#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jrk s LYS 7 N 0.00 0.50 -0.19 1.97 2.20 -1.26 -5.19 119.74 117.77 2jrk s LYS 7 Ca 0.00 0.61 -0.25 0.00 -0.36 0.00 0.00 55.97 55.97 2jrk s LYS 7 Cb 0.00 0.23 0.07 0.00 -1.51 0.00 0.00 37.83 36.62 2jrk s LYS 7 CO 0.00 -0.06 0.66 0.16 -0.36 0.00 0.00 175.35 175.75 2jrk s ASP 8 N 0.32 -0.67 0.25 1.43 -4.77 -1.26 -5.19 116.67 106.78 2jrk s ASP 8 Ca 0.02 1.14 -0.21 0.00 -3.30 0.00 0.00 52.55 50.20 2jrk s ASP 8 Cb -0.05 1.12 0.05 0.00 -1.09 0.00 0.00 42.92 42.95 2jrk s ASP 8 CO -0.07 -0.34 0.87 1.51 0.70 0.00 0.00 175.17 177.84 2jrk s ASP 9 N -0.12 -0.12 0.25 2.11 1.47 -1.26 -5.21 116.67 113.78 2jrk s ASP 9 Ca -0.03 -0.68 -0.02 0.00 1.18 0.00 0.00 52.55 52.99 2jrk s ASP 9 Cb -0.03 0.64 0.01 0.00 -0.34 0.00 0.00 42.92 43.20 2jrk s ASP 9 CO 0.04 -1.23 0.36 2.22 0.68 0.00 0.00 175.17 177.24 2jrk n PHE 10 N -0.52 -1.24 -1.58 2.11 -1.74 -1.26 -5.15 117.46 108.08 2jrk n PHE 10 Ca -0.05 -1.59 -0.42 0.00 -0.56 0.00 0.00 57.45 54.83 2jrk n PHE 10 Cb 0.60 0.41 0.01 0.00 1.52 0.00 0.00 39.48 42.02 2jrk n PHE 10 CO 0.00 0.00 0.00 0.54 -0.56 0.00 0.00 176.76 176.74 2jrk n ARG 11 N -0.40 1.20 -3.23 3.97 3.00 -1.26 -5.03 116.66 114.92 2jrk n ARG 11 Ca -0.00 0.43 -0.20 0.00 -0.01 0.00 0.00 57.85 58.06 2jrk n ARG 11 Cb 0.41 -1.91 0.00 0.00 0.00 0.00 0.00 32.46 30.96 2jrk n ARG 11 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.63 178.17 2jrk s ASN 12 N -0.75 5.87 0.77 0.55 4.22 -1.26 -5.12 114.94 119.23 2jrk s ASN 12 Ca 0.62 -0.02 -0.11 0.00 -2.14 0.00 0.00 52.86 51.21 2jrk s ASN 12 Cb -0.59 -1.29 0.06 0.00 1.28 0.00 0.00 41.25 40.71 2jrk s ASN 12 CO 0.57 -0.59 1.10 -1.61 -2.04 0.00 0.00 177.10 174.54 2jrk s GLU 13 N -4.35 2.18 0.56 3.55 2.02 -1.26 -5.07 118.70 116.33 2jrk s GLU 13 Ca 0.47 1.24 -0.08 0.00 0.02 0.00 0.00 54.97 56.62 2jrk s GLU 13 Cb -0.10 -1.88 -0.03 0.00 0.10 0.00 0.00 34.13 32.22 2jrk s GLU 13 CO 0.34 -1.71 0.91 0.12 0.02 0.00 0.00 175.26 174.94 2jrk s PHE 14 N -2.80 3.56 0.13 1.61 5.36 -1.26 -5.12 117.98 119.46 2jrk s PHE 14 Ca 0.63 1.02 -0.04 0.00 -0.96 0.00 0.00 56.93 57.57 2jrk s PHE 14 Cb -0.18 -2.54 -0.03 0.00 -0.34 0.00 0.00 43.02 39.93 2jrk s PHE 14 CO 0.54 -0.53 0.13 -0.51 -1.46 0.00 0.00 175.22 173.40 2jrk s ASP 15 N -4.16 0.23 -0.09 6.13 1.01 -1.26 -5.08 116.67 113.45 2jrk s ASP 15 Ca 0.51 -1.05 -0.03 0.00 0.71 0.00 0.00 52.55 52.69 2jrk s ASP 15 Cb -0.11 0.34 0.01 0.00 1.01 0.00 0.00 42.92 44.17 2jrk s ASP 15 CO 0.49 -0.77 0.06 1.57 0.21 0.00 0.00 175.17 176.73 2jrk n HIS 16 N -0.11 -1.64 -4.13 4.23 -0.00 -1.26 -5.10 115.22 107.21 2jrk n HIS 16 Ca -0.07 0.88 -0.25 0.00 0.46 0.00 0.00 57.72 58.74 2jrk n HIS 16 Cb 0.63 -2.43 -0.06 0.00 -0.12 0.00 0.00 29.99 28.01 2jrk n HIS 16 CO 0.00 0.00 0.00 -0.51 0.46 0.00 0.00 176.34 176.29 2jrk s LEU 17 N -0.38 3.69 1.10 0.27 1.02 -1.26 -5.14 118.68 117.99 2jrk s LEU 17 Ca -0.07 -0.24 -0.18 0.00 0.02 0.00 0.00 54.13 53.66 2jrk s LEU 17 Cb 0.00 -2.28 0.25 0.00 0.02 0.00 0.00 46.19 44.19 2jrk s LEU 17 CO 0.30 0.03 1.19 -0.22 0.02 0.00 0.00 176.35 177.67 2jrk s LEU 18 N -3.35 1.50 0.51 1.79 2.96 -1.26 -4.97 118.68 115.85 2jrk s LEU 18 Ca 0.31 0.51 0.17 0.00 -0.22 0.00 0.00 54.13 54.90 2jrk s LEU 18 Cb -0.09 -2.38 1.25 0.00 0.50 0.00 0.00 46.19 45.47 2jrk s LEU 18 CO 0.23 -3.55 2.10 -0.29 -1.32 0.00 0.00 176.35 173.52 2jrk h ILE 19 N -2.19 0.95 -3.50 6.68 2.10 -2.04 -3.29 117.51 116.21 2jrk h ILE 19 Ca -0.45 -0.02 -0.78 0.00 1.08 0.00 0.00 64.86 64.69 2jrk h ILE 19 Cb 1.27 0.87 -0.25 0.00 -1.09 0.00 0.00 36.82 37.63 2jrk h ILE 19 CO 0.37 0.01 -0.03 -1.61 -1.08 0.00 0.00 178.15 175.81 2jrk s GLU 20 N -5.11 3.34 0.54 2.19 8.01 -1.26 -4.92 118.70 121.49 2jrk s GLU 20 Ca -0.05 -2.14 0.22 0.00 0.01 0.00 0.00 54.97 