#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2vxf s GLU -1 N 0.00 1.91 0.11 3.23 2.02 -1.26 -5.13 118.70 119.57 2vxf s GLU -1 Ca 0.00 -1.41 -0.02 0.00 0.02 0.00 0.00 54.97 53.56 2vxf s GLU -1 Cb 0.00 -2.03 -0.05 0.00 0.10 0.00 0.00 34.13 32.15 2vxf s GLU -1 CO 0.00 0.41 0.30 -0.51 0.02 0.00 0.00 175.26 175.48 2vxf s ASP 0 N -2.97 6.43 0.21 -0.19 1.01 -1.26 -4.97 116.67 114.93 2vxf s ASP 0 Ca 0.25 0.44 -0.07 0.00 0.71 0.00 0.00 52.55 53.88 2vxf s ASP 0 Cb -0.08 -2.03 0.15 0.00 1.01 0.00 0.00 42.92 41.97 2vxf s ASP 0 CO 0.14 0.10 1.71 1.55 0.21 0.00 0.00 175.17 178.89 2vxf h PRO 1 N 2.92 1.06 -0.31 8.23 0.13 -2.00 0.54 132.00 142.57 2vxf h PRO 1 Ca -0.46 -0.28 -0.13 0.00 -0.87 0.00 0.00 66.00 64.27 2vxf h PRO 1 Cb 1.16 -0.13 -0.01 0.00 0.13 0.00 0.00 31.00 32.16 2vxf h PRO 1 CO 0.74 0.98 -0.34 1.03 -0.23 0.00 0.00 178.00 180.18 2vxf h SER 2 N 0.99 0.72 -0.26 1.44 0.87 -1.92 -2.83 113.55 112.56 2vxf h SER 2 Ca 0.20 -0.30 0.00 0.00 -1.23 0.00 0.00 61.79 60.46 2vxf h SER 2 Cb 0.44 -0.20 0.00 0.00 -0.44 0.00 0.00 62.40 62.20 2vxf h SER 2 CO 0.01 0.99 0.00 0.61 -0.53 0.00 0.00 176.83 177.92 2vxf n GLY 3 N -0.08 0.82 0.26 5.77 0.00 -1.04 -4.33 105.19 106.60 2vxf n GLY 3 Ca -0.01 -0.53 0.04 0.00 0.00 0.00 0.00 46.02 45.52 2vxf n GLY 3 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2vxf h GLY 4 N 4.87 0.30 -5.83 -0.02 0.00 0.34 -3.40 103.07 99.33 2vxf h GLY 4 Ca 0.00 -0.15 -0.59 0.00 0.00 0.00 0.00 47.33 46.59 2vxf h GLY 4 CO 0.00 0.14 0.23 -1.59 0.00 0.00 0.00 176.54 175.33 2vxf s THR 5 N -4.99 4.96 0.45 4.70 2.01 -1.26 -5.04 115.64 116.47 2vxf s THR 5 Ca -0.06 1.35 -0.22 0.00 0.31 0.00 0.00 61.69 63.07 2vxf s THR 5 Cb 0.16 -4.02 -0.08 0.00 0.01 0.00 0.00 72.50 68.57 2vxf s THR 5 CO 0.72 0.06 1.06 -2.16 -0.69 0.00 0.00 174.62 173.62 2vxf s PRO 6 N 2.11 3.90 0.33 4.92 0.04 -1.26 -4.95 135.00 140.09 2vxf s PRO 6 Ca 0.32 1.48 0.11 0.00 0.04 0.00 0.00 61.00 62.95 2vxf s PRO 6 Cb -0.16 -2.29 0.58 0.00 0.04 0.00 0.00 34.50 32.67 2vxf s PRO 6 CO 0.10 -0.37 1.75 1.88 0.04 0.00 0.00 177.00 180.41 2vxf h TYR 7 N 1.94 0.05 -3.71 0.56 0.05 -1.96 -3.44 116.97 110.46 2vxf h TYR 7 Ca -0.49 -0.01 -0.53 0.00 0.05 0.00 0.00 58.73 57.74 2vxf h TYR 7 Cb 1.22 -0.01 0.08 0.00 1.01 0.00 0.00 36.73 39.03 2vxf h TYR 7 CO 0.56 0.48 0.76 0.42 -1.05 0.00 0.00 178.16 179.33 2vxf s ILE 8 N -4.04 2.34 0.00 -2.88 1.01 -1.26 -2.24 121.20 114.14 2vxf s ILE 8 Ca -0.03 0.32 0.00 0.00 0.00 0.00 0.00 60.65 60.95 2vxf s ILE 8 Cb 0.14 -3.21 0.00 0.00 0.01 0.00 0.00 42.46 39.40 2vxf s ILE 8 CO 0.74 0.07 0.00 0.61 0.00 0.00 0.00 174.94 176.36 2vxf n GLY 9 N 1.19 0.55 3.91 6.18 0.00 -0.63 -5.00 105.19 111.39 2vxf n GLY 9 Ca 0.03 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 -2.84 6.46 -0.03 1.61 0.01 -0.95 -4.87 113.70 113.08 2vxf