#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 1.34 0.43 1.61 0.01 -1.26 -5.15 113.70 110.68 1v5n s SER 2 Ca 0.00 -0.99 -0.14 0.00 1.31 0.00 0.00 55.95 56.12 1v5n s SER 2 Cb 0.00 0.06 -0.08 0.00 0.21 0.00 0.00 66.02 66.21 1v5n s SER 2 CO 0.00 -0.41 0.86 -0.44 0.41 0.00 0.00 173.24 173.65 1v5n s SER 3 N -3.02 6.65 -1.07 2.44 0.01 -1.26 -5.01 113.70 112.44 1v5n s SER 3 Ca 0.13 1.37 -0.13 0.00 1.31 0.00 0.00 55.95 58.63 1v5n s SER 3 Cb 0.04 -2.42 0.22 0.00 0.21 0.00 0.00 66.02 64.07 1v5n s SER 3 CO -0.03 -0.42 1.15 -0.83 0.41 0.00 0.00 173.24 173.52 1v5n s GLY 4 N -2.86 2.73 -0.20 3.44 0.00 -1.26 -4.94 107.32 104.23 1v5n s GLY 4 Ca 0.56 -3.48 -0.29 0.00 0.00 0.00 0.00 44.72 41.51 1v5n s GLY 4 CO 0.27 1.62 1.03 -0.45 0.00 0.00 0.00 173.10 175.56 1v5n s SER 5 N 2.20 -0.37 0.24 1.64 0.15 -1.26 -5.14 113.70 111.15 1v5n s SER 5 Ca 0.32 0.51 -0.31 0.00 0.70 0.00 0.00 55.95 57.17 1v5n s SER 5 Cb -0.07 0.44 -0.14 0.00 -1.71 0.00 0.00 66.02 64.54 1v5n s SER 5 CO -0.06 -0.28 1.24 -0.24 1.20 0.00 0.00 173.24 175.10 1v5n n SER 6 N 1.13 2.02 -4.45 5.45 2.88 -1.26 -4.85 113.62 114.55 1v5n n SER 6 Ca -0.11 1.16 -0.41 0.00 -1.33 0.00 0.00 58.87 58.18 1v5n n SER 6 Cb 0.57 -1.34 0.01 0.00 -0.75 0.00 0.00 64.21 62.71 1v5n n SER 6 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1v5n n GLY 7 N 1.80 -1.56 2.92 0.46 0.00 -1.26 -5.00 105.19 102.55 1v5n n GLY 7 Ca 0.12 0.02 -0.12 0.00 0.00 0.00 0.00 46.02 46.03 1v5n n GLY 7 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1v5n s THR 8 N -1.52 0.01 0.03 2.61 -4.23 -1.26 -5.14 115.64 106.14 1v5n s THR 8 Ca 0.63 -0.06 -0.30 0.00 -1.18 0.00 0.00 61.69 60.78 1v5n s THR 8 Cb -0.58 -0.09 -0.04 0.00 1.34 0.00 0.00 72.50 73.13 1v5n s THR 8 CO 0.58 -0.03 1.02 -1.61 -0.54 0.00 0.00 174.62 174.04 1v5n s GLU 9 N -0.08 4.55 -0.29 3.99 2.02 -1.26 -5.02 118.70 122.60 1v5n s GLU 9 Ca -0.01 1.50 -0.14 0.00 0.02 0.00 0.00 54.97 56.34 1v5n s GLU 9 Cb -0.01 -3.42 0.14 0.00 0.10 0.00 0.00 34.13 30.93 1v5n s GLU 9 CO 0.00 -0.06 0.85 -2.00 0.02 0.00 0.00 175.26 174.08 1v5n s GLU 10 N 0.87 0.45 -1.34 1.61 2.12 -1.26 -4.98 118.70 116.17 1v5n s GLU 10 Ca 0.53 0.98 -0.12 0.00 0.36 0.00 0.00 54.97 56.72 1v5n s GLU 10 Cb -0.23 0.42 0.01 0.00 0.26 0.00 0.00 34.13 34.58 1v5n s GLU 10 CO 0.29 -0.13 0.47 0.54 -0.54 0.00 0.00 175.26 175.88 1v5n n ARG 11 N 4.68 -1.70 -0.65 4.30 3.00 -1.26 -4.77 116.66 120.26 1v5n n ARG 11 Ca -0.14 0.28 -0.04 0.00 -0.01 0.00 0.00 57.85 57.94 1v5n n ARG 11 Cb 0.54 -3.82 -0.06 0.00 0.00 0.00 0.00 32.46 29.12 1v5n n ARG 11 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.63 178.91 1v5n n LEU 12 N -4.54 5.03 -0.08 0.55 4.32 -1.26 -4.33 117.00 116.69 1v5n n LEU 12 Ca -0.23 -2.56 -0.13 0.00 -0.02 0.00 0.00 56.01 53.08 1v5n n