#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jo6 s SER 2 N 0.00 6.35 -0.60 7.83 0.01 -1.26 -4.66 113.70 121.37 2jo6 s SER 2 Ca 0.00 -0.28 -0.19 0.00 1.31 0.00 0.00 55.95 56.78 2jo6 s SER 2 Cb 0.00 -2.34 0.10 0.00 0.21 0.00 0.00 66.02 63.98 2jo6 s SER 2 CO 0.00 -0.84 0.73 -1.58 0.41 0.00 0.00 173.24 171.96 2jo6 s GLN 3 N 3.00 3.05 -0.77 12.44 0.74 -1.26 -5.00 119.66 131.86 2jo6 s GLN 3 Ca 0.25 -1.24 -0.20 0.00 0.05 0.00 0.00 55.36 54.21 2jo6 s GLN 3 Cb -0.14 -4.25 0.10 0.00 1.10 0.00 0.00 33.01 29.82 2jo6 s GLN 3 CO 0.20 -1.56 1.00 -1.58 -0.55 0.00 0.00 175.29 172.80 2jo6 s TRP 4 N 2.84 2.92 -0.22 1.67 0.52 -1.26 -3.88 118.94 121.53 2jo6 s TRP 4 Ca 0.13 -0.98 -0.20 0.00 0.02 0.00 0.00 56.10 55.06 2jo6 s TRP 4 Cb -0.23 -4.25 -0.02 0.00 -1.15 0.00 0.00 33.47 27.82 2jo6 s TRP 4 CO 0.07 -1.53 0.62 0.21 0.02 0.00 0.00 176.95 176.34 2jo6 s LYS 5 N 3.25 4.18 -0.29 4.98 2.20 -0.79 -4.84 119.74 128.42 2jo6 s LYS 5 Ca 0.25 0.58 -0.29 0.00 -0.36 0.00 0.00 55.97 56.15 2jo6 s LYS 5 Cb -0.13 -3.60 -0.02 0.00 -1.51 0.00 0.00 37.83 32.58 2jo6 s LYS 5 CO 0.01 -0.29 1.66 -0.51 -0.36 0.00 0.00 175.35 175.87 2jo6 s ASP 6 N 1.28 6.18 -0.01 1.43 1.11 -1.26 -2.11 116.67 123.30 2jo6 s ASP 6 Ca 0.28 1.40 -0.00 0.00 0.18 0.00 0.00 52.55 54.41 2jo6 s ASP 6 Cb -0.16 -2.53 -0.00 0.00 1.07 0.00 0.00 42.92 41.30 2jo6 s ASP 6 CO 0.10 -1.46 -0.00 0.40 1.18 0.00 0.00 175.17 175.39 2jo6 h ILE 7 N 6.45 0.00 -2.86 0.77 1.08 -1.02 -3.49 117.51 118.44 2jo6 h ILE 7 Ca -0.33 -0.05 0.04 0.00 -0.39 0.00 0.00 64.86 64.14 2jo6 h ILE 7 Cb 1.15 0.00 -0.02 0.00 -3.07 0.00 0.00 36.82 34.89 2jo6 h ILE 7 CO 1.02 0.00 0.35 0.00 -0.69 0.00 0.00 178.15 178.83 2jo6 s LYS 9 N -2.56 3.65 0.07 0.00 1.02 -1.26 0.41 119.74 121.06 2jo6 s LYS 9 Ca 0.16 0.65 0.14 0.00 0.02 0.00 0.00 55.97 56.93 2jo6 s LYS 9 Cb -0.04 -2.17 0.59 0.00 -0.52 0.00 0.00 37.83 35.69 2jo6 s LYS 9 CO 0.09 -0.42 1.42 1.51 -0.92 0.00 0.00 175.35 177.03 2jo6 n ILE 10 N -2.40 1.19 0.21 2.17 0.13 0.19 -0.94 119.36 119.90 2jo6 n ILE 10 Ca 0.05 0.34 0.10 0.00 -1.10 0.00 0.00 62.75 62.14 2jo6 n ILE 10 Cb 0.54 -1.20 0.23 0.00 -0.84 0.00 0.00 39.64 38.37 2jo6 n ILE 10 CO 0.00 0.00 0.00 -0.78 2.80 0.00 0.00 176.55 178.57 2jo6 h ASP 11 N 0.00 0.00 0.01 9.51 1.82 -1.92 -3.33 116.42 122.51 2jo6 h ASP 11 Ca 0.00 0.00 -0.03 0.00 -0.39 0.00 0.00 57.03 56.61 2jo6 h ASP 11 Cb 0.20 0.00 -0.00 0.00 0.68 0.00 0.00 39.33 40.21 2jo6 h ASP 11 CO 0.00 0.16 -0.14 -0.78 -1.61 0.00 0.00 179.24 176.88 2jo6 h ASP 12 N 0.00 0.03 -2.77 2.28 3.58 -1.41 -3.41 116.42 114.72 2jo6 h ASP 12 Ca -0.00 -0.96 -0.62 0.00 0.42 0.00 0.00 57.03 55.87 2jo6 h ASP 12 Cb 1.01 -0.01 -0.13 0.00 1.72 0.00 0.00 39.33 41.92 2jo6 h ASP 12 CO 0.02 1.06 0.59 -0.63 -2.88 0.00 0.00 179.24 177.40 2jo6 s ILE 13 N -2.24 4.29 0.83 2.25 1.01 -1.23 -5.03 121.20 121.08 2jo6 s ILE 13 Ca -0.19 -0.13 -0.12 0.00 0.00 0.00 0.00 60.65 60.21 2jo6 s ILE 13 Cb -0.02 -4.67 0.09 0.00 0.01 0.00 0.00 42.46 37.87 2jo6 s ILE 13 CO 0.69 -1.40 1.13 -0.76 0.00 0.00 0.00 174.94 174.59 2jo6 s LEU 14 N 4.18 2.40 0.45 2.97 1.43 -1.26 -4.89 118.68 123.96 2jo6 s LEU 14 Ca 0.25 1.05 -0.25 0.00 -1.03 0.00 0.00 54.13 54.16 2jo6 s LEU 14 Cb -0.15 -3.56 -0.09 0.00 0.03 0.00 0.00 46.19 42.42 2jo6 s LEU 14 CO 0.13 -2.09 1.28 -0.81 0.23 0.00 0.00 176.35 175.09 2jo6 n PRO 15 N -3.47 1.87 -2.94 1.29 -0.04 -1.26 -2.57 135.00 127.87 2jo6 n PRO 15 Ca 0.07 0.67 -0.21 0.00 -0.04 0.00 0.00 63.50 64.00 2jo6 n PRO 15 Cb 0.58 -2.41 0.03 0.00 -0.04 0.00 0.00 33.50 31.66 