#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k39 s GLN 2 N 0.00 3.10 0.13 2.12 0.00 -1.26 -0.13 119.66 123.62 2k39 s GLN 2 Ca 0.00 -0.35 0.08 0.00 -0.00 0.00 0.00 55.36 55.09 2k39 s GLN 2 Cb 0.00 -2.90 -0.04 0.00 0.00 0.00 0.00 33.01 30.08 2k39 s GLN 2 CO 0.00 0.71 -0.20 0.96 0.00 0.00 0.00 175.29 176.76 2k39 s ILE 3 N -0.96 1.79 0.22 3.63 -4.36 -0.42 -0.26 121.20 120.83 2k39 s ILE 3 Ca 0.15 -1.69 -0.06 0.00 -0.26 0.00 0.00 60.65 58.79 2k39 s ILE 3 Cb -0.12 -1.68 -0.06 0.00 1.25 0.00 0.00 42.46 41.85 2k39 s ILE 3 CO 0.04 -0.14 0.48 -0.36 0.24 0.00 0.00 174.94 175.21 2k39 s PHE 4 N -1.46 3.46 0.05 1.37 0.08 -0.99 -0.19 117.98 120.30 2k39 s PHE 4 Ca 0.10 0.67 0.09 0.00 0.12 0.00 0.00 56.93 57.92 2k39 s PHE 4 Cb -0.09 -2.11 -0.03 0.00 -0.57 0.00 0.00 43.02 40.23 2k39 s PHE 4 CO 0.05 0.30 -0.26 0.08 -0.10 0.00 0.00 175.22 175.29 2k39 s VAL 5 N -1.84 2.14 -0.09 -0.44 1.01 0.17 -1.32 120.40 120.02 2k39 s VAL 5 Ca 0.44 -1.41 0.02 0.00 0.00 0.00 0.00 61.98 61.03 2k39 s VAL 5 Cb -0.11 -1.83 0.01 0.00 0.00 0.00 0.00 36.38 34.45 2k39 s VAL 5 CO 0.25 0.35 -0.14 -0.75 0.00 0.00 0.00 175.10 174.81 2k39 s LYS 6 N -1.28 2.03 0.69 2.72 2.20 0.19 -0.54 119.74 125.75 2k39 s LYS 6 Ca 0.12 -0.51 -0.09 0.00 -0.36 0.00 0.00 55.97 55.12 2k39 s LYS 6 Cb -0.10 -1.70 0.03 0.00 -1.51 0.00 0.00 37.83 34.55 2k39 s LYS 6 CO 0.02 -0.01 1.05 0.95 -0.36 0.00 0.00 175.35 177.00 2k39 s THR 7 N 0.83 3.13 0.35 3.43 -4.23 -0.56 -1.75 115.64 116.85 2k39 s THR 7 Ca -0.10 0.18 0.07 0.00 -1.18 0.00 0.00 61.69 60.66 2k39 s THR 7 Cb -0.15 -3.33 0.31 0.00 1.34 0.00 0.00 72.50 70.66 2k39 s THR 7 CO 0.01 -0.40 1.90 -0.07 -0.54 0.00 0.00 174.62 175.52 2k39 h LEU 8 N -0.59 0.68 -0.45 4.79 3.38 -1.91 -2.59 115.31 118.62 2k39 h LEU 8 Ca -0.45 0.03 -0.17 0.00 0.09 0.00 0.00 57.88 57.37 2k39 h LEU 8 Cb 1.27 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.90 2k39 h LEU 8 CO 0.63 0.38 -0.74 0.71 0.09 0.00 0.00 178.44 179.51 2k39 h THR 9 N 0.74 1.43 0.00 0.22 1.35 -1.95 -3.48 112.91 111.21 2k39 h THR 9 Ca 0.40 -2.26 0.00 0.00 -0.55 0.00 0.00 66.41 64.00 2k39 h THR 9 Cb 0.55 2.21 0.00 0.00 -1.73 0.00 0.00 68.15 69.17 2k39 h THR 9 CO -0.17 0.67 0.00 0.61 -0.25 0.00 0.00 175.52 176.38 2k39 n GLY 10 N 0.57 1.62 3.75 5.82 0.00 -0.97 -5.13 105.19 110.85 2k39 n GLY 10 Ca -0.03 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.59 2k39 n GLY 10 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2k39 s LYS 11 N -0.09 4.42 -0.36 1.61 2.20 -1.26 -4.84 119.74 121.42 2k39 s LYS 11 