#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jy6 s GLN 2 N 0.00 2.44 0.28 3.17 -1.52 -1.26 -1.41 119.66 121.36 2jy6 s GLN 2 Ca 0.00 -1.18 -0.06 0.00 -1.95 0.00 0.00 55.36 52.17 2jy6 s GLN 2 Cb 0.00 -2.34 -0.01 0.00 -0.22 0.00 0.00 33.01 30.45 2jy6 s GLN 2 CO 0.00 0.43 0.41 0.96 -0.25 0.00 0.00 175.29 176.83 2jy6 s ILE 3 N -1.93 0.00 -0.06 1.08 -4.36 -1.08 -4.85 121.20 110.00 2jy6 s ILE 3 Ca 0.29 -1.60 0.05 0.00 -0.26 0.00 0.00 60.65 59.13 2jy6 s ILE 3 Cb -0.08 -2.43 -0.02 0.00 1.25 0.00 0.00 42.46 41.18 2jy6 s ILE 3 CO 0.20 0.00 -0.21 -0.36 0.24 0.00 0.00 174.94 174.81 2jy6 s PHE 4 N -3.67 2.55 -0.09 1.37 0.08 -0.31 -3.68 117.98 114.24 2jy6 s PHE 4 Ca 0.29 -0.51 0.00 0.00 0.12 0.00 0.00 56.93 56.83 2jy6 s PHE 4 Cb 0.01 -1.63 0.02 0.00 -0.57 0.00 0.00 43.02 40.86 2jy6 s PHE 4 CO 0.14 -0.07 -0.07 0.08 -0.10 0.00 0.00 175.22 175.19 2jy6 s VAL 5 N -0.32 0.91 0.01 -0.44 1.01 -0.58 0.32 120.40 121.31 2jy6 s VAL 5 Ca 0.02 -0.26 0.07 0.00 0.00 0.00 0.00 61.98 61.81 2jy6 s VAL 5 Cb -0.13 -0.92 -0.03 0.00 0.00 0.00 0.00 36.38 35.31 2jy6 s VAL 5 CO 0.02 0.33 -0.22 -0.54 0.00 0.00 0.00 175.10 174.70 2jy6 s LYS 6 N 1.38 2.08 0.00 2.72 1.02 0.15 -0.53 119.74 126.55 2jy6 s LYS 6 Ca -0.02 -0.95 0.00 0.00 0.02 0.00 0.00 55.97 55.02 2jy6 s LYS 6 Cb -0.14 -2.12 0.00 0.00 -0.52 0.00 0.00 37.83 35.05 2jy6 s LYS 6 CO -0.04 0.55 0.00 0.25 -0.92 0.00 0.00 175.35 175.19 2jy6 n THR 7 N 1.98 0.00 0.18 2.17 -2.24 -1.24 0.24 114.28 115.37 2jy6 n THR 7 Ca -0.16 0.00 0.03 0.00 -2.27 0.00 0.00 64.05 61.64 2jy6 n THR 7 Cb 0.52 -1.47 0.37 0.00 -2.10 0.00 0.00 70.33 67.65 2jy6 n THR 7 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 2jy6 h LEU 8 N 0.00 0.03 0.13 3.22 3.38 -1.95 -2.86 115.31 117.26 2jy6 h LEU 8 Ca 0.00 -0.01 -0.32 0.00 0.09 0.00 0.00 57.88 57.64 2jy6 h LEU 8 Cb 0.00 -0.01 -0.00 0.00 0.09 0.00 0.00 40.66 40.74 2jy6 h LEU 8 CO 0.00 0.36 -1.62 0.71 0.09 0.00 0.00 178.44 177.98 2jy6 h THR 9 N 0.03 1.05 0.00 0.22 1.35 -1.93 -3.48 112.91 110.15 2jy6 h THR 9 Ca 0.00 -2.69 0.00 0.00 -0.55 0.00 0.00 66.41 63.17 2jy6 h THR 9 Cb 0.60 2.73 0.00 0.00 -1.73 0.00 0.00 68.15 69.75 2jy6 h THR 9 CO 0.04 0.82 0.00 0.61 -0.25 0.00 0.00 175.52 176.74 2jy6 n GLY 10 N 1.73 1.82 3.75 5.82 0.00 -1.08 -5.12 105.19 112.12 2jy6 n GLY 10 Ca -0.19 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.46 2jy6 n GLY 10 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2jy6 s LYS 11 N -0.06 3.10 -0.78 1.61 2.20 -1.26 -4.71 119.74 119.84 2jy6 s LYS 11 Ca 