#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1v5n s SER 2 N 0.00 0.36 0.30 1.61 0.01 -1.26 -5.17 113.70 109.55 1v5n s SER 2 Ca 0.00 -0.58 0.04 0.00 1.31 0.00 0.00 55.95 56.72 1v5n s SER 2 Cb 0.00 0.10 -0.04 0.00 0.21 0.00 0.00 66.02 66.30 1v5n s SER 2 CO 0.00 -0.33 0.18 -0.94 0.41 0.00 0.00 173.24 172.56 1v5n s SER 3 N -1.69 1.41 0.00 2.44 1.04 -1.26 -5.16 113.70 110.48 1v5n s SER 3 Ca -0.12 -1.59 0.00 0.00 0.48 0.00 0.00 55.95 54.72 1v5n s SER 3 Cb -0.07 0.44 0.00 0.00 0.10 0.00 0.00 66.02 66.48 1v5n s SER 3 CO -0.02 -0.93 0.00 0.61 0.98 0.00 0.00 173.24 173.88 1v5n n GLY 4 N -0.56 1.24 3.49 7.32 0.00 -1.26 -5.19 105.19 110.24 1v5n n GLY 4 Ca 0.03 -0.42 -0.10 0.00 0.00 0.00 0.00 46.02 45.53 1v5n n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1v5n s SER 5 N 2.00 -0.47 -0.12 1.61 0.15 -1.26 -5.16 113.70 110.45 1v5n s SER 5 Ca 0.00 -0.07 0.00 0.00 0.70 0.00 0.00 55.95 56.59 1v5n s SER 5 Cb 0.00 0.55 0.02 0.00 -1.71 0.00 0.00 66.02 64.88 1v5n s SER 5 CO 0.00 -0.90 -0.12 -0.55 1.20 0.00 0.00 173.24 172.87 1v5n s SER 6 N -2.70 2.41 -0.61 5.45 0.15 -1.26 -5.09 113.70 112.05 1v5n s SER 6 Ca 0.03 -0.40 -0.21 0.00 0.70 0.00 0.00 55.95 56.08 1v5n s SER 6 Cb -0.01 -1.02 0.09 0.00 -1.71 0.00 0.00 66.02 63.36 1v5n s SER 6 CO -0.10 -0.07 0.81 -0.83 1.20 0.00 0.00 173.24 174.26 1v5n s GLY 7 N 1.46 1.60 0.32 9.45 0.00 -1.26 -5.03 107.32 113.86 1v5n s GLY 7 Ca 0.02 -2.01 0.08 0.00 0.00 0.00 0.00 44.72 42.81 1v5n s GLY 7 CO -0.08 1.78 0.13 -0.51 0.00 0.00 0.00 173.10 174.42 1v5n s THR 8 N 3.26 3.20 -2.08 0.90 -4.23 -1.26 -5.01 115.64 110.43 1v5n s THR 8 Ca 0.16 -1.69 0.13 0.00 -1.18 0.00 0.00 61.69 59.11 1v5n s THR 8 Cb -0.21 -3.00 0.32 0.00 1.34 0.00 0.00 72.50 70.96 1v5n s THR 8 CO 0.09 -0.22 1.37 1.21 -0.54 0.00 0.00 174.62 176.52 1v5n n GLU 9 N -1.13 1.47 -0.27 3.99 2.13 -1.26 -4.19 120.64 121.38 1v5n n GLU 9 Ca -0.04 -0.72 0.07 0.00 0.66 0.00 0.00 57.16 57.14 1v5n n GLU 9 Cb 0.61 -1.25 0.22 0.00 0.27 0.00 0.00 31.44 31.28 1v5n n GLU 9 CO 0.00 0.00 0.00 1.49 -0.41 0.00 0.00 177.13 178.21 1v5n h GLU 10 N 1.29 0.38 -4.66 5.31 4.57 -2.00 -3.33 114.58 116.14 1v5n h GLU 10 Ca 0.00 -0.02 -0.68 0.00 -1.18 0.00 0.00 59.36 57.48 1v5n h GLU 10 Cb 0.29 -0.09 -0.36 0.00 -0.16 0.00 0.00 28.75 28.44 1v5n h GLU 10 CO 0.00 0.25 -0.66 1.03 -1.18 0.00 0.00 179.01 178.45 1v5n s ARG 11 N -5.99 2.01 -0.12 1.92 0.52 -1.26 -4.91 118.95 111.12 1v5n s ARG 11 Ca -0.12 -1.63 0.14 0.00 -0.52 0.00 0.00 55.73 53.60 1v5n s ARG 11 Cb 0.22 -3.30 0.29 0.00 0.52 0.00 0.00 34.95 32.68 1v5n s ARG 11 CO 0.77 -0.86 1.15 1.47 0.02 0.00 0.00 175.30 177.85 1v5n n LEU 12 N 4.50 1.95 -0.16 2.53 -0.00 -1.25 -4.84 117.00 119.72 1v5n n LEU 12 Ca -0.05 -2.87 -0.04 0.00 -0.00 0.00 0.00 56.01 53.05 1v5n n LEU 12 Cb 0.42 -0.35 