Ca 0.00 0.93 -0.13 0.00 -0.36 0.00 0.00 55.97 56.41 2k39 s LYS 11 Cb 0.00 -3.35 -0.00 0.00 -1.51 0.00 0.00 37.83 32.97 2k39 s LYS 11 CO 0.00 0.33 0.25 0.99 -0.36 0.00 0.00 175.35 176.57 2k39 s THR 12 N -0.16 5.18 -0.35 3.43 2.01 -1.26 -1.50 115.64 122.99 2k39 s THR 12 Ca 0.35 -0.42 -0.13 0.00 0.31 0.00 0.00 61.69 61.80 2k39 s THR 12 Cb -0.20 -3.75 -0.01 0.00 0.01 0.00 0.00 72.50 68.55 2k39 s THR 12 CO 0.21 -0.12 0.24 -0.63 -0.69 0.00 0.00 174.62 173.63 2k39 s ILE 13 N 1.69 5.22 0.18 1.82 1.01 0.29 -4.94 121.20 126.47 2k39 s ILE 13 Ca 0.05 -0.31 -0.31 0.00 0.00 0.00 0.00 60.65 60.09 2k39 s ILE 13 Cb -0.18 -3.72 -0.09 0.00 0.01 0.00 0.00 42.46 38.48 2k39 s ILE 13 CO 0.10 -0.05 1.47 0.28 0.00 0.00 0.00 174.94 176.73 2k39 s THR 14 N 1.71 2.85 -0.06 2.92 -1.32 -1.26 0.41 115.64 120.89 2k39 s THR 14 Ca 0.06 0.65 0.01 0.00 -1.21 0.00 0.00 61.69 61.19 2k39 s THR 14 Cb -0.18 -3.41 0.02 0.00 -1.51 0.00 0.00 72.50 67.42 2k39 s THR 14 CO 0.10 0.07 -0.07 -0.22 -2.21 0.00 0.00 174.62 172.29 2k39 s LEU 15 N 0.61 1.39 -0.34 9.08 2.96 0.73 -4.95 118.68 128.16 2k39 s LEU 15 Ca 0.65 -0.20 -0.19 0.00 -0.22 0.00 0.00 54.13 54.17 2k39 s LEU 15 Cb -0.41 -0.61 -0.00 0.00 0.50 0.00 0.00 46.19 45.67 2k39 s LEU 15 CO 0.35 -0.04 0.58 -1.61 -1.32 0.00 0.00 176.35 174.31 2k39 s GLU 16 N 0.95 3.74 0.02 1.98 8.01 -1.26 -1.30 118.70 130.84 2k39 s GLU 16 Ca -0.10 0.05 0.00 0.00 0.01 0.00 0.00 54.97 54.93 2k39 s GLU 16 Cb -0.15 -3.78 0.00 0.00 -4.31 0.00 0.00 34.13 25.90 2k39 s GLU 16 CO 0.00 -0.63 0.00 1.33 0.01 0.00 0.00 175.26 175.97 2k39 n VAL 17 N 5.45 0.19 0.00 2.63 0.24 0.82 -4.99 118.33 122.67 2k39 n VAL 17 Ca -0.03 0.06 0.00 0.00 -2.04 0.00 0.00 64.34 62.34 2k39 n VAL 17 Cb 0.49 -1.04 0.00 0.00 -1.47 0.00 0.00 33.84 31.81 2k39 n VAL 17 CO 0.00 0.00 0.00 1.21 -2.14 0.00 0.00 176.83 175.90 2k39 n GLU 18 N -2.67 0.00 0.16 7.34 4.07 -1.21 -4.71 120.64 123.63 2k39 n GLU 18 Ca 0.00 0.00 0.13 0.00 -0.06 0.00 0.00 57.16 57.23 2k39 n GLU 18 Cb 0.00 0.00 0.38 0.00 -0.06 0.00 0.00 31.44 31.76 2k39 n GLU 18 CO 0.00 0.00 0.00 -1.00 -0.06 0.00 0.00 177.13 176.07 2k39 h PRO 19 N 0.00 0.00 -0.74 5.31 0.13 -1.91 -3.11 132.00 131.67 2k39 h PRO 19 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 2k39 h PRO 19 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 2k39 h PRO 19 CO 0.00 0.00 0.00 0.43 -0.23 0.00 0.00 178.00 178.20 2k39 n SER 20 N -2.59 2.25 -4.81 1.44 7.64 -1.26 -1.46 113.62 114.82 2k39 n SER 20 Ca 0.04 -2.24 -0.33 0.00 1.01 0.00 0.00 58.87 57.36 2k39 n SER 