#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 -0.74 -3.07 7.83 2.88 -1.26 -5.08 113.62 114.17 2jo6 n SER 2 Ca 0.00 0.17 -0.10 0.00 -1.33 0.00 0.00 58.87 57.61 2jo6 n SER 2 Cb 0.00 1.04 0.01 0.00 -0.75 0.00 0.00 64.21 64.51 2jo6 n SER 2 CO 0.00 0.00 0.00 1.67 -1.23 0.00 0.00 175.04 175.48 2jo6 n GLN 3 N -2.69 -1.88 -2.15 -1.46 7.27 -1.26 -3.14 117.38 112.07 2jo6 n GLN 3 Ca 0.00 1.71 -0.30 0.00 0.07 0.00 0.00 57.00 58.48 2jo6 n GLN 3 Cb 0.00 -5.06 -0.05 0.00 2.41 0.00 0.00 30.24 27.54 2jo6 n GLN 3 CO 0.00 0.00 0.00 -1.58 0.07 0.00 0.00 177.06 175.55 2jo6 s TRP 4 N -2.67 2.00 -0.31 3.69 0.52 -1.26 -3.78 118.94 117.12 2jo6 s TRP 4 Ca 0.15 0.26 -0.29 0.00 0.02 0.00 0.00 56.10 56.24 2jo6 s TRP 4 Cb -0.04 -4.17 -0.01 0.00 -1.15 0.00 0.00 33.47 28.11 2jo6 s TRP 4 CO 0.78 -1.65 1.47 0.21 0.02 0.00 0.00 176.95 177.78 2jo6 s LYS 5 N 6.45 3.73 -0.27 4.98 2.47 0.39 -4.61 119.74 132.88 2jo6 s LYS 5 Ca 0.65 1.30 -0.29 0.00 -1.56 0.00 0.00 55.97 56.07 2jo6 s LYS 5 Cb -0.04 -3.99 -0.01 0.00 -1.46 0.00 0.00 37.83 32.33 2jo6 s LYS 5 CO 0.02 -1.36 1.39 0.16 0.16 0.00 0.00 175.35 175.72 2jo6 s ASP 6 N 3.81 6.60 0.00 1.43 -4.77 -1.26 -1.16 116.67 121.32 2jo6 s ASP 6 Ca 0.64 1.35 0.00 0.00 -3.30 0.00 0.00 52.55 51.24 2jo6 s ASP 6 Cb -0.19 -2.54 0.00 0.00 -1.09 0.00 0.00 42.92 39.11 2jo6 s ASP 6 CO 0.28 -1.11 0.00 -0.38 0.70 0.00 0.00 175.17 174.66 2jo6 n ILE 7 N 6.22 0.00 -4.20 2.11 2.08 0.49 -5.00 119.36 121.06 2jo6 n ILE 7 Ca 0.16 0.00 -0.12 0.00 0.56 0.00 0.00 62.75 63.34 2jo6 n ILE 7 Cb 0.46 -0.52 -0.10 0.00 -0.75 0.00 0.00 39.64 38.73 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 -4.11 4.50 0.00 0.00 1.02 -1.26 0.07 119.74 119.95 2jo6 s LYS 9 Ca 0.39 1.36 0.13 0.00 0.02 0.00 0.00 55.97 57.87 2jo6 s LYS 9 Cb 0.07 -2.73 0.61 0.00 -0.52 0.00 0.00 37.83 35.25 2jo6 s LYS 9 CO 0.13 0.19 1.36 1.51 -0.92 0.00 0.00 175.35 177.62 2jo6 n ILE 10 N 0.40 0.86 0.27 2.17 3.06 0.15 -1.31 119.36 124.96 2jo6 n ILE 10 Ca 0.03 0.21 0.15 0.00 -2.50 0.00 0.00 62.75 60.64 2jo6 n ILE 10 Cb 0.50 -1.00 0.44 0.00 0.54 0.00 0.00 39.64 40.12 2jo6 n ILE 10 CO 0.00 0.00 0.00 -0.78 -2.50 0.00 0.00 176.55 173.27 2jo6 h ASP 11 N 0.00 0.00 0.13 9.51 3.58 -1.91 -3.21 116.42 124.51 2jo6 h ASP 11 Ca 0.00 0.00 -0.30 0.00 0.42 0.00 0.00 57.03 57.15 2jo6 h ASP 11 Cb 0.16 0.00 -0.00 0.00 1.72 0.00 0.00 39.33 41.21 2jo6 h ASP 11 CO 0.00 0.00 -1.54 -0.78 -2.88 0.00 0.00 179.24 174.04 2jo6 h ASP 12 N 0.00 0.42 -3.02 2.28 3.58 -1.58 -3.43 116.42 114.67 2jo6 h ASP 12 Ca 0.00 -0.87 -0.55 0.00 0.42 0.00 0.00 57.03 56.03 2jo6 h ASP 12 Cb 0.73 -0.14 -0.07 0.00 1.72 0.00 0.00 39.33 41.57 2jo6 h ASP 12 CO 0.00 1.68 1.00 -0.63 -2.88 0.00 0.00 179.24 178.41 2jo6 s ILE 13 N -2.50 3.95 0.68 2.25 1.01 -1.21 -5.01 121.20 120.36 2jo6 s ILE 13 Ca -0.20 0.80 -0.14 0.00 0.00 0.00 0.00 60.65 61.12 2jo6 s ILE 13 Cb 0.05 -4.76 0.01 0.00 0.01 0.00 0.00 42.46 37.77 2jo6 s ILE 13 CO 0.78 -1.44 1.09 -0.76 0.00 0.00 0.00 174.94 174.61 2jo6 s LEU 14 N 5.15 3.30 0.44 2.97 1.43 -1.26 -4.91 118.68 125.80 2jo6 s LEU 14 Ca 0.42 1.88 -0.25 0.00 -1.03 0.00 0.00 54.13 55.15 2jo6 s LEU 14 Cb -0.08 -4.53 -0.09 0.00 0.03 0.00 0.00 46.19 41.52 2jo6 s LEU 14 CO 0.23 -1.61 1.31 -2.65 0.23 0.00 0.00 176.35 173.86 2jo6 n PRO 15 N -2.67 1.98 -2.32 1.29 -0.02 -1.26 -2.46 135.00 129.55 2jo6 n PRO 15 Ca 0.09 0.71 -0.13 0.00 -2.02 0.00 0.00 63.50 62.15 2jo6 n PRO 15 Cb 0.53 -2.45 -0.00 0.00 -0.02 0.00 0.00 33.50 31.56 2jo6 n PRO 15 