0.00 -0.61 0.00 0.00 39.78 35.44 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 -5.72 1.33 0.18 3.52 -1.52 -1.15 -5.11 119.66 111.19 2dip s GLN 80 Ca 0.31 -1.16 0.07 0.00 -1.95 0.00 0.00 55.36 52.64 2dip s GLN 80 Cb -0.14 0.43 -0.04 0.00 -0.22 0.00 0.00 33.01 33.04 2dip s GLN 80 CO 0.57 -0.53 -0.15 0.15 -0.25 0.00 0.00 175.29 175.09 2dip s LYS 81 N -3.97 1.27 1.02 2.91 -0.14 -1.26 -4.80 119.74 114.76 2dip s LYS 81 Ca 0.18 -1.51 -0.21 0.00 -1.36 0.00 0.00 55.97 53.07 2dip s LYS 81 Cb 0.01 -1.10 -0.10 0.00 -1.68 0.00 0.00 37.83 34.97 2dip s LYS 81 CO 0.03 0.19 -0.81 0.91 -0.76 0.00 0.00 175.35 174.91 2dip n TRP 82 N -0.15 -2.46 -3.85 3.18 7.02 -1.26 -4.39 117.44 115.52 2dip n TRP 82 Ca -0.10 0.32 -0.12 0.00 -1.02 0.00 0.00 57.50 56.58 2dip n TRP 82 Cb 0.59 -1.48 -0.11 0.00 -2.42 0.00 0.00 31.31 27.89 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 -2.48 0.31 -0.33 -0.99 0.52 0.75 -4.94 118.95 111.80 2dip s ARG 83 Ca 0.44 -0.11 -0.28 0.00 -0.52 0.00 0.00 55.73 55.26 2dip s ARG 83 Cb -0.06 0.13 0.01 0.00 0.52 0.00 0.00 34.95 35.56 2dip s ARG 83 CO 0.71 -0.06 1.02 -1.12 0.02 0.00 0.00 175.30 175.86 2dip s SER 84 N -0.65 6.85 0.75 0.23 0.01 -1.26 -2.58 113.70 117.04 2dip s SER 84 Ca -0.07 0.90 -0.13 0.00 1.31 0.00 0.00 55.95 57.96 2dip s SER 84 Cb -0.04 -2.51 0.05 0.00 0.21 0.00 0.00 66.02 63.72 2dip s SER 84 CO 0.01 -0.85 1.14 -0.76 0.41 0.00 0.00 173.24 173.18 2dip s LEU 85 N 3.56 3.20 0.51 2.44 1.43 -1.25 -5.01 118.68 123.55 2dip s LEU 85 Ca 0.43 2.10 -0.09 0.00 -1.03 0.00 0.00 54.13 55.54 2dip s LEU 85 Cb -0.12 -4.56 -0.04 0.00 0.03 0.00 0.00 46.19 41.49 2dip s LEU 85 CO 0.16 -2.16 0.87 -1.61 0.23 0.00 0.00 176.35 173.84 2dip s GLU 86 N -4.31 3.63 -0.21 1.70 0.41 -1.26 -4.93 118.70 113.72 2dip s GLU 86 Ca 0.68 0.47 -0.05 0.00 -0.41 0.00 0.00 54.97 55.65 2dip s GLU 86 Cb -0.23 -2.27 -0.19 0.00 -1.78 0.00 0.00 34.13 29.66 2dip s GLU 86 CO 0.49 -0.30 2.92 1.63 -0.49 0.00 0.00 175.26 179.51 2dip n LYS 87 N -2.21 1.81 -2.36 1.61 5.02 -1.26 -4.82 118.16 115.96 2dip n LYS 87 Ca 0.03 -0.97 -0.36 0.00 -2.02 0.00 0.00 58.31 54.99 2dip n LYS 87 Cb 0.54 -2.02 -0.03 0.00 -0.02 0.00 0.00 35.03 33.50 2dip n LYS 87 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 2dip s ARG 88 N 1.63 3.24 -0.45 1.97 0.52 -1.26 -4.88 118.95 119.71 2dip s ARG 88 Ca 0.54 -1.09 0.03 0.00 -0.52 0.00 0.00 55.73 54.69 2dip s ARG 88 Cb 0.24 -5.30 0.12 0.00 0.52 0.00 0.00 34.95 30.53 2dip s ARG 