20 Cb 0.41 -0.48 -0.03 0.00 -1.01 0.00 0.00 64.21 63.11 2k39 n SER 20 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 2k39 s ASP 21 N -0.39 6.33 0.24 6.43 2.15 -1.18 -4.93 116.67 125.32 2k39 s ASP 21 Ca 0.17 1.76 -0.13 0.00 0.43 0.00 0.00 52.55 54.78 2k39 s ASP 21 Cb 0.12 -2.54 -0.08 0.00 -0.30 0.00 0.00 42.92 40.13 2k39 s ASP 21 CO 0.06 -0.79 0.62 0.42 -0.17 0.00 0.00 175.17 175.31 2k39 s THR 22 N -2.33 4.81 0.38 1.71 -4.23 -1.26 -2.22 115.64 112.50 2k39 s THR 22 Ca 0.63 0.76 0.19 0.00 -1.18 0.00 0.00 61.69 62.10 2k39 s THR 22 Cb -0.13 -3.66 0.39 0.00 1.34 0.00 0.00 72.50 70.43 2k39 s THR 22 CO 0.27 -0.02 1.70 0.40 -0.54 0.00 0.00 174.62 176.43 2k39 h ILE 23 N 2.21 0.37 0.00 2.99 1.08 -1.76 -0.69 117.51 121.71 2k39 h ILE 23 Ca -0.48 -0.11 0.00 0.00 -0.39 0.00 0.00 64.86 63.88 2k39 h ILE 23 Cb 1.18 0.02 0.00 0.00 -3.07 0.00 0.00 36.82 34.95 2k39 h ILE 23 CO 0.67 0.06 -0.16 -0.62 -0.69 0.00 0.00 178.15 177.41 2k39 n GLU 24 N -4.78 0.24 -0.00 2.37 1.02 -1.26 -2.41 120.64 115.81 2k39 n GLU 24 Ca 0.30 0.16 0.01 0.00 -0.02 0.00 0.00 57.16 57.61 2k39 n GLU 24 Cb 1.03 -1.74 -0.12 0.00 -0.02 0.00 0.00 31.44 30.59 2k39 n GLU 24 CO 0.00 0.00 0.00 -1.71 1.18 0.00 0.00 177.13 176.60 2k39 n ASN 25 N -2.13 0.45 -0.31 1.62 5.15 -0.30 -2.90 115.26 116.83 2k39 n ASN 25 Ca 0.05 0.19 -0.01 0.00 -0.60 0.00 0.00 54.58 54.21 2k39 n ASN 25 Cb 0.42 0.83 0.11 0.00 -0.53 0.00 0.00 39.78 40.61 2k39 n ASN 25 CO 0.00 0.00 0.00 0.58 1.40 0.00 0.00 177.26 179.24 2k39 h VAL 26 N 0.00 1.12 -0.16 3.44 2.07 -1.31 -0.94 116.25 120.47 2k39 h VAL 26 Ca -0.20 -0.36 -0.13 0.00 0.82 0.00 0.00 66.70 66.83 2k39 h VAL 26 Cb 1.56 -0.02 -0.01 0.00 -1.52 0.00 0.00 31.29 31.29 2k39 h VAL 26 CO 0.03 0.19 -0.45 0.11 0.02 0.00 0.00 177.57 177.47 2k39 h LYS 27 N 1.05 0.38 0.00 1.57 1.57 -1.56 -2.51 116.57 117.08 2k39 h LYS 27 Ca 0.35 -0.20 0.00 0.00 -1.87 0.00 0.00 60.65 58.92 2k39 h LYS 27 Cb 0.03 0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.35 2k39 h LYS 27 CO -0.12 0.76 0.00 0.00 -0.57 0.00 0.00 179.45 179.52 2k39 n ALA 28 N -2.49 2.14 -0.05 3.86 0.00 -1.02 -2.31 120.51 120.64 2k39 n ALA 28 Ca -0.02 -0.02 -0.08 0.00 0.00 0.00 0.00 53.44 53.31 2k39 n ALA 28 Cb 0.53 -1.44 0.08 0.00 0.00 0.00 0.00 19.45 18.62 2k39 n ALA 28 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 2k39 h LYS 29 N 0.00 0.69 -0.06 0.00 1.57 -0.73 -0.60 116.57 117.43 2k39 h LYS 29 Ca 0.00 -0.33 -0.10 0.00 -1.87 0.00 0.00 60.65 58.34 2k39 h LYS 29 Cb 0.58 -0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.87 