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 -0.15 -4.47 -4.81 0.54 1.02 0.15 -5.00 120.64 107.93 2jo6 n GLU 16 Ca 0.07 0.84 -0.25 0.00 -0.02 0.00 0.00 57.16 57.80 2jo6 n GLU 16 Cb 0.41 -5.54 -0.16 0.00 -0.02 0.00 0.00 31.44 26.12 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 -3.13 1.38 -0.03 2.62 2.01 -0.95 -4.95 115.64 112.59 2jo6 s THR 17 Ca 0.27 -0.71 0.07 0.00 0.31 0.00 0.00 61.69 61.64 2jo6 s THR 17 Cb -0.12 -1.18 -0.02 0.00 0.01 0.00 0.00 72.50 71.19 2jo6 s THR 17 CO 0.34 0.40 -0.25 -0.83 -0.69 0.00 0.00 174.62 173.59 2jo6 s GLY 18 N -0.07 1.30 0.06 4.40 0.00 -1.26 -1.10 107.32 110.65 2jo6 s GLY 18 Ca -0.01 -1.10 0.05 0.00 0.00 0.00 0.00 44.72 43.66 2jo6 s GLY 18 CO 0.01 -0.88 -0.15 -1.34 0.00 0.00 0.00 173.10 170.75 2jo6 s VAL 19 N -0.57 1.15 -0.37 1.40 -7.23 0.57 -4.95 120.40 110.41 2jo6 s VAL 19 Ca 0.08 -1.23 -0.15 0.00 -1.81 0.00 0.00 61.98 58.87 2jo6 s VAL 19 Cb -0.11 -1.08 -0.00 0.00 0.56 0.00 0.00 36.38 35.75 2jo6 s VAL 19 CO -0.00 -0.15 0.36 0.00 -0.31 0.00 0.00 175.10 175.00 2jo6 s ALA 21 N 1.98 4.42 -0.08 0.00 0.00 0.13 -4.96 121.76 123.26 2jo6 s ALA 21 Ca 0.11 -0.64 0.01 0.00 0.00 0.00 0.00 51.96 51.43 2jo6 s ALA 21 Cb -0.17 -0.40 0.02 0.00 0.00 0.00 0.00 23.12 22.57 2jo6 s ALA 21 CO 0.12 -0.27 -0.08 -0.51 0.00 0.00 0.00 175.76 175.02 2jo6 s LEU 22 N -4.14 1.32 -0.24 0.00 1.43 -1.26 -0.63 118.68 115.17 2jo6 s LEU 22 Ca 0.18 -0.25 -0.00 0.00 -1.03 0.00 0.00 54.13 53.02 2jo6 s LEU 22 Cb -0.01 -0.74 0.03 0.00 0.03 0.00 0.00 46.19 45.50 2jo6 s LEU 22 CO 0.11 -0.06 -0.10 -0.22 0.23 0.00 0.00 176.35 176.31 2jo6 s LEU 23 N 1.23 3.00 0.00 1.79 2.96 -0.53 -4.94 118.68 122.19 2jo6 s LEU 23 Ca -0.05 -0.92 0.00 0.00 -0.22 0.00 0.00 54.13 52.94 2jo6 s LEU 23 Cb -0.14 -1.60 0.00 0.00 0.50 0.00 0.00 46.19 44.95 2jo6 s LEU 23 CO -0.02 -0.11 0.00 0.61 -1.32 0.00 0.00 176.35 175.51 2jo6 n GLY 24 N 4.61 1.26 0.00 7.98 0.00 -1.26 -1.70 105.19 116.09 2jo6 n GLY 24 Ca -0.17 0.23 0.00 0.00 0.00 0.00 0.00 46.02 46.08 2jo6 n GLY 24 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2jo6 n ASP 25 N 8.41 0.52 -4.87 1.61 5.68 -1.26 -5.08 116.55 121.56 2jo6 n ASP 25 Ca 0.00 -0.99 -0.33 0.00 -0.50 0.00 0.00 54.79 52.97 2jo6 n ASP 25 Cb 0.00 0.01 -0.05 0.00 -1.14 0.00 0.00 41.12 39.93 2jo6 n ASP 25 CO 0.00 0.00 0.00 -0.70 -1.33 0.00 0.00 177.20 175.17 2jo6 s GLU 26 N -0.01 3.79 -0.27 0.11 2.12 -0.69 -5.05 118.70 118.71 2jo6 s GLU 26 Ca 0.00 0.23 -0.23 0.00 0.36 0.00 0.00 54.97 55.33 2jo6 s GLU 26 Cb 0.00 -2.79 -0.01 0.00 0.26 0.00 0.00 34.13 31.59 2jo6 s GLU 26 CO 0.00 0.41 0.75 -0.65 -0.54 0.00 0.00 175.26 175.23 2jo6 s GLN 27 N -2.48 4.08 -0.11 4.30 -0.21 -1.26 -1.46 119.66 122.52 2jo6 s GLN 27 Ca 0.42 0.68 -0.00 0.00 0.02 0.00 0.00 55.36 56.48 2jo6 s GLN 27 Cb -0.12 -3.68 -0.02 0.00 1.00 0.00 0.00 33.01 30.19 2jo6 s GLN 27 CO 0.21 -0.54 -0.10 0.08 -2.12 0.00 0.00 175.29 172.82 2jo6 s VAL 28 N 2.77 3.39 -0.30 1.09 1.01 0.20 -0.26 120.40 128.29 2jo6 s VAL 28 Ca 0.31 -0.56 -0.12 0.00 0.00 0.00 0.00 61.98 61.61 2jo6 s VAL 28 Cb -0.15 -2.42 -0.04 0.00 0.00 0.00 0.00 36.38 33.78 2jo6 s VAL 28 CO 0.09 0.54 0.24 0.00 0.00 0.00 0.00 175.10 175.98 2jo6 s ALA 29 N -0.08 3.53 -0.25 5.51 0.00 0.14 0.21 121.76 130.81 2jo6 s ALA 29 Ca -0.01 -1.14 -0.10 0.00 0.00 0.00 0.00 51.96 50.72 2jo6 s ALA 29 Cb -0.14 -2.58 -0.04 0.00 0.00 0.00 0.00 23.12 20.36 2jo6 s ALA 29 CO 0.03 -0.71 0.14 0.42 0.00 0.00 0.00 175.76 175.65 2jo6 s ILE 30 N 1.81 5.04 -0.15 0.00 1.01 0.56 -1.66 121.20 127.81 2jo6 s ILE 30 Ca 0.08 