#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jo6 n SER 2 N 0.00 5.55 -4.57 7.83 3.41 -1.26 -4.97 113.62 119.61 2jo6 n SER 2 Ca 0.00 -3.47 -0.33 0.00 -0.26 0.00 0.00 58.87 54.82 2jo6 n SER 2 Cb 0.00 -1.03 -0.04 0.00 -0.26 0.00 0.00 64.21 62.88 2jo6 n SER 2 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 2jo6 s GLN 3 N -2.87 2.99 -0.72 4.33 1.11 -1.26 -4.91 119.66 118.33 2jo6 s GLN 3 Ca 0.36 -1.04 -0.23 0.00 0.01 0.00 0.00 55.36 54.46 2jo6 s GLN 3 Cb 0.11 -5.26 0.07 0.00 -1.01 0.00 0.00 33.01 26.91 2jo6 s GLN 3 CO 0.04 -3.15 1.06 -1.58 0.01 0.00 0.00 175.29 171.67 2jo6 s TRP 4 N 8.36 2.66 0.02 0.91 0.52 -1.26 -4.02 118.94 126.14 2jo6 s TRP 4 Ca 0.62 -0.59 -0.30 0.00 0.02 0.00 0.00 56.10 55.84 2jo6 s TRP 4 Cb -0.02 -4.37 -0.04 0.00 -1.15 0.00 0.00 33.47 27.89 2jo6 s TRP 4 CO 0.04 -1.71 1.12 0.21 0.02 0.00 0.00 176.95 176.63 2jo6 s LYS 5 N 4.20 4.46 -0.76 4.98 2.20 -0.19 -4.73 119.74 129.90 2jo6 s LYS 5 Ca 0.27 1.64 -0.26 0.00 -0.36 0.00 0.00 55.97 57.25 2jo6 s LYS 5 Cb -0.13 -3.41 0.02 0.00 -1.51 0.00 0.00 37.83 32.80 2jo6 s LYS 5 CO 0.07 -0.21 1.43 0.34 -0.36 0.00 0.00 175.35 176.62 2jo6 s ASP 6 N 1.09 6.00 0.00 1.43 -1.08 -1.26 -2.18 116.67 120.67 2jo6 s ASP 6 Ca 0.56 -0.43 0.00 0.00 -0.52 0.00 0.00 52.55 52.16 2jo6 s ASP 6 Cb -0.26 -2.56 0.00 0.00 -1.46 0.00 0.00 42.92 38.64 2jo6 s ASP 6 CO 0.28 -1.93 0.03 -0.38 0.52 0.00 0.00 175.17 173.68 2jo6 n ILE 7 N 6.65 0.00 -3.96 4.11 2.08 -0.67 -5.05 119.36 122.52 2jo6 n ILE 7 Ca 0.11 0.06 -0.09 0.00 0.56 0.00 0.00 62.75 63.39 2jo6 n ILE 7 Cb 0.50 -0.12 -0.05 0.00 -0.75 0.00 0.00 39.64 39.22 2jo6 n ILE 7 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 2jo6 s LYS 9 N -3.99 4.12 0.52 0.00 1.02 -1.26 0.24 119.74 120.38 2jo6 s LYS 9 Ca 0.20 1.38 0.35 0.00 0.02 0.00 0.00 55.97 57.92 2jo6 s LYS 9 Cb -0.01 -2.38 1.77 0.00 -0.52 0.00 0.00 37.83 36.68 2jo6 s LYS 9 CO 0.07 -0.16 2.05 0.97 -0.92 0.00 0.00 175.35 177.37 2jo6 h ILE 10 N 2.01 0.00 0.00 2.17 6.09 -0.40 -0.65 117.51 126.73 2jo6 h ILE 10 Ca -0.49 -0.12 -0.03 0.00 -1.37 0.00 0.00 64.86 62.85 2jo6 h ILE 10 Cb 1.21 0.97 -0.00 0.00 0.47 0.00 0.00 36.82 39.46 2jo6 h ILE 10 CO 0.61 0.00 -0.13 -0.78 -3.07 0.00 0.00 178.15 174.78 2jo6 h ASP 11 N 0.00 0.00 0.05 2.19 3.58 -1.91 -3.17 116.42 117.16 2jo6 h ASP 11 Ca 0.00 0.00 -0.00 0.00 0.42 0.00 0.00 57.03 57.45 2jo6 h ASP 11 Cb 0.14 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.19 2jo6 h ASP 11 CO 0.00 0.13 -0.02 -0.78 -2.88 0.00 0.00 179.24 175.69 2jo6 h ASP 12 N 0.00 -0.06 -3.30 2.28 3.58 -1.49 -3.42 116.42 114.01 2jo6 h ASP 12 Ca -0.00 -0.59 -0.57 0.00 0.42 0.00 0.00 57.03 56.29 2jo6 h ASP 12 Cb 0.24 0.02 -0.05 0.00 1.72 0.00 0.00 39.33 41.25 2jo6 h ASP 12 CO 0.02 0.66 1.05 -0.63 -2.88 0.00 0.00 179.24 177.46 2jo6 s ILE 13 N -2.78 3.94 0.66 2.25 1.01 -1.20 -5.00 121.20 120.09 2jo6 s ILE 13 Ca -0.14 0.97 -0.13 0.00 0.00 0.00 0.00 60.65 61.35 2jo6 s ILE 13 Cb -0.01 -4.23 -0.00 0.00 0.01 0.00 0.00 42.46 38.23 2jo6 s ILE 13 CO 0.52 -0.76 1.06 -0.76 0.00 0.00 0.00 174.94 175.01 2jo6 s LEU 14 N 5.29 3.27 0.28 2.97 1.43 -1.26 -4.91 118.68 125.75 2jo6 s LEU 14 Ca 0.60 1.73 -0.30 0.00 -1.03 0.00 0.00 54.13 55.13 2jo6 s LEU 14 Cb -0.13 -4.51 -0.13 0.00 0.03 0.00 0.00 46.19 41.45 2jo6 s LEU 14 CO 0.32 -1.41 1.42 -0.81 0.23 0.00 0.00 176.35 176.10 2jo6 n PRO 15 N -2.73 2.22 -3.29 1.29 -0.04 -1.26 -2.43 135.00 128.76 2jo6 n PRO 15 Ca 0.08 0.79 -0.17 0.00 -0.04 0.00 0.00 63.50 64.16 2jo6 n PRO 15 Cb 0.53 -2.46 0.07 0.00 -0.04 0.00 0.00 33.50 31.60 2jo6 n PRO 15 