#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 0.00 -3.37 1.96 1.02 -1.26 -5.08 120.64 113.91 2vxf n GLU -1 Ca 0.00 0.00 -0.35 0.00 -0.02 0.00 0.00 57.16 56.79 2vxf n GLU -1 Cb 0.00 -0.28 -0.06 0.00 -0.02 0.00 0.00 31.44 31.08 2vxf n GLU -1 CO 0.00 0.00 0.00 0.16 1.18 0.00 0.00 177.13 178.47 2vxf s ASP 0 N -5.41 6.82 0.33 1.62 -4.77 -1.26 -4.98 116.67 109.02 2vxf s ASP 0 Ca 0.00 1.07 0.04 0.00 -3.30 0.00 0.00 52.55 50.36 2vxf s ASP 0 Cb 0.00 -2.28 0.59 0.00 -1.09 0.00 0.00 42.92 40.13 2vxf s ASP 0 CO 0.00 0.11 1.85 -0.65 0.70 0.00 0.00 175.17 177.19 2vxf h PRO 1 N 3.61 0.50 -0.55 2.11 0.11 -1.97 -2.60 132.00 133.21 2vxf h PRO 1 Ca -0.49 -0.12 -0.08 0.00 0.11 0.00 0.00 66.00 65.42 2vxf h PRO 1 Cb 1.19 -0.07 -0.02 0.00 0.11 0.00 0.00 31.00 32.21 2vxf h PRO 1 CO 0.66 0.56 0.01 0.66 -0.21 0.00 0.00 178.00 179.68 2vxf h SER 2 N 0.47 0.90 -0.04 -2.05 4.64 -1.94 0.16 113.55 115.69 2vxf h SER 2 Ca 0.10 -0.23 -0.18 0.00 -0.47 0.00 0.00 61.79 61.00 2vxf h SER 2 Cb 0.38 -0.24 -0.00 0.00 -0.31 0.00 0.00 62.40 62.23 2vxf h SER 2 CO 0.02 0.96 -0.62 1.23 -0.87 0.00 0.00 176.83 177.54 2vxf h GLY 3 N 1.00 0.72 1.25 -0.77 0.00 -1.94 -3.20 103.07 100.14 2vxf h GLY 3 Ca 0.16 -0.90 -0.17 0.00 0.00 0.00 0.00 47.33 46.42 2vxf h GLY 3 CO 0.02 0.80 -0.52 -1.33 0.00 0.00 0.00 176.54 175.52 2vxf h GLY 4 N 0.91 0.86 -6.64 4.60 0.00 -1.13 -3.42 103.07 98.25 2vxf h GLY 4 Ca -0.01 -0.98 -0.65 0.00 0.00 0.00 0.00 47.33 45.69 2vxf h GLY 4 CO 0.12 0.88 -0.69 -1.59 0.00 0.00 0.00 176.54 175.27 2vxf s THR 5 N -4.14 3.72 0.50 4.70 2.01 0.54 -5.10 115.64 117.88 2vxf s THR 5 Ca -0.10 -0.39 -0.21 0.00 0.31 0.00 0.00 61.69 61.31 2vxf s THR 5 Cb 0.11 -2.69 -0.07 0.00 0.01 0.00 0.00 72.50 69.86 2vxf s THR 5 CO 0.87 0.42 1.10 -2.16 -0.69 0.00 0.00 174.62 174.16 2vxf s PRO 6 N 1.18 3.63 0.52 4.92 0.04 -1.26 -4.59 135.00 139.45 2vxf s PRO 6 Ca 0.03 1.54 0.18 0.00 0.04 0.00 0.00 61.00 62.78 2vxf s PRO 6 Cb -0.15 -2.14 1.31 0.00 0.04 0.00 0.00 34.50 33.56 2vxf s PRO 6 CO 0.00 -0.61 2.14 1.88 0.04 0.00 0.00 177.00 180.46 2vxf h TYR 7 N 1.55 0.00 -3.76 0.56 -1.99 -1.99 -3.42 116.97 107.92 2vxf h TYR 7 Ca -0.50 0.00 -0.53 0.00 2.00 0.00 0.00 58.73 59.70 2vxf h TYR 7 Cb 1.24 0.00 0.08 0.00 2.00 0.00 0.00 36.73 40.05 2vxf h TYR 7 CO 0.54 0.00 0.73 0.42 -0.00 0.00 0.00 178.16 179.85 2vxf s ILE 8 N -5.04 2.43 0.00 -2.88 1.01 -1.26 -2.22 121.20 113.24 2vxf s ILE 8 Ca -0.05 0.41 0.00 0.00 0.00 0.00 0.00 60.65 61.01 2vxf s ILE 8 Cb 0.17 -3.26 0.00 0.00 0.01 0.00 0.00 42.46 39.38 2vxf s ILE 8 CO 0.67 0.09 0.00 0.61 0.00 0.00 0.00 174.94 176.31 2vxf n GLY 9 N 1.07 0.50 3.88 6.18 0.00 -0.24 -5.01 105.19 111.57 2vxf n GLY 9 Ca 0.02 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.75 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 -2.83 6.30 -0.02 1.61 0.01 -0.94 -4.76 113.70 113.06 2vxf s SER 10 Ca 0.00 1.22 -0.24 0.00 1.31 0.00 0.00 55.95 58.25 2vxf s SER 10 Cb 0.00 -2.38 -0.04 0.00 0.21 0.00 0.00 66.02 63.81 2vxf s SER 10 CO 0.00 -0.70 0.72 -0.54 0.41 0.00 0.00 173.24 173.12 2vxf s LYS 11 N -4.83 4.44 0.04 12.44 1.02 -1.26 -1.97 119.74 129.63 2vxf s LYS 11 Ca 0.52 0.94 0.04 0.00 0.02 0.00 0.00 55.97 57.48 2vxf s LYS 11 Cb -0.11 -3.41 -0.02 0.00 -0.52 0.00 0.00 37.83 33.77 2vxf s LYS 11 CO 0.47 0.17 -0.11 0.42 -0.92 0.00 0.00 175.35 175.38 2vxf s ILE 12 N 0.42 0.81 -0.09 2.17 1.01 -0.86 -2.43 121.20 122.23 2vxf s ILE 12 Ca 0.37 -1.01 0.03 0.00 0.00 0.00 0.00 60.65 60.05 2vxf s ILE 12 Cb -0.19 -0.79 -0.01 0.00 0.01 0.00 0.00 42.46 41.48 2vxf s ILE 12 CO 0.20 -0.18 -0.19 -0.55 0.00 0.00 0.00 174.94 174.22 2vxf s SER 13 N -1.33 3.57 -0.03 3.58 0.15 -0.78 -2.57 113.70 116.30 2vxf s SER 13 Ca -0.04 -0.41 0.05 0.00 0.70 0.00 0.00 55.95 56.26 2vxf s SER 13 Cb -0.08 -1.26 -0.01 0.00 -1.71 0.00 0.00 66.02 62.95 2vxf s SER 13 CO 0.01 0.21 -0.20 -0.22 1.20 0.00 0.00 173.24 174.25 2vxf s LEU 14 N 0.06 1.99 -0.23 3.45 2.96 -0.57 -2.23 118.68 124.11 2vxf s LEU 14 Ca -0.08 -0.38 -0.06 0.00 -0.22 0.00 0.00 54.13 53.40 2vxf s LEU 14 Cb -0.15 -1.06 -0.02 0.00 0.50 0.00 0.00 46.19 45.46 2vxf s LEU 14 CO 0.05 0.21 0.02 -0.63 -1.32 0.00 0.00 176.35 174.68 2vxf s ILE 15 N -0.23 3.92 0.65 6.68 1.01 -0.79 -1.89 121.20 130.56 2vxf s ILE 15 Ca 0.02 -0.31 -0.00 0.00 0.00 0.00 0.00 60.65 60.35 2vxf s ILE 15 Cb -0.10 -2.80 0.08 0.00 0.01 0.00 0.00 42.46 39.65 2vxf s ILE 15 CO 0.01 0.39 0.90 -0.44 0.00 0.00 0.00 174.94 175.80 2vxf s SER 16 N 1.39 4.77 0.66 3.58 0.01 -1.07 -0.77 113.70 122.26 2vxf s SER 16 Ca 0.05 -0.17 0.43 0.00 1.31 0.00 0.00 55.95 57.56 2vxf s SER 16 Cb -0.15 -0.43 2.33 0.00 0.21 0.00 0.00 66.02 67.98 2vxf s SER 16 CO 0.01 -1.54 2.34 0.50 0.41 0.00 0.00 173.24 174.96 2vxf h LYS 17 N -0.28 0.00 -0.65 12.44 3.64 -1.70 -1.47 116.57 128.56 2vxf h LYS 17 Ca -0.39 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 58.99 2vxf h LYS 17 Cb 1.28 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.10 2vxf h LYS 17 CO 0.46 0.00 0.00 0.00 -2.27 0.00 0.00 179.45 177.64 2vxf n ALA 18 N -2.09 2.98 -2.39 5.00 0.00 -1.26 -4.89 120.51 117.86 2vxf n ALA 18 Ca -0.03 -0.93 -0.18 0.00 0.00 0.00 0.00 53.44 52.30 2vxf n ALA 18 Cb 0.09 -1.04 -0.01 0.00 0.00 0.00 0.00 19.45 18.50 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 0.46 -1.85 -4.11 0.00 1.02 -0.55 -4.88 120.64 110.73 2vxf n GLU 19 Ca 0.15 0.89 -0.32 0.00 -0.02 0.00 0.00 57.16 57.85 2vxf n GLU 19 Cb 0.62 -5.53 -0.07 0.00 -0.02 0.00 0.00 31.44 26.45 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 -2.90 4.60 -0.26 -3.67 1.01 -1.26 -4.53 121.20 114.20 2vxf s ILE 20 Ca 0.00 -0.54 -0.09 0.00 0.00 0.00 0.00 60.65 60.03 2vxf s ILE 20 