#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2vxf n GLU -1 N 0.00 0.51 -4.22 1.96 2.13 -1.26 -4.96 120.64 114.80 2vxf n GLU -1 Ca 0.00 0.31 -0.35 0.00 0.66 0.00 0.00 57.16 57.78 2vxf n GLU -1 Cb 0.00 -1.52 -0.09 0.00 0.27 0.00 0.00 31.44 30.11 2vxf n GLU -1 CO 0.00 0.00 0.00 0.34 -0.41 0.00 0.00 177.13 177.06 2vxf s ASP 0 N -6.01 5.54 0.17 4.31 2.15 -1.26 -5.01 116.67 116.55 2vxf s ASP 0 Ca -0.26 0.21 -0.11 0.00 0.43 0.00 0.00 52.55 52.82 2vxf s ASP 0 Cb 0.04 -1.67 0.05 0.00 -0.30 0.00 0.00 42.92 41.04 2vxf s ASP 0 CO 0.38 0.36 1.63 1.55 -0.17 0.00 0.00 175.17 178.92 2vxf h PRO 1 N 5.31 0.98 -0.15 4.34 0.13 -1.93 -1.15 132.00 139.53 2vxf h PRO 1 Ca -0.50 -0.31 -0.12 0.00 -0.87 0.00 0.00 66.00 64.20 2vxf h PRO 1 Cb 1.20 -0.09 -0.01 0.00 0.13 0.00 0.00 31.00 32.23 2vxf h PRO 1 CO 0.57 0.98 -0.43 0.66 -0.23 0.00 0.00 178.00 179.55 2vxf h SER 2 N 0.87 0.39 0.16 1.44 4.64 -1.84 -2.70 113.55 116.50 2vxf h SER 2 Ca 0.16 -0.17 -0.14 0.00 -0.47 0.00 0.00 61.79 61.17 2vxf h SER 2 Cb 0.53 -0.11 -0.01 0.00 -0.31 0.00 0.00 62.40 62.50 2vxf h SER 2 CO 0.03 0.77 -0.51 1.23 -0.87 0.00 0.00 176.83 177.48 2vxf h GLY 3 N 1.19 0.43 1.25 -0.77 0.00 -1.90 -3.13 103.07 100.14 2vxf h GLY 3 Ca 0.02 -0.47 -0.12 0.00 0.00 0.00 0.00 47.33 46.77 2vxf h GLY 3 CO 0.07 0.43 -0.19 -1.33 0.00 0.00 0.00 176.54 175.52 2vxf h GLY 4 N 1.22 0.93 -6.02 4.60 0.00 -0.99 -3.41 103.07 99.40 2vxf h GLY 4 Ca 0.01 -0.78 -0.67 0.00 0.00 0.00 0.00 47.33 45.89 2vxf h GLY 4 CO 0.09 0.71 -0.83 -1.59 0.00 0.00 0.00 176.54 174.92 2vxf s THR 5 N -4.68 2.41 0.51 4.70 2.01 -1.04 -5.11 115.64 114.44 2vxf s THR 5 Ca -0.10 -0.84 -0.21 0.00 0.31 0.00 0.00 61.69 60.85 2vxf s THR 5 Cb 0.13 -2.02 -0.07 0.00 0.01 0.00 0.00 72.50 70.56 2vxf s THR 5 CO 0.85 0.52 1.12 -2.16 -0.69 0.00 0.00 174.62 174.26 2vxf s PRO 6 N 1.04 3.54 0.55 4.92 0.04 -1.26 -4.69 135.00 139.16 2vxf s PRO 6 Ca -0.01 1.61 0.29 0.00 0.04 0.00 0.00 61.00 62.92 2vxf s PRO 6 Cb -0.14 -2.13 1.63 0.00 0.04 0.00 0.00 34.50 33.89 2vxf s PRO 6 CO -0.05 -0.69 2.16 0.10 0.04 0.00 0.00 177.00 178.56 2vxf h TYR 7 N 1.50 0.00 -3.89 0.56 -0.00 -1.99 -3.42 116.97 109.73 2vxf h TYR 7 Ca -0.50 0.00 -0.53 0.00 -0.00 0.00 0.00 58.73 57.70 2vxf h TYR 7 Cb 1.25 0.00 0.08 0.00 -0.00 0.00 0.00 36.73 38.06 2vxf h TYR 7 CO 0.53 0.06 0.69 0.42 -0.00 0.00 0.00 178.16 179.86 2vxf s ILE 8 N -4.39 2.50 0.00 -0.90 1.01 -1.26 -2.20 121.20 115.95 2vxf s ILE 8 Ca -0.04 0.50 0.00 0.00 0.00 0.00 0.00 60.65 61.12 2vxf s ILE 8 Cb 0.14 -3.32 0.00 0.00 0.01 0.00 0.00 42.46 39.29 2vxf s ILE 8 CO 0.57 0.12 0.00 0.61 0.00 0.00 0.00 174.94 176.24 2vxf n GLY 9 N 0.72 0.67 3.84 6.18 0.00 -0.00 -5.02 105.19 111.58 2vxf n GLY 9 Ca 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.71 2vxf n GLY 9 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2vxf s SER 10 N -2.90 5.65 -0.07 1.61 0.01 -0.94 -4.64 