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 2jo6 n GLU 16 N -0.07 -1.35 -4.75 -0.52 1.02 0.19 -4.99 120.64 110.18 2jo6 n GLU 16 Ca 0.06 0.64 -0.25 0.00 -0.02 0.00 0.00 57.16 57.60 2jo6 n GLU 16 Cb 0.40 -4.87 -0.16 0.00 -0.02 0.00 0.00 31.44 26.79 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 -2.70 1.29 -0.05 2.62 2.01 -0.92 -4.99 115.64 112.91 2jo6 s THR 17 Ca 0.03 -0.65 0.06 0.00 0.31 0.00 0.00 61.69 61.43 2jo6 s THR 17 Cb -0.01 -1.11 -0.01 0.00 0.01 0.00 0.00 72.50 71.38 2jo6 s THR 17 CO 0.03 0.37 -0.22 -0.83 -0.69 0.00 0.00 174.62 173.29 2jo6 s GLY 18 N -0.02 1.12 0.19 4.40 0.00 -1.26 -1.40 107.32 110.35 2jo6 s GLY 18 Ca -0.02 -0.90 0.08 0.00 0.00 0.00 0.00 44.72 43.89 2jo6 s GLY 18 CO 0.01 -0.56 -0.16 -1.34 0.00 0.00 0.00 173.10 171.06 2jo6 s VAL 19 N -0.14 1.77 -0.40 1.40 -7.23 -0.18 -4.63 120.40 110.99 2jo6 s VAL 19 Ca -0.02 -2.10 -0.12 0.00 -1.81 0.00 0.00 61.98 57.93 2jo6 s VAL 19 Cb -0.12 -1.96 0.04 0.00 0.56 0.00 0.00 36.38 34.90 2jo6 s VAL 19 CO 0.02 -0.49 0.25 0.00 -0.31 0.00 0.00 175.10 174.57 2jo6 s ALA 21 N 1.55 3.91 -0.53 0.00 0.00 0.83 -4.88 121.76 122.64 2jo6 s ALA 21 Ca 0.03 -0.77 -0.15 0.00 0.00 0.00 0.00 51.96 51.07 2jo6 s ALA 21 Cb -0.20 -1.95 0.13 0.00 0.00 0.00 0.00 23.12 21.09 2jo6 s ALA 21 CO 0.06 0.68 0.48 -0.51 0.00 0.00 0.00 175.76 176.47 2jo6 s LEU 22 N -2.77 6.10 -0.99 0.00 1.43 -1.26 -0.24 118.68 120.95 2jo6 s LEU 22 Ca 0.37 -1.78 -0.13 0.00 -1.03 0.00 0.00 54.13 51.57 2jo6 s LEU 22 Cb -0.12 -2.18 0.23 0.00 0.03 0.00 0.00 46.19 44.14 2jo6 s LEU 22 CO 0.27 -0.83 1.00 -0.22 0.23 0.00 0.00 176.35 176.81 2jo6 s LEU 23 N 1.57 6.26 0.00 1.79 0.20 0.00 -4.89 118.68 123.62 2jo6 s LEU 23 Ca 0.03 -3.01 0.00 0.00 0.69 0.00 0.00 54.13 51.84 2jo6 s LEU 23 Cb -0.29 -2.25 0.00 0.00 -0.43 0.00 0.00 46.19 43.22 2jo6 s LEU 23 CO 0.03 -0.53 0.00 0.61 -0.29 0.00 0.00 176.35 176.17 2jo6 n GLY 24 N 3.64 2.33 0.62 7.98 0.00 -1.26 -2.01 105.19 116.49 2jo6 n GLY 24 Ca 0.21 -0.28 0.08 0.00 0.00 0.00 0.00 46.02 46.02 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 9.43 2.33 -4.59 1.61 8.00 -1.26 -4.93 116.55 127.15 2jo6 n ASP 25 Ca 0.00 -1.65 -0.43 0.00 0.71 0.00 0.00 54.79 53.42 2jo6 n ASP 25 Cb 0.00 -0.02 -0.04 0.00 -0.02 0.00 0.00 41.12 41.03 2jo6 n ASP 25 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 2jo6 s GLU 26 N -1.23 3.71 -0.47 -1.24 0.41 -0.85 -5.00 118.70 114.02 2jo6 s GLU 26 Ca 0.19 0.37 -0.29 0.00 -0.41 0.00 0.00 54.97 54.82 2jo6 s GLU 26 Cb 0.13 -3.85 0.03 0.00 -1.78 0.00 0.00 34.13 28.66 2jo6 s GLU 26 CO 0.19 -1.02 1.20 -0.65 -0.49 0.00 0.00 175.26 174.49 2jo6 s GLN 27 N 3.48 3.67 -0.20 1.61 -0.21 -1.26 -0.82 119.66 125.93 2jo6 s GLN 27 Ca 0.36 0.62 -0.09 0.00 0.02 0.00 0.00 55.36 56.27 2jo6 s GLN 27 Cb -0.12 -3.94 -0.05 0.00 1.00 0.00 0.00 33.01 29.91 2jo6 s GLN 27 CO 0.21 -1.45 0.10 0.08 -2.12 0.00 0.00 175.29 172.11 2jo6 s VAL 28 N 4.72 5.08 -0.50 1.09 1.01 0.66 -1.11 120.40 131.35 2jo6 s VAL 28 Ca 0.51 0.07 -0.21 0.00 0.00 0.00 0.00 61.98 62.34 2jo6 s VAL 28 Cb -0.08 -3.31 0.04 0.00 0.00 0.00 0.00 36.38 33.03 2jo6 s VAL 28 CO 0.32 0.44 0.75 0.00 0.00 0.00 0.00 175.10 176.61 2jo6 s ALA 29 N 0.44 3.29 -0.38 5.51 0.00 0.85 -0.12 121.76 131.36 2jo6 s ALA 29 Ca 0.06 -1.40 -0.19 0.00 0.00 0.00 0.00 51.96 50.42 2jo6 s ALA 29 Cb -0.12 -3.48 0.01 0.00 0.00 0.00 0.00 23.12 19.53 2jo6 s ALA 29 CO -0.00 -2.08 0.56 0.42 0.00 0.00 0.00 175.76 174.66 2jo6 s ILE 30 N 3.16 4.95 -0.22 0.00 1.01 0.29 -1.85 121.20 128.54 2jo6 