#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1v5u s SER 2 N 0.00 3.90 -0.20 1.61 0.01 -1.26 -4.92 113.70 112.84 1v5u s SER 2 Ca 0.00 -1.35 -0.10 0.00 1.31 0.00 0.00 55.95 55.81 1v5u s SER 2 Cb 0.00 -1.12 0.01 0.00 0.21 0.00 0.00 66.02 65.13 1v5u s SER 2 CO 0.00 -0.29 0.20 -0.24 0.41 0.00 0.00 173.24 173.32 1v5u n SER 3 N 4.69 -6.78 -4.75 2.44 2.88 -1.26 -4.81 113.62 106.03 1v5u n SER 3 Ca -0.08 0.51 -0.41 0.00 -1.33 0.00 0.00 58.87 57.56 1v5u n SER 3 Cb 0.44 -2.75 0.00 0.00 -0.75 0.00 0.00 64.21 61.15 1v5u n SER 3 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1v5u n GLY 4 N 0.70 0.99 2.18 0.46 0.00 -1.26 -4.82 105.19 103.43 1v5u n GLY 4 Ca -0.01 0.29 0.00 0.00 0.00 0.00 0.00 46.02 46.30 1v5u n GLY 4 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1v5u n SER 5 N 0.44 -3.19 0.05 1.61 2.88 -1.26 -4.98 113.62 109.17 1v5u n SER 5 Ca 0.03 0.74 -0.09 0.00 -1.33 0.00 0.00 58.87 58.22 1v5u n SER 5 Cb 0.38 3.04 -0.07 0.00 -0.75 0.00 0.00 64.21 66.82 1v5u n SER 5 CO 0.00 0.00 0.00 0.28 -1.23 0.00 0.00 175.04 174.09 1v5u h SER 6 N 0.00 -0.18 0.00 -3.46 0.02 -1.93 -3.48 113.55 104.51 1v5u h SER 6 Ca 0.00 -0.32 0.00 0.00 -0.84 0.00 0.00 61.79 60.63 1v5u h SER 6 Cb 0.00 0.05 0.00 0.00 0.14 0.00 0.00 62.40 62.59 1v5u h SER 6 CO 0.00 0.39 0.00 0.61 -1.14 0.00 0.00 176.83 176.69 1v5u n GLY 7 N 0.80 2.84 3.64 -3.77 0.00 -1.26 -4.96 105.19 102.49 1v5u n GLY 7 Ca -0.07 -0.77 -0.03 0.00 0.00 0.00 0.00 46.02 45.15 1v5u n GLY 7 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1v5u s ARG 8 N 0.00 0.43 0.48 1.61 0.52 -1.26 -5.15 118.95 115.59 1v5u s ARG 8 Ca 0.00 0.72 0.00 0.00 -0.52 0.00 0.00 55.73 55.93 1v5u s ARG 8 Cb 0.00 0.09 0.00 0.00 0.52 0.00 0.00 34.95 35.56 1v5u s ARG 8 CO 0.00 -0.09 0.00 0.45 0.02 0.00 0.00 175.30 175.68 1v5u n SER 9 N 3.68 -6.10 -4.70 0.23 2.88 -1.26 -4.98 113.62 103.37 1v5u n SER 9 Ca -0.18 1.13 -0.24 0.00 -1.33 0.00 0.00 58.87 58.25 1v5u n SER 9 Cb 0.58 -3.85 -0.07 0.00 -0.75 0.00 0.00 64.21 60.11 1v5u n SER 9 CO 0.00 0.00 0.00 -0.47 -1.23 0.00 0.00 175.04 173.34 1v5u s TYR 10 N -3.99 2.63 -0.12 0.66 5.04 -1.04 -4.94 117.35 115.60 1v5u s TYR 10 Ca 0.00 -0.44 -0.07 0.00 -2.44 0.00 0.00 57.07 54.12 1v5u s TYR 10 Cb 0.00 -1.65 0.05 0.00 0.35 0.00 0.00 41.96 40.71 1v5u s TYR 10 CO 0.00 0.36 0.30 -1.83 -1.34 0.00 0.00 175.55 173.04 1v5u s GLU 11 N -3.81 0.29 0.07 4.97 1.03 -1.26 -0.81 118.70 119.17 1v5u s GLU 11 Ca 0.37 0.58 -0.28 0.00 0.03 0.00 0.00 54.97 55.68 1v5u s GLU 11 Cb -0.00 -0.04 0.09 0.00 -0.80 0.00 0.00 34.13 33.38 1v5u s GLU 11 CO 0.21 -0.14 1.12 0.20 -1.33 0.00 0.00 175.26 175.33 1v5u s GLY 12 N 1.09 -0.31 0.30 -3.83 0.00 -1.22 -5.05 107.32 98.30 1v5u s GLY 12 Ca -0.08 0.38 -0.29 0.00 0.00 0.00 0.00 44.72 44.74 1v5u s GLY 12 CO -0.08 0.14 1.26 -0.42 0.00 0.00 0.00 173.10 174.00 1v5u s ILE 13 N -2.85 2.95 -0.19 0.90 -1.09 -1.26 -2.13 121.20 117.53 1v5u s ILE 13 Ca 0.13 0.93 -0.06 0.00 -2.23 0.00 0.00 60.65 59.43 1v5u s ILE 13 Cb 0.02 -3.59 0.09 0.00 -1.58 0.00 0.00 42.46 37.39 1v5u s ILE 13 CO -0.01 0.21 0.39 -0.76 -1.23 0.00 0.00 174.94 173.55 1v5u s LEU 14 N -1.53 -0.60 0.47 2.97 1.43 -0.73 -4.13 118.68 116.58 1v5u s LEU 14 Ca 0.49 0.90 -0.10 0.00 -1.03 0.00 0.00 54.13 54.39 1v5u s LEU 14 Cb -0.38 1.25 -0.06 0.00 0.03 0.00 0.00 46.19 47.04 1v5u s LEU 14 CO 0.48 -0.24 0.84 -0.31 0.23 0.00 0.00 176.35 177.36 1v5u s TYR 15 N 2.58 3.52 -0.09 0.29 1.51 -1.01 -2.80 117.35 121.35 1v5u s TYR 15 Ca -0.01 1.08 -0.00 0.00 -1.01 0.00 0.00 57.07 57.13 1v5u s TYR 15 Cb -0.12 -2.50 0.02 0.00 -0.11 0.00 0.00 41.96 39.25 1v5u s TYR 15 CO -0.12 -0.27 -0.06 0.21 -1.11 0.00 0.00 175.55 174.20 1v5u s LYS 16 N -4.30 1.22 0.50 -0.62 2.20 0.15 -3.73 119.74 115.15 1v5u s LYS 16 Ca 0.52 -0.16 -0.20 0.00 -0.36 0.00 0.00 55.97 55.77 