0.00 1.94 -0.14 0.00 -0.36 0.00 0.00 55.97 57.41 2jy6 s LYS 11 Cb 0.00 -2.08 0.20 0.00 -1.51 0.00 0.00 37.83 34.45 2jy6 s LYS 11 CO 0.00 -1.13 0.71 0.95 -0.36 0.00 0.00 175.35 175.52 2jy6 s THR 12 N -1.50 5.47 -0.37 3.43 -4.23 -1.26 -3.58 115.64 113.60 2jy6 s THR 12 Ca 0.74 -2.35 -0.13 0.00 -1.18 0.00 0.00 61.69 58.78 2jy6 s THR 12 Cb -0.33 -4.40 0.01 0.00 1.34 0.00 0.00 72.50 69.11 2jy6 s THR 12 CO 0.37 -1.00 0.24 -0.63 -0.54 0.00 0.00 174.62 173.07 2jy6 s ILE 13 N 0.37 5.01 -0.20 2.99 1.01 0.31 -4.96 121.20 125.72 2jy6 s ILE 13 Ca 0.16 -0.56 -0.23 0.00 0.00 0.00 0.00 60.65 60.02 2jy6 s ILE 13 Cb -0.14 -3.70 -0.02 0.00 0.01 0.00 0.00 42.46 38.62 2jy6 s ILE 13 CO -0.07 -0.16 0.72 -0.89 0.00 0.00 0.00 174.94 174.54 2jy6 s THR 14 N 1.65 4.95 0.05 2.92 2.01 -1.26 -1.52 115.64 124.44 2jy6 s THR 14 Ca 0.05 1.37 0.04 0.00 0.31 0.00 0.00 61.69 63.45 2jy6 s THR 14 Cb -0.18 -4.03 -0.02 0.00 0.01 0.00 0.00 72.50 68.28 2jy6 s THR 14 CO 0.09 0.06 -0.11 -0.76 -0.69 0.00 0.00 174.62 173.21 2jy6 s LEU 15 N 2.11 2.23 -0.16 4.42 1.43 -1.24 -5.04 118.68 122.43 2jy6 s LEU 15 Ca 0.32 -0.52 -0.10 0.00 -1.03 0.00 0.00 54.13 52.80 2jy6 s LEU 15 Cb -0.16 -0.38 -0.05 0.00 0.03 0.00 0.00 46.19 45.63 2jy6 s LEU 15 CO 0.11 -0.09 0.17 -0.70 0.23 0.00 0.00 176.35 176.06 2jy6 s GLU 16 N -1.43 3.98 0.29 1.70 2.12 -1.26 -2.65 118.70 121.44 2jy6 s GLU 16 Ca -0.04 -0.12 -0.05 0.00 0.36 0.00 0.00 54.97 55.12 2jy6 s GLU 16 Cb -0.09 -3.35 0.02 0.00 0.26 0.00 0.00 34.13 30.97 2jy6 s GLU 16 CO 0.01 0.44 0.46 1.33 -0.54 0.00 0.00 175.26 176.97 2jy6 n VAL 17 N 3.02 0.00 -4.09 3.70 0.24 -0.50 -4.99 118.33 115.72 2jy6 n VAL 17 Ca -0.16 -1.18 -0.10 0.00 -2.04 0.00 0.00 64.34 60.85 2jy6 n VAL 17 Cb 0.53 0.83 -0.11 0.00 -1.47 0.00 0.00 33.84 33.62 2jy6 n VAL 17 CO 0.00 0.00 0.00 -1.61 -2.14 0.00 0.00 176.83 173.08 2jy6 s GLU 18 N -2.43 0.61 0.44 7.34 0.41 -1.26 0.27 118.70 124.07 2jy6 s GLU 18 Ca 0.19 -1.03 0.11 0.00 -0.41 0.00 0.00 54.97 53.84 2jy6 s GLU 18 Cb -0.02 -0.07 0.99 0.00 -1.78 0.00 0.00 34.13 33.25 2jy6 s GLU 18 CO 0.14 -0.03 2.05 -1.35 -0.49 0.00 0.00 175.26 175.58 2jy6 h PRO 19 N 3.71 0.39 -0.00 0.39 0.11 -1.97 0.13 132.00 134.75 2jy6 h PRO 19 Ca -0.35 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.74 2jy6 h PRO 19 Cb 1.18 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 32.20 2jy6 h PRO 19 CO 0.55 0.26 -0.01 -1.13 -0.21 0.00 0.00 178.00 177.45 2jy6 n SER 20 N -4.48 0.49 -4.77 -2.05 3.41 -1.26 -1.18 113.62 103.78 2jy6 n SER 20 Ca 0.04 -1.07 -0.39 0.00 -0.26 0.00 0.00 58.87 57.20 2jy6 n SER 20 Cb 0.18 -0.02 -0.04 0.00 -0.26 0.00 0.00 64.21 64.07 2jy6 n SER 20 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2jy6 s ASP 21 N -2.07 6.97 0.36 4.04 -1.08 0.03 -4.85 116.67 120.08 2jy6 s ASP 21 Ca 0.42 2.20 -0.17 0.00 -0.52 0.00 0.00 52.55 54.48 2jy6 s ASP 21 Cb 0.21 -2.61 -0.10 0.00 -1.46 0.00 0.00 42.92 38.97 2jy6 s ASP 21 CO 0.37 -0.35 0.81 -0.89 0.52 0.00 0.00 175.17 175.64 2jy6 s THR 22 N -1.38 4.58 0.21 1.71 2.01 -1.26 -1.58 115.64 119.93 2jy6 s THR 22 Ca 0.51 1.14 -0.10 0.00 0.31 0.00 0.00 61.69 63.55 2jy6 s THR 22 Cb -0.28 -3.61 0.15 0.00 0.01 0.00 0.00 72.50 68.77 2jy6 s THR 22 CO 0.36 -0.23 1.87 0.40 -0.69 0.00 0.00 174.62 176.32 2jy6 h ILE 23 N 1.94 1.15 -0.53 1.82 1.08 -0.70 -1.60 117.51 120.67 2jy6 h ILE 23 Ca -0.48 -0.33 0.00 0.00 -0.39 0.00 0.00 64.86 63.67 2jy6 h ILE 23 Cb 1.18 0.11 -0.03 0.00 -3.07 0.00 0.00 36.82 35.01 2jy6 h ILE 23 CO 0.64 0.17 0.35 -0.08 -0.69 0.00 0.00 178.15 178.54 2jy6 h GLU 24 N 0.95 0.69 -0.85 2.37 4.81 -1.73 -0.62 114.58 120.21 2jy6 h GLU 24 Ca 0.28 -0.04 0.01 0.00 -0.13 0.00 0.00 59.36 59.48 2jy6 h GLU 24 Cb -0.05 -0.16 -0.04 0.00 0.63 0.00 0.00 28.75 29.13 2jy6 h GLU 24 CO -0.08 0.46 0.56 -0.91 -0.73 0.00 0.00 179.01 178.30 2jy6 h ASN 25 N 0.72 0.98 -0.34 1.04 2.35 -1.61 -0.77 115.58 117.95 2jy6 h ASN 25 Ca 0.19 -0.03 -0.02 0.00 -0.55 0.00 0.00 56.30 55.89 2jy6 h ASN 25 Cb -0.08 -0.25 -0.01 0.00 0.05 0.00 0.00 38.32 38.03 2jy6 h ASN 25 CO -0.04 0.72 0.12 0.58 -1.65 0.00 0.00 177.43 177.15 2jy6 h VAL 26 N 1.16 1.20 -0.89 2.81 2.07 -0.78 -1.44 116.25 120.37 2jy6 h VAL 26 Ca 0.31 -0.63 0.14 0.00 0.82 0.00 0.00 66.70 67.35 2jy6 h VAL 26 Cb -0.12 0.98 -0.09 0.00 -1.52 0.00 0.00 31.29 30.53 2jy6 h VAL 26 CO -0.07 0.22 0.49 0.11 0.02 0.00 0.00 177.57 178.34 2jy6 h LYS 27 N 0.39 0.68 -0.40 1.57 1.79 -0.50 0.23 116.57 120.34 2jy6 h LYS 27 Ca 0.11 -0.04 -0.08 0.00 -2.18 0.00 0.00 60.65 58.45 2jy6 h LYS 27 Cb 0.22 -0.15 -0.01 0.00 -1.58 0.00 0.00 32.23 30.71 2jy6 h LYS 27 CO -0.01 0.45 -0.08 0.00 -1.08 0.00 0.00 179.45 178.74 2jy6 h ALA 28 N 1.56 0.55 -0.52 3.86 0.00 -0.80 -0.58 119.26 123.33 2jy6 h ALA 28 Ca 0.48 -0.31 0.02 0.00 0.00 0.00 0.00 54.91 55.09 2jy6 h ALA 28 Cb 0.64 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 18.25 2jy6 h ALA 28 CO -0.34 0.41 0.33 0.87 0.00 0.00 0.00 179.25 180.51 2jy6 h LYS 29 N 0.58 0.64 -0.90 0.00 1.57 -0.08 0.16 116.57 118.53 2jy6 h LYS 29 Ca 0.10 -0.04 -0.01 0.00 -1.87 0.00 0.00 60.65 