0.02 0.00 -0.00 0.00 0.00 43.42 43.51 1v5n n LEU 12 CO 0.27 0.80 0.69 0.11 -0.00 0.00 0.00 177.39 179.26 1v5n h LYS 13 N 0.34 -0.12 0.04 1.47 6.56 -1.94 -1.47 116.57 121.45 1v5n h LYS 13 Ca -0.02 0.01 -0.00 0.00 -1.06 0.00 0.00 60.65 59.58 1v5n h LYS 13 Cb 1.14 0.03 0.00 0.00 -0.57 0.00 0.00 32.23 32.83 1v5n h LYS 13 CO 0.01 -0.08 -0.02 1.49 -2.06 0.00 0.00 179.45 178.79 1v5n h GLU 14 N -0.13 -0.05 -0.84 3.15 4.81 -2.02 -3.30 114.58 116.20 1v5n h GLU 14 Ca 0.23 0.00 0.31 0.00 -0.13 0.00 0.00 59.36 59.78 1v5n h GLU 14 Cb 0.49 0.01 -0.15 0.00 0.63 0.00 0.00 28.75 29.73 1v5n h GLU 14 CO -0.59 0.62 0.31 -0.89 -0.73 0.00 0.00 179.01 177.73 1v5n n ILE 15 N -4.75 -0.35 0.25 2.32 2.08 -1.07 0.45 119.36 118.29 1v5n n ILE 15 Ca -0.08 1.75 -0.16 0.00 0.56 0.00 0.00 62.75 64.82 1v5n n ILE 15 Cb 0.34 -2.74 -0.08 0.00 -0.75 0.00 0.00 39.64 36.40 1v5n n ILE 15 CO 0.00 0.00 0.00 -0.33 0.56 0.00 0.00 176.55 176.78 1v5n h GLU 16 N 0.00 -0.78 -0.84 0.38 5.08 -1.35 -2.50 114.58 114.58 1v5n h GLU 16 Ca 0.64 0.05 0.20 0.00 -1.00 0.00 0.00 59.36 59.26 1v5n h GLU 16 Cb 1.61 0.18 -0.12 0.00 0.50 0.00 0.00 28.75 30.91 1v5n h GLU 16 CO -0.69 -0.52 0.28 0.00 -1.00 0.00 0.00 179.01 177.08 1v5n h ALA 17 N -0.41 1.22 -0.96 3.43 0.00 -0.13 0.19 119.26 122.60 1v5n h ALA 17 Ca -0.04 0.18 0.20 0.00 0.00 0.00 0.00 54.91 55.25 1v5n h ALA 17 Cb 0.71 0.21 -0.11 0.00 0.00 0.00 0.00 17.79 18.60 1v5n h ALA 17 CO -0.04 -0.36 0.54 -0.22 0.00 0.00 0.00 179.25 179.17 1v5n h LYS 18 N 0.32 0.61 -0.37 0.00 1.63 -1.05 -0.16 116.57 117.55 1v5n h LYS 18 Ca 0.50 -0.04 -0.01 0.00 -0.85 0.00 0.00 60.65 60.25 1v5n h LYS 18 Cb 0.93 -0.14 -0.02 0.00 -0.60 0.00 0.00 32.23 32.41 1v5n h LYS 18 CO -0.55 0.41 0.18 1.88 -3.45 0.00 0.00 179.45 177.92 1v5n h TYR 19 N 0.63 0.53 -1.01 1.91 0.05 -0.50 -2.66 116.97 115.93 1v5n h TYR 19 Ca 0.57 -0.03 0.29 0.00 0.05 0.00 0.00 58.73 59.62 1v5n h TYR 19 Cb 0.97 -0.17 -0.14 0.00 1.01 0.00 0.00 36.73 38.40 1v5n h TYR 19 CO -0.04 0.45 0.58 -0.44 -1.05 0.00 0.00 178.16 177.66 1v5n h ASP 20 N 0.46 0.59 -0.77 3.88 3.32 -0.87 0.66 116.42 123.69 1v5n h ASP 20 Ca 0.13 0.17 0.17 0.00 0.02 0.00 0.00 57.03 57.51 1v5n h ASP 20 Cb 0.12 0.09 -0.05 0.00 0.22 0.00 0.00 39.33 39.71 1v5n h ASP 20 CO -0.02 -0.03 0.52 -0.08 -1.72 0.00 0.00 179.24 177.92 1v5n h GLU 21 N 0.44 0.34 0.04 3.56 4.22 -1.35 0.32 114.58 122.15 1v5n h GLU 21 Ca 0.70 -0.02 -0.23 0.00 0.08 0.00 0.00 59.36 59.89 1v5n h GLU 21 Cb 1.48 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 30.65 1v5n h GLU 21 CO -0.54 0.23 -1.02 0.82 -2.18 0.00 0.00 179.01 176.32 1v5n h ILE 22 N 0.35 1.53 -0.76 2.32 2.04 0.21 -3.27 117.51 119.92 1v5n h ILE 22 Ca 0.38 -2.88 -0.48 0.00 1.00 0.00 0.00 64.86 62.88 1v5n h ILE 22 Cb 0.97 2.68 -0.27 0.00 -0.74 0.00 0.00 36.82 39.46 