53.01 2jrk s GLU 20 Cb 0.18 -4.38 1.41 0.00 -4.31 0.00 0.00 34.13 27.03 2jrk s GLU 20 CO 0.69 -1.31 2.09 0.37 0.01 0.00 0.00 175.26 177.11 2jrk h GLN 21 N 8.26 0.00 0.54 1.61 4.15 -1.90 0.01 115.11 127.78 2jrk h GLN 21 Ca -0.07 0.00 -0.03 0.00 0.77 0.00 0.00 58.65 59.33 2jrk h GLN 21 Cb 1.07 0.00 0.01 0.00 0.21 0.00 0.00 27.48 28.76 2jrk h GLN 21 CO 0.88 0.00 -0.26 0.00 -1.93 0.00 0.00 178.83 177.51 2jrk h ALA 22 N 1.87 -0.73 -0.45 3.38 0.00 -1.92 -0.97 119.26 120.44 2jrk h ALA 22 Ca 0.10 -0.19 -0.14 0.00 0.00 0.00 0.00 54.91 54.68 2jrk h ALA 22 Cb 0.44 0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.50 2jrk h ALA 22 CO -0.00 -0.81 -0.28 -0.97 0.00 0.00 0.00 179.25 177.19 2jrk h ASN 23 N -0.93 1.01 -0.24 0.00 -1.24 -1.86 -2.46 115.58 109.87 2jrk h ASN 23 Ca -0.07 -0.41 0.00 0.00 0.71 0.00 0.00 56.30 56.53 2jrk h ASN 23 Cb 0.63 -0.28 -0.01 0.00 0.73 0.00 0.00 38.32 39.39 2jrk h ASN 23 CO 0.12 1.21 0.16 -0.74 -1.29 0.00 0.00 177.43 176.89 2jrk h HIS 24 N 0.82 0.30 0.21 0.67 2.76 -1.06 0.22 115.15 119.07 2jrk h HIS 24 Ca 0.09 0.01 -0.01 0.00 -2.20 0.00 0.00 60.37 58.26 2jrk h HIS 24 Cb 0.86 -0.10 0.00 0.00 1.55 0.00 0.00 27.41 29.72 2jrk h HIS 24 CO 0.06 0.19 -0.10 0.00 -1.30 0.00 0.00 177.93 176.77 2jrk h ALA 25 N 1.85 -0.28 -0.16 5.26 0.00 -0.69 0.78 119.26 126.03 2jrk h ALA 25 Ca 0.09 -0.13 -0.17 0.00 0.00 0.00 0.00 54.91 54.69 2jrk h ALA 25 Cb -0.04 0.11 -0.00 0.00 0.00 0.00 0.00 17.79 17.86 2jrk h ALA 25 CO -0.02 -0.56 -0.61 -0.84 0.00 0.00 0.00 179.25 177.22 2jrk h ILE 26 N -0.47 1.33 -0.06 0.00 -0.00 -1.37 0.15 117.51 117.09 2jrk h ILE 26 Ca -0.03 -1.89 -0.02 0.00 -0.00 0.00 0.00 64.86 62.92 2jrk h ILE 26 Cb 0.36 1.87 -0.00 0.00 -0.00 0.00 0.00 36.82 39.04 2jrk h ILE 26 CO 0.05 0.58 -0.02 -0.08 -0.00 0.00 0.00 178.15 178.68 2jrk h GLU 27 N 0.40 0.13 0.09 0.16 4.81 -0.49 0.14 114.58 119.82 2jrk h GLU 27 Ca -0.01 -0.05 -0.26 0.00 -0.13 0.00 0.00 59.36 58.91 2jrk h GLU 27 Cb 1.17 -0.01 -0.00 0.00 0.63 0.00 0.00 28.75 30.54 2jrk h GLU 27 CO 0.11 0.48 -1.19 0.87 -0.73 0.00 0.00 179.01 178.56 2jrk h LYS 28 N -0.23 0.20 0.19 1.92 1.79 -0.96 -2.93 116.57 116.55 2jrk h LYS 28 Ca 0.02 -0.34 -0.01 0.00 -2.18 0.00 0.00 60.65 58.14 2jrk h LYS 28 Cb 0.44 0.13 0.00 0.00 -1.58 0.00 0.00 32.23 31.22 2jrk h LYS 28 CO 0.01 1.16 -0.09 0.78 -1.08 0.00 0.00 179.45 180.22 2jrk h GLY 29 N 1.97 -0.27 1.10 3.86 0.00 -0.64 0.17 103.07 109.26 2jrk h GLY 29 Ca -0.11 0.10 -0.10 0.00 0.00 0.00 0.00 47.33 47.23 2jrk h GLY 29 CO 0.18 -0.10 0.00 0.83 0.00 0.00 0.00 176.54 177.46 2jrk h GLU 30 N -0.38 1.07 -0.30 4.80 4.39 -0.88 0.17 114.58 123.45 2jrk h GLU 30 Ca -0.03 -0.34 -0.01 0.00 0.34 0.00 0.00 59.36 59.33 2jrk h GLU 30 Cb 0.30 -0.10 -0.01 0.00 -0.10 0.00 0.00 28.75 28.83 2jrk h GLU 30 CO 0.04 1.04 0.15 0.45 -1.16 0.00 0.00 179.01 179.54 2jrk h HIS 31 N 0.98 0.42 0.00 4.33 3.86 -1.49 -2.54 115.15 120.70 2jrk h HIS 31 Ca 0.17 -0.02 0.00 0.00 -1.16 0.00 0.00 60.37 59.37 2jrk h HIS 31 Cb 0.56 -0.13 0.00 0.00 1.06 0.00 0.00 27.41 28.90 2jrk h HIS 31 CO 0.04 0.36 0.00 1.96 0.86 0.00 0.00 177.93 181.15 2jrk h GLN 32 N 0.35 0.00 -0.58 2.45 4.20 -0.42 -2.88 115.11 118.23 2jrk h GLN 32 Ca 0.10 0.00 -0.10 0.00 0.06 0.00 0.00 58.65 58.71 2jrk h GLN 32 Cb 0.09 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 27.85 2jrk h GLN 32 CO -0.01 0.00 -0.03 1.25 -0.67 0.00 0.00 178.83 179.36 2jrk h LEU 33 N 0.00 1.01 -0.67 1.46 5.85 -0.22 0.38 115.31 123.12 2jrk h LEU 33 Ca 0.00 -0.30 -0.05 0.00 0.84 0.00 0.00 57.88 58.37 2jrk h LEU 33 Cb 0.43 -0.27 -0.03 0.00 0.37 0.00 0.00 40.66 41.16 2jrk h LEU 33 CO 0.00 1.08 0.22 0.25 -0.34 0.00 0.00 178.44 179.65 2jrk h LEU 34 N 0.94 0.96 -1.27 2.25 6.46 -1.41 -2.91 115.31 120.33 2jrk h LEU 34 Ca 