0.07 0.01 0.00 0.00 0.00 0.00 60.65 60.82 2jo6 s ILE 30 Cb -0.16 -3.36 0.00 0.00 0.01 0.00 0.00 42.46 38.95 2jo6 s ILE 30 CO 0.11 0.32 -0.18 -0.36 0.00 0.00 0.00 174.94 174.83 2jo6 s PHE 31 N 1.37 2.73 -0.45 3.97 0.08 0.86 -0.32 117.98 126.23 2jo6 s PHE 31 Ca 0.07 -1.20 -0.07 0.00 0.12 0.00 0.00 56.93 55.84 2jo6 s PHE 31 Cb -0.15 -1.86 0.12 0.00 -0.57 0.00 0.00 43.02 40.56 2jo6 s PHE 31 CO 0.06 -0.55 0.30 0.50 -0.10 0.00 0.00 175.22 175.43 2jo6 s ARG 32 N 0.84 2.34 -0.03 0.44 3.52 -0.26 -0.85 118.95 124.95 2jo6 s ARG 32 Ca -0.06 -1.77 -0.20 0.00 -0.13 0.00 0.00 55.73 53.57 2jo6 s ARG 32 Cb -0.15 -3.82 -0.33 0.00 -1.56 0.00 0.00 34.95 29.09 2jo6 s ARG 32 CO -0.01 -1.15 0.91 -1.00 -0.81 0.00 0.00 175.30 173.24 2jo6 h PRO 33 N 8.33 0.37 -7.06 5.12 0.13 -1.85 0.45 132.00 137.49 2jo6 h PRO 33 Ca -0.19 -0.63 -0.45 0.00 -0.87 0.00 0.00 66.00 63.86 2jo6 h PRO 33 Cb 1.07 0.23 0.07 0.00 0.13 0.00 0.00 31.00 32.50 2jo6 h PRO 33 CO 0.81 1.30 0.09 0.71 -0.23 0.00 0.00 178.00 180.68 2jo6 s TYR 34 N -2.48 2.68 -1.87 1.56 2.02 -1.26 -3.52 117.35 114.49 2jo6 s TYR 34 Ca -0.12 0.12 0.28 0.00 -0.37 0.00 0.00 57.07 56.98 2jo6 s TYR 34 Cb 0.02 -2.97 1.11 0.00 -0.40 0.00 0.00 41.96 39.71 2jo6 s TYR 34 CO 0.86 -1.22 1.78 1.58 -1.57 0.00 0.00 175.55 176.99 2jo6 n HIS 35 N -2.65 0.00 -0.96 2.71 -0.00 -1.26 -4.40 115.22 108.66 2jo6 n HIS 35 Ca 0.09 0.00 0.00 0.00 0.46 0.00 0.00 57.72 58.27 2jo6 n HIS 35 Cb 0.60 -0.12 0.00 0.00 -0.12 0.00 0.00 29.99 30.35 2jo6 n HIS 35 CO 0.00 0.00 0.00 0.43 0.46 0.00 0.00 176.34 177.23 2jo6 n SER 36 N -0.65 0.00 -0.65 0.26 7.64 -1.26 -4.91 113.62 114.05 2jo6 n SER 36 Ca 0.15 0.00 0.09 0.00 1.01 0.00 0.00 58.87 60.12 2jo6 n SER 36 Cb 0.30 0.00 0.29 0.00 -1.01 0.00 0.00 64.21 63.79 2jo6 n SER 36 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 2jo6 n ASP 37 N 0.00 1.92 -4.60 6.43 9.92 -1.26 -4.85 116.55 124.11 2jo6 n ASP 37 Ca 0.00 -1.83 -0.43 0.00 -0.53 0.00 0.00 54.79 52.00 2jo6 n ASP 37 Cb 0.00 -0.17 -0.02 0.00 -0.64 0.00 0.00 41.12 40.29 2jo6 n ASP 37 CO 0.00 0.00 0.00 -1.10 0.13 0.00 0.00 177.20 176.23 2jo6 s GLN 38 N -1.66 3.70 0.03 -1.24 1.11 -1.26 -4.68 119.66 115.65 2jo6 s GLN 38 Ca 0.30 0.54 0.06 0.00 0.01 0.00 0.00 55.36 56.28 2jo6 s GLN 38 Cb 0.16 -3.92 -0.02 0.00 -1.01 0.00 0.00 33.01 28.22 2jo6 s GLN 38 CO 0.23 -1.42 -0.18 0.14 0.01 0.00 0.00 175.29 174.07 2jo6 s VAL 39 N 4.54 1.44 0.08 1.09 -7.23 -1.26 -4.00 120.40 115.06 2jo6 s VAL 39 Ca 0.48 -1.02 0.07 0.00 -1.81 0.00 0.00 61.98 59.70 2jo6 s VAL 39 Cb -0.07 -1.25 -0.03 0.00 0.56 0.00 0.00 36.38 35.59 2jo6 s VAL 39 CO 0.31 0.21 -0.18 -0.36 -0.31 0.00 0.00 175.10 174.77 2jo6 s PHE 40 N -0.70 1.59 -0.05 2.82 0.08 -0.03 -4.62 117.98 117.07 2jo6 s PHE 40 Ca 0.06 -0.41 0.01 0.00 0.12 0.00 0.00 56.93 56.71 2jo6 s PHE 40 Cb -0.08 -0.89 0.02 0.00 -0.57 0.00 0.00 43.02 41.50 2jo6 s PHE 40 CO 0.01 0.13 -0.07 0.00 -0.10 0.00 0.00 175.22 175.19 2jo6 s ALA 41 N -1.09 0.86 0.24 5.36 0.00 -1.25 -0.10 121.76 125.78 2jo6 s ALA 41 Ca 0.04 -0.18 0.01 0.00 0.00 0.00 0.00 51.96 51.83 2jo6 s ALA 41 Cb -0.10 -0.49 -0.05 0.00 0.00 0.00 0.00 23.12 22.48 2jo6 s ALA 41 CO 0.03 -0.01 0.10 0.96 0.00 0.00 0.00 175.76 176.84 2jo6 s ILE 42 N 0.91 0.44 0.20 0.00 -4.36 -0.67 -0.66 121.20 117.06 2jo6 s ILE 42 Ca -0.11 -2.00 -0.32 0.00 -0.26 0.00 0.00 60.65 57.96 2jo6 s ILE 42 Cb -0.15 -2.57 -0.12 0.00 1.25 0.00 0.00 42.46 40.88 2jo6 s ILE 42 CO 0.01 -0.04 1.73 -0.44 0.24 0.00 0.00 174.94 176.44 2jo6 s SER 43 N -3.27 6.39 0.26 4.36 0.01 -1.18 0.24 