s ILE 30 Ca 0.23 0.26 -0.06 0.00 0.00 0.00 0.00 60.65 61.08 2jo6 s ILE 30 Cb -0.15 -4.05 -0.03 0.00 0.01 0.00 0.00 42.46 38.24 2jo6 s ILE 30 CO 0.17 -0.35 0.03 -0.36 0.00 0.00 0.00 174.94 174.42 2jo6 s PHE 31 N 2.54 3.06 -0.47 3.97 0.08 0.74 -1.01 117.98 126.88 2jo6 s PHE 31 Ca 0.20 -0.45 -0.10 0.00 0.12 0.00 0.00 56.93 56.71 2jo6 s PHE 31 Cb -0.15 -2.15 0.12 0.00 -0.57 0.00 0.00 43.02 40.27 2jo6 s PHE 31 CO 0.15 -0.28 0.35 0.50 -0.10 0.00 0.00 175.22 175.84 2jo6 s ARG 32 N 1.23 2.50 0.03 0.44 3.52 -0.49 -1.30 118.95 124.89 2jo6 s ARG 32 Ca 0.04 -1.76 0.18 0.00 -0.13 0.00 0.00 55.73 54.06 2jo6 s ARG 32 Cb -0.15 -3.94 -0.16 0.00 -1.56 0.00 0.00 34.95 29.14 2jo6 s ARG 32 CO 0.02 -1.20 0.71 -0.35 -0.81 0.00 0.00 175.30 173.68 2jo6 n PRO 33 N 4.93 0.63 -3.28 5.12 -0.04 -1.26 0.57 135.00 141.67 2jo6 n PRO 33 Ca -0.08 0.13 -0.19 0.00 -0.04 0.00 0.00 63.50 63.32 2jo6 n PRO 33 Cb 0.41 -1.74 0.00 0.00 -0.04 0.00 0.00 33.50 32.13 2jo6 n PRO 33 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 2jo6 s TYR 34 N -2.99 3.07 -1.03 0.54 2.02 -1.26 -4.02 117.35 113.68 2jo6 s TYR 34 Ca -0.04 -0.17 0.28 0.00 -0.37 0.00 0.00 57.07 56.76 2jo6 s TYR 34 Cb 0.09 -2.15 1.02 0.00 -0.40 0.00 0.00 41.96 40.52 2jo6 s TYR 34 CO 0.82 -0.18 1.77 0.72 -1.57 0.00 0.00 175.55 177.12 2jo6 n HIS 35 N -1.78 0.00 -0.72 2.71 8.25 -1.26 -4.50 115.22 117.92 2jo6 n HIS 35 Ca 0.02 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.48 2jo6 n HIS 35 Cb 0.58 -0.41 0.00 0.00 1.12 0.00 0.00 29.99 31.28 2jo6 n HIS 35 CO 0.00 0.00 0.00 0.43 0.64 0.00 0.00 176.34 177.41 2jo6 n SER 36 N -1.48 -0.03 -2.02 0.41 7.64 -1.26 -4.95 113.62 111.94 2jo6 n SER 36 Ca 0.07 -0.72 -0.21 0.00 1.01 0.00 0.00 58.87 59.03 2jo6 n SER 36 Cb 0.33 0.00 0.14 0.00 -1.01 0.00 0.00 64.21 63.67 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 -2.18 4.08 -4.43 6.43 5.75 -1.26 -4.89 116.55 120.04 2jo6 n ASP 37 Ca 0.00 -3.33 -0.38 0.00 -0.01 0.00 0.00 54.79 51.07 2jo6 n ASP 37 Cb 0.00 -0.81 -0.12 0.00 -1.03 0.00 0.00 41.12 39.17 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 -2.73 3.34 0.13 0.11 -1.52 -1.26 -4.66 119.66 113.07 2jo6 s GLN 38 Ca 0.47 -0.71 0.07 0.00 -1.95 0.00 0.00 55.36 53.24 2jo6 s GLN 38 Cb 0.39 -3.51 -0.04 0.00 -0.22 0.00 0.00 33.01 29.63 2jo6 s GLN 38 CO 0.08 -0.39 -0.16 0.14 -0.25 0.00 0.00 175.29 174.70 2jo6 s VAL 39 N 1.60 1.49 0.07 1.09 -7.23 -1.26 -4.30 120.40 111.87 2jo6 s VAL 39 Ca 0.04 -1.72 0.05 0.00 -1.81 0.00 0.00 61.98 58.54 2jo6 s VAL 39 Cb -0.17 -1.58 -0.03 0.00 0.56 0.00 0.00 36.38 35.16 2jo6 s VAL 39 CO 0.05 -0.33 -0.13 -0.36 -0.31 0.00 0.00 175.10 174.03 2jo6 s PHE 40 N -1.92 1.14 -0.05 2.82 0.08 -0.42 -4.78 117.98 114.84 2jo6 s PHE 40 Ca 0.10 -0.50 0.01 0.00 0.12 0.00 0.00 56.93 56.66 2jo6 s PHE 40 Cb -0.06 -0.64 0.02 0.00 -0.57 0.00 0.00 43.02 41.77 2jo6 s PHE 40 CO 0.04 0.04 -0.05 0.00 -0.10 0.00 0.00 175.22 175.15 2jo6 s ALA 41 N -1.50 0.79 0.26 5.36 0.00 -1.25 -0.19 121.76 125.22 2jo6 s ALA 41 Ca -0.01 -0.13 0.04 0.00 0.00 0.00 0.00 51.96 51.85 2jo6 s ALA 41 Cb -0.09 -0.49 -0.01 0.00 0.00 0.00 0.00 23.12 22.53 2jo6 s ALA 41 CO 0.02 -0.06 0.13 0.44 0.00 0.00 0.00 175.76 176.29 2jo6 n ILE 42 N 4.16 0.00 -1.94 0.00 -5.35 -0.77 -1.13 119.36 114.33 2jo6 n ILE 42 Ca -0.22 -1.62 -0.42 0.00 -0.27 0.00 0.00 62.75 60.21 2jo6 n ILE 42 Cb 0.51 0.67 -0.03 0.00 -1.74 0.00 0.00 39.64 39.05 2jo6 n ILE 42 CO 0.00 0.00 0.00 -0.44 -1.76 0.00 0.00 176.55 174.35 2jo6 s SER 43 N -2.65 6.62 