#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2djb h SER 2 N 0.00 0.00 -5.46 1.61 4.64 -2.15 -3.50 113.55 108.69 2djb h SER 2 Ca 0.00 -0.16 0.20 0.00 -0.47 0.00 0.00 61.79 61.36 2djb h SER 2 Cb 0.00 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 62.03 2djb h SER 2 CO 0.00 0.76 0.60 -0.44 -0.87 0.00 0.00 176.83 176.88 2djb s SER 3 N -5.84 -0.07 0.00 4.97 0.01 -1.26 -5.18 113.70 106.34 2djb s SER 3 Ca -0.11 -0.48 0.00 0.00 1.31 0.00 0.00 55.95 56.67 2djb s SER 3 Cb 0.01 0.43 0.00 0.00 0.21 0.00 0.00 66.02 66.67 2djb s SER 3 CO 0.22 -0.82 0.00 0.61 0.41 0.00 0.00 173.24 173.66 2djb n GLY 4 N -0.60 1.29 3.58 3.44 0.00 -1.26 -5.18 105.19 106.47 2djb n GLY 4 Ca -0.04 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.92 2djb n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2djb s SER 5 N 0.02 -0.19 0.23 1.61 0.15 -1.26 -5.19 113.70 109.07 2djb s SER 5 Ca 0.00 0.05 0.01 0.00 0.70 0.00 0.00 55.95 56.71 2djb s SER 5 Cb 0.00 0.19 -0.04 0.00 -1.71 0.00 0.00 66.02 64.46 2djb s SER 5 CO 0.00 -0.28 0.15 -0.44 1.20 0.00 0.00 173.24 173.87 2djb s SER 6 N -1.98 0.53 0.33 5.45 0.01 -1.26 -5.18 113.70 111.60 2djb s SER 6 Ca 0.07 -1.46 -0.10 0.00 1.31 0.00 0.00 55.95 55.78 2djb s SER 6 Cb -0.01 0.40 0.02 0.00 0.21 0.00 0.00 66.02 66.63 2djb s SER 6 CO -0.05 -0.87 0.58 -0.83 0.41 0.00 0.00 173.24 172.48 2djb s GLY 7 N -3.21 0.87 -0.30 3.44 0.00 -1.26 -5.16 107.32 101.69 2djb s GLY 7 Ca 0.39 -1.09 -0.14 0.00 0.00 0.00 0.00 44.72 43.88 2djb s GLY 7 CO 0.15 -0.67 1.09 0.54 0.00 0.00 0.00 173.10 174.21 2djb s ASN 8 N -3.12 -0.38 0.05 1.64 4.22 -1.26 -5.17 114.94 110.92 2djb s ASN 8 Ca 0.23 0.27 -0.03 0.00 -2.14 0.00 0.00 52.86 51.19 2djb s ASN 8 Cb -0.02 1.33 -0.02 0.00 1.28 0.00 0.00 41.25 43.82 2djb s ASN 8 CO 0.14 -0.07 0.04 -0.76 -2.04 0.00 0.00 177.10 174.41 2djb s LEU 9 N 2.86 2.09 -0.15 3.54 1.43 -1.26 -5.17 118.68 122.02 2djb s LEU 9 Ca -0.02 -0.72 -0.31 0.00 -1.03 0.00 0.00 54.13 52.04 2djb s LEU 9 Cb -0.09 0.42 0.13 0.00 0.03 0.00 0.00 46.19 46.69 2djb s LEU 9 CO -0.11 -0.54 1.08 -0.55 0.23 0.00 0.00 176.35 176.46 2djb s SER 10 N -2.41 -0.26 0.00 2.29 0.15 -1.26 -5.03 113.70 107.18 2djb s SER 10 Ca -0.01 0.16 0.19 0.00 0.70 0.00 0.00 55.95 56.99 2djb s SER 10 Cb 0.02 0.24 0.35 0.00 -1.71 0.00 0.00 66.02 64.91 2djb s SER 10 CO -0.07 -0.33 1.29 -0.62 1.20 0.00 0.00 173.24 174.71 2djb n GLU 11 N 0.28 2.25 -2.91 5.44 4.71 -1.26 -4.97 120.64 124.17 2djb