#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 0.50 -3.81 1.96 2.13 -1.26 -5.00 120.64 115.16 2vxf n GLU -1 Ca 0.00 0.21 -0.31 0.00 0.66 0.00 0.00 57.16 57.72 2vxf n GLU -1 Cb 0.00 -1.35 -0.04 0.00 0.27 0.00 0.00 31.44 30.32 2vxf n GLU -1 CO 0.00 0.00 0.00 -0.51 -0.41 0.00 0.00 177.13 176.21 2vxf s ASP 0 N -6.82 6.42 0.34 4.31 1.01 -1.26 -5.00 116.67 115.66 2vxf s ASP 0 Ca -0.32 0.41 0.06 0.00 0.71 0.00 0.00 52.55 53.42 2vxf s ASP 0 Cb 0.10 -2.02 0.61 0.00 1.01 0.00 0.00 42.92 42.63 2vxf s ASP 0 CO 0.41 0.12 1.83 1.55 0.21 0.00 0.00 175.17 179.29 2vxf h PRO 1 N 2.95 0.36 -0.18 8.23 0.13 -1.99 -2.43 132.00 139.06 2vxf h PRO 1 Ca -0.45 -0.10 -0.11 0.00 -0.87 0.00 0.00 66.00 64.46 2vxf h PRO 1 Cb 1.16 -0.04 -0.01 0.00 0.13 0.00 0.00 31.00 32.24 2vxf h PRO 1 CO 0.74 0.52 -0.37 1.03 -0.23 0.00 0.00 178.00 179.69 2vxf h SER 2 N 0.33 0.41 0.09 1.44 0.87 -1.95 -2.82 113.55 111.92 2vxf h SER 2 Ca 0.06 -0.17 -0.13 0.00 -1.23 0.00 0.00 61.79 60.32 2vxf h SER 2 Cb 0.49 -0.11 -0.01 0.00 -0.44 0.00 0.00 62.40 62.33 2vxf h SER 2 CO 0.03 0.75 -0.45 1.23 -0.53 0.00 0.00 176.83 177.86 2vxf h GLY 3 N 1.12 0.47 0.96 5.77 0.00 -1.85 -3.16 103.07 106.38 2vxf h GLY 3 Ca 0.03 -0.49 -0.09 0.00 0.00 0.00 0.00 47.33 46.79 2vxf h GLY 3 CO 0.06 0.44 -0.12 -1.33 0.00 0.00 0.00 176.54 175.59 2vxf h GLY 4 N 1.15 0.79 -6.92 4.60 0.00 -1.29 -3.42 103.07 97.99 2vxf h GLY 4 Ca 0.02 -0.67 -0.63 0.00 0.00 0.00 0.00 47.33 46.05 2vxf h GLY 4 CO 0.08 0.61 -0.58 -1.59 0.00 0.00 0.00 176.54 175.06 2vxf s THR 5 N -4.72 4.66 0.21 4.70 2.01 -1.08 -5.07 115.64 116.35 2vxf s THR 5 Ca -0.13 -0.06 -0.30 0.00 0.31 0.00 0.00 61.69 61.51 2vxf s THR 5 Cb 0.10 -3.15 -0.09 0.00 0.01 0.00 0.00 72.50 69.36 2vxf s THR 5 CO 0.81 0.37 1.40 -2.16 -0.69 0.00 0.00 174.62 174.36 2vxf s PRO 6 N 1.12 4.31 0.31 4.92 0.04 -1.26 -4.74 135.00 139.70 2vxf s PRO 6 Ca 0.05 2.20 0.08 0.00 0.04 0.00 0.00 61.00 63.36 2vxf s PRO 6 Cb -0.14 -3.16 0.50 0.00 0.04 0.00 0.00 34.50 31.74 2vxf s PRO 6 CO 0.04 -0.38 1.72 -0.92 0.04 0.00 0.00 177.00 177.50 2vxf h TYR 7 N 5.49 0.23 -3.58 0.56 -0.00 -1.96 -3.44 116.97 114.28 2vxf h TYR 7 Ca -0.45 -0.06 -0.53 0.00 -0.00 0.00 0.00 58.73 57.69 2vxf h TYR 7 Cb 1.21 -0.05 0.07 0.00 -0.00 0.00 0.00 36.73 37.96 2vxf h TYR 7 CO 0.62 0.58 0.77 0.42 -0.00 0.00 0.00 178.16 180.54 2vxf s ILE 8 N -4.16 2.43 0.00 1.81 1.01 -1.26 -2.05 121.20 118.99 2vxf s ILE 8 Ca -0.04 0.39 0.00 0.00 0.00 0.00 0.00 60.65 61.00 2vxf s ILE 8 Cb 0.14 -3.25 0.00 0.00 0.01 0.00 0.00 42.46 39.36 2vxf s ILE 8 CO 0.76 0.07 0.00 0.61 0.00 0.00 0.00 174.94 176.39 2vxf n GLY 9 N 1.59 0.70 3.92 6.18 0.00 -0.71 -5.01 105.19 111.85 2vxf n GLY 9 Ca 0.05 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.79 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 -2.91 6.41 -0.04 1.61 