#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 3.00 -0.03 1.61 0.01 -1.26 -5.10 113.70 111.93 1v5n s SER 2 Ca 0.00 -0.59 -0.30 0.00 1.31 0.00 0.00 55.95 56.36 1v5n s SER 2 Cb 0.00 -1.39 0.11 0.00 0.21 0.00 0.00 66.02 64.95 1v5n s SER 2 CO 0.00 0.02 1.14 -0.94 0.41 0.00 0.00 173.24 173.87 1v5n s SER 3 N 1.12 -0.15 0.00 2.44 1.04 -1.26 -5.16 113.70 111.73 1v5n s SER 3 Ca -0.00 -0.13 0.00 0.00 0.48 0.00 0.00 55.95 56.30 1v5n s SER 3 Cb -0.14 0.25 0.00 0.00 0.10 0.00 0.00 66.02 66.23 1v5n s SER 3 CO -0.08 -0.45 0.00 0.61 0.98 0.00 0.00 173.24 174.31 1v5n n GLY 4 N -0.33 -0.74 3.32 7.32 0.00 -1.26 -5.16 105.19 108.34 1v5n n GLY 4 Ca -0.05 0.65 -0.13 0.00 0.00 0.00 0.00 46.02 46.48 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 -0.41 0.83 1.61 0.15 -1.26 -5.16 113.70 111.45 1v5n s SER 5 Ca 0.00 0.71 -0.10 0.00 0.70 0.00 0.00 55.95 57.26 1v5n s SER 5 Cb 0.00 0.75 0.09 0.00 -1.71 0.00 0.00 66.02 65.15 1v5n s SER 5 CO 0.00 -0.23 1.11 -0.55 1.20 0.00 0.00 173.24 174.77 1v5n s SER 6 N -0.15 3.91 0.00 5.45 0.15 -1.26 -4.88 113.70 116.92 1v5n s SER 6 Ca -0.03 1.96 0.00 0.00 0.70 0.00 0.00 55.95 58.57 1v5n s SER 6 Cb -0.03 -2.54 0.00 0.00 -1.71 0.00 0.00 66.02 61.74 1v5n s SER 6 CO 0.02 -2.44 0.00 0.61 1.20 0.00 0.00 173.24 172.63 1v5n n GLY 7 N -0.69 -0.32 3.30 9.45 0.00 -1.26 -5.13 105.19 110.54 1v5n n GLY 7 Ca 0.10 -1.25 -0.19 0.00 0.00 0.00 0.00 46.02 44.68 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 -0.60 0.08 1.02 2.61 -4.23 -1.26 -5.15 115.64 108.11 1v5n s THR 8 Ca 0.00 -2.00 -0.11 0.00 -1.18 0.00 0.00 61.69 58.40 1v5n s THR 8 Cb 0.00 -2.48 0.21 0.00 1.34 0.00 0.00 72.50 71.56 1v5n s THR 8 CO 0.00 0.00 1.09 -0.70 -0.54 0.00 0.00 174.62 174.47 1v5n s GLU 9 N -3.60 0.16 -0.78 3.99 2.12 -1.26 -3.56 118.70 115.76 1v5n s GLU 9 Ca 0.38 1.24 0.00 0.00 0.36 0.00 0.00 54.97 56.95 1v5n s GLU 9 Cb 0.03 -1.65 0.00 0.00 0.26 0.00 0.00 34.13 32.77 1v5n s GLU 9 CO 0.23 -3.12 0.00 0.39 -0.54 0.00 0.00 175.26 172.23 1v5n n GLU 10 N -4.54 -0.62 0.00 4.30 -0.58 -1.26 -4.83 120.64 113.12 1v5n n GLU 10 Ca 0.08 0.58 0.00 0.00 -0.42 0.00 0.00 57.16 57.40 1v5n n GLU 10 Cb 0.53 -4.49 0.00 0.00 -0.57 0.00 0.00 31.44 26.91 1v5n n GLU 10 CO 0.00 0.00 0.00 0.54 -0.48 0.00 0.00 177.13 177.19 1v5n n ARG 11 N -2.25 0.00 -0.82 3.49 1.74 -1.23 -5.05 116.66 112.54 1v5n n ARG 11 Ca -0.09 0.00 -0.25 0.00 -0.77 0.00 0.00 57.85 56.74 1v5n n ARG 11 Cb 0.43 -0.54 -0.08 0.00 -1.02 0.00 0.00 32.46 31.25 1v5n n ARG 11 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 1v5n n LEU 12 N -1.91 0.20 -0.09 0.55 7.99 -1.26 -4.77 117.00 117.71 1v5n n LEU 12 Ca 0.00 0.14 -0.12 0.00 -0.01 0.00 0.00 56.01 56.02 1v5n n LEU 12 Cb 0.13 -0.52 -0.05 0.00 -0.11 0.00 0.00 43.42 