LEU 12 Cb 0.64 -1.17 -0.05 0.00 -1.62 0.00 0.00 43.42 41.22 1v5n n LEU 12 CO 0.75 1.19 0.59 0.11 -1.22 0.00 0.00 177.39 178.81 1v5n h LYS 13 N 1.89 0.59 0.16 3.23 1.57 -2.02 -2.99 116.57 119.01 1v5n h LYS 13 Ca 0.07 -0.31 -0.26 0.00 -1.87 0.00 0.00 60.65 58.28 1v5n h LYS 13 Cb 1.13 0.01 0.02 0.00 0.08 0.00 0.00 32.23 33.46 1v5n h LYS 13 CO 0.09 0.90 -1.24 1.49 -0.57 0.00 0.00 179.45 180.12 1v5n h GLU 14 N 0.30 0.34 -0.42 3.15 4.22 -1.98 -3.36 114.58 116.83 1v5n h GLU 14 Ca 0.04 -0.57 0.06 0.00 0.08 0.00 0.00 59.36 58.97 1v5n h GLU 14 Cb 0.78 0.21 -0.09 0.00 0.50 0.00 0.00 28.75 30.16 1v5n h GLU 14 CO 0.06 1.28 -0.50 0.82 -2.18 0.00 0.00 179.01 178.48 1v5n h ILE 15 N -0.20 0.05 -0.90 2.32 1.08 -1.86 0.14 117.51 118.13 1v5n h ILE 15 Ca -0.24 0.00 0.24 0.00 -0.39 0.00 0.00 64.86 64.47 1v5n h ILE 15 Cb 1.83 0.05 -0.16 0.00 -3.07 0.00 0.00 36.82 35.47 1v5n h ILE 15 CO 0.15 0.00 0.12 -0.33 -0.69 0.00 0.00 178.15 177.40 1v5n h GLU 16 N -0.36 0.10 -0.95 2.37 4.39 -1.69 0.62 114.58 119.07 1v5n h GLU 16 Ca 0.11 -0.01 0.15 0.00 0.34 0.00 0.00 59.36 59.95 1v5n h GLU 16 Cb 0.59 -0.02 -0.09 0.00 -0.10 0.00 0.00 28.75 29.13 1v5n h GLU 16 CO -0.60 0.07 0.56 0.00 -1.16 0.00 0.00 179.01 177.88 1v5n h ALA 17 N 1.85 1.48 -0.67 3.43 0.00 -1.11 -0.85 119.26 123.39 1v5n h ALA 17 Ca 0.55 0.06 0.09 0.00 0.00 0.00 0.00 54.91 55.62 1v5n h ALA 17 Cb 1.13 -0.10 -0.07 0.00 0.00 0.00 0.00 17.79 18.74 1v5n h ALA 17 CO -0.76 0.03 0.31 0.87 0.00 0.00 0.00 179.25 179.69 1v5n h LYS 18 N 0.79 0.51 -0.41 0.00 1.79 0.49 -1.90 116.57 117.84 1v5n h LYS 18 Ca 0.51 -0.03 -0.00 0.00 -2.18 0.00 0.00 60.65 58.95 1v5n h LYS 18 Cb 0.68 -0.12 -0.02 0.00 -1.58 0.00 0.00 32.23 31.19 1v5n h LYS 18 CO -0.34 0.34 0.24 1.88 -1.08 0.00 0.00 179.45 180.49 1v5n h TYR 19 N 0.53 0.55 -1.03 -1.35 0.05 -1.09 -2.43 116.97 112.19 1v5n h TYR 19 Ca 0.33 -0.01 0.26 0.00 0.05 0.00 0.00 58.73 59.37 1v5n h TYR 19 Cb 0.37 -0.18 -0.11 0.00 1.01 0.00 0.00 36.73 37.83 1v5n h TYR 19 CO -0.13 0.40 0.64 -0.44 -1.05 0.00 0.00 178.16 177.57 1v5n h ASP 20 N 0.54 0.56 -0.37 3.88 3.32 -1.02 0.58 116.42 123.91 1v5n h ASP 20 Ca 0.15 0.11 0.08 0.00 0.02 0.00 0.00 57.03 57.39 1v5n h ASP 20 Cb 0.02 0.02 -0.02 0.00 0.22 0.00 0.00 39.33 39.57 1v5n h ASP 20 CO -0.03 0.09 0.25 -0.08 -1.72 0.00 0.00 179.24 177.76 1v5n h GLU 21 N 0.49 0.14 0.01 3.56 4.81 -1.23 0.19 114.58 122.55 1v5n h GLU 21 Ca 0.63 -0.01 -0.19 0.00 -0.13 0.00 0.00 59.36 59.66 1v5n h GLU 21 Cb 1.38 -0.03 -0.02 0.00 0.63 0.00 0.00 28.75 30.71 1v5n h GLU 21 CO -0.39 0.09 -0.89 0.82 -0.73 0.00 0.00 179.01 177.91 1v5n h ILE 22 N 0.15 1.61 -0.69 2.32 2.04 0.09 -3.25 117.51 119.77 1v5n h ILE 22 Ca 0.17 -2.98 -0.42 0.00 1.00 0.00 0.00 64.86 62.63 1v5n h ILE 22 Cb 0.48 2.62 -0.25 0.00 -0.74 