0.01 -0.87 -4.85 113.70 113.04 2vxf s SER 10 Ca 0.00 0.47 -0.29 0.00 1.31 0.00 0.00 55.95 57.44 2vxf s SER 10 Cb 0.00 -2.04 -0.03 0.00 0.21 0.00 0.00 66.02 64.17 2vxf s SER 10 CO 0.00 -0.05 0.93 -0.54 0.41 0.00 0.00 173.24 173.99 2vxf s LYS 11 N -3.27 4.49 0.04 12.44 1.02 -1.26 -2.26 119.74 130.94 2vxf s LYS 11 Ca 0.40 1.30 0.04 0.00 0.02 0.00 0.00 55.97 57.73 2vxf s LYS 11 Cb -0.11 -3.48 -0.02 0.00 -0.52 0.00 0.00 37.83 33.69 2vxf s LYS 11 CO 0.29 -0.11 -0.12 0.42 -0.92 0.00 0.00 175.35 174.90 2vxf s ILE 12 N 1.27 0.95 -0.12 2.17 1.01 -0.95 -2.48 121.20 123.06 2vxf s ILE 12 Ca 0.48 -0.99 0.01 0.00 0.00 0.00 0.00 60.65 60.15 2vxf s ILE 12 Cb -0.20 -0.89 -0.01 0.00 0.01 0.00 0.00 42.46 41.37 2vxf s ILE 12 CO 0.23 -0.08 -0.15 -0.55 0.00 0.00 0.00 174.94 174.39 2vxf s SER 13 N -1.20 3.88 -0.06 3.58 0.15 -0.82 -2.70 113.70 116.54 2vxf s SER 13 Ca -0.01 -0.35 0.06 0.00 0.70 0.00 0.00 55.95 56.35 2vxf s SER 13 Cb -0.08 -1.51 -0.01 0.00 -1.71 0.00 0.00 66.02 62.71 2vxf s SER 13 CO 0.01 0.18 -0.24 -0.22 1.20 0.00 0.00 173.24 174.17 2vxf s LEU 14 N 0.25 2.13 -0.23 3.45 2.96 -0.46 -2.27 118.68 124.52 2vxf s LEU 14 Ca -0.10 -0.49 -0.06 0.00 -0.22 0.00 0.00 54.13 53.26 2vxf s LEU 14 Cb -0.16 -1.40 -0.02 0.00 0.50 0.00 0.00 46.19 45.12 2vxf s LEU 14 CO 0.06 0.24 0.02 -0.63 -1.32 0.00 0.00 176.35 174.72 2vxf s ILE 15 N -0.14 3.92 0.56 6.68 1.01 -0.73 -1.86 121.20 130.64 2vxf s ILE 15 Ca -0.04 -0.31 0.01 0.00 0.00 0.00 0.00 60.65 60.32 2vxf s ILE 15 Cb -0.14 -2.81 0.04 0.00 0.01 0.00 0.00 42.46 39.56 2vxf s ILE 15 CO 0.04 0.38 0.78 -0.44 0.00 0.00 0.00 174.94 175.71 2vxf s SER 16 N 1.48 5.22 0.53 3.58 0.01 -1.08 -0.59 113.70 122.85 2vxf s SER 16 Ca 0.05 -0.06 0.36 0.00 1.31 0.00 0.00 55.95 57.61 2vxf s SER 16 Cb -0.15 -0.79 1.93 0.00 0.21 0.00 0.00 66.02 67.22 2vxf s SER 16 CO 0.01 -1.19 2.10 0.50 0.41 0.00 0.00 173.24 175.07 2vxf h LYS 17 N 0.05 0.00 -0.66 12.44 3.64 -1.23 -1.66 116.57 129.15 2vxf h LYS 17 Ca -0.41 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 58.97 2vxf h LYS 17 Cb 1.29 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.11 2vxf h LYS 17 CO 0.51 0.00 0.00 0.00 -2.27 0.00 0.00 179.45 177.69 2vxf n ALA 18 N -1.97 2.97 -2.25 5.00 0.00 -1.26 -4.88 120.51 118.12 2vxf n ALA 18 Ca -0.02 -0.88 -0.18 0.00 0.00 0.00 0.00 53.44 52.36 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 -1.78 -4.13 0.00 1.02 -0.62 -4.58 120.64 110.95 2vxf n GLU 19 Ca 0.14 0.91 -0.33 0.00 -0.02 0.00 0.00 57.16 57.86 2vxf n GLU 19 Cb 0.61 -5.49 -0.07 0.00 -0.02 0.00 0.00 31.44 26.46 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 -2.83 4.62 -0.24 -3.67 1.01 -1.26 -4.59 121.20 114.24 2vxf s ILE 20 Ca 0.00 -0.46 -0.07 0.00 0.00 0.00 0.00 60.65 60.12 2vxf s ILE 20 Cb 0.00 -3.11 -0.03 0.00 0.01 0.00 0.00 42.46 39.33 2vxf