s SER 10 Ca 0.00 0.56 -0.26 0.00 1.31 0.00 0.00 55.95 57.56 2vxf s SER 10 Cb 0.00 -2.08 -0.04 0.00 0.21 0.00 0.00 66.02 64.12 2vxf s SER 10 CO 0.00 -0.01 0.81 -0.54 0.41 0.00 0.00 173.24 173.91 2vxf s LYS 11 N -2.98 4.49 0.03 12.44 1.02 -1.26 -1.99 119.74 131.49 2vxf s LYS 11 Ca 0.41 1.10 0.04 0.00 0.02 0.00 0.00 55.97 57.54 2vxf s LYS 11 Cb -0.12 -3.44 -0.02 0.00 -0.52 0.00 0.00 37.83 33.73 2vxf s LYS 11 CO 0.27 0.05 -0.13 0.42 -0.92 0.00 0.00 175.35 175.04 2vxf s ILE 12 N 0.76 1.00 -0.12 2.17 1.01 -0.88 -2.32 121.20 122.82 2vxf s ILE 12 Ca 0.43 -0.90 0.01 0.00 0.00 0.00 0.00 60.65 60.19 2vxf s ILE 12 Cb -0.19 -0.91 -0.01 0.00 0.01 0.00 0.00 42.46 41.36 2vxf s ILE 12 CO 0.22 0.01 -0.16 -0.55 0.00 0.00 0.00 174.94 174.46 2vxf s SER 13 N -1.01 3.70 -0.05 3.58 0.15 -0.81 -2.60 113.70 116.66 2vxf s SER 13 Ca 0.01 -0.41 0.06 0.00 0.70 0.00 0.00 55.95 56.31 2vxf s SER 13 Cb -0.07 -1.55 -0.01 0.00 -1.71 0.00 0.00 66.02 62.68 2vxf s SER 13 CO 0.01 0.15 -0.24 -0.22 1.20 0.00 0.00 173.24 174.14 2vxf s LEU 14 N 0.41 2.05 -0.24 3.45 2.96 -0.55 -2.21 118.68 124.55 2vxf s LEU 14 Ca -0.12 -0.49 -0.07 0.00 -0.22 0.00 0.00 54.13 53.22 2vxf s LEU 14 Cb -0.16 -1.33 -0.03 0.00 0.50 0.00 0.00 46.19 45.17 2vxf s LEU 14 CO 0.06 0.24 0.05 -0.63 -1.32 0.00 0.00 176.35 174.75 2vxf s ILE 15 N -0.18 4.16 0.62 6.68 1.01 -0.72 -1.91 121.20 130.85 2vxf s ILE 15 Ca -0.03 -0.22 -0.01 0.00 0.00 0.00 0.00 60.65 60.40 2vxf s ILE 15 Cb -0.13 -2.94 0.06 0.00 0.01 0.00 0.00 42.46 39.46 2vxf s ILE 15 CO 0.03 0.35 0.87 -0.44 0.00 0.00 0.00 174.94 175.76 2vxf s SER 16 N 1.59 4.95 0.65 3.58 0.01 -1.06 -1.00 113.70 122.42 2vxf s SER 16 Ca 0.06 -0.03 0.42 0.00 1.31 0.00 0.00 55.95 57.71 2vxf s SER 16 Cb -0.15 -0.68 2.29 0.00 0.21 0.00 0.00 66.02 67.69 2vxf s SER 16 CO 0.03 -1.41 2.29 0.07 0.41 0.00 0.00 173.24 174.63 2vxf h LYS 17 N -0.19 0.00 -0.67 12.44 2.10 -1.69 -1.47 116.57 127.09 2vxf h LYS 17 Ca -0.41 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.24 2vxf h LYS 17 Cb 1.29 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.62 2vxf h LYS 17 CO 0.50 0.00 0.00 0.00 -2.00 0.00 0.00 179.45 177.95 2vxf n ALA 18 N -2.04 3.04 -2.26 0.07 0.00 -1.26 -4.89 120.51 113.17 2vxf n ALA 18 Ca -0.03 -0.98 -0.19 0.00 0.00 0.00 0.00 53.44 52.25 2vxf n ALA 18 Cb 0.10 -1.04 -0.02 0.00 0.00 0.00 0.00 19.45 18.49 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 -1.75 -4.10 0.00 1.02 -0.55 -4.98 120.64 110.74 2vxf n GLU 19 Ca 0.15 0.95 -0.32 0.00 -0.02 0.00 0.00 57.16 57.92 2vxf n GLU 19 Cb 0.66 -5.55 -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 -2.88 4.61 -0.25 -3.67 1.01 -1.26 -4.47 121.20 114.29 2vxf s ILE 20 Ca 0.00 -0.56 -0.08 0.00 0.00 0.00 0.00 60.65 60.01 2vxf s ILE 20 Cb 0.00 -3.15 -0.03 0.00 0.01 0.00 0.00 42.46 39.29 2vxf s ILE 