113.70 120.52 2jo6 s SER 43 Ca 0.37 2.84 0.25 0.00 1.31 0.00 0.00 55.95 60.72 2jo6 s SER 43 Cb 0.08 -2.60 0.91 0.00 0.21 0.00 0.00 66.02 64.62 2jo6 s SER 43 CO 0.12 -0.97 1.75 -1.13 0.41 0.00 0.00 173.24 173.42 2jo6 h ASN 44 N 7.03 0.00 -3.31 2.44 -1.24 -0.91 -3.42 115.58 116.17 2jo6 h ASN 44 Ca -0.43 0.00 -0.65 0.00 0.71 0.00 0.00 56.30 55.93 2jo6 h ASN 44 Cb 1.20 0.00 -0.33 0.00 0.73 0.00 0.00 38.32 39.92 2jo6 h ASN 44 CO 0.95 0.00 -0.86 -0.63 -1.29 0.00 0.00 177.43 175.60 2jo6 s ILE 45 N -3.24 1.89 0.33 2.57 1.01 -1.26 -1.86 121.20 120.64 2jo6 s ILE 45 Ca 0.07 -0.90 -0.18 0.00 0.00 0.00 0.00 60.65 59.63 2jo6 s ILE 45 Cb 0.10 -1.65 -0.09 0.00 0.01 0.00 0.00 42.46 40.83 2jo6 s ILE 45 CO 0.50 0.52 0.81 1.51 0.00 0.00 0.00 174.94 178.27 2jo6 s ASP 46 N 0.56 6.92 0.20 3.58 1.47 -1.22 -4.93 116.67 123.26 2jo6 s ASP 46 Ca -0.14 1.46 0.16 0.00 1.18 0.00 0.00 52.55 55.20 2jo6 s ASP 46 Cb -0.17 -2.44 -0.00 0.00 -0.34 0.00 0.00 42.92 39.97 2jo6 s ASP 46 CO 0.05 -0.19 1.21 1.55 0.68 0.00 0.00 175.17 178.47 2jo6 h PRO 47 N 2.45 0.00 0.05 2.11 0.14 -1.96 -2.88 132.00 131.92 2jo6 h PRO 47 Ca -0.48 0.00 -0.32 0.00 0.14 0.00 0.00 66.00 65.34 2jo6 h PRO 47 Cb 1.18 0.00 -0.03 0.00 0.14 0.00 0.00 31.00 32.29 2jo6 h PRO 47 CO 0.64 0.39 -1.76 1.19 0.14 0.00 0.00 178.00 178.60 2jo6 n PHE 48 N -3.08 0.96 0.64 1.56 3.72 -1.26 -4.40 117.46 115.61 2jo6 n PHE 48 Ca -0.02 0.30 0.07 0.00 -0.05 0.00 0.00 57.45 57.75 2jo6 n PHE 48 Cb 0.76 -1.11 -0.05 0.00 -0.94 0.00 0.00 39.48 38.14 2jo6 n PHE 48 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 176.76 177.05 2jo6 n PHE 49 N -3.95 0.00 -3.22 1.38 7.35 -1.26 -5.05 117.46 112.72 2jo6 n PHE 49 Ca -0.35 0.00 -0.25 0.00 -0.76 0.00 0.00 57.45 56.09 2jo6 n PHE 49 Cb 0.87 0.00 0.03 0.00 0.35 0.00 0.00 39.48 40.73 2jo6 n PHE 49 CO 0.00 0.00 0.00 -0.85 -0.76 0.00 0.00 176.76 175.15 2jo6 n GLU 50 N -0.89 -2.12 -3.57 -4.13 0.28 -1.09 -4.99 120.64 104.13 2jo6 n GLU 50 Ca 0.04 1.73 -0.40 0.00 -0.16 0.00 0.00 57.16 58.37 2jo6 n GLU 50 Cb 0.25 -3.61 -0.11 0.00 1.43 0.00 0.00 31.44 29.39 2jo6 n GLU 50 CO 0.00 0.00 0.00 -1.12 -0.16 0.00 0.00 177.13 175.85 2jo6 s SER 51 N -1.95 5.85 0.27 -1.84 0.01 -1.25 -4.92 113.70 109.86 2jo6 s SER 51 Ca 0.32 -0.59 -0.04 0.00 1.31 0.00 0.00 55.95 56.95 2jo6 s SER 51 Cb -0.05 -2.08 0.35 0.00 0.21 0.00 0.00 66.02 64.45 2jo6 s SER 51 CO 0.82 -0.27 1.93 0.28 0.41 0.00 0.00 173.24 176.42 2jo6 h SER 52 N 8.45 1.07 -3.27 2.44 0.02 -1.93 -3.22 113.55 117.11 2jo6 h SER 52 Ca -0.30 -0.02 -0.53 0.00 -0.84 0.00 0.00 61.79 60.09 2jo6 h SER 52 Cb 1.14 -0.26 -0.35 0.00 0.14 0.00 0.00 62.40 63.07 2jo6 h SER 52 CO 0.64 0.76 -0.81 0.68 -1.14 0.00 0.00 176.83 176.96 2jo6 s VAL 53 N -6.04 1.15 -0.59 2.27 -7.23 -1.24 -4.19 120.40 104.52 2jo6 s VAL 53 Ca -0.12 -0.41 0.23 0.00 -1.81 0.00 0.00 61.98 59.86 2jo6 s VAL 53 Cb 0.18 -1.10 -0.07 0.00 0.56 0.00 0.00 36.38 35.96 2jo6 s VAL 53 CO 0.81 0.38 1.10 0.18 -0.31 0.00 0.00 175.10 177.25 2jo6 n LEU 54 N 4.45 0.63 0.11 1.32 4.77 -0.78 -4.10 117.00 123.40 2jo6 n LEU 54 Ca -0.17 0.07 0.10 0.00 -0.03 0.00 0.00 56.01 55.98 2jo6 n LEU 54 Cb 0.51 -0.12 0.45 0.00 -2.33 0.00 0.00 43.42 41.93 2jo6 n LEU 54 CO 0.21 0.00 0.82 -1.20 -1.33 0.00 0.00 177.39 175.89 2jo6 n SER 55 N -2.04 0.52 -2.04 -1.43 7.64 -1.26 -2.73 113.62 112.27 2jo6 n SER 55 Ca 0.02 0.64 -0.22 0.00 1.01 0.00 0.00 58.87 60.32 2jo6 n SER 55 Cb 0.45 -0.75 0.04 0.00 -1.01 0.00 0.00 64.21 62.94 2jo6 n SER 55 CO 0.00 0.00 0.00 -1.14 -3.01 0.00 0.00 175.04 170.89 2jo6 