2k39 h LYS 29 CO 0.00 0.94 -0.44 0.82 -0.57 0.00 0.00 179.45 180.20 2k39 h ILE 30 N 0.58 1.32 -0.29 1.86 1.08 -1.35 -0.94 117.51 119.78 2k39 h ILE 30 Ca 0.06 -1.56 -0.14 0.00 -0.39 0.00 0.00 64.86 62.83 2k39 h ILE 30 Cb 0.88 1.77 -0.01 0.00 -3.07 0.00 0.00 36.82 36.38 2k39 h ILE 30 CO 0.08 0.46 -0.40 -0.61 -0.69 0.00 0.00 178.15 176.98 2k39 h GLN 31 N 0.11 0.68 0.07 2.37 4.15 -0.95 0.17 115.11 121.71 2k39 h GLN 31 Ca 0.01 -0.35 -0.00 0.00 0.77 0.00 0.00 58.65 59.07 2k39 h GLN 31 Cb 0.82 0.01 0.00 0.00 0.21 0.00 0.00 27.48 28.52 2k39 h GLN 31 CO 0.06 0.96 -0.03 0.22 -1.93 0.00 0.00 178.83 178.11 2k39 h ASP 32 N 0.56 -0.08 0.77 -0.69 3.58 -0.83 -2.90 116.42 116.84 2k39 h ASP 32 Ca 0.05 -0.40 -0.21 0.00 0.42 0.00 0.00 57.03 56.89 2k39 h ASP 32 Cb 0.93 0.02 -0.03 0.00 1.72 0.00 0.00 39.33 41.96 2k39 h ASP 32 CO 0.08 0.37 -1.35 0.50 -2.88 0.00 0.00 179.24 175.97 2k39 h LYS 33 N -0.55 0.00 0.00 0.28 3.64 -1.21 -3.39 116.57 115.34 2k39 h LYS 33 Ca -0.01 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.37 2k39 h LYS 33 Cb 0.47 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.29 2k39 h LYS 33 CO 0.01 0.48 -0.86 0.39 -2.27 0.00 0.00 179.45 177.21 2k39 n GLU 34 N -3.04 1.18 0.00 1.90 -0.58 -0.12 -5.06 120.64 114.92 2k39 n GLU 34 Ca -0.09 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.65 2k39 n GLU 34 Cb 0.91 -0.93 0.00 0.00 -0.57 0.00 0.00 31.44 30.85 2k39 n GLU 34 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2k39 n GLY 35 N 2.20 1.68 3.67 0.62 0.00 0.41 -4.98 105.19 108.80 2k39 n GLY 35 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 2k39 n GLY 35 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2k39 s ILE 36 N -2.31 4.56 0.43 -0.61 1.01 -1.16 -4.72 121.20 118.39 2k39 s ILE 36 Ca 0.00 1.87 -0.25 0.00 0.00 0.00 0.00 60.65 62.27 2k39 s ILE 36 Cb 0.00 -4.21 -0.10 0.00 0.01 0.00 0.00 42.46 38.17 2k39 s ILE 36 CO 0.00 -0.13 1.17 -2.65 0.00 0.00 0.00 174.94 173.33 2k39 n PRO 37 N 6.11 1.67 0.08 2.79 -0.02 -1.26 -3.86 135.00 140.51 2k39 n PRO 37 Ca 0.12 0.60 -0.04 0.00 -2.02 0.00 0.00 63.50 62.15 2k39 n PRO 37 Cb 0.46 -2.25 -0.06 0.00 -0.02 0.00 0.00 33.50 31.62 2k39 n PRO 37 CO 0.00 0.00 0.00 -1.00 1.98 0.00 0.00 175.50 176.48 2k39 h PRO 38 N 1.82 0.00 -0.74 0.52 0.13 -1.93 -3.27 132.00 128.53 2k39 h PRO 38 Ca -0.47 0.00 0.22 0.00 -0.87 0.00 0.00 66.00 64.88 2k39 h PRO 38 Cb 1.31 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.41 2k39 h PRO 38 CO 0.58 0.86 0.57 0.38 -0.23 0.00 0.00 