0.16 -0.20 -0.07 0.00 -0.12 0.00 0.00 57.88 57.65 2jrk h LEU 34 Cb 0.58 -0.25 -0.01 0.00 -0.73 0.00 0.00 40.66 40.25 2jrk h LEU 34 CO 0.03 0.91 -0.33 1.88 -0.62 0.00 0.00 178.44 180.31 2jrk h TYR 35 N 0.97 0.06 0.00 1.25 0.05 -1.22 -3.08 116.97 115.00 2jrk h TYR 35 Ca 0.22 -0.01 -0.03 0.00 0.05 0.00 0.00 58.73 58.96 2jrk h TYR 35 Cb 0.28 -0.02 -0.00 0.00 1.01 0.00 0.00 36.73 38.00 2jrk h TYR 35 CO 0.02 0.38 -0.14 1.25 -1.05 0.00 0.00 178.16 178.63 2jrk h LEU 36 N 0.05 0.00 -2.35 3.88 6.46 -0.05 -0.49 115.31 122.82 2jrk h LEU 36 Ca 0.01 0.00 0.00 0.00 -0.12 0.00 0.00 57.88 57.77 2jrk h LEU 36 Cb 0.61 0.00 -0.00 0.00 -0.73 0.00 0.00 40.66 40.54 2jrk h LEU 36 CO 0.04 0.14 0.22 1.56 -0.62 0.00 0.00 178.44 179.78 2jrk h GLN 37 N 0.00 0.00 0.00 1.25 4.20 -1.52 -0.34 115.11 118.70 2jrk h GLN 37 Ca -0.00 0.00 -0.14 0.00 0.06 0.00 0.00 58.65 58.57 2jrk h GLN 37 Cb 0.29 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.05 2jrk h GLN 37 CO 0.02 0.00 -0.88 0.45 -0.67 0.00 0.00 178.83 177.75 2jrk h HIS 38 N 0.00 0.00 0.00 2.96 3.86 -1.27 -3.29 115.15 117.41 2jrk h HIS 38 Ca 0.01 0.00 -0.06 0.00 -1.16 0.00 0.00 60.37 59.16 2jrk h HIS 38 Cb 0.44 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.90 2jrk h HIS 38 CO 0.00 0.58 -0.28 1.96 0.86 0.00 0.00 177.93 181.05 2jrk h GLN 39 N 0.00 0.00 -0.95 2.45 4.20 -1.16 -2.34 115.11 117.31 2jrk h GLN 39 Ca -0.06 0.00 0.11 0.00 0.06 0.00 0.00 58.65 58.76 2jrk h GLN 39 Cb 1.50 0.00 -0.08 0.00 0.30 0.00 0.00 27.48 29.20 2jrk h GLN 39 CO 0.06 0.28 0.61 -0.07 -0.67 0.00 0.00 178.83 179.04 2jrk h LEU 40 N 0.00 0.85 -0.38 1.46 -0.00 -1.60 -1.45 115.31 114.20 2jrk h LEU 40 Ca -0.00 0.04 -0.11 0.00 -0.00 0.00 0.00 57.88 57.81 2jrk h LEU 40 Cb 0.62 -0.14 -0.01 0.00 -0.00 0.00 0.00 40.66 41.13 2jrk h LEU 40 CO 0.04 0.47 -0.18 -0.78 -0.00 0.00 0.00 178.44 177.98 2jrk h ASP 41 N 0.92 0.82 -0.65 -0.43 1.82 -1.58 0.79 116.42 118.11 2jrk h ASP 41 Ca 0.46 -0.40 0.07 0.00 -0.39 0.00 0.00 57.03 56.76 2jrk h ASP 41 Cb 0.49 -0.23 -0.04 0.00 0.68 0.00 0.00 39.33 40.23 2jrk h ASP 41 CO -0.22 1.04 0.43 1.05 -1.61 0.00 0.00 179.24 179.93 2jrk h GLU 42 N 0.59 0.61 0.13 0.28 4.11 -1.18 -2.00 114.58 117.12 2jrk h GLU 42 Ca 0.08 -0.04 -0.30 0.00 0.07 0.00 0.00 59.36 59.18 2jrk h GLU 42 Cb 0.73 -0.14 -0.00 0.00 0.50 0.00 0.00 28.75 29.84 2jrk h GLU 42 CO 0.06 0.40 -1.47 1.25 0.07 0.00 0.00 179.01 179.32 2jrk h LEU 43 N 0.63 0.43 -1.92 3.06 7.12 -1.25 -3.34 115.31 120.04 2jrk h LEU 43 Ca 0.28 -0.55 0.13 0.00 0.13 0.00 0.00 57.88 57.87 2jrk h LEU 43 Cb 0.31 -0.14 -0.02 0.00 -0.53 0.00 0.00 40.66 40.28 2jrk h LEU 43 CO -0.09 1.45 0.35 -1.13 -0.13 0.00 0.00 178.44 178.89 2jrk h ASN 44 N 0.07 0.08 0.68 1.25 -1.24 -0.09 0.18 115.58 116.52 2jrk h ASN 44 Ca -0.22 0.00 -0.02 0.00 0.71 0.00 0.00 56.30 56.77 2jrk h ASN 44 Cb 2.02 -0.01 -0.00 0.00 0.73 0.00 0.00 38.32 41.05 2jrk h ASN 44 CO 0.18 0.05 -0.09 -0.33 -1.29 0.00 0.00 177.43 175.94 2jrk h GLU 45 N 0.09 0.00 0.05 6.67 4.39 -1.60 -1.82 114.58 122.37 2jrk h GLU 45 Ca 0.23 0.00 -0.36 0.00 0.34 0.00 0.00 59.36 59.57 2jrk h GLU 45 Cb 0.81 0.00 -0.04 0.00 -0.10 0.00 0.00 28.75 29.42 2jrk h GLU 45 CO -0.02 0.09 -2.07 -1.71 -1.16 0.00 0.00 179.01 174.14 2jrk n ASN 46 N -3.32 2.02 -1.31 1.42 5.15 0.52 -4.43 115.26 115.32 2jrk n ASN 46 Ca -0.01 0.17 0.04 0.00 -0.60 0.00 0.00 54.58 54.18 2jrk n ASN 46 Cb 0.29 -0.75 0.24 0.00 -0.53 0.00 0.00 39.78 39.02 2jrk n ASN 46 CO 0.00 0.00 0.00 2.29 1.40 0.00 0.00 177.26 180.95 2jrk n LYS 47 N -3.68 3.26 -1.50 1.20 -0.00 -0.47 -4.94 118.16 112.03 2jrk n LYS 47 Ca -0.39 -1.86 -0.12 0.00 -0.00 0.00 0.00 58.31 55.94 2jrk n LYS 47 Cb 0.95 -1.93 -0.10 0.00 -0.00 0.00 0.00 35.03 33.95 2jrk n LYS 47 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.40 