1v5u s LYS 16 Cb -0.10 -1.32 -0.11 0.00 -1.51 0.00 0.00 37.83 34.79 1v5u s LYS 16 CO 0.38 -0.22 0.50 1.17 -0.36 0.00 0.00 175.35 176.81 1v5u n LYS 17 N 4.78 0.53 0.00 4.03 4.81 -1.16 0.87 118.16 132.02 1v5u n LYS 17 Ca -0.13 0.20 0.00 0.00 -0.87 0.00 0.00 58.31 57.50 1v5u n LYS 17 Cb 0.50 -1.58 0.00 0.00 0.02 0.00 0.00 35.03 33.97 1v5u n LYS 17 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1v5u n GLY 18 N 1.82 0.23 1.58 3.14 0.00 -1.26 -4.64 105.19 106.05 1v5u n GLY 18 Ca 0.11 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.04 1v5u n GLY 18 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1v5u n ALA 19 N -1.13 0.23 -1.09 4.61 0.00 -1.26 -5.04 120.51 116.84 1v5u n ALA 19 Ca 0.00 -0.91 -0.26 0.00 0.00 0.00 0.00 53.44 52.27 1v5u n ALA 19 Cb 0.00 0.74 0.08 0.00 0.00 0.00 0.00 19.45 20.26 1v5u n ALA 19 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 1v5u n PHE 20 N -0.30 2.53 0.00 0.00 3.01 -1.26 -4.19 117.46 117.25 1v5u n PHE 20 Ca 0.03 -2.43 0.00 0.00 1.01 0.00 0.00 57.45 56.06 1v5u n PHE 20 Cb 0.29 -1.18 0.00 0.00 -0.01 0.00 0.00 39.48 38.58 1v5u n PHE 20 CO 0.00 0.00 0.00 -1.33 1.01 0.00 0.00 176.76 176.44 1v5u n MET 21 N -0.48 0.00 -3.80 -1.08 2.81 -1.26 -4.74 117.12 108.58 1v5u n MET 21 Ca 0.49 0.00 -0.23 0.00 -1.81 0.00 0.00 57.70 56.16 1v5u n MET 21 Cb 0.77 -0.10 -0.02 0.00 -0.71 0.00 0.00 33.22 33.15 1v5u n MET 21 CO 0.00 0.00 0.00 0.15 1.51 0.00 0.00 175.97 177.63 1v5u s LYS 22 N -1.62 3.46 0.61 0.03 -0.14 -1.26 -4.72 119.74 116.10 1v5u s LYS 22 Ca 0.00 -0.61 -0.15 0.00 -1.36 0.00 0.00 55.97 53.86 1v5u s LYS 22 Cb 0.00 -2.84 -0.03 0.00 -1.68 0.00 0.00 37.83 33.28 1v5u s LYS 22 CO 0.00 0.37 1.05 -1.25 -0.76 0.00 0.00 175.35 174.76 1v5u s PRO 23 N -3.94 3.29 0.71 -1.68 0.04 -1.26 -4.17 135.00 127.99 1v5u s PRO 23 Ca 0.36 1.12 -0.16 0.00 0.04 0.00 0.00 61.00 62.36 1v5u s PRO 23 Cb -0.09 -2.03 0.01 0.00 0.04 0.00 0.00 34.50 32.42 1v5u s PRO 23 CO 0.31 -0.83 1.04 0.91 0.04 0.00 0.00 177.00 178.46 1v5u n TRP 24 N -2.25 0.92 -2.61 0.56 7.02 -1.22 -4.63 117.44 115.22 1v5u n TRP 24 Ca 0.08 0.40 -0.43 0.00 -1.02 0.00 0.00 57.50 56.53 1v5u n TRP 24 Cb 0.53 -2.12 -0.02 0.00 -2.42 0.00 0.00 31.31 27.29 1v5u n TRP 24 CO 0.00 0.00 0.00 0.15 -2.02 0.00 0.00 177.69 175.82 1v5u s LYS 25 N -3.36 4.11 -0.36 -0.99 -0.14 0.25 -4.68 119.74 114.58 1v5u s LYS 25 Ca 0.75 1.20 -0.19 0.00 -1.36 0.00 0.00 55.97 56.37 1v5u s LYS 25 Cb -0.35 -3.73 0.00 0.00 -1.68 0.00 0.00 37.83 32.07 1v5u s LYS 25 CO 0.48 -0.84 0.57 0.00 -0.76 0.00 0.00 175.35 174.81 1v5u s ALA 26 N 3.59 3.46 0.12 5.17 0.00 -1.26 0.32 121.76 133.16 1v5u s ALA 26 Ca 0.47 -0.97 -0.03 0.00 0.00 0.00 0.00 51.96 51.43 1v5u s ALA 26 Cb -0.14 -3.10 -0.03 0.00 0.00 0.00 0.00 23.12 19.85 1v5u s ALA 26 CO 0.14 -1.31 0.08 1.03 0.00 0.00 0.00 175.76 175.70 1v5u s ARG 27 N 2.54 0.89 -0.20 0.00 0.52 -1.12 -5.00 118.95 116.59 1v5u s ARG 27 Ca 0.21 -1.33 -0.28 0.00 -0.52 0.00 0.00 55.73 53.81 1v5u s ARG 27 Cb -0.15 0.26 -0.00 0.00 0.52 0.00 0.00 34.95 35.58 1v5u s ARG 27 CO 0.14 -0.25 0.96 -0.46 0.02 0.00 0.00 175.30 175.70 1v5u s TRP 28 N -4.00 3.38 0.41 -0.53 -0.11 -0.95 -1.77 118.94 115.37 1v5u s TRP 28 Ca 0.19 1.39 0.08 0.00 1.22 0.00 0.00 56.10 58.97 1v5u s TRP 28 Cb 0.07 -3.17 -0.01 0.00 -1.50 0.00 0.00 33.47 28.87 1v5u s TRP 28 CO -0.01 -0.38 0.46 -0.06 -4.62 0.00 0.00 176.95 172.34 1v5u s PHE 29 N 2.73 2.79 -0.01 5.86 0.40 -0.90 -0.06 117.98 128.79 1v5u s PHE 29 Ca 0.42 -0.42 0.00 0.00 -0.60 0.00 0.00 56.93 56.33 1v5u s PHE 29 Cb -0.16 -2.23 0.02 0.00 0.51 0.00 0.00 43.02 41.16 1v5u s PHE 29 CO 0.10 -0.23 0.01 0.08 0.70 0.00 0.00 175.22 175.88 1v5u s VAL 30 N -2.39 -0.01 -0.89 -0.44 1.01 0.50 -3.42 120.40 114.76 1v5u s VAL 30 Ca 0.51 0.10 -0.08 0.00 0.00 0.00 0.00 61.98 62.51 1v5u s VAL 30 Cb -0.07 -0.06 0.23 0.00 0.00 0.00 0.00 36.38 36.48 1v5u s VAL 30 CO 0.30 0.05 0.81 -0.22 0.00 0.00 0.00 175.10 176.05 1v5u s LEU 31 N 0.55 6.10 0.21 3.92 1.98 0.01 -2.24 118.68 129.21 1v5u s LEU 31 Ca -0.05 -3.22 -0.30 0.00 -2.89 0.00 0.00 54.13 47.67 1v5u s LEU 31 Cb -0.07 -2.08 -0.08 0.00 0.66 0.00 0.00 46.19 44.62 1v5u s LEU 31 CO -0.01 -0.36 1.15 -0.62 -1.89 0.00 0.00 176.35 174.61 1v5u s ASP 32 N 1.12 7.16 -0.05 3.68 2.15 -0.33 -2.48 116.67 127.93 1v5u s ASP 32 Ca 0.24 2.22 0.01 0.00 0.43 0.00 0.00 52.55 55.45 1v5u s ASP 32 Cb -0.11 -2.61 -0.03 0.00 -0.30 0.00 0.00 42.92 39.86 1v5u s ASP 32 CO -0.08 -0.28 -0.04 2.29 -0.17 0.00 0.00 175.17 176.88 1v5u n LYS 33 N 2.08 0.27 -0.32 4.34 2.85 -1.26 -2.37 118.16 123.75 1v5u n LYS 33 Ca 0.02 0.03 0.05 0.00 -1.05 0.00 0.00 58.31 57.36 1v5u n LYS 33 Cb 0.45 -1.09 0.20 0.00 -0.65 0.00 0.00 35.03 33.93 1v5u n LYS 33 CO 0.00 0.00 0.00 1.79 -0.05 0.00 0.00 177.40 179.14 1v5u h THR 34 N 0.00 0.91 0.00 0.58 1.35 -1.98 -2.66 112.91 111.11 1v5u h THR 34 Ca -0.11 -0.30 0.00 0.00 -0.55 0.00 0.00 66.41 65.45 1v5u h THR 34 Cb 1.17 -0.04 0.00 0.00 -1.73 0.00 0.00 68.15 67.54 1v5u h THR 34 CO -0.02 0.16 -1.45 0.29 -0.25 0.00 0.00 175.52 174.26 1v5u n LYS 35 N -4.69 0.81 -2.61 4.72 5.02 -1.26 -5.05 118.16 115.11 1v5u n LYS 35 Ca 0.16 -0.10 -0.02 0.00 -2.02 0.00 0.00 58.31 56.33 1v5u n LYS 35 Cb 0.31 -1.29 0.00 0.00 -0.02 0.00 0.00 35.03 34.03 1v5u n LYS 35 CO 0.00 0.00 0.00 0.72 -0.52 0.00 0.00 177.40 177.60 1v5u n HIS 36 N -1.86 -2.35 -3.96 2.13 8.25 -1.01 -4.89 115.22 111.54 1v5u n HIS 36 Ca -0.02 0.91 -0.09 0.00 -0.26 0.00 0.00 57.72 58.27 1v5u n HIS 36 Cb 0.33 -3.44 -0.05 0.00 1.12 0.00 0.00 29.99 27.94 1v5u n HIS 36 CO 0.00 0.00 0.00 -0.65 0.64 0.00 0.00 176.34 176.33 1v5u s GLN 37 N -2.73 1.45 -0.35 -0.41 -0.21 -1.00 -1.61 119.66 114.80 1v5u s GLN 37 Ca 0.06 -1.19 0.01 0.00 0.02 0.00 0.00 55.36 54.26 1v5u s GLN 37 Cb -0.02 0.46 0.09 0.00 1.00 0.00 0.00 33.01 34.55 1v5u s GLN 37 CO 0.56 -0.59 0.09 -1.17 -2.12 0.00 0.00 175.29 172.05 1v5u s LEU 38 N -2.99 4.73 -0.20 2.90 0.20 0.75 -1.18 118.68 122.89 1v5u s LEU 38 Ca 0.20 -1.95 -0.07 0.00 0.69 0.00 0.00 54.13 53.00 1v5u s LEU 38 Cb 0.00 -1.70 -0.04 0.00 -0.43 0.00 0.00 46.19 44.02 1v5u s LEU 38 CO 0.06 -0.41 0.07 -0.13 -0.29 0.00 0.00 176.35 175.65 1v5u s ARG 39 N 1.04 3.89 -0.01 1.98 0.52 -0.95 -1.89 118.95 123.54 1v5u s ARG 39 Ca 0.06 -0.38 0.05 0.00 -0.52 0.00 0.00 55.73 54.94 1v5u s ARG 39 Cb -0.21 -3.25 -0.01 0.00 0.52 0.00 0.00 34.95 32.00 1v5u s ARG 39 CO -0.06 0.15 -0.16 1.52 0.02 0.00 0.00 175.30 176.78 1v5u s TYR 40 N 0.71 1.39 0.33 -0.53 -0.85 -1.26 0.19 117.35 117.33 1v5u s TYR 40 Ca 0.03 -0.27 0.07 0.00 -0.52 0.00 0.00 57.07 56.38 1v5u s TYR 40 Cb -0.13 -0.89 -0.07 0.00 0.38 0.00 0.00 41.96 41.25 1v5u s TYR 40 CO 0.02 -0.02 -0.03 0.71 -1.52 0.00 0.00 175.55 174.71 1v5u s TYR 41 N -0.40 2.20 0.05 -3.49 1.51 0.92 -3.72 117.35 114.41 1v5u s TYR 41 Ca 0.06 -0.68 -0.16 0.00 -1.01 0.00 0.00 57.07 55.28 1v5u s TYR 41 Cb -0.06 -1.36 -0.27 0.00 -0.11 0.00 0.00 41.96 40.16 1v5u s TYR 41 CO -0.00 0.35 1.11 0.22 -1.11 0.00 0.00 175.55 176.12 1v5u h ASP 42 N 2.07 0.81 -0.71 2.29 3.58 -1.88 -2.51 116.42 120.07 1v5u h ASP 42 Ca -0.41 -0.80 -0.62 0.00 0.42 0.00 0.00 57.03 55.61 1v5u h ASP 42 Cb 1.24 -0.25 -0.09 0.00 1.72 0.00 0.00 39.33 41.94 1v5u h ASP 42 CO 0.71 1.52 -0.44 -1.00 -2.88 0.00 0.00 179.24 177.15 1v5u s HIS 43 N -3.08 1.94 -0.10 0.28 3.76 -1.26 -4.58 115.29 112.25 1v5u s HIS 43 Ca -0.10 -0.84 -0.01 0.00 -0.15 0.00 0.00 55.06 53.96 1v5u s HIS 43 Cb 0.05 -1.79 -0.25 0.00 1.11 0.00 0.00 32.58 31.70 1v5u s HIS 43 CO 0.91 -0.02 0.44 -2.13 -0.85 0.00 0.00 174.74 173.08 1v5u n ARG 44 N -1.42 0.72 -1.49 1.40 0.63 -1.26 -4.18 116.66 111.05 1v5u n ARG 44 Ca -0.09 