0.00 0.00 36.82 38.94 1v5n h ILE 22 CO -0.02 0.85 0.14 0.00 0.00 0.00 0.00 178.15 179.12 1v5n n ALA 23 N -2.39 5.16 -0.14 1.87 0.00 -0.15 -4.70 120.51 120.17 1v5n n ALA 23 Ca -0.01 -3.30 -0.08 0.00 0.00 0.00 0.00 53.44 50.05 1v5n n ALA 23 Cb 0.84 -1.03 0.01 0.00 0.00 0.00 0.00 19.45 19.26 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 1.44 0.56 0.00 0.00 1.57 -1.08 -3.06 116.57 116.00 1v5n h LYS 24 Ca 0.42 -0.03 -0.27 0.00 -1.87 0.00 0.00 60.65 58.89 1v5n h LYS 24 Cb 1.68 -0.13 -0.05 0.00 0.08 0.00 0.00 32.23 33.82 1v5n h LYS 24 CO 0.87 0.37 -1.62 -0.44 -0.57 0.00 0.00 179.45 178.06 1v5n h ASP 25 N 0.57 0.00 -1.63 0.86 5.19 -1.87 -3.47 116.42 116.07 1v5n h ASP 25 Ca 0.15 0.00 -0.71 0.00 -0.62 0.00 0.00 57.03 55.86 1v5n h ASP 25 Cb -0.06 0.00 0.03 0.00 0.18 0.00 0.00 39.33 39.48 1v5n h ASP 25 CO -0.03 0.95 0.74 0.79 -3.12 0.00 0.00 179.24 178.57 1v5n n TRP 26 N -3.05 1.87 -1.21 4.55 7.02 -1.16 -4.93 117.44 120.54 1v5n n TRP 26 Ca -0.15 0.54 -0.30 0.00 -1.02 0.00 0.00 57.50 56.58 1v5n n TRP 26 Cb 1.02 -2.42 0.14 0.00 -2.42 0.00 0.00 31.31 27.62 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 2.39 1.25 -0.02 -0.99 0.04 -1.26 -4.99 135.00 131.42 1v5n s PRO 27 Ca 0.93 0.82 -0.01 0.00 0.04 0.00 0.00 61.00 62.77 1v5n s PRO 27 Cb -1.00 -1.81 -0.27 0.00 0.04 0.00 0.00 34.50 31.46 1v5n s PRO 27 CO 0.57 -2.25 0.75 0.87 0.04 0.00 0.00 177.00 176.99 1v5n h LYS 28 N -1.55 0.22 -4.75 4.56 1.79 -1.94 -3.43 116.57 111.47 1v5n h LYS 28 Ca -0.49 -0.37 -0.62 0.00 -2.18 0.00 0.00 60.65 56.98 1v5n h LYS 28 Cb 1.28 0.14 -0.36 0.00 -1.58 0.00 0.00 32.23 31.71 1v5n h LYS 28 CO 0.55 1.04 -0.83 0.15 -1.08 0.00 0.00 179.45 179.28 1v5n s LYS 29 N -2.61 2.42 0.04 3.15 -0.14 -1.26 -2.08 119.74 119.27 1v5n s LYS 29 Ca -0.10 -0.69 0.08 0.00 -1.36 0.00 0.00 55.97 53.89 1v5n s LYS 29 Cb 0.07 -2.29 -0.03 0.00 -1.68 0.00 0.00 37.83 33.90 1v5n s LYS 29 CO 0.83 -0.27 -0.23 0.54 -0.76 0.00 0.00 175.35 175.47 1v5n s VAL 30 N 1.41 1.83 -0.45 3.17 0.11 -0.90 -4.90 120.40 120.67 1v5n s VAL 30 Ca 0.04 -1.26 -0.11 0.00 -2.93 0.00 0.00 61.98 57.72 1v5n s VAL 30 Cb -0.14 -1.58 0.09 0.00 -1.53 0.00 0.00 36.38 33.23 1v5n s VAL 30 CO -0.11 0.27 0.33 -0.75 -3.33 0.00 0.00 175.10 171.51 1v5n s LYS 31 N -1.18 2.66 0.61 1.54 2.20 -1.26 0.18 119.74 124.50 1v5n s LYS 31 Ca 0.09 -1.55 -0.12 0.00 -0.36 0.00 0.00 55.97 54.03 1v5n s LYS 31 Cb -0.09 -3.92 -0.04 0.00 -1.51 0.00 0.00 37.83 32.26 1v5n s LYS 31 CO 0.02 -1.07 1.03 -1.58 -0.36 0.00 0.00 175.35 173.39 1v5n s HIS 32 N 1.46 3.59 -0.02 4.03 5.65 -1.26 -4.85 115.29 123.89 1v5n s HIS 32 Ca 0.04 1.31 -0.25 0.00 0.25 0.00 0.00 55.06 56.41 1v5n s HIS 32 Cb -0.25 -2.73 -0.20 0.00 -1.18 0.00 0.00 32.58 28.22 1v5n s HIS 32 CO 0.02 -0.67 1.25 -0.24 -0.65 0.00 