s ILE 20 CO 0.00 0.35 0.06 -0.60 0.00 0.00 0.00 174.94 174.75 2vxf s ARG 21 N -1.73 3.69 -0.09 2.79 3.52 -1.26 -2.65 118.95 123.22 2vxf s ARG 21 Ca 0.22 -0.47 0.00 0.00 -0.13 0.00 0.00 55.73 55.36 2vxf s ARG 21 Cb -0.12 -3.29 -0.03 0.00 -1.56 0.00 0.00 34.95 29.95 2vxf s ARG 21 CO 0.14 -0.12 -0.08 0.71 -0.81 0.00 0.00 175.30 175.14 2vxf s TYR 22 N 1.42 2.91 -0.01 5.12 2.02 -0.78 -2.14 117.35 125.90 2vxf s TYR 22 Ca 0.05 -0.14 0.08 0.00 -0.37 0.00 0.00 57.07 56.69 2vxf s TYR 22 Cb -0.15 -1.76 -0.02 0.00 -0.40 0.00 0.00 41.96 39.63 2vxf s TYR 22 CO 0.03 0.18 -0.26 -2.00 -1.57 0.00 0.00 175.55 171.93 2vxf s GLU 23 N -0.44 2.05 0.22 -0.62 2.12 -0.95 -1.35 118.70 119.73 2vxf s GLU 23 Ca 0.06 -0.95 -0.18 0.00 0.36 0.00 0.00 54.97 54.26 2vxf s GLU 23 Cb -0.12 -2.02 0.07 0.00 0.26 0.00 0.00 34.13 32.31 2vxf s GLU 23 CO 0.02 0.55 0.88 0.41 -0.54 0.00 0.00 175.26 176.58 2vxf n GLY 24 N 2.34 0.77 3.56 -1.50 0.00 -1.10 -1.76 105.19 107.50 2vxf n GLY 24 Ca -0.16 -1.16 -0.34 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 4.00 -0.12 -0.61 -1.09 -1.06 -2.24 121.20 117.95 2vxf s ILE 25 Ca 0.19 -0.34 -0.29 0.00 -2.23 0.00 0.00 60.65 57.99 2vxf s ILE 25 Cb -0.03 -2.72 -0.06 0.00 -1.58 0.00 0.00 42.46 38.06 2vxf s ILE 25 CO 0.07 0.53 2.04 -0.22 -1.23 0.00 0.00 174.94 176.13 2vxf s LEU 26 N -0.07 3.88 -0.22 2.97 2.96 -0.96 -2.63 118.68 124.62 2vxf s LEU 26 Ca 0.02 2.15 -0.17 0.00 -0.22 0.00 0.00 54.13 55.91 2vxf s LEU 26 Cb -0.13 -3.52 -0.14 0.00 0.50 0.00 0.00 46.19 42.90 2vxf s LEU 26 CO 0.02 -1.52 -0.06 0.00 -1.32 0.00 0.00 176.35 173.47 2vxf n TYR 27 N 9.68 0.62 -3.81 5.38 9.36 -1.04 -1.74 117.16 135.60 2vxf n TYR 27 Ca 0.24 0.27 -0.12 0.00 3.32 0.00 0.00 57.90 61.61 2vxf n TYR 27 Cb 0.44 -0.98 -0.10 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 -2.43 0.04 -0.15 2.97 -4.23 -1.11 -4.84 115.64 105.89 2vxf s THR 28 Ca -0.30 -0.33 0.00 0.00 -1.18 0.00 0.00 61.69 59.89 2vxf s THR 28 Cb 0.08 -0.42 -0.00 0.00 1.34 0.00 0.00 72.50 73.50 2vxf s THR 28 CO 0.50 -0.18 -0.15 -0.63 -0.54 0.00 0.00 174.62 173.62 2vxf s ILE 29 N -0.67 2.72 -0.47 2.99 1.01 -1.26 -2.11 121.20 123.41 2vxf s ILE 29 Ca -0.08 -0.76 -0.04 0.00 0.00 0.00 0.00 60.65 59.78 2vxf s ILE 29 Cb -0.04 -2.14 0.12 0.00 0.01 0.00 0.00 42.46 40.41 2vxf s ILE 29 CO 0.01 0.52 0.28 -0.62 0.00 0.00 0.00 174.94 175.13 2vxf s ASP 30 N 0.70 5.32 0.20 3.58 2.15 -0.79 -4.95 116.67 122.87 2vxf s ASP 30 Ca -0.07 -2.22 -0.03 0.00 0.43 0.00 0.00 52.55 50.66 2vxf s ASP 30 Cb -0.16 -1.86 0.13 0.00 -0.30 0.00 0.00 42.92 40.74 2vxf s ASP 30 CO 0.02 -0.52 1.52 0.74 -0.17 0.00 0.00 175.17 176.76 2vxf h THR 31 N 6.07 1.32 -0.07 1.71 2.02 -1.98 -2.42 112.91 119.55 2vxf h THR 31 Ca -0.11 -1.76 0.02 0.00 0.77 0.00 0.00 66.41 65.33 2vxf h THR 31 Cb 1.03 1.73 -0.00 0.00 -1.74 0.00 0.00 