58.84 2jy6 h LYS 29 Cb 0.60 -0.14 -0.04 0.00 0.08 0.00 0.00 32.23 32.72 2jy6 h LYS 29 CO 0.04 0.42 0.54 0.82 -0.57 0.00 0.00 179.45 180.70 2jy6 h ILE 30 N 0.66 1.25 -0.55 1.86 2.04 -0.43 -0.60 117.51 121.74 2jy6 h ILE 30 Ca 0.20 -0.55 -0.04 0.00 1.00 0.00 0.00 64.86 65.47 2jy6 h ILE 30 Cb -0.03 -0.02 -0.03 0.00 -0.74 0.00 0.00 36.82 36.01 2jy6 h ILE 30 CO -0.07 0.26 0.18 -0.61 0.00 0.00 0.00 178.15 177.92 2jy6 h GLN 31 N 1.25 0.82 -0.08 2.37 4.15 -0.17 0.29 115.11 123.74 2jy6 h GLN 31 Ca 0.32 -0.14 -0.03 0.00 0.77 0.00 0.00 58.65 59.57 2jy6 h GLN 31 Cb -0.04 -0.14 -0.00 0.00 0.21 0.00 0.00 27.48 27.51 2jy6 h GLN 31 CO -0.06 0.70 -0.07 0.22 -1.93 0.00 0.00 178.83 177.69 2jy6 h ASP 32 N 0.80 0.20 0.38 -0.69 3.58 -0.25 -0.89 116.42 119.55 2jy6 h ASP 32 Ca 0.19 -0.47 -0.02 0.00 0.42 0.00 0.00 57.03 57.14 2jy6 h ASP 32 Cb 0.21 -0.05 0.00 0.00 1.72 0.00 0.00 39.33 41.21 2jy6 h ASP 32 CO -0.01 0.63 -0.18 0.11 -2.88 0.00 0.00 179.24 176.90 2jy6 h LYS 33 N -0.23 -0.49 0.00 0.28 1.57 -0.93 -3.41 116.57 113.36 2jy6 h LYS 33 Ca 0.01 0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.83 2jy6 h LYS 33 Cb 0.57 0.11 0.00 0.00 0.08 0.00 0.00 32.23 32.99 2jy6 h LYS 33 CO 0.02 -0.17 0.00 0.39 -0.57 0.00 0.00 179.45 179.11 2jy6 n GLU 34 N -5.17 0.00 0.00 3.15 -0.58 0.10 -5.04 120.64 113.11 2jy6 n GLU 34 Ca -0.10 0.33 0.00 0.00 -0.42 0.00 0.00 57.16 56.97 2jy6 n GLU 34 Cb 0.28 -0.82 0.00 0.00 -0.57 0.00 0.00 31.44 30.33 2jy6 n GLU 34 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2jy6 n GLY 35 N 1.86 0.83 3.69 0.62 0.00 -0.34 -5.01 105.19 106.85 2jy6 n GLY 35 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 2jy6 n GLY 35 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2jy6 s ILE 36 N -0.51 3.10 0.29 -0.61 1.01 -1.26 -4.93 121.20 118.28 2jy6 s ILE 36 Ca 0.00 0.57 -0.29 0.00 0.00 0.00 0.00 60.65 60.93 2jy6 s ILE 36 Cb 0.00 -3.37 -0.14 0.00 0.01 0.00 0.00 42.46 38.97 2jy6 s ILE 36 CO 0.00 0.00 1.15 -2.65 0.00 0.00 0.00 174.94 173.44 2jy6 n PRO 37 N 5.41 1.63 0.23 2.79 -0.02 -1.26 -4.32 135.00 139.47 2jy6 n PRO 37 Ca 0.15 0.57 0.16 0.00 -2.02 0.00 0.00 63.50 62.36 2jy6 n PRO 37 Cb 0.41 -2.05 0.82 0.00 -0.02 0.00 0.00 33.50 32.66 2jy6 n PRO 37 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 2jy6 h PRO 38 N 2.53 0.00 0.00 0.52 0.11 -1.92 -0.40 132.00 132.84 2jy6 h PRO 38 Ca -0.42 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.69 2jy6 h PRO 38 Cb 1.32 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.43 2jy6 