113.70 112.43 2vxf s SER 10 Ca 0.00 1.56 -0.23 0.00 1.31 0.00 0.00 55.95 58.59 2vxf s SER 10 Cb 0.00 -2.49 -0.04 0.00 0.21 0.00 0.00 66.02 63.71 2vxf s SER 10 CO 0.00 -1.26 0.69 -0.75 0.41 0.00 0.00 173.24 172.33 2vxf s LYS 11 N -5.07 4.43 0.06 12.44 2.20 -1.26 -1.78 119.74 130.76 2vxf s LYS 11 Ca 0.57 0.86 0.04 0.00 -0.36 0.00 0.00 55.97 57.08 2vxf s LYS 11 Cb -0.13 -3.45 -0.03 0.00 -1.51 0.00 0.00 37.83 32.71 2vxf s LYS 11 CO 0.54 0.06 -0.12 0.42 -0.36 0.00 0.00 175.35 175.90 2vxf s ILE 12 N 0.81 0.89 -0.10 5.43 1.01 -0.85 -2.49 121.20 125.90 2vxf s ILE 12 Ca 0.37 -1.23 0.02 0.00 0.00 0.00 0.00 60.65 59.81 2vxf s ILE 12 Cb -0.18 -0.90 -0.02 0.00 0.01 0.00 0.00 42.46 41.38 2vxf s ILE 12 CO 0.18 -0.29 -0.16 -0.55 0.00 0.00 0.00 174.94 174.11 2vxf s SER 13 N -1.70 3.80 -0.04 3.58 0.15 -0.76 -2.60 113.70 116.13 2vxf s SER 13 Ca -0.05 -0.34 0.06 0.00 0.70 0.00 0.00 55.95 56.32 2vxf s SER 13 Cb -0.10 -1.32 -0.01 0.00 -1.71 0.00 0.00 66.02 62.88 2vxf s SER 13 CO 0.01 0.22 -0.22 -0.22 1.20 0.00 0.00 173.24 174.23 2vxf s LEU 14 N 0.03 2.02 -0.22 3.45 2.96 -0.45 -2.25 118.68 124.22 2vxf s LEU 14 Ca -0.06 -0.43 -0.05 0.00 -0.22 0.00 0.00 54.13 53.37 2vxf s LEU 14 Cb -0.15 -1.19 -0.02 0.00 0.50 0.00 0.00 46.19 45.34 2vxf s LEU 14 CO 0.05 0.23 -0.00 -0.63 -1.32 0.00 0.00 176.35 174.67 2vxf s ILE 15 N -0.24 3.78 0.58 6.68 1.01 -0.74 -1.90 121.20 130.37 2vxf s ILE 15 Ca 0.01 -0.36 0.01 0.00 0.00 0.00 0.00 60.65 60.31 2vxf s ILE 15 Cb -0.11 -2.73 0.05 0.00 0.01 0.00 0.00 42.46 39.68 2vxf s ILE 15 CO 0.02 0.41 0.81 -0.44 0.00 0.00 0.00 174.94 175.73 2vxf s SER 16 N 1.34 5.12 0.61 3.58 0.01 -1.08 -0.81 113.70 122.46 2vxf s SER 16 Ca 0.04 -0.09 0.41 0.00 1.31 0.00 0.00 55.95 57.62 2vxf s SER 16 Cb -0.15 -0.70 2.21 0.00 0.21 0.00 0.00 66.02 67.60 2vxf s SER 16 CO 0.00 -1.27 2.25 0.50 0.41 0.00 0.00 173.24 175.13 2vxf h LYS 17 N -0.03 0.00 -0.66 12.44 1.63 -1.36 -1.58 116.57 127.02 2vxf h LYS 17 Ca -0.41 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.39 2vxf h LYS 17 Cb 1.29 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.92 2vxf h LYS 17 CO 0.50 0.00 0.00 0.00 -3.45 0.00 0.00 179.45 176.50 2vxf n ALA 18 N -2.03 2.97 -2.27 5.00 0.00 -1.26 -4.88 120.51 118.03 2vxf n ALA 18 Ca -0.03 -0.88 -0.18 0.00 0.00 0.00 0.00 53.44 52.35 2vxf n ALA 18 Cb 0.07 -1.04 -0.02 0.00 0.00 0.00 0.00 19.45 18.46 2vxf n ALA 18 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2vxf n GLU 19 N 0.41 -1.77 -4.09 0.00 1.02 -0.59 -4.91 120.64 110.71 2vxf n GLU 19 Ca 0.14 0.93 -0.32 0.00 -0.02 0.00 0.00 57.16 57.89 2vxf n GLU 19 Cb 0.60 -5.53 -0.07 0.00 -0.02 0.00 0.00 31.44 26.43 2vxf n GLU 19 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 2vxf s ILE 20 N -2.87 4.62 -0.25 -3.67 1.01 -1.26 -4.54 121.20 114.25 2vxf s ILE 20 Ca 0.00 -0.58 -0.07 0.00 0.00 0.00 0.00 60.65 60.00 2vxf s ILE 20 Cb 0.00 -3.17 -0.03 0.00 0.01 0.00 0.00 42.46 39.28 2vxf s ILE 20 CO 0.00 0.25 0.06 -0.60 0.00 0.00 0.00 174.94 174.65 2vxf s ARG 21 N -2.04 3.61 -0.09 2.79 3.52 -1.26 -2.63 118.95 122.86 2vxf s ARG 21 Ca 0.26 -0.50 0.00 0.00 -0.13 0.00 0.00 55.73 55.36 2vxf s ARG 21 Cb -0.12 -3.30 -0.03 0.00 -1.56 0.00 0.00 34.95 29.94 2vxf s ARG 21 CO 0.18 -0.20 -0.08 0.71 -0.81 0.00 0.00 175.30 175.10 2vxf s TYR 22 N 1.60 2.90 -0.01 5.12 2.02 -0.80 -2.32 117.35 125.86 2vxf s TYR 22 Ca 0.06 -0.13 0.08 0.00 -0.37 0.00 0.00 57.07 56.71 2vxf s TYR 22 Cb -0.15 -1.75 -0.02 0.00 -0.40 0.00 0.00 41.96 39.64 2vxf s TYR 22 CO 0.03 0.19 -0.24 -2.00 -1.57 0.00 0.00 175.55 171.95 2vxf s GLU 23 N -0.48 1.93 0.21 -0.62 2.12 -0.94 -1.34 118.70 119.58 2vxf s GLU 23 Ca 0.07 -0.90 -0.18 0.00 0.36 0.00 0.00 54.97 54.32 2vxf s GLU 23 Cb -0.12 -1.90 0.06 0.00 0.26 0.00 0.00 34.13 32.44 2vxf s GLU 23 CO 0.02 0.52 0.88 0.41 -0.54 0.00 0.00 175.26 176.54 2vxf n GLY 24 N 2.38 0.77 3.70 -1.50 0.00 -1.07 -1.55 105.19 107.91 2vxf n GLY 24 Ca -0.16 -1.15 -0.35 0.00 0.00 0.00 0.00 46.02 44.36 2vxf n GLY 24 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2vxf s ILE 25 N -2.13 4.57 -0.33 -0.61 -1.09 -1.09 -2.00 121.20 118.52 2vxf s ILE 25 Ca 0.19 -0.14 -0.28 0.00 -2.23 0.00 0.00 60.65 58.19 2vxf s ILE 25 Cb -0.03 -2.96 -0.03 0.00 -1.58 0.00 0.00 42.46 37.86 2vxf s ILE 25 CO 0.06 0.58 1.91 -0.22 -1.23 0.00 0.00 174.94 176.05 2vxf s LEU 26 N -0.67 3.47 -0.22 2.97 2.96 -0.73 -2.80 118.68 123.66 2vxf s LEU 26 Ca 0.11 1.35 -0.17 0.00 -0.22 0.00 0.00 54.13 55.20 2vxf s LEU 26 Cb -0.12 -3.41 -0.14 0.00 0.50 0.00 0.00 46.19 43.03 2vxf s LEU 26 CO 0.02 -1.85 -0.05 0.00 -1.32 0.00 0.00 176.35 173.16 2vxf n TYR 27 N 10.96 0.65 -3.86 5.38 9.36 -1.10 -0.82 117.16 137.72 2vxf n TYR 27 Ca 0.25 0.28 -0.12 0.00 3.32 0.00 0.00 57.90 61.63 2vxf n TYR 27 Cb 0.47 -0.98 -0.13 0.00 -0.63 0.00 0.00 39.34 38.07 2vxf n TYR 27 CO 0.00 0.00 0.00 0.95 0.22 0.00 0.00 176.86 178.03 2vxf s THR 28 N -2.43 0.01 -0.15 2.97 -4.23 -1.13 -4.79 115.64 105.90 2vxf s THR 28 Ca -0.30 -0.11 0.01 0.00 -1.18 0.00 0.00 61.69 60.11 2vxf s THR 28 Cb 0.08 -0.12 0.00 0.00 1.34 0.00 0.00 72.50 73.80 2vxf s THR 28 CO 0.50 -0.06 -0.18 -0.63 -0.54 0.00 0.00 174.62 173.70 2vxf s ILE 29 N -0.16 2.38 -0.48 2.99 1.01 -1.26 -2.08 121.20 123.60 2vxf s ILE 29 Ca -0.02 -0.87 -0.04 0.00 0.00 0.00 0.00 60.65 59.73 2vxf s ILE 29 Cb -0.02 -1.99 0.13 0.00 0.01 0.00 0.00 42.46 40.59 2vxf s ILE 29 CO 0.00 0.53 0.29 -0.62 0.00 0.00 0.00 174.94 175.14 2vxf s ASP 30 N 0.85 5.32 0.21 3.58 -1.08 -0.81 -4.95 116.67 119.79 2vxf s ASP 30 Ca -0.05 -2.24 -0.02 0.00 -0.52 0.00 0.00 52.55 49.71 2vxf s ASP 30 Cb -0.15 -1.86 0.17 0.00 -1.46 0.00 0.00 42.92 39.62 2vxf s ASP 30 CO -0.02 -0.52 1.56 0.74 0.52 0.00 0.00 175.17 177.46 2vxf h THR 31 N 6.04 1.30 -0.08 1.71 2.02 -1.98 -2.47 112.91 119.46 2vxf h THR 