n GLU 11 Ca -0.06 -2.07 -0.20 0.00 -0.01 0.00 0.00 57.16 54.82 2djb n GLU 11 Cb 0.59 -1.43 0.06 0.00 -1.01 0.00 0.00 31.44 29.65 2djb n GLU 11 CO 0.00 0.00 0.00 -0.51 0.09 0.00 0.00 177.13 176.71 2djb s LEU 12 N -1.33 3.20 -0.50 -4.62 2.01 -1.26 -4.97 118.68 111.21 2djb s LEU 12 Ca 0.32 -0.61 -0.46 0.00 0.01 0.00 0.00 54.13 53.40 2djb s LEU 12 Cb 0.19 -1.99 -0.20 0.00 0.01 0.00 0.00 46.19 44.20 2djb s LEU 12 CO 0.26 -1.32 1.80 0.35 1.01 0.00 0.00 176.35 178.46 2djb n THR 13 N -2.29 0.01 0.99 5.49 -2.24 -1.26 -4.74 114.28 110.23 2djb n THR 13 Ca 0.13 -0.00 0.05 0.00 -2.27 0.00 0.00 64.05 61.96 2djb n THR 13 Cb 0.61 -0.52 0.30 0.00 -2.10 0.00 0.00 70.33 68.62 2djb n THR 13 CO 0.00 0.00 0.00 -0.81 -0.57 0.00 0.00 175.07 173.69 2djb n PRO 14 N 5.32 0.49 -0.03 -0.78 -0.04 -1.26 -3.22 135.00 135.48 2djb n PRO 14 Ca 0.40 0.00 -0.13 0.00 -0.04 0.00 0.00 63.50 63.72 2djb n PRO 14 Cb -0.05 -1.32 -0.11 0.00 -0.04 0.00 0.00 33.50 31.98 2djb n PRO 14 CO 0.00 0.00 0.00 1.88 -0.04 0.00 0.00 175.50 177.34 2djb h TYR 15 N 0.00 0.01 -0.69 0.54 0.05 -2.01 -3.29 116.97 111.58 2djb h TYR 15 Ca 0.00 -0.01 0.13 0.00 0.05 0.00 0.00 58.73 58.90 2djb h TYR 15 Cb 0.00 -0.00 -0.13 0.00 1.01 0.00 0.00 36.73 37.61 2djb h TYR 15 CO 0.00 0.63 -0.20 -0.89 -1.05 0.00 0.00 178.16 176.65 2djb n ILE 16 N -4.78 -0.32 -0.45 -2.88 -0.00 -1.20 -4.40 119.36 105.33 2djb n ILE 16 Ca -0.09 1.60 -0.24 0.00 -0.00 0.00 0.00 62.75 64.02 2djb n ILE 16 Cb 0.31 -2.18 0.20 0.00 -0.00 0.00 0.00 39.64 37.97 2djb n ILE 16 CO 0.00 0.00 0.00 0.18 -0.00 0.00 0.00 176.55 176.73 2djb n LEU 17 N -5.10 -1.19 -4.71 1.39 4.77 -1.24 -3.78 117.00 107.14 2djb n LEU 17 Ca 0.10 -0.49 -0.24 0.00 -0.03 0.00 0.00 56.01 55.34 2djb n LEU 17 Cb 0.33 -0.90 -0.07 0.00 -2.33 0.00 0.00 43.42 40.45 2djb n LEU 17 CO -0.09 -3.66 -0.20 0.00 -1.33 0.00 0.00 177.39 172.11 2djb n SER 19 N -1.15 0.51 -0.04 0.00 2.88 -1.26 -3.49 113.62 111.07 2djb n SER 19 Ca -0.02 0.00 -0.04 0.00 -1.33 0.00 0.00 58.87 57.48 2djb n SER 19 Cb 0.63 1.44 -0.01 0.00 -0.75 0.00 0.00 64.21 65.52 2djb n SER 19 CO 0.00 0.00 0.00 -0.38 -1.23 0.00 0.00 175.04 173.43 2djb n ILE 20 N -2.42 0.82 0.54 2.46 5.41 -1.26 -4.56 119.36 120.36 2djb n ILE 20 Ca -0.16 0.32 0.12 0.00 1.00 0.00 0.00 62.75 64.04 2djb n ILE 20 Cb 0.79 -2.00 0.26 0.00 -0.71 0.00 0.00 39.64 37.98 2djb n ILE 20 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2djb n LYS 22 N -2.28 -6.37 -4.13 0.00 