20 CO 0.00 0.27 0.09 -0.60 0.00 0.00 0.00 174.94 174.69 2vxf s ARG 21 N -1.97 3.74 -0.09 2.79 3.52 -1.26 -2.58 118.95 123.09 2vxf s ARG 21 Ca 0.25 -0.44 0.00 0.00 -0.13 0.00 0.00 55.73 55.42 2vxf s ARG 21 Cb -0.12 -3.37 -0.02 0.00 -1.56 0.00 0.00 34.95 29.88 2vxf s ARG 21 CO 0.17 -0.14 -0.10 0.71 -0.81 0.00 0.00 175.30 175.13 2vxf s TYR 22 N 1.51 2.87 -0.02 5.12 2.02 -0.81 -2.28 117.35 125.76 2vxf s TYR 22 Ca 0.06 -0.24 0.07 0.00 -0.37 0.00 0.00 57.07 56.58 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 0.05 0.10 -0.22 -2.00 -1.57 0.00 0.00 175.55 171.90 2vxf s GLU 23 N -0.29 2.21 0.23 -0.62 2.12 -0.94 -1.48 118.70 119.92 2vxf s GLU 23 Ca 0.03 -0.87 -0.17 0.00 0.36 0.00 0.00 54.97 54.32 2vxf s GLU 23 Cb -0.13 -2.15 0.06 0.00 0.26 0.00 0.00 34.13 32.18 2vxf s GLU 23 CO 0.03 0.58 0.86 0.41 -0.54 0.00 0.00 175.26 176.59 2vxf n GLY 24 N 2.31 0.81 3.64 -1.50 0.00 -1.07 -1.56 105.19 107.82 2vxf n GLY 24 Ca -0.16 -1.16 -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 3.98 -0.17 -0.61 -1.09 -1.09 -2.07 121.20 118.01 2vxf s ILE 25 Ca 0.19 -0.56 -0.29 0.00 -2.23 0.00 0.00 60.65 57.76 2vxf s ILE 25 Cb -0.03 -2.72 -0.05 0.00 -1.58 0.00 0.00 42.46 38.08 2vxf s ILE 25 CO 0.07 0.46 1.88 -0.22 -1.23 0.00 0.00 174.94 175.90 2vxf s LEU 26 N -1.27 3.87 -0.25 2.97 2.96 -0.84 -2.73 118.68 123.40 2vxf s LEU 26 Ca 0.16 1.92 -0.16 0.00 -0.22 0.00 0.00 54.13 55.84 2vxf s LEU 26 Cb -0.11 -3.53 -0.12 0.00 0.50 0.00 0.00 46.19 42.93 2vxf s LEU 26 CO 0.07 -1.43 -0.26 0.00 -1.32 0.00 0.00 176.35 173.40 2vxf n TYR 27 N 9.25 0.19 -3.85 5.38 9.36 -1.07 -1.60 117.16 134.83 2vxf n TYR 27 Ca 0.22 0.08 -0.12 0.00 3.32 0.00 0.00 57.90 61.41 2vxf n TYR 27 Cb 0.44 -0.92 -0.12 0.00 -0.63 0.00 0.00 39.34 38.11 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 -2.54 0.03 -0.15 2.97 -4.23 -1.11 -4.87 115.64 105.75 2vxf s THR 28 Ca -0.35 -0.27 0.01 0.00 -1.18 0.00 0.00 61.69 59.90 2vxf s THR 28 Cb 0.11 -0.27 0.00 0.00 1.34 0.00 0.00 72.50 73.68 2vxf s THR 28 CO 0.48 -0.15 -0.18 -0.63 -0.54 0.00 0.00 174.62 173.61 2vxf s ILE 29 N -0.48 2.46 -0.49 2.99 1.01 -1.26 -2.15 121.20 123.28 2vxf s ILE 29 Ca -0.06 -0.85 -0.04 0.00 0.00 0.00 0.00 60.65 59.71 2vxf s ILE 29 Cb -0.04 -2.02 0.13 0.00 0.01 0.00 0.00 42.46 40.55 2vxf s ILE 29 CO 0.01 0.53 0.30 -0.62 0.00 0.00 0.00 174.94 175.15 2vxf s ASP 30 N 0.76 5.31 0.17 3.58 2.15 -0.82 -4.95 116.67 122.87 2vxf s ASP 30 Ca -0.07 -2.29 -0.06 0.00 0.43 0.00 0.00 52.55 50.56 2vxf s ASP 30 Cb -0.16 -1.86 0.04 0.00 -0.30 0.00 0.00 42.92 40.64 2vxf s ASP 30 CO 0.00 -0.51 1.47 0.74 -0.17 0.00 0.00 175.17 176.70 2vxf h THR 31 N 5.98 1.30 -0.11 1.71 2.02 -1.98 -2.48 112.91 119.36 2vxf h THR 31 Ca -0.10 -1.78 0.03 0.00 0.77 0.00 0.00 66.41 65.33 2vxf h THR 31 Cb 1.02 1.73 -0.00 0.00 -1.74 0.00 0.00 