31 Ca -0.11 -1.64 0.02 0.00 0.77 0.00 0.00 66.41 65.46 2vxf h THR 31 Cb 1.03 1.61 -0.00 0.00 -1.74 0.00 0.00 68.15 69.04 2vxf h THR 31 CO 0.72 0.52 0.06 -0.33 0.37 0.00 0.00 175.52 176.85 2vxf h GLU 32 N 0.47 0.00 -0.15 6.66 5.08 -1.94 -2.03 114.58 122.67 2vxf h GLU 32 Ca 0.03 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.39 2vxf h GLU 32 Cb 0.96 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.21 2vxf h GLU 32 CO 0.09 0.00 0.00 0.09 -1.00 0.00 0.00 179.01 178.19 2vxf n ASN 33 N -4.46 2.72 -3.94 1.42 3.02 -1.22 -4.99 115.26 107.81 2vxf n ASN 33 Ca -0.01 -2.43 -0.27 0.00 -0.03 0.00 0.00 54.58 51.84 2vxf n ASN 33 Cb 0.16 -0.26 -0.00 0.00 -0.61 0.00 0.00 39.78 39.07 2vxf n ASN 33 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 2vxf n SER 34 N -0.40 -1.74 -4.15 6.41 7.64 -0.76 -4.89 113.62 115.72 2vxf n SER 34 Ca 0.11 -0.93 -0.17 0.00 1.01 0.00 0.00 58.87 58.88 2vxf n SER 34 Cb 0.51 -3.35 -0.12 0.00 -1.01 0.00 0.00 64.21 60.25 2vxf n SER 34 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 2vxf s THR 35 N -3.68 1.01 -0.01 0.44 -4.23 -0.94 -2.31 115.64 105.93 2vxf s THR 35 Ca 0.24 -1.25 0.03 0.00 -1.18 0.00 0.00 61.69 59.52 2vxf s THR 35 Cb -0.13 -0.99 -0.01 0.00 1.34 0.00 0.00 72.50 72.72 2vxf s THR 35 CO 0.87 -0.24 -0.09 -0.69 -0.54 0.00 0.00 174.62 173.93 2vxf s VAL 36 N -1.27 0.68 -0.14 2.29 1.01 -0.93 -1.92 120.40 120.12 2vxf s VAL 36 Ca -0.03 -0.38 -0.01 0.00 0.00 0.00 0.00 61.98 61.55 2vxf s VAL 36 Cb -0.10 -0.57 -0.02 0.00 0.00 0.00 0.00 36.38 35.69 2vxf s VAL 36 CO 0.02 0.18 -0.10 0.00 0.00 0.00 0.00 175.10 175.20 2vxf s ALA 37 N -0.23 2.75 -0.05 5.51 0.00 -0.88 -2.22 121.76 126.64 2vxf s ALA 37 Ca 0.03 -0.86 0.05 0.00 0.00 0.00 0.00 51.96 51.18 2vxf s ALA 37 Cb -0.03 -1.33 -0.02 0.00 0.00 0.00 0.00 23.12 21.73 2vxf s ALA 37 CO -0.00 0.24 -0.19 -0.51 0.00 0.00 0.00 175.76 175.30 2vxf s LEU 38 N 0.34 2.43 0.30 0.00 1.43 -0.93 -2.70 118.68 119.55 2vxf s LEU 38 Ca -0.09 -0.34 0.09 0.00 -1.03 0.00 0.00 54.13 52.77 2vxf s LEU 38 Cb -0.15 -1.47 -0.05 0.00 0.03 0.00 0.00 46.19 44.55 2vxf s LEU 38 CO 0.05 0.30 -0.00 0.00 0.23 0.00 0.00 176.35 176.93 2vxf s ALA 39 N -0.48 3.18 -1.08 4.21 0.00 -1.12 -2.18 121.76 124.28 2vxf s ALA 39 Ca 0.06 -1.81 -0.16 0.00 0.00 0.00 0.00 51.96 50.05 2vxf s ALA 39 Cb -0.12 -0.57 -0.02 0.00 0.00 0.00 0.00 23.12 22.42 2vxf s ALA 39 CO 0.01 0.17 0.80 1.63 0.00 0.00 0.00 175.76 178.37 2vxf n LYS 40 N -0.92 -1.40 -4.67 0.00 5.02 -0.69 -2.68 118.16 112.82 2vxf n LYS 40 Ca -0.05 0.61 -0.27 0.00 -2.02 0.00 0.00 58.31 56.58 2vxf n LYS 40 Cb 0.61 -4.42 -0.14 0.00 -0.02 0.00 0.00 35.03 31.06 2vxf n LYS 40 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 2vxf s VAL 41 N -3.39 1.92 0.06 -0.18 0.11 -1.02 -4.16 120.40 113.73 2vxf s VAL 41 Ca 0.42 -1.38 0.04 0.00 -2.93 0.00 0.00 61.98 58.13 2vxf s VAL 41 Cb -0.13 -1.67 -0.03 0.00 -1.53 0.00 0.00 36.38 33.02 2vxf s VAL 41 CO 0.84 0.22 -0.11 -0.13 -3.33 0.00 0.00 175.10 172.58 2vxf s ARG 42 N -1.39 0.70 -0.19 1.54 0.52 -0.60 -2.02 118.95 117.51 2vxf s ARG 42 Ca 0.10 -0.84 -0.13 0.00 -0.52 0.00 0.00 55.73 54.34 2vxf s ARG 42 Cb -0.10 -0.61 -0.05 0.00 0.52 0.00 0.00 34.95 34.72 2vxf s ARG 42 CO 0.03 0.13 0.26 -1.54 0.02 0.00 0.00 175.30 174.20 2vxf s SER 43 N -1.59 6.33 0.15 0.23 1.04 -1.26 -2.22 113.70 116.38 2vxf s SER 43 Ca -0.05 0.37 -0.11 0.00 0.48 0.00 0.00 55.95 56.65 2vxf s SER 43 Cb -0.10 -2.16 -0.02 0.00 0.10 0.00 0.00 66.02 63.84 2vxf s SER 43 CO 0.01 0.06 1.51 -0.26 0.98 0.00 0.00 173.24 175.55 2vxf h PHE 44 N 7.03 1.12 0.00 5.02 0.04 -1.87 -3.47 116.94 124.82 2vxf h PHE 44 Ca -0.39 -0.30 0.00 0.00 2.80 0.00 0.00 57.97 60.08 2vxf h PHE 44 Cb 1.16 -0.25 0.00 0.00 2.20 0.00 0.00 35.95 39.06 2vxf h PHE 44 CO 0.63 1.13 0.00 0.41 -0.60 0.00 0.00 178.31 179.88 2vxf n GLY 45 N 0.00 1.32 0.01 -1.45 0.00 -1.26 -5.05 105.19 98.77 2vxf n GLY 45 Ca -0.01 -1.00 -0.01 0.00 0.00 0.00 0.00 46.02 45.00 2vxf n GLY 45 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2vxf n THR 46 N -0.61 0.14 0.25 2.61 -2.24 -1.26 -4.30 114.28 108.86 2vxf n THR 46 Ca 0.00 -0.08 0.08 0.00 -2.27 0.00 0.00 64.05 61.78 2vxf n THR 46 Cb 0.00 -0.92 0.62 0.00 -2.10 0.00 0.00 70.33 67.93 2vxf n THR 46 CO 0.00 0.00 0.00 -0.08 -0.57 0.00 0.00 175.07 174.42 2vxf h GLU 47 N 0.00 0.00 -0.23 -0.78 4.81 -1.96 -2.00 114.58 114.42 2vxf h GLU 47 Ca -0.05 0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 59.17 2vxf h GLU 47 Cb 1.12 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.49 2vxf h GLU 47 CO 0.00 0.11 0.14 0.22 -0.73 0.00 0.00 179.01 178.76 2vxf h ASP 48 N 0.00 0.27 -3.99 1.04 -0.00 -1.95 -3.32 116.42 108.47 2vxf h ASP 48 Ca -0.00 -0.01 -0.66 0.00 -0.00 0.00 0.00 57.03 56.36 2vxf h ASP 48 Cb 0.22 -0.07 -0.40 0.00 -0.00 0.00 0.00 39.33 39.08 2vxf h ASP 48 CO 0.01 0.21 -0.65 -0.13 -0.00 0.00 0.00 179.24 178.69 2vxf s ARG 49 N -5.28 1.80 0.24 0.28 0.52 -0.75 -5.09 118.95 110.67 2vxf s ARG 49 Ca -0.07 -2.24 -0.31 0.00 -0.52 0.00 0.00 55.73 52.60 2vxf s ARG 49 Cb 0.17 -3.32 -0.13 0.00 0.52 0.00 0.00 34.95 32.19 2vxf s ARG 49 CO 0.71 -1.04 1.42 -2.30 0.02 0.00 0.00 175.30 174.11 2vxf n PRO 50 N 3.74 2.08 -4.29 3.54 -0.02 -1.25 -4.89 135.00 133.92 2vxf n PRO 50 Ca 0.04 0.74 -0.15 0.00 -2.02 0.00 0.00 63.50 62.11 2vxf n PRO 50 Cb 0.37 -2.41 -0.10 0.00 -0.02 0.00 0.00 33.50 31.34 2vxf n PRO 50 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 2vxf s THR 51 N -0.04 0.87 -1.79 3.45 -4.23 -1.26 -5.03 115.64 107.61 2vxf s THR 51 Ca 0.68 -2.01 0.28 0.00 -1.18 0.00 0.00 61.69 59.46 2vxf s THR 51 Cb -0.64 -2.25 0.68 0.00 1.34 0.00 0.00 72.50 71.63 2vxf s THR 51 CO 0.49 -0.38 1.99 0.47 -0.54 0.00 0.00 174.62 176.66 2vxf n ASP 52 N -0.34 0.00 -4.11 3.99 8.00 -1.26 -4.54 116.55 118.29 