n ARG 56 N -2.09 2.06 -4.24 1.43 0.63 -1.26 -4.69 116.66 108.50 2jo6 n ARG 56 Ca 0.02 -2.04 -0.14 0.00 -0.92 0.00 0.00 57.85 54.78 2jo6 n ARG 56 Cb 0.19 -1.81 -0.10 0.00 0.45 0.00 0.00 32.46 31.19 2jo6 n ARG 56 CO 0.00 0.00 0.00 0.20 -2.51 0.00 0.00 177.63 175.32 2jo6 s GLY 57 N -0.29 1.24 0.03 5.14 0.00 -1.10 -4.33 107.32 108.00 2jo6 s GLY 57 Ca 0.41 -1.60 -0.10 0.00 0.00 0.00 0.00 44.72 43.42 2jo6 s GLY 57 CO -0.02 -1.53 0.36 1.08 0.00 0.00 0.00 173.10 172.99 2jo6 s LEU 58 N -3.18 4.39 -0.19 0.66 2.01 -0.59 -4.80 118.68 116.99 2jo6 s LEU 58 Ca 0.24 0.78 -0.08 0.00 0.01 0.00 0.00 54.13 55.08 2jo6 s LEU 58 Cb 0.06 -2.76 -0.04 0.00 0.01 0.00 0.00 46.19 43.45 2jo6 s LEU 58 CO 0.04 0.24 0.08 -0.63 1.01 0.00 0.00 176.35 177.10 2jo6 s ILE 59 N -1.27 4.94 -0.05 -0.59 1.01 -1.26 -0.71 121.20 123.26 2jo6 s ILE 59 Ca 0.28 0.02 -0.07 0.00 0.00 0.00 0.00 60.65 60.88 2jo6 s ILE 59 Cb -0.14 -3.24 0.01 0.00 0.01 0.00 0.00 42.46 39.10 2jo6 s ILE 59 CO 0.15 0.45 0.18 0.00 0.00 0.00 0.00 174.94 175.72 2jo6 s ALA 60 N 0.41 -0.44 -0.54 9.38 0.00 0.74 -5.00 121.76 126.31 2jo6 s ALA 60 Ca 0.04 0.34 -0.22 0.00 0.00 0.00 0.00 51.96 52.13 2jo6 s ALA 60 Cb -0.12 -0.18 0.05 0.00 0.00 0.00 0.00 23.12 22.87 2jo6 s ALA 60 CO -0.00 -0.13 0.80 -2.00 0.00 0.00 0.00 175.76 174.43 2jo6 s GLU 61 N -0.36 3.22 -0.11 0.00 -6.30 -1.26 -0.64 118.70 113.26 2jo6 s GLU 61 Ca -0.05 -0.58 -0.14 0.00 -2.50 0.00 0.00 54.97 51.70 2jo6 s GLU 61 Cb -0.03 -4.09 -0.12 0.00 0.00 0.00 0.00 34.13 29.89 2jo6 s GLU 61 CO 0.01 -1.39 0.41 1.25 0.02 0.00 0.00 175.26 175.56 2jo6 h HIS 62 N 9.19 -0.04 -0.56 5.30 -0.00 -1.82 -3.46 115.15 123.75 2jo6 h HIS 62 Ca -0.27 -0.00 -0.01 0.00 -0.00 0.00 0.00 60.37 60.09 2jo6 h HIS 62 Cb 1.08 0.01 -0.17 0.00 -0.00 0.00 0.00 27.41 28.34 2jo6 h HIS 62 CO 0.84 0.40 -0.28 -1.14 -0.00 0.00 0.00 177.93 177.76 2jo6 s GLN 63 N -2.07 0.53 0.00 5.26 0.74 -1.26 -4.93 119.66 117.94 2jo6 s GLN 63 Ca -0.09 -0.37 0.00 0.00 0.05 0.00 0.00 55.36 54.95 2jo6 s GLN 63 Cb -0.01 0.02 0.00 0.00 1.10 0.00 0.00 33.01 34.11 2jo6 s GLN 63 CO 0.32 -0.71 0.00 0.41 -0.55 0.00 0.00 175.29 174.77 2jo6 n GLY 64 N 3.40 2.35 2.93 2.59 0.00 -1.26 -4.96 105.19 110.24 2jo6 n GLY 64 Ca 0.11 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.02 2jo6 n GLY 64 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2jo6 s GLU 65 N -0.01 0.16 -0.25 1.61 0.41 -1.26 -5.13 118.70 114.24 2jo6 s GLU 65 Ca 0.00 -0.29 -0.22 0.00 -0.41 0.00 0.00 54.97 54.05 2jo6 s GLU 65 Cb 0.00 0.03 -0.02 0.00 -1.78 0.00 0.00 34.13 32.36 2jo6 s GLU 65 CO 0.00 -0.02 0.69 -0.51 -0.49 0.00 0.00 175.26 174.94 2jo6 s LEU 66 N -0.68 4.07 -0.06 1.80 1.43 -1.26 -2.37 118.68 121.61 2jo6 s LEU 66 Ca -0.07 0.82 0.04 0.00 -1.03 0.00 0.00 54.13 53.90 2jo6 s LEU 66 Cb -0.05 -2.96 -0.02 0.00 0.03 0.00 0.00 46.19 43.19 2jo6 s LEU 66 CO -0.00 -0.41 -0.20 0.26 0.23 0.00 0.00 176.35 176.23 2jo6 s TRP 67 N 2.56 2.57 -0.08 0.29 0.52 0.19 -0.24 118.94 124.76 2jo6 s TRP 67 Ca 0.29 -0.52 -0.00 0.00 0.02 0.00 0.00 56.10 55.89 2jo6 s TRP 67 Cb -0.15 -1.64 -0.03 0.00 -1.15 0.00 0.00 33.47 30.49 2jo6 s TRP 67 CO 0.08 -0.09 -0.05 0.54 0.02 0.00 0.00 176.95 177.46 2jo6 s VAL 68 N -0.27 3.86 -0.13 4.03 0.11 0.43 -0.19 120.40 128.23 2jo6 s VAL 68 Ca 0.01 -0.42 -0.01 0.00 -2.93 0.00 0.00 61.98 58.63 2jo6 s VAL 68 Cb -0.13 -2.59 0.04 0.00 -1.53 0.00 0.00 36.38 32.16 2jo6 s VAL 68 CO 0.03 0.59 -0.03 0.00 -3.33 0.00 0.00 175.10 172.37 2jo6 s ALA 69 N -0.76 1.15 -0.20 1.54 0.00 0.11 -0.31 121.76 123.29 2jo6 s ALA 