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 2jo6 n GLU 16 N 1.68 -6.01 -4.10 0.54 1.02 0.71 -5.03 120.64 109.46 2jo6 n GLU 16 Ca 0.09 0.68 -0.17 0.00 -0.02 0.00 0.00 57.16 57.74 2jo6 n GLU 16 Cb 0.34 -5.25 -0.16 0.00 -0.02 0.00 0.00 31.44 26.35 2jo6 n GLU 16 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 2jo6 s THR 17 N -3.27 0.38 -0.08 2.62 2.01 -0.83 -4.99 115.64 111.49 2jo6 s THR 17 Ca 0.26 -0.10 0.04 0.00 0.31 0.00 0.00 61.69 62.21 2jo6 s THR 17 Cb -0.12 -0.40 -0.01 0.00 0.01 0.00 0.00 72.50 71.98 2jo6 s THR 17 CO 0.59 0.16 -0.20 -0.83 -0.69 0.00 0.00 174.62 173.65 2jo6 s GLY 18 N 0.55 1.40 0.25 4.40 0.00 -1.26 -0.99 107.32 111.67 2jo6 s GLY 18 Ca -0.06 -0.99 0.06 0.00 0.00 0.00 0.00 44.72 43.72 2jo6 s GLY 18 CO -0.00 -0.55 -0.06 -1.34 0.00 0.00 0.00 173.10 171.15 2jo6 s VAL 19 N -0.12 1.51 -0.22 1.40 -7.23 -0.38 -4.80 120.40 110.56 2jo6 s VAL 19 Ca -0.04 -2.11 -0.17 0.00 -1.81 0.00 0.00 61.98 57.85 2jo6 s VAL 19 Cb -0.14 -2.35 -0.03 0.00 0.56 0.00 0.00 36.38 34.42 2jo6 s VAL 19 CO 0.04 -0.36 0.45 0.00 -0.31 0.00 0.00 175.10 174.91 2jo6 s ALA 21 N 1.72 1.10 -0.34 0.00 0.00 0.40 -4.99 121.76 119.66 2jo6 s ALA 21 Ca 0.20 -0.75 -0.11 0.00 0.00 0.00 0.00 51.96 51.30 2jo6 s ALA 21 Cb -0.15 -0.19 0.00 0.00 0.00 0.00 0.00 23.12 22.78 2jo6 s ALA 21 CO 0.09 0.22 0.20 -0.51 0.00 0.00 0.00 175.76 175.75 2jo6 s LEU 22 N -0.96 4.45 -1.08 0.00 1.43 -1.26 0.01 118.68 121.27 2jo6 s LEU 22 Ca 0.02 -0.66 -0.13 0.00 -1.03 0.00 0.00 54.13 52.33 2jo6 s LEU 22 Cb -0.07 -2.05 0.20 0.00 0.03 0.00 0.00 46.19 44.30 2jo6 s LEU 22 CO 0.01 -0.28 1.19 -0.22 0.23 0.00 0.00 176.35 177.28 2jo6 s LEU 23 N 1.63 5.70 0.00 1.79 2.96 0.78 -4.88 118.68 126.66 2jo6 s LEU 23 Ca 0.04 -2.98 0.00 0.00 -0.22 0.00 0.00 54.13 50.97 2jo6 s LEU 23 Cb -0.18 -2.31 0.00 0.00 0.50 0.00 0.00 46.19 44.20 2jo6 s LEU 23 CO 0.08 -0.63 0.00 0.61 -1.32 0.00 0.00 176.35 175.09 2jo6 n GLY 24 N 3.88 1.33 0.17 7.98 0.00 -1.26 -1.61 105.19 115.68 2jo6 n GLY 24 Ca 0.27 0.25 0.04 0.00 0.00 0.00 0.00 46.02 46.59 2jo6 n GLY 24 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2jo6 n ASP 25 N 6.46 1.02 -4.86 1.61 9.92 -1.26 -5.01 116.55 124.43 2jo6 n ASP 25 Ca 0.00 -1.01 -0.37 0.00 -0.53 0.00 0.00 54.79 52.88 2jo6 n ASP 25 Cb 0.00 0.57 -0.06 0.00 -0.64 0.00 0.00 41.12 40.99 2jo6 n ASP 25 CO 0.00 0.00 0.00 -1.61 0.13 0.00 0.00 177.20 175.72 2jo6 s GLU 26 N -1.39 3.47 -0.43 -1.24 2.02 -0.63 -5.06 118.70 115.44 2jo6 s GLU 26 Ca 0.07 -0.15 -0.22 0.00 0.02 0.00 0.00 54.97 54.69 2jo6 s GLU 26 Cb 0.07 -3.19 0.02 0.00 0.10 0.00 0.00 34.13 31.14 2jo6 s GLU 26 CO 0.26 0.74 0.73 -0.65 0.02 0.00 0.00 175.26 176.36 2jo6 s GLN 27 N -0.92 3.42 -0.10 1.61 1.11 -1.26 -0.16 119.66 123.36 2jo6 s GLN 27 Ca 0.14 -0.14 -0.01 0.00 0.01 0.00 0.00 55.36 55.36 2jo6 s GLN 27 Cb -0.12 -3.92 -0.03 0.00 -1.01 0.00 0.00 33.01 27.93 2jo6 s GLN 27 CO 0.03 -1.04 -0.05 0.08 0.01 0.00 0.00 175.29 174.33 2jo6 s VAL 28 N 3.10 3.84 -0.40 1.09 1.01 0.10 0.09 120.40 129.24 2jo6 s VAL 28 Ca 0.28 -0.41 -0.11 0.00 0.00 0.00 0.00 61.98 61.73 2jo6 s VAL 28 Cb -0.13 -2.61 0.05 0.00 0.00 0.00 0.00 36.38 33.68 2jo6 s VAL 28 CO 0.21 0.56 0.25 0.00 0.00 0.00 0.00 175.10 176.11 2jo6 s ALA 29 N -0.39 3.32 -0.48 5.51 0.00 0.78 -0.45 121.76 130.05 2jo6 s ALA 29 Ca 0.06 -1.88 -0.24 0.00 0.00 0.00 0.00 51.96 49.91 2jo6 s ALA 29 Cb -0.12 -2.68 0.03 0.00 0.00 0.00 0.00 23.12 20.35 2jo6 s ALA 29 CO 0.02 -1.50 0.84 0.42 0.00 0.00 0.00 175.76 175.54 2jo6 s ILE 30 N 1.54 4.57 -0.24 0.00 1.01 -0.64 -2.28 121.20 125.15 2jo6 