68.15 69.17 2vxf h THR 31 CO 0.72 0.55 0.06 -0.33 0.37 0.00 0.00 175.52 176.89 2vxf h GLU 32 N 0.43 0.00 -0.13 6.66 5.08 -1.94 -2.03 114.58 122.65 2vxf h GLU 32 Ca 0.01 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.37 2vxf h GLU 32 Cb 1.06 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.31 2vxf h GLU 32 CO 0.10 0.00 0.00 0.09 -1.00 0.00 0.00 179.01 178.20 2vxf n ASN 33 N -4.41 2.63 -3.93 1.42 3.02 -1.23 -4.99 115.26 107.78 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 -0.25 -0.00 0.00 -0.61 0.00 0.00 39.78 39.08 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 -0.47 -1.52 -4.16 6.41 2.88 -0.77 -4.89 113.62 111.12 2vxf n SER 34 Ca 0.10 -0.94 -0.17 0.00 -1.33 0.00 0.00 58.87 56.53 2vxf n SER 34 Cb 0.49 -3.35 -0.12 0.00 -0.75 0.00 0.00 64.21 60.49 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 -3.71 1.02 -0.01 2.46 -4.23 -0.92 -2.33 115.64 107.92 2vxf s THR 35 Ca 0.20 -1.28 0.04 0.00 -1.18 0.00 0.00 61.69 59.46 2vxf s THR 35 Cb -0.10 -1.01 -0.01 0.00 1.34 0.00 0.00 72.50 72.72 2vxf s THR 35 CO 0.87 -0.26 -0.12 -0.69 -0.54 0.00 0.00 174.62 173.89 2vxf s VAL 36 N -1.32 0.93 -0.15 2.29 1.01 -0.93 -1.89 120.40 120.34 2vxf s VAL 36 Ca -0.03 -0.49 -0.02 0.00 0.00 0.00 0.00 61.98 61.43 2vxf s VAL 36 Cb -0.10 -0.78 -0.02 0.00 0.00 0.00 0.00 36.38 35.48 2vxf s VAL 36 CO 0.02 0.27 -0.08 0.00 0.00 0.00 0.00 175.10 175.31 2vxf s ALA 37 N -0.21 2.81 -0.04 5.51 0.00 -0.90 -2.31 121.76 126.62 2vxf s ALA 37 Ca 0.03 -0.90 0.05 0.00 0.00 0.00 0.00 51.96 51.15 2vxf s ALA 37 Cb -0.05 -1.43 -0.02 0.00 0.00 0.00 0.00 23.12 21.62 2vxf s ALA 37 CO -0.00 0.14 -0.19 -0.51 0.00 0.00 0.00 175.76 175.19 2vxf s LEU 38 N 0.51 2.43 0.30 0.00 1.43 -0.95 -2.49 118.68 119.90 2vxf s LEU 38 Ca -0.06 -0.33 0.10 0.00 -1.03 0.00 0.00 54.13 52.81 2vxf s LEU 38 Cb -0.15 -1.46 -0.05 0.00 0.03 0.00 0.00 46.19 44.56 2vxf s LEU 38 CO 0.03 0.32 -0.04 0.00 0.23 0.00 0.00 176.35 176.89 2vxf s ALA 39 N -0.58 3.10 -1.08 4.21 0.00 -1.08 -2.24 121.76 124.09 2vxf s ALA 39 Ca 0.08 -1.83 -0.16 0.00 0.00 0.00 0.00 51.96 50.05 2vxf s ALA 39 Cb -0.11 -0.50 -0.02 0.00 0.00 0.00 0.00 23.12 22.49 2vxf s ALA 39 CO 0.01 0.18 0.80 1.17 0.00 0.00 0.00 175.76 177.92 2vxf n LYS 40 N -0.86 -1.39 -4.53 0.00 4.81 -0.98 -2.56 118.16 112.66 2vxf n LYS 40 Ca -0.05 0.61 -0.23 0.00 -0.87 0.00 0.00 58.31 57.76 2vxf n LYS 40 Cb 0.61 -4.39 -0.14 0.00 0.02 0.00 0.00 35.03 31.12 2vxf n LYS 40 CO 0.00 0.00 0.00 0.54 1.17 0.00 0.00 177.40 179.11 2vxf s VAL 41 N -3.39 1.45 0.05 3.15 0.11 -1.01 -4.08 120.40 116.68 2vxf s VAL 41 Ca 0.42 -1.12 0.00 0.00 -2.93 0.00 0.00 61.98 58.35 2vxf s VAL 41 Cb -0.13 -1.28 -0.03 0.00 -1.53 0.00 0.00 36.38 33.41 2vxf s VAL 41 CO 0.84 0.13 -0.04 0.00 -3.33 0.00 0.00 175.10 172.69 2vxf s ARG 42 N -1.16 0.56 -0.16 1.54 1.70 -0.72 -1.88 118.95 118.82 2vxf s ARG 42 Ca 0.05 -1.00 -0.10 0.00 -0.47 0.00 0.00 55.73 54.21 2vxf s ARG 42 Cb -0.08 0.03 -0.05 0.00 -0.57 0.00 0.00 34.95 34.28 2vxf s ARG 42 CO 0.02 -0.05 0.17 -1.54 -1.08 0.00 0.00 175.30 172.82 2vxf s SER 43 N -2.34 6.33 0.15 -2.89 1.04 -1.26 -2.24 113.70 112.48 2vxf s SER 43 Ca -0.01 0.38 -0.11 0.00 0.48 0.00 0.00 55.95 56.70 2vxf s SER 43 Cb -0.00 -2.11 -0.03 0.00 0.10 0.00 0.00 66.02 63.98 2vxf s SER 43 CO -0.05 0.24 1.49 -0.26 0.98 0.00 0.00 173.24 175.65 2vxf h PHE 44 N 6.07 1.14 0.00 5.02 0.04 -1.83 -3.49 116.94 123.89 2vxf h PHE 44 Ca -0.46 -0.32 0.00 0.00 2.80 0.00 0.00 57.97 59.99 2vxf h PHE 44 Cb 1.18 -0.25 0.00 0.00 2.20 0.00 0.00 35.95 39.08 2vxf h PHE 44 CO 0.64 1.16 0.00 0.41 -0.60 0.00 0.00 178.31 179.92 2vxf n GLY 45 N 0.07 1.02 0.12 -1.45 0.00 -1.26 -5.02 105.19 98.67 2vxf n GLY 45 Ca -0.02 -1.02 0.01 0.00 0.00 0.00 0.00 46.02 44.99 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 -0.60 0.64 0.24 2.61 -2.24 -1.26 -4.29 114.28 109.38 2vxf n THR 46 Ca 0.00 -0.82 0.18 0.00 -2.27 0.00 0.00 64.05 61.14 2vxf n THR 46 Cb 0.00 0.70 0.84 0.00 -2.10 0.00 0.00 70.33 69.77 2vxf n THR 46 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 2vxf h GLU 47 N 0.45 0.00 -0.20 -0.78 5.08 -1.95 0.19 114.58 117.37 2vxf h GLU 47 Ca 0.00 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2vxf h GLU 47 Cb 0.39 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.63 2vxf h GLU 47 CO 0.00 0.00 0.11 0.22 -1.00 0.00 0.00 179.01 178.34 2vxf h ASP 48 N 0.00 0.23 -3.97 1.42 -0.00 -1.86 -3.33 116.42 108.91 2vxf h ASP 48 Ca 0.07 -0.01 -0.65 0.00 -0.00 0.00 0.00 57.03 56.45 2vxf h ASP 48 Cb 0.67 -0.06 -0.40 0.00 -0.00 0.00 0.00 39.33 39.54 2vxf h ASP 48 CO -0.00 0.19 -0.68 -0.13 -0.00 0.00 0.00 179.24 178.62 2vxf s ARG 49 N -5.23 1.67 0.17 0.28 1.81 0.67 -5.04 118.95 113.28 2vxf s ARG 49 Ca -0.07 -2.20 -0.32 0.00 -1.72 0.00 0.00 55.73 51.43 2vxf s ARG 49 Cb 0.17 -3.17 -0.10 0.00 -0.45 0.00 0.00 34.95 31.39 2vxf s ARG 49 CO 0.70 -1.03 1.58 -1.25 -0.68 0.00 0.00 175.30 174.62 2vxf s PRO 50 N 0.36 4.21 0.21 3.54 0.04 -1.25 -4.97 135.00 137.13 2vxf s PRO 50 Ca 0.14 2.38 0.03 0.00 0.04 0.00 0.00 61.00 63.59 2vxf s PRO 50 Cb -0.22 -3.15 -0.05 0.00 0.04 0.00 0.00 34.50 31.12 2vxf s PRO 50 CO -0.05 -0.62 -0.00 0.95 0.04 0.00 0.00 177.00 177.33 2vxf s THR 51 N 1.14 0.88 -1.78 1.26 -4.23 -1.26 -5.03 115.64 106.62 2vxf s THR 51 Ca 0.70 -2.01 0.28 0.00 -1.18 0.00 0.00 61.69 59.48 2vxf s THR 51 Cb -0.44 -2.25 0.69 0.00 1.34 0.00 0.00 72.50 71.83 2vxf s THR 51 CO 0.31 -0.38 2.01 -0.90 -0.54 0.00 0.00 174.62 175.12 2vxf n ASP 52 N -0.35 0.00 -4.09 3.99 5.68 -1.26 -4.56 116.55 115.97 2vxf n ASP 52 Ca -0.06 -0.59 -0.33 0.00 -0.50 0.00 0.00 54.79 53.31 2vxf n ASP 52 Cb 0.64 -0.11 -0.14 0.00 -1.14 0.00 0.00 