69 Ca 0.12 -0.56 -0.29 0.00 0.00 0.00 0.00 51.96 51.23 2jo6 s ALA 69 Cb -0.11 -0.99 -0.00 0.00 0.00 0.00 0.00 23.12 22.02 2jo6 s ALA 69 CO 0.02 -0.69 1.14 -1.12 0.00 0.00 0.00 175.76 175.10 2jo6 s SER 70 N 1.78 7.03 0.00 0.00 0.01 -1.10 -1.54 113.70 119.88 2jo6 s SER 70 Ca 0.02 1.51 0.06 0.00 1.31 0.00 0.00 55.95 58.85 2jo6 s SER 70 Cb -0.14 -2.54 0.29 0.00 0.21 0.00 0.00 66.02 63.84 2jo6 s SER 70 CO -0.07 -0.72 1.16 -2.65 0.41 0.00 0.00 173.24 171.37 2jo6 n PRO 71 N 6.46 0.03 0.00 12.44 -0.02 -1.26 -0.57 135.00 152.08 2jo6 n PRO 71 Ca 0.13 0.34 0.00 0.00 -2.02 0.00 0.00 63.50 61.95 2jo6 n PRO 71 Cb 0.46 -1.50 0.00 0.00 -0.02 0.00 0.00 33.50 32.44 2jo6 n PRO 71 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 2jo6 n LEU 72 N -1.44 0.00 -0.07 2.45 7.99 -1.26 -3.99 117.00 120.68 2jo6 n LEU 72 Ca 0.02 0.96 0.01 0.00 -0.01 0.00 0.00 56.01 56.99 2jo6 n LEU 72 Cb 0.07 -0.46 0.02 0.00 -0.11 0.00 0.00 43.42 42.93 2jo6 n LEU 72 CO 0.06 -0.46 0.50 0.29 -1.51 0.00 0.00 177.39 176.27 2jo6 n LYS 73 N -2.24 2.77 -3.14 3.23 4.76 -1.23 -5.01 118.16 117.29 2jo6 n LYS 73 Ca 0.00 -1.51 -0.06 0.00 -2.87 0.00 0.00 58.31 53.88 2jo6 n LYS 73 Cb 0.00 -1.03 0.02 0.00 -1.84 0.00 0.00 35.03 32.18 2jo6 n LYS 73 CO 0.00 0.00 0.00 1.17 -1.37 0.00 0.00 177.40 177.20 2jo6 n LYS 74 N -0.36 -1.63 -3.10 1.97 4.81 0.26 -4.98 118.16 115.13 2jo6 n LYS 74 Ca 0.01 1.27 -0.40 0.00 -0.87 0.00 0.00 58.31 58.32 2jo6 n LYS 74 Cb 0.26 -5.72 -0.06 0.00 0.02 0.00 0.00 35.03 29.53 2jo6 n LYS 74 CO 0.00 0.00 0.00 -0.65 1.17 0.00 0.00 177.40 177.92 2jo6 s GLN 75 N -3.53 4.16 -0.24 1.64 -1.52 -1.11 -4.88 119.66 114.18 2jo6 s GLN 75 Ca 0.16 0.60 -0.15 0.00 -1.95 0.00 0.00 55.36 54.02 2jo6 s GLN 75 Cb -0.02 -3.62 -0.04 0.00 -0.22 0.00 0.00 33.01 29.11 2jo6 s GLN 75 CO 0.75 -0.33 0.35 1.03 -0.25 0.00 0.00 175.29 176.84 2jo6 s ARG 76 N 2.24 4.07 -0.18 2.91 3.00 -1.26 -2.70 118.95 127.03 2jo6 s ARG 76 Ca 0.28 0.05 0.01 0.00 0.00 0.00 0.00 55.73 56.06 2jo6 s ARG 76 Cb -0.16 -3.60 0.02 0.00 0.00 0.00 0.00 34.95 31.21 2jo6 s ARG 76 CO 0.09 -0.16 -0.19 -0.06 0.00 0.00 0.00 175.30 174.98 2jo6 s PHE 77 N 1.70 2.78 -0.49 -0.53 0.40 0.58 0.20 117.98 122.61 2jo6 s PHE 77 Ca 0.15 -1.55 -0.28 0.00 -0.60 0.00 0.00 56.93 54.65 2jo6 s PHE 77 Cb -0.15 -1.92 0.01 0.00 0.51 0.00 0.00 43.02 41.47 2jo6 s PHE 77 CO 0.09 -0.76 1.41 0.50 0.70 0.00 0.00 175.22 177.15 2jo6 s ARG 78 N 1.24 3.43 0.49 0.44 3.52 0.15 -0.43 118.95 127.79 2jo6 s ARG 78 Ca 0.03 0.68 0.17 0.00 -0.13 0.00 0.00 55.73 56.49 2jo6 s ARG 78 Cb -0.13 -4.07 1.21 0.00 -1.56 0.00 0.00 34.95 30.39 2jo6 s ARG 78 CO -0.11 -1.76 2.05 -0.07 -0.81 0.00 0.00 175.30 174.61 2jo6 h LEU 79 N 12.67 0.14 -0.73 -0.88 3.38 -0.93 0.10 115.31 129.06 2jo6 h LEU 79 Ca -0.27 0.00 0.14 0.00 0.09 0.00 0.00 57.88 57.85 2jo6 h LEU 79 Cb 1.10 -0.03 -0.14 0.00 0.09 0.00 0.00 40.66 41.68 2jo6 h LEU 79 CO 1.13 0.09 -0.20 0.28 0.09 0.00 0.00 178.44 179.84 2jo6 h SER 80 N 0.16 -0.72 0.00 -0.43 0.02 -1.90 -3.27 113.55 107.40 2jo6 h SER 80 Ca 0.16 0.22 -0.01 0.00 -0.84 0.00 0.00 61.79 61.33 2jo6 h SER 80 Cb 0.44 0.47 -0.01 0.00 0.14 0.00 0.00 62.40 63.43 2jo6 h SER 80 CO -0.02 -0.25 -0.41 -0.67 -1.14 0.00 0.00 176.83 174.34 2jo6 n ASP 81 N -5.48 0.02 -2.23 3.07 2.03 -1.11 -5.01 116.55 107.84 2jo6 n ASP 81 Ca 0.09 -1.79 -0.13 0.00 0.52 0.00 0.00 54.79 53.49 2jo6 n ASP 81 Cb 0.37 -0.16 0.05 0.00 -0.72 0.00 0.00 41.12 40.66 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 0.01 0.11 3.44 0.27 0.00 0.28 -4.58 105.19 104.72 2jo6 