#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 2.08 0.26 3.23 2.02 -1.26 -5.13 118.70 119.90 2vxf s GLU -1 Ca 0.00 -1.86 -0.11 0.00 0.02 0.00 0.00 54.97 53.02 2vxf s GLU -1 Cb 0.00 -1.87 -0.08 0.00 0.10 0.00 0.00 34.13 32.28 2vxf s GLU -1 CO 0.00 0.03 0.60 -0.51 0.02 0.00 0.00 175.26 175.40 2vxf s ASP 0 N -3.76 6.66 0.40 -0.19 -0.00 -1.26 -4.98 116.67 113.54 2vxf s ASP 0 Ca 0.36 1.01 0.08 0.00 -0.00 0.00 0.00 52.55 54.01 2vxf s ASP 0 Cb 0.03 -2.26 0.84 0.00 -0.00 0.00 0.00 42.92 41.52 2vxf s ASP 0 CO 0.20 -0.11 2.00 -0.65 -0.00 0.00 0.00 175.17 176.61 2vxf h PRO 1 N 2.45 0.41 -0.32 8.23 0.11 -2.00 -2.35 132.00 138.53 2vxf h PRO 1 Ca -0.47 -0.05 -0.11 0.00 0.11 0.00 0.00 66.00 65.48 2vxf h PRO 1 Cb 1.17 -0.08 -0.01 0.00 0.11 0.00 0.00 31.00 32.19 2vxf h PRO 1 CO 0.68 0.36 -0.25 0.66 -0.21 0.00 0.00 178.00 179.24 2vxf h SER 2 N 0.41 0.65 0.10 -2.05 4.64 -1.93 -1.97 113.55 113.40 2vxf h SER 2 Ca 0.10 -0.23 -0.20 0.00 -0.47 0.00 0.00 61.79 60.99 2vxf h SER 2 Cb 0.12 -0.18 0.00 0.00 -0.31 0.00 0.00 62.40 62.03 2vxf h SER 2 CO -0.01 0.88 -0.74 1.23 -0.87 0.00 0.00 176.83 177.32 2vxf h GLY 3 N 1.00 0.62 1.62 -0.77 0.00 -1.79 -3.19 103.07 100.56 2vxf h GLY 3 Ca 0.08 -0.87 -0.12 0.00 0.00 0.00 0.00 47.33 46.42 2vxf h GLY 3 CO 0.06 0.77 -0.39 -1.33 0.00 0.00 0.00 176.54 175.65 2vxf h GLY 4 N 1.00 0.46 -3.00 4.60 0.00 -1.26 -3.44 103.07 101.44 2vxf h GLY 4 Ca -0.04 -0.44 -0.50 0.00 0.00 0.00 0.00 47.33 46.35 2vxf h GLY 4 CO 0.14 0.40 0.48 -1.59 0.00 0.00 0.00 176.54 175.96 2vxf s THR 5 N -4.23 3.27 0.59 4.70 2.01 -0.76 -4.99 115.64 116.23 2vxf s THR 5 Ca -0.06 1.03 -0.19 0.00 0.31 0.00 0.00 61.69 62.77 2vxf s THR 5 Cb 0.13 -3.56 -0.04 0.00 0.01 0.00 0.00 72.50 69.04 2vxf s THR 5 CO 0.80 0.06 1.25 -2.84 -0.69 0.00 0.00 174.62 173.20 2vxf s PRO 6 N -2.39 2.98 0.45 4.92 0.02 -1.26 -4.91 135.00 134.81 2vxf s PRO 6 Ca 0.58 1.94 0.14 0.00 0.02 0.00 0.00 61.00 63.68 2vxf s PRO 6 Cb -0.28 -2.00 1.02 0.00 0.02 0.00 0.00 34.50 33.25 2vxf s PRO 6 CO 0.36 -1.23 2.02 1.88 -0.33 0.00 0.00 177.00 179.69 2vxf h TYR 7 N 1.01 0.05 -3.47 6.54 0.05 -1.94 -3.43 116.97 115.78 2vxf h TYR 7 Ca -0.51 -0.00 -0.53 0.00 0.05 0.00 0.00 58.73 57.74 2vxf h TYR 7 Cb 1.30 -0.02 0.07 0.00 1.01 0.00 0.00 36.73 39.09 2vxf h TYR 7 CO 0.46 0.17 0.77 0.42 -1.05 0.00 0.00 178.16 178.93 2vxf s ILE 8 N -4.77 2.52 0.00 -2.88 1.01 -1.26 -2.08 121.20 113.73 2vxf s ILE 8 Ca -0.05 0.45 0.00 0.00 0.00 0.00 0.00 60.65 61.05 2vxf s ILE 8 Cb 0.16 -3.29 0.00 0.00 0.01 0.00 0.00 42.46 39.34 2vxf s ILE 8 CO 0.70 0.08 0.00 0.61 0.00 0.00 0.00 174.94 176.33 2vxf n GLY 9 N 1.91 0.54 3.93 6.18 0.00 -0.75 -5.03 105.19 111.98 2vxf n GLY 9 Ca 0.06 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.83 