#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 2.52 0.05 3.23 2.12 -1.26 -5.12 118.70 120.24 2vxf s GLU -1 Ca 0.00 -0.81 0.02 0.00 0.36 0.00 0.00 54.97 54.54 2vxf s GLU -1 Cb 0.00 -2.51 -0.04 0.00 0.26 0.00 0.00 34.13 31.84 2vxf s GLU -1 CO 0.00 0.56 0.10 0.34 -0.54 0.00 0.00 175.26 175.72 2vxf s ASP 0 N -1.99 5.69 0.39 -1.70 2.15 -1.26 -5.00 116.67 114.94 2vxf s ASP 0 Ca 0.22 0.08 0.09 0.00 0.43 0.00 0.00 52.55 53.37 2vxf s ASP 0 Cb -0.11 -1.59 0.79 0.00 -0.30 0.00 0.00 42.92 41.70 2vxf s ASP 0 CO 0.14 0.20 1.94 -0.65 -0.17 0.00 0.00 175.17 176.63 2vxf h PRO 1 N 3.51 0.29 -0.06 4.34 0.11 -2.00 -2.55 132.00 135.63 2vxf h PRO 1 Ca -0.47 -0.06 -0.07 0.00 0.11 0.00 0.00 66.00 65.51 2vxf h PRO 1 Cb 1.17 -0.05 -0.01 0.00 0.11 0.00 0.00 31.00 32.22 2vxf h PRO 1 CO 0.66 0.38 -0.31 0.66 -0.21 0.00 0.00 178.00 179.18 2vxf h SER 2 N 0.28 0.10 -0.06 -2.05 4.64 -1.95 -2.65 113.55 111.87 2vxf h SER 2 Ca 0.06 -0.03 -0.12 0.00 -0.47 0.00 0.00 61.79 61.23 2vxf h SER 2 Cb 0.31 -0.03 -0.01 0.00 -0.31 0.00 0.00 62.40 62.35 2vxf h SER 2 CO 0.01 0.41 -0.33 1.23 -0.87 0.00 0.00 176.83 177.29 2vxf h GLY 3 N 1.00 0.59 1.54 -0.77 0.00 -1.87 -2.96 103.07 100.60 2vxf h GLY 3 Ca 0.01 -0.54 -0.13 0.00 0.00 0.00 0.00 47.33 46.67 2vxf h GLY 3 CO 0.04 0.49 -0.42 -1.33 0.00 0.00 0.00 176.54 175.33 2vxf h GLY 4 N 1.04 0.56 -5.11 4.60 0.00 -1.46 -3.43 103.07 99.26 2vxf h GLY 4 Ca 0.05 -0.56 -0.63 0.00 0.00 0.00 0.00 47.33 46.20 2vxf h GLY 4 CO 0.06 0.50 -0.35 -1.59 0.00 0.00 0.00 176.54 175.17 2vxf s THR 5 N -4.21 5.26 0.14 4.70 2.01 -1.09 -4.89 115.64 117.56 2vxf s THR 5 Ca -0.07 0.38 -0.31 0.00 0.31 0.00 0.00 61.69 62.00 2vxf s THR 5 Cb 0.12 -3.57 -0.08 0.00 0.01 0.00 0.00 72.50 68.98 2vxf s THR 5 CO 0.82 0.47 1.37 -2.16 -0.69 0.00 0.00 174.62 174.43 2vxf s PRO 6 N -1.44 4.33 0.27 4.92 0.04 -1.26 -4.84 135.00 137.02 2vxf s PRO 6 Ca 0.24 2.08 0.03 0.00 0.04 0.00 0.00 61.00 63.40 2vxf s PRO 6 Cb -0.14 -3.22 0.36 0.00 0.04 0.00 0.00 34.50 31.54 2vxf s PRO 6 CO 0.13 -0.39 1.66 1.88 0.04 0.00 0.00 177.00 180.32 2vxf h TYR 7 N 6.33 0.45 -3.21 0.56 -1.99 -1.95 -3.43 116.97 113.72 2vxf h TYR 7 Ca -0.43 -0.12 -0.53 0.00 2.00 0.00 0.00 58.73 59.65 2vxf h TYR 7 Cb 1.21 -0.10 0.05 0.00 2.00 0.00 0.00 36.73 39.89 2vxf h TYR 7 CO 0.64 0.72 0.79 0.42 -0.00 0.00 0.00 178.16 180.74 2vxf s ILE 8 N -4.22 2.66 0.00 -2.88 1.01 -1.26 -2.06 121.20 114.45 2vxf s ILE 8 Ca -0.06 0.53 0.00 0.00 0.00 0.00 0.00 60.65 61.12 2vxf s ILE 8 Cb 0.13 -3.34 0.00 0.00 0.01 0.00 0.00 42.46 39.26 2vxf s ILE 8 CO 0.79 0.07 0.00 0.61 0.00 0.00 0.00 174.94 176.41 2vxf n GLY 9 N 2.67 0.70 3.88 6.18 0.00 -0.79 -5.01 105.19 112.82 2vxf n GLY 9 Ca 0.09 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.81 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 -2.92 6.11 -0.04 1.61 0.01 -0.87 -4.88 113.70 112.72 2vxf s SER 10 Ca 0.00 0.16 -0.30 0.00 1.31 0.00 0.00 55.95 57.12 2vxf s SER 10 Cb 0.00 -1.80 -0.03 0.00 0.21 0.00 0.00 66.02 64.40 2vxf s SER 10 CO 0.00 0.14 1.06 -0.54 0.41 0.00 0.00 173.24 174.31 2vxf s LYS 11 N -2.66 4.46 0.03 12.44 1.02 -1.26 -2.19 119.74 131.58 2vxf s LYS 11 Ca 0.33 1.50 0.04 0.00 0.02 0.00 0.00 55.97 57.87 2vxf s LYS 11 Cb -0.12 -3.49 -0.02 0.00 -0.52 0.00 0.00 37.83 33.68 2vxf s LYS 11 CO 0.26 -0.24 -0.13 0.42 -0.92 0.00 0.00 175.35 174.75 2vxf s ILE 12 N 1.56 1.00 -0.12 2.17 1.01 -0.89 -2.45 121.20 123.48 2vxf s ILE 12 Ca 0.52 -0.88 -0.00 0.00 0.00 0.00 0.00 60.65 60.30 2vxf s ILE 12 Cb -0.22 -0.90 -0.02 0.00 0.01 0.00 0.00 42.46 41.33 2vxf s ILE 12 CO 0.24 0.03 -0.11 -0.55 0.00 0.00 0.00 174.94 174.54 2vxf s SER 13 N -0.96 4.19 -0.05 3.58 0.15 -0.80 -2.66 113.70 117.14 2vxf s SER 13 Ca 0.01 -0.25 0.06 0.00 0.70 0.00 0.00 55.95 56.47 2vxf s SER 13 Cb -0.07 -1.48 -0.01 0.00 -1.71 0.00 0.00 66.02 62.75 2vxf s SER 13 CO 0.01 0.21 -0.24 -0.22 1.20 0.00 0.00 173.24 174.20 2vxf s LEU 14 N 0.09 2.04 -0.22 3.45 2.96 -0.53 -2.31 118.68 124.15 2vxf s LEU 14 Ca -0.05 -0.47 -0.05 0.00 -0.22 0.00 0.00 54.13 53.34 2vxf s LEU 14 Cb -0.14 -1.28 -0.02 0.00 0.50 0.00 0.00 46.19 45.24 2vxf s LEU 14 CO 0.04 0.24 0.01 -0.63 -1.32 0.00 0.00 176.35 174.69 2vxf s ILE 15 N -0.19 3.86 0.61 6.68 1.01 -0.74 -1.96 121.20 130.47 2vxf s ILE 15 Ca -0.02 -0.33 0.01 0.00 0.00 0.00 0.00 60.65 60.31 2vxf s ILE 15 Cb -0.13 -2.77 0.06 0.00 0.01 0.00 0.00 42.46 39.64 2vxf s ILE 15 CO 0.03 0.40 0.85 -0.44 0.00 0.00 0.00 174.94 175.77 2vxf s SER 16 N 1.38 4.97 0.62 3.58 0.01 -1.08 -0.64 113.70 122.54 2vxf s SER 16 Ca 0.05 -0.14 0.42 0.00 1.31 0.00 0.00 55.95 57.58 2vxf s SER 16 Cb -0.15 -0.57 2.26 0.00 0.21 0.00 0.00 66.02 67.78 2vxf s SER 16 CO 0.01 -1.38 2.27 0.50 0.41 0.00 0.00 173.24 175.05 2vxf h LYS 17 N -0.13 0.00 -0.57 12.44 1.63 -1.32 -1.46 116.57 127.17 2vxf h LYS 17 Ca -0.40 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.40 2vxf h LYS 17 Cb 1.29 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.92 2vxf h LYS 17 CO 0.48 0.00 0.00 0.00 -3.45 0.00 0.00 179.45 176.48 2vxf n ALA 18 N -2.04 2.78 -2.33 5.00 0.00 -1.26 -4.88 120.51 117.78 2vxf n ALA 18 Ca -0.03 -0.73 -0.18 0.00 0.00 0.00 0.00 53.44 52.50 2vxf n ALA 18 Cb 0.07 -1.01 -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 0.39 -1.80 -4.08 0.00 -0.58 -0.55 -4.94 120.64 109.08 2vxf n GLU 19 Ca 0.12 0.91 -0.32 0.00 -0.42 0.00 0.00 57.16 57.46 2vxf n GLU 19 Cb 0.48 -5.54 -0.07 0.00 -0.57 0.00 0.00 31.44 25.75 2vxf n GLU 19 CO 0.00 0.00 0.00 0.42 -0.48 0.00 0.00 177.13 177.07 2vxf s ILE 20 N -2.89 4.60 -0.23 -3.67 1.01 -1.26 -4.46 121.20 114.30 2vxf s ILE 20 Ca 0.00 -0.61 -0.07 0.00 0.00 0.00 0.00 60.65 59.97 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 0.23 0.04 -0.60 0.00 0.00 0.00 174.94 174.61 2vxf s ARG 21 N -2.09 3.67 -0.07 2.79 3.52 -1.26 -2.64 118.95 122.87 2vxf s ARG 21 Ca 0.26 -0.48 0.02 0.00 -0.13 0.00 0.00 55.73 55.41 2vxf s ARG 21 Cb -0.12 -3.23 -0.02 0.00 -1.56 0.00 0.00 34.95 30.02 2vxf s ARG 21 CO 0.18 -0.07 -0.13 0.71 -0.81 0.00 0.00 175.30 175.18 2vxf s TYR 22 N 1.27 2.75 -0.01 5.12 2.02 -0.83 -2.51 117.35 125.17 2vxf s TYR 22 Ca 0.04 -0.26 0.08 0.00 -0.37 0.00 0.00 57.07 56.56 2vxf s TYR 22 Cb -0.15 -1.69 -0.02 0.00 -0.40 0.00 0.00 41.96 39.70 2vxf s TYR 22 CO 0.03 0.10 -0.25 -1.21 -1.57 0.00 0.00 175.55 172.65 2vxf s GLU 23 N -0.46 2.10 0.24 -0.62 0.41 -0.96 -1.46 118.70 117.95 2vxf s GLU 23 Ca 0.06 -0.93 -0.17 0.00 -0.41 0.00 0.00 54.97 53.51 2vxf s GLU 23 Cb -0.12 -2.06 0.06 0.00 -1.78 0.00 0.00 34.13 30.23 2vxf s GLU 23 CO 0.02 0.56 0.85 0.41 -0.49 0.00 0.00 175.26 176.61 2vxf n GLY 24 N 2.33 0.83 3.59 -1.39 0.00 -1.09 -1.60 105.19 107.85 2vxf n GLY 24 Ca -0.16 -1.17 -0.34 0.00 0.00 0.00 0.00 46.02 44.35 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 4.13 -0.12 -0.61 -1.09 -1.06 -2.09 121.20 118.22 2vxf s ILE 25 Ca 0.18 -0.29 -0.29 0.00 -2.23 0.00 0.00 60.65 58.02 2vxf s ILE 25 Cb -0.03 -2.78 -0.06 0.00 -1.58 0.00 0.00 42.46 38.01 2vxf s ILE 25 CO 0.07 0.54 2.04 -0.22 -1.23 0.00 0.00 174.94 176.14 2vxf s LEU 26 N -0.20 3.89 -0.23 2.97 2.96 -0.93 -2.66 118.68 124.48 2vxf s LEU 26 Ca 0.05 2.16 -0.17 0.00 -0.22 0.00 0.00 54.13 55.95 2vxf s LEU 26 Cb -0.13 -3.52 -0.13 0.00 0.50 0.00 0.00 46.19 42.91 2vxf s LEU 26 CO 0.02 -1.51 -0.14 0.00 -1.32 0.00 0.00 176.35 173.39 2vxf n TYR 27 N 9.64 0.44 -3.85 5.38 9.36 -1.02 -1.88 117.16 135.22 2vxf n TYR 27 Ca 0.24 0.19 -0.12 0.00 3.32 0.00 0.00 57.90 61.54 2vxf n TYR 27 Cb 0.43 -0.96 -0.12 0.00 -0.63 0.00 0.00 39.34 38.07 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 -2.48 0.04 -0.16 2.97 -4.23 -1.11 -4.85 115.64 105.81 2vxf s THR 28 Ca -0.32 -0.29 0.01 0.00 -1.18 0.00 0.00 61.69 59.90 2vxf s THR 28 Cb 0.10 -0.28 0.00 0.00 1.34 0.00 0.00 72.50 73.66 2vxf s THR 28 CO 0.50 -0.16 -0.17 -0.63 -0.54 0.00 0.00 174.62 173.62 2vxf s ILE 29 N -0.51 2.52 -0.46 2.99 1.01 -1.26 -2.06 121.20 123.43 2vxf s ILE 29 Ca -0.06 -0.81 -0.04 0.00 0.00 0.00 0.00 60.65 59.74 2vxf s ILE 29 Cb -0.04 -2.06 0.12 0.00 0.01 0.00 0.00 42.46 40.50 2vxf s ILE 29 CO 0.01 0.52 0.27 -0.62 0.00 0.00 0.00 174.94 175.12 2vxf s ASP 30 N 0.89 5.32 0.19 3.58 -1.08 -0.84 -4.95 116.67 119.78 2vxf s ASP 30 Ca -0.04 -2.18 -0.03 0.00 -0.52 0.00 0.00 52.55 49.78 2vxf s ASP 30 Cb -0.15 -1.86 0.11 0.00 -1.46 0.00 0.00 42.92 39.56 2vxf s ASP 30 CO -0.02 -0.53 1.49 0.74 0.52 0.00 0.00 175.17 177.38 2vxf h THR 31 N 6.12 1.33 -0.12 1.71 2.02 -1.98 -2.42 112.91 119.57 2vxf h THR 31 Ca -0.12 -1.85 0.03 0.00 0.77 0.00 0.00 66.41 65.25 2vxf h THR 31 Cb 1.03 1.83 -0.00 0.00 -1.74 0.00 0.00 68.15 69.27 2vxf h THR 31 CO 0.72 0.57 0.09 -0.08 0.37 0.00 0.00 175.52 177.19 2vxf h GLU 32 N 0.40 0.00 -0.13 6.66 4.81 -1.94 -1.99 114.58 122.38 2vxf h GLU 32 Ca 0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 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 -4.44 2.64 -3.90 1.04 3.02 -1.23 -4.99 115.26 107.40 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 0.20 -0.25 -0.00 0.00 -0.61 0.00 0.00 39.78 39.12 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 -0.93 -4.12 6.41 2.88 -0.75 -4.87 113.62 111.78 2vxf n SER 34 Ca 0.10 -0.95 -0.17 0.00 -1.33 0.00 0.00 58.87 56.53 2vxf n SER 34 Cb 0.50 -3.35 -0.12 0.00 -0.75 0.00 0.00 64.21 60.48 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 0.90 -0.02 2.46 -4.23 -0.92 -2.28 115.64 107.75 2vxf s THR 35 Ca 0.08 -1.06 0.04 0.00 -1.18 0.00 0.00 61.69 59.57 2vxf s THR 35 Cb -0.04 -0.87 -0.01 0.00 1.34 0.00 0.00 72.50 72.92 2vxf s THR 35 CO 0.87 -0.17 -0.14 -0.69 -0.54 0.00 0.00 174.62 173.95 2vxf s VAL 36 N -1.08 1.14 -0.18 2.29 1.01 -0.91 -1.98 120.40 120.69 2vxf s VAL 36 Ca -0.03 -0.60 -0.03 0.00 0.00 0.00 0.00 61.98 61.32 2vxf s VAL 36 Cb -0.09 -0.96 -0.02 0.00 0.00 0.00 0.00 36.38 35.31 2vxf s VAL 36 CO 0.01 0.33 -0.05 0.00 0.00 0.00 0.00 175.10 175.39 2vxf s ALA 37 N -0.19 2.89 -0.06 5.51 0.00 -0.87 -2.27 121.76 126.76 2vxf s ALA 37 Ca 0.03 -0.96 0.04 0.00 0.00 0.00 0.00 51.96 51.07 2vxf s ALA 37 Cb -0.07 -1.57 -0.02 0.00 0.00 0.00 0.00 23.12 21.46 2vxf s ALA 37 CO 0.00 -0.02 -0.19 -0.51 0.00 0.00 0.00 175.76 175.04 2vxf s LEU 38 N 0.77 2.43 0.33 0.00 1.43 -1.00 -2.43 118.68 120.21 2vxf s LEU 38 Ca -0.02 -0.35 0.09 0.00 -1.03 0.00 0.00 54.13 52.82 2vxf s LEU 38 Cb -0.15 -1.48 -0.05 0.00 0.03 0.00 0.00 46.19 44.55 2vxf s LEU 38 CO 0.02 0.28 0.03 0.00 0.23 0.00 0.00 176.35 176.91 2vxf s ALA 39 N -0.36 3.23 -1.16 4.21 0.00 -1.09 -2.21 121.76 124.38 2vxf s ALA 39 Ca 0.03 -1.91 -0.15 0.00 0.00 0.00 0.00 51.96 49.93 2vxf s ALA 39 Cb -0.12 -0.46 -0.02 0.00 0.00 0.00 0.00 23.12 22.52 2vxf s ALA 39 CO 0.02 0.08 0.78 1.63 0.00 0.00 0.00 175.76 178.27 2vxf n LYS 40 N -0.97 -1.96 -4.63 0.00 5.02 -0.93 -2.56 118.16 112.12 2vxf n LYS 40 Ca -0.04 0.53 -0.30 0.00 -2.02 0.00 0.00 58.31 56.49 2vxf n LYS 40 Cb 0.62 -4.53 -0.14 0.00 -0.02 0.00 0.00 35.03 30.96 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 -3.51 2.21 0.05 -0.18 0.11 -1.01 -4.18 120.40 113.89 2vxf s VAL 41 Ca 0.38 -1.59 0.03 0.00 -2.93 0.00 0.00 61.98 57.88 2vxf s VAL 41 Cb -0.12 -1.92 -0.03 0.00 -1.53 0.00 0.00 36.38 32.78 2vxf s VAL 41 CO 0.84 0.22 -0.11 -0.13 -3.33 0.00 0.00 175.10 172.59 2vxf s ARG 42 