4.76 -1.23 -4.94 118.16 103.98 2djb n LYS 22 Ca 0.04 0.71 -0.09 0.00 -2.87 0.00 0.00 58.31 56.10 2djb n LYS 22 Cb 0.45 -5.61 -0.10 0.00 -1.84 0.00 0.00 35.03 27.93 2djb n LYS 22 CO 0.00 0.00 0.00 0.20 -1.37 0.00 0.00 177.40 176.23 2djb s GLY 23 N -3.60 0.68 0.43 0.72 0.00 -1.26 -4.57 107.32 99.71 2djb s GLY 23 Ca 0.46 -1.31 -0.22 0.00 0.00 0.00 0.00 44.72 43.64 2djb s GLY 23 CO 0.78 -1.37 0.50 -1.72 0.00 0.00 0.00 173.10 171.29 2djb n TYR 24 N 0.02 -0.66 -3.24 1.90 4.02 -1.26 -2.93 117.16 115.01 2djb n TYR 24 Ca -0.12 0.60 -0.34 0.00 -0.01 0.00 0.00 57.90 58.03 2djb n TYR 24 Cb 0.62 -1.97 -0.06 0.00 -0.02 0.00 0.00 39.34 37.91 2djb n TYR 24 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 176.86 175.34 2djb s LEU 25 N 1.96 4.20 -0.16 7.72 1.43 -1.25 -4.91 118.68 127.68 2djb s LEU 25 Ca 0.63 1.19 -0.11 0.00 -1.03 0.00 0.00 54.13 54.81 2djb s LEU 25 Cb -0.60 -3.72 -0.07 0.00 0.03 0.00 0.00 46.19 41.84 2djb s LEU 25 CO 0.58 -0.06 -0.26 -0.38 0.23 0.00 0.00 176.35 176.47 2djb n ILE 26 N 0.17 1.24 -0.02 -0.59 -0.00 -1.26 -4.76 119.36 114.14 2djb n ILE 26 Ca -0.00 -0.08 -0.13 0.00 -0.00 0.00 0.00 62.75 62.54 2djb n ILE 26 Cb 0.52 -1.93 -0.14 0.00 -0.00 0.00 0.00 39.64 38.10 2djb n ILE 26 CO 0.00 0.00 0.00 -0.67 -0.00 0.00 0.00 176.55 175.88 2djb n ASP 27 N -4.02 1.25 -2.51 4.38 2.03 -1.26 -5.02 116.55 111.40 2djb n ASP 27 Ca -0.27 0.30 -0.10 0.00 0.52 0.00 0.00 54.79 55.24 2djb n ASP 27 Cb 0.61 -0.25 0.05 0.00 -0.72 0.00 0.00 41.12 40.81 2djb n ASP 27 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2djb n ALA 28 N -2.74 -1.45 -2.60 -1.67 0.00 -1.26 -4.96 120.51 105.83 2djb n ALA 28 Ca -0.24 0.02 -0.43 0.00 0.00 0.00 0.00 53.44 52.79 2djb n ALA 28 Cb 1.06 -2.67 -0.02 0.00 0.00 0.00 0.00 19.45 17.82 2djb n ALA 28 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 2djb s THR 29 N -3.23 4.33 -0.10 0.00 2.01 -1.05 -4.89 115.64 112.72 2djb s THR 29 Ca 0.14 1.27 -0.01 0.00 0.31 0.00 0.00 61.69 63.40 2djb s THR 29 Cb -0.02 -4.52 -0.03 0.00 0.01 0.00 0.00 72.50 67.94 2djb s THR 29 CO 0.44 -0.84 -0.07 -0.89 -0.69 0.00 0.00 174.62 172.58 2djb s THR 30 N 4.12 3.69 0.92 -0.82 2.01 -1.26 -0.71 115.64 123.60 2djb s THR 30 Ca 0.45 -0.46 -0.12 0.00 0.31 0.00 0.00 61.69 61.87 2djb s THR 30 Cb -0.09 -2.55 0.15 0.00 0.01 0.00 0.00 72.50 70.02 2djb s THR 30 CO 0.27 0.56 1.12 -0.63 -0.69 0.00 0.00 174.62 175.24 2djb s ILE 31 N -0.32 2.19 -0.14 1.82 1.01 -0.10 -4.90 121.20 