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 6.30 -0.07 1.61 0.01 -0.89 -4.85 113.70 112.98 2vxf s SER 10 Ca 0.00 0.54 -0.17 0.00 1.31 0.00 0.00 55.95 57.63 2vxf s SER 10 Cb 0.00 -2.07 -0.05 0.00 0.21 0.00 0.00 66.02 64.11 2vxf s SER 10 CO 0.00 -0.33 0.46 -0.75 0.41 0.00 0.00 173.24 173.04 2vxf s LYS 11 N -4.30 4.21 0.05 12.44 2.20 -1.26 -1.70 119.74 131.37 2vxf s LYS 11 Ca 0.41 0.46 0.04 0.00 -0.36 0.00 0.00 55.97 56.52 2vxf s LYS 11 Cb -0.10 -3.36 -0.02 0.00 -1.51 0.00 0.00 37.83 32.84 2vxf s LYS 11 CO 0.37 0.36 -0.12 0.42 -0.36 0.00 0.00 175.35 176.02 2vxf s ILE 12 N -0.02 0.89 -0.11 5.43 1.01 -0.82 -2.20 121.20 125.37 2vxf s ILE 12 Ca 0.25 -1.05 0.01 0.00 0.00 0.00 0.00 60.65 59.87 2vxf s ILE 12 Cb -0.16 -0.86 -0.01 0.00 0.01 0.00 0.00 42.46 41.44 2vxf s ILE 12 CO 0.12 -0.16 -0.15 -0.55 0.00 0.00 0.00 174.94 174.19 2vxf s SER 13 N -1.35 3.86 -0.05 3.58 0.15 -0.78 -2.62 113.70 116.49 2vxf s SER 13 Ca -0.03 -0.35 0.05 0.00 0.70 0.00 0.00 55.95 56.33 2vxf s SER 13 Cb -0.09 -1.46 -0.01 0.00 -1.71 0.00 0.00 66.02 62.76 2vxf s SER 13 CO 0.01 0.19 -0.21 -0.22 1.20 0.00 0.00 173.24 174.21 2vxf s LEU 14 N 0.19 2.00 -0.23 3.45 2.96 -0.47 -2.17 118.68 124.41 2vxf s LEU 14 Ca -0.09 -0.42 -0.06 0.00 -0.22 0.00 0.00 54.13 53.34 2vxf s LEU 14 Cb -0.15 -1.16 -0.02 0.00 0.50 0.00 0.00 46.19 45.36 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 -0.12 3.88 0.62 6.68 1.01 -0.71 -1.86 121.20 130.69 2vxf s ILE 15 Ca -0.02 -0.32 -0.01 0.00 0.00 0.00 0.00 60.65 60.30 2vxf s ILE 15 Cb -0.12 -2.79 0.06 0.00 0.01 0.00 0.00 42.46 39.62 2vxf s ILE 15 CO 0.02 0.38 0.87 -0.44 0.00 0.00 0.00 174.94 175.77 2vxf s SER 16 N 1.49 4.99 0.60 3.58 0.01 -1.06 -1.25 113.70 122.06 2vxf s SER 16 Ca 0.06 -0.00 0.40 0.00 1.31 0.00 0.00 55.95 57.71 2vxf s SER 16 Cb -0.15 -0.73 2.17 0.00 0.21 0.00 0.00 66.02 67.52 2vxf s SER 16 CO 0.01 -1.38 2.22 0.07 0.41 0.00 0.00 173.24 174.56 2vxf h LYS 17 N -0.18 0.00 -0.67 12.44 2.10 -1.46 -1.45 116.57 127.34 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 0.51 0.00 0.00 0.00 -2.00 0.00 0.00 179.45 177.96 2vxf n ALA 18 N -2.01 3.04 -2.31 0.07 0.00 -1.26 -4.89 120.51 113.15 2vxf n ALA 18 Ca -0.03 -0.97 -0.19 0.00 0.00 0.00 0.00 53.44 52.26 2vxf n ALA 18 Cb 0.08 -1.04 -0.02 0.00 0.00 0.00 0.00 19.45 18.47 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 0.45 -1.77 -4.08 0.00 1.02 -0.55 -4.91 120.64 110.80 2vxf n GLU 19 Ca 0.15 0.94 -0.31 0.00 -0.02 0.00 0.00 57.16 57.92 2vxf n GLU 19 Cb 0.66 -5.56 -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 -2.91 4.59 -0.27 -3.67 1.01 -1.26 -4.56 121.20 114.14 2vxf s ILE 20 Ca 0.00 -0.62 -0.08 0.00 0.00 0.00 0.00 60.65 59.95 2vxf s ILE 20 Cb 0.00 -3.16 -0.03 0.00 0.01 0.00 0.00 42.46 39.28 2vxf s ILE 20 CO 0.00 0.22 0.10 -0.60 0.00 0.00 0.00 174.94 174.66 2vxf s ARG 21 N -2.10 3.60 -0.09 2.79 3.52 -1.26 -2.58 118.95 122.84 2vxf s ARG 21 Ca 0.26 -0.52 0.01 0.00 -0.13 0.00 0.00 55.73 55.35 2vxf s ARG 21 Cb -0.12 -3.40 -0.03 0.00 -1.56 0.00 0.00 34.95 29.84 2vxf s ARG 21 CO 0.18 -0.24 -0.09 0.71 -0.81 0.00 0.00 175.30 175.05 2vxf s TYR 22 N 1.62 2.87 -0.01 5.12 2.02 -0.78 -2.40 117.35 125.80 2vxf s TYR 22 Ca 0.06 -0.20 0.07 0.00 -0.37 0.00 0.00 57.07 56.63 2vxf s TYR 22 Cb -0.16 -1.76 -0.02 0.00 -0.40 0.00 0.00 41.96 39.63 2vxf s TYR 22 CO 0.05 0.14 -0.22 -2.00 -1.57 0.00 0.00 175.55 171.94 2vxf s GLU 23 N -0.38 1.78 0.20 -0.62 2.12 -0.93 -1.37 118.70 119.50 2vxf s GLU 23 Ca 0.05 -0.82 -0.18 0.00 0.36 0.00 0.00 54.97 54.37 2vxf s GLU 23 Cb -0.12 -1.75 0.07 0.00 0.26 0.00 0.00 34.13 32.59 2vxf s GLU 23 CO 0.02 0.48 0.89 0.41 -0.54 0.00 0.00 175.26 176.52 2vxf n GLY 24 N 2.44 0.74 3.68 -1.50 0.00 -1.08 -1.58 105.19 107.90 2vxf n GLY 24 Ca -0.16 -1.15 -0.35 0.00 0.00 0.00 0.00 46.02 44.37 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 4.25 -0.28 -0.61 -1.09 -1.12 -1.95 121.20 118.28 2vxf s ILE 25 Ca 0.19 -0.31 -0.28 0.00 -2.23 0.00 0.00 60.65 58.03 2vxf s ILE 25 Cb -0.03 -2.80 -0.03 0.00 -1.58 0.00 0.00 42.46 38.02 2vxf s ILE 25 CO 0.06 0.58 1.99 -0.22 -1.23 0.00 0.00 174.94 176.12 2vxf s LEU 26 N -0.96 3.47 -0.22 2.97 2.96 -0.69 -2.79 118.68 123.43 2vxf s LEU 26 Ca 0.14 1.57 -0.18 0.00 -0.22 0.00 0.00 54.13 55.45 2vxf s LEU 26 Cb -0.11 -3.52 -0.14 0.00 0.50 0.00 0.00 46.19 42.92 2vxf s LEU 26 CO 0.03 -1.82 -0.04 0.00 -1.32 0.00 0.00 176.35 173.20 2vxf n TYR 27 N 10.92 0.66 -3.86 5.38 9.36 -1.07 -1.80 117.16 136.75 2vxf n TYR 27 Ca 0.26 0.28 -0.12 0.00 3.32 0.00 0.00 57.90 61.65 2vxf n TYR 27 Cb 0.46 -0.99 -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 -2.42 0.03 -0.15 2.97 -4.23 -1.12 -4.84 115.64 105.88 2vxf s THR 28 Ca -0.30 -0.25 0.01 0.00 -1.18 0.00 0.00 61.69 59.97 2vxf s THR 28 Cb 0.08 -0.24 -0.00 0.00 1.34 0.00 0.00 72.50 73.68 2vxf s THR 28 CO 0.50 -0.14 -0.16 -0.63 -0.54 0.00 0.00 174.62 173.65 2vxf s ILE 29 N -0.43 2.58 -0.46 2.99 1.01 -1.26 -2.16 121.20 123.47 2vxf s ILE 29 Ca -0.05 -0.80 -0.04 0.00 0.00 0.00 0.00 60.65 59.76 2vxf s ILE 29 Cb -0.03 -2.08 0.12 0.00 0.01 0.00 0.00 42.46 40.48 2vxf s ILE 29 CO 0.00 0.52 0.27 -0.62 0.00 0.00 0.00 174.94 175.12 2vxf s ASP 30 N 0.79 5.33 0.19 3.58 2.15 -0.82 -4.95 116.67 122.94 2vxf s ASP 30 Ca -0.06 -2.17 -0.03 0.00 0.43 0.00 0.00 52.55 50.72 2vxf s ASP 30 Cb -0.15 -1.86 0.12 0.00 -0.30 0.00 0.00 42.92 40.72 2vxf s ASP 30 CO 0.00 -0.53 1.50 0.74 -0.17 0.00 0.00 175.17 176.71 2vxf h THR 31 N 6.12 1.33 -0.11 1.71 2.02 -1.98 -2.42 112.91 119.58 2vxf h THR 31 Ca -0.12 -1.81 0.03 0.00 0.77 0.00 0.00 66.41 65.28 2vxf h