N -1.68 0.66 -0.18 1.54 0.52 -0.63 -2.15 118.95 117.03 2vxf s ARG 42 Ca 0.13 -0.84 -0.11 0.00 -0.52 0.00 0.00 55.73 54.39 2vxf s ARG 42 Cb -0.10 -0.53 -0.05 0.00 0.52 0.00 0.00 34.95 34.79 2vxf s ARG 42 CO 0.04 0.11 0.19 -1.54 0.02 0.00 0.00 175.30 174.12 2vxf s SER 43 N -1.63 6.31 0.10 0.23 1.04 -1.26 -2.27 113.70 116.21 2vxf s SER 43 Ca -0.06 0.35 -0.13 0.00 0.48 0.00 0.00 55.95 56.59 2vxf s SER 43 Cb -0.10 -2.12 -0.15 0.00 0.10 0.00 0.00 66.02 63.75 2vxf s SER 43 CO 0.01 0.18 1.31 -0.26 0.98 0.00 0.00 173.24 175.46 2vxf h PHE 44 N 6.47 1.06 0.00 5.02 0.04 -1.90 -3.49 116.94 124.14 2vxf h PHE 44 Ca -0.43 -0.46 0.00 0.00 2.80 0.00 0.00 57.97 59.89 2vxf h PHE 44 Cb 1.16 -0.17 0.00 0.00 2.20 0.00 0.00 35.95 39.15 2vxf h PHE 44 CO 0.61 1.29 0.00 0.41 -0.60 0.00 0.00 178.31 180.02 2vxf n GLY 45 N 0.68 0.92 0.00 -1.45 0.00 -1.26 -5.03 105.19 99.05 2vxf n GLY 45 Ca -0.07 -1.04 0.01 0.00 0.00 0.00 0.00 46.02 44.92 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 0.26 2.61 -2.24 -1.26 -4.32 114.28 108.71 2vxf n THR 46 Ca 0.00 -0.17 0.11 0.00 -2.27 0.00 0.00 64.05 61.72 2vxf n THR 46 Cb 0.00 0.62 0.68 0.00 -2.10 0.00 0.00 70.33 69.53 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 -2.31 114.58 114.38 2vxf h GLU 47 Ca 0.00 0.00 0.02 0.00 -1.00 0.00 0.00 59.36 58.38 2vxf h GLU 47 Cb 0.08 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.32 2vxf h GLU 47 CO 0.00 0.12 0.15 0.22 -1.00 0.00 0.00 179.01 178.50 2vxf h ASP 48 N 0.00 0.20 -3.47 1.42 1.82 -1.93 -3.32 116.42 111.14 2vxf h ASP 48 Ca -0.00 -0.00 -0.61 0.00 -0.39 0.00 0.00 57.03 56.02 2vxf h ASP 48 Cb 0.27 -0.05 -0.40 0.00 0.68 0.00 0.00 39.33 39.83 2vxf h ASP 48 CO 0.02 0.14 -0.73 -0.13 -1.61 0.00 0.00 179.24 176.93 2vxf s ARG 49 N -5.25 1.16 0.27 0.28 1.81 -0.87 -5.11 118.95 111.25 2vxf s ARG 49 Ca -0.06 -1.70 -0.30 0.00 -1.72 0.00 0.00 55.73 51.94 2vxf s ARG 49 Cb 0.18 -2.42 -0.12 0.00 -0.45 0.00 0.00 34.95 32.13 2vxf s ARG 49 CO 0.70 -1.06 1.50 -2.30 -0.68 0.00 0.00 175.30 173.46 2vxf n PRO 50 N 4.08 2.38 -4.32 3.54 -0.02 -1.25 -4.92 135.00 134.49 2vxf n PRO 50 Ca 0.04 0.85 -0.17 0.00 -2.02 0.00 0.00 63.50 62.20 2vxf n PRO 50 Cb 0.38 -2.56 -0.10 0.00 -0.02 0.00 0.00 33.50 31.19 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 -0.11 1.04 -1.86 3.45 -4.23 -1.26 -5.03 115.64 107.65 2vxf s THR 51 Ca 0.65 -2.04 0.28 0.00 -1.18 0.00 0.00 61.69 59.41 2vxf s THR 51 Cb -0.56 -2.30 0.73 0.00 1.34 0.00 0.00 72.50 71.70 2vxf s THR 51 CO 0.50 -0.36 2.01 -0.90 -0.54 0.00 0.00 174.62 175.33 2vxf n ASP 52 N -0.40 0.00 -4.23 3.99 5.68 -1.26 -4.55 116.55 115.78 2vxf n ASP 52 Ca -0.05 -0.69 -0.38 0.00 -0.50 0.00 0.00 54.79 53.17 2vxf n ASP 52 Cb 0.64 -0.07 -0.12 0.00 -1.14 0.00 0.00 41.12 40.43 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 -2.14 2.47 0.28 0.11 3.00 -1.26 -5.08 118.95 116.33 2vxf s ARG 53 Ca 0.38 -1.38 -0.30 0.00 -1.00 0.00 0.00 55.73 53.44 2vxf s ARG 53 Cb 0.19 -3.51 -0.10 0.00 0.00 0.00 0.00 34.95 31.53 2vxf s ARG 53 CO 0.35 -0.80 1.42 -1.25 0.00 0.00 0.00 175.30 175.02 2vxf s PRO 54 N 1.34 4.27 0.03 5.12 0.04 -1.26 -5.02 135.00 139.50 2vxf s PRO 54 Ca 0.01 2.32 0.08 0.00 0.04 0.00 0.00 61.00 63.44 2vxf s PRO 54 Cb -0.21 -3.09 -0.03 0.00 0.04 0.00 0.00 34.50 31.22 2vxf s PRO 54 CO 0.01 -0.39 -0.23 0.42 0.04 0.00 0.00 177.00 176.85 2vxf s ILE 55 N -0.34 2.42 0.34 0.56 -1.09 -1.26 -5.13 121.20 116.70 2vxf s ILE 55 Ca 0.57 -1.23 -0.07 0.00 -2.23 0.00 0.00 60.65 57.69 2vxf s ILE 55 Cb -0.42 -1.96 -0.05 0.00 -1.58 0.00 0.00 42.46 38.45 2vxf s ILE 55 CO 0.47 0.41 0.64 0.00 -1.23 0.00 0.00 174.94 175.23 2vxf s ALA 56 N -0.81 3.52 0.31 9.38 0.00 -1.26 -5.03 121.76 127.86 2vxf s ALA 56 Ca 0.12 -0.44 -0.29 0.00 0.00 0.00 0.00 51.96 51.35 2vxf s ALA 56 Cb -0.10 -2.45 -0.11 0.00 0.00 0.00 0.00 23.12 20.46 2vxf s ALA 56 CO 0.03 0.12 1.48 -2.14 0.00 0.00 0.00 175.76 175.25 2vxf s PRO 57 N -3.73 4.19 -0.03 0.00 0.02 -1.26 -5.02 135.00 129.17 2vxf s PRO 57 Ca 0.47 2.46 -0.00 0.00 0.02 0.00 0.00 61.00 63.94 2vxf s PRO 57 Cb -0.10 -3.04 0.03 0.00 0.02 0.00 0.00 34.50 31.41 2vxf s PRO 57 CO 0.31 -0.49 0.03 1.03 -0.33 0.00 0.00 177.00 177.55 2vxf s ARG 58 N -1.11 0.07 -0.26 5.54 0.52 -1.26 -5.03 118.95 117.42 2vxf s ARG 58 Ca 0.57 0.19 0.09 0.00 -0.52 0.00 0.00 55.73 56.07 2vxf s ARG 58 Cb -0.45 -0.39 0.45 0.00 0.52 0.00 0.00 34.95 35.08 2vxf s ARG 58 CO 0.52 -0.20 1.30 -0.40 0.02 0.00 0.00 175.30 176.54 2vxf n ASP 59 N 4.43 2.67 -4.71 0.23 5.68 -1.26 -5.00 116.55 118.58 2vxf n ASP 59 Ca -0.22 -3.85 -0.24 0.00 -0.50 0.00 0.00 54.79 49.98 2vxf n ASP 59 Cb 0.50 -0.54 -0.06 0.00 -1.14 0.00 0.00 41.12 39.88 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 -3.33 2.56 0.01 0.11 2.12 -1.26 -5.13 118.70 113.79 2vxf s GLU 60 Ca 0.43 -1.18 -0.00 0.00 0.36 0.00 0.00 54.97 54.57 2vxf s GLU 60 Cb 0.39 -2.37 -0.04 0.00 0.26 0.00 0.00 34.13 32.37 2vxf s GLU 60 CO -0.03 0.41 0.12 0.99 -0.54 0.00 0.00 175.26 176.21 2vxf s THR 61 N -2.06 4.94 -0.22 -1.70 2.01 -1.26 -4.82 115.64 112.53 2vxf s THR 61 Ca 0.31 -0.40 -0.09 0.00 0.31 0.00 0.00 61.69 61.81 2vxf s THR 61 Cb -0.08 -3.31 -0.04 0.00 0.01 0.00 0.00 72.50 69.08 2vxf s THR 61 CO 0.21 0.29 0.12 -0.36 -0.69 0.00 0.00 174.62 174.18 2vxf s PHE 62 N -1.29 3.27 0.13 4.92 0.40 -0.91 -4.99 117.98 119.51 2vxf s PHE 62 Ca 0.26 0.11 -0.13 0.00 -0.60 0.00 0.00 56.93 56.57 2vxf s PHE 62 Cb -0.12 -2.20 -0.03 0.00 0.51 0.00 0.00 43.02 41.19 2vxf s PHE 62 CO 0.18 0.06 1.52 0.93 0.70 0.00 0.00 175.22 178.61 2vxf h GLU 63 N 7.27 0.84 -2.66 0.44 5.08 -1.94 -2.67 114.58 120.95 2vxf h GLU 63 Ca -0.38 -0.35 -0.14 0.00 -1.00 0.00 0.00 59.36 57.49 2vxf h GLU 63 Cb 1.17 -0.03 -0.29 0.00 0.50 0.00 0.00 28.75 30.10 2vxf h GLU 63 CO 0.67 0.99 -0.41 -0.47 -1.00 0.00 0.00 179.01 178.79 2vxf s TYR 64 N -4.68 -0.64 0.03 4.33 6.14 -1.26 -2.20 117.35 119.07 2vxf s TYR 64 Ca -0.12 1.30 0.05 0.00 0.64 0.00 0.00 57.07 58.93 2vxf s TYR 64 Cb 0.11 0.19 -0.02 0.00 0.42 0.00 0.00 41.96 42.66 2vxf s TYR 64 CO 0.84 -0.41 -0.14 0.42 0.64 0.00 0.00 175.55 176.89 2vxf s ILE 65 N 2.30 1.14 -0.12 3.14 1.01 -0.94 -5.03 121.20 122.70 2vxf s ILE 65 Ca -0.02 -0.93 -0.02 0.00 0.00 0.00 0.00 60.65 59.67 2vxf s ILE 65 Cb -0.11 -1.01 -0.03 0.00 0.01 0.00 0.00 42.46 41.31 2vxf s ILE 65 CO -0.11 0.07 -0.05 -0.63 0.00 0.00 0.00 174.94 174.22 2vxf s ILE 66 N -0.75 3.83 -0.01 2.92 1.01 -1.26 -2.37 121.20 124.57 2vxf s ILE 66 Ca 0.03 -0.40 0.07 0.00 0.00 0.00 0.00 60.65 60.34 2vxf s ILE 66 Cb -0.07 -2.64 -0.02 0.00 0.01 0.00 0.00 42.46 39.74 2vxf s ILE 66 CO 0.01 0.53 -0.21 -0.36 0.00 0.00 0.00 174.94 174.91 2vxf s PHE 67 N -0.05 1.89 0.11 3.97 0.08 -0.96 -5.03 117.98 117.98 2vxf s PHE 67 Ca 0.01 -0.36 0.04 0.00 0.12 0.00 0.00 56.93 56.74 2vxf s PHE 67 Cb -0.13 -1.20 -0.04 0.00 -0.57 0.00 0.00 43.02 41.07 2vxf s PHE 67 CO 0.03 -0.02 0.11 1.03 -0.10 0.00 0.00 175.22 176.27 2vxf s ARG 68 N -0.57 2.92 0.58 0.44 0.52 -1.26 -2.15 118.95 119.43 2vxf s ARG 68 Ca 0.08 -0.75 0.28 0.00 -0.52 0.00 0.00 55.73 54.82 2vxf s ARG 68 Cb -0.08 -2.71 1.63 0.00 0.52 0.00 0.00 34.95 34.31 2vxf s ARG 68 CO -0.01 0.53 2.09 0.78 0.02 0.00 0.00 175.30 178.72 2vxf h GLY 69 N 2.92 0.00 0.96 -3.53 0.00 -1.79 -2.06 103.07 99.57 2vxf h GLY 69 Ca -0.47 0.00 -0.07 0.00 0.00 0.00 0.00 47.33 46.79 2vxf h GLY 69 CO 0.65 0.00 -0.02 1.48 0.00 0.00 0.00 176.54 178.66 2vxf h SER 70 N 0.00 0.74 0.67 0.19 4.64 -1.94 -3.23 113.55 114.61 2vxf h SER 70 Ca 0.09 -0.32 -0.27 0.00 -0.47 0.00 0.00 61.79 60.83 2vxf h SER 70 Cb 0.52 -0.20 -0.03 0.00 -0.31 0.00 0.00 62.40 62.38 2vxf h SER 70 CO -0.00 0.88 -1.40 -2.24 -0.87 0.00 0.00 176.83 173.19 2vxf h ASP 71 N 0.58 0.10 -3.92 4.97 2.03 -1.81 -3.46 116.42 114.92 2vxf h ASP 71 Ca 0.12 -0.15 -0.52 0.00 -0.73 0.00 0.00 57.03 55.74 2vxf h ASP 71 Cb 0.51 -0.03 0.07 0.00 -0.83 0.00 0.00 39.33 39.05 2vxf h ASP 71 CO 0.02 1.13 0.62 -0.63 -1.03 0.00 0.00 179.24 179.35 2vxf s ILE 72 N -2.64 2.67 -0.20 4.15 1.01 -0.84 -0.87 121.20 124.48 2vxf s ILE 72 Ca -0.04 0.64 -0.02 0.00 0.00 0.00 0.00 60.65 61.23 2vxf s ILE 72 Cb 0.08 -3.39 -0.12 0.00 0.01 0.00 0.00 42.46 39.05 2vxf s ILE 72 CO 0.83 0.12 -0.20 1.17 0.00 0.00 0.00 174.94 176.87 2vxf n LYS 73 N 0.44 0.47 -3.84 2.79 4.81 0.18 -4.80 118.16 118.21 2vxf n LYS 73 Ca 0.02 0.13 -0.12 0.00 -0.87 0.00 0.00 58.31 57.47 2vxf n LYS 73 Cb 0.43 -1.34 -0.10 0.00 0.02 0.00 0.00 35.03 34.03 