0.00 174.74 174.46 1v5n h VAL 33 N -0.19 1.40 0.00 0.89 3.04 -1.94 1.79 116.25 121.24 1v5n h VAL 33 Ca -0.44 -1.23 -0.01 0.00 -1.01 0.00 0.00 66.70 64.00 1v5n h VAL 33 Cb 1.19 2.19 -0.00 0.00 -2.01 0.00 0.00 31.29 32.66 1v5n h VAL 33 CO 0.62 0.33 -0.07 -0.07 -1.01 0.00 0.00 177.57 177.36 1v5n h LEU 34 N -0.45 0.00 -2.88 3.16 3.38 -2.00 -2.43 115.31 114.11 1v5n h LEU 34 Ca 0.00 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 1v5n h LEU 34 Cb 0.54 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.27 1v5n h LEU 34 CO 0.01 0.07 -0.24 1.57 0.09 0.00 0.00 178.44 179.94 1v5n n HIS 35 N -3.50 0.00 -0.55 1.13 -0.00 -1.16 -4.81 115.22 106.32 1v5n n HIS 35 Ca -0.02 -0.97 0.44 0.00 0.46 0.00 0.00 57.72 57.63 1v5n n HIS 35 Cb 0.20 -0.16 0.71 0.00 -0.12 0.00 0.00 29.99 30.61 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 -1.08 -0.02 -0.35 1.57 0.28 0.61 -0.48 120.64 121.16 1v5n n GLU 36 Ca 0.14 1.13 0.04 0.00 -0.16 0.00 0.00 57.16 58.30 1v5n n GLU 36 Cb 0.69 -2.37 0.10 0.00 1.43 0.00 0.00 31.44 31.29 1v5n n GLU 36 CO 0.00 0.00 0.00 0.39 -0.16 0.00 0.00 177.13 177.36 1v5n n GLU 37 N -4.28 -0.13 -4.33 3.44 4.71 -1.26 -4.63 120.64 114.15 1v5n n GLU 37 Ca 0.40 1.49 -0.17 0.00 -0.01 0.00 0.00 57.16 58.86 1v5n n GLU 37 Cb 1.68 -2.21 -0.10 0.00 -1.01 0.00 0.00 31.44 29.80 1v5n n GLU 37 CO 0.00 0.00 0.00 -1.01 0.09 0.00 0.00 177.13 176.21 1v5n s HIS 38 N -6.11 1.56 -0.24 -0.32 3.76 0.36 -5.14 115.29 109.17 1v5n s HIS 38 Ca -0.14 -1.25 -0.10 0.00 -0.15 0.00 0.00 55.06 53.43 1v5n s HIS 38 Cb 0.24 -0.89 -0.05 0.00 1.11 0.00 0.00 32.58 32.99 1v5n s HIS 38 CO 0.72 -0.40 0.14 -1.21 -0.85 0.00 0.00 174.74 173.14 1v5n s GLU 39 N -3.96 3.98 1.18 1.40 2.02 -1.26 -4.33 118.70 117.73 1v5n s GLU 39 Ca 0.37 -0.32 -0.13 0.00 0.02 0.00 0.00 54.97 54.91 1v5n s GLU 39 Cb 0.07 -3.48 0.29 0.00 0.10 0.00 0.00 34.13 31.11 1v5n s GLU 39 CO 0.15 0.02 1.02 -0.51 0.02 0.00 0.00 175.26 175.96 1v5n s LEU 40 N 1.14 0.71 -0.35 1.80 2.01 0.48 -4.62 118.68 119.85 1v5n s LEU 40 Ca 0.07 1.49 -0.00 0.00 0.01 0.00 0.00 54.13 55.69 1v5n s LEU 40 Cb -0.14 -3.36 0.12 0.00 0.01 0.00 0.00 46.19 42.81 1v5n s LEU 40 CO 0.05 -4.29 0.16 -0.70 1.01 0.00 0.00 176.35 172.57 1v5n s GLU 41 N -4.45 0.82 -0.57 1.70 2.12 0.19 -2.11 118.70 116.39 1v5n s GLU 41 Ca 0.69 -1.34 -0.20 0.00 0.36 0.00 0.00 54.97 54.47 1v5n s GLU 41 Cb -0.25 -1.93 -0.13 0.00 0.26 0.00 0.00 34.13 32.07 1v5n s GLU 41 CO 0.65 -1.07 1.62 -0.11 -0.54 0.00 0.00 175.26 175.80 1v5n n LEU 42 N 4.39 0.22 -4.50 2.70 7.94 -0.88 -3.02 117.00 123.85 1v5n n LEU 42 Ca 0.03 0.16 -0.33 0.00 -1.11 0.00 0.00 56.01 54.75 1v5n n LEU 42 Cb 0.39 -0.57 -0.13 0.00 0.53 0.00 0.00 43.42 43.65 1v5n n LEU 42 CO 0.15 -0.45 -0.44 -0.89 -1.11 0.00 0.00 177.39 174.65 1v5n s