0.27 -0.36 0.00 -0.92 0.00 0.00 57.85 56.74 1v5u n ARG 44 Cb 0.66 -1.73 0.07 0.00 0.45 0.00 0.00 32.46 31.91 1v5u n ARG 44 CO 0.00 0.00 0.00 -0.12 -2.51 0.00 0.00 177.63 175.00 1v5u n MET 45 N -3.35 2.70 -3.88 -0.14 1.56 -1.26 -4.96 117.12 107.79 1v5u n MET 45 Ca -0.28 -3.34 -0.33 0.00 -0.27 0.00 0.00 57.70 53.49 1v5u n MET 45 Cb 1.05 -2.28 -0.05 0.00 2.15 0.00 0.00 33.22 34.10 1v5u n MET 45 CO 0.00 0.00 0.00 0.34 -0.73 0.00 0.00 175.97 175.58 1v5u s ASP 46 N -1.59 6.39 -0.42 6.12 -1.08 -1.26 -5.02 116.67 119.82 1v5u s ASP 46 Ca 0.61 0.37 0.05 0.00 -0.52 0.00 0.00 52.55 53.05 1v5u s ASP 46 Cb 0.49 -2.01 0.44 0.00 -1.46 0.00 0.00 42.92 40.38 1v5u s ASP 46 CO -0.13 0.23 1.32 1.07 0.52 0.00 0.00 175.17 178.18 1v5u n THR 47 N 0.78 2.68 -3.68 1.71 5.66 -1.26 -4.96 114.28 115.22 1v5u n THR 47 Ca -0.09 -4.29 -0.11 0.00 -3.05 0.00 0.00 64.05 56.50 1v5u n THR 47 Cb 0.52 -1.19 -0.12 0.00 -1.55 0.00 0.00 70.33 68.00 1v5u n THR 47 CO 0.00 0.00 0.00 -1.61 -3.05 0.00 0.00 175.07 170.41 1v5u s GLU 48 N -3.64 0.25 -0.32 1.09 2.02 -1.26 -5.12 118.70 111.71 1v5u s GLU 48 Ca 0.52 0.82 -0.20 0.00 0.02 0.00 0.00 54.97 56.12 1v5u s GLU 48 Cb 0.42 0.07 -0.01 0.00 0.10 0.00 0.00 34.13 34.71 1v5u s GLU 48 CO -0.07 -0.24 0.61 0.00 0.02 0.00 0.00 175.26 175.59 1v5u s LYS 50 N 2.59 2.12 0.00 0.00 1.02 -1.24 -5.00 119.74 119.22 1v5u s LYS 50 Ca 0.24 -2.41 0.00 0.00 0.02 0.00 0.00 55.97 53.82 1v5u s LYS 50 Cb -0.15 -3.47 0.00 0.00 -0.52 0.00 0.00 37.83 33.69 1v5u s LYS 50 CO 0.12 -1.11 0.00 0.41 -0.92 0.00 0.00 175.35 173.86 1v5u n GLY 51 N 3.54 2.58 3.23 -3.33 0.00 -1.26 -4.62 105.19 105.33 1v5u n GLY 51 Ca 0.05 -1.72 -0.13 0.00 0.00 0.00 0.00 46.02 44.22 1v5u n GLY 51 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1v5u s VAL 52 N -1.88 0.07 -0.30 1.61 1.01 -1.26 -4.18 120.40 115.47 1v5u s VAL 52 Ca 0.00 -0.54 -0.03 0.00 0.00 0.00 0.00 61.98 61.41 1v5u s VAL 52 Cb 0.00 -0.67 0.11 0.00 0.00 0.00 0.00 36.38 35.81 1v5u s VAL 52 CO 0.00 -0.30 0.14 -0.63 0.00 0.00 0.00 175.10 174.31 1v5u s ILE 53 N -1.60 0.03 -0.19 2.22 1.01 -0.79 -4.88 121.20 117.00 1v5u s ILE 53 Ca -0.12 -0.95 -0.34 0.00 0.00 0.00 0.00 60.65 59.24 1v5u s ILE 53 Cb -0.04 -1.05 -0.11 0.00 0.01 0.00 0.00 42.46 41.27 1v5u s ILE 53 CO 0.02 -0.77 2.00 -0.67 0.00 0.00 0.00 174.94 175.53 1v5u n ASP 54 N 5.04 3.03 0.15 3.58 2.03 -1.26 -0.18 116.55 128.94 1v5u n ASP 54 Ca -0.03 0.74 0.01 0.00 0.52 0.00 0.00 54.79 56.02 1v5u n ASP 54 Cb 0.41 -1.35 0.30 0.00 -0.72 0.00 0.00 41.12 39.75 1v5u n ASP 54 CO 0.00 0.00 0.00 -0.07 -1.92 0.00 0.00 177.20 175.21 1v5u h LEU 55 N 10.68 0.08 -1.51 -2.67 3.38 -1.60 -1.53 115.31 122.14 1v5u h LEU 55 Ca -0.42 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.52 1v5u h LEU 55 Cb 1.28 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 42.01 1v5u h LEU 55 CO 0.97 0.48 0.00 0.00 0.09 0.00 0.00 178.44 179.98 1v5u h ALA 56 N 1.52 1.00 0.00 1.53 0.00 -1.82 0.62 119.26 122.11 1v5u h ALA 56 Ca 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 54.91 54.74 1v5u h ALA 56 Cb 0.75 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.51 1v5u h ALA 56 CO 0.06 0.00 -1.32 0.93 0.00 0.00 0.00 179.25 178.91 1v5u h GLU 57 N 0.00 0.00 -6.59 0.00 5.08 -1.63 -3.43 114.58 108.01 1v5u h GLU 57 Ca 0.00 0.00 -0.52 0.00 -1.00 0.00 0.00 59.36 57.84 1v5u h GLU 57 Cb 0.12 0.00 0.05 0.00 0.50 0.00 0.00 28.75 29.42 1v5u h GLU 57 CO 0.00 0.37 1.00 0.08 -1.00 0.00 0.00 179.01 179.46 1v5u s VAL 58 N -2.87 2.38 -0.06 3.13 1.01 0.21 -3.04 120.40 121.16 1v5u s VAL 58 Ca -0.02 0.18 0.09 0.00 0.00 0.00 0.00 61.98 62.23 1v5u s VAL 58 Cb 0.08 -3.12 -0.24 0.00 0.00 0.00 0.00 36.38 33.11 1v5u s VAL 58 CO 0.81 0.01 0.62 -0.62 0.00 0.00 0.00 175.10 175.91 1v5u n GLU 59 N 4.50 0.65 0.00 2.72 1.02 0.77 -4.05 120.64 126.25 