176.27 2jrk n SER 48 N 0.39 0.85 0.01 -5.58 3.41 -0.68 -4.45 113.62 107.57 2jrk n SER 48 Ca 0.16 -2.33 0.00 0.00 -0.26 0.00 0.00 58.87 56.45 2jrk n SER 48 Cb 0.79 -1.58 0.00 0.00 -0.26 0.00 0.00 64.21 63.17 2jrk n SER 48 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2jrk n LYS 49 N 7.63 0.00 0.08 4.33 4.76 -1.26 -5.04 118.16 128.65 2jrk n LYS 49 Ca 0.35 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.79 2jrk n LYS 49 Cb 0.47 -0.03 0.00 0.00 -1.84 0.00 0.00 35.03 33.64 2jrk n LYS 49 CO 0.00 0.00 0.00 0.39 -1.37 0.00 0.00 177.40 176.42 2jrk n GLU 50 N -2.63 0.00 0.00 1.97 -0.58 -1.26 -4.90 120.64 113.24 2jrk n GLU 50 Ca 0.00 0.00 0.04 0.00 -0.42 0.00 0.00 57.16 56.78 2jrk n GLU 50 Cb 0.00 0.00 0.23 0.00 -0.57 0.00 0.00 31.44 31.10 2jrk n GLU 50 CO 0.00 0.00 0.00 1.28 -0.48 0.00 0.00 177.13 177.93 2jrk n LEU 51 N -2.97 0.00 -0.00 -4.62 4.32 -1.26 -4.08 117.00 108.40 2jrk n LEU 51 Ca 0.00 0.00 0.23 0.00 -0.02 0.00 0.00 56.01 56.22 2jrk n LEU 51 Cb 0.00 0.00 0.73 0.00 -1.62 0.00 0.00 43.42 42.53 2jrk n LEU 51 CO 0.00 0.00 1.20 0.06 -1.22 0.00 0.00 177.39 177.43 2jrk h GLN 52 N 0.00 0.00 -0.11 3.23 3.07 -1.90 0.83 115.11 120.22 2jrk h GLN 52 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.74 2jrk h GLN 52 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.56 2jrk h GLN 52 CO 0.00 0.00 0.00 -0.85 0.09 0.00 0.00 178.83 178.07 2jrk n GLU 53 N -3.95 2.73 0.00 0.06 0.28 -1.26 -4.60 120.64 113.90 2jrk n GLU 53 Ca 0.11 -1.89 0.00 0.00 -0.16 0.00 0.00 57.16 55.22 2jrk n GLU 53 Cb 0.73 -1.20 0.00 0.00 1.43 0.00 0.00 31.44 32.40 2jrk n GLU 53 CO 0.00 0.00 0.00 1.63 -0.16 0.00 0.00 177.13 178.60 2jrk n LYS 54 N -0.35 0.00 0.16 3.44 4.76 -0.01 -4.49 118.16 121.68 2jrk n LYS 54 Ca 0.07 0.00 0.03 0.00 -2.87 0.00 0.00 58.31 55.53 2jrk n LYS 54 Cb 0.40 -0.60 0.24 0.00 -1.84 0.00 0.00 35.03 33.22 2jrk n LYS 54 CO 0.00 0.00 0.00 0.97 -1.37 0.00 0.00 177.40 177.00 2jrk h ILE 55 N 0.00 1.10 -1.00 -0.18 6.09 -1.24 -0.84 117.51 121.44 2jrk h ILE 55 Ca 0.00 -1.86 0.15 0.00 -1.37 0.00 0.00 64.86 61.77 2jrk h ILE 55 Cb 0.95 2.08 -0.09 0.00 0.47 0.00 0.00 36.82 40.23 2jrk h ILE 55 CO 0.00 0.48 0.62 -0.29 -3.07 0.00 0.00 178.15 175.90 2jrk h ILE 56 N 0.00 0.84 0.09 2.19 2.10 -1.82 0.15 117.51 121.06 2jrk h ILE 56 Ca -0.00 -0.31 -0.29 0.00 1.08 0.00 0.00 64.86 65.34 2jrk h ILE 56 Cb 1.04 -0.14 0.02 0.00 -1.09 0.00 0.00 36.82 36.66 2jrk h ILE 56 CO 0.06 0.16 -1.19 0.03 -1.08 0.00 0.00 178.15 176.14 2jrk h ARG 57 N 0.90 0.60 -0.17 2.19 2.47 -1.51 -1.88 114.38 116.97 2jrk h ARG 57 Ca 0.53 -0.77 -0.08 0.00 -1.26 0.00 0.00 59.98 58.39 2jrk h ARG 57 Cb 0.65 0.25 -0.00 0.00 -1.65 0.00 0.00 29.97 29.22 2jrk h ARG 57 CO -0.30 1.34 -0.21 0.93 0.56 0.00 0.00 179.97 182.28 2jrk h GLU 58 N 0.28 0.45 -0.64 0.04 5.08 -0.98 0.11 114.58 118.92 2jrk h GLU 58 Ca -0.17 -0.25 -0.09 0.00 -1.00 0.00 0.00 59.36 57.85 2jrk h GLU 58 Cb 1.86 0.02 -0.02 0.00 0.50 0.00 0.00 28.75 31.10 2jrk h GLU 58 CO 0.23 0.83 0.05 1.25 -1.00 0.00 0.00 179.01 180.37 2jrk h LEU 59 N 0.09 1.05 -0.69 1.33 6.46 -0.84 -1.26 115.31 121.45 2jrk h LEU 59 Ca 0.02 -0.27 0.05 0.00 -0.12 0.00 0.00 57.88 57.55 2jrk h LEU 59 Cb 0.77 -0.28 -0.05 0.00 -0.73 0.00 0.00 40.66 40.37 2jrk h LEU 59 CO 0.05 1.07 0.41 -0.78 -0.62 0.00 0.00 178.44 178.57 2jrk h ASP 60 N 1.00 0.65 -0.44 1.25 3.58 -1.31 0.17 116.42 121.31 2jrk h ASP 60 Ca 0.19 0.02 0.03 0.00 0.42 0.00 0.00 57.03 57.69 2jrk h ASP 60 Cb 0.50 -0.12 -0.04 0.00 1.72 0.00 0.00 39.33 41.40 2jrk h ASP 60 CO 0.02 0.43 0.23 0.58 -2.88 0.00 0.00 179.24 177.62 2jrk h VAL 61 N 0.78 0.98 0.00 2.25 2.07 -0.27 0.13 116.25 122.20 2jrk h VAL 61 Ca 0.30 -0.16 -0.19 0.00 0.82 0.00 0.00 66.70 67.47 2jrk h VAL 61 Cb 0.11 