41.12 40.36 2vxf n ASP 52 CO 0.00 0.00 0.00 -0.60 -1.33 0.00 0.00 177.20 175.27 2vxf s ARG 53 N -2.22 2.10 0.45 0.11 3.52 -1.26 -5.10 118.95 116.56 2vxf s ARG 53 Ca 0.36 -1.48 -0.24 0.00 -0.13 0.00 0.00 55.73 54.24 2vxf s ARG 53 Cb 0.19 -3.09 -0.07 0.00 -1.56 0.00 0.00 34.95 30.41 2vxf s ARG 53 CO 0.36 -0.71 1.24 -1.25 -0.81 0.00 0.00 175.30 174.13 2vxf s PRO 54 N 1.10 3.73 -0.13 5.12 0.04 -1.26 -5.02 135.00 138.58 2vxf s PRO 54 Ca -0.02 1.97 -0.04 0.00 0.04 0.00 0.00 61.00 62.95 2vxf s PRO 54 Cb -0.20 -2.50 -0.04 0.00 0.04 0.00 0.00 34.50 31.80 2vxf s PRO 54 CO -0.05 -0.63 0.03 0.42 0.04 0.00 0.00 177.00 176.82 2vxf s ILE 55 N -1.41 4.56 -0.39 0.56 -1.09 -1.26 -5.08 121.20 117.08 2vxf s ILE 55 Ca 0.62 -0.14 -0.13 0.00 -2.23 0.00 0.00 60.65 58.78 2vxf s ILE 55 Cb -0.34 -2.97 0.02 0.00 -1.58 0.00 0.00 42.46 37.60 2vxf s ILE 55 CO 0.41 0.55 0.25 0.00 -1.23 0.00 0.00 174.94 174.93 2vxf s ALA 56 N -0.41 3.38 0.63 9.38 0.00 -1.26 -5.04 121.76 128.44 2vxf s ALA 56 Ca 0.09 -1.73 -0.17 0.00 0.00 0.00 0.00 51.96 50.15 2vxf s ALA 56 Cb -0.12 -2.74 -0.01 0.00 0.00 0.00 0.00 23.12 20.24 2vxf s ALA 56 CO 0.02 -1.43 1.16 -1.25 0.00 0.00 0.00 175.76 174.26 2vxf s PRO 57 N 1.61 2.83 0.18 0.00 0.04 -1.26 -5.05 135.00 133.35 2vxf s PRO 57 Ca 0.03 1.64 0.11 0.00 0.04 0.00 0.00 61.00 62.82 2vxf s PRO 57 Cb -0.19 -1.93 -0.04 0.00 0.04 0.00 0.00 34.50 32.37 2vxf s PRO 57 CO 0.08 -1.27 -0.21 1.03 0.04 0.00 0.00 177.00 176.67 2vxf s ARG 58 N -3.67 1.64 0.33 4.56 0.52 -1.26 -5.03 118.95 116.04 2vxf s ARG 58 Ca 0.73 -1.44 0.07 0.00 -0.52 0.00 0.00 55.73 54.57 2vxf s ARG 58 Cb -0.26 -1.93 0.57 0.00 0.52 0.00 0.00 34.95 33.85 2vxf s ARG 58 CO 0.37 0.42 1.78 0.22 0.02 0.00 0.00 175.30 178.11 2vxf h ASP 59 N 3.23 0.27 -2.56 0.23 3.58 -2.05 -3.44 116.42 115.69 2vxf h ASP 59 Ca -0.47 -0.09 -0.05 0.00 0.42 0.00 0.00 57.03 56.84 2vxf h ASP 59 Cb 1.20 -0.07 0.02 0.00 1.72 0.00 0.00 39.33 42.20 2vxf h ASP 59 CO 0.48 0.55 0.04 -0.62 -2.88 0.00 0.00 179.24 176.82 2vxf n GLU 60 N -4.13 0.02 -4.33 0.28 1.02 -1.26 -5.12 120.64 107.12 2vxf n GLU 60 Ca -0.01 -0.27 -0.18 0.00 -0.02 0.00 0.00 57.16 56.68 2vxf n GLU 60 Cb 0.39 -0.15 -0.10 0.00 -0.02 0.00 0.00 31.44 31.57 2vxf n GLU 60 CO 0.00 0.00 0.00 -0.08 1.18 0.00 0.00 177.13 178.23 2vxf s THR 61 N -1.06 0.47 -0.01 2.62 -1.32 -1.26 -5.01 115.64 110.07 2vxf s THR 61 Ca 0.09 -2.00 -0.23 0.00 -1.21 0.00 0.00 61.69 58.34 2vxf s THR 61 Cb -0.00 -2.58 -0.05 0.00 -1.51 0.00 0.00 72.50 68.36 2vxf s THR 61 CO 0.06 0.00 0.68 -0.36 -2.21 0.00 0.00 174.62 172.80 2vxf s PHE 62 N -3.68 3.66 0.05 9.09 0.40 -0.79 -4.91 117.98 121.81 2vxf s PHE 62 Ca 0.36 1.30 -0.20 0.00 -0.60 0.00 0.00 56.93 57.80 2vxf s PHE 62 Cb 0.06 -2.74 -0.13 0.00 0.51 0.00 0.00 43.02 40.72 2vxf s PHE 62 CO 0.15 0.24 1.38 0.93 0.70 0.00 0.00 