#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 -4.04 3.23 1.02 -1.26 -5.12 120.64 114.47 2vxf n GLU -1 Ca 0.00 0.00 -0.31 0.00 -0.02 0.00 0.00 57.16 56.83 2vxf n GLU -1 Cb 0.00 0.00 -0.06 0.00 -0.02 0.00 0.00 31.44 31.36 2vxf n GLU -1 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 2vxf s ASP 0 N -4.22 5.60 0.35 1.62 1.11 -1.26 -5.01 116.67 114.87 2vxf s ASP 0 Ca 0.00 0.02 0.08 0.00 0.18 0.00 0.00 52.55 52.83 2vxf s ASP 0 Cb 0.00 -1.53 0.66 0.00 1.07 0.00 0.00 42.92 43.12 2vxf s ASP 0 CO 0.00 0.17 1.84 1.55 1.18 0.00 0.00 175.17 179.91 2vxf h PRO 1 N 3.28 0.25 -0.31 8.23 0.13 -2.00 -2.77 132.00 138.81 2vxf h PRO 1 Ca -0.47 -0.08 -0.08 0.00 -0.87 0.00 0.00 66.00 64.51 2vxf h PRO 1 Cb 1.16 -0.02 -0.02 0.00 0.13 0.00 0.00 31.00 32.25 2vxf h PRO 1 CO 0.67 0.47 -0.14 0.77 -0.23 0.00 0.00 178.00 179.53 2vxf h SER 2 N 0.22 0.53 -0.04 1.44 0.02 -1.95 -2.58 113.55 111.19 2vxf h SER 2 Ca 0.04 -0.15 -0.12 0.00 -0.84 0.00 0.00 61.79 60.72 2vxf h SER 2 Cb 0.53 -0.14 -0.01 0.00 0.14 0.00 0.00 62.40 62.92 2vxf h SER 2 CO 0.04 0.70 -0.35 1.23 -1.14 0.00 0.00 176.83 177.31 2vxf h GLY 3 N 0.95 0.57 1.71 -3.77 0.00 -1.91 -2.89 103.07 97.74 2vxf h GLY 3 Ca 0.09 -0.53 -0.10 0.00 0.00 0.00 0.00 47.33 46.79 2vxf h GLY 3 CO 0.03 0.48 -0.34 -1.33 0.00 0.00 0.00 176.54 175.38 2vxf h GLY 4 N 1.06 0.36 -4.20 4.60 0.00 -1.38 -3.43 103.07 100.07 2vxf h GLY 4 Ca 0.05 -0.31 -0.52 0.00 0.00 0.00 0.00 47.33 46.54 2vxf h GLY 4 CO 0.07 0.29 0.68 -1.59 0.00 0.00 0.00 176.54 175.98 2vxf s THR 5 N -4.29 3.00 0.59 4.70 2.01 -1.01 -4.98 115.64 115.67 2vxf s THR 5 Ca -0.05 0.85 -0.19 0.00 0.31 0.00 0.00 61.69 62.60 2vxf s THR 5 Cb 0.14 -3.54 -0.03 0.00 0.01 0.00 0.00 72.50 69.07 2vxf s THR 5 CO 0.78 0.14 1.26 -2.84 -0.69 0.00 0.00 174.62 173.27 2vxf s PRO 6 N -0.38 2.94 0.44 4.92 0.02 -1.26 -4.91 135.00 136.76 2vxf s PRO 6 Ca 0.56 1.98 0.16 0.00 0.02 0.00 0.00 61.00 63.72 2vxf s PRO 6 Cb -0.38 -2.00 0.99 0.00 0.02 0.00 0.00 34.50 33.13 2vxf s PRO 6 CO 0.41 -1.27 1.96 1.88 -0.33 0.00 0.00 177.00 179.65 2vxf h TYR 7 N 0.99 0.00 -3.67 6.54 0.05 -1.93 -3.44 116.97 115.51 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 1.31 0.00 0.08 0.00 1.01 0.00 0.00 36.73 39.13 2vxf h TYR 7 CO 0.45 0.23 0.77 0.42 -1.05 0.00 0.00 178.16 178.98 2vxf s ILE 8 N -4.43 2.35 0.00 -2.88 1.01 -1.26 -2.18 121.20 113.80 2vxf s ILE 8 Ca -0.03 0.32 0.00 0.00 0.00 0.00 0.00 60.65 60.94 2vxf s ILE 8 Cb 0.15 -3.21 0.00 0.00 0.01 0.00 0.00 42.46 39.41 2vxf s ILE 8 CO 0.69 0.07 0.00 0.61 0.00 0.00 0.00 174.94 176.30 2vxf n GLY 9 N 1.31 0.46 3.94 6.18 0.00 -0.68 -5.02 105.19 111.38 2vxf n GLY 9 Ca 0.04 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.82 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 -2.80 6.29 -0.02 1.61 0.01 -0.93 -4.86 113.70 113.00 