2vxf n ASP 52 Ca -0.06 -0.59 -0.34 0.00 0.71 0.00 0.00 54.79 54.52 2vxf n ASP 52 Cb 0.64 -0.11 -0.14 0.00 -0.02 0.00 0.00 41.12 41.49 2vxf n ASP 52 CO 0.00 0.00 0.00 -0.60 -0.39 0.00 0.00 177.20 176.21 2vxf s ARG 53 N -2.21 2.16 0.25 -1.24 3.52 -1.26 -5.09 118.95 115.07 2vxf s ARG 53 Ca 0.36 -1.47 -0.30 0.00 -0.13 0.00 0.00 55.73 54.19 2vxf s ARG 53 Cb 0.19 -3.16 -0.11 0.00 -1.56 0.00 0.00 34.95 30.31 2vxf s ARG 53 CO 0.36 -0.73 1.55 -2.14 -0.81 0.00 0.00 175.30 173.53 2vxf s PRO 54 N 1.13 4.18 0.06 5.12 0.02 -1.26 -5.02 135.00 139.24 2vxf s PRO 54 Ca -0.02 2.46 0.09 0.00 0.02 0.00 0.00 61.00 63.55 2vxf s PRO 54 Cb -0.20 -3.07 -0.03 0.00 0.02 0.00 0.00 34.50 31.22 2vxf s PRO 54 CO -0.04 -0.56 -0.24 0.42 -0.33 0.00 0.00 177.00 176.25 2vxf s ILE 55 N 0.23 1.98 0.30 2.83 -1.09 -1.26 -5.14 121.20 119.05 2vxf s ILE 55 Ca 0.64 -1.41 -0.01 0.00 -2.23 0.00 0.00 60.65 57.64 2vxf s ILE 55 Cb -0.45 -1.72 -0.04 0.00 -1.58 0.00 0.00 42.46 38.67 2vxf s ILE 55 CO 0.43 0.23 0.52 0.00 -1.23 0.00 0.00 174.94 174.89 2vxf s ALA 56 N -0.88 3.71 0.68 9.38 0.00 -1.26 -4.94 121.76 128.45 2vxf s ALA 56 Ca 0.10 -0.82 -0.16 0.00 0.00 0.00 0.00 51.96 51.08 2vxf s ALA 56 Cb -0.10 -2.12 0.01 0.00 0.00 0.00 0.00 23.12 20.91 2vxf s ALA 56 CO 0.03 0.13 1.22 -2.14 0.00 0.00 0.00 175.76 175.00 2vxf s PRO 57 N -3.95 2.43 0.00 0.00 0.02 -1.26 -4.95 135.00 127.29 2vxf s PRO 57 Ca 0.40 1.83 0.00 0.00 0.02 0.00 0.00 61.00 63.26 2vxf s PRO 57 Cb -0.10 -1.86 0.00 0.00 0.02 0.00 0.00 34.50 32.56 2vxf s PRO 57 CO 0.33 -1.63 0.00 0.54 -0.33 0.00 0.00 177.00 175.91 2vxf n ARG 58 N -2.28 0.00 -3.85 5.54 1.74 -1.26 -5.04 116.66 111.51 2vxf n ARG 58 Ca 0.14 0.00 -0.30 0.00 -0.77 0.00 0.00 57.85 56.92 2vxf n ARG 58 Cb 0.50 -0.03 0.02 0.00 -1.02 0.00 0.00 32.46 31.92 2vxf n ARG 58 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 2vxf n ASP 59 N -2.54 -4.63 -4.49 0.55 10.43 -1.26 -4.97 116.55 109.64 2vxf n ASP 59 Ca 0.00 -0.74 -0.27 0.00 2.57 0.00 0.00 54.79 56.35 2vxf n ASP 59 Cb 0.03 -3.72 -0.11 0.00 1.84 0.00 0.00 41.12 39.17 2vxf n ASP 59 CO 0.00 0.00 0.00 -0.70 -1.07 0.00 0.00 177.20 175.43 2vxf s GLU 60 N -6.56 1.76 -0.14 -1.24 2.12 -1.26 -5.13 118.70 108.26 2vxf s GLU 60 Ca 0.64 -1.43 -0.06 0.00 0.36 0.00 0.00 54.97 54.48 2vxf s GLU 60 Cb -0.32 -1.98 -0.04 0.00 0.26 0.00 0.00 34.13 32.05 2vxf s GLU 60 CO 0.78 0.41 0.08 0.99 -0.54 0.00 0.00 175.26 176.98 2vxf s THR 61 N -1.73 4.96 -0.16 -1.70 2.01 -1.26 -4.60 115.64 113.15 2vxf s THR 61 Ca 0.23 0.01 -0.08 0.00 0.31 0.00 0.00 61.69 62.17 2vxf s THR 61 Cb -0.08 -3.18 -0.04 0.00 0.01 0.00 0.00 72.50 69.21 2vxf s THR 61 CO 0.12 0.54 0.09 -0.36 -0.69 0.00 0.00 174.62 174.33 2vxf s PHE 62 N -0.38 3.36 0.09 4.92 0.08 -0.86 -4.99 117.98 120.22 2vxf s PHE 62 Ca 0.10 0.26 -0.16 0.00 0.12 0.00 0.00 56.93 57.24 2vxf s PHE 62 Cb -0.12 -2.05 -0.08 0.00 -0.57 0.00 0.00 43.02 40.21 