68.15 69.15 2vxf h THR 31 CO 0.72 0.56 0.08 -0.08 0.37 0.00 0.00 175.52 177.18 2vxf h GLU 32 N 0.51 0.00 -0.13 6.66 4.81 -1.94 -1.98 114.58 122.51 2vxf h GLU 32 Ca 0.01 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.24 2vxf h GLU 32 Cb 1.12 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.50 2vxf h GLU 32 CO 0.11 0.00 0.00 0.09 -0.73 0.00 0.00 179.01 178.48 2vxf n ASN 33 N -4.31 2.64 -3.92 1.04 3.02 -1.23 -4.99 115.26 107.51 2vxf n ASN 33 Ca -0.00 -2.44 -0.26 0.00 -0.03 0.00 0.00 54.58 51.85 2vxf n ASN 33 Cb 0.20 -0.25 -0.00 0.00 -0.61 0.00 0.00 39.78 39.11 2vxf n ASN 33 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 2vxf n SER 34 N -0.48 -1.22 -4.12 6.41 3.41 -0.75 -4.88 113.62 111.99 2vxf n SER 34 Ca 0.10 -0.94 -0.18 0.00 -0.26 0.00 0.00 58.87 57.59 2vxf n SER 34 Cb 0.50 -3.34 -0.13 0.00 -0.26 0.00 0.00 64.21 60.99 2vxf n SER 34 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 2vxf s THR 35 N -3.76 0.95 -0.01 6.66 -4.23 -0.94 -2.46 115.64 111.84 2vxf s THR 35 Ca 0.14 -1.04 0.04 0.00 -1.18 0.00 0.00 61.69 59.65 2vxf s THR 35 Cb -0.07 -0.90 -0.01 0.00 1.34 0.00 0.00 72.50 72.86 2vxf s THR 35 CO 0.87 -0.12 -0.12 -0.69 -0.54 0.00 0.00 174.62 174.02 2vxf s VAL 36 N -1.01 0.95 -0.15 2.29 1.01 -0.94 -1.94 120.40 120.61 2vxf s VAL 36 Ca -0.02 -0.50 -0.02 0.00 0.00 0.00 0.00 61.98 61.44 2vxf s VAL 36 Cb -0.08 -0.80 -0.02 0.00 0.00 0.00 0.00 36.38 35.48 2vxf s VAL 36 CO 0.01 0.27 -0.08 0.00 0.00 0.00 0.00 175.10 175.31 2vxf s ALA 37 N -0.21 2.82 -0.05 5.51 0.00 -0.91 -2.27 121.76 126.65 2vxf s ALA 37 Ca 0.03 -0.89 0.05 0.00 0.00 0.00 0.00 51.96 51.16 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 0.16 -0.20 -0.51 0.00 0.00 0.00 175.76 175.21 2vxf s LEU 38 N 0.48 2.42 0.35 0.00 1.43 -0.95 -2.60 118.68 119.81 2vxf s LEU 38 Ca -0.06 -0.33 0.09 0.00 -1.03 0.00 0.00 54.13 52.79 2vxf s LEU 38 Cb -0.15 -1.46 -0.05 0.00 0.03 0.00 0.00 46.19 44.55 2vxf s LEU 38 CO 0.03 0.31 0.04 0.00 0.23 0.00 0.00 176.35 176.97 2vxf s ALA 39 N -0.56 3.27 -1.15 4.21 0.00 -1.10 -2.23 121.76 124.21 2vxf s ALA 39 Ca 0.08 -1.98 -0.16 0.00 0.00 0.00 0.00 51.96 49.90 2vxf s ALA 39 Cb -0.11 -0.39 -0.02 0.00 0.00 0.00 0.00 23.12 22.60 2vxf s ALA 39 CO 0.01 0.03 0.79 1.63 0.00 0.00 0.00 175.76 178.22 2vxf n LYS 40 N -1.01 -1.73 -4.60 0.00 5.02 -0.94 -2.68 118.16 112.23 2vxf n LYS 40 Ca -0.04 0.53 -0.29 0.00 -2.02 0.00 0.00 58.31 56.50 2vxf n LYS 40 Cb 0.63 -4.48 -0.14 0.00 -0.02 0.00 0.00 35.03 31.02 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 -3.49 2.10 0.05 -0.18 0.11 -1.03 -4.19 120.40 113.77 2vxf s VAL 41 Ca 0.42 -1.54 0.03 0.00 -2.93 0.00 0.00 61.98 57.95 2vxf s VAL 41 Cb -0.13 -1.84 -0.02 0.00 -1.53 0.00 0.00 36.38 32.86 2vxf s VAL 41 CO 0.84 0.19 -0.09 -0.13 -3.33 0.00 0.00 175.10 172.58 2vxf s ARG 