0.48 -0.02 0.00 -1.52 0.00 0.00 31.29 30.34 2jrk h VAL 61 CO -0.15 0.08 -0.87 1.62 0.02 0.00 0.00 177.57 178.27 2jrk h VAL 62 N 0.46 1.60 0.17 2.57 3.04 -1.06 -1.86 116.25 121.17 2jrk h VAL 62 Ca 0.19 -2.91 -0.01 0.00 -1.01 0.00 0.00 66.70 62.96 2jrk h VAL 62 Cb 0.08 2.59 0.00 0.00 -2.01 0.00 0.00 31.29 31.95 2jrk h VAL 62 CO -0.12 0.83 -0.08 0.00 -1.01 0.00 0.00 177.57 177.19 2jrk h ALA 64 N 0.35 1.30 -0.14 0.00 0.00 -0.81 0.35 119.26 120.31 2jrk h ALA 64 Ca -0.02 -0.29 -0.03 0.00 0.00 0.00 0.00 54.91 54.57 2jrk h ALA 64 Cb 0.34 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.03 2jrk h ALA 64 CO 0.04 0.47 -0.05 1.98 0.00 0.00 0.00 179.25 181.69 2jrk h MET 65 N 0.30 0.27 -0.15 0.00 4.05 -1.26 -1.82 114.93 116.31 2jrk h MET 65 Ca 0.05 -0.11 -0.11 0.00 -0.28 0.00 0.00 59.70 59.25 2jrk h MET 65 Cb 0.54 -0.01 -0.01 0.00 -0.80 0.00 0.00 31.60 31.32 2jrk h MET 65 CO 0.04 0.58 -0.38 0.97 0.23 0.00 0.00 176.91 178.34 2jrk h ILE 66 N -0.05 1.30 0.08 1.77 6.09 -0.69 -1.35 117.51 124.65 2jrk h ILE 66 Ca 0.03 -1.48 0.02 0.00 -1.37 0.00 0.00 64.86 62.06 2jrk h ILE 66 Cb 0.49 1.60 -0.03 0.00 0.47 0.00 0.00 36.82 39.35 2jrk h ILE 66 CO 0.02 0.45 -0.22 -0.08 -3.07 0.00 0.00 178.15 175.24 2jrk h GLU 67 N 0.28 -0.38 -0.79 2.19 4.81 -0.94 -0.92 114.58 118.82 2jrk h GLU 67 Ca 0.03 0.03 0.09 0.00 -0.13 0.00 0.00 59.36 59.37 2jrk h GLU 67 Cb 0.80 0.09 -0.05 0.00 0.63 0.00 0.00 28.75 30.22 2jrk h GLU 67 CO 0.06 -0.26 0.51 0.78 -0.73 0.00 0.00 179.01 179.38 2jrk h GLY 68 N -0.40 1.04 1.08 1.92 0.00 -1.07 -0.61 103.07 105.03 2jrk h GLY 68 Ca 0.04 -0.31 -0.11 0.00 0.00 0.00 0.00 47.33 46.95 2jrk h GLY 68 CO -0.15 0.19 -0.10 0.00 0.00 0.00 0.00 176.54 176.48 2jrk h ALA 69 N 1.60 0.72 -0.56 3.60 0.00 -0.76 -1.16 119.26 122.70 2jrk h ALA 69 Ca 0.36 -0.34 -0.07 0.00 0.00 0.00 0.00 54.91 54.85 2jrk h ALA 69 Cb 0.40 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.98 2jrk h ALA 69 CO -0.13 0.62 0.07 1.96 0.00 0.00 0.00 179.25 181.77 2jrk h GLN 70 N 0.86 0.91 -0.97 0.00 1.08 -0.66 -1.98 115.11 114.36 2jrk h GLN 70 Ca 0.14 -0.23 0.16 0.00 -1.45 0.00 0.00 58.65 57.27 2jrk h GLN 70 Cb 0.66 -0.11 -0.10 0.00 -0.05 0.00 0.00 27.48 27.88 2jrk h GLN 70 CO 0.05 0.86 0.58 0.78 -0.95 0.00 0.00 178.83 180.15 2jrk h GLY 71 N 1.01 1.66 1.06 3.46 0.00 -0.81 0.15 103.07 109.59 2jrk h GLY 71 Ca 0.17 -0.36 -0.15 0.00 0.00 0.00 0.00 47.33 47.00 2jrk h GLY 71 CO 0.01 0.01 -0.41 0.00 0.00 0.00 0.00 176.54 176.15 2jrk h ALA 72 N 1.60 0.45 -0.09 3.60 0.00 -0.86 -2.39 119.26 121.56 2jrk h ALA 72 Ca 0.53 -0.46 -0.01 0.00 0.00 0.00 0.00 54.91 54.98 2jrk h ALA 72 Cb 0.73 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.43 2jrk h ALA 72 CO -0.34 0.56 0.03 1.25 0.00 0.00 0.00 179.25 180.75 2jrk h LEU 73 N 0.57 0.12 -1.20 0.00 7.12 -0.64 -1.50 115.31 119.78 2jrk h LEU 73 Ca 0.03 -0.17 -0.07 0.00 0.13 0.00 0.00 57.88 57.81 2jrk h LEU 73 Cb 1.00 -0.03 -0.01 0.00 -0.53 0.00 0.00 40.66 41.09 2jrk h LEU 73 CO 0.10 0.25 -0.16 1.05 -0.13 0.00 0.00 178.44 179.55 2jrk h GLU 74 N -0.02 0.36 -0.28 1.25 4.11 -1.10 -2.09 114.58 116.81 2jrk h GLU 74 Ca 0.03 -0.10 -0.04 0.00 0.07 0.00 0.00 59.36 59.32 2jrk h GLU 74 Cb 0.17 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.37 2jrk h GLU 74 CO -0.00 0.52 0.01 0.00 0.07 0.00 0.00 179.01 179.61 2jrk h ARG 75 N 0.34 0.49 -0.83 1.06 3.08 -1.18 0.23 114.38 117.57 2jrk h ARG 75 Ca 0.06 -0.15 -0.00 0.00 0.07 0.00 0.00 59.98 59.96 2jrk h ARG 75 Cb 0.48 -0.05 -0.04 0.00 0.08 0.00 0.00 29.97 30.44 2jrk h ARG 75 CO 0.03 0.63 0.50 0.93 -1.07 0.00 0.00 179.97 181.00 2jrk h GLU 76 N 0.29 1.12 -0.20 0.04 5.08 -1.21 -2.68 114.58 117.02 2jrk h GLU 76 Ca 0.08 -0.10 -0.14 0.00 -1.00 0.00 0.00 59.36 58.21 2jrk h GLU 76 Cb 0.40 -0.24 -0.01 0.00 0.50 0.00 0.00 28.75 29.41 2jrk h GLU 76 CO 0.01 0.78 -0.44 1.25 -1.00 0.00 0.00 179.01 179.61 2jrk h LEU 77 N 1.14 0.54 -2.17 1.33 6.46 -1.15 -3.10 115.31 118.36 2jrk h LEU 77 Ca 0.30 -0.25 -0.01 0.00 -0.12 0.00 0.00 57.88 57.80 2jrk h LEU 77 Cb -0.05 -0.15 -0.00 0.00 -0.73 0.00 0.00 40.66 39.72 2jrk h LEU 77 CO -0.06 0.91 -0.06 0.11 -0.62 0.00 0.00 178.44 178.72 2jrk h LYS 78 N 0.41 0.00 0.00 1.25 1.57 -0.23 -0.39 116.57 119.18 2jrk h LYS 78 Ca 0.03 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.81 2jrk h LYS 78 Cb 0.94 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.25 2jrk h LYS 78 CO 0.08 0.06 0.00 0.54 -0.57 0.00 0.00 179.45 179.56 2jrk n ARG 79 N -3.48 0.44 -1.69 3.15 1.74 -1.07 -3.64 116.66 112.10 2jrk n ARG 79 Ca -0.02 0.01 -0.03 0.00 -0.77 0.00 0.00 57.85 57.04 2jrk n ARG 79 Cb 0.19 -1.50 0.08 0.00 -1.02 0.00 0.00 32.46 30.21 2jrk n ARG 79 CO 0.00 0.00 0.00 -2.37 -1.52 0.00 0.00 177.63 173.74 2jrk n THR 80 N -1.27 1.50 -0.87 0.55 5.66 -0.18 -4.97 114.28 114.70 2jrk n THR 80 Ca 0.14 -2.83 -0.29 0.00 -3.05 0.00 0.00 64.05 58.02 2jrk n THR 80 Cb 0.23 0.22 -0.03 0.00 -1.55 0.00 0.00 70.33 69.20 2jrk n THR 80 CO 0.00 0.00 0.00 0.47 -3.05 0.00 0.00 175.07 172.49 2jrk n ASP 81 N -0.48 4.03 -4.76 1.09 8.00 -1.05 -4.77 116.55 118.61 2jrk n ASP 81 Ca 0.19 -2.44 -0.22 0.00 0.71 0.00 0.00 54.79 53.03 2jrk n ASP 81 Cb 0.90 -1.10 0.03 0.00 -0.02 0.00 0.00 41.12 40.93 2jrk n ASP 81 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 2jrk n LEU 82 N 5.32 0.00 0.03 0.64 7.99 -1.26 -5.03 117.00 124.69 2jrk n LEU 82 Ca 0.45 -2.61 0.05 0.00 -0.01 0.00 0.00 56.01 53.90 2jrk n LEU 82 Cb 0.22 -0.18 0.46 0.00 -0.11 0.00 0.00 43.42 43.81 2jrk n LEU 82 CO 0.81 -0.62 1.15 0.78 -1.51 0.00 0.00 177.39 178.00 2jrk h ASN 83 N 0.42 0.40 -0.10 -1.43 4.21 -2.03 -2.17 115.58 114.86 2jrk h ASN 83 Ca -0.30 -0.01 0.03 0.00 1.21 0.00 0.00 56.30 57.23 2jrk h ASN 83 Cb 1.21 -0.10 -0.00 0.00 -1.12 0.00 0.00 38.32 38.31 2jrk h ASN 83 CO 0.46 0.28 0.12 0.16 -1.29 0.00 0.00 177.43 177.17 2jrk h ILE 84 N 0.47 0.46 0.00 2.81 -0.00 -1.96 -1.03 117.51 118.25 2jrk h ILE 84 Ca 0.14 0.00 -0.04 0.00 -0.00 0.00 0.00 64.86 64.96 2jrk h ILE 84 Cb -0.01 0.90 -0.01 0.00 -0.00 0.00 0.00 36.82 37.71 2jrk h ILE 84 CO -0.03 0.00 -0.18 0.25 -0.00 0.00 0.00 178.15 178.19 2jrk h LEU 85 N 0.00 0.00 -0.34 0.16 5.85 -1.69 -0.62 115.31 118.68 2jrk h LEU 85 Ca 0.05 0.00 -0.19 0.00 0.84 0.00 0.00 57.88 58.58 2jrk h LEU 85 Cb 0.30 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.32 2jrk h LEU 85 CO -0.00 0.18 -0.82 -0.33 -0.34 0.00 0.00 178.44 177.13 2jrk h GLU 86 N 0.00 0.30 0.02 1.25 5.08 -1.34 0.22 114.58 120.11 2jrk h GLU 86 Ca -0.00 -0.29 -0.00 0.00 -1.00 0.00 0.00 59.36 58.07 2jrk h GLU 86 Cb 0.55 0.07 0.00 0.00 0.50 0.00 0.00 28.75 29.87 2jrk h GLU 86 CO 0.02 0.97 -0.01 0.00 -1.00 0.00 0.00 179.01 178.99 2jrk h ARG 87 N 0.19 -0.02 0.00 2.33 2.47 -1.59 -3.31 114.38 114.45 2jrk h ARG 87 Ca -0.04 0.00 -0.02 0.00 -1.26 0.00 0.00 59.98 58.66 2jrk h ARG 87 Cb 1.42 0.01 -0.00 0.00 -1.65 0.00 0.00 29.97 29.74 2jrk h ARG 87 CO 0.13 0.53 -0.10 0.74 0.56 0.00 0.00 179.97 181.83 2jrk h PHE 88 N -0.60 0.00 -0.75 3.04 0.04 -1.14 -3.16 116.94 114.37 2jrk h PHE 88 Ca -0.00 0.00 0.22 0.00 2.80 0.00 0.00 57.97 60.98 2jrk h PHE 88 Cb 0.56 0.00 -0.03 0.00 2.20 0.00 0.00 35.95 38.68 2jrk h PHE 88 CO 0.12 0.10 0.62 -0.91 -0.60 0.00 0.00 178.31 177.63 2jrk h ASN 89 N 0.00 0.00 -1.04 2.17 2.35 -0.64 0.23 115.58 118.65 2jrk h ASN 89 Ca -0.00 0.00 0.26 0.00 -0.55 0.00 0.00 56.30 56.01 2jrk h ASN 89 Cb 0.51 0.00 -0.09 0.00 0.05 0.00 0.00 38.32 38.79 2jrk h ASN 89 CO 0.01 0.00 0.67 0.22 -1.65 0.00 0.00 177.43 176.68 2jrk h TYR 90 N 0.00 0.64 0.00 1.19 5.03 -1.76 -0.95 116.97 121.12 2jrk h TYR 90 Ca 0.35 0.02 -0.09 0.00 2.58 0.00 0.00 58.73 61.60 2jrk h TYR 90 Cb 1.59 -0.19 -0.02 0.00 1.55 0.00 0.00 36.73 39.67 2jrk h TYR 90 CO 0.00 0.06 -1.34 -1.91 -1.32 0.00 0.00 178.16 173.66 2jrk n GLU 91 N -4.61 0.21 -0.14 1.82 2.13 0.05 -4.53 120.64 115.57 2jrk n GLU 91 Ca 0.25 0.03 -0.10 0.00 0.66 0.00 0.00 57.16 58.00 2jrk n GLU 91 Cb 0.87 -1.12 -0.01 0.00 0.27 0.00 0.00 31.44 31.45 2jrk n GLU 91 CO 0.00 0.00 0.00 0.93 -0.41 0.00 0.00 177.13 177.65 2jrk h GLU 92 N 0.00 0.68 -0.34 5.31 5.08 -0.70 0.18 114.58 124.78 2jrk h GLU 92 Ca -0.13 -0.19 -0.08 0.00 -1.00 0.00 0.00 59.36 57.96 2jrk h GLU 92 Cb 1.21 -0.07 -0.02 0.00 0.50 0.00 0.00 28.75 30.37 2jrk h GLU 92 CO -0.02 0.74 -0.11 0.00 -1.00 0.00 0.00 179.01 178.62 2jrk h ALA 93 N 0.91 1.17 0.00 3.43 0.00 -1.36 0.22 119.26 123.64 2jrk h ALA 93 Ca 0.12 -0.28 -0.12 0.00 0.00 0.00 0.00 54.91 54.63 2jrk h ALA 93 Cb 0.40 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.02 2jrk h ALA 93 CO 0.01 0.53 -0.57 1.96 0.00 0.00 0.00 179.25 181.18 2jrk h GLN 94 N 0.54 0.00 -0.23 0.00 4.20 -1.62 0.78 115.11 118.78 2jrk h GLN 94 Ca 0.10 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.80 2jrk h GLN 94 Cb 0.51 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.28 2jrk h GLN 94 CO 0.03 0.57 0.09 1.15 -0.67 0.00 0.00 178.83 180.00 2jrk h THR 95 N 0.00 1.17 -0.78 -0.54 2.02 0.29 0.20 112.91 115.27 2jrk h THR 95 Ca -0.01 -0.51 -0.05 0.00 0.77 0.00 0.00 66.41 66.61 2jrk h THR 95 Cb 1.11 1.07 -0.03 0.00 -1.74 0.00 0.00 68.15 68.56 2jrk h THR 95 CO 0.07 0.17 0.28 -0.07 0.37 0.00 0.00 175.52 176.34 2jrk h LEU 96 N 0.23 1.10 -1.65 2.58 4.07 -0.87 -1.75 115.31 119.02 2jrk h LEU 96 Ca 0.08 -0.19 0.03 0.00 0.08 0.00 0.00 57.88 57.87 2jrk h LEU 96 Cb 0.18 -0.29 -0.02 0.00 1.08 0.00 0.00 40.66 41.61 2jrk h LEU 96 CO -0.01 0.99 0.27 0.77 -1.08 0.00 0.00 178.44 179.39 2jrk h SER 97 N 1.15 0.39 0.46 -0.43 4.64 -0.67 0.10 113.55 119.20 2jrk h SER 97 Ca 0.26 -0.01 -0.07 0.00 -0.47 0.00 0.00 61.79 61.50 2jrk h SER 97 Cb 0.26 -0.09 -0.01 0.00 -0.31 0.00 0.00 62.40 62.24 2jrk h SER 97 CO -0.02 0.27 -0.35 0.50 -0.87 0.00 0.00 176.83 176.37 2jrk h LYS 98 N 0.46 0.00 -0.35 4.77 3.64 -0.44 -3.14 116.57 121.51 2jrk h LYS 98 Ca 0.16 0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.53 2jrk h LYS 98 Cb 0.08 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 31.89 2jrk h LYS 98 CO -0.04 0.35 0.17 0.82 -2.27 0.00 0.00 179.45 178.47 2jrk h ILE 99 N 0.00 1.16 -0.64 2.00 2.04 0.08 0.20 117.51 122.35 2jrk h ILE 99 Ca -0.00 -0.47 -0.04 0.00 1.00 0.00 0.00 64.86 65.35 2jrk h ILE 99 Cb 0.67 0.83 -0.03 0.00 -0.74 0.00 0.00 36.82 37.55 2jrk h ILE 99 CO 0.04 0.17 0.24 0.17 0.00 0.00 0.00 178.15 178.77 2jrk h LEU 100 N 0.43 0.88 -0.20 1.44 -0.00 -1.48 0.15 115.31 116.53 2jrk h LEU 100 Ca 0.12 -0.13 -0.16 0.00 -0.00 0.00 0.00 57.88 57.71 2jrk h LEU 100 Cb 0.12 -0.23 0.00 0.00 -0.00 0.00 0.00 40.66 40.56 2jrk h LEU 100 CO -0.01 0.80 -0.49 0.25 -0.00 0.00 0.00 178.44 178.99 2jrk h LEU 101 N 0.93 0.77 -0.53 0.17 6.46 -1.49 -2.32 115.31 119.29 2jrk h LEU 101 Ca 0.22 -0.57 0.09 0.00 -0.12 0.00 0.00 57.88 57.49 2jrk h LEU 101 Cb 0.21 -0.22 -0.07 0.00 -0.73 0.00 0.00 40.66 39.85 2jrk h LEU 101 CO -0.02 1.20 0.15 0.11 -0.62 0.00 0.00 178.44 179.26 2jrk h LYS 102 N 0.37 0.29 -0.88 1.25 1.57 -0.31 0.14 116.57 119.00 2jrk h LYS 102 Ca -0.00 -0.02 -0.02 0.00 -1.87 0.00 0.00 60.65 58.74 2jrk h LYS 102 Cb 1.10 -0.07 -0.04 0.00 0.08 0.00 0.00 32.23 33.30 2jrk h LYS 102 CO 0.11 0.19 0.48 -0.44 -0.57 0.00 0.00 179.45 179.22 2jrk h ASP 103 N 0.30 1.11 0.50 0.86 3.32 -0.57 0.36 116.42 122.28 2jrk h ASP 103 Ca 0.27 -0.10 -0.02 0.00 0.02 0.00 0.00 57.03 57.20 2jrk h ASP 103 Cb 