Cb 0.00 -3.13 -0.03 0.00 0.01 0.00 0.00 42.46 39.30 2vxf s ILE 20 CO 0.00 0.29 0.11 -0.60 0.00 0.00 0.00 174.94 174.74 2vxf s ARG 21 N -1.91 3.74 -0.09 2.79 3.52 -1.26 -2.61 118.95 123.13 2vxf s ARG 21 Ca 0.24 -0.43 0.00 0.00 -0.13 0.00 0.00 55.73 55.42 2vxf s ARG 21 Cb -0.12 -3.44 -0.03 0.00 -1.56 0.00 0.00 34.95 29.81 2vxf s ARG 21 CO 0.16 -0.19 -0.09 0.71 -0.81 0.00 0.00 175.30 175.08 2vxf s TYR 22 N 1.66 2.89 -0.02 5.12 2.02 -0.79 -2.26 117.35 125.98 2vxf s TYR 22 Ca 0.07 -0.18 0.07 0.00 -0.37 0.00 0.00 57.07 56.65 2vxf s TYR 22 Cb -0.15 -1.77 -0.02 0.00 -0.40 0.00 0.00 41.96 39.62 2vxf s TYR 22 CO 0.06 0.14 -0.22 -2.00 -1.57 0.00 0.00 175.55 171.96 2vxf s GLU 23 N -0.37 2.19 0.23 -0.62 2.12 -0.93 -1.51 118.70 119.81 2vxf s GLU 23 Ca 0.05 -0.88 -0.17 0.00 0.36 0.00 0.00 54.97 54.32 2vxf s GLU 23 Cb -0.12 -2.14 0.06 0.00 0.26 0.00 0.00 34.13 32.19 2vxf s GLU 23 CO 0.02 0.57 0.85 0.41 -0.54 0.00 0.00 175.26 176.58 2vxf n GLY 24 N 2.29 0.81 3.66 -1.50 0.00 -1.06 -1.65 105.19 107.74 2vxf n GLY 24 Ca -0.16 -1.17 -0.33 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 -2.14 4.05 -0.32 -0.61 -1.09 -1.10 -2.02 121.20 117.98 2vxf s ILE 25 Ca 0.18 -0.53 -0.28 0.00 -2.23 0.00 0.00 60.65 57.79 2vxf s ILE 25 Cb -0.03 -2.76 -0.03 0.00 -1.58 0.00 0.00 42.46 38.06 2vxf s ILE 25 CO 0.07 0.46 1.95 -0.22 -1.23 0.00 0.00 174.94 175.97 2vxf s LEU 26 N -1.28 3.47 -0.21 2.97 2.96 -0.83 -2.77 118.68 122.99 2vxf s LEU 26 Ca 0.17 1.41 -0.18 0.00 -0.22 0.00 0.00 54.13 55.31 2vxf s LEU 26 Cb -0.11 -3.42 -0.14 0.00 0.50 0.00 0.00 46.19 43.01 2vxf s LEU 26 CO 0.07 -1.86 -0.00 0.00 -1.32 0.00 0.00 176.35 173.23 2vxf n TYR 27 N 11.04 0.73 -3.85 5.38 9.36 -1.06 -1.08 117.16 137.68 2vxf n TYR 27 Ca 0.25 0.32 -0.12 0.00 3.32 0.00 0.00 57.90 61.67 2vxf n TYR 27 Cb 0.47 -1.00 -0.12 0.00 -0.63 0.00 0.00 39.34 38.06 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 -2.41 0.03 -0.16 2.97 -4.23 -1.09 -4.83 115.64 105.92 2vxf s THR 28 Ca -0.29 -0.22 0.00 0.00 -1.18 0.00 0.00 61.69 60.01 2vxf s THR 28 Cb 0.07 -0.25 -0.00 0.00 1.34 0.00 0.00 72.50 73.66 2vxf s THR 28 CO 0.50 -0.12 -0.16 -0.63 -0.54 0.00 0.00 174.62 173.68 2vxf s ILE 29 N -0.36 2.60 -0.48 2.99 1.01 -1.26 -2.16 121.20 123.53 2vxf s ILE 29 Ca -0.04 -0.79 -0.04 0.00 0.00 0.00 0.00 60.65 59.78 2vxf s ILE 29 Cb -0.03 -2.09 0.13 0.00 0.01 0.00 0.00 42.46 40.47 2vxf s ILE 29 CO 0.00 0.52 0.29 -0.62 0.00 0.00 0.00 174.94 175.13 2vxf s ASP 30 N 0.84 5.31 0.18 3.58 -1.08 -0.84 -4.95 116.67 119.73 2vxf s ASP 30 Ca -0.05 -2.25 -0.04 0.00 -0.52 0.00 0.00 52.55 49.69 2vxf s ASP 30 Cb -0.15 -1.86 0.09 0.00 -1.46 0.00 0.00 42.92 39.54 2vxf s ASP 30 CO -0.01 -0.51 1.49 0.74 0.52 0.00 0.00 175.17 177.40 2vxf h THR 31 N 6.03 1.32 -0.12 1.71 2.02 -1.98 -2.43 112.91 119.47 2vxf h THR 31 Ca -0.11 -1.83 