1v5n h ILE 22 CO -0.11 0.84 0.19 0.00 0.00 0.00 0.00 178.15 179.06 1v5n n ALA 23 N -2.47 5.37 -0.09 1.87 0.00 0.14 -4.69 120.51 120.63 1v5n n ALA 23 Ca -0.05 -3.37 -0.10 0.00 0.00 0.00 0.00 53.44 49.93 1v5n n ALA 23 Cb 0.90 -1.10 -0.02 0.00 0.00 0.00 0.00 19.45 19.22 1v5n n ALA 23 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 1v5n h LYS 24 N 1.60 0.43 0.00 0.00 1.57 -0.54 -3.17 116.57 116.45 1v5n h LYS 24 Ca 0.45 -0.07 -0.26 0.00 -1.87 0.00 0.00 60.65 58.91 1v5n h LYS 24 Cb 1.56 -0.08 -0.04 0.00 0.08 0.00 0.00 32.23 33.75 1v5n h LYS 24 CO 0.99 0.41 -1.61 -0.44 -0.57 0.00 0.00 179.45 178.24 1v5n h ASP 25 N 0.34 0.00 -1.54 0.86 3.32 -1.86 -3.47 116.42 114.07 1v5n h ASP 25 Ca 0.10 0.00 -0.71 0.00 0.02 0.00 0.00 57.03 56.44 1v5n h ASP 25 Cb 0.13 0.00 0.04 0.00 0.22 0.00 0.00 39.33 39.73 1v5n h ASP 25 CO -0.01 0.90 0.49 0.79 -1.72 0.00 0.00 179.24 179.69 1v5n n TRP 26 N -3.02 1.50 -1.18 4.55 7.02 -1.20 -4.93 117.44 120.19 1v5n n TRP 26 Ca -0.14 0.70 -0.29 0.00 -1.02 0.00 0.00 57.50 56.74 1v5n n TRP 26 Cb 1.00 -2.32 0.16 0.00 -2.42 0.00 0.00 31.31 27.73 1v5n n TRP 26 CO 0.00 0.00 0.00 -1.25 -2.02 0.00 0.00 177.69 174.42 1v5n s PRO 27 N 1.08 0.76 -0.09 -0.99 0.04 -1.26 -5.00 135.00 129.55 1v5n s PRO 27 Ca 0.89 0.64 0.04 0.00 0.04 0.00 0.00 61.00 62.61 1v5n s PRO 27 Cb -1.04 -1.77 -0.24 0.00 0.04 0.00 0.00 34.50 31.49 1v5n s PRO 27 CO 0.53 -2.53 0.50 1.63 0.04 0.00 0.00 177.00 177.16 1v5n n LYS 28 N -4.06 0.69 -4.55 4.56 4.76 -1.26 -4.65 118.16 113.65 1v5n n LYS 28 Ca 0.06 0.27 -0.28 0.00 -2.87 0.00 0.00 58.31 55.49 1v5n n LYS 28 Cb 0.56 -1.74 -0.17 0.00 -1.84 0.00 0.00 35.03 31.84 1v5n n LYS 28 CO 0.00 0.00 0.00 0.15 -1.37 0.00 0.00 177.40 176.18 1v5n s LYS 29 N -2.58 2.12 0.01 1.97 -0.14 -1.26 -1.78 119.74 118.08 1v5n s LYS 29 Ca -0.13 -0.54 0.06 0.00 -1.36 0.00 0.00 55.97 54.00 1v5n s LYS 29 Cb 0.07 -1.77 -0.02 0.00 -1.68 0.00 0.00 37.83 34.43 1v5n s LYS 29 CO 0.80 -0.02 -0.19 0.54 -0.76 0.00 0.00 175.35 175.72 1v5n s VAL 30 N 0.86 1.52 -0.64 3.17 0.11 -0.86 -4.94 120.40 119.62 1v5n s VAL 30 Ca -0.10 -0.97 -0.15 0.00 -2.93 0.00 0.00 61.98 57.83 1v5n s VAL 30 Cb -0.15 -1.30 0.16 0.00 -1.53 0.00 0.00 36.38 33.56 1v5n s VAL 30 CO 0.01 0.30 0.59 -0.75 -3.33 0.00 0.00 175.10 171.92 1v5n s LYS 31 N -0.79 3.20 0.40 1.54 2.20 -1.26 0.36 119.74 125.39 1v5n s LYS 31 Ca 0.07 -1.97 -0.23 0.00 -0.36 0.00 0.00 55.97 53.47 1v5n s LYS 31 Cb -0.08 -4.34 -0.10 0.00 -1.51 0.00 0.00 37.83 31.80 1v5n s LYS 31 CO 0.00 -1.32 0.98 -1.58 -0.36 0.00 0.00 175.35 173.08 1v5n s HIS 32 N 1.10 3.38 0.06 4.03 5.65 -1.26 -4.87 115.29 123.38 1v5n s HIS 32 Ca 0.08 1.67 -0.24 0.00 0.25 0.00 0.00 55.06 56.82 1v5n s HIS 32 Cb -0.23 -2.96 -0.16 0.00 -1.18 0.00 0.00 32.58 28.05 1v5n s HIS 32 CO -0.01 -0.22 1.63 -0.24 -0.65 0.00 0.00 174.74 175.24 1v5n h VAL 33 N 2.15 1.09 0.00 0.89 3.04 -1.95 1.72 116.25 123.19 1v5n h VAL 33 Ca -0.48 -0.27 -0.01 0.00 -1.01 0.00 0.00 66.70 64.92 1v5n h VAL 33 Cb 1.20 1.27 -0.00 0.00 -2.01 0.00 0.00 31.29 31.74 1v5n h VAL 33 CO 0.62 0.07 -0.04 -0.07 -1.01 0.00 0.00 177.57 177.14 1v5n h LEU 34 N -0.10 0.00 -3.02 3.16 3.38 -1.99 -1.85 115.31 114.88 1v5n h LEU 34 Ca 0.00 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.97 1v5n h LEU 34 Cb 0.12 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.86 1v5n h LEU 34 CO -0.00 0.04 -0.17 1.57 0.09 0.00 0.00 178.44 179.97 1v5n n HIS 35 N -3.83 0.08 -0.35 1.13 -0.00 -0.90 -4.80 115.22 106.54 1v5n n HIS 35 Ca -0.03 -1.19 0.30 0.00 0.46 0.00 0.00 57.72 57.27 1v5n n HIS 35 Cb 0.13 -0.20 0.51 0.00 -0.12 0.00 0.00 29.99 30.31 1v5n n HIS 35 CO 0.00 0.00 0.00 -0.85 0.46 0.00 0.00 176.34 175.95 1v5n n GLU 36 N -1.28 -0.03 -0.36 1.57 0.28 0.58 0.17 120.64 121.58 1v5n n GLU 36 Ca 0.18 0.95 0.01 0.00 -0.16 0.00 0.00 57.16 58.14 1v5n n GLU 36 Cb 0.68 -1.87 0.07 0.00 1.43 0.00 0.00 31.44 31.76 1v5n n GLU 36 CO 0.00 0.00 0.00 0.93 -0.16 0.00 0.00 177.13 177.90 1v5n h GLU 37 N 0.00 -0.01 -4.72 3.44 4.39 -1.85 -3.43 114.58 112.40 1v5n h GLU 37 Ca 0.66 0.00 -0.28 0.00 0.34 0.00 0.00 59.36 60.08 1v5n h GLU 37 Cb 2.12 0.00 -0.15 0.00 -0.10 0.00 0.00 28.75 30.63 1v5n h GLU 37 CO -0.36 -0.01 -0.63 -1.01 -1.16 0.00 0.00 179.01 175.84 1v5n s HIS 38 N -6.06 1.27 -0.30 4.33 3.76 0.13 -5.14 115.29 113.27 1v5n s HIS 38 Ca -0.14 -1.21 -0.11 0.00 -0.15 0.00 0.00 55.06 53.45 1v5n s HIS 38 Cb 0.22 -0.70 -0.03 0.00 1.11 0.00 0.00 32.58 33.18 1v5n s HIS 38 CO 0.73 -0.42 0.18 -1.21 -0.85 0.00 0.00 174.74 173.17 1v5n s GLU 39 N -4.05 3.60 1.13 1.40 8.01 -1.26 -4.32 118.70 123.22 1v5n s GLU 39 Ca 0.33 -0.55 -0.18 0.00 0.01 0.00 0.00 54.97 54.58 1v5n s GLU 39 Cb 0.07 -3.63 0.14 0.00 -4.31 0.00 0.00 34.13 26.40 1v5n s GLU 39 CO 0.09 -0.33 0.13 1.28 0.01 0.00 0.00 175.26 176.45 1v5n n LEU 40 N 5.03 -2.12 -3.74 1.80 7.99 0.16 -4.47 117.00 121.65 1v5n n LEU 40 Ca -0.14 -0.21 -0.29 0.00 -0.01 0.00 0.00 56.01 55.37 1v5n n LEU 40 Cb 0.50 -0.94 -0.16 0.00 -0.11 0.00 0.00 43.42 42.71 1v5n n LEU 40 CO 0.34 -3.17 -0.36 -0.70 -1.51 0.00 0.00 177.39 171.99 1v5n s GLU 41 N -3.57 0.73 -0.77 3.23 2.12 0.95 -2.03 118.70 119.36 1v5n s GLU 41 Ca 0.54 -0.67 -0.20 0.00 0.36 0.00 0.00 54.97 55.00 1v5n s GLU 41 Cb -0.11 -2.07 -0.19 0.00 0.26 0.00 0.00 34.13 32.02 1v5n s GLU 41 CO 0.61 -0.76 1.99 -0.11 -0.54 0.00 0.00 175.26 176.45 1v5n n LEU 42 N 4.97 -0.08 -4.68 2.70 7.94 -0.74 -2.54 117.00 124.57 1v5n n LEU 42 Ca -0.07 0.01 -0.35 0.00 -1.11 0.00 0.00 56.01 54.49 1v5n n LEU 42 Cb 0.45 -0.64 -0.10 0.00 0.53 0.00 0.00 43.42 43.66 1v5n n LEU 42 CO 0.12 -0.68 -0.31 -0.89 -1.11 