THR 31 Cb 1.03 1.79 -0.00 0.00 -1.74 0.00 0.00 68.15 69.23 2vxf h THR 31 CO 0.72 0.56 0.08 -0.33 0.37 0.00 0.00 175.52 176.93 2vxf h GLU 32 N 0.41 0.00 -0.12 6.66 5.08 -1.94 -2.06 114.58 122.61 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 1.10 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.35 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 -4.49 2.60 -3.91 1.42 4.13 -1.23 -4.99 115.26 108.79 2vxf n ASN 33 Ca -0.00 -2.43 -0.25 0.00 1.68 0.00 0.00 54.58 53.57 2vxf n ASN 33 Cb 0.20 -0.25 -0.01 0.00 -1.54 0.00 0.00 39.78 38.19 2vxf n ASN 33 CO 0.00 0.00 0.00 -0.24 0.28 0.00 0.00 177.26 177.30 2vxf n SER 34 N -0.50 -0.99 -4.15 6.41 2.88 -0.77 -4.88 113.62 111.62 2vxf n SER 34 Ca 0.10 -0.95 -0.18 0.00 -1.33 0.00 0.00 58.87 56.52 2vxf n SER 34 Cb 0.49 -3.33 -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 -3.80 1.03 -0.01 2.46 -4.23 -0.92 -2.39 115.64 107.78 2vxf s THR 35 Ca 0.09 -1.24 0.03 0.00 -1.18 0.00 0.00 61.69 59.40 2vxf s THR 35 Cb -0.05 -1.00 -0.01 0.00 1.34 0.00 0.00 72.50 72.79 2vxf s THR 35 CO 0.87 -0.23 -0.11 -0.69 -0.54 0.00 0.00 174.62 173.92 2vxf s VAL 36 N -1.24 0.87 -0.15 2.29 1.01 -0.91 -1.95 120.40 120.31 2vxf s VAL 36 Ca -0.03 -0.47 -0.01 0.00 0.00 0.00 0.00 61.98 61.47 2vxf s VAL 36 Cb -0.10 -0.73 -0.02 0.00 0.00 0.00 0.00 36.38 35.53 2vxf s VAL 36 CO 0.02 0.25 -0.10 0.00 0.00 0.00 0.00 175.10 175.27 2vxf s ALA 37 N -0.23 2.73 -0.05 5.51 0.00 -0.92 -2.22 121.76 126.58 2vxf s ALA 37 Ca 0.04 -0.91 0.05 0.00 0.00 0.00 0.00 51.96 51.13 2vxf s ALA 37 Cb -0.05 -1.36 -0.02 0.00 0.00 0.00 0.00 23.12 21.70 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 0.52 2.42 0.32 0.00 1.43 -0.98 -2.59 118.68 119.81 2vxf s LEU 38 Ca -0.07 -0.35 0.09 0.00 -1.03 0.00 0.00 54.13 52.78 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 0.04 0.00 0.23 0.00 0.00 176.35 176.95 2vxf s ALA 39 N -0.45 3.26 -0.98 4.21 0.00 -1.12 -2.27 121.76 124.41 2vxf s ALA 39 Ca 0.05 -1.85 -0.11 0.00 0.00 0.00 0.00 51.96 50.05 2vxf s ALA 39 Cb -0.12 -0.55 -0.01 0.00 0.00 0.00 0.00 23.12 22.44 2vxf s ALA 39 CO 0.01 0.11 0.75 1.63 0.00 0.00 0.00 175.76 178.26 2vxf n LYS 40 N -0.98 -1.39 -4.63 0.00 5.02 -0.69 -2.80 118.16 112.69 2vxf n LYS 40 Ca -0.04 0.80 -0.26 0.00 -2.02 0.00 0.00 58.31 56.78 2vxf n LYS 40 Cb 0.61 -4.33 -0.14 0.00 -0.02 0.00 0.00 35.03 31.15 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 -3.26 1.75 0.08 -0.18 0.11 -0.96 -4.18 120.40 113.77 2vxf s VAL 41 Ca 0.27 -1.28 0.06 0.00 -2.93 0.00 0.00 61.98 58.11 2vxf s VAL 41 Cb -0.09 -1.53 -0.03 0.00 -1.53 0.00 0.00 36.38 33.20 2vxf s VAL 41 CO 0.83 0.20 -0.17 -0.60 -3.33 0.00 0.00 175.10 172.02 2vxf s ARG 42 N -1.29 0.99 -0.23 1.54 3.52 -0.61 -2.36 118.95 120.50 2vxf s ARG 42 Ca 0.08 -1.02 -0.11 0.00 -0.13 0.00 0.00 55.73 54.55 2vxf s ARG 42 Cb -0.09 -1.11 -0.05 0.00 -1.56 0.00 0.00 34.95 32.14 2vxf s ARG 42 CO 0.02 0.26 0.19 -1.54 -0.81 0.00 0.00 175.30 173.42 2vxf s SER 43 N -1.72 6.16 0.13 -2.12 1.04 -1.26 -2.20 113.70 113.72 2vxf s SER 43 Ca 0.02 0.16 -0.12 0.00 0.48 0.00 0.00 55.95 56.50 2vxf s SER 43 Cb -0.10 -2.12 -0.06 0.00 0.10 0.00 0.00 66.02 63.84 2vxf s SER 43 CO 0.03 0.05 1.44 -0.26 0.98 0.00 0.00 173.24 175.48 2vxf h PHE 44 N 7.48 1.10 0.00 5.02 0.04 -1.88 -3.48 116.94 125.21 2vxf h PHE 44 Ca -0.38 -0.35 0.00 0.00 2.80 0.00 0.00 57.97 60.04 2vxf h PHE 44 Cb 1.17 -0.22 0.00 0.00 2.20 0.00 0.00 35.95 39.10 2vxf h PHE 44 CO 0.67 1.18 0.00 0.41 -0.60 0.00 0.00 178.31 179.97 2vxf n GLY 45 N 0.23 1.46 0.00 -1.45 0.00 -1.26 -5.03 105.19 99.13 2vxf n GLY 45 Ca -0.03 -0.98 0.01 0.00 0.00 0.00 0.00 46.02 45.02 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 -0.62 0.00 0.23 2.61 -2.24 -1.26 -4.28 114.28 108.73 2vxf n THR 46 Ca 0.00 -0.07 0.07 0.00 -2.27 0.00 0.00 64.05 61.77 2vxf n THR 46 Cb 0.00 0.48 0.55 0.00 -2.10 0.00 0.00 70.33 69.26 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 -0.29 -0.78 4.39 -1.96 -2.22 114.58 113.72 2vxf h GLU 47 Ca 0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 2vxf h GLU 47 Cb 0.09 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.73 2vxf h GLU 47 CO 0.00 0.16 0.19 0.22 -1.16 0.00 0.00 179.01 178.43 2vxf h ASP 48 N 0.00 0.34 -3.68 1.42 1.82 -1.95 -3.32 116.42 111.04 2vxf h ASP 48 Ca -0.00 -0.01 -0.63 0.00 -0.39 0.00 0.00 57.03 56.00 2vxf h ASP 48 Cb 0.30 -0.08 -0.40 0.00 0.68 0.00 0.00 39.33 39.82 2vxf h ASP 48 CO 0.02 0.24 -0.71 -0.13 -1.61 0.00 0.00 179.24 177.05 2vxf s ARG 49 N -5.37 1.38 0.25 0.28 0.52 -0.83 -5.10 118.95 110.07 2vxf s ARG 49 Ca -0.07 -1.91 -0.31 0.00 -0.52 0.00 0.00 55.73 52.91 2vxf s ARG 49 Cb 0.17 -2.73 -0.12 0.00 0.52 0.00 0.00 34.95 32.79 2vxf s ARG 49 CO 0.71 -1.05 1.65 -0.35 0.02 0.00 0.00 175.30 176.28 2vxf n PRO 50 N 3.93 2.70 -4.37 3.54 -0.04 -1.25 -4.90 135.00 134.61 2vxf n PRO 50 Ca 0.04 0.97 -0.19 0.00 -0.04 0.00 0.00 63.50 64.28 2vxf n PRO 50 Cb 0.38 -2.78 -0.10 0.00 -0.04 0.00 0.00 33.50 30.96 2vxf n PRO 50 CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 2vxf s THR 51 N 0.55 1.28 -1.82 0.52 -4.23 -1.26 -5.03 115.64 105.66 2vxf s THR 51 Ca 0.70 -2.07 0.28 0.00 -1.18 0.00 0.00 61.69 59.42 2vxf s THR 51 Cb -0.51 -2.38 0.70 0.00 1.34 0.00 0.00 72.50 71.65 2vxf s THR 51 CO 0.41 -0.32 2.00 0.47 -0.54 0.00 0.00 174.62 176.64 2vxf n ASP 52 N -0.48 0.00 -4.24 3.99 10.43 -1.26 -4.56 116.55 120.42 2vxf n ASP 52 Ca -0.05 -0.63 -0.38 0.00 2.57 0.00 0.00 54.79 56.29 2vxf n ASP 52 Cb 0.64 -0.09 -0.12 0.00 1.84 0.00 0.00 41.12 43.39 2vxf n ASP 52 CO 0.00 0.00 0.00 -0.13 -1.07 0.00 0.00 177.20 176.00 2vxf s ARG 53 N -2.18 2.51 0.32 -1.24 0.52 -1.26 -5.08 118.95 112.53 2vxf s ARG 53 Ca 0.37 -1.37 -0.29 0.00 -0.52 0.00 0.00 55.73 53.93 2vxf s ARG 53 Cb 0.19 -3.56 -0.10 0.00 0.52 0.00 0.00 34.95 32.00 2vxf s ARG 53 CO 0.36 -0.81 1.36 -1.25 0.02 0.00 0.00 175.30 174.97 2vxf s PRO 54 N 1.36 4.31 0.06 3.54 0.04 -1.26 -5.03 135.00 138.02 2vxf s PRO 54 Ca 0.01 2.28 0.09 0.00 0.04 0.00 0.00 61.00 63.41 2vxf s PRO 54 Cb -0.21 -3.07 -0.03 0.00 0.04 0.00 0.00 34.50 31.23 2vxf s PRO 54 CO 0.01 -0.28 -0.24 0.42 0.04 0.00 0.00 177.00 176.95 2vxf s ILE 55 N -0.86 1.92 0.34 0.56 -1.09 -1.26 -5.14 121.20 115.68 2vxf s ILE 55 Ca 0.52 -1.38 -0.02 0.00 -2.23 0.00 0.00 60.65 57.53 2vxf s ILE 55 Cb -0.41 -1.67 -0.04 0.00 -1.58 0.00 0.00 42.46 38.76 2vxf s ILE 55 CO 0.52 0.22 0.58 0.00 -1.23 0.00 0.00 174.94 175.03 2vxf s ALA 56 N -0.88 3.63 0.88 9.38 0.00 -1.26 -5.06 121.76 128.45 2vxf s ALA 56 Ca 0.10 -0.72 -0.11 0.00 0.00 0.00 0.00 51.96 51.23 2vxf s ALA 56 Cb -0.10 -2.25 0.12 0.00 0.00 0.00 0.00 23.12 20.90 2vxf s ALA 56 CO 0.03 0.03 1.11 -1.25 0.00 0.00 0.00 175.76 175.68 2vxf s PRO 57 N -4.10 1.32 0.04 0.00 0.04 -1.26 -5.05 135.00 126.00 2vxf s PRO 57 Ca 0.42 1.30 0.05 0.00 0.04 0.00 0.00 61.00 62.82 2vxf s PRO 57 Cb -0.10 -1.78 -0.02 0.00 0.04 0.00 0.00 34.50 32.64 2vxf s PRO 57 CO 0.35 -2.34 -0.16 1.03 0.04 0.00 0.00 177.00 175.93 2vxf s ARG 58 N -4.75 1.04 -0.05 4.56 0.52 -1.26 -5.04 118.95 113.97 2vxf s ARG 58 Ca 0.65 -0.81 0.04 0.00 -0.52 0.00 0.00 55.73 55.08 2vxf s ARG 58 Cb -0.21 -1.08 -0.06 0.00 0.52 0.00 0.00 34.95 34.13 2vxf s ARG 58 CO 0.58 0.27 0.00 -3.47 0.02 0.00 0.00 175.30 172.70 2vxf n ASP 59 N 1.86 3.72 -4.99 0.23 2.03 -1.26 -5.05 116.55 113.09 2vxf n ASP 59 Ca -0.18 -0.01 -0.19 0.00 0.52 0.00 0.00 54.79 54.93 2vxf n ASP 59 Cb 0.54 0.49 0.00 0.00 -0.72 0.00 0.00 41.12 41.43 2vxf n ASP 59 CO 0.00 0.00 0.00 -0.70 -1.92 0.00 0.00 177.20 174.58 2vxf s GLU 60 N -2.12 3.02 0.41 -0.67 2.12 -1.26 -5.12 118.70 115.08 2vxf s GLU 60 Ca -0.04 -0.99 0.08 0.00 0.36 0.00 0.00 54.97 54.38 2vxf s GLU 60 Cb 0.02 -2.76 -0.01 0.00 0.26 0.00 0.00 34.13 31.64 2vxf s GLU 60 CO 0.19 -0.08 0.47 0.99 -0.54 0.00 0.00 175.26 176.29 2vxf s THR 61 N -2.28 2.99 -0.23 -1.70 2.01 -1.26 -5.01 115.64 110.16 2vxf s THR 61 Ca 0.48 -1.15 -0.09 0.00 0.31 0.00 0.00 61.69 61.24 2vxf s THR 61 Cb -0.10 -3.04 -0.04 0.00 0.01 0.00 0.00 72.50 69.33 2vxf s THR 61 CO 0.33 -0.02 0.12 -0.36 -0.69 0.00 0.00 174.62 173.99 2vxf s PHE 62 N -2.38 3.26 0.07 4.92 0.08 -1.00 -4.99 117.98 117.94 2vxf s PHE 62 Ca 0.51 0.09 -0.18 0.00 0.12 0.00 0.00 56.93 57.47 2vxf s PHE 62 Cb -0.07 -2.22 -0.11 0.00 -0.57 0.00 0.00 43.02 40.05 2vxf s PHE 62 CO 0.31 0.02 1.40 1.49 -0.10 0.00 0.00 175.22 