0.19 7.28 0.01 -0.78 -0.10 113.70 124.27 2jo6 s SER 43 Ca 0.19 2.39 0.05 0.00 1.31 0.00 0.00 55.95 59.89 2jo6 s SER 43 Cb 0.01 -2.55 0.08 0.00 0.21 0.00 0.00 66.02 63.77 2jo6 s SER 43 CO 0.13 -0.92 1.44 -1.13 0.41 0.00 0.00 173.24 173.17 2jo6 h ASN 44 N 9.17 0.16 -3.35 2.44 -1.24 -1.41 -3.43 115.58 117.92 2jo6 h ASN 44 Ca -0.42 -0.12 -0.64 0.00 0.71 0.00 0.00 56.30 55.83 2jo6 h ASN 44 Cb 1.20 -0.05 -0.22 0.00 0.73 0.00 0.00 38.32 39.97 2jo6 h ASN 44 CO 0.94 0.90 -0.67 -0.63 -1.29 0.00 0.00 177.43 176.68 2jo6 s ILE 45 N -3.29 3.87 -0.15 2.57 1.01 -1.25 -1.16 121.20 122.81 2jo6 s ILE 45 Ca -0.02 -0.36 -0.29 0.00 0.00 0.00 0.00 60.65 59.98 2jo6 s ILE 45 Cb 0.11 -2.72 -0.01 0.00 0.01 0.00 0.00 42.46 39.85 2jo6 s ILE 45 CO 0.81 0.47 1.11 -0.62 0.00 0.00 0.00 174.94 176.71 2jo6 s ASP 46 N 0.62 7.10 0.00 3.58 2.15 -0.20 -4.93 116.67 124.99 2jo6 s ASP 46 Ca -0.02 1.57 0.27 0.00 0.43 0.00 0.00 52.55 54.80 2jo6 s ASP 46 Cb -0.14 -2.55 0.88 0.00 -0.30 0.00 0.00 42.92 40.81 2jo6 s ASP 46 CO 0.02 -0.61 1.65 -0.81 -0.17 0.00 0.00 175.17 175.26 2jo6 n PRO 47 N 5.78 0.42 -0.08 4.34 -0.05 -1.26 -1.91 135.00 142.23 2jo6 n PRO 47 Ca 0.11 -0.20 -0.11 0.00 -0.05 0.00 0.00 63.50 63.26 2jo6 n PRO 47 Cb 0.47 -1.50 -0.05 0.00 -0.05 0.00 0.00 33.50 32.37 2jo6 n PRO 47 CO 0.00 0.00 0.00 1.19 -0.05 0.00 0.00 175.50 176.64 2jo6 n PHE 48 N -1.12 0.93 0.94 0.54 3.72 -1.26 -4.41 117.46 116.81 2jo6 n PHE 48 Ca 0.10 0.41 0.11 0.00 -0.05 0.00 0.00 57.45 58.02 2jo6 n PHE 48 Cb 0.32 -0.89 0.04 0.00 -0.94 0.00 0.00 39.48 38.02 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 -4.55 0.03 -2.71 1.38 7.35 -1.26 -4.99 117.46 112.70 2jo6 n PHE 49 Ca -0.17 0.01 -0.06 0.00 -0.76 0.00 0.00 57.45 56.47 2jo6 n PHE 49 Cb 0.42 -0.15 0.03 0.00 0.35 0.00 0.00 39.48 40.13 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 -1.56 -1.34 -3.62 -4.13 1.02 -0.80 -5.02 120.64 105.18 2jo6 n GLU 50 Ca 0.04 0.90 -0.38 0.00 -0.02 0.00 0.00 57.16 57.69 2jo6 n GLU 50 Cb 0.35 -4.64 -0.11 0.00 -0.02 0.00 0.00 31.44 27.01 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 -3.04 5.73 0.15 1.62 0.01 -0.95 -4.94 113.70 112.29 2jo6 s SER 51 Ca 0.19 -0.31 -0.12 0.00 1.31 0.00 0.00 55.95 57.01 2jo6 s SER 51 Cb -0.02 -2.05 0.03 0.00 0.21 0.00 0.00 66.02 64.18 2jo6 s SER 51 CO 0.54 -0.14 1.63 0.28 0.41 0.00 0.00 173.24 175.96 2jo6 h SER 52 N 8.37 0.84 -3.27 2.44 0.02 -1.87 -0.51 113.55 119.58 2jo6 h SER 52 Ca -0.34 -0.27 -0.53 0.00 -0.84 0.00 0.00 61.79 59.81 2jo6 h SER 52 Cb 1.16 -0.22 -0.35 0.00 0.14 0.00 0.00 62.40 63.13 2jo6 h SER 52 CO 0.60 0.91 -0.81 0.68 -1.14 0.00 0.00 176.83 177.06 2jo6 s VAL 53 N -5.14 1.12 -0.14 2.27 -7.23 -1.25 -3.94 120.40 106.09 2jo6 s VAL 53 Ca -0.13 -0.40 0.19 0.00 -1.81 0.00 0.00 61.98 59.84 2jo6 s VAL 53 Cb 0.12 -1.08 -0.15 0.00 0.56 0.00 0.00 36.38 35.82 2jo6 s VAL 53 CO 0.81 0.37 0.73 0.18 -0.31 0.00 0.00 175.10 176.89 2jo6 n LEU 54 N 4.47 0.64 0.24 1.32 4.77 -0.30 -4.39 117.00 123.75 2jo6 n LEU 54 Ca -0.17 0.27 0.08 0.00 -0.03 0.00 0.00 56.01 56.16 2jo6 n LEU 54 Cb 0.51 0.08 0.60 0.00 -2.33 0.00 0.00 43.42 42.28 2jo6 n LEU 54 CO 0.21 0.10 0.94 0.77 -1.33 0.00 0.00 177.39 178.07 2jo6 h SER 55 N 0.00 0.00 -0.39 -1.43 4.64 -1.88 -2.87 113.55 111.62 2jo6 h SER 55 Ca -0.15 0.00 -0.26 0.00 -0.47 0.00 0.00 61.79 60.91 2jo6 h SER 55 Cb 1.46 0.00 -0.11 0.00 -0.31 0.00 0.00 62.40 63.44 2jo6 h SER 55 CO 0.03 0.15 0.29 0.54 -0.87 0.00 0.00 176.83 176.97 2jo6 n ARG 56 N -4.08 1.67 -4.25 4.77 