0.03 0.00 0.77 0.00 0.00 66.41 65.28 2vxf h THR 31 Cb 1.02 1.80 -0.00 0.00 -1.74 0.00 0.00 68.15 69.23 2vxf h THR 31 CO 0.72 0.57 0.08 -0.08 0.37 0.00 0.00 175.52 177.18 2vxf h GLU 32 N 0.43 0.00 -0.14 6.66 4.57 -1.94 -2.02 114.58 122.13 2vxf h GLU 32 Ca 0.00 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.18 2vxf h GLU 32 Cb 1.12 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.71 2vxf h GLU 32 CO 0.11 0.00 0.00 0.09 -1.18 0.00 0.00 179.01 178.03 2vxf n ASN 33 N -4.47 2.68 -3.90 1.04 3.02 -1.23 -4.99 115.26 107.40 2vxf n ASN 33 Ca -0.00 -2.42 -0.25 0.00 -0.03 0.00 0.00 54.58 51.87 2vxf n ASN 33 Cb 0.20 -0.26 -0.01 0.00 -0.61 0.00 0.00 39.78 39.11 2vxf n ASN 33 CO 0.00 0.00 0.00 -0.24 -2.62 0.00 0.00 177.26 174.40 2vxf n SER 34 N -0.42 -0.97 -4.13 6.41 2.88 -0.76 -4.88 113.62 111.74 2vxf n SER 34 Ca 0.11 -0.95 -0.18 0.00 -1.33 0.00 0.00 58.87 56.52 2vxf n SER 34 Cb 0.50 -3.34 -0.12 0.00 -0.75 0.00 0.00 64.21 60.50 2vxf n SER 34 CO 0.00 0.00 0.00 0.42 -1.23 0.00 0.00 175.04 174.23 2vxf s THR 35 N -3.81 0.97 -0.01 2.46 -4.23 -0.92 -2.45 115.64 107.65 2vxf s THR 35 Ca 0.09 -1.12 0.03 0.00 -1.18 0.00 0.00 61.69 59.51 2vxf s THR 35 Cb -0.05 -0.93 -0.01 0.00 1.34 0.00 0.00 72.50 72.86 2vxf s THR 35 CO 0.87 -0.18 -0.11 -0.69 -0.54 0.00 0.00 174.62 173.97 2vxf s VAL 36 N -1.12 0.88 -0.15 2.29 1.01 -0.91 -1.98 120.40 120.42 2vxf s VAL 36 Ca -0.02 -0.46 -0.02 0.00 0.00 0.00 0.00 61.98 61.48 2vxf s VAL 36 Cb -0.09 -0.74 -0.02 0.00 0.00 0.00 0.00 36.38 35.53 2vxf s VAL 36 CO 0.01 0.25 -0.09 0.00 0.00 0.00 0.00 175.10 175.27 2vxf s ALA 37 N -0.16 2.75 -0.05 5.51 0.00 -0.92 -2.26 121.76 126.62 2vxf s ALA 37 Ca 0.03 -0.90 0.05 0.00 0.00 0.00 0.00 51.96 51.14 2vxf s ALA 37 Cb -0.05 -1.36 -0.02 0.00 0.00 0.00 0.00 23.12 21.68 2vxf s ALA 37 CO -0.00 0.17 -0.19 -0.51 0.00 0.00 0.00 175.76 175.22 2vxf s LEU 38 N 0.47 2.43 0.35 0.00 1.43 -0.97 -2.57 118.68 119.81 2vxf s LEU 38 Ca -0.07 -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 0.04 0.30 0.05 0.00 0.23 0.00 0.00 176.35 176.97 2vxf s ALA 39 N -0.48 3.29 -1.18 4.21 0.00 -1.11 -2.19 121.76 124.29 2vxf s ALA 39 Ca 0.06 -1.96 -0.14 0.00 0.00 0.00 0.00 51.96 49.93 2vxf s ALA 39 Cb -0.12 -0.43 -0.01 0.00 0.00 0.00 0.00 23.12 22.56 2vxf s ALA 39 CO 0.01 0.04 0.76 1.63 0.00 0.00 0.00 175.76 178.20 2vxf n LYS 40 N -1.01 -2.16 -4.49 0.00 5.02 -0.97 -2.70 118.16 111.85 2vxf n LYS 40 Ca -0.04 0.53 -0.28 0.00 -2.02 0.00 0.00 58.31 56.50 2vxf n LYS 40 Cb 0.62 -4.55 -0.13 0.00 -0.02 0.00 0.00 35.03 30.95 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 -3.54 2.11 0.03 -0.18 0.11 -1.03 -4.21 120.40 113.68 2vxf s VAL 41 Ca 0.35 -1.62 -0.01 0.00 -2.93 0.00 0.00 61.98 57.77 2vxf s VAL 41 Cb -0.11 -1.86 -0.02 0.00 -1.53 0.00 0.00 36.38 32.86 2vxf s VAL 41 CO 0.84 0.13 -0.01 0.00 -3.33 0.00 0.00 175.10 172.73 2vxf s ARG 42 N -1.82 0.41 -0.16 1.54 1.70 -0.66 -1.99 118.95 117.96 2vxf s ARG 42 Ca 0.12 -0.72 -0.12 0.00 -0.47 0.00 0.00 55.73 54.53 2vxf s ARG 42 Cb -0.10 0.15 -0.05 0.00 -0.57 0.00 0.00 34.95 34.38 2vxf s ARG 42 CO 0.05 -0.08 0.24 -1.54 -1.08 0.00 0.00 175.30 172.89 2vxf s SER 43 N -1.79 6.38 0.13 -2.89 1.04 -1.26 -2.20 113.70 113.11 2vxf s SER 43 Ca -0.11 0.45 -0.12 0.00 0.48 0.00 0.00 55.95 56.65 2vxf s SER 43 Cb -0.06 -2.15 -0.08 0.00 0.10 0.00 0.00 66.02 63.83 2vxf s SER 43 CO -0.03 0.16 1.42 -0.26 0.98 0.00 0.00 173.24 175.50 2vxf h PHE 44 N 6.46 1.09 0.00 5.02 0.04 -1.85 -3.49 116.94 124.21 2vxf h PHE 44 Ca -0.43 -0.37 0.00 0.00 2.80 0.00 0.00 57.97 59.97 2vxf h PHE 44 Cb 1.17 -0.21 0.00 0.00 2.20 0.00 0.00 35.95 39.11 2vxf h PHE 44 CO 0.61 1.20 0.00 0.41 -0.60 0.00 0.00 178.31 179.93 2vxf n GLY 45 N 0.31 1.21 0.00 -1.45 0.00 -1.26 -5.03 105.19 98.97 2vxf n GLY 45 Ca -0.04 -1.01 0.01 0.00 0.00 0.00 0.00 46.02 44.98 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 0.00 0.23 2.61 -2.24 -1.26 -4.29 114.28 108.72 2vxf n THR 46 Ca 0.00 -0.06 0.06 0.00 -2.27 0.00 0.00 64.05 61.78 2vxf n THR 46 Cb 0.00 0.47 0.55 0.00 -2.10 0.00 0.00 70.33 69.24 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 -0.27 -0.78 4.81 -1.96 -2.06 114.58 114.32 2vxf h GLU 47 Ca 0.00 0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 59.23 2vxf h GLU 47 Cb 0.10 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.46 2vxf h GLU 47 CO 0.00 0.15 0.16 0.22 -0.73 0.00 0.00 179.01 178.81 2vxf h ASP 48 N 0.00 0.32 -3.54 1.04 3.58 -1.95 -3.33 116.42 112.54 2vxf h ASP 48 Ca -0.00 -0.01 -0.62 0.00 0.42 0.00 0.00 57.03 56.82 2vxf h ASP 48 Cb 0.27 -0.08 -0.40 0.00 1.72 0.00 0.00 39.33 40.84 2vxf h ASP 48 CO 0.02 0.25 -0.73 -0.13 -2.88 0.00 0.00 179.24 175.77 2vxf s ARG 49 N -5.31 1.23 0.22 0.28 0.52 -0.77 -5.10 118.95 110.01 2vxf s ARG 49 Ca -0.07 -1.77 -0.32 0.00 -0.52 0.00 0.00 55.73 53.05 2vxf s ARG 49 Cb 0.17 -2.52 -0.14 0.00 0.52 0.00 0.00 34.95 32.98 2vxf s ARG 49 CO 0.71 -1.06 1.36 -2.30 0.02 0.00 0.00 175.30 174.03 2vxf n PRO 50 N 4.03 1.84 -4.40 3.54 -0.02 -1.25 -4.87 135.00 133.87 2vxf n PRO 50 Ca 0.04 0.66 -0.20 0.00 -2.02 0.00 0.00 63.50 61.98 2vxf n PRO 50 Cb 0.38 -2.28 -0.10 0.00 -0.02 0.00 0.00 33.50 31.47 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 -0.06 1.44 -1.83 3.45 -4.23 -1.26 -5.03 115.64 108.12 2vxf s THR 51 Ca 0.70 -2.09 0.28 0.00 -1.18 0.00 0.00 61.69 59.40 2vxf s THR 51 Cb -0.70 -2.42 0.71 0.00 1.34 0.00 0.00 72.50 71.43 2vxf s THR 51 CO 0.50 -0.30 2.00 -0.67 -0.54 0.00 0.00 174.62 175.61 2vxf n ASP 52 N -0.53 0.00 -4.16 3.99 -0.08 -1.26 -4.53 116.55 109.97 2vxf n ASP 52 Ca -0.05 -0.66 -0.35 0.00 -1.51 0.00 0.00 54.79 52.22 2vxf n ASP 52 Cb 0.64 -0.08 -0.13 0.00 2.34 0.00 