h PRO 38 CO 0.64 0.00 0.00 -0.44 -0.21 0.00 0.00 178.00 177.99 2jy6 h ASP 39 N 0.00 0.00 -0.11 -2.05 3.32 -1.98 -2.50 116.42 113.11 2jy6 h ASP 39 Ca 0.06 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.11 2jy6 h ASP 39 Cb 0.32 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.87 2jy6 h ASP 39 CO -0.00 0.00 0.00 0.00 -1.72 0.00 0.00 179.24 177.52 2jy6 n GLN 40 N -2.62 2.10 -3.63 3.56 6.02 -0.17 -4.93 117.38 117.71 2jy6 n GLN 40 Ca 0.03 -1.89 -0.36 0.00 -0.01 0.00 0.00 57.00 54.76 2jy6 n GLN 40 Cb 0.35 -1.43 -0.07 0.00 1.02 0.00 0.00 30.24 30.11 2jy6 n GLN 40 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 177.06 175.40 2jy6 s GLN 41 N -1.70 4.08 -0.10 -1.09 -0.21 -0.94 -4.62 119.66 115.07 2jy6 s GLN 41 Ca 0.28 0.03 0.02 0.00 0.02 0.00 0.00 55.36 55.70 2jy6 s GLN 41 Cb 0.19 -3.36 0.01 0.00 1.00 0.00 0.00 33.01 30.85 2jy6 s GLN 41 CO 0.28 0.39 -0.16 1.03 -2.12 0.00 0.00 175.29 174.70 2jy6 s ARG 42 N 0.04 2.23 -0.37 2.91 1.81 -0.56 -5.00 118.95 120.01 2jy6 s ARG 42 Ca 0.15 -0.57 -0.10 0.00 -1.72 0.00 0.00 55.73 53.49 2jy6 s ARG 42 Cb -0.13 -1.86 0.03 0.00 -0.45 0.00 0.00 34.95 32.55 2jy6 s ARG 42 CO 0.04 -0.02 0.18 -0.51 -0.68 0.00 0.00 175.30 174.31 2jy6 s LEU 43 N 0.86 4.64 -0.20 2.53 1.43 -1.26 -0.28 118.68 126.40 2jy6 s LEU 43 Ca -0.09 -1.05 -0.06 0.00 -1.03 0.00 0.00 54.13 51.89 2jy6 s LEU 43 Cb -0.15 -1.98 -0.03 0.00 0.03 0.00 0.00 46.19 44.05 2jy6 s LEU 43 CO 0.00 -0.38 0.04 -0.63 0.23 0.00 0.00 176.35 175.61 2jy6 s ILE 44 N 1.51 4.35 -0.34 -0.59 1.09 0.91 -0.09 121.20 128.04 2jy6 s ILE 44 Ca 0.01 -0.18 0.02 0.00 -1.10 0.00 0.00 60.65 59.40 2jy6 s ILE 44 Cb -0.19 -2.97 0.10 0.00 -1.06 0.00 0.00 42.46 38.34 2jy6 s ILE 44 CO 0.06 0.42 0.08 0.12 -0.10 0.00 0.00 174.94 175.52 2jy6 s PHE 45 N 0.85 2.78 -1.23 3.97 5.36 0.59 -1.45 117.98 128.85 2jy6 s PHE 45 Ca 0.02 -2.44 -0.05 0.00 -0.96 0.00 0.00 56.93 53.51 2jy6 s PHE 45 Cb -0.14 -2.36 0.01 0.00 -0.34 0.00 0.00 43.02 40.19 2jy6 s PHE 45 CO 0.02 -0.91 1.05 0.00 -1.46 0.00 0.00 175.22 173.93 2jy6 n ALA 46 N 4.45 -1.50 0.00 11.12 0.00 -1.26 -2.05 120.51 131.27 2jy6 n ALA 46 Ca 0.02 0.21 0.00 0.00 0.00 0.00 0.00 53.44 53.67 2jy6 n ALA 46 Cb 0.41 -4.12 0.00 0.00 0.00 0.00 0.00 19.45 15.74 2jy6 n ALA 46 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2jy6 n GLY 47 N -1.62 2.52 3.68 0.00 0.00 -1.26 -4.97 105.19 103.53 2jy6 n GLY 47 Ca -0.10 -0.03 -0.43 0.00 0.00 0.00 0.00 46.02 45.46 2jy6 n GLY 47 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2jy6 s