42 N -1.65 0.57 -0.18 1.54 0.52 -0.60 -2.08 118.95 117.08 2vxf s ARG 42 Ca 0.12 -0.79 -0.13 0.00 -0.52 0.00 0.00 55.73 54.41 2vxf s ARG 42 Cb -0.10 -0.37 -0.05 0.00 0.52 0.00 0.00 34.95 34.95 2vxf s ARG 42 CO 0.04 0.07 0.27 -1.54 0.02 0.00 0.00 175.30 174.16 2vxf s SER 43 N -1.60 6.38 0.13 0.23 1.04 -1.26 -2.22 113.70 116.39 2vxf s SER 43 Ca -0.09 0.44 -0.12 0.00 0.48 0.00 0.00 55.95 56.66 2vxf s SER 43 Cb -0.10 -2.17 -0.07 0.00 0.10 0.00 0.00 66.02 63.78 2vxf s SER 43 CO 0.01 0.09 1.43 -0.26 0.98 0.00 0.00 173.24 175.49 2vxf h PHE 44 N 6.79 1.10 0.00 5.02 0.04 -1.86 -3.49 116.94 124.54 2vxf h PHE 44 Ca -0.40 -0.36 0.00 0.00 2.80 0.00 0.00 57.97 60.00 2vxf h PHE 44 Cb 1.16 -0.22 0.00 0.00 2.20 0.00 0.00 35.95 39.09 2vxf h PHE 44 CO 0.61 1.19 0.00 0.41 -0.60 0.00 0.00 178.31 179.91 2vxf n GLY 45 N 0.26 0.89 0.00 -1.45 0.00 -1.26 -5.03 105.19 98.59 2vxf n GLY 45 Ca -0.03 -1.04 0.01 0.00 0.00 0.00 0.00 46.02 44.96 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 0.01 0.27 2.61 -2.24 -1.26 -4.29 114.28 108.77 2vxf n THR 46 Ca 0.00 -0.05 0.13 0.00 -2.27 0.00 0.00 64.05 61.86 2vxf n THR 46 Cb 0.00 0.30 0.78 0.00 -2.10 0.00 0.00 70.33 69.31 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 0.00 0.00 -0.23 -0.78 5.08 -1.96 -2.26 114.58 114.43 2vxf h GLU 47 Ca -0.01 0.00 0.02 0.00 -1.00 0.00 0.00 59.36 58.37 2vxf h GLU 47 Cb 0.21 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.44 2vxf h GLU 47 CO 0.00 0.08 0.16 0.22 -1.00 0.00 0.00 179.01 178.47 2vxf h ASP 48 N 0.00 0.20 -3.81 1.42 1.82 -1.93 -3.32 116.42 110.80 2vxf h ASP 48 Ca -0.00 -0.00 -0.63 0.00 -0.39 0.00 0.00 57.03 56.00 2vxf h ASP 48 Cb 0.22 -0.05 -0.40 0.00 0.68 0.00 0.00 39.33 39.78 2vxf h ASP 48 CO 0.01 0.14 -0.70 -0.13 -1.61 0.00 0.00 179.24 176.95 2vxf s ARG 49 N -5.24 1.51 0.20 0.28 1.81 -0.85 -5.10 118.95 111.55 2vxf s ARG 49 Ca -0.06 -2.04 -0.33 0.00 -1.72 0.00 0.00 55.73 51.58 2vxf s ARG 49 Cb 0.18 -2.93 -0.14 0.00 -0.45 0.00 0.00 34.95 31.61 2vxf s ARG 49 CO 0.70 -1.04 1.51 -2.30 -0.68 0.00 0.00 175.30 173.49 2vxf n PRO 50 N 3.84 2.12 -4.36 3.54 -0.02 -1.25 -4.96 135.00 133.92 2vxf n PRO 50 Ca 0.04 0.76 -0.18 0.00 -2.02 0.00 0.00 63.50 62.10 2vxf n PRO 50 Cb 0.37 -2.49 -0.10 0.00 -0.02 0.00 0.00 33.50 31.27 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 0.48 1.23 -1.78 3.45 -4.23 -1.26 -5.03 115.64 108.51 2vxf s THR 51 Ca 0.74 -2.06 0.28 0.00 -1.18 0.00 0.00 61.69 59.46 2vxf s THR 51 Cb -0.66 -2.36 0.67 0.00 1.34 0.00 0.00 72.50 71.49 2vxf s THR 51 CO 0.43 -0.33 1.99 0.47 -0.54 0.00 0.00 174.62 176.64 2vxf n ASP 52 N -0.46 0.00 -4.14 3.99 8.00 -1.26 -4.54 116.55 118.13 2vxf n ASP 52 Ca -0.05 -0.58 -0.35 0.00 0.71 0.00 0.00 54.79 54.52 2vxf n ASP 52 Cb 0.64 -0.11 -0.13 0.00 -0.02 0.00 0.00 41.12 41.49 2vxf n ASP 52 