1v5u n GLU 59 Ca 0.16 0.29 0.00 0.00 -0.02 0.00 0.00 57.16 57.59 1v5u n GLU 59 Cb 0.37 -1.78 0.00 0.00 -0.02 0.00 0.00 31.44 30.01 1v5u n GLU 59 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1v5u n ALA 60 N -2.63 0.00 -2.31 0.62 0.00 -1.17 -4.80 120.51 110.22 1v5u n ALA 60 Ca -0.19 0.00 -0.08 0.00 0.00 0.00 0.00 53.44 53.17 1v5u n ALA 60 Cb 1.05 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 20.40 1v5u n ALA 60 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1v5u s VAL 61 N -2.00 0.19 -0.05 0.00 0.11 -1.26 0.43 120.40 117.83 1v5u s VAL 61 Ca 0.00 -1.59 -0.09 0.00 -2.93 0.00 0.00 61.98 57.38 1v5u s VAL 61 Cb 0.00 -1.22 0.02 0.00 -1.53 0.00 0.00 36.38 33.64 1v5u s VAL 61 CO 0.00 -0.88 0.21 0.00 -3.33 0.00 0.00 175.10 171.11 1v5u s ALA 62 N -3.34 -0.52 -0.47 1.54 0.00 -0.08 -4.95 121.76 113.92 1v5u s ALA 62 Ca 0.02 0.36 -0.28 0.00 0.00 0.00 0.00 51.96 52.06 1v5u s ALA 62 Cb 0.04 -0.16 0.01 0.00 0.00 0.00 0.00 23.12 23.00 1v5u s ALA 62 CO -0.08 -0.16 1.45 -1.25 0.00 0.00 0.00 175.76 175.72 1v5u s PRO 63 N -0.54 3.42 0.00 0.00 0.04 -1.26 0.10 135.00 136.76 1v5u s PRO 63 Ca -0.06 0.76 0.00 0.00 0.04 0.00 0.00 61.00 61.74 1v5u s PRO 63 Cb -0.04 -4.09 0.00 0.00 0.04 0.00 0.00 34.50 30.42 1v5u s PRO 63 CO 0.01 -1.77 0.00 0.41 0.04 0.00 0.00 177.00 175.69 1v5u n GLY 64 N 5.19 0.53 3.39 0.56 0.00 -1.13 -4.92 105.19 108.82 1v5u n GLY 64 Ca 0.15 -1.89 -0.22 0.00 0.00 0.00 0.00 46.02 44.06 1v5u n GLY 64 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1v5u s THR 65 N 0.33 2.09 0.17 2.61 -4.23 -1.26 -4.57 115.64 110.77 1v5u s THR 65 Ca 0.00 -2.19 -0.30 0.00 -1.18 0.00 0.00 61.69 58.02 1v5u s THR 65 Cb 0.00 -2.09 -0.07 0.00 1.34 0.00 0.00 72.50 71.67 1v5u s THR 65 CO 0.00 -0.41 1.12 -2.16 -0.54 0.00 0.00 174.62 172.64 1v5u s PRO 66 N -3.28 4.56 0.00 3.99 0.04 -1.26 -5.02 135.00 134.02 1v5u s PRO 66 Ca 0.23 1.74 0.00 0.00 0.04 0.00 0.00 61.00 63.02 1v5u s PRO 66 Cb -0.04 -3.28 0.00 0.00 0.04 0.00 0.00 34.50 31.22 1v5u s PRO 66 CO 0.10 0.02 0.00 0.25 0.04 0.00 0.00 177.00 177.41 1v5u n THR 67 N 2.53 0.00 -0.77 1.26 -2.24 -1.26 -5.07 114.28 108.72 1v5u n THR 67 Ca 0.03 0.00 -0.32 0.00 -2.27 0.00 0.00 64.05 61.50 1v5u n THR 67 Cb 0.46 0.00 0.16 0.00 -2.10 0.00 0.00 70.33 68.85 1v5u n THR 67 CO 0.00 0.00 0.00 -0.38 -0.57 0.00 0.00 175.07 174.12 1v5u n ILE 68 N 0.00 0.39 -4.21 2.28 5.41 -1.26 -3.09 119.36 118.87 1v5u n ILE 68 Ca 0.00 -0.06 -0.38 0.00 1.00 0.00 0.00 62.75 63.31 1v5u n ILE 68 Cb 0.00 -0.99 -0.05 0.00 -0.71 0.00 0.00 39.64 37.89 1v5u n ILE 68 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1v5u n GLY 69 N 0.48 -0.41 1.79 7.39 0.00 -1.26 -4.92 105.19 108.26 1v5u n GLY 69 Ca 0.12 0.24 -0.13 0.00 0.00 0.00 0.00 46.02 46.25 1v5u n GLY 69 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1v5u n ALA 70 N -4.77 -0.49 -1.00 4.61 0.00 -1.18 -3.37 120.51 114.32 1v5u n ALA 70 Ca -0.23 -0.83 0.00 0.00 0.00 0.00 0.00 53.44 52.37 1v5u n ALA 70 Cb 0.63 0.01 0.00 0.00 0.00 0.00 0.00 19.45 20.10 1v5u n ALA 70 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1v5u n PRO 71 N -2.18 0.85 0.01 0.00 -0.04 -1.26 -3.83 135.00 128.55 1v5u n PRO 71 Ca 0.08 0.00 -0.01 0.00 -0.04 0.00 0.00 63.50 63.53 1v5u n PRO 71 Cb 0.27 0.00 -0.00 0.00 -0.04 0.00 0.00 33.50 33.73 1v5u n PRO 71 CO 0.00 0.00 0.00 0.87 -0.04 0.00 0.00 175.50 176.33 1v5u h LYS 72 N 0.00 -0.04 -1.24 0.54 1.79 -1.98 -3.45 116.57 112.19 1v5u h LYS 72 Ca 0.00 0.00 -0.32 0.00 -2.18 0.00 0.00 60.65 58.15 1v5u h LYS 72 Cb 0.00 0.01 -0.24 0.00 -1.58 0.00 0.00 32.23 30.42 1v5u h LYS 72 CO 0.00 -0.02 -0.68 0.25 -1.08 0.00 0.00 179.45 177.92 1v5u n THR 73 N -2.25 -0.38 -4.08 -0.16 -2.24 -1.26 -5.14 114.28 98.78 1v5u n THR 73 Ca -0.00 -2.03 -0.31 0.00 -2.27 0.00 0.00 64.05 59.44 1v5u n THR 73 Cb 