42.87 1v5n n LEU 12 CO 0.00 -0.41 -0.61 1.17 -1.51 0.00 0.00 177.39 176.03 1v5n n LYS 13 N 4.69 0.51 -0.10 3.23 3.00 -1.26 -4.12 118.16 124.11 1v5n n LYS 13 Ca 0.36 0.42 -0.08 0.00 -0.00 0.00 0.00 58.31 59.01 1v5n n LYS 13 Cb 0.01 -1.61 -0.00 0.00 0.00 0.00 0.00 35.03 33.42 1v5n n LYS 13 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.40 178.89 1v5n h GLU 14 N -1.00 0.43 -0.51 1.64 4.81 -2.01 -2.86 114.58 115.08 1v5n h GLU 14 Ca -0.16 -0.03 0.08 0.00 -0.13 0.00 0.00 59.36 59.12 1v5n h GLU 14 Cb 0.93 -0.10 -0.10 0.00 0.63 0.00 0.00 28.75 30.12 1v5n h GLU 14 CO -0.10 0.28 -0.44 0.82 -0.73 0.00 0.00 179.01 178.85 1v5n h ILE 15 N 0.44 0.09 -0.34 2.32 1.08 -1.96 -0.91 117.51 118.23 1v5n h ILE 15 Ca 0.13 0.00 0.07 0.00 -0.39 0.00 0.00 64.86 64.68 1v5n h ILE 15 Cb -0.02 0.09 -0.07 0.00 -3.07 0.00 0.00 36.82 33.75 1v5n h ILE 15 CO -0.05 0.00 -0.14 -0.33 -0.69 0.00 0.00 178.15 176.94 1v5n h GLU 16 N -0.27 -0.07 -0.94 2.37 5.08 -1.68 -1.16 114.58 117.91 1v5n h GLU 16 Ca 0.16 0.01 0.28 0.00 -1.00 0.00 0.00 59.36 58.81 1v5n h GLU 16 Cb 0.57 0.02 -0.16 0.00 0.50 0.00 0.00 28.75 29.68 1v5n h GLU 16 CO -0.64 -0.05 0.30 0.00 -1.00 0.00 0.00 179.01 177.62 1v5n h ALA 17 N 1.21 1.51 -0.71 3.43 0.00 -0.96 0.53 119.26 124.28 1v5n h ALA 17 Ca 0.17 0.25 0.08 0.00 0.00 0.00 0.00 54.91 55.40 1v5n h ALA 17 Cb 0.34 0.34 -0.06 0.00 0.00 0.00 0.00 17.79 18.41 1v5n h ALA 17 CO -0.40 -0.57 0.38 0.87 0.00 0.00 0.00 179.25 179.53 1v5n h LYS 18 N 0.16 0.65 -0.08 0.00 1.79 -0.78 -2.43 116.57 115.89 1v5n h LYS 18 Ca 0.64 -0.04 -0.01 0.00 -2.18 0.00 0.00 60.65 59.06 1v5n h LYS 18 Cb 1.40 -0.15 -0.00 0.00 -1.58 0.00 0.00 32.23 31.90 1v5n h LYS 18 CO -0.71 0.43 0.00 1.88 -1.08 0.00 0.00 179.45 179.98 1v5n h TYR 19 N 0.67 0.15 -1.03 -1.35 0.05 0.06 -2.95 116.97 112.57 1v5n h TYR 19 Ca 0.33 -0.02 0.28 0.00 0.05 0.00 0.00 58.73 59.36 1v5n h TYR 19 Cb 0.27 -0.04 -0.12 0.00 1.01 0.00 0.00 36.73 37.85 1v5n h TYR 19 CO -0.09 0.39 0.63 -0.44 -1.05 0.00 0.00 178.16 177.60 1v5n h ASP 20 N -0.13 0.56 -0.16 3.88 3.32 -0.86 0.76 116.42 123.79 1v5n h ASP 20 Ca 0.02 0.13 0.02 0.00 0.02 0.00 0.00 57.03 57.23 1v5n h ASP 20 Cb 0.32 0.05 -0.01 0.00 0.22 0.00 0.00 39.33 39.91 1v5n h ASP 20 CO 0.00 0.04 0.11 -0.08 -1.72 0.00 0.00 179.24 177.59 1v5n h GLU 21 N 0.45 0.11 0.03 3.56 4.57 -1.27 -0.24 114.58 121.80 1v5n h GLU 21 Ca 0.66 -0.01 -0.22 0.00 -1.18 0.00 0.00 59.36 58.61 1v5n h GLU 21 Cb 1.47 -0.02 -0.01 0.00 -0.16 0.00 0.00 28.75 30.02 1v5n h GLU 21 CO -0.44 0.07 -0.98 0.82 -1.18 0.00 0.00 179.01 177.30 1v5n h ILE 22 N 0.11 1.53 -0.78 2.32 2.04 0.46 -3.27 117.51 119.93 1v5n h ILE 22 Ca 0.07 -2.85 -0.50 0.00 1.00 0.00 0.00 64.86 62.58 1v5n h ILE 22 Cb 0.14 2.63 -0.28 0.00 -0.74 0.00 0.00 