2vxf s SER 10 Ca 0.00 0.41 -0.17 0.00 1.31 0.00 0.00 55.95 57.51 2vxf s SER 10 Cb 0.00 -2.01 -0.05 0.00 0.21 0.00 0.00 66.02 64.17 2vxf s SER 10 CO 0.00 -0.28 0.46 -0.75 0.41 0.00 0.00 173.24 173.08 2vxf s LYS 11 N -4.29 4.11 0.04 12.44 2.20 -1.26 -1.57 119.74 131.40 2vxf s LYS 11 Ca 0.40 0.49 0.04 0.00 -0.36 0.00 0.00 55.97 56.54 2vxf s LYS 11 Cb -0.10 -3.29 -0.02 0.00 -1.51 0.00 0.00 37.83 32.92 2vxf s LYS 11 CO 0.35 0.52 -0.11 0.42 -0.36 0.00 0.00 175.35 176.17 2vxf s ILE 12 N -0.58 0.87 -0.14 5.43 1.01 -0.80 -2.23 121.20 124.75 2vxf s ILE 12 Ca 0.25 -0.93 -0.00 0.00 0.00 0.00 0.00 60.65 59.97 2vxf s ILE 12 Cb -0.17 -0.82 -0.01 0.00 0.01 0.00 0.00 42.46 41.47 2vxf s ILE 12 CO 0.14 -0.09 -0.13 -0.55 0.00 0.00 0.00 174.94 174.31 2vxf s SER 13 N -1.15 3.97 -0.05 3.58 0.15 -0.69 -2.67 113.70 116.83 2vxf s SER 13 Ca -0.02 -0.36 0.06 0.00 0.70 0.00 0.00 55.95 56.33 2vxf s SER 13 Cb -0.08 -1.61 -0.01 0.00 -1.71 0.00 0.00 66.02 62.61 2vxf s SER 13 CO 0.01 0.13 -0.24 -0.22 1.20 0.00 0.00 173.24 174.12 2vxf s LEU 14 N 0.55 2.05 -0.25 3.45 2.96 -0.55 -2.25 118.68 124.64 2vxf s LEU 14 Ca -0.08 -0.49 -0.06 0.00 -0.22 0.00 0.00 54.13 53.28 2vxf s LEU 14 Cb -0.16 -1.33 -0.01 0.00 0.50 0.00 0.00 46.19 45.19 2vxf s LEU 14 CO 0.04 0.25 0.02 -0.63 -1.32 0.00 0.00 176.35 174.70 2vxf s ILE 15 N -0.20 3.80 0.71 6.68 1.01 -0.71 -1.81 121.20 130.68 2vxf s ILE 15 Ca -0.02 -0.43 -0.05 0.00 0.00 0.00 0.00 60.65 60.15 2vxf s ILE 15 Cb -0.13 -2.80 0.09 0.00 0.01 0.00 0.00 42.46 39.63 2vxf s ILE 15 CO 0.03 0.32 1.00 -0.44 0.00 0.00 0.00 174.94 175.85 2vxf s SER 16 N 1.53 4.58 0.57 3.58 0.01 -1.06 -1.37 113.70 121.53 2vxf s SER 16 Ca 0.05 0.13 0.38 0.00 1.31 0.00 0.00 55.95 57.82 2vxf s SER 16 Cb -0.15 -0.69 2.05 0.00 0.21 0.00 0.00 66.02 67.44 2vxf s SER 16 CO 0.00 -1.72 2.15 0.07 0.41 0.00 0.00 173.24 174.16 2vxf h LYS 17 N -0.58 0.00 -0.60 12.44 2.10 -1.54 -1.29 116.57 127.10 2vxf h LYS 17 Ca -0.42 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.23 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 -1.98 2.88 -2.29 0.07 0.00 -1.26 -4.89 120.51 113.04 2vxf n ALA 18 Ca -0.03 -0.87 -0.17 0.00 0.00 0.00 0.00 53.44 52.38 2vxf n ALA 18 Cb 0.07 -1.02 -0.02 0.00 0.00 0.00 0.00 19.45 18.48 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 0.48 -1.85 -4.00 0.00 1.02 -0.49 -4.58 120.64 111.22 2vxf n GLU 19 Ca 0.14 0.85 -0.35 0.00 -0.02 0.00 0.00 57.16 57.78 2vxf n GLU 19 Cb 0.56 -5.44 -0.06 0.00 -0.02 0.00 0.00 31.44 26.48 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 -2.79 5.16 -0.27 -3.67 1.01 -1.26 -4.68 121.20 114.70 2vxf s ILE 20 Ca 0.00 -0.09 -0.10 0.00 0.00 0.00 0.00 60.65 60.46 2vxf s ILE 20 Cb 0.00 -3.31 -0.05 0.00 0.01 0.00 0.00 42.46 39.11 2vxf s ILE 20 CO 0.00 0.48 0.17 -0.60 0.00 0.00 0.00 174.94 174.99 