n GLY 82 Ca -0.00 -0.16 -0.44 0.00 0.00 0.00 0.00 46.02 45.42 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 -4.47 5.01 0.17 0.99 2.96 -0.79 -2.83 118.68 119.72 2jo6 s LEU 83 Ca 0.27 -0.97 -0.30 0.00 -0.22 0.00 0.00 54.13 52.90 2jo6 s LEU 83 Cb -0.12 -2.43 -0.08 0.00 0.50 0.00 0.00 46.19 44.06 2jo6 s LEU 83 CO 0.40 -0.93 1.29 0.00 -1.32 0.00 0.00 176.35 175.80 2jo6 h MET 85 N 5.74 0.56 0.00 0.00 4.05 -0.64 0.57 114.93 125.21 2jo6 h MET 85 Ca -0.44 -0.15 -0.21 0.00 -0.28 0.00 0.00 59.70 58.62 2jo6 h MET 85 Cb 1.21 -0.07 -0.03 0.00 -0.80 0.00 0.00 31.60 31.92 2jo6 h MET 85 CO 0.79 0.64 -1.15 1.49 0.23 0.00 0.00 176.91 178.90 2jo6 h GLU 86 N 0.53 0.01 -0.18 0.39 4.81 -1.92 -3.34 114.58 114.88 2jo6 h GLU 86 Ca 0.10 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.32 2jo6 h GLU 86 Cb 0.44 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.83 2jo6 h GLU 86 CO 0.02 1.01 0.00 -0.25 -0.73 0.00 0.00 179.01 179.06 2jo6 n ASP 87 N -4.43 0.81 -0.42 1.04 8.00 -1.24 -4.40 116.55 115.91 2jo6 n ASP 87 Ca -0.30 -2.01 0.35 0.00 0.71 0.00 0.00 54.79 53.54 2jo6 n ASP 87 Cb 0.67 -0.12 0.57 0.00 -0.02 0.00 0.00 41.12 42.23 2jo6 n ASP 87 CO 0.00 0.00 0.00 1.21 -0.39 0.00 0.00 177.20 178.02 2jo6 n GLU 88 N -0.08 -0.03 -0.31 -1.24 2.13 0.19 -0.62 120.64 120.69 2jo6 n GLU 88 Ca 0.05 1.00 0.16 0.00 0.66 0.00 0.00 57.16 59.03 2jo6 n GLU 88 Cb 0.13 -2.02 0.34 0.00 0.27 0.00 0.00 31.44 30.17 2jo6 n GLU 88 CO 0.00 0.00 0.00 0.37 -0.41 0.00 0.00 177.13 177.09 2jo6 h GLN 89 N 0.00 0.29 0.00 5.31 5.75 -1.85 -3.24 115.11 121.36 2jo6 h GLN 89 Ca 0.73 -0.02 0.00 0.00 -0.15 0.00 0.00 58.65 59.21 2jo6 h GLN 89 Cb 2.44 -0.06 0.00 0.00 1.07 0.00 0.00 27.48 30.92 2jo6 h GLN 89 CO -0.33 0.19 -0.55 0.34 -2.65 0.00 0.00 178.83 175.83 2jo6 n PHE 90 N -5.13 0.00 -4.61 3.99 7.35 -0.46 -5.15 117.46 113.45 2jo6 n PHE 90 Ca 0.24 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.93 2jo6 n PHE 90 Cb 0.76 0.00 0.00 0.00 0.35 0.00 0.00 39.48 40.59 2jo6 n PHE 90 CO 0.00 0.00 0.00 0.43 -0.76 0.00 0.00 176.76 176.43 2jo6 n SER 91 N -1.00 -3.42 -1.77 -2.13 7.64 0.21 -4.97 113.62 108.17 2jo6 n SER 91 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 2jo6 n SER 91 Cb 0.10 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.30 2jo6 n SER 91 CO 0.00 0.00 0.00 1.33 -3.01 0.00 0.00 175.04 173.36 2jo6 n VAL 92 N -1.06 0.00 -2.74 0.44 0.24 -1.13 -4.96 118.33 109.13 2jo6 n VAL 92 Ca 0.00 0.00 -0.42 0.00 -2.04 0.00 0.00 64.34 61.88 2jo6 n VAL 92 Cb 0.00 -0.27 -0.03 0.00 -1.47 0.00 0.00 33.84 32.06 2jo6 n VAL 92 CO 0.00 0.00 0.00 -0.54 -2.14 0.00 0.00 176.83 174.15 2jo6 s LYS 93 N -1.60 4.58 -0.32 7.34 1.02 -1.26 -4.92 119.74 124.57 2jo6 s LYS 93 Ca 0.00 1.39 -0.10 0.00 0.02 0.00 0.00 55.97 57.27 2jo6 s LYS 93 Cb 0.00 -3.44 -0.00 0.00 -0.52 0.00 0.00 37.83 33.86 2jo6 s LYS 93 CO 0.00 0.01 0.17 -1.58 -0.92 0.00 0.00 175.35 173.03 2jo6 s HIS 94 N 0.79 3.19 0.04 3.18 5.65 -1.26 -3.11 115.29 123.78 2jo6 s HIS 94 Ca 0.50 -0.57 -0.06 0.00 0.25 0.00 0.00 55.06 55.17 2jo6 s HIS 94 Cb -0.21 -2.39 -0.05 0.00 -1.18 0.00 0.00 32.58 28.75 2jo6 s HIS 94 CO 0.28 -0.47 0.30 0.71 -0.65 0.00 0.00 174.74 174.90 2jo6 s TYR 95 N 1.62 3.56 -0.35 3.88 2.02 0.17 -5.02 117.35 123.22 2jo6 s TYR 95 Ca 0.04 0.57 -0.23 0.00 -0.37 0.00 0.00 57.07 57.08 2jo6 s TYR 95 Cb -0.17 -1.99 0.01 0.00 -0.40 0.00 0.00 41.96 39.40 2jo6 s TYR 95 CO 0.07 0.57 0.80 -1.21 -1.57 0.00 0.00 175.55 174.21 2jo6 s GLU 96 N -1.98 3.80 0.05 -0.62 2.02 -0.87 -3.93 118.70 117.16 2jo6 s GLU 