178.00 180.16 2k39 h ASP 39 N 0.00 0.00 0.67 1.44 3.04 -1.94 -2.94 116.42 116.70 2k39 h ASP 39 Ca -0.01 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.78 2k39 h ASP 39 Cb 1.63 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 39.92 2k39 h ASP 39 CO 0.11 0.00 -1.17 0.00 -2.04 0.00 0.00 179.24 176.14 2k39 n GLN 40 N -4.18 0.53 -2.87 4.15 6.02 -1.23 -4.95 117.38 114.85 2k39 n GLN 40 Ca 0.15 0.03 -0.41 0.00 -0.01 0.00 0.00 57.00 56.76 2k39 n GLN 40 Cb 0.84 -1.71 -0.04 0.00 1.02 0.00 0.00 30.24 30.36 2k39 n GLN 40 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 177.06 175.40 2k39 s GLN 41 N -3.34 4.48 -0.27 -1.09 -0.21 -1.11 -0.96 119.66 117.16 2k39 s GLN 41 Ca -0.01 1.15 -0.09 0.00 0.02 0.00 0.00 55.36 56.43 2k39 s GLN 41 Cb 0.12 -3.46 -0.04 0.00 1.00 0.00 0.00 33.01 30.63 2k39 s GLN 41 CO 0.81 -0.03 0.13 1.03 -2.12 0.00 0.00 175.29 175.11 2k39 s ARG 42 N 1.03 3.75 -0.24 2.91 0.52 -0.51 -4.99 118.95 121.41 2k39 s ARG 42 Ca 0.44 -0.43 -0.21 0.00 -0.52 0.00 0.00 55.73 55.01 2k39 s ARG 42 Cb -0.19 -3.48 -0.02 0.00 0.52 0.00 0.00 34.95 31.78 2k39 s ARG 42 CO 0.22 -0.20 0.67 -0.51 0.02 0.00 0.00 175.30 175.50 2k39 s LEU 43 N 1.67 4.08 -0.08 2.53 1.43 -1.26 -1.78 118.68 125.28 2k39 s LEU 43 Ca 0.07 0.80 0.02 0.00 -1.03 0.00 0.00 54.13 53.99 2k39 s LEU 43 Cb -0.16 -2.93 -0.02 0.00 0.03 0.00 0.00 46.19 43.11 2k39 s LEU 43 CO 0.07 -0.38 -0.15 -0.63 0.23 0.00 0.00 176.35 175.50 2k39 s ILE 44 N 2.43 2.98 -0.20 -0.59 -1.09 -0.29 -2.47 121.20 121.97 2k39 s ILE 44 Ca 0.28 -0.72 -0.04 0.00 -2.23 0.00 0.00 60.65 57.94 2k39 s ILE 44 Cb -0.16 -2.20 0.10 0.00 -1.58 0.00 0.00 42.46 38.63 2k39 s ILE 44 CO 0.09 0.56 0.31 0.12 -1.23 0.00 0.00 174.94 174.79 2k39 s PHE 45 N -0.22 -0.57 -0.72 3.97 2.19 -1.06 -1.31 117.98 120.26 2k39 s PHE 45 Ca 0.00 0.76 -0.00 0.00 0.33 0.00 0.00 56.93 58.02 2k39 s PHE 45 Cb -0.13 -0.07 -0.00 0.00 -1.31 0.00 0.00 43.02 41.50 2k39 s PHE 45 CO 0.03 -0.58 0.60 0.00 1.83 0.00 0.00 175.22 177.10 2k39 n ALA 46 N 5.35 -1.25 -0.39 11.12 0.00 -1.26 -3.57 120.51 130.50 2k39 n ALA 46 Ca -0.05 -0.03 0.00 0.00 0.00 0.00 0.00 53.44 53.36 2k39 n ALA 46 Cb 0.50 -1.81 0.00 0.00 0.00 0.00 0.00 19.45 18.14 2k39 n ALA 46 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2k39 n GLY 47 N -1.10 0.74 3.58 0.00 0.00 -1.26 -5.03 105.19 102.13 2k39 n GLY 47 Ca -0.17 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.70 2k39 n GLY 47 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2k39 s LYS 48 N -0.61 0.89 0.10 1.61 -2.85 -1.23 -5.15 119.74 112.50 2k39 s LYS 48 Ca 0.00 0.61 -0.21 0.00 -1.00 0.00 0.00 55.97 55.37 2k39 s LYS 48 Cb 0.00 0.43 -0.07 0.00 -2.06 0.00 0.00 37.83 36.12 2k39 s LYS 48 CO 0.00 -0.20 0.62 -1.14 0.10 0.00 0.00 175.35 174.74 2k39 s GLN 49 N -0.37 4.29 -0.38 1.78 0.74 -1.26 -2.55 119.66 121.89 2k39 s GLN 49 Ca -0.04 0.84 -0.22 0.00 0.05 0.00 0.00 55.36 55.99 2k39 s GLN 49 Cb -0.03 -3.22 0.01 0.00 1.10 0.00 0.00 33.01 30.87 2k39 s GLN 49 CO 0.04 0.61 0.70 -0.51 -0.55 0.00 0.00 175.29 175.58 2k39 s LEU 50 N -1.18 4.25 0.18 3.68 1.43 -1.03 -5.01 118.68 121.00 2k39 s LEU 50 Ca 0.31 0.10 -0.30 0.00 -1.03 0.00 0.00 54.13 53.21 2k39 s LEU 50 Cb -0.20 -2.87 -0.07 0.00 0.03 0.00 0.00 46.19 43.07 2k39 s LEU 50 CO 0.21 -0.71 0.98 -1.61 0.23 0.00 0.00 176.35 175.44 2k39 s GLU 51 N 2.93 4.75 -0.40 1.70 2.02 -1.26 -4.72 118.70 123.71 2k39 s GLU 51 Ca 0.27 1.52 -0.40 0.00 0.02 0.00 0.00 54.97 56.37 2k39 s GLU 51 Cb -0.14 -3.32 -0.15 0.00 0.10 0.00 0.00 34.13 30.62 2k39 s GLU 51 CO 0.17 0.32 2.06 -0.25 0.02 0.00 0.00 175.26 177.58 2k39 n ASP 52 N 2.13 1.60 0.00 -0.19 9.92 -1.26 -2.50 116.55 126.25 2k39 n ASP 52 Ca 0.00 0.68 0.00 0.00 -0.53 0.00 0.00 54.79 54.94 2k39 n ASP 52 Cb 0.48 -1.08 0.00 0.00 -0.64 0.00 0.00 41.12 39.88 2k39 n ASP 52 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2k39 n GLY 53 N 6.33 1.87 3.96 0.44 0.00 -1.26 -5.07 105.19 111.46 2k39 n GLY 53 Ca 0.43 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 46.22 2k39 n GLY 53 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2k39 s ARG 54 N 0.00 2.29 0.41 1.61 1.81 -1.04 -5.00 118.95 119.03 2k39 s ARG 54 Ca 0.00 -1.85 0.07 0.00 -1.72 0.00 0.00 55.73 52.24 2k39 s ARG 54 Cb 0.00 -2.33 -0.04 0.00 -0.45 0.00 0.00 34.95 32.13 2k39 s ARG 54 CO 0.00 -0.70 0.27 0.95 -0.68 0.00 0.00 175.30 175.14 2k39 s THR 55 N -2.72 2.46 0.15 0.02 -4.23 -1.26 -2.27 115.64 107.79 2k39 s THR 55 Ca 0.46 -1.53 -0.04 0.00 -1.18 0.00 0.00 61.69 59.40 2k39 s THR 55 Cb -0.04 -3.00 -0.14 0.00 1.34 0.00 0.00 72.50 70.66 2k39 s THR 55 CO 0.29 0.00 1.37 -0.07 -0.54 0.00 0.00 174.62 175.67 2k39 h LEU 56 N 1.24 0.54 -2.02 4.79 3.38 -1.07 -3.12 115.31 119.06 2k39 h LEU 56 Ca -0.42 -0.39 0.14 0.00 0.09 0.00 0.00 57.88 57.30 2k39 h LEU 56 Cb 1.26 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 41.83 2k39 h LEU 56 CO 0.64 1.15 0.41 0.77 0.09 0.00 0.00 178.44 181.50 2k39 h SER 57 N 0.28 0.00 -0.08 -0.43 4.64 -1.53 -1.36 113.55 115.06 2k39 h SER 57 Ca -0.05 0.00 0.02 0.00 -0.47 0.00 0.00 61.79 61.29 2k39 h SER 57 