2vxf s ARG 21 N -1.42 3.93 -0.12 2.79 3.52 -1.26 -2.57 118.95 123.82 2vxf s ARG 21 Ca 0.20 -0.33 -0.00 0.00 -0.13 0.00 0.00 55.73 55.46 2vxf s ARG 21 Cb -0.12 -3.60 -0.02 0.00 -1.56 0.00 0.00 34.95 29.65 2vxf s ARG 21 CO 0.10 -0.14 -0.11 0.71 -0.81 0.00 0.00 175.30 175.05 2vxf s TYR 22 N 1.63 2.85 -0.02 5.12 2.02 -0.75 -2.28 117.35 125.92 2vxf s TYR 22 Ca 0.07 -0.44 0.07 0.00 -0.37 0.00 0.00 57.07 56.40 2vxf s TYR 22 Cb -0.16 -1.82 -0.02 0.00 -0.40 0.00 0.00 41.96 39.56 2vxf s TYR 22 CO 0.09 -0.07 -0.22 -1.21 -1.57 0.00 0.00 175.55 172.58 2vxf s GLU 23 N 0.09 2.21 0.21 -0.62 2.02 -0.96 -1.48 118.70 120.17 2vxf s GLU 23 Ca -0.04 -0.87 -0.18 0.00 0.02 0.00 0.00 54.97 53.90 2vxf s GLU 23 Cb -0.14 -2.15 0.06 0.00 0.10 0.00 0.00 34.13 32.00 2vxf s GLU 23 CO 0.04 0.58 0.87 0.41 0.02 0.00 0.00 175.26 177.18 2vxf n GLY 24 N 2.29 0.77 3.67 -1.39 0.00 -1.09 -1.54 105.19 107.91 2vxf n GLY 24 Ca -0.16 -1.15 -0.33 0.00 0.00 0.00 0.00 46.02 44.38 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 4.13 -0.21 -0.61 -1.09 -1.07 -1.91 121.20 118.31 2vxf s ILE 25 Ca 0.19 -0.58 -0.29 0.00 -2.23 0.00 0.00 60.65 57.75 2vxf s ILE 25 Cb -0.03 -2.82 -0.04 0.00 -1.58 0.00 0.00 42.46 37.99 2vxf s ILE 25 CO 0.06 0.40 1.82 -0.22 -1.23 0.00 0.00 174.94 175.78 2vxf s LEU 26 N -1.47 3.79 -0.22 2.97 2.96 -0.61 -2.58 118.68 123.51 2vxf s LEU 26 Ca 0.19 1.74 -0.17 0.00 -0.22 0.00 0.00 54.13 55.67 2vxf s LEU 26 Cb -0.11 -3.53 -0.14 0.00 0.50 0.00 0.00 46.19 42.91 2vxf s LEU 26 CO 0.09 -1.47 -0.08 0.00 -1.32 0.00 0.00 176.35 173.57 2vxf n TYR 27 N 9.39 0.57 -3.79 5.38 9.36 -1.05 -1.69 117.16 135.33 2vxf n TYR 27 Ca 0.22 0.25 -0.13 0.00 3.32 0.00 0.00 57.90 61.56 2vxf n TYR 27 Cb 0.45 -0.98 -0.11 0.00 -0.63 0.00 0.00 39.34 38.08 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 -2.45 0.02 -0.16 2.97 -4.23 -1.11 -4.83 115.64 105.86 2vxf s THR 28 Ca -0.31 -0.19 -0.02 0.00 -1.18 0.00 0.00 61.69 59.99 2vxf s THR 28 Cb 0.08 -0.43 -0.02 0.00 1.34 0.00 0.00 72.50 73.47 2vxf s THR 28 CO 0.50 -0.10 -0.09 -0.63 -0.54 0.00 0.00 174.62 173.76 2vxf s ILE 29 N -0.36 3.35 -0.48 2.99 1.01 -1.26 -2.09 121.20 124.37 2vxf s ILE 29 Ca -0.05 -0.54 -0.04 0.00 0.00 0.00 0.00 60.65 60.03 2vxf s ILE 29 Cb -0.03 -2.45 0.13 0.00 0.01 0.00 0.00 42.46 40.11 2vxf s ILE 29 CO 0.01 0.49 0.29 -0.62 0.00 0.00 0.00 174.94 175.11 2vxf s ASP 30 N 0.60 5.32 0.20 3.58 2.15 -0.81 -4.95 116.67 122.77 2vxf s ASP 30 Ca -0.05 -2.24 -0.02 0.00 0.43 0.00 0.00 52.55 50.67 2vxf s ASP 30 Cb -0.15 -1.86 0.15 0.00 -0.30 0.00 0.00 42.92 40.76 2vxf s ASP 30 CO 0.03 -0.52 1.53 0.74 -0.17 0.00 0.00 175.17 176.78 2vxf h THR 31 N 6.04 1.32 -0.13 1.71 2.02 -1.98 -2.49 112.91 119.40 2vxf h THR 31 Ca -0.11 -1.76 0.04 0.00 0.77 0.00 0.00 66.41 65.35 2vxf h THR 31 Cb 1.03 1.75 -0.01 0.00 -1.74 