36.82 38.58 1v5n h ILE 22 CO -0.01 0.83 0.24 0.00 0.00 0.00 0.00 178.15 179.21 1v5n n ALA 23 N -2.46 5.43 -0.16 1.87 0.00 -0.52 -4.68 120.51 119.99 1v5n n ALA 23 Ca -0.04 -3.35 -0.08 0.00 0.00 0.00 0.00 53.44 49.97 1v5n n ALA 23 Cb 0.88 -1.15 0.01 0.00 0.00 0.00 0.00 19.45 19.19 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 1.59 0.67 0.00 0.00 1.57 -1.14 -3.12 116.57 116.14 1v5n h LYS 24 Ca 0.47 -0.08 -0.29 0.00 -1.87 0.00 0.00 60.65 58.88 1v5n h LYS 24 Cb 1.57 -0.13 -0.05 0.00 0.08 0.00 0.00 32.23 33.70 1v5n h LYS 24 CO 1.03 0.54 -1.70 -0.25 -0.57 0.00 0.00 179.45 178.49 1v5n n ASP 25 N -4.66 0.87 -4.66 0.86 8.00 -1.26 -4.92 116.55 110.78 1v5n n ASP 25 Ca 0.02 0.41 -0.56 0.00 0.71 0.00 0.00 54.79 55.37 1v5n n ASP 25 Cb 0.09 -0.05 -0.07 0.00 -0.02 0.00 0.00 41.12 41.07 1v5n n ASP 25 CO 0.00 0.00 0.00 0.79 -0.39 0.00 0.00 177.20 177.60 1v5n n TRP 26 N -3.04 1.77 -1.21 1.24 7.02 -1.18 -4.92 117.44 117.12 1v5n n TRP 26 Ca -0.17 0.62 -0.30 0.00 -1.02 0.00 0.00 57.50 56.63 1v5n n TRP 26 Cb 1.04 -2.39 0.14 0.00 -2.42 0.00 0.00 31.31 27.69 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 2.13 1.28 -0.04 -0.99 0.04 -1.26 -4.99 135.00 131.17 1v5n s PRO 27 Ca 0.93 0.82 -0.01 0.00 0.04 0.00 0.00 61.00 62.78 1v5n s PRO 27 Cb -1.04 -1.81 -0.26 0.00 0.04 0.00 0.00 34.50 31.42 1v5n s PRO 27 CO 0.58 -2.22 0.68 0.87 0.04 0.00 0.00 177.00 176.95 1v5n h LYS 28 N -1.54 0.20 -5.32 4.56 1.79 -1.94 -3.42 116.57 110.90 1v5n h LYS 28 Ca -0.49 -0.34 -0.68 0.00 -2.18 0.00 0.00 60.65 56.96 1v5n h LYS 28 Cb 1.28 0.13 -0.32 0.00 -1.58 0.00 0.00 32.23 31.74 1v5n h LYS 28 CO 0.55 1.00 -0.86 0.15 -1.08 0.00 0.00 179.45 179.21 1v5n s LYS 29 N -2.60 3.10 0.04 3.15 -0.14 -1.26 -1.76 119.74 120.28 1v5n s LYS 29 Ca -0.12 -0.84 0.08 0.00 -1.36 0.00 0.00 55.97 53.73 1v5n s LYS 29 Cb 0.07 -2.38 -0.03 0.00 -1.68 0.00 0.00 37.83 33.82 1v5n s LYS 29 CO 0.82 0.16 -0.24 0.54 -0.76 0.00 0.00 175.35 175.87 1v5n s VAL 30 N 0.41 1.93 -0.86 3.17 0.11 -0.50 -4.96 120.40 119.70 1v5n s VAL 30 Ca -0.16 -1.30 -0.04 0.00 -2.93 0.00 0.00 61.98 57.55 1v5n s VAL 30 Cb -0.17 -1.66 0.22 0.00 -1.53 0.00 0.00 36.38 33.23 1v5n s VAL 30 CO 0.07 0.30 0.75 -0.75 -3.33 0.00 0.00 175.10 172.14 1v5n s LYS 31 N -1.20 3.28 0.77 1.54 2.47 -1.26 -0.60 119.74 124.74 1v5n s LYS 31 Ca 0.10 -3.05 -0.11 0.00 -1.56 0.00 0.00 55.97 51.35 1v5n s LYS 31 Cb -0.09 -4.03 0.05 0.00 -1.46 0.00 0.00 37.83 32.30 1v5n s LYS 31 CO 0.02 -1.25 1.08 -1.58 0.16 0.00 0.00 175.35 173.78 1v5n s HIS 32 N -0.94 2.80 -0.01 4.03 5.65 -1.26 -4.91 115.29 120.64 1v5n s HIS 32 Ca 0.25 1.37 -0.16 0.00 0.25 0.00 0.00 55.06 56.77 1v5n s HIS 32 Cb -0.11 -3.02 -0.33 0.00 -1.18 0.00 0.00 32.58 27.94 1v5n s HIS 32 CO -0.10 -1.67 0.87 -0.24 -0.65 0.00 0.00 174.74 172.96 1v5n h VAL 33 N -1.03 1.24 0.00 0.89 3.04 -1.96 -0.61 116.25 117.83 1v5n h VAL 33 Ca -0.45 -2.60 -0.03 0.00 -1.01 0.00 0.00 66.70 62.61 1v5n h VAL 33 Cb 1.24 3.00 -0.00 0.00 -2.01 0.00 0.00 31.29 33.51 1v5n h VAL 33 CO 0.56 0.79 -0.15 -0.07 -1.01 0.00 0.00 177.57 177.69 1v5n h LEU 34 N -0.01 0.00 -2.98 3.16 3.38 -1.99 -2.58 115.31 114.28 1v5n h LEU 34 Ca -0.25 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.71 1v5n h LEU 34 Cb 2.01 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.75 1v5n h LEU 34 CO 0.21 0.15 -0.31 1.57 0.09 0.00 0.00 178.44 180.15 1v5n n HIS 35 N -4.01 0.00 -0.25 1.13 -0.00 -1.24 -4.82 115.22 106.03 1v5n n HIS 35 Ca -0.02 -1.25 0.22 0.00 0.46 0.00 0.00 57.72 57.13 1v5n n HIS 35 Cb 0.23 -0.20 0.41 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 -1.19 -0.05 -0.22 1.57 -0.00 -0.24 -0.43 120.64 120.09 1v5n n GLU 36 Ca 0.17 1.06 0.02 0.00 -0.00 0.00 0.00 57.16 58.40 1v5n n GLU 36 Cb 0.68 -1.87 0.05 0.00 -0.00 0.00 0.00 31.44 30.31 1v5n n GLU 36 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.13 177.52 1v5n n GLU 37 N -4.76 -0.09 -4.18 3.44 -0.58 -1.26 -4.59 120.64 108.62 1v5n n GLU 37 Ca 0.27 0.90 -0.19 0.00 -0.42 0.00 0.00 57.16 57.72 1v5n n GLU 37 Cb 0.92 -1.34 -0.08 0.00 -0.57 0.00 0.00 31.44 30.37 1v5n n GLU 37 CO 0.00 0.00 0.00 0.72 -0.48 0.00 0.00 177.13 177.37 1v5n n HIS 38 N -4.90 -0.71 -3.77 -0.32 8.25 0.43 -5.14 115.22 109.04 1v5n n HIS 38 Ca 0.08 -2.72 -0.37 0.00 -0.26 0.00 0.00 57.72 54.45 1v5n n HIS 38 Cb 0.26 0.26 -0.13 0.00 1.12 0.00 0.00 29.99 31.51 1v5n n HIS 38 CO 0.00 0.00 0.00 -1.21 0.64 0.00 0.00 176.34 175.77 1v5n s GLU 39 N -3.33 3.25 1.08 -0.41 2.02 -1.26 -4.50 118.70 115.55 1v5n s GLU 39 Ca 0.38 -0.74 -0.12 0.00 0.02 0.00 0.00 54.97 54.50 1v5n s GLU 39 Cb 0.02 -3.32 0.23 0.00 0.10 0.00 0.00 34.13 31.16 1v5n s GLU 39 CO 0.27 -0.36 1.01 1.28 0.02 0.00 0.00 175.26 177.48 1v5n n LEU 40 N 4.87 0.28 -3.99 1.80 7.99 0.23 -4.58 117.00 123.60 1v5n n LEU 40 Ca -0.15 0.06 -0.26 0.00 -0.01 0.00 0.00 56.01 55.65 1v5n n LEU 40 Cb 0.49 -1.33 -0.17 0.00 -0.11 0.00 0.00 43.42 42.31 1v5n n LEU 40 CO 0.31 -2.89 -0.46 -0.70 -1.51 0.00 0.00 177.39 172.14 1v5n s GLU 41 N -4.43 1.76 -0.78 3.23 -6.30 0.68 -1.41 118.70 111.44 1v5n s GLU 41 Ca 0.67 -0.40 -0.24 0.00 -2.50 0.00 0.00 54.97 52.51 1v5n s GLU 41 Cb -0.24 -1.57 -0.17 0.00 0.00 0.00 0.00 34.13 32.14 1v5n s GLU 41 CO 0.63 -0.09 2.42 -0.11 0.02 0.00 0.00 175.26 178.13 1v5n n LEU 42 N 4.26 1.01 -4.79 2.70 7.94 -0.72 -0.43 117.00 126.96 1v5n n LEU 42 Ca -0.19 -0.68 -0.36 0.00 -1.11 0.00 0.00 56.01 53.67 1v5n n LEU 42 Cb 0.51 -1.27 -0.07 0.00 0.53 0.00 0.00 43.42 43.12 1v5n n LEU 42 CO 0.22 -1.70 -0.20 -0.89 -1.11 