0.01 0.12 -0.07 0.00 -2.10 0.00 0.00 70.33 68.30 1v5u n THR 73 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 1v5u s VAL 74 N 0.41 4.42 -0.15 2.28 1.01 -1.26 -4.98 120.40 122.12 1v5u s VAL 74 Ca 0.32 -0.79 -0.28 0.00 0.00 0.00 0.00 61.98 61.22 1v5u s VAL 74 Cb 0.08 -3.11 -0.01 0.00 0.00 0.00 0.00 36.38 33.33 1v5u s VAL 74 CO -0.13 0.14 0.96 -1.81 0.00 0.00 0.00 175.10 174.26 1v5u s ASP 75 N -2.32 7.13 0.40 3.32 1.11 -1.26 -4.88 116.67 120.16 1v5u s ASP 75 Ca 0.28 1.40 0.31 0.00 0.18 0.00 0.00 52.55 54.72 1v5u s ASP 75 Cb -0.12 -2.52 1.31 0.00 1.07 0.00 0.00 42.92 42.66 1v5u s ASP 75 CO 0.20 -0.48 1.32 -1.84 1.18 0.00 0.00 175.17 175.55 1v5u n GLU 76 N 5.35 -0.02 0.29 8.23 0.28 -1.26 0.20 120.64 133.71 1v5u n GLU 76 Ca 0.08 1.02 -0.16 0.00 -0.16 0.00 0.00 57.16 57.94 1v5u n GLU 76 Cb 0.48 -2.09 -0.08 0.00 1.43 0.00 0.00 31.44 31.18 1v5u n GLU 76 CO 0.00 0.00 0.00 0.87 -0.16 0.00 0.00 177.13 177.84 1v5u h LYS 77 N 0.00 -0.69 -0.83 3.44 1.57 -1.90 -3.14 116.57 115.03 1v5u h LYS 77 Ca 0.76 0.05 0.07 0.00 -1.87 0.00 0.00 60.65 59.66 1v5u h LYS 77 Cb 2.60 0.16 -0.10 0.00 0.08 0.00 0.00 32.23 34.97 1v5u h LYS 77 CO -0.29 -0.41 -0.49 0.00 -0.57 0.00 0.00 179.45 177.68 1v5u n ALA 78 N -2.47 -0.53 -0.97 3.86 0.00 0.53 -4.54 120.51 116.39 1v5u n ALA 78 Ca -0.12 0.70 -0.34 0.00 0.00 0.00 0.00 53.44 53.68 1v5u n ALA 78 Cb 0.32 -0.03 -0.03 0.00 0.00 0.00 0.00 19.45 19.71 1v5u n ALA 78 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 1v5u n PHE 79 N -4.86 -0.20 -3.65 0.00 3.01 -1.11 -4.38 117.46 106.26 1v5u n PHE 79 Ca 0.02 0.68 -0.04 0.00 1.01 0.00 0.00 57.45 59.11 1v5u n PHE 79 Cb 0.21 -1.36 -0.06 0.00 -0.01 0.00 0.00 39.48 38.27 1v5u n PHE 79 CO 0.00 0.00 0.00 -0.59 1.01 0.00 0.00 176.76 177.18 1v5u s PHE 80 N -0.57 -1.18 -0.01 1.38 -0.71 0.16 -2.82 117.98 114.23 1v5u s PHE 80 Ca 0.47 2.19 -0.25 0.00 -1.04 0.00 0.00 56.93 58.29 1v5u s PHE 80 Cb -0.68 0.70 -0.04 0.00 -1.21 0.00 0.00 43.02 41.79 1v5u s PHE 80 CO 0.39 -0.59 0.78 -0.51 -1.34 0.00 0.00 175.22 173.95 1v5u s ASP 81 N 2.27 7.15 -0.44 1.98 1.11 0.29 -1.82 116.67 127.21 1v5u s ASP 81 Ca -0.08 1.38 -0.11 0.00 0.18 0.00 0.00 52.55 53.92 1v5u s ASP 81 Cb -0.09 -2.47 0.08 0.00 1.07 0.00 0.00 42.92 41.52 1v5u s ASP 81 CO -0.19 -0.10 0.31 -0.69 1.18 0.00 0.00 175.17 175.67 1v5u s VAL 82 N 0.56 4.55 -0.03 -1.27 1.01 -0.89 -0.90 120.40 123.42 1v5u s VAL 82 Ca 0.41 -1.31 -0.30 0.00 0.00 0.00 0.00 61.98 60.78 1v5u s VAL 82 Cb -0.19 -3.77 -0.03 0.00 0.00 0.00 0.00 36.38 32.38 1v5u s VAL 82 CO 0.22 -0.54 1.12 -0.54 0.00 0.00 0.00 175.10 175.35 1v5u s LYS 83 N 1.49 4.43 0.17 2.72 1.02 0.17 -1.47 119.74 128.26 1v5u s LYS 83 Ca 0.03 1.59 0.02 0.00 0.02 0.00 0.00 55.97 57.63 1v5u s LYS 83 Cb -0.24 -3.49 -0.01 0.00 -0.52 0.00 0.00 37.83 33.58 1v5u s LYS 83 CO 0.03 -0.30 0.06 0.25 -0.92 0.00 0.00 175.35 174.48 1v5u n THR 84 N 4.30 0.00 0.12 2.17 -2.24 -1.25 -0.16 114.28 117.21 1v5u n THR 84 Ca 0.09 -0.97 -0.23 0.00 -2.27 0.00 0.00 64.05 60.67 1v5u n THR 84 Cb 0.48 0.35 -0.15 0.00 -2.10 0.00 0.00 70.33 68.90 1v5u n THR 84 CO 0.00 0.00 0.00 0.71 -0.57 0.00 0.00 175.07 175.21 1v5u h THR 85 N 1.28 1.35 0.00 4.28 1.35 -1.92 -3.39 112.91 115.86 1v5u h THR 85 Ca -0.13 -2.63 0.00 0.00 -0.55 0.00 0.00 66.41 63.10 1v5u h THR 85 Cb 0.49 3.06 0.00 0.00 -1.73 0.00 0.00 68.15 69.98 1v5u h THR 85 CO 0.20 0.78 0.00 0.54 -0.25 0.00 0.00 175.52 176.79 1v5u n ARG 86 N -3.85 0.00 -3.55 4.72 1.74 -1.26 -4.98 116.66 109.48 1v5u n ARG 86 Ca -0.16 0.49 -0.11 0.00 -0.77 0.00 0.00 57.85 57.31 1v5u n ARG 86 Cb 1.01 -1.38 -0.03 0.00 -1.02 0.00 0.00 32.46 31.05 1v5u n ARG 86 CO 0.00 0.00 0.00 -0.98 -1.52 0.00 0.00 177.63 175.13 1v5u s ARG 87 N -2.51 1.32 0.27 5.56 1.70 -1.26 -5.14 118.95 118.88 1v5u s ARG 87 Ca 0.00 -0.63 -0.29 0.00 -0.47 