175.22 178.62 2vxf h GLU 63 N 6.02 0.39 -2.82 0.44 5.08 -1.94 -2.66 114.58 119.10 2vxf h GLU 63 Ca -0.43 -0.19 -0.19 0.00 -1.00 0.00 0.00 59.36 57.55 2vxf h GLU 63 Cb 1.20 -0.00 -0.31 0.00 0.50 0.00 0.00 28.75 30.14 2vxf h GLU 63 CO 0.72 0.73 -0.49 -0.47 -1.00 0.00 0.00 179.01 178.50 2vxf s TYR 64 N -4.44 -0.48 0.05 4.33 6.14 -1.26 -2.31 117.35 119.38 2vxf s TYR 64 Ca -0.14 1.05 0.04 0.00 0.64 0.00 0.00 57.07 58.66 2vxf s TYR 64 Cb 0.06 0.04 -0.02 0.00 0.42 0.00 0.00 41.96 42.46 2vxf s TYR 64 CO 0.76 -0.36 -0.12 0.42 0.64 0.00 0.00 175.55 176.89 2vxf s ILE 65 N 2.24 0.91 -0.07 3.14 1.01 -0.95 -5.03 121.20 122.45 2vxf s ILE 65 Ca -0.01 -1.07 0.02 0.00 0.00 0.00 0.00 60.65 59.58 2vxf s ILE 65 Cb -0.12 -0.88 -0.03 0.00 0.01 0.00 0.00 42.46 41.45 2vxf s ILE 65 CO -0.09 -0.17 -0.11 -0.63 0.00 0.00 0.00 174.94 173.94 2vxf s ILE 66 N -1.09 3.37 0.03 2.92 1.01 -1.26 -2.25 121.20 123.93 2vxf s ILE 66 Ca -0.03 -0.60 0.05 0.00 0.00 0.00 0.00 60.65 60.07 2vxf s ILE 66 Cb -0.09 -2.36 -0.02 0.00 0.01 0.00 0.00 42.46 40.00 2vxf s ILE 66 CO 0.01 0.59 -0.15 -0.36 0.00 0.00 0.00 174.94 175.03 2vxf s PHE 67 N -0.64 1.32 0.12 3.97 0.08 -0.98 -5.04 117.98 116.82 2vxf s PHE 67 Ca 0.10 -0.34 0.05 0.00 0.12 0.00 0.00 56.93 56.86 2vxf s PHE 67 Cb -0.11 -0.79 -0.04 0.00 -0.57 0.00 0.00 43.02 41.50 2vxf s PHE 67 CO 0.01 0.04 0.02 1.03 -0.10 0.00 0.00 175.22 176.22 2vxf s ARG 68 N -1.02 2.57 0.58 0.44 0.52 -1.26 -2.19 118.95 118.60 2vxf s ARG 68 Ca 0.03 -0.90 0.28 0.00 -0.52 0.00 0.00 55.73 54.62 2vxf s ARG 68 Cb -0.08 -2.52 1.64 0.00 0.52 0.00 0.00 34.95 34.52 2vxf s ARG 68 CO 0.01 0.51 2.11 0.78 0.02 0.00 0.00 175.30 178.73 2vxf h GLY 69 N 3.11 0.00 0.89 -3.53 0.00 -1.80 -2.15 103.07 99.58 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 0.03 1.76 0.00 0.00 0.00 176.54 178.93 2vxf h SER 70 N 0.00 0.51 0.81 0.19 0.02 -1.94 -3.21 113.55 109.92 2vxf h SER 70 Ca 0.08 -0.28 -0.24 0.00 -0.84 0.00 0.00 61.79 60.51 2vxf h SER 70 Cb 0.45 -0.14 -0.03 0.00 0.14 0.00 0.00 62.40 62.83 2vxf h SER 70 CO -0.00 0.66 -1.20 -2.24 -1.14 0.00 0.00 176.83 172.91 2vxf h ASP 71 N 0.34 0.10 -3.90 3.07 3.04 -1.83 -3.46 116.42 113.78 2vxf h ASP 71 Ca 0.09 -0.12 -0.52 0.00 -3.24 0.00 0.00 57.03 53.23 2vxf h ASP 71 Cb 0.38 -0.03 0.07 0.00 -1.04 0.00 0.00 39.33 38.71 2vxf h ASP 71 CO 0.01 1.10 0.63 -0.63 -2.04 0.00 0.00 179.24 178.31 2vxf s ILE 72 N -2.68 2.68 -0.21 4.15 1.01 -0.86 -0.73 121.20 124.56 2vxf s ILE 72 Ca -0.02 0.67 -0.02 0.00 0.00 0.00 0.00 60.65 61.28 2vxf s ILE 72 Cb 0.09 -3.42 -0.13 0.00 0.01 0.00 0.00 42.46 39.02 2vxf s ILE 72 CO 0.83 0.14 -0.21 1.17 0.00 0.00 0.00 174.94 176.88 2vxf n LYS 73 N 0.61 0.51 -3.81 2.79 4.81 0.24 -4.78 118.16 118.53 2vxf n LYS 73 Ca 0.01 0.14 -0.12 0.00 -0.87 0.00 0.00 58.31 57.47 2vxf n LYS 73 Cb 0.42 -1.38 -0.09 