0.00 0.00 177.39 173.71 1v5n s THR 43 N 10.00 5.23 0.05 1.96 2.01 0.25 -4.89 115.64 130.26 1v5n s THR 43 Ca 1.11 0.11 -0.31 0.00 0.31 0.00 0.00 61.69 62.92 1v5n s THR 43 Cb -0.51 -3.30 -0.06 0.00 0.01 0.00 0.00 72.50 68.64 1v5n s THR 43 CO 0.31 0.56 1.27 -0.13 -0.69 0.00 0.00 174.62 175.94 1v5n s ARG 44 N -0.55 4.38 -0.12 4.92 1.81 -1.26 -1.27 118.95 126.85 1v5n s ARG 44 Ca 0.12 1.85 -0.11 0.00 -1.72 0.00 0.00 55.73 55.87 1v5n s ARG 44 Cb -0.12 -3.37 0.03 0.00 -0.45 0.00 0.00 34.95 31.04 1v5n s ARG 44 CO 0.02 -0.36 0.32 0.08 -0.68 0.00 0.00 175.30 174.69 1v5n s VAL 45 N 1.35 -0.00 -0.01 3.52 1.01 -1.26 -4.91 120.40 120.09 1v5n s VAL 45 Ca 0.60 0.01 -0.25 0.00 0.00 0.00 0.00 61.98 62.34 1v5n s VAL 45 Cb -0.31 -0.46 -0.20 0.00 0.00 0.00 0.00 36.38 35.42 1v5n s VAL 45 CO 0.28 0.00 1.28 -0.61 0.00 0.00 0.00 175.10 176.06 1v5n h GLN 46 N 5.77 0.04 -2.83 2.72 4.15 -1.93 0.91 115.11 123.94 1v5n h GLN 46 Ca -0.27 -0.02 -0.11 0.00 0.77 0.00 0.00 58.65 59.02 1v5n h GLN 46 Cb 1.19 0.00 -0.20 0.00 0.21 0.00 0.00 27.48 28.67 1v5n h GLN 46 CO 0.31 0.51 -0.19 0.08 -1.93 0.00 0.00 178.83 177.61 1v5n s VAL 47 N -4.28 0.04 0.14 2.39 1.01 -1.26 -3.81 120.40 114.64 1v5n s VAL 47 Ca -0.16 -0.34 -0.10 0.00 0.00 0.00 0.00 61.98 61.39 1v5n s VAL 47 Cb 0.02 -0.67 0.04 0.00 0.00 0.00 0.00 36.38 35.77 1v5n s VAL 47 CO 0.68 -0.19 0.49 0.00 0.00 0.00 0.00 175.10 176.09 1v5n n TYR 48 N 1.41 -1.28 -3.86 5.22 4.11 -1.26 -5.00 117.16 116.51 1v5n n TYR 48 Ca -0.20 -0.79 -0.30 0.00 -0.00 0.00 0.00 57.90 56.61 1v5n n TYR 48 Cb 0.56 0.39 -0.16 0.00 -0.00 0.00 0.00 39.34 40.14 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 -2.40 1.25 0.67 -3.48 2.01 -1.26 -3.69 115.64 108.75 1v5n s THR 49 Ca 0.10 -1.24 -0.17 0.00 0.31 0.00 0.00 61.69 60.69 1v5n s THR 49 Cb -0.02 -1.70 0.00 0.00 0.01 0.00 0.00 72.50 70.79 1v5n s THR 49 CO 0.04 -0.31 1.27 0.00 -0.69 0.00 0.00 174.62 174.93 1v5n n ASP 51 N -2.15 3.04 0.05 0.00 8.00 -1.24 -3.73 116.55 120.52 1v5n n ASP 51 Ca 0.15 -3.59 0.00 0.00 0.71 0.00 0.00 54.79 52.06 1v5n n ASP 51 Cb 0.49 -0.66 0.00 0.00 -0.02 0.00 0.00 41.12 40.93 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 -0.97 0.00 0.00 -1.24 4.81 -1.26 -4.84 118.16 114.66 1v5n n LYS 52 Ca 0.36 0.00 0.11 0.00 -0.87 0.00 0.00 58.31 57.90 1v5n n LYS 52 Cb 1.13 -0.34 -0.00 0.00 0.02 0.00 0.00 35.03 35.84 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 -0.00 -1.53 -3.44 0.00 1.02 -1.24 -5.01 120.64 110.43 1v5n n GLU 54 Ca 0.09 0.70 -0.21 0.00 -0.02 0.00 0.00 57.16 57.72 1v5n n GLU 54 Cb 0.45 -5.01 -0.01 0.00 -0.02 0.00 0.00 31.44 26.86 1v5n n GLU 54 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 1v5n n GLU 55 N -2.51 0.87 -4.18 3.49 1.02 -1.26 -4.87 120.64 113.20 