0.00 0.00 177.39 174.53 1v5n s THR 43 N 5.38 4.32 0.08 1.96 2.01 0.22 -4.89 115.64 124.73 1v5n s THR 43 Ca 1.04 -0.24 -0.31 0.00 0.31 0.00 0.00 61.69 62.49 1v5n s THR 43 Cb -0.90 -2.82 -0.06 0.00 0.01 0.00 0.00 72.50 68.73 1v5n s THR 43 CO 0.39 0.60 1.26 -0.13 -0.69 0.00 0.00 174.62 176.06 1v5n s ARG 44 N -0.84 4.39 -0.13 4.92 1.81 -1.26 -1.18 118.95 126.65 1v5n s ARG 44 Ca 0.13 1.87 -0.11 0.00 -1.72 0.00 0.00 55.73 55.90 1v5n s ARG 44 Cb -0.11 -3.32 0.04 0.00 -0.45 0.00 0.00 34.95 31.11 1v5n s ARG 44 CO 0.02 -0.32 0.35 0.08 -0.68 0.00 0.00 175.30 174.75 1v5n s VAL 45 N 1.09 -0.01 0.01 3.52 1.01 -1.26 -4.91 120.40 119.85 1v5n s VAL 45 Ca 0.61 0.04 -0.25 0.00 0.00 0.00 0.00 61.98 62.37 1v5n s VAL 45 Cb -0.32 -0.50 -0.18 0.00 0.00 0.00 0.00 36.38 35.39 1v5n s VAL 45 CO 0.29 0.01 1.35 -0.61 0.00 0.00 0.00 175.10 176.15 1v5n h GLN 46 N 6.09 -0.15 -2.81 2.72 4.15 -1.94 0.63 115.11 123.80 1v5n h GLN 46 Ca -0.30 0.01 -0.11 0.00 0.77 0.00 0.00 58.65 59.02 1v5n h GLN 46 Cb 1.18 0.03 -0.21 0.00 0.21 0.00 0.00 27.48 28.70 1v5n h GLN 46 CO 0.30 0.19 -0.19 0.08 -1.93 0.00 0.00 178.83 177.27 1v5n s VAL 47 N -4.78 0.04 0.17 2.39 1.01 -1.26 -3.79 120.40 114.18 1v5n s VAL 47 Ca -0.15 -0.30 -0.09 0.00 0.00 0.00 0.00 61.98 61.44 1v5n s VAL 47 Cb 0.03 -0.67 0.03 0.00 0.00 0.00 0.00 36.38 35.77 1v5n s VAL 47 CO 0.62 -0.17 0.45 0.00 0.00 0.00 0.00 175.10 176.01 1v5n n TYR 48 N 1.55 -1.50 -3.87 5.22 4.11 -1.25 -5.00 117.16 116.43 1v5n n TYR 48 Ca -0.19 -0.88 -0.30 0.00 -0.00 0.00 0.00 57.90 56.52 1v5n n TYR 48 Cb 0.56 0.44 -0.15 0.00 -0.00 0.00 0.00 39.34 40.19 1v5n n TYR 48 CO 0.00 0.00 0.00 0.99 -0.00 0.00 0.00 176.86 177.85 1v5n s THR 49 N -2.46 1.36 0.40 -3.48 2.01 -1.26 -3.68 115.64 108.53 1v5n s THR 49 Ca 0.09 -1.43 -0.27 0.00 0.31 0.00 0.00 61.69 60.39 1v5n s THR 49 Cb -0.02 -1.85 -0.10 0.00 0.01 0.00 0.00 72.50 70.53 1v5n s THR 49 CO 0.05 -0.40 1.42 0.00 -0.69 0.00 0.00 174.62 175.00 1v5n n ASP 51 N 0.25 3.34 0.03 0.00 8.00 -1.26 -3.44 116.55 123.47 1v5n n ASP 51 Ca 0.04 -3.71 0.00 0.00 0.71 0.00 0.00 54.79 51.83 1v5n n ASP 51 Cb 0.39 -0.75 0.00 0.00 -0.02 0.00 0.00 41.12 40.75 1v5n n ASP 51 CO 0.00 0.00 0.00 1.17 -0.39 0.00 0.00 177.20 177.98 1v5n n LYS 52 N -1.12 0.00 0.00 -1.24 4.81 -1.26 -4.85 118.16 114.50 1v5n n LYS 52 Ca 0.48 0.00 0.07 0.00 -0.87 0.00 0.00 58.31 57.99 1v5n n LYS 52 Cb 1.34 -0.35 -0.01 0.00 0.02 0.00 0.00 35.03 36.04 1v5n n LYS 52 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1v5n n GLU 54 N -0.21 -3.87 -3.05 0.00 4.71 -1.22 -5.05 120.64 111.96 1v5n n GLU 54 Ca 0.06 0.48 -0.12 0.00 -0.01 0.00 0.00 57.16 57.57 1v5n n GLU 54 Cb 0.31 -4.41 -0.03 0.00 -1.01 0.00 0.00 31.44 26.30 1v5n n GLU 54 CO 0.00 0.00 0.00 0.39 0.09 0.00 0.00 177.13 177.61 1v5n n GLU 55 N -2.81 0.99 -3.95 3.49 -0.58 -1.25 -4.92 120.64 111.61 1v5n n GLU 55 Ca -0.14 -1.48 -0.28 0.00 -0.42 0.00 0.00 57.16 54.83 1v5n n GLU 55 Cb 0.59 0.68 -0.17 0.00 -0.57 0.00 0.00 31.44 31.97 1v5n n GLU 55 CO 0.00 0.00 0.00 -2.00 -0.48 0.00 0.00 177.13 174.65 1v5n s GLU 56 N -2.69 1.79 0.83 3.49 2.12 -1.26 0.67 118.70 123.66 1v5n s GLU 56 Ca 0.06 -0.40 -0.06 0.00 0.36 0.00 0.00 54.97 54.94 1v5n s GLU 56 Cb 0.00 -1.82 0.17 0.00 0.26 0.00 0.00 34.13 32.75 1v5n s GLU 56 CO 0.04 -0.28 1.14 0.20 -0.54 0.00 0.00 175.26 175.83 1v5n s GLY 57 N 1.62 1.77 -0.22 -1.50 0.00 -1.24 -4.90 107.32 102.84 1v5n s GLY 57 Ca 0.04 -1.70 -0.22 0.00 0.00 0.00 0.00 44.72 42.84 1v5n s GLY 57 CO -0.09 -1.00 0.62 -0.51 0.00 0.00 0.00 173.10 172.11 1v5n s THR 58 N -3.45 0.00 -1.18 0.90 -4.23 -1.26 -3.74 115.64 102.68 1v5n s THR 58 Ca 0.71 -0.01 0.00 0.00 -1.18 0.00 0.00 61.69 61.21 1v5n s THR 58 Cb -0.03 -0.86 0.00 0.00 1.34 0.00 0.00 72.50 72.94 1v5n s THR 58 CO 0.48 -0.00 0.00 -0.38 -0.54 0.00 0.00 174.62 174.18 1v5n n ILE 59 N 2.66 -0.30 -3.65 2.99 2.08 0.22 -4.85 119.36 118.51 1v5n n ILE 59 Ca -0.14 0.00 -0.01 0.00 0.56 0.00 0.00 62.75 63.16 1v5n n ILE 59 Cb 0.56 -1.47 -0.07 0.00 -0.75 0.00 0.00 39.64 37.91 1v5n n ILE 59 CO 0.00 0.00 0.00 0.26 0.56 0.00 0.00 176.55 177.37 1v5n s TRP 60 N -2.33 -0.07 -0.30 1.39 0.23 -1.18 -4.66 118.94 112.02 1v5n s TRP 60 Ca 0.00 0.15 -0.19 0.00 -2.03 0.00 0.00 56.10 54.03 1v5n s TRP 60 Cb 0.00 0.34 0.19 0.00 0.03 0.00 0.00 33.47 34.03 1v5n s TRP 60 CO 0.00 -0.03 1.23 -1.54 0.96 0.00 0.00 176.95 177.57 1v5n s SER 61 N 0.36 -0.16 -0.69 2.95 1.04 -0.33 -4.68 113.70 112.19 1v5n s SER 61 Ca 0.02 0.21 -0.26 0.00 0.48 0.00 0.00 55.95 56.40 1v5n s SER 61 Cb -0.04 1.18 -0.00 0.00 0.10 0.00 0.00 66.02 67.26 1v5n s SER 61 CO -0.14 -0.03 1.63 -0.31 0.98 0.00 0.00 173.24 175.37 1v5n s TYR 62 N 2.16 1.94 0.17 5.02 2.02 -0.56 0.73 117.35 128.83 1v5n s TYR 62 Ca -0.00 0.40 0.06 0.00 -0.37 0.00 0.00 57.07 57.16 1v5n s TYR 62 Cb -0.02 -4.31 -0.04 0.00 -0.40 0.00 0.00 41.96 37.19 1v5n s TYR 62 CO -0.16 -2.18 0.06 -1.58 -1.57 0.00 0.00 175.55 170.12 1v5n s HIS 63 N 7.73 2.97 -0.18 2.71 5.65 -1.05 -1.67 115.29 131.44 1v5n s HIS 63 Ca 0.54 -0.09 0.00 0.00 0.25 0.00 0.00 55.06 55.77 1v5n s HIS 63 Cb -0.10 -1.43 0.01 0.00 -1.18 0.00 0.00 32.58 29.89 1v5n s HIS 63 CO 0.16 0.52 -0.17 0.00 -0.65 0.00 0.00 174.74 174.60 1v5n n ASP 65 N 4.57 1.35 0.00 0.00 5.68 -1.26 -0.57 116.55 126.32 1v5n n ASP 65 Ca -0.20 -1.52 0.00 0.00 -0.50 0.00 0.00 54.79 52.57 1v5n n ASP 65 Cb 0.50 -0.38 0.00 0.00 -1.14 0.00 0.00 41.12 40.10 1v5n n ASP 65 CO 0.00 0.00 0.00 1.21 -1.33 0.00 0.00 177.20 177.08 1v5n n GLU 66 N 0.31 2.18 -0.55 0.11 2.13 -1.26 -4.83 120.64 118.74 1v5n n GLU 66 Ca 0.00 0.00 0.04 0.00 0.66 0.00 0.00 57.16 57.86 