s ILE 30 Ca 0.02 0.40 -0.09 0.00 0.00 0.00 0.00 60.65 60.99 2jo6 s ILE 30 Cb -0.21 -4.39 -0.04 0.00 0.01 0.00 0.00 42.46 37.83 2jo6 s ILE 30 CO 0.06 -0.84 0.12 -0.36 0.00 0.00 0.00 174.94 173.91 2jo6 s PHE 31 N 3.50 3.20 -0.49 3.97 0.08 0.20 -1.25 117.98 127.19 2jo6 s PHE 31 Ca 0.31 -0.04 -0.11 0.00 0.12 0.00 0.00 56.93 57.20 2jo6 s PHE 31 Cb -0.12 -2.24 0.12 0.00 -0.57 0.00 0.00 43.02 40.21 2jo6 s PHE 31 CO 0.22 -0.10 0.39 0.50 -0.10 0.00 0.00 175.22 176.13 2jo6 s ARG 32 N 1.24 2.64 -0.02 0.44 3.52 -0.16 -0.85 118.95 125.76 2jo6 s ARG 32 Ca 0.06 -1.73 -0.08 0.00 -0.13 0.00 0.00 55.73 53.84 2jo6 s ARG 32 Cb -0.14 -4.04 -0.30 0.00 -1.56 0.00 0.00 34.95 28.91 2jo6 s ARG 32 CO 0.05 -1.22 0.76 -1.00 -0.81 0.00 0.00 175.30 173.07 2jo6 h PRO 33 N 8.59 0.35 -6.69 5.12 0.13 -1.85 0.22 132.00 137.87 2jo6 h PRO 33 Ca -0.24 -0.60 -0.45 0.00 -0.87 0.00 0.00 66.00 63.84 2jo6 h PRO 33 Cb 1.08 0.22 0.03 0.00 0.13 0.00 0.00 31.00 32.46 2jo6 h PRO 33 CO 0.91 1.25 -0.11 0.71 -0.23 0.00 0.00 178.00 180.53 2jo6 s TYR 34 N -2.59 3.14 -0.37 1.56 2.02 -1.26 -4.00 117.35 115.85 2jo6 s TYR 34 Ca -0.13 0.14 0.21 0.00 -0.37 0.00 0.00 57.07 56.93 2jo6 s TYR 34 Cb 0.06 -2.37 0.29 0.00 -0.40 0.00 0.00 41.96 39.54 2jo6 s TYR 34 CO 0.86 -0.43 1.58 1.25 -1.57 0.00 0.00 175.55 177.24 2jo6 h HIS 35 N 0.38 0.00 -2.79 2.71 2.76 -1.93 -3.39 115.15 112.90 2jo6 h HIS 35 Ca -0.45 0.00 -0.07 0.00 -2.20 0.00 0.00 60.37 57.65 2jo6 h HIS 35 Cb 1.26 0.00 0.02 0.00 1.55 0.00 0.00 27.41 30.24 2jo6 h HIS 35 CO 0.43 0.11 0.05 0.43 -1.30 0.00 0.00 177.93 177.66 2jo6 n SER 36 N -3.13 0.09 -3.65 3.26 7.64 -1.26 -4.88 113.62 111.69 2jo6 n SER 36 Ca 0.03 -1.12 -0.41 0.00 1.01 0.00 0.00 58.87 58.39 2jo6 n SER 36 Cb 0.57 -0.14 -0.01 0.00 -1.01 0.00 0.00 64.21 63.62 2jo6 n SER 36 CO 0.00 0.00 0.00 -0.90 -3.01 0.00 0.00 175.04 171.13 2jo6 n ASP 37 N -3.08 4.47 -3.90 6.43 5.75 -1.26 -4.83 116.55 120.13 2jo6 n ASP 37 Ca 0.03 -2.78 -0.30 0.00 -0.01 0.00 0.00 54.79 51.73 2jo6 n ASP 37 Cb 0.09 -1.58 -0.16 0.00 -1.03 0.00 0.00 41.12 38.44 2jo6 n ASP 37 CO 0.00 0.00 0.00 -1.10 -0.11 0.00 0.00 177.20 175.99 2jo6 s GLN 38 N 3.22 1.40 -0.02 0.11 -1.52 -1.26 -4.81 119.66 116.78 2jo6 s GLN 38 Ca 0.51 -1.02 0.07 0.00 -1.95 0.00 0.00 55.36 52.97 2jo6 s GLN 38 Cb 0.15 -2.53 -0.02 0.00 -0.22 0.00 0.00 33.01 30.39 2jo6 s GLN 38 CO -0.07 -0.68 -0.23 0.14 -0.25 0.00 0.00 175.29 174.20 2jo6 s VAL 39 N 1.42 1.82 -0.05 1.09 -7.23 -1.26 -3.88 120.40 112.31 2jo6 s VAL 39 Ca -0.02 -0.98 0.03 0.00 -1.81 0.00 0.00 61.98 59.20 2jo6 s VAL 39 Cb -0.19 -1.51 0.01 0.00 0.56 0.00 0.00 36.38 35.25 2jo6 s VAL 39 CO -0.09 0.51 -0.13 -0.36 -0.31 0.00 0.00 175.10 174.72 2jo6 s PHE 40 N -0.50 1.47 -0.11 2.82 0.08 -0.03 -4.75 117.98 116.97 2jo6 s PHE 40 Ca 0.08 -0.49 0.03 0.00 0.12 0.00 0.00 56.93 56.67 2jo6 s PHE 40 Cb -0.09 -1.04 0.01 0.00 -0.57 0.00 0.00 43.02 41.32 2jo6 s PHE 40 CO -0.01 -0.22 -0.21 0.00 -0.10 0.00 0.00 175.22 174.68 2jo6 s ALA 41 N 0.41 2.04 0.41 5.36 0.00 -1.26 -0.63 121.76 128.09 2jo6 s ALA 41 Ca -0.10 -0.92 0.03 0.00 0.00 0.00 0.00 51.96 50.98 2jo6 s ALA 41 Cb -0.13 -0.84 -0.03 0.00 0.00 0.00 0.00 23.12 22.12 2jo6 s ALA 41 CO 0.03 0.14 0.10 0.96 0.00 0.00 0.00 175.76 176.99 2jo6 s ILE 42 N 0.58 0.77 0.10 0.00 -4.36 -0.97 -1.01 121.20 116.32 2jo6 s ILE 42 Ca -0.14 -2.00 -0.31 0.00 -0.26 0.00 0.00 60.65 57.94 2jo6 s ILE 42 Cb -0.17 -2.39 -0.09 0.00 1.25 0.00 0.00 42.46 41.06 2jo6 s ILE 42 CO 0.04 0.00 1.65 -0.55 0.24 0.00 0.00 174.94 176.32 2jo6 s SER 43 N -3.63 6.58 0.33 4.36 0.15 -0.85 -0.16 113.70 120.49 2jo6 s SER 43 Ca 0.23 2.55 0.16 0.00 0.70 0.00 0.00 55.95 59.59 2jo6 s SER 43 Cb 0.03 -2.57 0.52 0.00 -1.71 0.00 0.00 66.02 62.29 2jo6 s SER 43 CO 0.13 -0.88 1.66 -1.13 1.20 0.00 0.00 173.24 174.22 2jo6 h ASN 44 N 7.92 0.00 -3.31 5.45 -1.24 -0.61 -3.42 115.58 120.38 2jo6 h ASN 44 Ca -0.43 0.00 -0.64 0.00 0.71 0.00 0.00 56.30 55.94 2jo6 h ASN 44 Cb 1.20 0.00 -0.22 0.00 0.73 0.00 0.00 38.32 40.03 2jo6 h ASN 44 CO 0.93 0.46 -0.68 -0.63 -1.29 0.00 0.00 177.43 176.22 2jo6 s ILE 45 N -3.52 3.80 -0.29 2.57 -1.09 -1.26 -1.68 121.20 119.74 2jo6 s ILE 45 Ca 0.00 -0.39 -0.21 0.00 -2.23 0.00 0.00 60.65 57.83 2jo6 s ILE 45 Cb 0.11 -2.66 -0.01 0.00 -1.58 0.00 0.00 42.46 38.32 2jo6 s ILE 45 CO 0.71 0.49 0.65 -0.62 -1.23 0.00 0.00 174.94 174.95 2jo6 s ASP 46 N 0.38 6.55 0.00 3.58 2.15 -0.84 -4.94 116.67 123.55 2jo6 s ASP 46 Ca -0.05 0.56 0.26 0.00 0.43 0.00 0.00 52.55 53.76 2jo6 s ASP 46 Cb -0.14 -2.34 0.62 0.00 -0.30 0.00 0.00 42.92 40.75 2jo6 s ASP 46 CO 0.03 -0.46 1.50 -0.81 -0.17 0.00 0.00 175.17 175.26 2jo6 n PRO 47 N 5.86 1.79 -0.08 4.34 -0.04 -1.26 -0.70 135.00 144.90 2jo6 n PRO 47 Ca -0.00 -1.27 -0.10 0.00 -0.04 0.00 0.00 63.50 62.09 2jo6 n PRO 47 Cb 0.49 -1.47 -0.04 0.00 -0.04 0.00 0.00 33.50 32.43 2jo6 n PRO 47 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 2jo6 n PHE 48 N 0.51 0.82 1.17 0.54 -0.00 -1.26 -4.33 117.46 114.92 2jo6 n PHE 48 Ca 0.16 0.36 0.12 0.00 -0.00 0.00 0.00 57.45 58.09 2jo6 n PHE 48 Cb 0.45 -0.82 0.29 0.00 -0.00 0.00 0.00 39.48 39.40 2jo6 n PHE 48 CO 0.00 0.00 0.00 0.34 -0.00 0.00 0.00 176.76 177.10 2jo6 n PHE 49 N -4.55 0.00 -2.82 -5.13 7.35 -1.26 -4.98 117.46 106.06 2jo6 n PHE 49 Ca -0.15 0.00 -0.04 0.00 -0.76 0.00 0.00 57.45 56.51 2jo6 n PHE 49 Cb 0.40 -0.11 0.00 0.00 0.35 0.00 0.00 39.48 40.12 2jo6 n PHE 49 CO 0.00 0.00 0.00 0.39 -0.76 0.00 0.00 176.76 176.39 2jo6 n GLU 50 N -0.67 -1.68 -4.35 -4.13 1.02 -1.05 -5.06 120.64 104.72 2jo6 n GLU 50 Ca 0.11 1.69 -0.28 0.00 -0.02 0.00 0.00 57.16 58.66 2jo6 n GLU 50 Cb 0.36 -5.34 -0.11 0.00 -0.02 0.00 0.00 31.44 26.33 2jo6 n GLU 50 CO 0.00 0.00 0.00 -1.12 1.18 0.00 0.00 177.13 177.19 2jo6 s SER 51 N -2.69 3.81 0.00 1.62 0.01 0.12 -4.98 113.70 111.59 2jo6 s SER 51 Ca 0.11 -0.69 0.00 0.00 1.31 0.00 0.00 55.95 56.68 2jo6 s SER 51 Cb -0.03 -0.48 0.00 0.00 0.21 0.00 0.00 66.02 65.72 2jo6 s SER 51 CO 0.69 0.13 0.00 -1.54 0.41 0.00 0.00 173.24 172.93 2jo6 n SER 52 N 0.36 0.00 -4.70 2.44 3.41 -1.26 -1.99 113.62 111.87 2jo6 n SER 52 Ca -0.13 0.00 -0.42 0.00 -0.26 0.00 0.00 58.87 58.06 2jo6 n SER 52 Cb 0.55 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 64.47 2jo6 n SER 52 CO 0.00 0.00 0.00 0.68 -0.16 0.00 0.00 175.04 175.56 2jo6 s VAL 53 N 0.00 3.32 -1.41 -3.33 -7.23 -1.25 -4.08 120.40 106.42 2jo6 s VAL 53 Ca 0.00 0.84 0.27 0.00 -1.81 0.00 0.00 61.98 61.28 2jo6 s VAL 53 Cb 0.00 -3.54 0.27 0.00 0.56 0.00 0.00 36.38 33.67 2jo6 s VAL 53 CO 0.00 0.02 1.69 0.18 -0.31 0.00 0.00 175.10 176.69 2jo6 n LEU 54 N 4.88 0.53 0.29 1.32 4.77 -0.68 -3.74 117.00 124.38 2jo6 n LEU 54 Ca 0.13 0.02 0.17 0.00 -0.03 0.00 0.00 56.01 56.30 2jo6 n LEU 54 Cb 0.42 -0.23 0.88 0.00 -2.33 0.00 0.00 43.42 42.16 2jo6 n LEU 54 CO 0.60 0.11 1.05 0.77 -1.33 0.00 0.00 177.39 178.59 2jo6 h SER 55 N 0.48 0.00 -0.33 -1.43 4.64 -1.87 -2.96 113.55 112.08 2jo6 h SER 55 Ca 0.00 0.00 -0.22 0.00 -0.47 0.00 0.00 61.79 61.10 2jo6 h SER 55 Cb 0.45 0.00 -0.09 0.00 -0.31 0.00 0.00 62.40 62.44 2jo6 h SER 55 CO 0.00 0.05 0.25 -2.11 -0.87 0.00 0.00 176.83 174.15 2jo6 n ARG 56 N -3.36 