#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 -1.88 -4.08 3.23 2.13 -1.26 -4.92 120.64 113.87 2vxf n GLU -1 Ca 0.00 1.46 -0.31 0.00 0.66 0.00 0.00 57.16 58.97 2vxf n GLU -1 Cb 0.00 -2.22 -0.07 0.00 0.27 0.00 0.00 31.44 29.42 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 -6.16 5.43 0.33 4.31 -0.00 -1.26 -5.01 116.67 114.31 2vxf s ASP 0 Ca 0.00 -0.03 0.06 0.00 -0.00 0.00 0.00 52.55 52.58 2vxf s ASP 0 Cb 0.00 -1.43 0.59 0.00 -0.00 0.00 0.00 42.92 42.07 2vxf s ASP 0 CO 0.00 0.18 1.81 1.55 -0.00 0.00 0.00 175.17 178.71 2vxf h PRO 1 N 3.41 0.35 -0.32 8.23 0.13 -1.91 -2.78 132.00 139.10 2vxf h PRO 1 Ca -0.47 -0.11 -0.10 0.00 -0.87 0.00 0.00 66.00 64.45 2vxf h PRO 1 Cb 1.16 -0.03 -0.01 0.00 0.13 0.00 0.00 31.00 32.25 2vxf h PRO 1 CO 0.64 0.54 -0.21 0.77 -0.23 0.00 0.00 178.00 179.52 2vxf h SER 2 N 0.32 0.61 0.07 1.44 0.02 -1.90 -2.79 113.55 111.32 2vxf h SER 2 Ca 0.06 -0.20 -0.12 0.00 -0.84 0.00 0.00 61.79 60.68 2vxf h SER 2 Cb 0.54 -0.17 -0.01 0.00 0.14 0.00 0.00 62.40 62.90 2vxf h SER 2 CO 0.04 0.82 -0.39 1.23 -1.14 0.00 0.00 176.83 177.38 2vxf h GLY 3 N 0.99 0.46 1.39 -3.77 0.00 -1.91 -3.02 103.07 97.21 2vxf h GLY 3 Ca 0.08 -0.45 -0.11 0.00 0.00 0.00 0.00 47.33 46.85 2vxf h GLY 3 CO 0.05 0.40 -0.24 -1.33 0.00 0.00 0.00 176.54 175.43 2vxf h GLY 4 N 1.12 0.76 -5.48 4.60 0.00 -1.33 -3.43 103.07 99.32 2vxf h GLY 4 Ca 0.03 -0.65 -0.66 0.00 0.00 0.00 0.00 47.33 46.06 2vxf h GLY 4 CO 0.07 0.59 -0.46 -1.59 0.00 0.00 0.00 176.54 175.15 2vxf s THR 5 N -4.57 5.46 0.37 4.70 2.01 -1.08 -5.08 115.64 117.45 2vxf s THR 5 Ca -0.09 0.18 -0.26 0.00 0.31 0.00 0.00 61.69 61.84 2vxf s THR 5 Cb 0.13 -3.45 -0.09 0.00 0.01 0.00 0.00 72.50 69.10 2vxf s THR 5 CO 0.83 0.55 1.09 -2.16 -0.69 0.00 0.00 174.62 174.24 2vxf s PRO 6 N -1.24 4.24 0.28 4.92 0.04 -1.26 -4.83 135.00 137.14 2vxf s PRO 6 Ca 0.18 1.66 0.04 0.00 0.04 0.00 0.00 61.00 62.93 2vxf s PRO 6 Cb -0.12 -2.72 0.39 0.00 0.04 0.00 0.00 34.50 32.09 2vxf s PRO 6 CO 0.08 -0.11 1.67 1.88 0.04 0.00 0.00 177.00 180.56 2vxf h TYR 7 N 2.83 0.38 -3.29 0.56 -1.99 -1.96 -3.44 116.97 110.06 2vxf h TYR 7 Ca -0.48 -0.10 -0.53 0.00 2.00 0.00 0.00 58.73 59.62 2vxf h TYR 7 Cb 1.22 -0.08 0.06 0.00 2.00 0.00 0.00 36.73 39.92 2vxf h TYR 7 CO 0.57 0.68 0.79 0.42 -0.00 0.00 0.00 178.16 180.62 2vxf s ILE 8 N -4.18 2.61 0.00 -2.88 1.01 -1.26 -2.06 121.20 114.44 2vxf s ILE 8 Ca -0.05 0.50 0.00 0.00 