2vxf s PHE 62 CO 0.02 0.35 1.45 1.49 -0.10 0.00 0.00 175.22 178.43 2vxf h GLU 63 N 6.17 0.60 -2.69 0.44 4.57 -1.94 -2.70 114.58 119.03 2vxf h GLU 63 Ca -0.43 -0.27 -0.15 0.00 -1.18 0.00 0.00 59.36 57.33 2vxf h GLU 63 Cb 1.18 -0.02 -0.29 0.00 -0.16 0.00 0.00 28.75 29.46 2vxf h GLU 63 CO 0.68 0.84 -0.42 -0.47 -1.18 0.00 0.00 179.01 178.46 2vxf s TYR 64 N -4.58 -0.61 0.05 0.92 6.14 -1.26 -1.71 117.35 116.30 2vxf s TYR 64 Ca -0.13 1.25 0.05 0.00 0.64 0.00 0.00 57.07 58.88 2vxf s TYR 64 Cb 0.08 0.16 -0.02 0.00 0.42 0.00 0.00 41.96 42.60 2vxf s TYR 64 CO 0.79 -0.40 -0.14 0.42 0.64 0.00 0.00 175.55 176.87 2vxf s ILE 65 N 2.29 1.08 -0.08 3.14 1.01 -0.93 -5.03 121.20 122.67 2vxf s ILE 65 Ca -0.02 -1.13 0.01 0.00 0.00 0.00 0.00 60.65 59.50 2vxf s ILE 65 Cb -0.11 -1.01 -0.03 0.00 0.01 0.00 0.00 42.46 41.32 2vxf s ILE 65 CO -0.11 -0.12 -0.08 -0.63 0.00 0.00 0.00 174.94 174.00 2vxf s ILE 66 N -1.06 3.56 0.04 2.92 1.01 -1.26 -2.19 121.20 124.22 2vxf s ILE 66 Ca -0.01 -0.52 0.05 0.00 0.00 0.00 0.00 60.65 60.18 2vxf s ILE 66 Cb -0.09 -2.46 -0.02 0.00 0.01 0.00 0.00 42.46 39.90 2vxf s ILE 66 CO 0.02 0.58 -0.16 -0.36 0.00 0.00 0.00 174.94 175.02 2vxf s PHE 67 N -0.53 1.36 0.13 3.97 0.08 -0.94 -5.04 117.98 117.01 2vxf s PHE 67 Ca 0.08 -0.36 0.06 0.00 0.12 0.00 0.00 56.93 56.83 2vxf s PHE 67 Cb -0.12 -0.80 -0.04 0.00 -0.57 0.00 0.00 43.02 41.49 2vxf s PHE 67 CO 0.02 0.05 0.02 1.03 -0.10 0.00 0.00 175.22 176.24 2vxf s ARG 68 N -1.16 2.57 0.58 0.44 0.52 -1.26 -2.19 118.95 118.44 2vxf s ARG 68 Ca 0.03 -0.93 0.28 0.00 -0.52 0.00 0.00 55.73 54.59 2vxf s ARG 68 Cb -0.08 -2.50 1.64 0.00 0.52 0.00 0.00 34.95 34.52 2vxf s ARG 68 CO 0.01 0.50 2.12 0.78 0.02 0.00 0.00 175.30 178.74 2vxf h GLY 69 N 3.02 0.00 0.89 -3.53 0.00 -1.80 -2.17 103.07 99.48 2vxf h GLY 69 Ca -0.47 0.00 -0.04 0.00 0.00 0.00 0.00 47.33 46.81 2vxf h GLY 69 CO 0.60 0.00 0.02 1.76 0.00 0.00 0.00 176.54 178.92 2vxf h SER 70 N 0.00 0.51 0.80 0.19 0.02 -1.95 -3.21 113.55 109.92 2vxf h SER 70 Ca 0.08 -0.29 -0.24 0.00 -0.84 0.00 0.00 61.79 60.50 2vxf h SER 70 Cb 0.42 -0.14 -0.02 0.00 0.14 0.00 0.00 62.40 62.80 2vxf h SER 70 CO -0.00 0.67 -1.20 -2.24 -1.14 0.00 0.00 176.83 172.92 2vxf h ASP 71 N 0.33 0.11 -3.93 3.07 2.03 -1.84 -3.46 116.42 112.74 2vxf h ASP 71 Ca 0.09 -0.13 -0.52 0.00 -0.73 0.00 0.00 57.03 55.73 2vxf h ASP 71 Cb 0.39 -0.04 0.08 0.00 -0.83 0.00 0.00 39.33 38.93 2vxf h ASP 71 CO 0.01 1.11 0.62 -0.63 -1.03 0.00 0.00 179.24 179.31 2vxf s ILE 72 N -2.67 2.66 -0.16 4.15 1.01 -0.87 -0.95 121.20 124.37 2vxf s ILE 72 Ca -0.02 0.61 -0.02 0.00 0.00 0.00 0.00 60.65 61.22 2vxf s ILE 72 Cb 0.09 -3.37 -0.09 0.00 0.01 0.00 0.00 42.46 39.10 2vxf s ILE 72 CO 0.83 0.10 -0.17 1.17 0.00 0.00 0.00 174.94 176.88 2vxf n LYS 73 N 0.31 0.38 -3.92 2.79 4.81 0.01 -4.81 118.16 117.73 2vxf n LYS 73 Ca 0.03 0.11 -0.10 0.00 -0.87 0.00 0.00 58.31 57.48 