1.59 -4.25 4.77 1.85 -1.25 -4.63 116.66 111.39 2jo6 n ARG 56 Ca -0.02 -1.08 -0.14 0.00 -1.00 0.00 0.00 57.85 55.62 2jo6 n ARG 56 Cb 0.19 -1.46 -0.10 0.00 -1.05 0.00 0.00 32.46 30.04 2jo6 n ARG 56 CO 0.00 0.00 0.00 0.20 -0.01 0.00 0.00 177.63 177.82 2jo6 s GLY 57 N 0.85 1.27 0.04 2.89 0.00 -1.12 -4.37 107.32 106.88 2jo6 s GLY 57 Ca 0.24 -1.62 -0.08 0.00 0.00 0.00 0.00 44.72 43.27 2jo6 s GLY 57 CO -0.02 -1.54 0.32 0.48 0.00 0.00 0.00 173.10 172.34 2jo6 s LEU 58 N -3.19 4.36 -0.14 0.66 0.05 -0.66 -4.89 118.68 114.87 2jo6 s LEU 58 Ca 0.25 0.64 -0.03 0.00 0.05 0.00 0.00 54.13 55.04 2jo6 s LEU 58 Cb 0.06 -2.82 -0.03 0.00 -2.05 0.00 0.00 46.19 41.35 2jo6 s LEU 58 CO 0.05 0.21 -0.05 -0.63 -0.55 0.00 0.00 176.35 175.38 2jo6 s ILE 59 N -1.35 3.82 0.10 1.48 1.01 -1.26 -0.14 121.20 124.85 2jo6 s ILE 59 Ca 0.30 -0.39 0.00 0.00 0.00 0.00 0.00 60.65 60.56 2jo6 s ILE 59 Cb -0.13 -2.65 -0.04 0.00 0.01 0.00 0.00 42.46 39.64 2jo6 s ILE 59 CO 0.17 0.51 -0.03 0.00 0.00 0.00 0.00 174.94 175.60 2jo6 s ALA 60 N 0.18 0.87 -0.04 9.38 0.00 0.61 -5.01 121.76 127.76 2jo6 s ALA 60 Ca -0.02 -1.36 0.05 0.00 0.00 0.00 0.00 51.96 50.62 2jo6 s ALA 60 Cb -0.14 0.35 -0.01 0.00 0.00 0.00 0.00 23.12 23.33 2jo6 s ALA 60 CO 0.03 -0.33 -0.18 -2.00 0.00 0.00 0.00 175.76 173.29 2jo6 s GLU 61 N -3.90 1.75 -0.22 0.00 2.12 -1.26 -0.53 118.70 116.66 2jo6 s GLU 61 Ca 0.14 -0.63 -0.16 0.00 0.36 0.00 0.00 54.97 54.68 2jo6 s GLU 61 Cb 0.07 -1.55 -0.11 0.00 0.26 0.00 0.00 34.13 32.80 2jo6 s GLU 61 CO -0.04 0.28 -0.19 1.58 -0.54 0.00 0.00 175.26 176.35 2jo6 n HIS 62 N 3.04 0.40 -2.75 5.30 -0.00 -0.95 -4.90 115.22 115.35 2jo6 n HIS 62 Ca -0.17 0.17 -0.06 0.00 -0.00 0.00 0.00 57.72 57.65 2jo6 n HIS 62 Cb 0.53 -0.88 0.04 0.00 -0.00 0.00 0.00 29.99 29.68 2jo6 n HIS 62 CO 0.00 0.00 0.00 0.94 -0.00 0.00 0.00 176.34 177.28 2jo6 n GLN 63 N -4.40 0.65 0.00 1.57 -0.06 -1.26 -4.92 117.38 108.96 2jo6 n GLN 63 Ca -0.33 -1.77 0.00 0.00 -2.00 0.00 0.00 57.00 52.91 2jo6 n GLN 63 Cb 0.66 -1.37 0.00 0.00 -4.06 0.00 0.00 30.24 25.47 2jo6 n GLN 63 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 2jo6 n GLY 64 N 2.12 2.67 3.77 1.69 0.00 -1.26 -4.96 105.19 109.22 2jo6 n GLY 64 Ca 0.12 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.75 2jo6 n GLY 64 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2jo6 s GLU 65 N -0.01 4.32 -0.19 1.61 2.56 -1.26 -5.05 118.70 120.67 2jo6 s GLU 65 Ca 0.00 0.76 -0.08 0.00 0.00 0.00 0.00 54.97 55.65 2jo6 s GLU 65 Cb 0.00 -3.33 -0.04 0.00 2.00 0.00 0.00 34.13 32.76 2jo6 s GLU 65 CO 0.00 0.40 0.08 -0.51 -0.56 0.00 0.00 175.26 174.67 2jo6 s LEU 66 N -0.32 3.94 -0.04 2.70 1.43 -1.26 -2.23 118.68 122.90 2jo6 s LEU 66 Ca 0.31 0.13 0.04 0.00 -1.03 0.00 0.00 54.13 53.58 2jo6 s LEU 66 Cb -0.19 -2.00 -0.00 0.00 0.03 0.00 0.00 46.19 44.03 2jo6 s LEU 66 CO 0.18 0.18 -0.15 0.26 0.23 0.00 0.00 176.35 177.05 2jo6 s TRP 67 N 0.33 1.55 -0.16 0.29 0.52 0.31 -3.49 118.94 118.29 2jo6 s TRP 67 Ca 0.05 -0.44 -0.02 0.00 0.02 0.00 0.00 56.10 55.70 2jo6 s TRP 67 Cb -0.12 -1.06 -0.02 0.00 -1.15 0.00 0.00 33.47 31.13 2jo6 s TRP 67 CO -0.01 -0.16 -0.08 0.54 0.02 0.00 0.00 176.95 177.27 2jo6 s VAL 68 N 0.10 3.41 -0.34 4.03 0.11 0.85 -0.28 120.40 128.28 2jo6 s VAL 68 Ca -0.04 -0.52 -0.11 0.00 -2.93 0.00 0.00 61.98 58.37 2jo6 s VAL 68 Cb -0.11 -2.48 -0.01 0.00 -1.53 0.00 0.00 36.38 32.25 2jo6 s VAL 68 CO 0.02 0.49 0.20 0.00 -3.33 0.00 0.00 175.10 172.49 2jo6 s ALA 69 N 0.57 3.39 -0.32 1.54 0.00 0.81 -0.66 121.76 127.09 2jo6 s ALA 69 Ca -0.05 -1.43 -0.21 0.00 0.00 0.00 0.00 51.96 