120.77 2djb s ILE 31 Ca 0.05 0.06 0.02 0.00 0.00 0.00 0.00 60.65 60.78 2djb s ILE 31 Cb -0.13 -2.71 -0.10 0.00 0.01 0.00 0.00 42.46 39.53 2djb s ILE 31 CO 0.02 -0.08 -0.11 0.41 0.00 0.00 0.00 174.94 175.18 2djb n THR 32 N -3.87 0.84 0.02 2.92 -1.04 -1.26 -3.59 114.28 108.30 2djb n THR 32 Ca 0.06 -0.34 -0.01 0.00 -2.04 0.00 0.00 64.05 61.72 2djb n THR 32 Cb 0.58 -0.99 -0.01 0.00 -1.82 0.00 0.00 70.33 68.10 2djb n THR 32 CO 0.00 0.00 0.00 -0.08 -0.64 0.00 0.00 175.07 174.35 2djb h GLU 33 N 0.00 -0.05 0.00 -2.82 4.57 -1.99 -3.28 114.58 111.01 2djb h GLU 33 Ca -0.33 0.00 -0.08 0.00 -1.18 0.00 0.00 59.36 57.78 2djb h GLU 33 Cb 1.53 0.01 -0.01 0.00 -0.16 0.00 0.00 28.75 30.12 2djb h GLU 33 CO -0.04 -0.04 -1.00 0.00 -1.18 0.00 0.00 179.01 176.75 2djb n LEU 35 N -2.88 -2.91 -4.55 0.00 7.94 -1.24 -5.05 117.00 108.31 2djb n LEU 35 Ca -0.03 -0.24 -0.33 0.00 -1.11 0.00 0.00 56.01 54.30 2djb n LEU 35 Cb 0.69 -1.49 -0.12 0.00 0.53 0.00 0.00 43.42 43.03 2djb n LEU 35 CO 0.41 0.12 -0.41 -1.00 -1.11 0.00 0.00 177.39 175.39 2djb s HIS 36 N -3.14 2.83 -0.05 1.96 3.76 -1.26 -4.84 115.29 114.56 2djb s HIS 36 Ca 0.04 -0.06 -0.23 0.00 -0.15 0.00 0.00 55.06 54.66 2djb s HIS 36 Cb -0.01 -1.64 -0.04 0.00 1.11 0.00 0.00 32.58 32.00 2djb s HIS 36 CO 0.27 0.30 0.66 0.99 -0.85 0.00 0.00 174.74 176.12 2djb s THR 37 N -0.85 5.02 -0.19 1.30 2.01 -1.26 -0.92 115.64 120.74 2djb s THR 37 Ca 0.14 1.37 -0.15 0.00 0.31 0.00 0.00 61.69 63.36 2djb s THR 37 Cb -0.11 -4.00 0.05 0.00 0.01 0.00 0.00 72.50 68.45 2djb s THR 37 CO 0.03 0.29 0.49 -0.36 -0.69 0.00 0.00 174.62 174.38 2djb s PHE 38 N 0.56 -0.60 0.07 4.92 0.08 0.11 -4.84 117.98 118.28 2djb s PHE 38 Ca 0.35 1.38 -0.34 0.00 0.12 0.00 0.00 56.93 58.45 2djb s PHE 38 Cb -0.18 0.25 -0.13 0.00 -0.57 0.00 0.00 43.02 42.39 2djb s PHE 38 CO 0.17 -0.31 1.69 0.00 -0.10 0.00 0.00 175.22 176.68 2djb n LYS 40 N 4.60 -0.11 -0.09 0.00 0.00 -1.26 0.68 118.16 121.99 2djb n LYS 40 Ca 0.19 1.42 -0.10 0.00 0.00 0.00 0.00 58.31 59.82 2djb n LYS 40 Cb 0.29 -2.11 -0.03 0.00 0.00 0.00 0.00 35.03 33.18 2djb n LYS 40 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.40 178.17 2djb h SER 41 N 0.00 0.37 0.63 3.14 0.02 -1.98 -1.61 113.55 114.12 2djb h SER 41 Ca 0.41 -0.14 -0.03 0.00 -0.84 0.00 0.00 61.79 61.19 2djb h SER 41 Cb 0.64 -0.10 0.00 0.00 0.14 0.00 0.00 62.40 63.08 2djb h SER 41 CO -0.93 0.41 -0.36 0.00 -1.14 0.00 0.00 176.83 174.81 2djb h ILE 43 N -0.92 