Cb 1.42 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.51 2k39 h SER 57 CO 0.14 0.00 0.08 0.44 -0.87 0.00 0.00 176.83 176.63 2k39 h ASP 58 N 0.00 0.00 0.00 4.97 3.32 -1.84 -3.14 116.42 119.73 2k39 h ASP 58 Ca 0.22 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 57.27 2k39 h ASP 58 Cb 1.03 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.58 2k39 h ASP 58 CO -0.00 0.00 -0.16 -1.22 -1.72 0.00 0.00 179.24 176.14 2k39 n TYR 59 N -3.97 0.00 -1.00 4.55 4.01 -0.52 -4.97 117.16 115.27 2k39 n TYR 59 Ca -0.01 -1.14 -0.00 0.00 -0.16 0.00 0.00 57.90 56.60 2k39 n TYR 59 Cb 0.19 -0.18 -0.00 0.00 -0.31 0.00 0.00 39.34 39.04 2k39 n TYR 59 CO 0.00 0.00 0.00 0.09 -0.46 0.00 0.00 176.86 176.49 2k39 n ASN 60 N -1.32 -3.19 -4.66 7.72 4.13 -1.19 -4.96 115.26 111.79 2k39 n ASN 60 Ca 0.17 0.00 -0.43 0.00 1.68 0.00 0.00 54.58 56.00 2k39 n ASN 60 Cb 0.66 -0.69 -0.02 0.00 -1.54 0.00 0.00 39.78 38.19 2k39 n ASN 60 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 2k39 s ILE 61 N -1.94 4.50 0.43 2.41 -1.09 -1.16 -5.00 121.20 119.35 2k39 s ILE 61 Ca 0.00 1.81 0.05 0.00 -2.23 0.00 0.00 60.65 60.28 2k39 s ILE 61 Cb 0.00 -4.17 0.05 0.00 -1.58 0.00 0.00 42.46 36.76 2k39 s ILE 61 CO 0.00 -0.13 0.42 0.00 -1.23 0.00 0.00 174.94 174.00 2k39 n GLN 62 N 6.21 0.81 -2.17 2.79 1.13 -1.26 -4.70 117.38 120.20 2k39 n GLN 62 Ca 0.12 -2.54 -0.42 0.00 -1.94 0.00 0.00 57.00 52.22 2k39 n GLN 62 Cb 0.46 0.12 -0.03 0.00 0.11 0.00 0.00 30.24 30.90 2k39 n GLN 62 CO 0.00 0.00 0.00 0.21 -1.44 0.00 0.00 177.06 175.83 2k39 s LYS 63 N -3.82 4.28 -1.65 -1.09 2.20 -1.26 -3.13 119.74 115.28 2k39 s LYS 63 Ca 0.32 2.04 0.00 0.00 -0.36 0.00 0.00 55.97 57.97 2k39 s LYS 63 Cb -0.03 -3.49 0.00 0.00 -1.51 0.00 0.00 37.83 32.81 2k39 s LYS 63 CO 0.20 -0.56 0.00 0.39 -0.36 0.00 0.00 175.35 175.02 2k39 n GLU 64 N 5.01 -1.52 -1.82 4.03 1.02 0.63 -4.98 120.64 123.02 2k39 n GLU 64 Ca 0.13 0.93 -0.42 0.00 -0.02 0.00 0.00 57.16 57.78 2k39 n GLU 64 Cb 0.43 -5.49 -0.03 0.00 -0.02 0.00 0.00 31.44 26.33 2k39 n GLU 64 CO 0.00 0.00 0.00 -1.12 1.18 0.00 0.00 177.13 177.19 2k39 s SER 65 N -2.16 6.50 -0.24 1.62 0.01 -1.18 -4.63 113.70 113.62 2k39 s SER 65 Ca 0.00 2.67 -0.26 0.00 1.31 0.00 0.00 55.95 59.67 2k39 s SER 65 Cb 0.00 -2.58 0.00 0.00 0.21 0.00 0.00 66.02 63.66 2k39 s SER 65 CO 0.00 -0.93 0.91 0.42 0.41 0.00 0.00 173.24 174.05 2k39 s THR 66 N 2.18 4.77 0.34 1.44 -4.23 -1.26 -2.34 115.64 116.54 2k39 s THR 66 Ca 0.76 1.75 -0.07 0.00 -1.18 0.00 0.00 61.69 62.95 2k39 s THR 66 Cb -0.44 -4.19 -0.06 