1.74 -1.26 -4.21 116.66 111.05 2jo6 n ARG 56 Ca -0.02 -1.23 -0.14 0.00 -0.77 0.00 0.00 57.85 55.69 2jo6 n ARG 56 Cb 0.23 -1.52 -0.10 0.00 -1.02 0.00 0.00 32.46 30.05 2jo6 n ARG 56 CO 0.00 0.00 0.00 0.20 -1.52 0.00 0.00 177.63 176.31 2jo6 s GLY 57 N 0.69 1.26 0.26 -0.13 0.00 -1.08 -4.54 107.32 103.78 2jo6 s GLY 57 Ca 0.27 -1.61 -0.26 0.00 0.00 0.00 0.00 44.72 43.12 2jo6 s GLY 57 CO -0.02 -1.54 0.88 1.08 0.00 0.00 0.00 173.10 173.50 2jo6 s LEU 58 N -3.19 4.45 -0.41 0.66 2.01 -0.59 -4.75 118.68 116.86 2jo6 s LEU 58 Ca 0.25 1.75 -0.09 0.00 0.01 0.00 0.00 54.13 56.05 2jo6 s LEU 58 Cb 0.06 -3.73 0.07 0.00 0.01 0.00 0.00 46.19 42.60 2jo6 s LEU 58 CO 0.05 0.04 0.24 -0.63 1.01 0.00 0.00 176.35 177.06 2jo6 s ILE 59 N -1.43 4.14 0.10 -0.59 1.01 -1.26 0.18 121.20 123.35 2jo6 s ILE 59 Ca 0.45 -1.39 0.07 0.00 0.00 0.00 0.00 60.65 59.78 2jo6 s ILE 59 Cb -0.21 -3.52 -0.04 0.00 0.01 0.00 0.00 42.46 38.70 2jo6 s ILE 59 CO 0.25 -0.47 -0.10 0.00 0.00 0.00 0.00 174.94 174.62 2jo6 s ALA 60 N 1.41 2.95 0.31 9.38 0.00 0.41 -4.89 121.76 131.33 2jo6 s ALA 60 Ca 0.03 -1.24 -0.28 0.00 0.00 0.00 0.00 51.96 50.47 2jo6 s ALA 60 Cb -0.22 -0.89 -0.09 0.00 0.00 0.00 0.00 23.12 21.91 2jo6 s ALA 60 CO 0.02 0.64 1.07 -2.00 0.00 0.00 0.00 175.76 175.49 2jo6 s GLU 61 N -2.17 4.52 -0.56 0.00 2.12 -1.26 -0.66 118.70 120.68 2jo6 s GLU 61 Ca 0.21 1.70 0.05 0.00 0.36 0.00 0.00 54.97 57.29 2jo6 s GLU 61 Cb -0.11 -3.01 0.18 0.00 0.26 0.00 0.00 34.13 31.45 2jo6 s GLU 61 CO 0.13 0.13 0.46 1.58 -0.54 0.00 0.00 175.26 177.03 2jo6 n HIS 62 N 0.85 1.39 -1.52 5.30 -0.00 0.11 -4.88 115.22 116.46 2jo6 n HIS 62 Ca 0.01 -3.85 -0.18 0.00 -0.00 0.00 0.00 57.72 53.70 2jo6 n HIS 62 Cb 0.46 -0.25 -0.08 0.00 -0.00 0.00 0.00 29.99 30.12 2jo6 n HIS 62 CO 0.00 0.00 0.00 1.04 -0.00 0.00 0.00 176.34 177.38 2jo6 n GLN 63 N 2.14 -1.53 0.00 1.57 3.00 -1.26 -2.41 117.38 118.88 2jo6 n GLN 63 Ca 0.25 1.13 0.00 0.00 -0.01 0.00 0.00 57.00 58.37 2jo6 n GLN 63 Cb 0.42 -5.53 0.00 0.00 0.00 0.00 0.00 30.24 25.14 2jo6 n GLN 63 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 2jo6 n GLY 64 N -0.20 4.04 3.91 1.08 0.00 -1.26 -5.13 105.19 107.62 2jo6 n GLY 64 Ca -0.18 -0.63 -0.27 0.00 0.00 0.00 0.00 46.02 44.94 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 0.00 3.58 -0.27 1.61 8.01 -1.01 -5.07 118.70 125.55 2jo6 s GLU 65 Ca 0.00 0.15 -0.08 0.00 0.01 0.00 0.00 54.97 55.06 2jo6 s GLU 65 Cb 0.00 -2.44 -0.01 0.00 -4.31 0.00 0.00 34.13 27.36 2jo6 s GLU 65 CO 0.00 -0.09 0.09 -0.51 0.01 0.00 0.00 175.26 174.76 2jo6 s LEU 66 N -4.42 3.66 -0.12 1.80 1.43 -1.26 0.08 118.68 119.86 2jo6 s LEU 66 Ca 0.47 -0.40 -0.01 0.00 -1.03 0.00 0.00 54.13 53.15 2jo6 s LEU 66 Cb -0.10 -1.92 -0.02 0.00 0.03 0.00 0.00 46.19 44.17 2jo6 s LEU 66 CO 0.40 -0.11 -0.08 0.26 0.23 0.00 0.00 176.35 177.06 2jo6 s TRP 67 N 1.58 2.92 -0.19 0.29 0.52 0.16 -3.43 118.94 120.80 2jo6 s TRP 67 Ca 0.05 -0.29 -0.13 0.00 0.02 0.00 0.00 56.10 55.75 2jo6 s TRP 67 Cb -0.16 -1.84 -0.05 0.00 -1.15 0.00 0.00 33.47 30.28 2jo6 s TRP 67 CO 0.04 0.04 0.28 0.54 0.02 0.00 0.00 176.95 177.86 2jo6 s VAL 68 N -0.05 5.30 -0.25 4.03 0.11 0.71 -0.45 120.40 129.80 2jo6 s VAL 68 Ca -0.00 0.49 -0.04 0.00 -2.93 0.00 0.00 61.98 59.49 2jo6 s VAL 68 Cb -0.14 -3.62 0.01 0.00 -1.53 0.00 0.00 36.38 31.11 2jo6 s VAL 68 CO 0.03 0.35 -0.01 0.00 -3.33 0.00 0.00 175.10 172.14 2jo6 s ALA 69 N 0.77 2.85 -0.16 1.54 0.00 0.13 -0.89 121.76 126.00 2jo6 s ALA 69 Ca 0.15 -1.35 -0.29 0.00 0.00 0.00 0.00 51.96 