178.33 2vxf h GLU 63 N 7.42 0.51 -2.75 0.44 4.81 -1.94 -2.55 114.58 120.53 2vxf h GLU 63 Ca -0.38 -0.26 -0.17 0.00 -0.13 0.00 0.00 59.36 58.43 2vxf h GLU 63 Cb 1.17 0.00 -0.30 0.00 0.63 0.00 0.00 28.75 30.25 2vxf h GLU 63 CO 0.65 0.83 -0.46 -0.47 -0.73 0.00 0.00 179.01 178.84 2vxf s TYR 64 N -4.41 -0.54 0.05 0.92 6.14 -1.26 -1.70 117.35 116.55 2vxf s TYR 64 Ca -0.13 1.15 0.05 0.00 0.64 0.00 0.00 57.07 58.78 2vxf s TYR 64 Cb 0.07 0.10 -0.02 0.00 0.42 0.00 0.00 41.96 42.53 2vxf s TYR 64 CO 0.78 -0.38 -0.14 0.42 0.64 0.00 0.00 175.55 176.88 2vxf s ILE 65 N 2.26 1.07 -0.09 3.14 1.01 -0.96 -5.03 121.20 122.61 2vxf s ILE 65 Ca -0.02 -1.13 0.00 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 -0.10 -0.12 -0.08 -0.63 0.00 0.00 0.00 174.94 174.01 2vxf s ILE 66 N -1.06 3.56 0.03 2.92 1.01 -1.26 -2.31 121.20 124.09 2vxf s ILE 66 Ca -0.01 -0.52 0.06 0.00 0.00 0.00 0.00 60.65 60.19 2vxf s ILE 66 Cb -0.09 -2.47 -0.02 0.00 0.01 0.00 0.00 42.46 39.89 2vxf s ILE 66 CO 0.02 0.57 -0.17 -0.36 0.00 0.00 0.00 174.94 175.00 2vxf s PHE 67 N -0.44 1.47 0.12 3.97 0.08 -0.94 -5.04 117.98 117.19 2vxf s PHE 67 Ca 0.06 -0.34 0.05 0.00 0.12 0.00 0.00 56.93 56.83 2vxf s PHE 67 Cb -0.12 -0.89 -0.04 0.00 -0.57 0.00 0.00 43.02 41.40 2vxf s PHE 67 CO 0.02 0.04 0.03 1.03 -0.10 0.00 0.00 175.22 176.24 2vxf s ARG 68 N -0.97 2.60 0.58 0.44 0.52 -1.26 -2.15 118.95 118.71 2vxf s ARG 68 Ca 0.05 -0.89 0.28 0.00 -0.52 0.00 0.00 55.73 54.64 2vxf s ARG 68 Cb -0.08 -2.53 1.64 0.00 0.52 0.00 0.00 34.95 34.51 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 3.08 0.00 0.87 -3.53 0.00 -1.81 -2.20 103.07 99.49 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 0.01 1.76 0.00 0.00 0.00 176.54 178.91 2vxf h SER 70 N 0.00 0.49 0.79 0.19 0.02 -1.94 -3.23 113.55 109.87 2vxf h SER 70 Ca 0.08 -0.30 -0.25 0.00 -0.84 0.00 0.00 61.79 60.49 2vxf h SER 70 Cb 0.46 -0.13 -0.02 0.00 0.14 0.00 0.00 62.40 62.84 2vxf h SER 70 CO -0.00 0.67 -1.21 -2.24 -1.14 0.00 0.00 176.83 172.91 2vxf h ASP 71 N 0.29 0.12 -3.90 3.07 3.04 -1.83 -3.46 116.42 113.75 2vxf h ASP 71 Ca 0.08 -0.15 -0.52 0.00 -3.24 0.00 0.00 57.03 53.20 2vxf h ASP 71 Cb 0.42 -0.04 0.07 0.00 -1.04 0.00 0.00 39.33 38.74 2vxf h ASP 71 CO 0.01 1.12 0.64 -0.63 -2.04 0.00 0.00 179.24 178.35 2vxf s ILE 72 N -2.67 2.64 -0.16 4.15 1.01 -0.88 -1.17 121.20 124.12 2vxf s ILE 72 Ca -0.02 0.63 -0.01 0.00 0.00 0.00 0.00 60.65 61.25 2vxf s ILE 72 Cb 0.09 -3.40 -0.09 0.00 0.01 0.00 0.00 42.46 39.07 2vxf s ILE 72 CO 0.84 0.14 -0.15 1.17 0.00 0.00 0.00 174.94 176.93 2vxf n LYS 73 N 0.63 0.38 -3.96 2.79 4.81 -0.38 -4.83 118.16 117.60 2vxf n LYS 73 Ca 0.01 0.10 -0.11 0.00 -0.87 0.00 0.00 58.31 57.44 2vxf n LYS 73 Cb 0.42 -1.26 -0.13 0.00 0.02 0.00 0.00 35.03 34.09 