50.26 2jo6 s ALA 69 Cb -0.15 -2.56 -0.00 0.00 0.00 0.00 0.00 23.12 20.41 2jo6 s ALA 69 CO 0.03 -1.01 0.66 -1.12 0.00 0.00 0.00 175.76 174.32 2jo6 s SER 70 N 1.66 6.50 0.00 0.00 0.01 0.22 -1.65 113.70 120.44 2jo6 s SER 70 Ca 0.05 0.38 0.00 0.00 1.31 0.00 0.00 55.95 57.69 2jo6 s SER 70 Cb -0.17 -2.34 0.00 0.00 0.21 0.00 0.00 66.02 63.71 2jo6 s SER 70 CO 0.08 -0.54 0.48 -2.65 0.41 0.00 0.00 173.24 171.02 2jo6 n PRO 71 N 6.00 0.71 0.15 12.44 -0.02 -1.26 -3.08 135.00 149.94 2jo6 n PRO 71 Ca -0.00 0.00 0.12 0.00 -2.02 0.00 0.00 63.50 61.60 2jo6 n PRO 71 Cb 0.49 -1.28 0.19 0.00 -0.02 0.00 0.00 33.50 32.88 2jo6 n PRO 71 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 2jo6 h LEU 72 N 0.64 0.00 0.00 2.45 4.07 -1.91 -3.46 115.31 117.10 2jo6 h LEU 72 Ca 0.00 -0.03 0.00 0.00 0.08 0.00 0.00 57.88 57.93 2jo6 h LEU 72 Cb 0.48 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.22 2jo6 h LEU 72 CO 0.00 0.02 0.00 1.17 -1.08 0.00 0.00 178.44 178.55 2jo6 n LYS 73 N -2.68 0.00 -0.22 1.13 3.00 -1.18 -5.01 118.16 113.20 2jo6 n LYS 73 Ca 0.03 0.00 -0.00 0.00 -0.00 0.00 0.00 58.31 58.34 2jo6 n LYS 73 Cb 0.50 0.00 -0.00 0.00 0.00 0.00 0.00 35.03 35.52 2jo6 n LYS 73 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.40 178.57 2jo6 n LYS 74 N -0.62 0.00 -3.08 1.64 3.00 -1.23 -5.08 118.16 112.80 2jo6 n LYS 74 Ca 0.00 -0.05 -0.37 0.00 -0.00 0.00 0.00 58.31 57.89 2jo6 n LYS 74 Cb 0.00 0.09 -0.06 0.00 0.00 0.00 0.00 35.03 35.06 2jo6 n LYS 74 CO 0.00 0.00 0.00 1.14 0.00 0.00 0.00 177.40 178.54 2jo6 s GLN 75 N 0.00 4.35 -0.05 1.64 -2.07 -1.23 -4.88 119.66 117.43 2jo6 s GLN 75 Ca 0.00 0.96 0.05 0.00 -1.82 0.00 0.00 55.36 54.54 2jo6 s GLN 75 Cb 0.00 -3.04 -0.00 0.00 -1.09 0.00 0.00 33.01 28.87 2jo6 s GLN 75 CO 0.00 0.48 -0.19 1.03 -1.32 0.00 0.00 175.29 175.29 2jo6 s ARG 76 N -1.60 1.99 0.05 9.60 0.52 -1.26 -0.61 118.95 127.64 2jo6 s ARG 76 Ca 0.39 -0.68 0.09 0.00 -0.52 0.00 0.00 55.73 55.01 2jo6 s ARG 76 Cb -0.19 -1.71 -0.03 0.00 0.52 0.00 0.00 34.95 33.54 2jo6 s ARG 76 CO 0.22 0.26 -0.24 -0.06 0.02 0.00 0.00 175.30 175.50 2jo6 s PHE 77 N 0.03 2.38 -0.89 -0.53 0.40 0.17 -2.15 117.98 117.40 2jo6 s PHE 77 Ca -0.05 -0.37 -0.17 0.00 -0.60 0.00 0.00 56.93 55.75 2jo6 s PHE 77 Cb -0.12 -1.40 0.17 0.00 0.51 0.00 0.00 43.02 42.17 2jo6 s PHE 77 CO 0.03 0.18 0.98 0.50 0.70 0.00 0.00 175.22 177.61 2jo6 s ARG 78 N -1.37 3.60 0.20 0.44 3.52 0.29 -0.11 118.95 125.52 2jo6 s ARG 78 Ca 0.13 -2.04 0.19 0.00 -0.13 0.00 0.00 55.73 53.88 2jo6 s ARG 78 Cb -0.10 -4.72 0.86 0.00 -1.56 0.00 0.00 34.95 29.43 2jo6 s ARG 78 CO 0.03 -1.58 1.58 1.47 -0.81 0.00 0.00 175.30 175.99 2jo6 n LEU 79 N 5.52 0.45 -0.01 -0.88 -0.00 -1.23 -0.68 117.00 120.18 2jo6 n LEU 79 Ca 0.20 0.64 -0.12 0.00 -0.00 0.00 0.00 56.01 56.73 2jo6 n LEU 79 Cb 0.48 -0.62 -0.07 0.00 -0.00 0.00 0.00 43.42 43.21 2jo6 n LEU 79 CO 0.44 -0.60 0.78 0.77 -0.00 0.00 0.00 177.39 178.78 2jo6 h SER 80 N 0.00 0.11 -0.00 1.45 4.64 -1.90 -3.33 113.55 114.51 2jo6 h SER 80 Ca 0.00 -0.22 0.00 0.00 -0.47 0.00 0.00 61.79 61.10 2jo6 h SER 80 Cb 0.21 -0.03 0.00 0.00 -0.31 0.00 0.00 62.40 62.27 2jo6 h SER 80 CO 0.00 0.30 0.00 -0.67 -0.87 0.00 0.00 176.83 175.59 2jo6 n ASP 81 N -4.91 1.45 -0.60 4.97 2.03 -1.14 -4.90 116.55 113.45 2jo6 n ASP 81 Ca -0.06 -1.44 -0.01 0.00 0.52 0.00 0.00 54.79 53.79 2jo6 n ASP 81 Cb 0.14 -0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.54 2jo6 n ASP 81 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2jo6 n GLY 82 N -0.20 0.77 3.89 0.27 0.00 0.15 -4.67 105.19 105.40 2jo6 n GLY 82 