0.00 0.00 68.15 69.18 2vxf h THR 31 CO 0.72 0.55 0.10 -0.08 0.37 0.00 0.00 175.52 177.18 2vxf h GLU 32 N 0.41 0.00 -0.08 6.66 4.81 -1.94 -2.04 114.58 122.40 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 1.05 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.43 2vxf h GLU 32 CO 0.10 0.00 0.00 0.09 -0.73 0.00 0.00 179.01 178.47 2vxf n ASN 33 N -4.34 2.44 -3.90 1.04 3.02 -1.23 -4.99 115.26 107.30 2vxf n ASN 33 Ca 0.00 -2.43 -0.25 0.00 -0.03 0.00 0.00 54.58 51.86 2vxf n ASN 33 Cb 0.22 -0.22 -0.01 0.00 -0.61 0.00 0.00 39.78 39.16 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 -0.63 -1.00 -4.15 6.41 2.88 -0.77 -4.88 113.62 111.48 2vxf n SER 34 Ca 0.09 -0.95 -0.17 0.00 -1.33 0.00 0.00 58.87 56.51 2vxf n SER 34 Cb 0.46 -3.34 -0.12 0.00 -0.75 0.00 0.00 64.21 60.46 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 0.98 -0.02 2.46 -4.23 -0.95 -2.42 115.64 107.66 2vxf s THR 35 Ca 0.09 -1.27 0.04 0.00 -1.18 0.00 0.00 61.69 59.37 2vxf s THR 35 Cb -0.05 -0.98 -0.01 0.00 1.34 0.00 0.00 72.50 72.80 2vxf s THR 35 CO 0.87 -0.28 -0.13 -0.69 -0.54 0.00 0.00 174.62 173.86 2vxf s VAL 36 N -1.35 1.02 -0.17 2.29 1.01 -0.92 -1.92 120.40 120.35 2vxf s VAL 36 Ca -0.03 -0.53 -0.04 0.00 0.00 0.00 0.00 61.98 61.38 2vxf s VAL 36 Cb -0.10 -0.86 -0.02 0.00 0.00 0.00 0.00 36.38 35.40 2vxf s VAL 36 CO 0.02 0.29 -0.04 0.00 0.00 0.00 0.00 175.10 175.37 2vxf s ALA 37 N -0.16 2.95 -0.04 5.51 0.00 -0.89 -2.30 121.76 126.83 2vxf s ALA 37 Ca 0.02 -0.90 0.05 0.00 0.00 0.00 0.00 51.96 51.13 2vxf s ALA 37 Cb -0.06 -1.59 -0.02 0.00 0.00 0.00 0.00 23.12 21.45 2vxf s ALA 37 CO -0.00 0.07 -0.20 -0.51 0.00 0.00 0.00 175.76 175.12 2vxf s LEU 38 N 0.63 2.41 0.34 0.00 1.43 -0.96 -2.52 118.68 120.01 2vxf s LEU 38 Ca -0.03 -0.34 0.09 0.00 -1.03 0.00 0.00 54.13 52.83 2vxf s LEU 38 Cb -0.14 -1.46 -0.05 0.00 0.03 0.00 0.00 46.19 44.57 2vxf s LEU 38 CO 0.02 0.32 0.05 0.00 0.23 0.00 0.00 176.35 176.97 2vxf s ALA 39 N -0.56 3.28 -1.20 4.21 0.00 -1.07 -2.20 121.76 124.23 2vxf s ALA 39 Ca 0.08 -1.93 -0.12 0.00 0.00 0.00 0.00 51.96 50.00 2vxf s ALA 39 Cb -0.11 -0.47 -0.01 0.00 0.00 0.00 0.00 23.12 22.53 2vxf s ALA 39 CO 0.01 0.06 0.74 1.63 0.00 0.00 0.00 175.76 178.20 2vxf n LYS 40 N -1.01 -2.43 -4.46 0.00 5.02 -0.98 -2.59 118.16 111.71 2vxf n LYS 40 Ca -0.04 0.54 -0.30 0.00 -2.02 0.00 0.00 58.31 56.49 2vxf n LYS 40 Cb 0.62 -4.63 -0.13 0.00 -0.02 0.00 0.00 35.03 30.88 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 -3.56 2.55 0.05 -0.18 0.11 -1.02 -4.21 120.40 114.13 2vxf s VAL 41 Ca 0.31 -1.53 0.01 0.00 -2.93 0.00 0.00 61.98 57.84 2vxf s VAL 41 Cb -0.10 -2.12 -0.03 0.00 -1.53 0.00 0.00 36.38 32.60 2vxf s VAL 41 CO 0.84 0.17 -0.06 0.00 -3.33 0.00 0.00 175.10 172.72 2vxf s ARG 42 N -1.89 0.55 -0.16 1.54 1.70 -0.59 -2.00 118.95 118.10 