0.35 -0.28 0.00 0.00 0.22 0.00 0.00 39.33 39.62 2jrk h ASP 103 CO -0.32 0.89 -0.24 -0.07 -1.72 0.00 0.00 179.24 177.78 2jrk h LEU 104 N 1.24 -0.56 0.00 1.55 -0.00 -1.10 -2.39 115.31 114.05 2jrk h LEU 104 Ca 0.31 0.02 0.00 0.00 -0.00 0.00 0.00 57.88 58.21 2jrk h LEU 104 Cb 0.03 0.15 0.00 0.00 -0.00 0.00 0.00 40.66 40.84 2jrk h LEU 104 CO -0.05 -0.36 0.00 2.29 -0.00 0.00 0.00 178.44 180.32 2jrk n LYS 105 N -4.04 0.47 0.00 1.13 -0.00 0.47 0.30 118.16 116.49 2jrk n LYS 105 Ca -0.08 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.23 2jrk n LYS 105 Cb 0.26 -1.44 0.00 0.00 -0.00 0.00 0.00 35.03 33.85 2jrk n LYS 105 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.40 177.79 2jrk n GLU 106 N -0.94 0.00 0.03 -1.58 -0.58 0.12 -4.23 120.64 113.46 2jrk n GLU 106 Ca 0.10 0.43 -0.12 0.00 -0.42 0.00 0.00 57.16 57.15 2jrk n GLU 106 Cb 0.05 -0.93 -0.14 0.00 -0.57 0.00 0.00 31.44 29.85 2jrk n GLU 106 CO 0.00 0.00 0.00 1.15 -0.48 0.00 0.00 177.13 177.80 2jrk h THR 107 N 0.00 1.18 -0.30 2.62 2.02 -0.83 0.85 112.91 118.45 2jrk h THR 107 Ca 0.00 -2.91 -0.18 0.00 0.77 0.00 0.00 66.41 64.09 2jrk h THR 107 Cb 0.00 2.66 -0.00 0.00 -1.74 0.00 0.00 68.15 69.07 2jrk h THR 107 CO 0.00 0.76 -0.51 1.05 0.37 0.00 0.00 175.52 177.19 2jrk h GLU 108 N 0.03 0.87 -0.13 6.66 -0.00 -0.35 -0.72 114.58 120.93 2jrk h GLU 108 Ca -0.20 -0.53 -0.18 0.00 -0.00 0.00 0.00 59.36 58.45 2jrk h GLU 108 Cb 1.95 0.05 0.01 0.00 -0.00 0.00 0.00 28.75 30.76 2jrk h GLU 108 CO 0.12 1.16 -0.61 0.37 -0.00 0.00 0.00 179.01 180.05 2jrk h GLN 109 N 0.68 0.65 -0.96 1.06 -0.00 -1.58 -2.61 115.11 112.36 2jrk h GLN 109 Ca 0.03 -0.52 0.13 0.00 -0.00 0.00 0.00 58.65 58.28 2jrk h GLN 109 Cb 1.11 0.11 -0.08 0.00 0.00 0.00 0.00 27.48 28.61 2jrk h GLN 109 CO 0.11 1.14 0.61 0.87 0.00 0.00 0.00 178.83 181.56 2jrk h LYS 110 N 0.32 0.85 -0.50 1.69 1.79 -0.88 0.12 116.57 119.96 2jrk h LYS 110 Ca -0.04 -0.05 0.10 0.00 -2.18 0.00 0.00 60.65 58.48 2jrk h LYS 110 Cb 1.25 -0.19 -0.09 0.00 -1.58 0.00 0.00 32.23 31.61 2jrk h LYS 110 CO 0.13 0.56 -0.12 0.28 -1.08 0.00 0.00 179.45 179.22 2jrk h VAL 111 N 0.87 0.51 0.00 0.50 2.07 -0.75 0.21 116.25 119.66 2jrk h VAL 111 Ca 0.48 -0.00 0.00 0.00 0.82 0.00 0.00 66.70 68.00 2jrk h VAL 111 Cb 0.58 0.50 0.00 0.00 -1.52 0.00 0.00 31.29 30.85 2jrk h VAL 111 CO -0.24 0.00 0.00 0.29 0.02 0.00 0.00 177.57 177.64 2jrk n LYS 112 N -5.35 0.20 0.03 1.57 5.02 -0.50 -3.14 118.16 115.98 2jrk n LYS 112 Ca 0.05 0.26 0.11 0.00 -2.02 0.00 0.00 58.31 56.70 2jrk n LYS 112 Cb 0.26 -1.77 0.05 0.00 -0.02 0.00 0.00 35.03 33.55 2jrk n LYS 112 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 2jrk n ASP 113 N -2.12 0.62 -4.63 4.39 2.03 -0.09 -4.98 116.55 111.78 2jrk n ASP 113 Ca 0.05 -0.17 -0.43 0.00 0.52 0.00 0.00 54.79 54.76 2jrk n ASP 113 Cb 0.34 0.69 -0.00 0.00 -0.72 0.00 0.00 41.12 41.43 2jrk n ASP 113 CO 0.00 0.00 0.00 -0.38 -1.92 0.00 0.00 177.20 174.90 2jrk n ILE 114 N -1.97 2.14 -4.26 5.18 5.41 0.61 -5.01 119.36 121.46 2jrk n ILE 114 Ca 0.02 -0.50 -0.24 0.00 1.00 0.00 0.00 62.75 63.04 2jrk n ILE 114 Cb 0.43 -1.24 -0.07 0.00 -0.71 0.00 0.00 39.64 38.06 2jrk n ILE 114 CO 0.00 0.00 0.00 -1.10 0.00 0.00 0.00 176.55 175.45 2jrk s GLN 115 N -1.81 2.38 -0.17 0.38 -0.21 -1.26 -5.06 119.66 113.91 2jrk s GLN 115 Ca 0.59 -1.31 -0.14 0.00 0.02 0.00 0.00 55.36 54.51 2jrk s GLN 115 Cb -0.61 -2.24 -0.04 0.00 1.00 0.00 0.00 33.01 31.11 2jrk s GLN 115 CO 0.60 0.39 0.32 0.95 -2.12 0.00 0.00 175.29 175.43 2jrk s THR 116 N -2.16 5.28 0.00 -0.19 -4.23 -1.26 -4.89 115.64 108.19 2jrk s THR 116 Ca 0.30 0.59 0.00 0.00 -1.18 0.00 0.00 61.69 61.41 2jrk s THR 116 Cb -0.07 -3.66 0.00 0.00 1.34 0.00 0.00 72.50 70.11 2jrk s THR 116 CO 0.20 0.35 0.00 0.00 -0.54 0.00 0.00 174.62 174.63