THR 43 N 5.29 3.20 0.04 1.96 2.01 0.73 -4.89 115.64 123.98 1v5n s THR 43 Ca 0.83 -0.67 -0.30 0.00 0.31 0.00 0.00 61.69 61.85 1v5n s THR 43 Cb -0.80 -2.27 -0.06 0.00 0.01 0.00 0.00 72.50 69.38 1v5n s THR 43 CO 0.32 0.59 1.35 -0.13 -0.69 0.00 0.00 174.62 176.06 1v5n s ARG 44 N -0.71 4.32 -0.03 4.92 1.81 -1.26 -2.00 118.95 126.01 1v5n s ARG 44 Ca 0.11 1.95 -0.05 0.00 -1.72 0.00 0.00 55.73 56.02 1v5n s ARG 44 Cb -0.11 -3.45 0.01 0.00 -0.45 0.00 0.00 34.95 30.95 1v5n s ARG 44 CO 0.01 -0.48 0.12 0.08 -0.68 0.00 0.00 175.30 174.34 1v5n s VAL 45 N 1.83 0.03 -0.01 3.52 1.01 -1.26 -4.95 120.40 120.57 1v5n s VAL 45 Ca 0.63 -0.23 -0.25 0.00 0.00 0.00 0.00 61.98 62.13 1v5n s VAL 45 Cb -0.32 -0.24 -0.19 0.00 0.00 0.00 0.00 36.38 35.62 1v5n s VAL 45 CO 0.28 -0.13 1.29 -0.61 0.00 0.00 0.00 175.10 175.93 1v5n h GLN 46 N 5.47 0.08 -2.34 2.72 5.75 -1.95 -0.88 115.11 123.95 1v5n h GLN 46 Ca -0.27 -0.04 -0.08 0.00 -0.15 0.00 0.00 58.65 58.11 1v5n h GLN 46 Cb 1.20 0.00 -0.21 0.00 1.07 0.00 0.00 27.48 29.55 1v5n h GLN 46 CO 0.42 0.54 0.01 0.08 -2.65 0.00 0.00 178.83 177.23 1v5n s VAL 47 N -4.28 0.01 0.20 2.39 1.01 -1.26 -4.18 120.40 114.29 1v5n s VAL 47 Ca -0.16 -0.10 -0.06 0.00 0.00 0.00 0.00 61.98 61.67 1v5n s VAL 47 Cb 0.02 -0.85 0.02 0.00 0.00 0.00 0.00 36.38 35.58 1v5n s VAL 47 CO 0.69 -0.05 0.37 0.00 0.00 0.00 0.00 175.10 176.10 1v5n n TYR 48 N 1.74 -1.53 -3.87 5.22 4.11 -1.25 -5.02 117.16 116.56 1v5n n TYR 48 Ca -0.17 -1.00 -0.28 0.00 -0.00 0.00 0.00 57.90 56.45 1v5n n TYR 48 Cb 0.56 0.43 -0.16 0.00 -0.00 0.00 0.00 39.34 40.17 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 -2.57 1.01 0.06 -3.48 2.01 -1.26 -3.77 115.64 107.64 1v5n s THR 49 Ca 0.10 -0.60 -0.31 0.00 0.31 0.00 0.00 61.69 61.18 1v5n s THR 49 Cb -0.02 -1.23 -0.06 0.00 0.01 0.00 0.00 72.50 71.20 1v5n s THR 49 CO 0.07 0.08 1.24 0.00 -0.69 0.00 0.00 174.62 175.33 1v5n n ASP 51 N 4.06 3.49 0.01 0.00 9.92 -1.26 -2.75 116.55 130.02 1v5n n ASP 51 Ca 0.10 -2.69 -0.00 0.00 -0.53 0.00 0.00 54.79 51.66 1v5n n ASP 51 Cb 0.45 -0.64 -0.00 0.00 -0.64 0.00 0.00 41.12 40.29 1v5n n ASP 51 CO 0.00 0.00 0.00 1.17 0.13 0.00 0.00 177.20 178.50 1v5n n LYS 52 N -0.04 0.01 -0.15 -1.24 4.81 -1.26 -4.80 118.16 115.49 1v5n n LYS 52 Ca 0.24 0.00 0.11 0.00 -0.87 0.00 0.00 58.31 57.80 1v5n n LYS 52 Cb 0.96 -0.17 0.28 0.00 0.02 0.00 0.00 35.03 36.11 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 0.99 -7.35 -4.59 0.00 1.02 -1.11 -4.99 120.64 104.60 1v5n n GLU 54 Ca 0.18 0.77 -0.27 0.00 -0.02 0.00 0.00 57.16 57.82 1v5n n GLU 54 Cb 0.48 -5.79 -0.11 0.00 -0.02 0.00 0.00 31.44 26.01 1v5n n GLU 54 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 1v5n s GLU 55 N -6.40 1.90 -0.17 3.49 0.41 -1.24 -4.90 118.70 111.79 1v5n s GLU 55 Ca 0.61 -2.06 -0.01 0.00 -0.41 0.00 0.00 54.97 53.10 1v5n s GLU 55 Cb -0.28 -1.56 -0.01 0.00 -1.78 0.00 0.00 34.13 30.50 1v5n s GLU 55 CO 0.76 -0.03 -0.11 -2.00 -0.49 0.00 0.00 175.26 173.39 1v5n s GLU 56 N -3.71 3.35 0.56 1.61 2.12 -1.26 0.42 118.70 121.79 1v5n s GLU 56 Ca 0.35 -0.68 0.01 0.00 0.36 0.00 0.00 54.97 55.01 1v5n s GLU 56 Cb 0.09 -2.76 0.11 0.00 0.26 0.00 0.00 34.13 31.83 1v5n s GLU 56 CO 0.17 0.04 0.77 0.41 -0.54 0.00 0.00 175.26 176.11 1v5n n GLY 57 N 4.05 0.85 3.63 -1.50 0.00 -1.25 -4.94 105.19 106.03 1v5n n GLY 57 Ca -0.18 -2.04 -0.14 0.00 0.00 0.00 0.00 46.02 43.66 1v5n n GLY 57 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1v5n s THR 58 N -2.33 0.00 -1.72 2.61 -4.23 -1.26 -3.92 115.64 104.79 1v5n s THR 58 Ca 0.52 0.00 0.00 0.00 -1.18 0.00 0.00 61.69 61.03 1v5n s THR 58 Cb -0.03 -1.00 0.00 0.00 1.34 0.00 0.00 72.50 72.81 1v5n s THR 58 CO 0.34 0.00 0.00 -0.38 -0.54 0.00 0.00 174.62 174.04 1v5n n ILE 59 N 2.56 -0.43 0.00 2.99 2.08 -0.33 -4.88 119.36 121.34 1v5n n ILE 59 Ca -0.14 0.00 0.00 0.00 0.56 0.00 0.00 62.75 63.17 1v5n n ILE 59 Cb 0.55 -2.13 0.00 0.00 -0.75 0.00 0.00 39.64 37.31 1v5n n ILE 59 CO 0.00 0.00 0.00 0.79 0.56 0.00 0.00 176.55 177.90 1v5n n TRP 60 N -2.99 0.00 -3.29 1.39 5.03 -1.24 -4.76 117.44 111.57 1v5n n TRP 60 Ca -0.20 0.00 0.03 0.00 3.03 0.00 0.00 57.50 60.36 1v5n n TRP 60 Cb 0.63 0.00 -0.03 0.00 -1.03 0.00 0.00 31.31 30.87 1v5n n TRP 60 CO 0.00 0.00 0.00 -1.12 -0.03 0.00 0.00 177.69 176.54 1v5n s SER 61 N 0.00 -0.49 -0.67 -0.99 0.01 -0.85 -4.76 113.70 105.95 1v5n s SER 61 Ca 0.00 0.55 -0.26 0.00 1.31 0.00 0.00 55.95 57.54 1v5n s SER 61 Cb 0.00 1.51 -0.01 0.00 0.21 0.00 0.00 66.02 67.73 1v5n s SER 61 CO 0.00 -0.09 1.69 -0.31 0.41 0.00 0.00 173.24 174.94 1v5n s TYR 62 N 2.54 1.86 0.12 2.43 2.02 -1.00 -0.19 117.35 125.12 1v5n s TYR 62 Ca -0.01 0.51 0.04 0.00 -0.37 0.00 0.00 57.07 57.24 1v5n s TYR 62 Cb -0.07 -4.25 -0.04 0.00 -0.40 0.00 0.00 41.96 37.20 1v5n s TYR 62 CO -0.16 -2.22 0.11 -1.58 -1.57 0.00 0.00 175.55 170.14 1v5n s HIS 63 N 8.10 3.18 -0.16 2.71 5.65 -1.17 -2.35 115.29 131.25 1v5n s HIS 63 Ca 0.58 0.04 -0.03 0.00 0.25 0.00 0.00 55.06 55.89 1v5n s HIS 63 Cb -0.11 -1.57 -0.02 0.00 -1.18 0.00 0.00 32.58 29.70 1v5n s HIS 63 CO 0.18 0.52 -0.05 0.00 -0.65 0.00 0.00 174.74 174.73 1v5n n ASP 65 N 3.71 3.07 0.04 0.00 2.03 -1.26 -1.08 116.55 123.06 1v5n n ASP 65 Ca -0.18 -2.12 0.00 0.00 0.52 0.00 0.00 54.79 53.01 1v5n n ASP 65 Cb 0.52 -0.53 0.00 0.00 -0.72 0.00 0.00 41.12 40.39 1v5n n ASP 65 CO 0.00 0.00 0.00 1.21 -1.92 0.00 0.00 177.20 176.49 1v5n n GLU 66 N 0.38 0.00 -0.01 -0.67 0.00 -1.26 -4.91 120.64 114.17 1v5n n GLU 66 Ca 0.05 0.00 0.07 0.00 0.00 0.00 0.00 57.16 57.27 1v5n n GLU 66 Cb 0.59 -0.13 -0.10 0.00 0.00 0.00 