0.00 0.00 55.73 54.34 1v5u s ARG 87 Cb 0.00 0.56 -0.09 0.00 -0.57 0.00 0.00 34.95 34.85 1v5u s ARG 87 CO 0.00 -0.57 1.23 0.08 -1.08 0.00 0.00 175.30 174.96 1v5u s VAL 88 N -3.80 3.15 0.34 4.99 1.01 -1.26 -3.83 120.40 121.00 1v5u s VAL 88 Ca 0.04 1.08 0.08 0.00 0.00 0.00 0.00 61.98 63.18 1v5u s VAL 88 Cb -0.01 -3.69 -0.04 0.00 0.00 0.00 0.00 36.38 32.64 1v5u s VAL 88 CO -0.09 0.23 0.16 -0.31 0.00 0.00 0.00 175.10 175.09 1v5u s TYR 89 N -0.75 2.72 -0.42 5.22 2.02 -0.54 -4.97 117.35 120.62 1v5u s TYR 89 Ca 0.50 -0.38 0.02 0.00 -0.37 0.00 0.00 57.07 56.83 1v5u s TYR 89 Cb -0.36 -1.68 0.14 0.00 -0.40 0.00 0.00 41.96 39.66 1v5u s TYR 89 CO 0.44 0.31 0.24 -0.80 -1.57 0.00 0.00 175.55 174.17 1v5u s ASN 90 N -3.87 3.45 0.23 2.29 0.01 -1.26 -2.09 114.94 113.70 1v5u s ASN 90 Ca 0.38 -2.56 0.08 0.00 -0.71 0.00 0.00 52.86 50.05 1v5u s ASN 90 Cb -0.03 -0.88 -0.04 0.00 0.41 0.00 0.00 41.25 40.71 1v5u s ASN 90 CO 0.23 -0.27 0.08 -0.36 -1.51 0.00 0.00 177.10 175.27 1v5u s PHE 91 N 0.48 2.92 0.05 2.20 0.08 -0.76 -2.98 117.98 119.98 1v5u s PHE 91 Ca 0.18 -0.14 -0.23 0.00 0.12 0.00 0.00 56.93 56.86 1v5u s PHE 91 Cb -0.23 -1.34 0.05 0.00 -0.57 0.00 0.00 43.02 40.93 1v5u s PHE 91 CO -0.00 0.55 0.53 0.00 -0.10 0.00 0.00 175.22 176.20 1v5u s ALA 93 N -2.55 4.51 -2.18 0.00 0.00 -1.26 -2.41 121.76 117.87 1v5u s ALA 93 Ca -0.05 -1.67 0.30 0.00 0.00 0.00 0.00 51.96 50.54 1v5u s ALA 93 Cb -0.01 -1.64 1.52 0.00 0.00 0.00 0.00 23.12 22.99 1v5u s ALA 93 CO -0.02 -0.33 2.01 1.04 0.00 0.00 0.00 175.76 178.46 1v5u n GLN 94 N -1.89 1.25 -4.00 0.00 6.02 -1.26 -4.76 117.38 112.74 1v5u n GLN 94 Ca 0.08 -0.40 -0.10 0.00 -0.01 0.00 0.00 57.00 56.57 1v5u n GLN 94 Cb 0.59 -1.49 -0.07 0.00 1.02 0.00 0.00 30.24 30.29 1v5u n GLN 94 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 177.06 176.39 1v5u s ASP 95 N -2.03 0.05 -0.04 1.08 2.15 -1.26 -4.92 116.67 111.70 1v5u s ASP 95 Ca 0.43 -0.95 -0.24 0.00 0.43 0.00 0.00 52.55 52.22 1v5u s ASP 95 Cb 0.21 0.44 -0.23 0.00 -0.30 0.00 0.00 42.92 43.04 1v5u s ASP 95 CO 0.36 -0.91 1.05 0.58 -0.17 0.00 0.00 175.17 176.08 1v5u h VAL 96 N 2.54 1.53 0.00 1.11 2.07 -1.92 -2.38 116.25 119.20 1v5u h VAL 96 Ca -0.32 -1.92 0.00 0.00 0.82 0.00 0.00 66.70 65.28 1v5u h VAL 96 Cb 1.23 2.72 0.00 0.00 -1.52 0.00 0.00 31.29 33.72 1v5u h VAL 96 CO 0.48 0.53 0.00 1.55 0.02 0.00 0.00 177.57 180.15 1v5u h PRO 97 N -0.46 0.00 0.15 1.57 0.13 -2.00 -2.59 132.00 128.80 1v5u h PRO 97 Ca -0.03 0.00 -0.31 0.00 -0.87 0.00 0.00 66.00 64.79 1v5u h PRO 97 Cb 1.00 0.00 0.03 0.00 0.13 0.00 0.00 31.00 32.17 1v5u h PRO 97 CO 0.05 0.00 -1.31 0.77 -0.23 0.00 0.00 178.00 177.29 1v5u h SER 98 N 0.00 0.88 0.07 1.44 0.02 -1.96 -3.08 113.55 110.93 1v5u h SER 98 Ca 0.00 -0.84 -0.00 0.00 -0.84 0.00 0.00 61.79 60.10 1v5u h SER 98 Cb 0.65 -0.28 0.00 0.00 0.14 0.00 0.00 62.40 62.91 1v5u h SER 98 CO 0.00 1.64 -0.04 0.00 -1.14 0.00 0.00 176.83 177.30 1v5u h ALA 99 N 0.25 -0.10 -0.88 3.77 0.00 -1.33 -2.84 119.26 118.14 1v5u h ALA 99 Ca -0.21 -0.20 0.23 0.00 0.00 0.00 0.00 54.91 54.73 1v5u h ALA 99 Cb 1.98 0.04 -0.14 0.00 0.00 0.00 0.00 17.79 19.67 1v5u h ALA 99 CO 0.25 -0.35 0.29 1.96 0.00 0.00 0.00 179.25 181.40 1v5u h GLN 100 N -0.51 0.25 -0.81 0.00 1.08 -1.58 0.67 115.11 114.22 1v5u h GLN 100 Ca -0.01 -0.02 0.01 0.00 -1.45 0.00 0.00 58.65 57.19 1v5u h GLN 100 Cb 0.44 -0.06 -0.04 0.00 -0.05 0.00 0.00 27.48 27.77 1v5u h GLN 100 CO 0.02 0.17 0.53 1.96 -0.95 0.00 0.00 178.83 180.56 1v5u h GLN 101 N 0.26 1.05 0.74 1.46 4.20 -1.44 0.26 115.11 121.64 1v5u h GLN 101 Ca 0.56 -0.06 -0.04 0.00 0.06 0.00 0.00 58.65 59.17 1v5u h GLN 101 Cb 1.11 -0.24 0.00 0.00 0.30 0.00 0.00 27.48 28.66 1v5u h GLN 101 CO -0.61 0.69 -0.37 -1.49 -0.67 0.00 0.00 178.83 176.37 1v5u h TRP 102 N 1.08 -0.98 0.10 2.96 4.06 0.50 0.22 