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 2vxf s ARG 53 N -2.22 2.24 0.23 -1.24 0.52 -1.26 -5.09 118.95 112.13 2vxf s ARG 53 Ca 0.36 -1.44 -0.31 0.00 -0.52 0.00 0.00 55.73 53.81 2vxf s ARG 53 Cb 0.19 -3.25 -0.11 0.00 0.52 0.00 0.00 34.95 32.30 2vxf s ARG 53 CO 0.36 -0.74 1.60 -2.14 0.02 0.00 0.00 175.30 174.40 2vxf s PRO 54 N 1.19 4.17 0.00 3.54 0.02 -1.26 -5.01 135.00 137.65 2vxf s PRO 54 Ca -0.01 2.48 0.08 0.00 0.02 0.00 0.00 61.00 63.57 2vxf s PRO 54 Cb -0.20 -3.09 -0.02 0.00 0.02 0.00 0.00 34.50 31.21 2vxf s PRO 54 CO -0.03 -0.62 -0.26 0.42 -0.33 0.00 0.00 177.00 176.19 2vxf s ILE 55 N 0.65 2.03 0.33 2.83 -1.09 -1.26 -5.13 121.20 119.55 2vxf s ILE 55 Ca 0.68 -1.17 -0.11 0.00 -2.23 0.00 0.00 60.65 57.81 2vxf s ILE 55 Cb -0.46 -1.70 -0.07 0.00 -1.58 0.00 0.00 42.46 38.64 2vxf s ILE 55 CO 0.38 0.50 0.68 0.00 -1.23 0.00 0.00 174.94 175.27 2vxf s ALA 56 N -0.66 3.42 0.43 9.38 0.00 -1.26 -4.97 121.76 128.10 2vxf s ALA 56 Ca 0.10 -0.19 -0.24 0.00 0.00 0.00 0.00 51.96 51.63 2vxf s ALA 56 Cb -0.10 -2.61 -0.08 0.00 0.00 0.00 0.00 23.12 20.33 2vxf s ALA 56 CO -0.00 0.24 1.20 -1.25 0.00 0.00 0.00 175.76 175.95 2vxf s PRO 57 N -3.32 3.90 -0.04 0.00 0.04 -1.26 -5.02 135.00 129.30 2vxf s PRO 57 Ca 0.50 1.89 0.02 0.00 0.04 0.00 0.00 61.00 63.45 2vxf s PRO 57 Cb -0.10 -2.58 0.01 0.00 0.04 0.00 0.00 34.50 31.86 2vxf s PRO 57 CO 0.25 -0.46 -0.08 1.03 0.04 0.00 0.00 177.00 177.77 2vxf s ARG 58 N -2.45 1.05 -0.35 4.56 0.52 -1.26 -5.03 118.95 116.00 2vxf s ARG 58 Ca 0.60 -0.27 0.07 0.00 -0.52 0.00 0.00 55.73 55.60 2vxf s ARG 58 Cb -0.32 -0.96 0.52 0.00 0.52 0.00 0.00 34.95 34.72 2vxf s ARG 58 CO 0.39 0.05 1.55 -0.25 0.02 0.00 0.00 175.30 177.07 2vxf n ASP 59 N 3.55 3.24 -4.62 0.23 10.43 -1.26 -4.98 116.55 123.14 2vxf n ASP 59 Ca -0.21 -3.77 -0.27 0.00 2.57 0.00 0.00 54.79 53.12 2vxf n ASP 59 Cb 0.53 -0.67 -0.08 0.00 1.84 0.00 0.00 41.12 42.74 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 -3.34 2.23 0.03 -1.24 2.12 -1.26 -5.13 118.70 112.12 2vxf s GLU 60 Ca 0.49 -1.19 0.00 0.00 0.36 0.00 0.00 54.97 54.63 2vxf s GLU 60 Cb 0.43 -2.26 -0.04 0.00 0.26 0.00 0.00 34.13 32.52 2vxf s GLU 60 CO 0.01 0.44 0.13 0.99 -0.54 0.00 0.00 175.26 176.29 2vxf s THR 61 N -1.73 4.94 -0.21 -1.70 2.01 -1.26 -4.82 115.64 112.87 2vxf s THR 61 Ca 0.26 -0.47 -0.09 0.00 0.31 0.00 0.00 61.69 61.71 2vxf s THR 61 Cb -0.09 -3.34 -0.04 0.00 0.01 0.00 0.00 72.50 69.04 2vxf s THR 61 CO 0.17 0.23 0.11 -0.36 -0.69 0.00 0.00 174.62 174.08 2vxf s PHE 62 N -1.34 3.29 0.09 4.92 0.40 -0.88 -5.00 117.98 119.45 2vxf s PHE 62 Ca 0.28 0.13 -0.17 0.00 -0.60 0.00 0.00 56.93 56.57 2vxf s PHE 62 Cb -0.12 -2.17 -0.09 0.00 0.51 0.00 0.00 43.02 41.15 2vxf s PHE 62 CO 0.20 0.10 1.44 1.49 0.70 0.00 0.00 175.22 179.16 2vxf h GLU 63 N 7.10 0.57 -2.75 0.44 4.81 -1.94 -2.72 114.58 120.09 2vxf h GLU 63 Ca -0.38 -0.26 -0.17 0.00 -0.13 0.00 0.00 59.36 58.42 2vxf h GLU 63 Cb 1.17 -0.01 -0.30 0.00 0.63 0.00 0.00 28.75 30.23 2vxf h GLU 63 CO 0.69 0.83 -0.45 -0.47 -0.73 0.00 0.00 179.01 178.87 2vxf s TYR 64 N -4.55 -0.54 0.05 0.92 6.14 -1.26 -2.21 117.35 115.89 2vxf s TYR 64 Ca -0.13 1.15 0.04 0.00 0.64 0.00 0.00 57.07 58.77 2vxf s TYR 64 Cb 0.08 0.10 -0.02 0.00 0.42 0.00 0.00 41.96 42.54 2vxf s TYR 64 CO 0.79 -0.38 -0.13 0.42 0.64 0.00 0.00 175.55 176.89 2vxf s ILE 65 N 2.26 1.00 -0.08 3.14 1.01 -0.95 -5.03 121.20 122.56 2vxf s ILE 65 Ca -0.02 -1.08 0.01 0.00 0.00 0.00 0.00 60.65 59.56 2vxf s ILE 65 Cb -0.11 -0.94 -0.03 0.00 0.01 0.00 0.00 42.46 41.38 2vxf s ILE 65 CO -0.10 -0.13 -0.07 -0.63 0.00 0.00 0.00 174.94 174.01 2vxf s ILE 66 N -1.04 3.66 -0.00 2.92 1.01 -1.26 -2.25 121.20 124.24 2vxf s ILE 66 Ca -0.01 -0.49 0.04 0.00 0.00 0.00 0.00 60.65 60.19 2vxf s ILE 66 Cb -0.09 -2.50 -0.01 0.00 0.01 0.00 0.00 42.46 39.87 2vxf s ILE 66 CO 0.01 0.59 -0.14 -0.36 0.00 0.00 0.00 174.94 175.04 2vxf s PHE 67 N -0.65 1.21 0.13 3.97 0.08 -0.96 -5.04 117.98 116.73 2vxf s PHE 67 Ca 0.10 -0.25 0.06 0.00 0.12 0.00 0.00 56.93 56.96 2vxf s PHE 67 Cb -0.11 -0.77 -0.04 0.00 -0.57 0.00 0.00 43.02 41.53 2vxf s PHE 67 CO 0.02 -0.01 -0.00 1.03 -0.10 0.00 0.00 175.22 176.15 2vxf s ARG 68 N -0.47 2.46 0.58 0.44 0.52 -1.26 -2.21 118.95 119.01 2vxf s ARG 68 Ca 0.05 -0.97 0.28 0.00 -0.52 0.00 0.00 55.73 54.57 2vxf s ARG 68 Cb -0.06 -2.45 1.61 0.00 0.52 0.00 0.00 34.95 34.58 2vxf s ARG 68 CO -0.00 0.50 2.07 0.78 0.02 0.00 0.00 175.30 178.67 2vxf h GLY 69 N 3.11 0.00 0.83 -3.53 0.00 -1.82 -2.12 103.07 99.53 2vxf h GLY 69 Ca -0.48 0.00 -0.04 0.00 0.00 0.00 0.00 47.33 46.81 2vxf h GLY 69 CO 0.58 0.00 -0.03 1.76 0.00 0.00 0.00 176.54 178.85 2vxf h SER 70 N 0.00 0.42 0.76 0.19 0.02 -1.95 -3.26 113.55 109.74 2vxf h SER 70 Ca 0.11 -0.34 -0.25 0.00 -0.84 0.00 0.00 61.79 60.46 2vxf h SER 70 Cb 0.58 -0.11 -0.02 0.00 0.14 0.00 0.00 62.40 62.98 2vxf h SER 70 CO -0.00 0.66 -1.24 -2.24 -1.14 0.00 0.00 176.83 172.87 2vxf h ASP 71 N 0.17 0.14 -3.93 3.07 2.03 -1.83 -3.46 116.42 112.61 2vxf h ASP 71 Ca 0.06 -0.17 -0.53 0.00 -0.73 0.00 0.00 57.03 55.66 2vxf h ASP 71 Cb 0.47 -0.04 0.08 0.00 -0.83 0.00 0.00 39.33 39.00 2vxf h ASP 71 CO 0.02 1.14 0.64 -0.63 -1.03 0.00 0.00 179.24 179.37 2vxf s ILE 72 N -2.67 2.58 -0.24 4.15 1.01 -0.85 -1.87 121.20 123.30 2vxf s ILE 72 Ca -0.02 0.54 -0.03 0.00 0.00 0.00 0.00 60.65 61.14 2vxf s ILE 72 Cb 0.09 -3.33 -0.14 0.00 0.01 0.00 0.00 42.46 39.09 2vxf s ILE 72 CO 0.84 0.10 -0.25 1.17 0.00 0.00 0.00 174.94 176.80 2vxf n LYS 73 N 0.35 0.58 -3.83 2.79 4.81 -0.17 -4.82 118.16 117.86 2vxf n LYS 73 Ca 0.02 0.17 -0.12 0.00 -0.87 0.00 0.00 58.31 57.52 2vxf n LYS 73 Cb 0.43 -1.45 -0.10 0.00 