50.47 2jo6 s ALA 69 Cb -0.13 -1.83 -0.00 0.00 0.00 0.00 0.00 23.12 21.15 2jo6 s ALA 69 CO 0.04 -0.70 1.00 -1.54 0.00 0.00 0.00 175.76 174.56 2jo6 s SER 70 N 1.43 7.16 0.00 0.00 1.04 0.06 -1.55 113.70 121.85 2jo6 s SER 70 Ca 0.03 1.43 0.20 0.00 0.48 0.00 0.00 55.95 58.09 2jo6 s SER 70 Cb -0.16 -2.54 1.19 0.00 0.10 0.00 0.00 66.02 64.61 2jo6 s SER 70 CO -0.02 -0.53 1.58 -0.81 0.98 0.00 0.00 173.24 174.44 2jo6 n PRO 71 N 5.53 0.63 0.32 4.02 -0.04 -1.26 -0.90 135.00 143.29 2jo6 n PRO 71 Ca 0.09 0.00 -0.13 0.00 -0.04 0.00 0.00 63.50 63.43 2jo6 n PRO 71 Cb 0.48 -1.50 -0.06 0.00 -0.04 0.00 0.00 33.50 32.38 2jo6 n PRO 71 CO 0.00 0.00 0.00 -0.07 -0.04 0.00 0.00 175.50 175.39 2jo6 h LEU 72 N 0.00 -0.72 -1.96 1.53 3.38 -1.91 -3.39 115.31 112.24 2jo6 h LEU 72 Ca 0.00 0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.99 2jo6 h LEU 72 Cb 0.00 0.18 0.00 0.00 0.09 0.00 0.00 40.66 40.93 2jo6 h LEU 72 CO 0.00 -0.39 -0.07 1.17 0.09 0.00 0.00 178.44 179.23 2jo6 n LYS 73 N -4.94 1.05 -2.93 1.13 3.00 -1.24 -5.03 118.16 109.20 2jo6 n LYS 73 Ca -0.10 -1.09 -0.03 0.00 -0.00 0.00 0.00 58.31 57.08 2jo6 n LYS 73 Cb 0.33 -0.76 0.02 0.00 0.00 0.00 0.00 35.03 34.62 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 -0.30 -1.39 -4.28 1.64 4.81 -0.08 -5.05 118.16 113.52 2jo6 n LYS 74 Ca 0.02 1.23 -0.31 0.00 -0.87 0.00 0.00 58.31 58.38 2jo6 n LYS 74 Cb 0.47 -5.32 -0.09 0.00 0.02 0.00 0.00 35.03 30.11 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 -3.32 2.48 -0.17 1.64 -1.52 -1.14 -4.91 119.66 112.72 2jo6 s GLN 75 Ca 0.11 -0.82 0.00 0.00 -1.95 0.00 0.00 55.36 52.70 2jo6 s GLN 75 Cb -0.01 -2.49 0.03 0.00 -0.22 0.00 0.00 33.01 30.32 2jo6 s GLN 75 CO 0.67 0.56 -0.12 0.50 -0.25 0.00 0.00 175.29 176.64 2jo6 s ARG 76 N -1.91 2.16 0.01 2.91 3.52 -1.26 -0.76 118.95 123.62 2jo6 s ARG 76 Ca 0.21 -0.65 0.08 0.00 -0.13 0.00 0.00 55.73 55.24 2jo6 s ARG 76 Cb -0.11 -2.20 -0.02 0.00 -1.56 0.00 0.00 34.95 31.05 2jo6 s ARG 76 CO 0.13 -0.31 -0.25 -0.06 -0.81 0.00 0.00 175.30 174.00 2jo6 s PHE 77 N 1.46 2.37 -0.78 5.12 0.40 -0.07 -2.02 117.98 124.47 2jo6 s PHE 77 Ca 0.03 -0.39 -0.20 0.00 -0.60 0.00 0.00 56.93 55.76 2jo6 s PHE 77 Cb -0.14 -1.47 0.10 0.00 0.51 0.00 0.00 43.02 42.03 2jo6 s PHE 77 CO -0.10 0.07 1.01 0.50 0.70 0.00 0.00 175.22 177.40 2jo6 s ARG 78 N -0.93 3.34 0.49 0.44 3.52 0.18 -0.21 118.95 125.79 2jo6 s ARG 78 Ca 0.11 -1.35 0.33 0.00 -0.13 0.00 0.00 55.73 54.70 2jo6 s ARG 78 Cb -0.10 -4.57 1.71 0.00 -1.56 0.00 0.00 34.95 30.43 2jo6 s ARG 78 CO 0.01 -1.76 2.01 1.37 -0.81 0.00 0.00 175.30 176.12 2jo6 h LEU 79 N 10.72 0.00 0.48 -0.88 8.10 -1.83 0.27 115.31 132.16 2jo6 h LEU 79 Ca -0.07 0.00 -0.02 0.00 0.11 0.00 0.00 57.88 57.90 2jo6 h LEU 79 Cb 1.05 0.00 0.00 0.00 -0.44 0.00 0.00 40.66 41.27 2jo6 h LEU 79 CO 1.14 0.00 -0.23 -1.28 -4.11 0.00 0.00 178.44 173.96 2jo6 h SER 80 N 0.00 -0.54 0.00 0.17 0.87 -1.90 -3.36 113.55 108.79 2jo6 h SER 80 Ca 0.00 -0.05 0.00 0.00 -1.23 0.00 0.00 61.79 60.51 2jo6 h SER 80 Cb 0.12 0.14 0.00 0.00 -0.44 0.00 0.00 62.40 62.22 2jo6 h SER 80 CO 0.00 -0.28 -0.79 -0.90 -0.53 0.00 0.00 176.83 174.33 2jo6 n ASP 81 N -5.31 1.08 0.00 6.23 5.75 -1.10 -4.86 116.55 118.34 2jo6 n ASP 81 Ca -0.11 -0.53 0.00 0.00 -0.01 0.00 0.00 54.79 54.13 2jo6 n ASP 81 Cb 0.30 1.14 0.00 0.00 -1.03 0.00 0.00 41.12 41.53 2jo6 n ASP 81 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2jo6 n GLY 82 N 1.43 0.85 3.78 6.12 0.00 0.91 -4.63 105.19 113.66 2jo6 n GLY 82 Ca 0.01 -0.13 -0.37 0.00 0.00 0.00 0.00 46.02 45.53 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 0.00 4.23 -0.02 0.99 2.96 -1.13 -3.36 118.68 122.34 2jo6 s LEU 83 Ca 0.00 1.94 -0.03 0.00 -0.22 0.00 0.00 54.13 55.82 2jo6 s LEU 83 Cb 0.00 -4.11 -0.04 0.00 0.50 0.00 0.00 46.19 42.54 2jo6 s LEU 83 CO 0.00 -0.29 0.17 0.00 -1.32 0.00 0.00 176.35 174.91 2jo6 h MET 85 N 3.97 -0.93 0.00 0.00 4.05 -1.79 -1.45 114.93 118.78 2jo6 h MET 85 Ca -0.50 0.06 0.00 0.00 -0.28 0.00 0.00 59.70 58.99 2jo6 h MET 85 Cb 1.19 0.21 0.00 0.00 -0.80 0.00 0.00 31.60 32.20 2jo6 h MET 85 CO 0.67 -0.62 -0.81 -0.85 0.23 0.00 0.00 176.91 175.53 2jo6 n GLU 86 N -4.69 0.17 -0.38 0.39 -0.00 -1.26 -3.49 120.64 111.38 2jo6 n GLU 86 Ca -0.12 0.01 0.11 0.00 -0.00 0.00 0.00 57.16 57.16 2jo6 n GLU 86 Cb 0.38 -1.57 0.31 0.00 -0.00 0.00 0.00 31.44 30.56 2jo6 n GLU 86 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.13 173.66 2jo6 n ASP 87 N -1.79 3.78 -0.28 -1.84 2.03 -1.24 -4.68 116.55 112.52 2jo6 n ASP 87 Ca 0.03 -2.06 0.26 0.00 0.52 0.00 0.00 54.79 53.54 2jo6 n ASP 87 Cb 0.39 -0.47 0.45 0.00 -0.72 0.00 0.00 41.12 40.77 2jo6 n ASP 87 CO 0.00 0.00 0.00 1.21 -1.92 0.00 0.00 177.20 176.49 2jo6 n GLU 88 N 1.43 -0.04 0.31 -0.67 2.13 -0.55 0.32 120.64 123.58 2jo6 n GLU 88 Ca 0.23 0.95 0.18 0.00 0.66 0.00 0.00 57.16 59.18 2jo6 n GLU 88 Cb 0.62 -1.78 1.03 0.00 0.27 0.00 0.00 31.44 31.57 2jo6 n GLU 88 CO 0.00 0.00 0.00 -0.56 -0.41 0.00 0.00 177.13 176.16 2jo6 h GLN 89 N 0.00 0.00 0.00 5.31 -0.00 -1.86 -3.39 115.11 115.17 2jo6 h GLN 89 Ca 0.62 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 59.27 2jo6 h GLN 89 Cb 1.81 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 29.29 2jo6 h GLN 89 CO -0.45 0.00 0.00 0.34 -0.00 0.00 0.00 178.83 178.72 2jo6 n PHE 90 N -3.52 -0.74 -0.78 0.06 7.35 0.15 -5.16 117.46 114.81 2jo6 n PHE 90 Ca -0.03 0.13 0.11 0.00 -0.76 0.00 0.00 57.45 56.90 2jo6 n PHE 90 Cb 0.11 0.33 -0.03 0.00 0.35 0.00 0.00 39.48 40.24 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 -2.96 -4.64 -4.34 -2.13 7.64 -0.56 -4.92 113.62 101.70 2jo6 n SER 91 Ca 0.00 0.31 -0.22 0.00 1.01 0.00 0.00 58.87 59.97 2jo6 n SER 91 Cb 0.00 -2.37 0.12 0.00 -1.01 0.00 0.00 64.21 60.95 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 -2.77 0.00 -3.17 0.44 0.24 -1.21 -4.97 118.33 106.89 2jo6 n VAL 92 Ca 0.01 -1.43 -0.40 0.00 -2.04 0.00 0.00 64.34 60.48 2jo6 n VAL 92 Cb 0.36 -0.98 -0.06 0.00 -1.47 0.00 0.00 33.84 31.69 2jo6 n VAL 92 CO 0.00 0.00 0.00 -0.75 -2.14 0.00 0.00 176.83 173.94 2jo6 s LYS 93 N -5.03 4.23 0.01 7.34 2.20 -1.26 -4.81 119.74 122.41 2jo6 s LYS 93 Ca 0.63 0.55 -0.19 0.00 -0.36 0.00 0.00 55.97 56.61 2jo6 s LYS 93 Cb -0.03 -3.55 -0.06 0.00 -1.51 0.00 0.00 37.83 32.68 2jo6 s LYS 93 CO 0.42 -0.15 0.54 -1.58 -0.36 0.00 0.00 175.35 174.23 2jo6 s HIS 94 N 1.62 3.71 -0.11 4.03 5.65 -1.26 -1.86 115.29 127.07 2jo6 s HIS 94 Ca 0.28 1.15 -0.01 0.00 0.25 0.00 0.00 55.06 56.73 2jo6 s HIS 94 Cb -0.16 -2.52 -0.03 0.00 -1.18 0.00 0.00 32.58 28.69 2jo6 s HIS 94 CO 0.11 0.45 -0.05 0.71 -0.65 0.00 0.00 174.74 175.30 2jo6 s TYR 95 N -0.51 3.00 -0.19 3.88 1.51 -0.29 -4.99 117.35 119.77 2jo6 s TYR 95 Ca 0.29 -0.10 -0.29 0.00 -1.01 0.00 0.00 57.07 55.95 2jo6 s TYR 95 Cb -0.18 -1.82 -0.00 0.00 -0.11 0.00 0.00 41.96 39.84 2jo6 s TYR 95 CO 0.16 0.19 1.15 -1.21 -1.11 0.00 0.00 175.55 174.74 2jo6 s GLU 96 N -0.32 4.26 0.06 -0.62 0.41 -0.85 -3.97 118.70 117.67 2jo6 s GLU 96 Ca 0.05 1.52 0.07 0.00 -0.41 0.00 0.00 54.97 