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 -5.72 0.24 -0.05 3.14 2.15 -1.13 -5.03 116.67 110.28 2vxf s ASP 74 Ca -0.21 -0.27 0.01 0.00 0.43 0.00 0.00 52.55 52.51 2vxf s ASP 74 Cb 0.06 0.04 0.02 0.00 -0.30 0.00 0.00 42.92 42.74 2vxf s ASP 74 CO 0.34 -0.14 -0.07 -0.22 -0.17 0.00 0.00 175.17 174.92 2vxf s LEU 75 N -0.78 1.41 0.01 -1.34 0.20 -1.26 -1.74 118.68 115.18 2vxf s LEU 75 Ca -0.07 -0.18 0.04 0.00 0.69 0.00 0.00 54.13 54.61 2vxf s LEU 75 Cb -0.05 -0.55 -0.01 0.00 -0.43 0.00 0.00 46.19 45.14 2vxf s LEU 75 CO -0.00 -0.03 -0.13 -0.89 -0.29 0.00 0.00 176.35 175.01 2vxf s THR 76 N 0.85 1.02 -0.04 3.68 2.01 -0.92 -5.05 115.64 117.20 2vxf s THR 76 Ca -0.12 -0.73 -0.03 0.00 0.31 0.00 0.00 61.69 61.12 2vxf s THR 76 Cb -0.15 -0.89 -0.04 0.00 0.01 0.00 0.00 72.50 71.44 2vxf s THR 76 CO 0.01 0.15 0.12 -0.69 -0.69 0.00 0.00 174.62 173.52 2vxf s VAL 77 N -0.54 5.09 -0.05 3.82 1.01 -1.26 -1.87 120.40 126.60 2vxf s VAL 77 Ca 0.03 -0.19 0.02 0.00 0.00 0.00 0.00 61.98 61.85 2vxf s VAL 77 Cb -0.06 -3.31 -0.25 0.00 0.00 0.00 0.00 36.38 32.76 2vxf s VAL 77 CO 0.00 0.42 0.65 0.00 0.00 0.00 0.00 175.10 176.17 2vxf s GLU 79 N -2.60 3.82 -0.22 0.00 2.02 -1.26 -4.95 118.70 115.51 2vxf s GLU 79 Ca -0.11 0.62 -0.30 0.00 0.02 0.00 0.00 54.97 55.20 2vxf s GLU 79 Cb 0.07 -2.31 -0.07 0.00 0.10 0.00 0.00 34.13 31.93 2vxf s GLU 79 CO 0.82 -0.12 2.19 -2.30 0.02 0.00 0.00 175.26 175.87 2vxf n PRO 80 N -1.44 1.87 -2.32 0.39 -0.02 -1.26 -4.95 135.00 127.27 2vxf n PRO 80 Ca 0.04 0.53 -0.33 0.00 -2.02 0.00 0.00 63.50 61.72 2vxf n PRO 80 Cb 0.54 -3.07 -0.02 0.00 -0.02 0.00 0.00 33.50 30.93 2vxf n PRO 80 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 2vxf s PRO 81 N 6.15 3.63 0.22 0.52 0.04 -1.26 -4.88 135.00 139.43 2vxf s PRO 81 Ca 1.01 1.22 0.05 0.00 0.04 0.00 0.00 61.00 63.33 2vxf s PRO 81 Cb -0.44 -2.08 -0.03 0.00 0.04 0.00 0.00 34.50 31.99 2vxf s PRO 81 CO 0.39 -0.55 0.28 0.15 0.04 0.00 0.00 177.00 177.30 2vxf s LYS 82 N -3.72 3.25 0.39 4.56 1.02 -1.26 -5.07 119.74 118.91 2vxf s LYS 82 Ca 0.64 -0.82 -0.27 0.00 0.02 0.00 0.00 55.97 55.54 2vxf s LYS 82 Cb -0.15 -2.79 -0.10 0.00 -0.52 0.00 0.00 37.83 34.27 2vxf s LYS 82 CO 0.29 0.44 1.41 -2.14 -0.92 0.00 0.00 175.35 174.43 2vxf s PRO 83 N -3.73 4.03 0.36 -1.68 0.02 -1.26 -4.91 135.00 127.83 2vxf s PRO 83 Ca 0.33 2.40 0.10 0.00 0.02 0.00 0.00 61.00 63.86 2vxf s PRO 83 Cb -0.09 -2.88 0.70 0.00 0.02 0.00 0.00 34.50 32.25 2vxf s PRO 83 CO 0.27 -0.53 1.84 0.97 -0.33 0.00 0.00 177.00 179.22 2vxf h ILE 84 N 2.74 1.24 0.00 2.83 2.10 -2.07 -3.55 117.51 120.80 2vxf h ILE 84 Ca -0.50 -1.12 0.00 0.00 1.08 0.00 0.00 64.86 64.32 2vxf h ILE 84 Cb 1.24 1.50 0.00 0.00 -1.09 0.00 0.00 36.82 38.47 2vxf h ILE 84 CO 0.63 0.33 0.00 0.23 -1.08 0.00 0.00 178.15 178.26