1v5n n GLU 55 Ca -0.16 -2.75 -0.31 0.00 -0.02 0.00 0.00 57.16 53.92 1v5n n GLU 55 Cb 0.62 0.36 -0.16 0.00 -0.02 0.00 0.00 31.44 32.24 1v5n n GLU 55 CO 0.00 0.00 0.00 -2.00 1.18 0.00 0.00 177.13 176.31 1v5n s GLU 56 N -3.74 2.62 0.05 3.49 2.12 -1.26 0.01 118.70 121.98 1v5n s GLU 56 Ca 0.21 -0.69 -0.00 0.00 0.36 0.00 0.00 54.97 54.85 1v5n s GLU 56 Cb -0.02 -2.28 0.01 0.00 0.26 0.00 0.00 34.13 32.10 1v5n s GLU 56 CO 0.14 -0.18 0.06 0.41 -0.54 0.00 0.00 175.26 175.15 1v5n n GLY 57 N 4.57 -0.13 3.62 -1.50 0.00 -1.24 -4.91 105.19 105.60 1v5n n GLY 57 Ca -0.19 -1.83 -0.11 0.00 0.00 0.00 0.00 46.02 43.90 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 -0.51 0.00 -0.99 2.61 -4.23 -1.26 -4.00 115.64 107.26 1v5n s THR 58 Ca 0.04 0.00 0.00 0.00 -1.18 0.00 0.00 61.69 60.55 1v5n s THR 58 Cb -0.00 -1.00 0.00 0.00 1.34 0.00 0.00 72.50 72.84 1v5n s THR 58 CO 0.03 0.00 0.00 -0.38 -0.54 0.00 0.00 174.62 173.73 1v5n n ILE 59 N 1.94 -0.25 -3.65 2.99 2.08 0.32 -4.83 119.36 117.96 1v5n n ILE 59 Ca -0.13 0.00 -0.01 0.00 0.56 0.00 0.00 62.75 63.17 1v5n n ILE 59 Cb 0.56 -1.23 -0.07 0.00 -0.75 0.00 0.00 39.64 38.15 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 -2.20 -0.04 -0.30 1.39 0.23 -1.17 -4.66 118.94 112.19 1v5n s TRP 60 Ca 0.00 0.10 -0.19 0.00 -2.03 0.00 0.00 56.10 53.98 1v5n s TRP 60 Cb 0.00 0.38 0.19 0.00 0.03 0.00 0.00 33.47 34.07 1v5n s TRP 60 CO 0.00 -0.02 1.26 -1.54 0.96 0.00 0.00 176.95 177.61 1v5n s SER 61 N 0.26 -0.11 -0.71 2.95 1.04 -0.40 -4.68 113.70 112.05 1v5n s SER 61 Ca 0.04 0.15 -0.26 0.00 0.48 0.00 0.00 55.95 56.36 1v5n s SER 61 Cb -0.04 1.13 0.00 0.00 0.10 0.00 0.00 66.02 67.20 1v5n s SER 61 CO -0.15 -0.02 1.61 -0.31 0.98 0.00 0.00 173.24 175.36 1v5n s TYR 62 N 2.09 1.97 0.12 5.02 2.02 -0.85 0.87 117.35 128.58 1v5n s TYR 62 Ca 0.00 0.34 0.05 0.00 -0.37 0.00 0.00 57.07 57.09 1v5n s TYR 62 Cb -0.01 -4.34 -0.04 0.00 -0.40 0.00 0.00 41.96 37.17 1v5n s TYR 62 CO -0.16 -2.15 0.06 -1.58 -1.57 0.00 0.00 175.55 170.15 1v5n s HIS 63 N 7.59 3.07 -0.20 2.71 5.65 0.42 -1.89 115.29 132.64 1v5n s HIS 63 Ca 0.53 -0.01 -0.00 0.00 0.25 0.00 0.00 55.06 55.83 1v5n s HIS 63 Cb -0.09 -1.53 0.02 0.00 -1.18 0.00 0.00 32.58 29.79 1v5n s HIS 63 CO 0.15 0.51 -0.14 0.00 -0.65 0.00 0.00 174.74 174.60 1v5n n ASP 65 N 4.65 3.47 0.00 0.00 2.03 -1.26 -0.44 116.55 125.00 1v5n n ASP 65 Ca -0.19 -1.90 0.00 0.00 0.52 0.00 0.00 54.79 53.22 1v5n n ASP 65 Cb 0.49 -0.69 0.00 0.00 -0.72 0.00 0.00 41.12 40.20 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 1.18 0.36 0.00 -0.67 4.07 -1.26 -4.88 120.64 119.44 1v5n n GLU 66 Ca 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.10 1v5n n GLU 66 Cb 0.40 -0.63 0.00 0.00 -0.06 0.00 0.00 31.44 31.15 1v5n n GLU 66 