56.20 2jo6 s GLU 96 Cb -0.12 -3.69 -0.03 0.00 -1.78 0.00 0.00 34.13 28.50 2jo6 s GLU 96 CO 0.02 -0.65 -0.17 0.00 -0.49 0.00 0.00 175.26 173.97 2jo6 s ALA 97 N 3.27 2.65 0.06 5.21 0.00 -1.26 0.14 121.76 131.83 2jo6 s ALA 97 Ca 0.50 -1.22 -0.14 0.00 0.00 0.00 0.00 51.96 51.11 2jo6 s ALA 97 Cb -0.19 -0.75 0.02 0.00 0.00 0.00 0.00 23.12 22.20 2jo6 s ALA 97 CO 0.11 0.58 0.31 -0.98 0.00 0.00 0.00 175.76 175.78 2jo6 s ARG 98 N -1.61 0.86 -0.50 0.00 1.70 -0.59 -4.96 118.95 113.86 2jo6 s ARG 98 Ca 0.16 -0.60 -0.12 0.00 -0.47 0.00 0.00 55.73 54.70 2jo6 s ARG 98 Cb -0.11 0.37 0.12 0.00 -0.57 0.00 0.00 34.95 34.77 2jo6 s ARG 98 CO 0.07 -0.29 0.41 0.08 -1.08 0.00 0.00 175.30 174.49 2jo6 s VAL 99 N -2.95 4.59 -0.51 4.99 1.01 -1.26 -0.79 120.40 125.47 2jo6 s VAL 99 Ca -0.02 -1.70 -0.19 0.00 0.00 0.00 0.00 61.98 60.07 2jo6 s VAL 99 Cb 0.00 -3.99 0.06 0.00 0.00 0.00 0.00 36.38 32.46 2jo6 s VAL 99 CO -0.06 -0.81 0.64 -0.75 0.00 0.00 0.00 175.10 174.12 2jo6 s LYS 100 N 1.43 3.12 -0.19 2.72 2.20 0.91 -4.26 119.74 125.67 2jo6 s LYS 100 Ca 0.05 -0.90 0.00 0.00 -0.36 0.00 0.00 55.97 54.76 2jo6 s LYS 100 Cb -0.27 -4.11 0.00 0.00 -1.51 0.00 0.00 37.83 31.94 2jo6 s LYS 100 CO 0.01 -1.25 0.00 -3.47 -0.36 0.00 0.00 175.35 170.28 2jo6 n ASP 101 N 6.22 -5.49 0.00 1.43 2.03 -1.26 -0.34 116.55 119.13 2jo6 n ASP 101 Ca -0.06 0.04 0.00 0.00 0.52 0.00 0.00 54.79 55.29 2jo6 n ASP 101 Cb 0.45 -3.15 0.00 0.00 -0.72 0.00 0.00 41.12 37.71 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 0.25 0.86 3.69 0.27 0.00 -1.26 -5.06 105.19 103.93 2jo6 n GLY 102 Ca -0.02 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.65 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 5.06 -0.23 1.61 1.01 0.53 0.33 120.40 126.71 2jo6 s VAL 103 Ca 0.00 0.06 -0.29 0.00 0.00 0.00 0.00 61.98 61.75 2jo6 s VAL 103 Cb 0.00 -3.28 -0.00 0.00 0.00 0.00 0.00 36.38 33.09 2jo6 s VAL 103 CO 0.00 0.47 1.22 -0.69 0.00 0.00 0.00 175.10 176.10 2jo6 s VAL 104 N 0.23 4.32 -0.10 2.92 1.01 0.11 -0.06 120.40 128.84 2jo6 s VAL 104 Ca 0.06 1.56 0.01 0.00 0.00 0.00 0.00 61.98 63.61 2jo6 s VAL 104 Cb -0.12 -4.14 -0.02 0.00 0.00 0.00 0.00 36.38 32.10 2jo6 s VAL 104 CO -0.00 -0.29 -0.13 -1.10 0.00 0.00 0.00 175.10 173.57 2jo6 s GLN 105 N 3.68 3.04 -0.19 2.72 -0.21 0.03 -0.38 119.66 128.35 2jo6 s GLN 105 Ca 0.52 -0.69 -0.01 0.00 0.02 0.00 0.00 55.36 55.21 2jo6 s GLN 105 Cb -0.18 -2.53 0.01 0.00 1.00 0.00 0.00 33.01 31.31 2jo6 s GLN 105 CO 0.16 0.38 -0.15 -0.51 -2.12 0.00 0.00 175.29 173.05 2jo6 s LEU 106 N -0.07 2.38 -0.31 2.90 1.43 -0.31 -1.53 118.68 123.16 2jo6 s LEU 106 Ca -0.02 -0.57 -0.19 0.00 -1.03 0.00 0.00 54.13 52.32 2jo6 s LEU 106 Cb -0.14 -1.56 -0.01 0.00 0.03 0.00 0.00 46.19 44.51 2jo6 s LEU 106 CO 0.04 -0.01 0.58 -0.60 0.23 0.00 0.00 176.35 176.59 2jo6 s ARG 107 N 1.35 3.86 0.00 1.70 3.52 0.12 -0.46 118.95 129.04 2jo6 s ARG 107 Ca 0.05 0.18 0.00 0.00 -0.13 0.00 0.00 55.73 55.83 2jo6 s ARG 107 Cb -0.13 -3.74 0.00 0.00 -1.56 0.00 0.00 34.95 29.52 2jo6 s ARG 107 CO -0.10 -0.55 0.00 0.41 -0.81 0.00 0.00 175.30 174.25 2jo6 n GLY 108 N 4.53 -2.07 0.00 8.12 0.00 -1.19 -2.00 105.19 112.57 2jo6 n GLY 108 Ca -0.03 -1.18 0.00 0.00 0.00 0.00 0.00 46.02 44.81 2jo6 n GLY 108 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jo6 n GLY 109 N -0.50 3.16 0.45 -0.02 0.00 -1.26 -4.85 105.19 102.17 2jo6 n GLY 109 Ca 0.00 -0.60 0.06 0.00 0.00 0.00 0.00 46.02 45.48 2jo6 n GLY 109 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76