LYS 48 N 0.00 4.34 0.06 1.61 1.02 -0.87 -5.01 119.74 120.89 2jy6 s LYS 48 Ca 0.00 1.45 -0.30 0.00 0.02 0.00 0.00 55.97 57.14 2jy6 s LYS 48 Cb 0.00 -3.60 -0.05 0.00 -0.52 0.00 0.00 37.83 33.67 2jy6 s LYS 48 CO 0.00 -0.47 1.01 -1.14 -0.92 0.00 0.00 175.35 173.82 2jy6 s GLN 49 N 2.57 4.59 -0.14 1.68 0.74 -1.26 -0.30 119.66 127.55 2jy6 s GLN 49 Ca 0.49 1.49 -0.26 0.00 0.05 0.00 0.00 55.36 57.12 2jy6 s GLN 49 Cb -0.18 -3.41 -0.02 0.00 1.10 0.00 0.00 33.01 30.50 2jy6 s GLN 49 CO 0.14 0.02 0.88 -0.51 -0.55 0.00 0.00 175.29 175.27 2jy6 s LEU 50 N 0.57 4.21 0.20 3.68 1.43 0.87 -4.95 118.68 124.70 2jy6 s LEU 50 Ca 0.51 1.29 -0.30 0.00 -1.03 0.00 0.00 54.13 54.60 2jy6 s LEU 50 Cb -0.23 -3.32 -0.08 0.00 0.03 0.00 0.00 46.19 42.58 2jy6 s LEU 50 CO 0.29 -0.38 1.10 -1.61 0.23 0.00 0.00 176.35 175.98 2jy6 s GLU 51 N 1.96 4.60 0.47 1.70 2.02 -1.26 -4.62 118.70 123.57 2jy6 s GLU 51 Ca 0.42 1.74 0.14 0.00 0.02 0.00 0.00 54.97 57.29 2jy6 s GLU 51 Cb -0.17 -3.26 1.09 0.00 0.10 0.00 0.00 34.13 31.88 2jy6 s GLU 51 CO 0.15 0.10 2.05 -0.44 0.02 0.00 0.00 175.26 177.14 2jy6 h ASP 52 N 4.86 0.04 -0.34 -0.19 3.32 -1.95 -1.92 116.42 120.24 2jy6 h ASP 52 Ca -0.45 -0.00 -0.02 0.00 0.02 0.00 0.00 57.03 56.58 2jy6 h ASP 52 Cb 1.21 -0.01 -0.01 0.00 0.22 0.00 0.00 39.33 40.74 2jy6 h ASP 52 CO 0.71 0.13 0.03 0.61 -1.72 0.00 0.00 179.24 179.00 2jy6 n GLY 53 N -1.24 2.40 3.54 2.75 0.00 -1.26 -2.60 105.19 108.78 2jy6 n GLY 53 Ca -0.02 -0.52 -0.25 0.00 0.00 0.00 0.00 46.02 45.23 2jy6 n GLY 53 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2jy6 s ARG 54 N -1.97 1.80 0.38 1.61 1.81 -0.72 -5.00 118.95 116.86 2jy6 s ARG 54 Ca 0.30 -1.98 0.08 0.00 -1.72 0.00 0.00 55.73 52.41 2jy6 s ARG 54 Cb 0.23 -1.43 -0.04 0.00 -0.45 0.00 0.00 34.95 33.27 2jy6 s ARG 54 CO 0.09 -0.02 0.23 0.95 -0.68 0.00 0.00 175.30 175.87 2jy6 s THR 55 N -2.85 2.75 -0.96 0.02 -4.23 -1.26 -0.16 115.64 108.95 2jy6 s THR 55 Ca 0.34 -1.57 0.16 0.00 -1.18 0.00 0.00 61.69 59.44 2jy6 s THR 55 Cb 0.07 -3.01 0.13 0.00 1.34 0.00 0.00 72.50 71.03 2jy6 s THR 55 CO 0.16 -0.07 1.49 0.18 -0.54 0.00 0.00 174.62 175.84 2jy6 n LEU 56 N -1.31 0.06 0.08 4.79 4.77 -0.61 -1.95 117.00 122.82 2jy6 n LEU 56 Ca -0.00 0.51 0.02 0.00 -0.03 0.00 0.00 56.01 56.51 2jy6 n LEU 56 Cb 0.62 -0.51 -0.04 0.00 -2.33 0.00 0.00 43.42 41.17 2jy6 n LEU 56 CO 0.44 -0.27 -0.00 0.77 -1.33 0.00 0.00 177.39 176.99 2jy6 h SER 57 N 0.00 0.00 -0.34 -1.43 4.64 -1.41 -1.98 113.55 113.03 2jy6 h SER 57 Ca 0.00 0.00 -0.12 0.00 -0.47 0.00 0.00 