2vxf s ARG 42 Ca 0.15 -0.90 -0.07 0.00 -0.47 0.00 0.00 55.73 54.44 2vxf s ARG 42 Cb -0.10 -0.11 -0.04 0.00 -0.57 0.00 0.00 34.95 34.12 2vxf s ARG 42 CO 0.07 -0.01 0.10 -1.54 -1.08 0.00 0.00 175.30 172.84 2vxf s SER 43 N -2.02 5.98 0.09 -2.89 1.04 -1.26 -2.26 113.70 112.39 2vxf s SER 43 Ca -0.05 0.24 -0.13 0.00 0.48 0.00 0.00 55.95 56.49 2vxf s SER 43 Cb -0.05 -1.98 -0.18 0.00 0.10 0.00 0.00 66.02 63.92 2vxf s SER 43 CO -0.02 0.26 1.27 -0.26 0.98 0.00 0.00 173.24 175.47 2vxf h PHE 44 N 6.04 1.07 0.00 5.02 0.04 -1.87 -3.48 116.94 123.76 2vxf h PHE 44 Ca -0.45 -0.50 0.00 0.00 2.80 0.00 0.00 57.97 59.83 2vxf h PHE 44 Cb 1.18 -0.15 0.00 0.00 2.20 0.00 0.00 35.95 39.18 2vxf h PHE 44 CO 0.63 1.33 0.00 0.41 -0.60 0.00 0.00 178.31 180.08 2vxf n GLY 45 N 0.80 1.08 0.11 -1.45 0.00 -1.26 -4.97 105.19 99.50 2vxf n GLY 45 Ca -0.08 -1.02 0.01 0.00 0.00 0.00 0.00 46.02 44.93 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 0.63 0.24 2.61 -2.24 -1.26 -4.28 114.28 109.36 2vxf n THR 46 Ca 0.00 -0.81 0.18 0.00 -2.27 0.00 0.00 64.05 61.15 2vxf n THR 46 Cb 0.00 0.70 0.88 0.00 -2.10 0.00 0.00 70.33 69.81 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 0.42 0.00 -0.16 -0.78 4.81 -1.93 -0.54 114.58 116.40 2vxf h GLU 47 Ca 0.00 0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 59.22 2vxf h GLU 47 Cb 0.38 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.75 2vxf h GLU 47 CO 0.00 0.00 0.04 0.22 -0.73 0.00 0.00 179.01 178.54 2vxf h ASP 48 N 0.00 0.19 -3.81 1.04 -0.00 -1.86 -3.34 116.42 108.64 2vxf h ASP 48 Ca 0.07 -0.01 -0.63 0.00 -0.00 0.00 0.00 57.03 56.45 2vxf h ASP 48 Cb 0.51 -0.05 -0.40 0.00 -0.00 0.00 0.00 39.33 39.39 2vxf h ASP 48 CO -0.00 0.20 -0.70 -0.13 -0.00 0.00 0.00 179.24 178.61 2vxf s ARG 49 N -5.09 1.50 0.20 0.28 1.81 -0.21 -5.07 118.95 112.38 2vxf s ARG 49 Ca -0.06 -2.03 -0.32 0.00 -1.72 0.00 0.00 55.73 51.59 2vxf s ARG 49 Cb 0.17 -2.93 -0.12 0.00 -0.45 0.00 0.00 34.95 31.61 2vxf s ARG 49 CO 0.70 -1.04 1.69 -2.30 -0.68 0.00 0.00 175.30 173.68 2vxf n PRO 50 N 3.84 2.63 -4.30 3.54 -0.02 -1.26 -4.99 135.00 134.44 2vxf n PRO 50 Ca 0.04 0.95 -0.16 0.00 -2.02 0.00 0.00 63.50 62.31 2vxf n PRO 50 Cb 0.37 -2.78 -0.10 0.00 -0.02 0.00 0.00 33.50 30.97 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 1.13 0.93 -1.89 3.45 -4.23 -1.26 -5.03 115.64 108.74 2vxf s THR 51 Ca 0.76 -2.02 0.28 0.00 -1.18 0.00 0.00 61.69 59.53 2vxf s THR 51 Cb -0.55 -2.27 0.74 0.00 1.34 0.00 0.00 72.50 71.76 2vxf s THR 51 CO 0.34 -0.37 2.02 -0.90 -0.54 0.00 0.00 174.62 175.16 2vxf n ASP 52 N -0.36 0.00 -4.17 3.99 5.68 -1.26 -4.51 116.55 115.92 2vxf n ASP 52 Ca -0.05 -0.74 -0.36 0.00 -0.50 0.00 0.00 54.79 53.14 2vxf n ASP 52 Cb 0.64 -0.06 -0.13 0.00 -1.14 0.00 0.00 41.12 40.43 2vxf n ASP 52 CO 0.00 0.00 0.00 -0.13 -1.33 0.00 0.00 