1v5n n GLU 66 Cb 0.26 -0.79 0.06 0.00 0.27 0.00 0.00 31.44 31.24 1v5n n GLU 66 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1v5n n ASP 68 N -0.40 -1.20 -4.93 0.00 8.00 0.26 -4.90 116.55 113.39 1v5n n ASP 68 Ca 0.07 -1.00 -0.21 0.00 0.71 0.00 0.00 54.79 54.35 1v5n n ASP 68 Cb 0.75 -1.22 0.05 0.00 -0.02 0.00 0.00 41.12 40.68 1v5n n ASP 68 CO 0.00 0.00 0.00 0.12 -0.39 0.00 0.00 177.20 176.93 1v5n s PHE 69 N -3.97 2.54 -0.28 1.24 5.36 -1.22 -4.85 117.98 116.80 1v5n s PHE 69 Ca 0.19 -0.13 -0.19 0.00 -0.96 0.00 0.00 56.93 55.85 1v5n s PHE 69 Cb -0.11 -2.74 0.08 0.00 -0.34 0.00 0.00 43.02 39.92 1v5n s PHE 69 CO 0.76 -1.01 0.73 -0.51 -1.46 0.00 0.00 175.22 173.74 1v5n s ASP 70 N -4.49 -0.85 0.34 6.13 1.01 -1.22 -3.04 116.67 114.55 1v5n s ASP 70 Ca 0.59 1.42 -0.01 0.00 0.71 0.00 0.00 52.55 55.26 1v5n s ASP 70 Cb -0.09 1.38 -0.00 0.00 1.01 0.00 0.00 42.92 45.21 1v5n s ASP 70 CO 0.39 -0.23 0.45 -0.76 0.21 0.00 0.00 175.17 175.23 1v5n s LEU 71 N 1.25 1.09 0.17 1.23 1.43 -0.67 -3.99 118.68 119.19 1v5n s LEU 71 Ca -0.07 -1.51 -0.11 0.00 -1.03 0.00 0.00 54.13 51.40 1v5n s LEU 71 Cb -0.05 1.36 -0.07 0.00 0.03 0.00 0.00 46.19 47.46 1v5n s LEU 71 CO -0.14 -1.27 0.51 -1.00 0.23 0.00 0.00 176.35 174.69 1v5n s HIS 72 N -3.11 3.53 0.31 0.29 3.76 -1.26 -1.50 115.29 117.31 1v5n s HIS 72 Ca 0.32 0.92 0.03 0.00 -0.15 0.00 0.00 55.06 56.17 1v5n s HIS 72 Cb -0.00 -2.27 0.62 0.00 1.11 0.00 0.00 32.58 32.03 1v5n s HIS 72 CO 0.21 0.39 1.88 0.00 -0.85 0.00 0.00 174.74 176.37 1v5n h ALA 73 N 3.17 1.60 0.15 -1.40 0.00 -1.95 -0.57 119.26 120.26 1v5n h ALA 73 Ca -0.48 -0.00 -0.21 0.00 0.00 0.00 0.00 54.91 54.22 1v5n h ALA 73 Cb 1.18 -0.21 0.02 0.00 0.00 0.00 0.00 17.79 18.78 1v5n h ALA 73 CO 0.67 0.20 -0.91 1.57 0.00 0.00 0.00 179.25 180.79 1v5n h LYS 74 N 0.93 0.36 -0.41 0.00 2.10 -1.99 -3.00 116.57 114.56 1v5n h LYS 74 Ca 0.43 -0.58 0.07 0.00 -2.00 0.00 0.00 60.65 58.57 1v5n h LYS 74 Cb 0.42 0.21 -0.06 0.00 -0.90 0.00 0.00 32.23 31.90 1v5n h LYS 74 CO -0.20 1.27 0.02 0.00 -2.00 0.00 0.00 179.45 178.54 1v5n h ALA 76 N 1.35 1.11 0.50 0.00 0.00 -1.24 -3.19 119.26 117.79 1v5n h ALA 76 Ca 0.20 -0.23 -0.02 0.00 0.00 0.00 0.00 54.91 54.85 1v5n h ALA 76 Cb 0.28 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 17.84 1v5n h ALA 76 CO -0.32 0.59 -0.24 -0.07 0.00 0.00 0.00 179.25 179.21 1v5n h LEU 77 N 0.88 -0.57-10.40 0.00 3.38 -1.12 -3.45 115.31 104.03 1v5n h LEU 77 Ca 0.19 -0.07 -0.49 0.00 0.09 0.00 0.00 57.88 57.60 1v5n h LEU 77 Cb 0.35 0.15 0.12 0.00 0.09 0.00 0.00 40.66 41.36 1v5n h LEU 77 CO 0.00 -0.22 0.32 0.54 0.09 0.00 0.00 178.44 179.18 1v5n s ASN 78 N -4.77 4.28 -0.07 -0.43 2.20 0.68 -5.02 114.94 111.80 1v5n s ASN 78 Ca -0.14 1.32 -0.02 0.00 -0.94 0.00 0.00 52.86 53.08 1v5n s ASN 78 Cb 0.02 -2.04 -0.04 