61.79 61.20 2jy6 h SER 57 Cb 0.27 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.34 2jy6 h SER 57 CO 0.00 0.48 -0.22 0.44 -0.87 0.00 0.00 176.83 176.66 2jy6 h ASP 58 N 0.00 0.85 -0.19 4.97 3.32 -1.68 -2.47 116.42 121.21 2jy6 h ASP 58 Ca -0.09 -0.31 0.00 0.00 0.02 0.00 0.00 57.03 56.64 2jy6 h ASP 58 Cb 1.45 -0.23 0.00 0.00 0.22 0.00 0.00 39.33 40.76 2jy6 h ASP 58 CO 0.05 1.04 0.00 -1.22 -1.72 0.00 0.00 179.24 177.39 2jy6 n TYR 59 N -4.11 0.25 -2.81 4.55 4.01 -1.25 -4.98 117.16 112.82 2jy6 n TYR 59 Ca 0.00 -0.12 -0.05 0.00 -0.16 0.00 0.00 57.90 57.56 2jy6 n TYR 59 Cb 0.44 0.00 0.01 0.00 -0.31 0.00 0.00 39.34 39.48 2jy6 n TYR 59 CO 0.00 0.00 0.00 -1.71 -0.46 0.00 0.00 176.86 174.69 2jy6 n ASN 60 N 0.46 -7.99 -4.77 7.72 2.85 -0.93 -4.93 115.26 107.67 2jy6 n ASN 60 Ca 0.16 0.85 -0.41 0.00 -0.11 0.00 0.00 54.58 55.07 2jy6 n ASN 60 Cb 0.36 -5.37 -0.02 0.00 1.24 0.00 0.00 39.78 35.99 2jy6 n ASN 60 CO 0.00 0.00 0.00 -0.51 -2.11 0.00 0.00 177.26 174.64 2jy6 s ILE 61 N -2.27 2.79 0.41 -1.44 1.10 -0.75 -5.02 121.20 116.02 2jy6 s ILE 61 Ca 0.17 0.79 0.00 0.00 -0.51 0.00 0.00 60.65 61.10 2jy6 s ILE 61 Cb -0.05 -3.50 0.00 0.00 0.15 0.00 0.00 42.46 39.06 2jy6 s ILE 61 CO 0.78 0.19 0.04 0.00 -2.11 0.00 0.00 174.94 173.83 2jy6 n GLN 62 N 0.90 1.00 -2.93 3.50 10.64 -1.26 -5.06 117.38 124.17 2jy6 n GLN 62 Ca 0.00 -2.91 -0.33 0.00 -1.83 0.00 0.00 57.00 51.93 2jy6 n GLN 62 Cb 0.42 0.73 -0.06 0.00 -0.86 0.00 0.00 30.24 30.46 2jy6 n GLN 62 CO 0.00 0.00 0.00 -1.59 -1.83 0.00 0.00 177.06 173.64 2jy6 s LYS 63 N -3.49 4.11 -1.35 2.61 -2.85 -1.26 -3.92 119.74 113.58 2jy6 s LYS 63 Ca 0.03 0.91 -0.08 0.00 -1.00 0.00 0.00 55.97 55.83 2jy6 s LYS 63 Cb -0.00 -2.29 0.02 0.00 -2.06 0.00 0.00 37.83 33.50 2jy6 s LYS 63 CO 0.02 0.04 1.13 0.39 0.10 0.00 0.00 175.35 177.02 2jy6 n GLU 64 N -0.58 -7.46 -2.61 1.78 4.71 -1.26 -4.95 120.64 110.27 2jy6 n GLU 64 Ca 0.05 0.80 -0.41 0.00 -0.01 0.00 0.00 57.16 57.60 2jy6 n GLU 64 Cb 0.54 -5.83 -0.05 0.00 -1.01 0.00 0.00 31.44 25.09 2jy6 n GLU 64 CO 0.00 0.00 0.00 -1.12 0.09 0.00 0.00 177.13 176.10 2jy6 s SER 65 N -3.50 7.41 -0.40 1.62 0.01 -1.25 -4.94 113.70 112.65 2jy6 s SER 65 Ca 0.50 2.04 0.04 0.00 1.31 0.00 0.00 55.95 59.83 2jy6 s SER 65 Cb -0.22 -2.61 0.11 0.00 0.21 0.00 0.00 66.02 63.51 2jy6 s SER 65 CO 0.74 -0.08 0.13 -0.89 0.41 0.00 0.00 173.24 173.55 2jy6 s THR 66 N -0.64 2.26 0.02 1.44 2.01 -1.25 -1.16 115.64 118.32 2jy6 s THR 66 Ca 0.46 -2.62 -0.30 0.00 0.31 0.00 0.00 61.69 59.53 2jy6 s THR 66 Cb -0.28 -2.64 -0.04 0.00 0.01 0.00 0.00 72.50 69.55 2jy6 s THR 66 CO 0.34 -0.68 1.15 -0.76 -0.69 0.00 0.00 174.62 173.98 2jy6 s LEU 67 N 0.53 4.35 -0.28 4.42 1.02 0.15 -4.82 118.68 124.04 2jy6 s LEU 67 Ca 0.13 1.88 -0.08 0.00 0.02 0.00 0.00 54.13 56.08 2jy6 s LEU 67 Cb -0.21 -3.57 -0.02 0.00 0.02 0.00 0.00 46.19 42.41 2jy6 s LEU 67 CO -0.06 -0.45 0.11 -1.00 0.02 0.00 0.00 176.35 174.97 2jy6 s HIS 68 N 1.34 3.14 -0.50 0.29 3.76 -0.53 0.30 115.29 123.09 2jy6 s HIS 68 Ca 0.56 -0.51 -0.20 0.00 -0.15 0.00 0.00 55.06 54.76 2jy6 s HIS 68 Cb -0.26 -2.30 0.05 0.00 1.11 0.00 0.00 32.58 31.18 2jy6 s HIS 68 CO 0.27 -0.41 0.69 -1.17 -0.85 0.00 0.00 174.74 173.27 2jy6 s LEU 69 N 1.61 4.68 0.17 0.89 2.96 0.14 -0.06 118.68 129.07 2jy6 s LEU 69 Ca 0.05 -0.66 0.05 0.00 -0.22 0.00 0.00 54.13 53.35 2jy6 s LEU 69 Cb -0.16 -2.59 -0.04 0.00 0.50 0.00 0.00 46.19 43.90 2jy6 s LEU 69 CO 0.05 -0.92 0.15 -0.69 -1.32 0.00 0.00 176.35 173.61 2jy6 s VAL 70 N 2.92 4.52 -0.28 1.68 1.01 0.62 -3.10 120.40 127.77 2jy6 s VAL 70 Ca 0.20 -1.08 -0.13 0.00 0.00 0.00 0.00 61.98 60.97 2jy6 s VAL 70 Cb -0.17 -3.32 0.10 0.00 0.00 0.00 0.00 36.38 33.00 2jy6 s VAL 70 CO 0.15 -0.12 0.65 -1.48 0.00 0.00 0.00 175.10 174.31 2jy6 s LEU 71 N -3.14 -1.00 -0.12 3.92 2.34 -1.26 -1.50 118.68 117.92 2jy6 s LEU 71 Ca 0.31 1.51 -0.22 0.00 0.06 0.00 0.00 54.13 55.79 2jy6 s LEU 71 Cb -0.10 2.29 -0.03 0.00 -0.56 0.00 0.00 46.19 47.78 2jy6 s LEU 71 CO 0.24 -0.23 0.64 -0.60 -1.06 0.00 0.00 176.35 175.34 2jy6 s ARG 72 N 2.20 4.34 0.66 1.48 3.52 -1.26 -5.05 118.95 124.84 2jy6 s ARG 72 Ca -0.08 0.72 -0.14 0.00 -0.13 0.00 0.00 55.73 56.11 2jy6 s ARG 72 Cb -0.08 -3.49 -0.01 0.00 -1.56 0.00 0.00 34.95 29.81 2jy6 s ARG 72 CO -0.19 -0.03 1.08 -0.51 -0.81 0.00 0.00 175.30 174.83 2jy6 s LEU 73 N 1.19 3.33 -0.01 -0.88 1.43 -1.26 -4.96 118.68 117.52 2jy6 s LEU 73 Ca 0.33 1.83 0.21 0.00 -1.03 0.00 0.00 54.13 55.46 2jy6 s LEU 73 Cb -0.17 -4.53 -0.27 0.00 0.03 0.00 0.00 46.19 41.25 2jy6 s LEU 73 CO 0.14 -1.46 0.72 0.54 0.23 0.00 0.00 176.35 176.51 2jy6 n ARG 74 N -2.56 0.32 -4.06 1.70 5.12 -1.26 -4.97 116.66 110.95 2jy6 n ARG 74 Ca 0.09 -0.08 -0.10 0.00 -1.93 0.00 0.00 57.85 55.83 2jy6 n ARG 74 Cb 0.53 -1.50 -0.11 0.00 -1.16 0.00 0.00 32.46 30.22 2jy6 n ARG 74 CO 0.00 0.00 0.00 0.20 -1.93 0.00 0.00 177.63 175.90 2jy6 s GLY 75 N -3.60 0.45 0.00 -0.13 0.00 -1.26 -5.38 107.32 97.40 2jy6 s GLY 75 Ca 0.01 -0.89 0.00 0.00 0.00 0.00 0.00 44.72 43.84 2jy6 s GLY 75 CO 0.88 -0.97 0.00 0.61 0.00 0.00 0.00 173.10 173.61