0.00 41.12 43.88 2vxf n ASP 52 CO 0.00 0.00 0.00 -0.13 0.12 0.00 0.00 177.20 177.19 2vxf s ARG 53 N -2.17 2.30 0.18 -0.67 1.81 -1.26 -5.09 118.95 114.05 2vxf s ARG 53 Ca 0.38 -1.43 -0.31 0.00 -1.72 0.00 0.00 55.73 52.65 2vxf s ARG 53 Cb 0.19 -3.32 -0.09 0.00 -0.45 0.00 0.00 34.95 31.28 2vxf s ARG 53 CO 0.35 -0.76 1.45 -1.25 -0.68 0.00 0.00 175.30 174.41 2vxf s PRO 54 N 1.22 4.28 0.04 3.54 0.04 -1.26 -5.02 135.00 137.85 2vxf s PRO 54 Ca -0.01 2.22 0.07 0.00 0.04 0.00 0.00 61.00 63.33 2vxf s PRO 54 Cb -0.21 -3.17 -0.03 0.00 0.04 0.00 0.00 34.50 31.14 2vxf s PRO 54 CO -0.02 -0.46 -0.21 0.42 0.04 0.00 0.00 177.00 176.77 2vxf s ILE 55 N 0.67 1.71 0.30 0.56 -1.09 -1.26 -5.14 121.20 116.95 2vxf s ILE 55 Ca 0.64 -1.22 -0.03 0.00 -2.23 0.00 0.00 60.65 57.81 2vxf s ILE 55 Cb -0.40 -1.48 -0.05 0.00 -1.58 0.00 0.00 42.46 38.95 2vxf s ILE 55 CO 0.35 0.22 0.54 0.00 -1.23 0.00 0.00 174.94 174.82 2vxf s ALA 56 N -0.80 3.66 0.46 9.38 0.00 -1.26 -4.98 121.76 128.21 2vxf s ALA 56 Ca 0.08 -0.66 -0.25 0.00 0.00 0.00 0.00 51.96 51.13 2vxf s ALA 56 Cb -0.09 -2.23 -0.08 0.00 0.00 0.00 0.00 23.12 20.72 2vxf s ALA 56 CO 0.02 0.19 1.37 -2.14 0.00 0.00 0.00 175.76 175.20 2vxf s PRO 57 N -3.73 3.64 0.04 0.00 0.02 -1.26 -5.03 135.00 128.68 2vxf s PRO 57 Ca 0.43 2.29 -0.19 0.00 0.02 0.00 0.00 61.00 63.54 2vxf s PRO 57 Cb -0.10 -2.58 0.04 0.00 0.02 0.00 0.00 34.50 31.87 2vxf s PRO 57 CO 0.32 -0.81 0.44 -0.98 -0.33 0.00 0.00 177.00 175.64 2vxf s ARG 58 N -2.51 0.94 -0.19 5.54 1.70 -1.26 -5.06 118.95 118.10 2vxf s ARG 58 Ca 0.62 -0.31 0.14 0.00 -0.47 0.00 0.00 55.73 55.71 2vxf s ARG 58 Cb -0.41 0.42 0.44 0.00 -0.57 0.00 0.00 34.95 34.83 2vxf s ARG 58 CO 0.52 -0.32 1.19 -0.25 -1.08 0.00 0.00 175.30 175.36 2vxf n ASP 59 N 0.52 2.37 -4.87 -2.89 10.43 -1.26 -5.05 116.55 115.80 2vxf n ASP 59 Ca -0.19 -3.29 -0.35 0.00 2.57 0.00 0.00 54.79 53.53 2vxf n ASP 59 Cb 0.60 -0.43 -0.05 0.00 1.84 0.00 0.00 41.12 43.07 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 -2.76 3.69 0.00 -1.24 2.12 -1.26 -5.09 118.70 114.16 2vxf s GLU 60 Ca 0.39 0.09 -0.01 0.00 0.36 0.00 0.00 54.97 55.81 2vxf s GLU 60 Cb 0.38 -3.07 -0.04 0.00 0.26 0.00 0.00 34.13 31.66 2vxf s GLU 60 CO -0.06 0.63 0.12 0.99 -0.54 0.00 0.00 175.26 176.39 2vxf s THR 61 N -1.29 4.95 -0.20 -1.70 2.01 -1.26 -4.81 115.64 113.34 2vxf s THR 61 Ca 0.28 -0.35 -0.09 0.00 0.31 0.00 0.00 61.69 61.84 2vxf s THR 61 Cb -0.14 -3.29 -0.04 0.00 0.01 0.00 0.00 72.50 69.03 2vxf s THR 61 CO 0.16 0.32 0.10 -0.36 -0.69 0.00 0.00 174.62 174.15 2vxf s PHE 62 N -1.26 3.30 0.13 4.92 0.08 -0.84 -4.99 117.98 119.32 2vxf s PHE 62 Ca 0.25 0.15 -0.13 0.00 0.12 0.00 0.00 56.93 57.32 2vxf s PHE 62 Cb -0.12 -2.14 -0.03 0.00 -0.57 0.00 0.00 43.02 40.16 2vxf s PHE 62 CO 0.16 0.16 1.51 0.93 -0.10 0.00 0.00 175.22 177.88 2vxf h GLU 63 N 