0.00 31.44 31.80 1v5n n GLU 66 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1v5n n ASP 68 N -1.86 -2.50 -4.63 0.00 -0.08 -0.24 -5.00 116.55 102.25 1v5n n ASP 68 Ca -0.02 -0.15 -0.39 0.00 -1.51 0.00 0.00 54.79 52.73 1v5n n ASP 68 Cb 0.32 -1.65 -0.08 0.00 2.34 0.00 0.00 41.12 42.05 1v5n n ASP 68 CO 0.00 0.00 0.00 0.12 0.12 0.00 0.00 177.20 177.44 1v5n s PHE 69 N -3.09 3.29 0.14 -0.67 5.36 -1.26 -4.75 117.98 117.00 1v5n s PHE 69 Ca 0.07 0.49 0.03 0.00 -0.96 0.00 0.00 56.93 56.56 1v5n s PHE 69 Cb -0.03 -2.56 -0.04 0.00 -0.34 0.00 0.00 43.02 40.06 1v5n s PHE 69 CO 0.18 -0.15 0.19 -0.51 -1.46 0.00 0.00 175.22 173.47 1v5n s ASP 70 N 1.42 5.89 0.38 6.13 1.11 -1.24 -2.47 116.67 127.88 1v5n s ASP 70 Ca 0.16 0.03 -0.14 0.00 0.18 0.00 0.00 52.55 52.79 1v5n s ASP 70 Cb -0.15 -1.66 0.05 0.00 1.07 0.00 0.00 42.92 42.22 1v5n s ASP 70 CO 0.09 0.09 0.75 -0.76 1.18 0.00 0.00 175.17 176.52 1v5n s LEU 71 N -2.99 0.13 0.26 1.23 1.43 -0.99 -4.37 118.68 113.37 1v5n s LEU 71 Ca 0.32 -1.19 -0.02 0.00 -1.03 0.00 0.00 54.13 52.21 1v5n s LEU 71 Cb -0.11 2.69 -0.04 0.00 0.03 0.00 0.00 46.19 48.75 1v5n s LEU 71 CO 0.25 -1.65 0.47 -1.00 0.23 0.00 0.00 176.35 174.66 1v5n s HIS 72 N -2.38 3.48 0.17 0.29 3.76 -1.26 -2.38 115.29 116.96 1v5n s HIS 72 Ca 0.17 0.44 -0.15 0.00 -0.15 0.00 0.00 55.06 55.38 1v5n s HIS 72 Cb -0.05 -1.94 0.05 0.00 1.11 0.00 0.00 32.58 31.75 1v5n s HIS 72 CO 0.13 0.27 1.82 0.00 -0.85 0.00 0.00 174.74 176.10 1v5n h ALA 73 N 1.69 0.59 -0.10 -1.40 0.00 -1.98 0.57 119.26 118.63 1v5n h ALA 73 Ca -0.48 -0.02 -0.20 0.00 0.00 0.00 0.00 54.91 54.21 1v5n h ALA 73 Cb 1.20 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.82 1v5n h ALA 73 CO 0.66 0.01 -0.75 1.57 0.00 0.00 0.00 179.25 180.74 1v5n h LYS 74 N 0.60 0.53 -0.49 0.00 2.10 -1.95 -1.75 116.57 115.62 1v5n h LYS 74 Ca 0.18 -0.44 -0.03 0.00 -2.00 0.00 0.00 60.65 58.36 1v5n h LYS 74 Cb -0.04 0.09 -0.02 0.00 -0.90 0.00 0.00 32.23 31.36 1v5n h LYS 74 CO -0.05 1.07 0.19 0.00 -2.00 0.00 0.00 179.45 178.65 1v5n h ALA 76 N 1.04 0.37 0.48 0.00 0.00 -0.91 -3.33 119.26 116.91 1v5n h ALA 76 Ca 0.16 -0.49 -0.02 0.00 0.00 0.00 0.00 54.91 54.56 1v5n h ALA 76 Cb 0.21 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.94 1v5n h ALA 76 CO -0.01 0.54 -0.23 -0.07 0.00 0.00 0.00 179.25 179.47 1v5n h LEU 77 N 0.46 -0.55 -9.89 0.00 3.38 -1.20 -3.45 115.31 104.07 1v5n h LEU 77 Ca 0.00 -0.08 -0.62 0.00 0.09 0.00 0.00 57.88 57.28 1v5n h LEU 77 Cb 1.09 0.14 -0.04 0.00 0.09 0.00 0.00 40.66 41.94 1v5n h LEU 77 CO 0.11 -0.18 -0.47 0.21 0.09 0.00 0.00 178.44 178.19 1v5n s ASN 78 N -4.80 6.38 -0.23 -0.43 2.47 0.91 -5.08 114.94 114.16 1v5n s ASN 78 Ca -0.14 0.33 -0.08 0.00 0.42 0.00 0.00 52.86 53.40 1v5n s ASN 78 Cb 0.02 -1.99 -0.04 0.00 -1.45 