0.00 1.34 0.00 0.00 72.50 69.15 2k39 s THR 66 CO 0.34 -0.12 0.65 -0.76 -0.54 0.00 0.00 174.62 174.18 2k39 s LEU 67 N 2.99 3.96 -0.03 4.79 1.43 -0.43 -4.90 118.68 126.49 2k39 s LEU 67 Ca 0.39 0.88 0.07 0.00 -1.03 0.00 0.00 54.13 54.44 2k39 s LEU 67 Cb -0.15 -3.73 -0.02 0.00 0.03 0.00 0.00 46.19 42.32 2k39 s LEU 67 CO 0.07 -0.29 -0.24 -1.38 0.23 0.00 0.00 176.35 174.74 2k39 s HIS 68 N -2.22 2.38 -0.12 0.29 -3.43 -0.43 -0.64 115.29 111.13 2k39 s HIS 68 Ca 0.47 -0.42 -0.00 0.00 -0.80 0.00 0.00 55.06 54.30 2k39 s HIS 68 Cb -0.10 -1.52 -0.02 0.00 -1.43 0.00 0.00 32.58 29.50 2k39 s HIS 68 CO 0.31 -0.02 -0.10 -1.17 -2.00 0.00 0.00 174.74 171.76 2k39 s LEU 69 N -0.60 2.90 -0.04 5.38 2.96 -0.72 -1.13 118.68 127.43 2k39 s LEU 69 Ca 0.09 -0.23 0.02 0.00 -0.22 0.00 0.00 54.13 53.80 2k39 s LEU 69 Cb -0.10 -1.66 0.01 0.00 0.50 0.00 0.00 46.19 44.94 2k39 s LEU 69 CO -0.01 0.21 -0.11 0.68 -1.32 0.00 0.00 176.35 175.81 2k39 s VAL 70 N 0.09 0.95 -0.10 1.68 -7.23 -0.73 -3.92 120.40 111.14 2k39 s VAL 70 Ca -0.04 -0.42 -0.14 0.00 -1.81 0.00 0.00 61.98 59.57 2k39 s VAL 70 Cb -0.14 -0.86 -0.05 0.00 0.56 0.00 0.00 36.38 35.89 2k39 s VAL 70 CO 0.04 0.30 0.34 -0.76 -0.31 0.00 0.00 175.10 174.71 2k39 s LEU 71 N 0.42 4.33 -0.15 1.32 1.02 -1.26 -1.42 118.68 122.93 2k39 s LEU 71 Ca -0.08 0.69 0.00 0.00 0.02 0.00 0.00 54.13 54.76 2k39 s LEU 71 Cb -0.12 -2.46 0.02 0.00 0.02 0.00 0.00 46.19 43.65 2k39 s LEU 71 CO 0.02 0.17 -0.15 -0.60 0.02 0.00 0.00 176.35 175.81 2k39 s ARG 72 N -0.08 2.38 -0.04 1.70 3.52 -0.14 -4.99 118.95 121.30 2k39 s ARG 72 Ca 0.20 -0.60 -0.02 0.00 -0.13 0.00 0.00 55.73 55.18 2k39 s ARG 72 Cb -0.14 -2.17 -0.04 0.00 -1.56 0.00 0.00 34.95 31.04 2k39 s ARG 72 CO 0.08 -0.24 0.08 -0.51 -0.81 0.00 0.00 175.30 173.90 2k39 s LEU 73 N 1.46 3.92 0.00 -0.88 2.01 -1.26 -4.65 118.68 119.28 2k39 s LEU 73 Ca 0.05 0.20 0.00 0.00 0.01 0.00 0.00 54.13 54.39 2k39 s LEU 73 Cb -0.13 -2.16 0.00 0.00 0.01 0.00 0.00 46.19 43.91 2k39 s LEU 73 CO -0.11 0.31 0.00 -1.14 1.01 0.00 0.00 176.35 176.42 2k39 n ARG 74 N 1.49 0.00 -1.27 1.70 0.63 -1.26 -4.80 116.66 113.14 2k39 n ARG 74 Ca -0.15 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.78 2k39 n ARG 74 Cb 0.53 0.00 0.00 0.00 0.45 0.00 0.00 32.46 33.44 2k39 n ARG 74 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2k39 n GLY 75 N 0.00 4.04 0.00 5.14 0.00 -1.26 -5.19 105.19 107.92 2k39 n GLY 75 Ca 0.00 -1.48 0.00 0.00 0.00 0.00 0.00 46.02 44.54 2k39 n GLY 75 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93