115.95 123.90 1v5u h TRP 102 Ca 0.30 -0.02 0.01 0.00 2.06 0.00 0.00 58.89 61.24 1v5u h TRP 102 Cb -0.10 0.33 -0.04 0.00 -1.00 0.00 0.00 29.16 28.35 1v5u h TRP 102 CO -0.02 -0.60 -0.45 0.28 -3.56 0.00 0.00 178.44 174.09 1v5u h VAL 103 N -1.02 0.00 -0.74 1.49 2.07 -0.74 0.49 116.25 117.80 1v5u h VAL 103 Ca -0.10 0.00 0.11 0.00 0.82 0.00 0.00 66.70 67.53 1v5u h VAL 103 Cb 0.79 0.00 -0.13 0.00 -1.52 0.00 0.00 31.29 30.43 1v5u h VAL 103 CO 0.15 0.00 -0.40 0.44 0.02 0.00 0.00 177.57 177.79 1v5u h ASP 104 N -0.64 -1.40 0.12 0.57 5.19 -0.42 1.70 116.42 121.54 1v5u h ASP 104 Ca -0.01 0.27 -0.00 0.00 -0.62 0.00 0.00 57.03 56.67 1v5u h ASP 104 Cb 0.65 0.69 -0.01 0.00 0.18 0.00 0.00 39.33 40.83 1v5u h ASP 104 CO -0.25 -0.30 -0.17 0.03 -3.12 0.00 0.00 179.24 175.43 1v5u h ARG 105 N -0.12 -0.30 -0.67 3.56 3.08 0.25 0.75 114.38 120.93 1v5u h ARG 105 Ca 0.25 0.02 0.14 0.00 0.07 0.00 0.00 59.98 60.46 1v5u h ARG 105 Cb 0.56 0.07 -0.12 0.00 0.08 0.00 0.00 29.97 30.55 1v5u h ARG 105 CO -0.80 -0.20 -0.13 0.82 -1.07 0.00 0.00 179.97 178.60 1v5u h ILE 106 N -0.31 0.35 -0.10 2.04 2.04 0.82 1.29 117.51 123.64 1v5u h ILE 106 Ca -0.01 -0.01 0.03 0.00 1.00 0.00 0.00 64.86 65.87 1v5u h ILE 106 Cb 0.28 0.33 -0.00 0.00 -0.74 0.00 0.00 36.82 36.68 1v5u h ILE 106 CO -0.05 0.00 0.07 1.56 0.00 0.00 0.00 178.15 179.74 1v5u h GLN 107 N 0.02 0.00 -0.00 2.37 1.08 0.29 0.50 115.11 119.37 1v5u h GLN 107 Ca 0.33 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.53 1v5u h GLN 107 Cb 0.52 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.95 1v5u h GLN 107 CO -0.67 0.00 -0.08 0.43 -0.95 0.00 0.00 178.83 177.57 1v5u n SER 108 N -4.47 0.26 -3.15 1.46 7.64 0.42 -3.85 113.62 111.92 1v5u n SER 108 Ca -0.01 -0.33 -0.20 0.00 1.01 0.00 0.00 58.87 59.34 1v5u n SER 108 Cb 0.19 -0.17 -0.04 0.00 -1.01 0.00 0.00 64.21 63.18 1v5u n SER 108 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1v5u n LEU 110 N 0.34 0.00 -4.80 0.00 4.77 -1.03 -4.65 117.00 111.63 1v5u n LEU 110 Ca 0.26 0.00 -0.29 0.00 -0.03 0.00 0.00 56.01 55.95 1v5u n LEU 110 Cb 0.59 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.62 1v5u n LEU 110 CO 0.23 0.00 -0.23 -0.55 -1.33 0.00 0.00 177.39 175.51 1v5u s SER 111 N -0.69 5.64 -0.47 -1.43 0.15 -1.26 -4.62 113.70 111.02 1v5u s SER 111 Ca 0.00 -0.02 0.03 0.00 0.70 0.00 0.00 55.95 56.66 1v5u s SER 111 Cb 0.00 -1.53 0.14 0.00 -1.71 0.00 0.00 66.02 62.91 1v5u s SER 111 CO 0.00 0.13 0.26 -0.44 1.20 0.00 0.00 173.24 174.39 1v5u s SER 112 N -2.69 3.80 0.07 5.45 0.01 -1.26 -5.09 113.70 114.00 1v5u s SER 112 Ca 0.31 -2.81 0.01 0.00 1.31 0.00 0.00 55.95 54.76 1v5u s SER 112 Cb -0.11 -1.19 -0.00 0.00 0.21 0.00 0.00 66.02 64.92 1v5u s SER 112 CO 0.23 -0.24 0.03 0.61 0.41 0.00 0.00 173.24 174.28 1v5u n GLY 113 N 3.32 3.92 3.55 3.44 0.00 -1.26 -5.08 105.19 113.08 1v5u n GLY 113 Ca 0.09 -1.91 -0.39 0.00 0.00 0.00 0.00 46.02 43.81 1v5u n GLY 113 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1v5u s PRO 114 N -2.29 2.92 -0.30 1.61 0.04 -1.26 -4.88 135.00 130.85 1v5u s PRO 114 Ca 0.05 0.13 -0.24 0.00 0.04 0.00 0.00 61.00 60.98 1v5u s PRO 114 Cb 0.00 -4.33 0.18 0.00 0.04 0.00 0.00 34.50 30.40 1v5u s PRO 114 CO 0.03 -2.45 1.37 -1.54 0.04 0.00 0.00 177.00 174.45 1v5u s SER 115 N 5.89 -0.11 -0.13 6.66 1.04 -1.26 -5.11 113.70 120.68 1v5u s SER 115 Ca 0.51 0.20 -0.29 0.00 0.48 0.00 0.00 55.95 56.85 1v5u s SER 115 Cb -0.10 0.30 -0.06 0.00 0.10 0.00 0.00 66.02 66.26 1v5u s SER 115 CO 0.17 -0.03 2.08 -0.55 0.98 0.00 0.00 173.24 175.88 1v5u s SER 116 N 0.17 5.89 0.00 7.02 0.15 -1.26 -5.16 113.70 120.51 1v5u s SER 116 Ca 0.05 2.15 0.03 0.00 0.70 0.00 0.00 55.95 58.89 1v5u s SER 116 Cb -0.05 -2.52 0.03 0.00 -1.71 0.00 0.00 66.02 61.77 1v5u s SER 116 CO -0.14 -1.58 0.61 0.61 1.20 0.00 0.00 173.24 173.94