177.20 175.74 2vxf s ARG 53 N -2.11 2.31 0.16 0.11 1.81 -1.26 -5.09 118.95 114.89 2vxf s ARG 53 Ca 0.39 -1.43 -0.31 0.00 -1.72 0.00 0.00 55.73 52.67 2vxf s ARG 53 Cb 0.19 -3.34 -0.09 0.00 -0.45 0.00 0.00 34.95 31.27 2vxf s ARG 53 CO 0.35 -0.76 1.38 -1.25 -0.68 0.00 0.00 175.30 174.33 2vxf s PRO 54 N 1.24 4.33 -0.17 3.54 0.04 -1.26 -5.02 135.00 137.70 2vxf s PRO 54 Ca -0.00 2.11 0.01 0.00 0.04 0.00 0.00 61.00 63.16 2vxf s PRO 54 Cb -0.21 -3.21 0.03 0.00 0.04 0.00 0.00 34.50 31.15 2vxf s PRO 54 CO -0.02 -0.39 -0.16 0.42 0.04 0.00 0.00 177.00 176.90 2vxf s ILE 55 N 0.68 1.77 0.20 0.56 -1.09 -1.26 -5.13 121.20 116.93 2vxf s ILE 55 Ca 0.62 -0.82 0.02 0.00 -2.23 0.00 0.00 60.65 58.23 2vxf s ILE 55 Cb -0.38 -1.67 -0.04 0.00 -1.58 0.00 0.00 42.46 38.80 2vxf s ILE 55 CO 0.34 0.44 0.36 0.00 -1.23 0.00 0.00 174.94 174.84 2vxf s ALA 56 N 1.39 3.89 0.51 9.38 0.00 -1.26 -4.79 121.76 130.88 2vxf s ALA 56 Ca 0.04 -0.98 -0.23 0.00 0.00 0.00 0.00 51.96 50.79 2vxf s ALA 56 Cb -0.14 -1.88 -0.06 0.00 0.00 0.00 0.00 23.12 21.05 2vxf s ALA 56 CO -0.11 0.40 1.32 -2.14 0.00 0.00 0.00 175.76 175.24 2vxf s PRO 57 N -3.48 3.39 0.22 0.00 0.02 -1.26 -5.04 135.00 128.85 2vxf s PRO 57 Ca 0.36 2.16 0.09 0.00 0.02 0.00 0.00 61.00 63.63 2vxf s PRO 57 Cb -0.11 -2.37 -0.05 0.00 0.02 0.00 0.00 34.50 31.99 2vxf s PRO 57 CO 0.29 -0.96 -0.16 1.03 -0.33 0.00 0.00 177.00 176.87 2vxf s ARG 58 N -2.76 1.39 -0.41 5.54 0.52 -1.26 -5.04 118.95 116.94 2vxf s ARG 58 Ca 0.68 -1.61 0.05 0.00 -0.52 0.00 0.00 55.73 54.32 2vxf s ARG 58 Cb -0.38 -1.26 0.65 0.00 0.52 0.00 0.00 34.95 34.47 2vxf s ARG 58 CO 0.46 0.22 1.85 -0.40 0.02 0.00 0.00 175.30 177.46 2vxf n ASP 59 N -0.38 3.87 -4.17 0.23 5.68 -1.26 -4.92 116.55 115.60 2vxf n ASP 59 Ca -0.08 -3.47 -0.24 0.00 -0.50 0.00 0.00 54.79 50.51 2vxf n ASP 59 Cb 0.60 -0.81 -0.15 0.00 -1.14 0.00 0.00 41.12 39.62 2vxf n ASP 59 CO 0.00 0.00 0.00 -0.70 -1.33 0.00 0.00 177.20 175.17 2vxf s GLU 60 N -3.08 1.32 0.24 0.11 2.12 -1.26 -5.15 118.70 113.00 2vxf s GLU 60 Ca 0.54 -0.68 0.06 0.00 0.36 0.00 0.00 54.97 55.25 2vxf s GLU 60 Cb 0.45 -1.31 -0.03 0.00 0.26 0.00 0.00 34.13 33.50 2vxf s GLU 60 CO 0.11 0.35 0.27 0.99 -0.54 0.00 0.00 175.26 176.44 2vxf s THR 61 N -0.52 4.82 -0.17 -1.70 2.01 -1.26 -4.97 115.64 113.86 2vxf s THR 61 Ca 0.06 -1.20 -0.13 0.00 0.31 0.00 0.00 61.69 60.73 2vxf s THR 61 Cb -0.07 -3.61 -0.05 0.00 0.01 0.00 0.00 72.50 68.78 2vxf s THR 61 CO -0.00 -0.33 0.25 -0.36 -0.69 0.00 0.00 174.62 173.49 2vxf s PHE 62 N -2.05 3.45 0.15 4.92 0.08 -0.85 -4.96 117.98 118.73 2vxf s PHE 62 Ca 0.33 0.53 -0.11 0.00 0.12 0.00 0.00 56.93 57.81 2vxf s PHE 62 Cb -0.08 -2.29 0.00 0.00 -0.57 0.00 0.00 43.02 40.08 2vxf s PHE 62 CO 0.27 0.26 1.55 1.49 -0.10 0.00 0.00 175.22 178.70 2vxf h GLU 63 N 6.62 0.96 -2.54 0.44 4.81 -1.94 -2.69 114.58 120.24 2vxf h GLU 63 Ca -0.41 -0.39 -0.10 0.00 -0.13 0.00 0.00 59.36 58.33 2vxf h GLU 63 Cb 1.16 -0.04 -0.27 0.00 0.63 0.00 0.00 28.75 30.23 2vxf h GLU 63 CO 0.75 1.05 -0.36 -0.47 -0.73 0.00 0.00 179.01 179.26 2vxf s TYR 64 N -4.74 -0.75 0.05 0.92 6.14 -1.26 -2.33 117.35 115.38 2vxf s TYR 64 Ca -0.12 1.47 0.05 0.00 0.64 0.00 0.00 57.07 59.11 2vxf s TYR 64 Cb 0.12 0.29 -0.03 0.00 0.42 0.00 0.00 41.96 42.77 2vxf s TYR 64 CO 0.86 -0.45 -0.14 0.42 0.64 0.00 0.00 175.55 176.88 2vxf s ILE 65 N 2.38 1.06 -0.11 3.14 1.01 -0.93 -5.03 121.20 122.72 2vxf s ILE 65 Ca -0.03 -1.14 -0.01 0.00 0.00 0.00 0.00 60.65 59.47 2vxf s ILE 65 Cb -0.11 -1.00 -0.03 0.00 0.01 0.00 0.00 42.46 41.33 2vxf s ILE 65 CO -0.13 -0.13 -0.06 -0.63 0.00 0.00 0.00 174.94 173.99 2vxf s ILE 66 N -1.08 3.71 0.01 2.92 1.01 -1.26 -2.27 121.20 124.25 2vxf s ILE 66 Ca -0.01 -0.45 0.06 0.00 0.00 0.00 0.00 60.65 60.25 2vxf s ILE 66 Cb -0.09 -2.57 -0.02 0.00 0.01 0.00 0.00 42.46 39.80 2vxf s ILE 66 CO 0.02 0.55 -0.18 -0.36 0.00 0.00 0.00 174.94 174.97 2vxf s PHE 67 N -0.24 1.62 0.12 3.97 0.08 -0.97 -5.04 117.98 117.51 2vxf s PHE 67 Ca 0.03 -0.33 0.05 0.00 0.12 0.00 0.00 56.93 56.81 2vxf s PHE 67 Cb -0.13 -1.01 -0.04 0.00 -0.57 0.00 0.00 43.02 41.27 2vxf s PHE 67 CO 0.03 0.02 0.04 1.03 -0.10 0.00 0.00 175.22 176.23 2vxf s ARG 68 N -0.73 2.63 0.58 0.44 0.52 -1.26 -2.17 118.95 118.96 2vxf s ARG 68 Ca 0.06 -0.88 0.28 0.00 -0.52 0.00 0.00 55.73 54.68 2vxf s ARG 68 Cb -0.08 -2.55 1.65 0.00 0.52 0.00 0.00 34.95 34.50 2vxf s ARG 68 CO 0.00 0.52 2.12 0.78 0.02 0.00 0.00 175.30 178.74 2vxf h GLY 69 N 3.07 0.00 0.88 -3.53 0.00 -1.82 -2.28 103.07 99.40 2vxf h GLY 69 Ca -0.47 0.00 -0.05 0.00 0.00 0.00 0.00 47.33 46.81 2vxf h GLY 69 CO 0.61 0.00 -0.01 1.48 0.00 0.00 0.00 176.54 178.61 2vxf h SER 70 N 0.00 0.53 0.77 0.19 4.64 -1.94 -3.23 113.55 114.50 2vxf h SER 70 Ca 0.08 -0.32 -0.25 0.00 -0.47 0.00 0.00 61.79 60.83 2vxf h SER 70 Cb 0.42 -0.14 -0.02 0.00 -0.31 0.00 0.00 62.40 62.34 2vxf h SER 70 CO -0.00 0.72 -1.22 -2.24 -0.87 0.00 0.00 176.83 173.22 2vxf h ASP 71 N 0.32 0.15 -3.90 4.97 2.03 -1.85 -3.46 116.42 114.68 2vxf h ASP 71 Ca 0.08 -0.18 -0.53 0.00 -0.73 0.00 0.00 57.03 55.68 2vxf h ASP 71 Cb 0.46 -0.05 0.07 0.00 -0.83 0.00 0.00 39.33 38.98 2vxf h ASP 71 CO 0.02 1.14 0.65 -0.63 -1.03 0.00 0.00 179.24 179.39 2vxf s ILE 72 N -2.67 2.61 -0.18 4.15 1.01 -0.91 -1.37 121.20 123.84 2vxf s ILE 72 Ca -0.02 0.60 -0.01 0.00 0.00 0.00 0.00 60.65 61.22 2vxf s ILE 72 Cb 0.09 -3.38 -0.11 0.00 0.01 0.00 0.00 42.46 39.07 2vxf s ILE 72 CO 0.84 0.13 -0.18 1.17 0.00 0.00 0.00 174.94 176.91 2vxf n LYS 73 N 0.62 0.43 -3.94 2.79 4.81 -0.47 -4.81 118.16 117.59 2vxf n LYS 73 Ca 0.01 0.12 -0.12 0.00 -0.87 0.00 0.00 58.31 57.45 2vxf n LYS 73 Cb 0.42 -1.31 -0.13 0.00 0.02 