Ca 0.00 -0.66 -0.34 0.00 0.00 0.00 0.00 46.02 45.03 2jo6 n GLY 82 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2jo6 s LEU 83 N -1.22 4.36 -0.03 0.99 2.96 -0.56 -3.69 118.68 121.50 2jo6 s LEU 83 Ca 0.03 0.48 -0.02 0.00 -0.22 0.00 0.00 54.13 54.40 2jo6 s LEU 83 Cb -0.01 -2.71 -0.04 0.00 0.50 0.00 0.00 46.19 43.93 2jo6 s LEU 83 CO 0.04 0.24 0.09 0.00 -1.32 0.00 0.00 176.35 175.39 2jo6 h MET 85 N 4.36 -0.51 0.19 0.00 0.00 -1.81 -1.95 114.93 115.21 2jo6 h MET 85 Ca -0.50 0.03 -0.31 0.00 0.00 0.00 0.00 59.70 58.92 2jo6 h MET 85 Cb 1.19 0.12 0.02 0.00 0.00 0.00 0.00 31.60 32.93 2jo6 h MET 85 CO 0.61 -0.22 -1.47 1.49 0.00 0.00 0.00 176.91 177.31 2jo6 h GLU 86 N -0.76 0.41 -0.12 1.72 4.81 -1.97 -3.29 114.58 115.39 2jo6 h GLU 86 Ca -0.05 -0.70 0.00 0.00 -0.13 0.00 0.00 59.36 58.48 2jo6 h GLU 86 Cb 0.52 0.26 0.00 0.00 0.63 0.00 0.00 28.75 30.16 2jo6 h GLU 86 CO 0.09 1.33 0.00 -0.25 -0.73 0.00 0.00 179.01 179.45 2jo6 n ASP 87 N -3.77 0.47 -0.25 1.04 9.92 -1.26 -4.60 116.55 118.11 2jo6 n ASP 87 Ca -0.21 -2.00 0.04 0.00 -0.53 0.00 0.00 54.79 52.08 2jo6 n ASP 87 Cb 1.02 -0.07 0.09 0.00 -0.64 0.00 0.00 41.12 41.52 2jo6 n ASP 87 CO 0.00 0.00 0.00 1.21 0.13 0.00 0.00 177.20 178.54 2jo6 n GLU 88 N -0.25 -0.07 0.29 -1.24 2.13 -0.73 0.00 120.64 120.76 2jo6 n GLU 88 Ca 0.03 1.07 0.13 0.00 0.66 0.00 0.00 57.16 59.05 2jo6 n GLU 88 Cb 0.08 -1.60 0.83 0.00 0.27 0.00 0.00 31.44 31.02 2jo6 n GLU 88 CO 0.00 0.00 0.00 1.96 -0.41 0.00 0.00 177.13 178.68 2jo6 h GLN 89 N 0.00 0.00 0.00 5.31 7.50 -1.86 -3.32 115.11 122.74 2jo6 h GLN 89 Ca 0.32 0.00 -0.01 0.00 0.50 0.00 0.00 58.65 59.46 2jo6 h GLN 89 Cb 0.49 0.00 -0.00 0.00 0.05 0.00 0.00 27.48 28.02 2jo6 h GLN 89 CO -0.70 0.00 -0.42 1.19 -1.50 0.00 0.00 178.83 177.40 2jo6 n PHE 90 N -4.04 0.00 -1.25 2.96 3.72 0.10 -5.13 117.46 113.82 2jo6 n PHE 90 Ca -0.03 0.00 0.17 0.00 -0.05 0.00 0.00 57.45 57.54 2jo6 n PHE 90 Cb 0.09 -0.17 -0.04 0.00 -0.94 0.00 0.00 39.48 38.41 2jo6 n PHE 90 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 176.76 177.14 2jo6 n SER 91 N -3.77 -7.39 -4.79 4.37 7.64 0.74 -4.94 113.62 105.48 2jo6 n SER 91 Ca -0.06 0.50 -0.22 0.00 1.01 0.00 0.00 58.87 60.10 2jo6 n SER 91 Cb 0.20 -3.77 0.09 0.00 -1.01 0.00 0.00 64.21 59.73 2jo6 n SER 91 CO 0.00 0.00 0.00 0.68 -3.01 0.00 0.00 175.04 172.71 2jo6 s VAL 92 N -2.08 2.15 -0.07 0.44 -7.23 -1.24 -4.97 120.40 107.40 2jo6 s VAL 92 Ca 0.00 -0.73 -0.30 0.00 -1.81 0.00 0.00 61.98 59.15 2jo6 s VAL 92 Cb 0.00 -2.42 -0.02 0.00 0.56 0.00 0.00 36.38 34.50 2jo6 s VAL 92 CO 0.00 0.00 1.09 -0.75 -0.31 0.00 0.00 175.10 175.13 2jo6 s LYS 93 N -4.99 4.41 -0.14 4.82 2.20 -1.26 -4.82 119.74 119.96 2jo6 s LYS 93 Ca 0.65 1.52 -0.20 0.00 -0.36 0.00 0.00 55.97 57.58 2jo6 s LYS 93 Cb -0.05 -3.53 -0.03 0.00 -1.51 0.00 0.00 37.83 32.70 2jo6 s LYS 93 CO 0.43 -0.34 0.59 -1.58 -0.36 0.00 0.00 175.35 174.09 2jo6 s HIS 94 N 1.93 3.47 -0.12 4.03 5.65 -1.26 -2.00 115.29 126.99 2jo6 s HIS 94 Ca 0.52 0.98 -0.06 0.00 0.25 0.00 0.00 55.06 56.76 2jo6 s HIS 94 Cb -0.22 -2.72 -0.04 0.00 -1.18 0.00 0.00 32.58 28.43 2jo6 s HIS 94 CO 0.21 -0.00 0.09 0.71 -0.65 0.00 0.00 174.74 175.10 2jo6 s TYR 95 N 1.23 3.41 -0.31 3.88 1.51 -0.18 -5.00 117.35 121.90 2jo6 s TYR 95 Ca 0.30 0.35 -0.22 0.00 -1.01 0.00 0.00 57.07 56.49 2jo6 s TYR 95 Cb -0.16 -1.92 -0.00 0.00 -0.11 0.00 0.00 41.96 39.76 2jo6 s TYR 95 CO 0.12 0.55 0.70 -1.21 -1.11 0.00 0.00 175.55 174.61 2jo6 s GLU 96 N -0.72 3.93 0.23 -0.62 2.02 -0.92 -4.06 118.70 118.56 2jo6 s GLU 96 Ca 0.12 0.43 0.11 0.00 0.02 0.00 0.00 