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 -6.12 -0.06 -0.06 3.14 -1.08 -1.11 -5.02 116.67 106.35 2vxf s ASP 74 Ca -0.27 -0.02 0.02 0.00 -0.52 0.00 0.00 52.55 51.77 2vxf s ASP 74 Cb 0.08 0.27 0.02 0.00 -1.46 0.00 0.00 42.92 41.82 2vxf s ASP 74 CO 0.42 -0.30 -0.10 -0.22 0.52 0.00 0.00 175.17 175.49 2vxf s LEU 75 N -1.00 1.54 0.03 -1.34 0.20 -1.26 -1.79 118.68 115.06 2vxf s LEU 75 Ca -0.11 -0.25 0.03 0.00 0.69 0.00 0.00 54.13 54.49 2vxf s LEU 75 Cb -0.06 -0.73 -0.02 0.00 -0.43 0.00 0.00 46.19 44.96 2vxf s LEU 75 CO 0.02 0.00 -0.09 -0.89 -0.29 0.00 0.00 176.35 175.10 2vxf s THR 76 N 0.77 0.71 0.08 3.68 2.01 -0.98 -5.05 115.64 116.87 2vxf s THR 76 Ca -0.13 -0.79 -0.12 0.00 0.31 0.00 0.00 61.69 60.96 2vxf s THR 76 Cb -0.15 -0.68 -0.06 0.00 0.01 0.00 0.00 72.50 71.62 2vxf s THR 76 CO 0.02 -0.09 0.43 -0.69 -0.69 0.00 0.00 174.62 173.61 2vxf s VAL 77 N -0.81 5.03 -0.22 3.82 1.01 -1.26 -1.91 120.40 126.06 2vxf s VAL 77 Ca -0.02 0.61 0.06 0.00 0.00 0.00 0.00 61.98 62.63 2vxf s VAL 77 Cb -0.07 -3.68 -0.18 0.00 0.00 0.00 0.00 36.38 32.46 2vxf s VAL 77 CO 0.00 0.34 -0.13 0.00 0.00 0.00 0.00 175.10 175.31 2vxf s GLU 79 N -2.47 3.43 0.77 0.00 -1.05 -1.25 -5.06 118.70 113.07 2vxf s GLU 79 Ca -0.25 -0.41 -0.11 0.00 -0.15 0.00 0.00 54.97 54.04 2vxf s GLU 79 Cb 0.07 -3.05 0.05 0.00 -0.44 0.00 0.00 34.13 30.77 2vxf s GLU 79 CO 0.61 0.63 1.09 -1.25 0.95 0.00 0.00 175.26 177.29 2vxf s PRO 80 N -2.34 2.31 0.25 -4.83 0.04 -1.26 -4.95 135.00 124.22 2vxf s PRO 80 Ca 0.33 0.70 -0.30 0.00 0.04 0.00 0.00 61.00 61.77 2vxf s PRO 80 Cb -0.13 -1.94 -0.10 0.00 0.04 0.00 0.00 34.50 32.37 2vxf s PRO 80 CO 0.25 -1.48 1.50 -2.14 0.04 0.00 0.00 177.00 175.18 2vxf s PRO 81 N -5.14 4.22 0.33 0.56 0.02 -1.26 -5.02 135.00 128.70 2vxf s PRO 81 Ca 0.60 2.39 0.07 0.00 0.02 0.00 0.00 61.00 64.08 2vxf s PRO 81 Cb -0.14 -3.09 -0.02 0.00 0.02 0.00 0.00 34.50 31.28 2vxf s PRO 81 CO 0.54 -0.50 0.40 -1.59 -0.33 0.00 0.00 177.00 175.52 2vxf s LYS 82 N -0.27 3.01 0.45 5.54 -2.85 -1.26 -5.07 119.74 119.29 2vxf s LYS 82 Ca 0.62 -1.08 -0.25 0.00 -1.00 0.00 0.00 55.97 54.25 2vxf s LYS 82 Cb -0.44 -2.71 -0.08 0.00 -2.06 0.00 0.00 37.83 32.54 2vxf s LYS 82 CO 0.44 0.11 1.37 -2.14 0.10 0.00 0.00 175.35 175.22 2vxf s PRO 83 N -4.09 3.71 -0.15 1.78 0.02 -1.26 -4.77 135.00 130.24 2vxf s PRO 83 Ca 0.43 2.28 0.07 0.00 0.02 0.00 0.00 61.00 63.79 2vxf s PRO 83 Cb -0.08 -2.63 -0.23 0.00 0.02 0.00 0.00 34.50 31.58 2vxf s PRO 83 CO 0.29 -0.75 0.24 -0.89 -0.33 0.00 0.00 177.00 175.56 2vxf n ILE 84 N -0.21 1.57 -0.68 2.83 -0.00 -1.26 -5.08 119.36 116.53 2vxf n ILE 84 Ca 0.05 -0.73 0.00 0.00 -0.00 0.00 0.00 62.75 62.08 2vxf n ILE 84 Cb 0.43 -1.15 0.00 0.00 -0.00 0.00 0.00 39.64 38.92 2vxf n ILE 84 CO 0.00 0.00 0.00 0.23 -0.00 0.00 0.00 176.55 176.78