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 1v5n n ASP 68 N -0.48 -3.56 -4.94 0.00 2.03 0.42 -5.01 116.55 105.02 1v5n n ASP 68 Ca 0.00 -0.44 -0.20 0.00 0.52 0.00 0.00 54.79 54.66 1v5n n ASP 68 Cb 0.02 -3.61 0.05 0.00 -0.72 0.00 0.00 41.12 36.86 1v5n n ASP 68 CO 0.00 0.00 0.00 0.12 -1.92 0.00 0.00 177.20 175.40 1v5n s PHE 69 N -3.25 2.43 -0.28 -0.67 5.36 -1.24 -4.86 117.98 115.46 1v5n s PHE 69 Ca 0.15 -0.24 -0.13 0.00 -0.96 0.00 0.00 56.93 55.75 1v5n s PHE 69 Cb -0.02 -2.64 0.10 0.00 -0.34 0.00 0.00 43.02 40.12 1v5n s PHE 69 CO 0.49 -0.96 0.66 -0.51 -1.46 0.00 0.00 175.22 173.44 1v5n s ASP 70 N -4.50 -1.01 0.36 6.13 1.01 -1.22 -3.26 116.67 114.18 1v5n s ASP 70 Ca 0.59 1.52 0.05 0.00 0.71 0.00 0.00 52.55 55.42 1v5n s ASP 70 Cb -0.09 1.77 -0.03 0.00 1.01 0.00 0.00 42.92 45.59 1v5n s ASP 70 CO 0.38 -0.23 0.21 -0.76 0.21 0.00 0.00 175.17 174.98 1v5n s LEU 71 N 2.21 1.83 0.12 1.23 1.43 -0.79 -3.72 118.68 120.97 1v5n s LEU 71 Ca -0.08 -1.71 -0.05 0.00 -1.03 0.00 0.00 54.13 51.25 1v5n s LEU 71 Cb -0.08 0.26 -0.05 0.00 0.03 0.00 0.00 46.19 46.34 1v5n s LEU 71 CO -0.19 -1.00 0.36 -1.00 0.23 0.00 0.00 176.35 174.75 1v5n s HIS 72 N -3.37 3.50 0.31 0.29 3.76 -1.26 -2.01 115.29 116.50 1v5n s HIS 72 Ca 0.33 0.58 0.06 0.00 -0.15 0.00 0.00 55.06 55.88 1v5n s HIS 72 Cb 0.03 -2.02 0.72 0.00 1.11 0.00 0.00 32.58 32.42 1v5n s HIS 72 CO 0.21 0.47 1.80 0.00 -0.85 0.00 0.00 174.74 176.37 1v5n h ALA 73 N 3.08 1.68 0.20 -1.40 0.00 -1.96 0.13 119.26 120.99 1v5n h ALA 73 Ca -0.47 0.06 -0.27 0.00 0.00 0.00 0.00 54.91 54.23 1v5n h ALA 73 Cb 1.17 -0.11 0.03 0.00 0.00 0.00 0.00 17.79 18.88 1v5n h ALA 73 CO 0.71 -0.01 -1.18 1.57 0.00 0.00 0.00 179.25 180.34 1v5n h LYS 74 N 0.80 0.44 -0.78 0.00 2.10 -1.94 -2.97 116.57 114.23 1v5n h LYS 74 Ca 0.55 -0.74 0.10 0.00 -2.00 0.00 0.00 60.65 58.55 1v5n h LYS 74 Cb 0.81 0.28 -0.07 0.00 -0.90 0.00 0.00 32.23 32.34 1v5n h LYS 74 CO -0.33 1.36 0.42 0.00 -2.00 0.00 0.00 179.45 178.89 1v5n h ALA 76 N 1.45 0.42 0.31 0.00 0.00 -1.11 -3.35 119.26 116.98 1v5n h ALA 76 Ca 0.38 -0.36 -0.02 0.00 0.00 0.00 0.00 54.91 54.92 1v5n h ALA 76 Cb 0.39 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.09 1v5n h ALA 76 CO -0.27 0.36 -0.15 -0.07 0.00 0.00 0.00 179.25 179.13 1v5n h LEU 77 N 0.39 -0.35-10.41 0.00 3.38 -1.20 -3.46 115.31 103.67 1v5n h LEU 77 Ca 0.06 0.01 -0.44 0.00 0.09 0.00 0.00 57.88 57.60 1v5n h LEU 77 Cb 0.75 0.09 0.03 0.00 0.09 0.00 0.00 40.66 41.62 1v5n h LEU 77 CO 0.05 -0.13 -0.16 0.20 0.09 0.00 0.00 178.44 178.49 1v5n s ASN 78 N -3.66 5.66 -0.07 -0.43 0.01 0.22 -5.09 114.94 111.59 1v5n s ASN 78 Ca -0.06 -0.04 0.00 0.00 -0.71 0.00 0.00 52.86 52.05 1v5n s ASN 78 Cb 0.01 -1.11 0.02 0.00 0.41 0.00 0.00 41.25 40.58 1v5n s ASN 