54.97 55.65 2jo6 s GLU 96 Cb -0.12 -3.73 -0.05 0.00 0.10 0.00 0.00 34.13 30.34 2jo6 s GLU 96 CO 0.03 -0.62 -0.16 0.00 0.02 0.00 0.00 175.26 174.53 2jo6 s ALA 97 N 2.77 2.79 0.08 5.21 0.00 -1.26 0.05 121.76 131.41 2jo6 s ALA 97 Ca 0.28 -1.67 -0.17 0.00 0.00 0.00 0.00 51.96 50.41 2jo6 s ALA 97 Cb -0.15 -0.48 0.03 0.00 0.00 0.00 0.00 23.12 22.53 2jo6 s ALA 97 CO 0.12 0.37 0.39 -0.98 0.00 0.00 0.00 175.76 175.66 2jo6 s ARG 98 N -3.10 0.98 -0.49 0.00 1.70 -0.60 -4.97 118.95 112.46 2jo6 s ARG 98 Ca 0.26 -0.55 -0.16 0.00 -0.47 0.00 0.00 55.73 54.81 2jo6 s ARG 98 Cb -0.07 0.43 0.09 0.00 -0.57 0.00 0.00 34.95 34.83 2jo6 s ARG 98 CO 0.14 -0.36 0.43 0.08 -1.08 0.00 0.00 175.30 174.51 2jo6 s VAL 99 N -3.15 5.22 -0.79 4.99 1.01 -1.26 -0.49 120.40 125.92 2jo6 s VAL 99 Ca -0.01 -1.17 -0.19 0.00 0.00 0.00 0.00 61.98 60.61 2jo6 s VAL 99 Cb 0.01 -4.19 0.12 0.00 0.00 0.00 0.00 36.38 32.32 2jo6 s VAL 99 CO -0.07 -0.66 0.97 -0.75 0.00 0.00 0.00 175.10 174.59 2jo6 s LYS 100 N 1.65 3.38 -2.02 2.72 2.20 0.19 -4.39 119.74 123.48 2jo6 s LYS 100 Ca 0.04 -1.56 0.00 0.00 -0.36 0.00 0.00 55.97 54.09 2jo6 s LYS 100 Cb -0.26 -4.59 0.00 0.00 -1.51 0.00 0.00 37.83 31.47 2jo6 s LYS 100 CO 0.06 -1.68 0.00 -3.47 -0.36 0.00 0.00 175.35 169.89 2jo6 n ASP 101 N 6.46 -5.66 0.00 1.43 2.03 -1.26 -1.08 116.55 118.48 2jo6 n ASP 101 Ca 0.10 0.29 0.00 0.00 0.52 0.00 0.00 54.79 55.70 2jo6 n ASP 101 Cb 0.47 -4.85 0.00 0.00 -0.72 0.00 0.00 41.12 36.02 2jo6 n ASP 101 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2jo6 n GLY 102 N -0.68 0.93 3.37 0.27 0.00 -1.26 -5.06 105.19 102.76 2jo6 n GLY 102 Ca -0.22 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.48 2jo6 n GLY 102 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2jo6 s VAL 103 N -2.00 2.38 -0.34 1.61 1.01 -0.24 0.38 120.40 123.19 2jo6 s VAL 103 Ca 0.00 -1.09 -0.27 0.00 0.00 0.00 0.00 61.98 60.62 2jo6 s VAL 103 Cb 0.00 -1.89 0.01 0.00 0.00 0.00 0.00 36.38 34.50 2jo6 s VAL 103 CO 0.00 0.51 0.96 -0.69 0.00 0.00 0.00 175.10 175.88 2jo6 s VAL 104 N -0.72 4.59 -0.11 2.92 1.01 0.14 0.57 120.40 128.81 2jo6 s VAL 104 Ca 0.11 1.40 -0.04 0.00 0.00 0.00 0.00 61.98 63.46 2jo6 s VAL 104 Cb -0.10 -4.33 -0.04 0.00 0.00 0.00 0.00 36.38 31.91 2jo6 s VAL 104 CO 0.01 -0.47 0.04 -1.10 0.00 0.00 0.00 175.10 173.58 2jo6 s GLN 105 N 3.46 3.21 -0.14 2.72 -1.52 0.35 -1.67 119.66 126.07 2jo6 s GLN 105 Ca 0.40 -0.35 0.02 0.00 -1.95 0.00 0.00 55.36 53.48 2jo6 s GLN 105 Cb -0.12 -2.92 0.01 0.00 -0.22 0.00 0.00 33.01 29.76 2jo6 s GLN 105 CO 0.16 0.66 -0.19 -0.51 -0.25 0.00 0.00 175.29 175.16 2jo6 s LEU 106 N -0.74 1.97 -0.38 2.90 1.43 -0.93 -1.56 118.68 121.37 2jo6 s LEU 106 Ca 0.12 -0.56 -0.06 0.00 -1.03 0.00 0.00 54.13 52.61 2jo6 s LEU 106 Cb -0.12 -1.33 0.07 0.00 0.03 0.00 0.00 46.19 44.84 2jo6 s LEU 106 CO 0.02 0.03 0.17 -0.60 0.23 0.00 0.00 176.35 176.20 2jo6 s ARG 107 N 1.03 2.41 0.00 1.70 3.52 0.11 -1.02 118.95 126.69 2jo6 s ARG 107 Ca -0.03 -1.47 0.00 0.00 -0.13 0.00 0.00 55.73 54.10 2jo6 s ARG 107 Cb -0.15 -3.55 0.00 0.00 -1.56 0.00 0.00 34.95 29.69 2jo6 s ARG 107 CO -0.05 -0.87 0.00 0.41 -0.81 0.00 0.00 175.30 173.98 2jo6 n GLY 108 N 4.75 2.04 3.25 8.12 0.00 -1.26 -2.17 105.19 119.92 2jo6 n GLY 108 Ca -0.09 -0.15 -0.24 0.00 0.00 0.00 0.00 46.02 45.54 2jo6 n GLY 108 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2jo6 s GLY 109 N 0.00 1.12 0.00 -0.02 0.00 -1.26 -4.96 107.32 102.21 2jo6 s GLY 109 Ca 0.00 -1.11 0.00 0.00 0.00 0.00 0.00 44.72 43.61 2jo6 s GLY 109 CO 0.00 -1.07 0.00 1.44 0.00 0.00 0.00 173.10 173.47