0.00 0.02 0.00 0.00 35.03 34.00 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 -6.26 -0.10 -0.05 3.14 2.15 -1.09 -5.03 116.67 109.42 2vxf s ASP 74 Ca -0.29 -0.02 0.02 0.00 0.43 0.00 0.00 52.55 52.69 2vxf s ASP 74 Cb 0.08 0.27 0.01 0.00 -0.30 0.00 0.00 42.92 42.99 2vxf s ASP 74 CO 0.46 -0.40 -0.11 -0.22 -0.17 0.00 0.00 175.17 174.72 2vxf s LEU 75 N -1.30 1.65 0.01 -1.34 0.20 -1.26 -1.78 118.68 114.86 2vxf s LEU 75 Ca -0.14 -0.27 0.04 0.00 0.69 0.00 0.00 54.13 54.46 2vxf s LEU 75 Cb -0.06 -0.75 -0.01 0.00 -0.43 0.00 0.00 46.19 44.93 2vxf s LEU 75 CO 0.03 0.04 -0.11 -0.89 -0.29 0.00 0.00 176.35 175.12 2vxf s THR 76 N 0.57 0.90 0.04 3.68 2.01 -0.96 -5.05 115.64 116.83 2vxf s THR 76 Ca -0.12 -0.68 -0.09 0.00 0.31 0.00 0.00 61.69 61.11 2vxf s THR 76 Cb -0.14 -0.79 -0.05 0.00 0.01 0.00 0.00 72.50 71.52 2vxf s THR 76 CO 0.03 0.11 0.34 -0.69 -0.69 0.00 0.00 174.62 173.72 2vxf s VAL 77 N -0.54 5.18 -0.21 3.82 1.01 -1.26 -1.94 120.40 126.46 2vxf s VAL 77 Ca 0.02 0.39 0.05 0.00 0.00 0.00 0.00 61.98 62.44 2vxf s VAL 77 Cb -0.06 -3.61 -0.21 0.00 0.00 0.00 0.00 36.38 32.50 2vxf s VAL 77 CO 0.00 0.37 -0.01 0.00 0.00 0.00 0.00 175.10 175.46 2vxf s GLU 79 N -2.52 3.75 0.77 0.00 2.12 -1.26 -5.06 118.70 116.50 2vxf s GLU 79 Ca -0.25 -0.30 -0.12 0.00 0.36 0.00 0.00 54.97 54.66 2vxf s GLU 79 Cb 0.08 -3.74 0.06 0.00 0.26 0.00 0.00 34.13 30.79 2vxf s GLU 79 CO 0.69 -0.38 1.13 -2.14 -0.54 0.00 0.00 175.26 174.02 2vxf s PRO 80 N 1.95 2.09 0.51 4.30 0.02 -1.26 -4.96 135.00 137.65 2vxf s PRO 80 Ca 0.11 1.39 -0.23 0.00 0.02 0.00 0.00 61.00 62.30 2vxf s PRO 80 Cb -0.16 -1.86 -0.06 0.00 0.02 0.00 0.00 34.50 32.43 2vxf s PRO 80 CO 0.11 -1.80 1.32 -2.14 -0.33 0.00 0.00 177.00 174.16 2vxf s PRO 81 N -4.51 3.39 -0.02 5.54 0.02 -1.26 -5.01 135.00 133.15 2vxf s PRO 81 Ca 0.66 2.14 -0.09 0.00 0.02 0.00 0.00 61.00 63.73 2vxf s PRO 81 Cb -0.21 -2.36 -0.05 0.00 0.02 0.00 0.00 34.50 31.90 2vxf s PRO 81 CO 0.51 -0.96 0.28 0.21 -0.33 0.00 0.00 177.00 176.71 2vxf s LYS 82 N -2.77 3.64 0.29 5.54 2.20 -1.26 -5.06 119.74 122.32 2vxf s LYS 82 Ca 0.68 0.04 -0.29 0.00 -0.36 0.00 0.00 55.97 56.04 2vxf s LYS 82 Cb -0.38 -3.13 -0.10 0.00 -1.51 0.00 0.00 37.83 32.72 2vxf s LYS 82 CO 0.46 0.68 1.27 -1.25 -0.36 0.00 0.00 175.35 176.15 2vxf s PRO 83 N -1.45 4.41 -0.02 4.03 0.04 -1.26 -4.98 135.00 135.77 2vxf s PRO 83 Ca 0.24 2.11 0.04 0.00 0.04 0.00 0.00 61.00 63.43 2vxf s PRO 83 Cb -0.14 -3.12 -0.01 0.00 0.04 0.00 0.00 34.50 31.28 2vxf s PRO 83 CO 0.13 -0.13 -0.13 -1.50 0.04 0.00 0.00 177.00 175.40 2vxf s ILE 84 N -0.84 1.07 0.00 0.56 2.07 -1.26 -5.20 121.20 117.60 2vxf s ILE 84 Ca 0.50 -0.55 0.00 0.00 -1.41 0.00 0.00 60.65 59.19 2vxf s ILE 84 Cb -0.38 -0.91 0.00 0.00 0.13 0.00 0.00 42.46 41.30 2vxf s ILE 84 CO 0.47 0.31 0.00 0.23 -1.91 0.00 0.00 174.94 174.04