0.53 -0.01 0.00 6.09 -0.57 0.60 117.51 123.24 2djb h ILE 43 Ca -0.09 -0.18 -0.19 0.00 -1.37 0.00 0.00 64.86 63.03 2djb h ILE 43 Cb 0.73 -0.06 -0.01 0.00 0.47 0.00 0.00 36.82 37.95 2djb h ILE 43 CO 0.10 0.10 -0.84 0.58 -3.07 0.00 0.00 178.15 175.02 2djb h VAL 44 N 0.54 1.46 0.00 2.19 2.07 -0.99 -2.82 116.25 118.70 2djb h VAL 44 Ca 0.64 -2.49 -0.09 0.00 0.82 0.00 0.00 66.70 65.57 2djb h VAL 44 Cb 1.30 2.38 -0.01 0.00 -1.52 0.00 0.00 31.29 33.44 2djb h VAL 44 CO -0.44 0.73 -0.44 -0.09 0.02 0.00 0.00 177.57 177.35 2djb h ARG 45 N 0.14 0.00 0.00 1.57 2.43 0.45 -3.13 114.38 115.84 2djb h ARG 45 Ca -0.04 0.00 -0.16 0.00 -0.81 0.00 0.00 59.98 58.97 2djb h ARG 45 Cb 1.45 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 30.98 2djb h ARG 45 CO 0.13 0.44 -0.77 1.25 -1.51 0.00 0.00 179.97 179.52 2djb h HIS 46 N 0.00 0.00 0.00 2.20 2.76 0.02 -3.20 115.15 116.93 2djb h HIS 46 Ca -0.00 0.00 -0.06 0.00 -2.20 0.00 0.00 60.37 58.10 2djb h HIS 46 Cb 1.15 0.00 -0.01 0.00 1.55 0.00 0.00 27.41 30.10 2djb h HIS 46 CO 0.00 0.77 -0.30 0.74 -1.30 0.00 0.00 177.93 177.84 2djb h PHE 47 N 0.00 0.00 -0.66 5.26 0.04 -1.44 0.28 116.94 120.41 2djb h PHE 47 Ca -0.01 0.00 -0.08 0.00 2.80 0.00 0.00 57.97 60.68 2djb h PHE 47 Cb 1.55 0.00 -0.03 0.00 2.20 0.00 0.00 35.95 39.67 2djb h PHE 47 CO 0.00 0.30 0.10 1.88 -0.60 0.00 0.00 178.31 179.98 2djb h TYR 48 N 0.00 1.17 0.07 -0.55 0.05 -1.58 -3.29 116.97 112.84 2djb h TYR 48 Ca -0.00 -0.17 -0.35 0.00 0.05 0.00 0.00 58.73 58.26 2djb h TYR 48 Cb 0.74 -0.32 -0.03 0.00 1.01 0.00 0.00 36.73 38.13 2djb h TYR 48 CO 0.00 0.99 -1.95 0.66 -1.05 0.00 0.00 178.16 176.80 2djb n TYR 49 N -4.21 0.91 -3.81 4.88 4.01 -1.13 -4.89 117.16 112.92 2djb n TYR 49 Ca 0.04 0.24 -0.26 0.00 -0.16 0.00 0.00 57.90 57.77 2djb n TYR 49 Cb 0.30 -1.11 -0.17 0.00 -0.31 0.00 0.00 39.34 38.05 2djb n TYR 49 CO 0.00 0.00 0.00 0.45 -0.46 0.00 0.00 176.86 176.85 2djb s SER 50 N -6.96 2.23 0.00 7.72 0.15 0.96 -5.01 113.70 112.80 2djb s SER 50 Ca -0.27 -0.40 -0.02 0.00 0.70 0.00 0.00 55.95 55.96 2djb s SER 50 Cb 0.07 -0.64 -0.07 0.00 -1.71 0.00 0.00 66.02 63.67 2djb s SER 50 CO 0.68 -0.20 2.07 -0.46 1.20 0.00 0.00 173.24 176.53 2djb n ASN 51 N 5.03 4.26 -2.86 5.45 6.94 -1.24 -3.40 115.26 129.44 2djb n ASN 51 Ca -0.09 -2.18 -0.15 0.00 -0.02 0.00 0.00 54.58 52.13 2djb n ASN 51 Cb 0.49 -0.98 -0.05 0.00 -2.36 0.00 0.00 39.78 36.87 2djb n ASN 51 CO 0.00 0.00 0.00 0.54 -1.03 0.00 0.00 177.26 