96 Ca 0.31 0.39 0.05 0.00 0.02 0.00 0.00 54.97 55.74 2jo6 s GLU 96 Cb -0.13 -3.79 -0.04 0.00 0.10 0.00 0.00 34.13 30.27 2jo6 s GLU 96 CO 0.19 -0.83 -0.11 0.00 0.02 0.00 0.00 175.26 174.53 2jo6 s ALA 97 N 3.11 2.89 0.23 5.21 0.00 -1.26 -0.05 121.76 131.90 2jo6 s ALA 97 Ca 0.32 -1.14 -0.12 0.00 0.00 0.00 0.00 51.96 51.03 2jo6 s ALA 97 Cb -0.13 -0.95 -0.01 0.00 0.00 0.00 0.00 23.12 22.03 2jo6 s ALA 97 CO 0.16 0.61 0.43 -0.98 0.00 0.00 0.00 175.76 175.99 2jo6 s ARG 98 N -1.69 1.46 -0.56 0.00 1.70 -0.90 -4.87 118.95 114.10 2jo6 s ARG 98 Ca 0.18 -1.25 -0.05 0.00 -0.47 0.00 0.00 55.73 54.14 2jo6 s ARG 98 Cb -0.11 0.45 0.14 0.00 -0.57 0.00 0.00 34.95 34.86 2jo6 s ARG 98 CO 0.09 -0.59 0.38 0.08 -1.08 0.00 0.00 175.30 174.18 2jo6 s VAL 99 N -4.02 3.80 -0.78 4.99 1.01 -1.26 -1.31 120.40 122.84 2jo6 s VAL 99 Ca 0.23 -2.49 -0.24 0.00 0.00 0.00 0.00 61.98 59.47 2jo6 s VAL 99 Cb 0.00 -3.50 0.06 0.00 0.00 0.00 0.00 36.38 32.94 2jo6 s VAL 99 CO 0.08 -0.82 1.20 -0.75 0.00 0.00 0.00 175.10 174.80 2jo6 s LYS 100 N 0.51 3.27 -1.37 2.72 2.20 0.22 -4.05 119.74 123.24 2jo6 s LYS 100 Ca 0.13 -0.71 0.00 0.00 -0.36 0.00 0.00 55.97 55.02 2jo6 s LYS 100 Cb -0.21 -4.46 0.00 0.00 -1.51 0.00 0.00 37.83 31.64 2jo6 s LYS 100 CO -0.04 -2.02 0.00 -3.47 -0.36 0.00 0.00 175.35 169.46 2jo6 n ASP 101 N 8.52 -5.20 0.00 1.43 2.03 -1.26 -0.00 116.55 122.07 2jo6 n ASP 101 Ca 0.08 0.32 0.00 0.00 0.52 0.00 0.00 54.79 55.71 2jo6 n ASP 101 Cb 0.48 -4.09 0.00 0.00 -0.72 0.00 0.00 41.12 36.79 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 0.06 0.93 3.46 0.27 0.00 -1.26 -5.05 105.19 103.60 2jo6 n GLY 102 Ca -0.13 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.55 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 3.76 -0.16 1.61 1.01 0.99 0.53 120.40 126.14 2jo6 s VAL 103 Ca 0.00 -0.40 -0.29 0.00 0.00 0.00 0.00 61.98 61.29 2jo6 s VAL 103 Cb 0.00 -2.65 -0.01 0.00 0.00 0.00 0.00 36.38 33.71 2jo6 s VAL 103 CO 0.00 0.48 1.16 -0.69 0.00 0.00 0.00 175.10 176.05 2jo6 s VAL 104 N 0.57 4.44 0.18 2.92 1.01 0.17 0.70 120.40 130.39 2jo6 s VAL 104 Ca -0.03 1.74 0.10 0.00 0.00 0.00 0.00 61.98 63.79 2jo6 s VAL 104 Cb -0.14 -4.12 -0.04 0.00 0.00 0.00 0.00 36.38 32.07 2jo6 s VAL 104 CO 0.03 -0.11 -0.15 -1.10 0.00 0.00 0.00 175.10 173.76 2jo6 s GLN 105 N 3.02 1.84 -0.10 2.72 -0.21 -0.43 -0.29 119.66 126.21 2jo6 s GLN 105 Ca 0.51 -1.35 0.03 0.00 0.02 0.00 0.00 55.36 54.57 2jo6 s GLN 105 Cb -0.20 -2.05 0.01 0.00 1.00 0.00 0.00 33.01 31.77 2jo6 s GLN 105 CO 0.14 0.43 -0.19 -0.51 -2.12 0.00 0.00 175.29 173.03 2jo6 s LEU 106 N -2.70 1.92 -0.28 2.90 1.43 -0.89 -2.11 118.68 118.95 2jo6 s LEU 106 Ca 0.23 -0.49 -0.05 0.00 -1.03 0.00 0.00 54.13 52.79 2jo6 s LEU 106 Cb -0.09 -1.23 0.01 0.00 0.03 0.00 0.00 46.19 44.92 2jo6 s LEU 106 CO 0.13 0.09 0.03 -0.60 0.23 0.00 0.00 176.35 176.22 2jo6 s ARG 107 N 0.65 3.03 -0.54 1.70 3.52 0.93 -1.89 118.95 126.34 2jo6 s ARG 107 Ca -0.13 -0.88 0.04 0.00 -0.13 0.00 0.00 55.73 54.63 2jo6 s ARG 107 Cb -0.16 -3.24 0.14 0.00 -1.56 0.00 0.00 34.95 30.13 2jo6 s ARG 107 CO 0.03 -0.42 0.31 0.20 -0.81 0.00 0.00 175.30 174.62 2jo6 s GLY 108 N 1.45 2.40 -1.00 8.12 0.00 -1.25 -2.05 107.32 114.98 2jo6 s GLY 108 Ca 0.02 -3.27 -0.24 0.00 0.00 0.00 0.00 44.72 41.23 2jo6 s GLY 108 CO 0.00 1.14 1.90 -0.32 0.00 0.00 0.00 173.10 175.82 2jo6 s GLY 109 N -0.43 0.30 0.00 0.20 0.00 -1.26 -4.77 107.32 101.36 2jo6 s GLY 109 Ca 0.19 -1.79 0.00 0.00 0.00 0.00 0.00 44.72 43.12 2jo6 s GLY 109 CO -0.04 3.42 0.11 1.44 0.00 0.00 0.00 173.10 178.03