2vxf n LYS 73 Cb 0.43 -1.24 -0.11 0.00 0.02 0.00 0.00 35.03 34.13 2vxf n LYS 73 CO 0.00 0.00 0.00 0.34 1.17 0.00 0.00 177.40 178.91 2vxf s ASP 74 N -5.86 0.10 -0.05 3.14 -1.08 -1.12 -5.02 116.67 106.78 2vxf s ASP 74 Ca -0.22 -0.25 0.01 0.00 -0.52 0.00 0.00 52.55 51.57 2vxf s ASP 74 Cb 0.07 0.14 0.02 0.00 -1.46 0.00 0.00 42.92 41.68 2vxf s ASP 74 CO 0.34 -0.25 -0.07 -0.22 0.52 0.00 0.00 175.17 175.49 2vxf s LEU 75 N -1.05 1.43 0.00 -1.34 0.20 -1.26 -1.79 118.68 114.86 2vxf s LEU 75 Ca -0.12 -0.19 0.04 0.00 0.69 0.00 0.00 54.13 54.55 2vxf s LEU 75 Cb -0.07 -0.58 -0.01 0.00 -0.43 0.00 0.00 46.19 45.10 2vxf s LEU 75 CO 0.00 -0.03 -0.11 -0.89 -0.29 0.00 0.00 176.35 175.03 2vxf s THR 76 N 0.85 0.88 -0.04 3.68 2.01 -0.95 -5.05 115.64 117.02 2vxf s THR 76 Ca -0.12 -0.58 -0.03 0.00 0.31 0.00 0.00 61.69 61.27 2vxf s THR 76 Cb -0.15 -0.76 -0.04 0.00 0.01 0.00 0.00 72.50 71.57 2vxf s THR 76 CO 0.01 0.17 0.12 -0.69 -0.69 0.00 0.00 174.62 173.54 2vxf s VAL 77 N -0.41 5.09 -0.16 3.82 1.01 -1.26 -1.83 120.40 126.67 2vxf s VAL 77 Ca 0.03 -0.18 0.02 0.00 0.00 0.00 0.00 61.98 61.85 2vxf s VAL 77 Cb -0.05 -3.31 -0.23 0.00 0.00 0.00 0.00 36.38 32.79 2vxf s VAL 77 CO -0.00 0.42 0.22 0.00 0.00 0.00 0.00 175.10 175.74 2vxf s GLU 79 N -2.55 4.04 0.68 0.00 0.41 -1.26 -5.03 118.70 114.99 2vxf s GLU 79 Ca -0.21 0.81 -0.14 0.00 -0.41 0.00 0.00 54.97 55.02 2vxf s GLU 79 Cb 0.07 -3.71 0.01 0.00 -1.78 0.00 0.00 34.13 28.72 2vxf s GLU 79 CO 0.74 -0.72 1.11 -1.25 -0.49 0.00 0.00 175.26 174.65 2vxf s PRO 80 N 3.15 2.67 0.61 0.39 0.04 -1.26 -5.00 135.00 135.59 2vxf s PRO 80 Ca 0.37 1.36 -0.17 0.00 0.04 0.00 0.00 61.00 62.59 2vxf s PRO 80 Cb -0.14 -1.94 -0.03 0.00 0.04 0.00 0.00 34.50 32.44 2vxf s PRO 80 CO 0.12 -1.35 1.14 -1.25 0.04 0.00 0.00 177.00 175.70 2vxf s PRO 81 N -4.25 3.00 0.37 0.56 0.04 -1.26 -5.04 135.00 128.41 2vxf s PRO 81 Ca 0.66 1.57 0.04 0.00 0.04 0.00 0.00 61.00 63.31 2vxf s PRO 81 Cb -0.20 -1.96 -0.01 0.00 0.04 0.00 0.00 34.50 32.37 2vxf s PRO 81 CO 0.45 -1.13 0.54 0.15 0.04 0.00 0.00 177.00 177.05 2vxf s LYS 82 N -3.64 3.13 0.54 4.56 1.02 -1.26 -5.07 119.74 119.02 2vxf s LYS 82 Ca 0.71 -0.76 -0.20 0.00 0.02 0.00 0.00 55.97 55.74 2vxf s LYS 82 Cb -0.24 -2.72 -0.05 0.00 -0.52 0.00 0.00 37.83 34.30 2vxf s LYS 82 CO 0.35 -0.04 1.20 -1.25 -0.92 0.00 0.00 175.35 174.69 2vxf s PRO 83 N -4.32 3.29 -0.10 -1.68 0.04 -1.26 -4.96 135.00 126.01 2vxf s PRO 83 Ca 0.45 1.82 0.00 0.00 0.04 0.00 0.00 61.00 63.32 2vxf s PRO 83 Cb -0.10 -2.12 -0.02 0.00 0.04 0.00 0.00 34.50 32.30 2vxf s PRO 83 CO 0.34 -0.95 -0.09 0.42 0.04 0.00 0.00 177.00 176.75 2vxf s ILE 84 N -1.58 3.44 0.00 0.56 1.09 -1.26 -4.71 121.20 118.75 2vxf s ILE 84 Ca 0.72 -0.55 0.00 0.00 -1.10 0.00 0.00 60.65 59.72 2vxf s ILE 84 Cb -0.30 -2.43 0.00 0.00 -1.06 0.00 0.00 42.46 38.67 2vxf s ILE 84 CO 0.34 0.56 0.00 1.15 -0.10 0.00 0.00 174.94 176.89