176.77 2djb n ARG 52 N 1.94 0.44 -3.53 -3.83 1.74 -1.26 -3.52 116.66 108.64 2djb n ARG 52 Ca 0.12 -2.72 -0.37 0.00 -0.77 0.00 0.00 57.85 54.11 2djb n ARG 52 Cb 0.51 2.35 -0.07 0.00 -1.02 0.00 0.00 32.46 34.23 2djb n ARG 52 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2djb n PRO 54 N 3.19 0.48 0.00 0.00 -0.04 -1.26 -0.46 135.00 136.92 2djb n PRO 54 Ca -0.12 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.34 2djb n PRO 54 Cb 0.52 -1.23 0.00 0.00 -0.04 0.00 0.00 33.50 32.75 2djb n PRO 54 CO 0.00 0.00 0.00 1.17 -0.04 0.00 0.00 175.50 176.63 2djb n LYS 55 N -0.73 0.00 0.05 0.54 4.81 -1.26 -4.86 118.16 116.71 2djb n LYS 55 Ca 0.05 0.00 -0.02 0.00 -0.87 0.00 0.00 58.31 57.48 2djb n LYS 55 Cb 0.02 -0.10 -0.08 0.00 0.02 0.00 0.00 35.03 34.90 2djb n LYS 55 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2djb n ASN 57 N -3.03 -2.51 -4.36 0.00 3.02 0.39 -4.94 115.26 103.84 2djb n ASN 57 Ca -0.08 -0.16 -0.32 0.00 -0.03 0.00 0.00 54.58 53.99 2djb n ASN 57 Cb 0.87 -1.65 -0.15 0.00 -0.61 0.00 0.00 39.78 38.24 2djb n ASN 57 CO 0.00 0.00 0.00 0.27 -2.62 0.00 0.00 177.26 174.91 2djb s ILE 58 N -3.09 2.69 -0.69 2.41 -4.36 -1.26 -4.64 121.20 112.26 2djb s ILE 58 Ca 0.05 -0.82 -0.25 0.00 -0.26 0.00 0.00 60.65 59.37 2djb s ILE 58 Cb -0.01 -2.07 -0.13 0.00 1.25 0.00 0.00 42.46 41.51 2djb s ILE 58 CO 0.18 0.56 2.42 0.52 0.24 0.00 0.00 174.94 178.86 2djb n VAL 59 N 3.05 -0.04 -2.91 8.37 0.31 -1.26 -2.77 118.33 123.09 2djb n VAL 59 Ca -0.18 -0.60 -0.44 0.00 -0.01 0.00 0.00 64.34 63.11 2djb n VAL 59 Cb 0.52 -2.13 -0.02 0.00 -0.91 0.00 0.00 33.84 31.30 2djb n VAL 59 CO 0.00 0.00 0.00 -0.69 -1.32 0.00 0.00 176.83 174.82 2djb s VAL 60 N 12.57 4.72 -0.05 2.52 1.01 -1.23 -4.88 120.40 135.07 2djb s VAL 60 Ca 1.00 -1.66 -0.02 0.00 0.00 0.00 0.00 61.98 61.30 2djb s VAL 60 Cb -0.26 -4.81 -0.07 0.00 0.00 0.00 0.00 36.38 31.24 2djb s VAL 60 CO 0.21 -1.54 2.60 0.00 0.00 0.00 0.00 175.10 176.37 2djb n HIS 61 N 6.57 0.20 -4.01 5.22 1.44 -1.26 -4.88 115.22 118.51 2djb n HIS 61 Ca 0.26 -1.30 -0.22 0.00 -2.01 0.00 0.00 57.72 54.45 2djb n HIS 61 Cb 0.48 -0.96 -0.03 0.00 0.12 0.00 0.00 29.99 29.61 2djb n HIS 61 CO 0.00 0.00 0.00 -0.65 -2.81 0.00 0.00 176.34 172.88 2djb s GLN 62 N 0.11 3.29 -0.81 -1.40 -0.21 -1.26 -4.57 119.66 114.81 2djb s GLN 62 Ca 0.28 -0.81 -0.03 0.00 0.02 0.00 0.00 55.36 54.83 2djb s GLN 62 Cb 0.15 -2.81 0.00 0.00 1.00 0.00 0.00 33.01 31.35 2djb s GLN 62 CO -0.01 