88 CO -0.01 -2.79 0.19 0.00 0.02 0.00 0.00 175.30 172.71 2dip s ALA 89 N 7.07 2.85 -0.07 2.13 0.00 -1.26 -4.97 121.76 127.50 2dip s ALA 89 Ca 0.57 -2.85 -0.14 0.00 0.00 0.00 0.00 51.96 49.54 2dip s ALA 89 Cb -0.01 -2.02 -0.10 0.00 0.00 0.00 0.00 23.12 20.98 2dip s ALA 89 CO -0.00 -1.92 0.54 0.22 0.00 0.00 0.00 175.76 174.59 2dip h ASP 90 N 6.93 -0.18 -0.10 0.00 3.58 -2.01 -3.43 116.42 121.21 2dip h ASP 90 Ca -0.06 -0.23 -0.37 0.00 0.42 0.00 0.00 57.03 56.80 2dip h ASP 90 Cb 0.94 0.05 -0.10 0.00 1.72 0.00 0.00 39.33 41.94 2dip h ASP 90 CO 0.59 0.38 1.75 -0.62 -2.88 0.00 0.00 179.24 178.46 2dip n GLU 91 N -4.90 0.10 0.00 0.28 4.71 -1.26 -4.51 120.64 115.05 2dip n GLU 91 Ca -0.05 -0.08 0.00 0.00 -0.01 0.00 0.00 57.16 57.01 2dip n GLU 91 Cb 0.20 -1.50 0.00 0.00 -1.01 0.00 0.00 31.44 29.13 2dip n GLU 91 CO 0.00 0.00 0.00 1.55 0.09 0.00 0.00 177.13 178.77 2dip n VAL 92 N 6.45 0.00 0.23 2.62 3.14 -1.26 -4.80 118.33 124.71 2dip n VAL 92 Ca 0.64 0.00 -0.16 0.00 -2.96 0.00 0.00 64.34 61.86 2dip n VAL 92 Cb 0.16 0.29 -0.08 0.00 -1.06 0.00 0.00 33.84 33.15 2dip n VAL 92 CO 0.00 0.00 0.00 0.28 -6.46 0.00 0.00 176.83 170.65 2dip h SER 93 N 0.00 -1.09 -5.03 6.55 0.02 -2.00 -3.48 113.55 108.53 2dip h SER 93 Ca 0.00 0.09 0.00 0.00 -0.84 0.00 0.00 61.79 61.04 2dip h SER 93 Cb 0.07 0.37 0.00 0.00 0.14 0.00 0.00 62.40 62.98 2dip h SER 93 CO 0.00 -0.54 -0.66 0.61 -1.14 0.00 0.00 176.83 175.10 2dip n GLY 94 N -1.49 -2.57 0.00 -3.77 0.00 -1.26 -4.83 105.19 91.27 2dip n GLY 94 Ca -0.10 0.82 0.04 0.00 0.00 0.00 0.00 46.02 46.79 2dip n GLY 94 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2dip n PRO 95 N 0.11 0.49 -0.20 1.61 -0.04 -1.26 -4.12 135.00 131.58 2dip n PRO 95 Ca 0.06 0.00 0.12 0.00 -0.04 0.00 0.00 63.50 63.65 2dip n PRO 95 Cb 0.24 -1.28 0.24 0.00 -0.04 0.00 0.00 33.50 32.66 2dip n PRO 95 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 2dip n SER 96 N -0.78 0.02 0.01 3.54 7.64 -1.26 -3.94 113.62 118.86 2dip n SER 96 Ca 0.06 1.01 0.00 0.00 1.01 0.00 0.00 58.87 60.96 2dip n SER 96 Cb 0.03 -0.41 0.00 0.00 -1.01 0.00 0.00 64.21 62.82 2dip n SER 96 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 2dip n SER 97 N -4.63 0.07 0.00 6.43 2.88 -1.26 -5.34 113.62 111.78 2dip n SER 97 Ca 0.17 0.04 0.00 0.00 -1.33 0.00 0.00 58.87 57.75 2dip n SER 97 Cb 0.57 -0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.02 2dip n SER 97 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42