0.02 0.00 0.00 35.03 33.92 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 -6.64 -0.08 -0.06 3.14 2.15 -1.12 -5.03 116.67 109.02 2vxf s ASP 74 Ca -0.33 0.02 0.02 0.00 0.43 0.00 0.00 52.55 52.69 2vxf s ASP 74 Cb 0.10 0.29 0.01 0.00 -0.30 0.00 0.00 42.92 43.03 2vxf s ASP 74 CO 0.51 -0.31 -0.11 -0.22 -0.17 0.00 0.00 175.17 174.88 2vxf s LEU 75 N -0.97 1.60 0.03 -1.34 0.20 -1.26 -1.75 118.68 115.19 2vxf s LEU 75 Ca -0.11 -0.28 0.04 0.00 0.69 0.00 0.00 54.13 54.48 2vxf s LEU 75 Cb -0.05 -0.78 -0.02 0.00 -0.43 0.00 0.00 46.19 44.91 2vxf s LEU 75 CO 0.02 0.02 -0.12 -0.89 -0.29 0.00 0.00 176.35 175.09 2vxf s THR 76 N 0.71 0.95 0.02 3.68 2.01 -0.94 -5.05 115.64 117.03 2vxf s THR 76 Ca -0.14 -0.88 -0.08 0.00 0.31 0.00 0.00 61.69 60.89 2vxf s THR 76 Cb -0.16 -0.87 -0.05 0.00 0.01 0.00 0.00 72.50 71.44 2vxf s THR 76 CO 0.03 -0.01 0.32 -0.69 -0.69 0.00 0.00 174.62 173.58 2vxf s VAL 77 N -0.79 5.22 -0.14 3.82 1.01 -1.26 -1.92 120.40 126.34 2vxf s VAL 77 Ca 0.00 0.32 0.04 0.00 0.00 0.00 0.00 61.98 62.34 2vxf s VAL 77 Cb -0.07 -3.60 -0.23 0.00 0.00 0.00 0.00 36.38 32.48 2vxf s VAL 77 CO 0.01 0.37 0.29 0.00 0.00 0.00 0.00 175.10 175.77 2vxf s GLU 79 N -2.55 3.96 0.52 0.00 -1.05 -1.26 -5.03 118.70 113.29 2vxf s GLU 79 Ca -0.18 0.72 -0.21 0.00 -0.15 0.00 0.00 54.97 55.15 2vxf s GLU 79 Cb 0.07 -2.34 -0.06 0.00 -0.44 0.00 0.00 34.13 31.37 2vxf s GLU 79 CO 0.76 0.01 1.17 -1.25 0.95 0.00 0.00 175.26 176.90 2vxf s PRO 80 N -3.43 3.43 0.67 -4.83 0.04 -1.26 -5.00 135.00 124.61 2vxf s PRO 80 Ca 0.55 1.74 -0.14 0.00 0.04 0.00 0.00 61.00 63.19 2vxf s PRO 80 Cb -0.10 -2.15 0.00 0.00 0.04 0.00 0.00 34.50 32.30 2vxf s PRO 80 CO 0.23 -0.82 1.09 -1.25 0.04 0.00 0.00 177.00 176.29 2vxf s PRO 81 N -3.06 2.82 0.27 0.56 0.04 -1.26 -5.05 135.00 129.32 2vxf s PRO 81 Ca 0.70 1.24 -0.01 0.00 0.04 0.00 0.00 61.00 62.98 2vxf s PRO 81 Cb -0.27 -1.96 -0.04 0.00 0.04 0.00 0.00 34.50 32.26 2vxf s PRO 81 CO 0.32 -1.21 0.47 0.15 0.04 0.00 0.00 177.00 176.77 2vxf s LYS 82 N -4.38 3.52 0.29 4.56 1.02 -1.26 -5.05 119.74 118.43 2vxf s LYS 82 Ca 0.64 -0.31 -0.29 0.00 0.02 0.00 0.00 55.97 56.02 2vxf s LYS 82 Cb -0.18 -2.75 -0.10 0.00 -0.52 0.00 0.00 37.83 34.28 2vxf s LYS 82 CO 0.45 0.29 1.35 -1.25 -0.92 0.00 0.00 175.35 175.27 2vxf s PRO 83 N -3.74 4.33 -0.05 -1.68 0.04 -1.26 -4.94 135.00 127.70 2vxf s PRO 83 Ca 0.40 2.22 0.07 0.00 0.04 0.00 0.00 61.00 63.72 2vxf s PRO 83 Cb -0.10 -3.10 -0.10 0.00 0.04 0.00 0.00 34.50 31.24 2vxf s PRO 83 CO 0.31 -0.27 0.06 0.44 0.04 0.00 0.00 177.00 177.59 2vxf n ILE 84 N 1.53 0.35 0.60 0.56 -5.35 -1.26 -4.88 119.36 110.91 2vxf n ILE 84 Ca 0.03 -0.27 0.07 0.00 -0.27 0.00 0.00 62.75 62.32 2vxf n ILE 84 Cb 0.41 -0.50 0.06 0.00 -1.74 0.00 0.00 39.64 37.88 2vxf n ILE 84 CO 0.00 0.00 0.00 0.23 -1.76 0.00 0.00 176.55 175.02