0.00 0.00 41.25 37.79 1v5n s ASN 78 CO 0.49 0.18 0.08 -0.70 -3.72 0.00 0.00 177.10 173.43 1v5n s GLU 79 N -2.38 3.80 -0.49 0.43 2.12 -1.26 -4.39 118.70 116.53 1v5n s GLU 79 Ca 0.34 -0.41 0.03 0.00 0.36 0.00 0.00 54.97 55.28 1v5n s GLU 79 Cb -0.13 -3.33 0.15 0.00 0.26 0.00 0.00 34.13 31.08 1v5n s GLU 79 CO 0.25 -0.03 0.30 0.34 -0.54 0.00 0.00 175.26 175.59 1v5n s ASP 80 N 1.21 3.59 -0.56 -1.70 -1.08 -1.26 -5.07 116.67 111.80 1v5n s ASP 80 Ca 0.05 -2.95 -0.28 0.00 -0.52 0.00 0.00 52.55 48.85 1v5n s ASP 80 Cb -0.14 -1.10 -0.10 0.00 -1.46 0.00 0.00 42.92 40.12 1v5n s ASP 80 CO 0.04 -0.22 2.44 0.35 0.52 0.00 0.00 175.17 178.30 1v5n n THR 81 N 3.12 -0.02 -2.51 1.71 -2.24 -1.26 -4.76 114.28 108.31 1v5n n THR 81 Ca 0.14 -0.58 -0.12 0.00 -2.27 0.00 0.00 64.05 61.22 1v5n n THR 81 Cb 0.36 -2.26 0.03 0.00 -2.10 0.00 0.00 70.33 66.37 1v5n n THR 81 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1v5n n LYS 82 N 8.83 2.44 -0.98 -0.78 5.02 -1.26 -5.11 118.16 126.33 1v5n n LYS 82 Ca 0.42 -3.79 -0.35 0.00 -2.02 0.00 0.00 58.31 52.57 1v5n n LYS 82 Cb 0.42 -1.84 0.07 0.00 -0.02 0.00 0.00 35.03 33.65 1v5n n LYS 82 CO 0.00 0.00 0.00 -1.91 -0.52 0.00 0.00 177.40 174.97 1v5n n GLU 83 N -0.56 -0.07 -3.81 1.97 2.13 -1.26 -5.01 120.64 114.04 1v5n n GLU 83 Ca 0.23 0.00 -0.02 0.00 0.66 0.00 0.00 57.16 58.03 1v5n n GLU 83 Cb 0.85 -1.45 0.00 0.00 0.27 0.00 0.00 31.44 31.11 1v5n n GLU 83 CO 0.00 0.00 0.00 0.45 -0.41 0.00 0.00 177.13 177.17 1v5n s SER 84 N -1.46 -0.07 0.08 4.31 0.15 -1.26 -5.14 113.70 110.31 1v5n s SER 84 Ca 0.51 -0.50 -0.31 0.00 0.70 0.00 0.00 55.95 56.36 1v5n s SER 84 Cb -0.24 0.44 -0.07 0.00 -1.71 0.00 0.00 66.02 64.44 1v5n s SER 84 CO 0.72 -0.85 1.36 -0.83 1.20 0.00 0.00 173.24 174.84 1v5n s GLY 85 N -3.21 2.03 0.00 9.45 0.00 -1.26 -4.88 107.32 109.44 1v5n s GLY 85 Ca 0.18 1.01 0.15 0.00 0.00 0.00 0.00 44.72 46.05 1v5n s GLY 85 CO 0.03 2.33 1.29 -1.55 0.00 0.00 0.00 173.10 175.20 1v5n n PRO 86 N 4.31 0.49 -3.60 2.90 -0.04 -1.26 -4.20 135.00 133.60 1v5n n PRO 86 Ca 0.11 0.00 -0.38 0.00 -0.04 0.00 0.00 63.50 63.19 1v5n n PRO 86 Cb 0.43 -1.47 -0.06 0.00 -0.04 0.00 0.00 33.50 32.37 1v5n n PRO 86 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1v5n s SER 87 N -1.97 6.00 0.06 3.54 0.15 -1.26 -4.75 113.70 115.46 1v5n s SER 87 Ca 0.22 -3.42 0.00 0.00 0.70 0.00 0.00 55.95 53.45 1v5n s SER 87 Cb 0.10 -1.95 0.00 0.00 -1.71 0.00 0.00 66.02 62.46 1v5n s SER 87 CO 0.17 -0.27 0.00 -0.24 1.20 0.00 0.00 173.24 174.10 1v5n n SER 88 N 2.78 0.29 0.00 5.45 2.88 -1.26 -5.25 113.62 118.50 1v5n n SER 88 Ca 0.18 0.09 0.00 0.00 -1.33 0.00 0.00 58.87 57.81 1v5n n SER 88 Cb 0.38 -0.05 0.00 0.00 -0.75 0.00 0.00 64.21 63.79 1v5n n SER 88 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42