0.00 -2.00 0.00 0.00 41.25 37.19 1v5n s ASN 78 CO 0.50 -2.11 -0.08 -0.62 -2.94 0.00 0.00 177.10 171.85 1v5n n GLU 79 N -3.52 0.17 -1.32 3.55 -0.58 -1.26 -4.83 120.64 112.85 1v5n n GLU 79 Ca 0.07 0.06 -0.49 0.00 -0.42 0.00 0.00 57.16 56.38 1v5n n GLU 79 Cb 0.56 -0.95 -0.13 0.00 -0.57 0.00 0.00 31.44 30.36 1v5n n GLU 79 CO 0.00 0.00 0.00 -0.40 -0.48 0.00 0.00 177.13 176.25 1v5n n ASP 80 N -3.05 0.50 -4.36 1.62 5.75 -1.26 -4.89 116.55 110.86 1v5n n ASP 80 Ca -0.14 0.41 -0.32 0.00 -0.01 0.00 0.00 54.79 54.73 1v5n n ASP 80 Cb 0.62 -0.88 -0.15 0.00 -1.03 0.00 0.00 41.12 39.69 1v5n n ASP 80 CO 0.00 0.00 0.00 -0.89 -0.11 0.00 0.00 177.20 176.20 1v5n s THR 81 N 7.22 2.76 0.05 2.12 2.01 -1.26 -5.13 115.64 123.41 1v5n s THR 81 Ca 1.23 -0.79 0.05 0.00 0.31 0.00 0.00 61.69 62.49 1v5n s THR 81 Cb -1.33 -2.10 -0.04 0.00 0.01 0.00 0.00 72.50 69.04 1v5n s THR 81 CO 0.55 0.55 -0.08 -0.54 -0.69 0.00 0.00 174.62 174.42 1v5n s LYS 82 N -0.03 2.37 0.93 4.92 3.01 -1.26 -5.12 119.74 124.56 1v5n s LYS 82 Ca -0.05 -0.86 -0.12 0.00 -1.01 0.00 0.00 55.97 53.93 1v5n s LYS 82 Cb -0.14 -2.42 0.15 0.00 -1.01 0.00 0.00 37.83 34.40 1v5n s LYS 82 CO 0.04 0.56 1.09 -1.21 0.51 0.00 0.00 175.35 176.34 1v5n s GLU 83 N -1.83 0.99 0.12 1.68 2.02 -1.26 -4.93 118.70 115.49 1v5n s GLU 83 Ca 0.20 0.83 -0.25 0.00 0.02 0.00 0.00 54.97 55.76 1v5n s GLU 83 Cb -0.11 -1.78 -0.06 0.00 0.10 0.00 0.00 34.13 32.28 1v5n s GLU 83 CO 0.11 -2.42 1.43 1.03 0.02 0.00 0.00 175.26 175.43 1v5n h SER 84 N -1.68 -1.67 -5.00 -0.19 0.87 -2.00 -3.48 113.55 100.41 1v5n h SER 84 Ca -0.51 0.25 0.00 0.00 -1.23 0.00 0.00 61.79 60.30 1v5n h SER 84 Cb 1.29 0.73 0.00 0.00 -0.44 0.00 0.00 62.40 63.98 1v5n h SER 84 CO 0.54 -0.21 0.00 0.61 -0.53 0.00 0.00 176.83 177.24 1v5n n GLY 85 N -1.22 0.66 3.57 5.77 0.00 -1.26 -4.87 105.19 107.84 1v5n n GLY 85 Ca 0.01 -2.19 -0.27 0.00 0.00 0.00 0.00 46.02 43.56 1v5n n GLY 85 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1v5n s PRO 86 N -1.05 2.54 0.21 1.61 0.04 -1.26 -4.83 135.00 132.26 1v5n s PRO 86 Ca 0.00 -0.57 -0.17 0.00 0.04 0.00 0.00 61.00 60.30 1v5n s PRO 86 Cb 0.00 -5.12 0.21 0.00 0.04 0.00 0.00 34.50 29.63 1v5n s PRO 86 CO 0.00 -3.57 1.58 0.77 0.04 0.00 0.00 177.00 175.83 1v5n h SER 87 N 10.80 -1.07 -5.55 6.66 0.02 -2.02 -3.45 113.55 118.94 1v5n h SER 87 Ca 0.13 0.24 -0.36 0.00 -0.84 0.00 0.00 61.79 60.97 1v5n h SER 87 Cb 0.98 0.58 0.14 0.00 0.14 0.00 0.00 62.40 64.24 1v5n h SER 87 CO 1.21 -0.29 -0.66 -0.24 -1.14 0.00 0.00 176.83 175.72 1v5n n SER 88 N -5.47 -5.27 0.00 3.07 2.88 -1.26 -5.30 113.62 102.27 1v5n n SER 88 Ca 0.08 -0.53 0.00 0.00 -1.33 0.00 0.00 58.87 57.09 1v5n n SER 88 Cb 0.38 -4.80 0.00 0.00 -0.75 0.00 0.00 64.21 59.04 1v5n n SER 88 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42