0.00 0.00 35.03 34.02 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 -5.95 0.18 -0.07 3.14 -1.08 -1.10 -5.03 116.67 106.75 2vxf s ASP 74 Ca -0.25 -0.15 0.01 0.00 -0.52 0.00 0.00 52.55 51.65 2vxf s ASP 74 Cb 0.07 0.01 0.02 0.00 -1.46 0.00 0.00 42.92 41.56 2vxf s ASP 74 CO 0.39 -0.07 -0.08 -0.22 0.52 0.00 0.00 175.17 175.71 2vxf s LEU 75 N -0.41 1.39 -0.03 -1.34 0.20 -1.26 -1.73 118.68 115.50 2vxf s LEU 75 Ca -0.04 -0.24 0.04 0.00 0.69 0.00 0.00 54.13 54.58 2vxf s LEU 75 Cb -0.03 -0.70 -0.00 0.00 -0.43 0.00 0.00 46.19 45.02 2vxf s LEU 75 CO -0.00 -0.04 -0.13 -0.89 -0.29 0.00 0.00 176.35 175.00 2vxf s THR 76 N 1.05 1.10 -0.01 3.68 2.01 -0.96 -5.05 115.64 117.47 2vxf s THR 76 Ca -0.08 -0.55 0.02 0.00 0.31 0.00 0.00 61.69 61.39 2vxf s THR 76 Cb -0.14 -0.95 -0.03 0.00 0.01 0.00 0.00 72.50 71.38 2vxf s THR 76 CO -0.01 0.32 -0.03 -0.69 -0.69 0.00 0.00 174.62 173.53 2vxf s VAL 77 N 0.03 3.95 0.05 3.82 1.01 -1.26 -1.71 120.40 126.30 2vxf s VAL 77 Ca -0.02 -0.64 -0.09 0.00 0.00 0.00 0.00 61.98 61.23 2vxf s VAL 77 Cb -0.09 -2.73 -0.32 0.00 0.00 0.00 0.00 36.38 33.24 2vxf s VAL 77 CO 0.01 0.41 1.08 0.00 0.00 0.00 0.00 175.10 176.59 2vxf s GLU 79 N -2.63 4.04 -0.23 0.00 0.41 -1.26 -4.97 118.70 114.05 2vxf s GLU 79 Ca -0.06 0.81 -0.29 0.00 -0.41 0.00 0.00 54.97 55.02 2vxf s GLU 79 Cb 0.06 -3.71 -0.06 0.00 -1.78 0.00 0.00 34.13 28.64 2vxf s GLU 79 CO 0.91 -0.71 2.22 -2.30 -0.49 0.00 0.00 175.26 174.90 2vxf n PRO 80 N 6.35 1.86 -1.48 0.39 -0.02 -1.26 -4.94 135.00 135.89 2vxf n PRO 80 Ca 0.07 0.51 -0.32 0.00 -2.02 0.00 0.00 63.50 61.73 2vxf n PRO 80 Cb 0.48 -3.15 0.08 0.00 -0.02 0.00 0.00 33.50 30.88 2vxf n PRO 80 CO 0.00 0.00 0.00 -2.14 1.98 0.00 0.00 175.50 175.34 2vxf s PRO 81 N 6.35 2.40 0.28 0.52 0.02 -1.26 -5.04 135.00 138.26 2vxf s PRO 81 Ca 1.02 1.40 0.03 0.00 0.02 0.00 0.00 61.00 63.47 2vxf s PRO 81 Cb -0.40 -1.90 -0.03 0.00 0.02 0.00 0.00 34.50 32.19 2vxf s PRO 81 CO 0.37 -1.57 0.43 0.15 -0.33 0.00 0.00 177.00 176.05 2vxf s LYS 82 N -4.33 3.45 0.55 5.54 3.01 -1.26 -5.07 119.74 121.63 2vxf s LYS 82 Ca 0.66 -0.60 -0.21 0.00 -1.01 0.00 0.00 55.97 54.81 2vxf s LYS 82 Cb -0.21 -2.80 -0.05 0.00 -1.01 0.00 0.00 37.83 33.76 2vxf s LYS 82 CO 0.47 0.32 1.31 -2.14 0.51 0.00 0.00 175.35 175.82 2vxf s PRO 83 N -4.11 3.14 -0.39 -1.68 0.02 -1.26 -4.97 135.00 125.75 2vxf s PRO 83 Ca 0.36 2.11 0.11 0.00 0.02 0.00 0.00 61.00 63.60 2vxf s PRO 83 Cb -0.09 -2.19 0.40 0.00 0.02 0.00 0.00 34.50 32.63 2vxf s PRO 83 CO 0.32 -1.15 1.23 1.51 -0.33 0.00 0.00 177.00 178.57 2vxf n ILE 84 N -1.11 0.23 -0.80 2.83 3.06 -1.26 -5.25 119.36 117.05 2vxf n ILE 84 Ca 0.11 -1.95 0.00 0.00 -2.50 0.00 0.00 62.75 58.41 2vxf n ILE 84 Cb 0.46 0.93 0.00 0.00 0.54 0.00 0.00 39.64 41.57 2vxf n ILE 84 CO 0.00 0.00 0.00 0.80 -2.50 0.00 0.00 176.55 174.85