6.90 0.83 -2.62 0.44 5.08 -1.94 -2.72 114.58 120.54 2vxf h GLU 63 Ca -0.38 -0.35 -0.13 0.00 -1.00 0.00 0.00 59.36 57.50 2vxf h GLU 63 Cb 1.16 -0.03 -0.28 0.00 0.50 0.00 0.00 28.75 30.10 2vxf h GLU 63 CO 0.71 0.98 -0.39 -0.47 -1.00 0.00 0.00 179.01 178.84 2vxf s TYR 64 N -4.67 -0.67 0.05 4.33 6.14 -1.26 -2.29 117.35 118.98 2vxf s TYR 64 Ca -0.12 1.35 0.05 0.00 0.64 0.00 0.00 57.07 58.98 2vxf s TYR 64 Cb 0.10 0.22 -0.02 0.00 0.42 0.00 0.00 41.96 42.68 2vxf s TYR 64 CO 0.84 -0.43 -0.13 0.42 0.64 0.00 0.00 175.55 176.89 2vxf s ILE 65 N 2.33 1.03 -0.08 3.14 1.01 -0.93 -5.03 121.20 122.68 2vxf s ILE 65 Ca -0.03 -1.06 0.00 0.00 0.00 0.00 0.00 60.65 59.57 2vxf s ILE 65 Cb -0.11 -0.96 -0.03 0.00 0.01 0.00 0.00 42.46 41.36 2vxf s ILE 65 CO -0.12 -0.09 -0.06 -0.63 0.00 0.00 0.00 174.94 174.04 2vxf s ILE 66 N -0.99 3.75 0.01 2.92 1.01 -1.26 -2.29 121.20 124.36 2vxf s ILE 66 Ca -0.00 -0.46 0.04 0.00 0.00 0.00 0.00 60.65 60.22 2vxf s ILE 66 Cb -0.08 -2.54 -0.01 0.00 0.01 0.00 0.00 42.46 39.83 2vxf s ILE 66 CO 0.01 0.59 -0.11 -0.36 0.00 0.00 0.00 174.94 175.07 2vxf s PHE 67 N -0.72 0.99 0.14 3.97 0.08 -0.96 -5.04 117.98 116.44 2vxf s PHE 67 Ca 0.11 -0.26 0.07 0.00 0.12 0.00 0.00 56.93 56.96 2vxf s PHE 67 Cb -0.11 -0.61 -0.04 0.00 -0.57 0.00 0.00 43.02 41.68 2vxf s PHE 67 CO 0.02 -0.00 -0.02 1.03 -0.10 0.00 0.00 175.22 176.14 2vxf s ARG 68 N -0.67 2.39 0.58 0.44 0.52 -1.26 -2.14 118.95 118.81 2vxf s ARG 68 Ca 0.02 -1.03 0.28 0.00 -0.52 0.00 0.00 55.73 54.48 2vxf s ARG 68 Cb -0.06 -2.39 1.64 0.00 0.52 0.00 0.00 34.95 34.66 2vxf s ARG 68 CO 0.00 0.48 2.11 0.78 0.02 0.00 0.00 175.30 178.70 2vxf h GLY 69 N 3.04 0.00 1.06 -3.53 0.00 -1.82 -2.02 103.07 99.80 2vxf h GLY 69 Ca -0.48 0.00 -0.11 0.00 0.00 0.00 0.00 47.33 46.75 2vxf h GLY 69 CO 0.57 0.00 -0.10 1.48 0.00 0.00 0.00 176.54 178.49 2vxf h SER 70 N 0.00 0.97 0.54 0.19 4.64 -1.95 -3.26 113.55 114.69 2vxf h SER 70 Ca 0.08 -0.35 -0.28 0.00 -0.47 0.00 0.00 61.79 60.76 2vxf h SER 70 Cb 0.45 -0.26 -0.04 0.00 -0.31 0.00 0.00 62.40 62.23 2vxf h SER 70 CO -0.00 1.10 -1.61 -2.24 -0.87 0.00 0.00 176.83 173.20 2vxf h ASP 71 N 0.83 0.05 -3.95 4.97 2.03 -1.80 -3.47 116.42 115.08 2vxf h ASP 71 Ca 0.13 -0.09 -0.53 0.00 -0.73 0.00 0.00 57.03 55.81 2vxf h ASP 71 Cb 0.66 -0.02 0.09 0.00 -0.83 0.00 0.00 39.33 39.24 2vxf h ASP 71 CO 0.05 1.08 0.64 -0.63 -1.03 0.00 0.00 179.24 179.35 2vxf s ILE 72 N -2.61 2.51 -0.27 4.15 1.01 -0.84 -1.90 121.20 123.24 2vxf s ILE 72 Ca -0.05 0.46 -0.05 0.00 0.00 0.00 0.00 60.65 61.01 2vxf s ILE 72 Cb 0.08 -3.27 -0.15 0.00 0.01 0.00 0.00 42.46 39.13 2vxf s ILE 72 CO 0.82 0.07 -0.28 1.17 0.00 0.00 0.00 174.94 176.73 2vxf n LYS 73 N 0.15 0.63 -3.81 2.79 4.81 0.05 -4.82 118.16 117.96 2vxf n LYS 73 Ca 0.03 0.20 -0.12 0.00 -0.87 0.00 0.00 58.31 57.55 2vxf n LYS 73 Cb 0.43 -1.51 -0.10 0.00 0.02 0.00 0.00 35.03 33.87 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 -6.93 -0.12 -0.06 3.14 2.15 -1.12 -5.02 116.67 108.70 2vxf s ASP 74 Ca -0.37 0.08 0.02 0.00 0.43 0.00 0.00 52.55 52.72 2vxf s ASP 74 Cb 0.11 0.32 0.01 0.00 -0.30 0.00 0.00 42.92 43.07 2vxf s ASP 74 CO 0.56 -0.32 -0.12 -0.22 -0.17 0.00 0.00 175.17 174.90 2vxf s LEU 75 N -0.94 1.62 -0.01 -1.34 0.20 -1.26 -1.88 118.68 115.06 2vxf s LEU 75 Ca -0.10 -0.28 0.03 0.00 0.69 0.00 0.00 54.13 54.47 2vxf s LEU 75 Cb -0.05 -0.80 -0.01 0.00 -0.43 0.00 0.00 46.19 44.91 2vxf s LEU 75 CO 0.02 0.03 -0.11 -0.89 -0.29 0.00 0.00 176.35 175.11 2vxf s THR 76 N 0.69 0.87 -0.03 3.68 2.01 -0.95 -5.05 115.64 116.85 2vxf s THR 76 Ca -0.14 -0.46 -0.02 0.00 0.31 0.00 0.00 61.69 61.38 2vxf s THR 76 Cb -0.16 -0.74 -0.04 0.00 0.01 0.00 0.00 72.50 71.57 2vxf s THR 76 CO 0.03 0.25 0.11 -0.69 -0.69 0.00 0.00 174.62 173.64 2vxf s VAL 77 N -0.15 5.00 -0.11 3.82 1.01 -1.26 -1.87 120.40 126.85 2vxf s VAL 77 Ca 0.02 -0.22 -0.01 0.00 0.00 0.00 0.00 61.98 61.78 2vxf s VAL 77 Cb -0.05 -3.27 -0.25 0.00 0.00 0.00 0.00 36.38 32.81 2vxf s VAL 77 CO -0.00 0.41 0.42 0.00 0.00 0.00 0.00 175.10 175.93 2vxf s GLU 79 N -2.57 3.98 0.58 0.00 2.56 -1.26 -5.04 118.70 116.95 2vxf s GLU 79 Ca -0.18 0.58 -0.17 0.00 0.00 0.00 0.00 54.97 55.20 2vxf s GLU 79 Cb 0.07 -3.72 -0.04 0.00 2.00 0.00 0.00 34.13 32.44 2vxf s GLU 79 CO 0.78 -0.65 1.08 -1.25 -0.56 0.00 0.00 175.26 174.67 2vxf s PRO 80 N 2.89 3.29 0.77 4.30 0.04 -1.26 -5.01 135.00 140.03 2vxf s PRO 80 Ca 0.31 1.38 -0.13 0.00 0.04 0.00 0.00 61.00 62.61 2vxf s PRO 80 Cb -0.14 -2.02 0.06 0.00 0.04 0.00 0.00 34.50 32.44 2vxf s PRO 80 CO 0.12 -0.86 1.16 -2.14 0.04 0.00 0.00 177.00 175.32 2vxf s PRO 81 N -3.72 1.98 -0.02 0.56 0.02 -1.26 -5.01 135.00 127.54 2vxf s PRO 81 Ca 0.67 1.56 -0.14 0.00 0.02 0.00 0.00 61.00 63.12 2vxf s PRO 81 Cb -0.19 -1.83 -0.05 0.00 0.02 0.00 0.00 34.50 32.44 2vxf s PRO 81 CO 0.32 -1.92 0.38 0.21 -0.33 0.00 0.00 177.00 175.67 2vxf s LYS 82 N -4.27 3.90 0.22 5.54 2.47 -1.26 -5.05 119.74 121.30 2vxf s LYS 82 Ca 0.69 0.35 -0.30 0.00 -1.56 0.00 0.00 55.97 55.15 2vxf s LYS 82 Cb -0.24 -3.24 -0.10 0.00 -1.46 0.00 0.00 37.83 32.79 2vxf s LYS 82 CO 0.49 0.66 1.41 -1.25 0.16 0.00 0.00 175.35 176.82 2vxf s PRO 83 N -0.93 4.30 -0.01 4.03 0.04 -1.26 -5.01 135.00 136.16 2vxf s PRO 83 Ca 0.23 2.22 0.05 0.00 0.04 0.00 0.00 61.00 63.53 2vxf s PRO 83 Cb -0.16 -3.14 -0.01 0.00 0.04 0.00 0.00 34.50 31.22 2vxf s PRO 83 CO 0.12 -0.38 -0.15 -1.50 0.04 0.00 0.00 177.00 175.13 2vxf s ILE 84 N 0.15 1.18 0.00 0.56 2.07 -1.26 -5.07 121.20 118.83 2vxf s ILE 84 Ca 0.59 -0.64 0.00 0.00 -1.41 0.00 0.00 60.65 59.20 2vxf s ILE 84 Cb -0.40 -0.98 0.00 0.00 0.13 0.00 0.00 42.46 41.21 2vxf s ILE 84 CO 0.40 0.33 0.38 0.23 -1.91 0.00 0.00 174.94 174.37