78 CO 0.18 -0.79 -0.04 -1.61 -1.51 0.00 0.00 177.10 173.33 1v5n s GLU 79 N -4.50 0.96 -0.14 -0.60 8.01 -1.26 -4.30 118.70 116.88 1v5n s GLU 79 Ca 0.51 -0.10 -0.05 0.00 0.01 0.00 0.00 54.97 55.34 1v5n s GLU 79 Cb -0.10 -1.05 -0.04 0.00 -4.31 0.00 0.00 34.13 28.63 1v5n s GLU 79 CO 0.36 -0.17 0.05 0.34 0.01 0.00 0.00 175.26 175.86 1v5n s ASP 80 N 1.33 5.62 0.00 -0.19 2.15 -1.26 -4.98 116.67 119.33 1v5n s ASP 80 Ca -0.04 0.17 0.26 0.00 0.43 0.00 0.00 52.55 53.37 1v5n s ASP 80 Cb -0.14 -1.83 0.71 0.00 -0.30 0.00 0.00 42.92 41.37 1v5n s ASP 80 CO -0.02 0.28 1.54 0.41 -0.17 0.00 0.00 175.17 177.21 1v5n n THR 81 N 2.79 0.00 -3.64 1.71 -1.04 -1.26 -4.84 114.28 108.00 1v5n n THR 81 Ca -0.18 -0.06 -0.05 0.00 -2.04 0.00 0.00 64.05 61.72 1v5n n THR 81 Cb 0.53 0.25 -0.06 0.00 -1.82 0.00 0.00 70.33 69.23 1v5n n THR 81 CO 0.00 0.00 0.00 -0.75 -0.64 0.00 0.00 175.07 173.68 1v5n s LYS 82 N -2.74 0.66 -1.17 -2.82 2.36 -1.26 -5.08 119.74 109.69 1v5n s LYS 82 Ca 0.18 1.28 -0.21 0.00 -2.55 0.00 0.00 55.97 54.67 1v5n s LYS 82 Cb 0.19 0.34 -0.01 0.00 -1.05 0.00 0.00 37.83 37.30 1v5n s LYS 82 CO 0.60 -0.17 1.80 -2.00 1.55 0.00 0.00 175.35 177.13 1v5n s GLU 83 N 1.99 3.20 -0.82 4.03 2.12 -1.26 -4.91 118.70 123.05 1v5n s GLU 83 Ca -0.09 -1.35 -0.23 0.00 0.36 0.00 0.00 54.97 53.66 1v5n s GLU 83 Cb -0.07 -5.34 0.07 0.00 0.26 0.00 0.00 34.13 29.04 1v5n s GLU 83 CO -0.19 -3.03 1.19 -1.54 -0.54 0.00 0.00 175.26 171.15 1v5n s SER 84 N 5.66 6.34 -0.30 -1.70 1.04 -1.26 -4.90 113.70 118.57 1v5n s SER 84 Ca 0.60 -1.17 -0.07 0.00 0.48 0.00 0.00 55.95 55.80 1v5n s SER 84 Cb 0.00 -2.49 0.18 0.00 0.10 0.00 0.00 66.02 63.82 1v5n s SER 84 CO 0.06 -1.48 0.83 -0.83 0.98 0.00 0.00 173.24 172.80 1v5n s GLY 85 N 3.99 -0.72 1.07 7.32 0.00 -1.26 -5.10 107.32 112.61 1v5n s GLY 85 Ca 0.33 2.22 -0.14 0.00 0.00 0.00 0.00 44.72 47.13 1v5n s GLY 85 CO 0.03 3.64 1.10 2.56 0.00 0.00 0.00 173.10 180.43 1v5n s PRO 86 N 2.91 -0.13 -0.56 2.90 0.04 -1.26 -4.79 135.00 134.09 1v5n s PRO 86 Ca 0.11 0.32 -0.35 0.00 0.04 0.00 0.00 61.00 61.12 1v5n s PRO 86 Cb -0.12 -1.69 -0.15 0.00 0.04 0.00 0.00 34.50 32.58 1v5n s PRO 86 CO -0.17 -3.07 2.34 0.43 0.04 0.00 0.00 177.00 176.57 1v5n n SER 87 N -4.38 1.40 -3.51 6.66 7.64 -1.26 -0.58 113.62 119.60 1v5n n SER 87 Ca 0.07 0.28 -0.19 0.00 1.01 0.00 0.00 58.87 60.04 1v5n n SER 87 Cb 0.58 -1.14 0.06 0.00 -1.01 0.00 0.00 64.21 62.70 1v5n n SER 87 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 1v5n n SER 88 N 10.37 -2.96 0.00 6.43 2.88 -1.26 -5.35 113.62 123.73 1v5n n SER 88 Ca 0.50 -0.74 0.00 0.00 -1.33 0.00 0.00 58.87 57.29 1v5n n SER 88 Cb 0.17 -4.62 0.00 0.00 -0.75 0.00 0.00 64.21 59.01 1v5n n SER 88 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42