0.44 0.69 2.41 -2.12 0.00 0.00 175.29 176.70 2djb n THR 63 N -1.15 -2.87 -2.98 -0.19 -1.04 -1.26 -5.00 114.28 99.78 2djb n THR 63 Ca -0.08 -0.16 -0.40 0.00 -2.04 0.00 0.00 64.05 61.37 2djb n THR 63 Cb 0.57 -3.60 -0.06 0.00 -1.82 0.00 0.00 70.33 65.42 2djb n THR 63 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2djb s GLN 64 N -5.34 4.54 0.26 -2.82 0.00 -1.26 -5.03 119.66 110.00 2djb s GLN 64 Ca 0.18 1.12 -0.30 0.00 -0.00 0.00 0.00 55.36 56.37 2djb s GLN 64 Cb -0.08 -3.29 -0.09 0.00 0.00 0.00 0.00 33.01 29.54 2djb s GLN 64 CO 0.46 0.48 1.26 -1.25 0.00 0.00 0.00 175.29 176.25 2djb s PRO 65 N -0.79 4.43 -0.24 9.60 0.04 -1.26 -4.92 135.00 141.86 2djb s PRO 65 Ca 0.37 2.05 -0.28 0.00 0.04 0.00 0.00 61.00 63.18 2djb s PRO 65 Cb -0.22 -3.15 -0.05 0.00 0.04 0.00 0.00 34.50 31.11 2djb s PRO 65 CO 0.25 -0.14 2.24 -0.11 0.04 0.00 0.00 177.00 179.28 2djb n LEU 66 N 1.75 3.17 -4.69 -3.56 7.94 -1.26 -4.89 117.00 115.46 2djb n LEU 66 Ca 0.03 0.17 -0.43 0.00 -1.11 0.00 0.00 56.01 54.67 2djb n LEU 66 Cb 0.43 -1.55 -0.03 0.00 0.53 0.00 0.00 43.42 42.80 2djb n LEU 66 CO 0.57 -0.74 1.47 -1.54 -1.11 0.00 0.00 177.39 176.05 2djb n SER 67 N 11.86 4.00 0.00 1.96 3.41 -1.26 -4.89 113.62 128.70 2djb n SER 67 Ca 0.31 0.99 0.00 0.00 -0.26 0.00 0.00 58.87 59.91 2djb n SER 67 Cb 0.44 -1.54 0.00 0.00 -0.26 0.00 0.00 64.21 62.86 2djb n SER 67 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2djb n GLY 68 N 4.21 0.83 0.00 5.00 0.00 -1.26 -4.97 105.19 109.00 2djb n GLY 68 Ca 0.18 -0.97 0.06 0.00 0.00 0.00 0.00 46.02 45.29 2djb n GLY 68 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2djb n PRO 69 N -0.44 0.49 -5.00 1.61 -0.04 -1.26 -4.64 135.00 125.71 2djb n PRO 69 Ca 0.00 0.00 -0.32 0.00 -0.04 0.00 0.00 63.50 63.14 2djb n PRO 69 Cb 0.00 -1.40 -0.15 0.00 -0.04 0.00 0.00 33.50 31.91 2djb n PRO 69 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 2djb s SER 70 N -1.90 3.61 -0.05 3.54 1.04 -1.26 -5.12 113.70 113.57 2djb s SER 70 Ca 0.19 -0.39 0.00 0.00 0.48 0.00 0.00 55.95 56.23 2djb s SER 70 Cb 0.09 -1.22 0.02 0.00 0.10 0.00 0.00 66.02 65.01 2djb s SER 70 CO 0.14 0.22 -0.03 -0.44 0.98 0.00 0.00 173.24 174.12 2djb s SER 71 N -0.01 1.11 0.00 7.02 0.01 -1.26 -4.95 113.70 115.61 2djb s SER 71 Ca -0.06 -0.11 0.00 0.00 1.31 0.00 0.00 55.95 57.10 2djb s SER 71 Cb -0.15 -0.43 0.00 0.00 0.21 0.00 0.00 66.02 65.66 2djb s SER 71 CO 0.05 -0.10 0.00 0.61 0.41 0.00 0.00 173.24 174.20