0.00 0.00 0.00 60.65 61.10 2vxf s ILE 8 Cb 0.13 -3.32 0.00 0.00 0.01 0.00 0.00 42.46 39.28 2vxf s ILE 8 CO 0.78 0.07 0.00 0.61 0.00 0.00 0.00 174.94 176.41 2vxf n GLY 9 N 2.44 0.62 3.92 6.18 0.00 -0.79 -5.02 105.19 112.54 2vxf n GLY 9 Ca 0.08 0.00 -0.29 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 -2.88 6.38 -0.08 1.61 0.01 -0.88 -4.88 113.70 112.98 2vxf s SER 10 Ca 0.00 0.32 -0.25 0.00 1.31 0.00 0.00 55.95 57.33 2vxf s SER 10 Cb 0.00 -1.98 -0.03 0.00 0.21 0.00 0.00 66.02 64.22 2vxf s SER 10 CO 0.00 0.07 0.78 -0.75 0.41 0.00 0.00 173.24 173.76 2vxf s LYS 11 N -2.90 4.42 0.06 12.44 2.20 -1.26 -1.97 119.74 132.73 2vxf s LYS 11 Ca 0.37 1.01 0.04 0.00 -0.36 0.00 0.00 55.97 57.02 2vxf s LYS 11 Cb -0.12 -3.49 -0.03 0.00 -1.51 0.00 0.00 37.83 32.69 2vxf s LYS 11 CO 0.28 -0.06 -0.12 0.42 -0.36 0.00 0.00 175.35 175.50 2vxf s ILE 12 N 1.21 0.95 -0.11 5.43 1.01 -0.86 -2.55 121.20 126.28 2vxf s ILE 12 Ca 0.40 -1.26 0.01 0.00 0.00 0.00 0.00 60.65 59.81 2vxf s ILE 12 Cb -0.18 -0.96 -0.01 0.00 0.01 0.00 0.00 42.46 41.32 2vxf s ILE 12 CO 0.18 -0.28 -0.16 -0.55 0.00 0.00 0.00 174.94 174.13 2vxf s SER 13 N -1.73 3.79 -0.07 3.58 0.15 -0.79 -2.60 113.70 116.04 2vxf s SER 13 Ca -0.04 -0.37 0.05 0.00 0.70 0.00 0.00 55.95 56.30 2vxf s SER 13 Cb -0.10 -1.45 -0.01 0.00 -1.71 0.00 0.00 66.02 62.75 2vxf s SER 13 CO 0.02 0.19 -0.23 -0.22 1.20 0.00 0.00 173.24 174.20 2vxf s LEU 14 N 0.20 2.20 -0.23 3.45 2.96 -0.46 -2.34 118.68 124.47 2vxf s LEU 14 Ca -0.10 -0.46 -0.06 0.00 -0.22 0.00 0.00 54.13 53.29 2vxf s LEU 14 Cb -0.16 -1.42 -0.03 0.00 0.50 0.00 0.00 46.19 45.09 2vxf s LEU 14 CO 0.06 0.24 0.03 -0.63 -1.32 0.00 0.00 176.35 174.73 2vxf s ILE 15 N -0.14 4.13 0.58 6.68 1.01 -0.76 -1.87 121.20 130.83 2vxf s ILE 15 Ca -0.04 -0.24 0.02 0.00 0.00 0.00 0.00 60.65 60.39 2vxf s ILE 15 Cb -0.14 -2.90 0.05 0.00 0.01 0.00 0.00 42.46 39.48 2vxf s ILE 15 CO 0.04 0.39 0.81 -0.44 0.00 0.00 0.00 174.94 175.73 2vxf s SER 16 N 1.31 5.11 0.61 3.58 0.01 -1.08 0.38 113.70 123.61 2vxf s SER 16 Ca 0.04 -0.15 0.41 0.00 1.31 0.00 0.00 55.95 57.56 2vxf s SER 16 Cb -0.15 -0.63 2.21 0.00 0.21 0.00 0.00 66.02 67.66 2vxf s SER 16 CO 0.02 -1.27 2.25 0.50 0.41 0.00 0.00 173.24 175.15 2vxf h LYS 17 N -0.01 0.00 -0.65 12.44 1.63 -0.34 -1.61 116.57 128.03 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 0.49 0.00 0.00 0.00 -3.45 0.00 0.00 179.45 176.49 2vxf n ALA 18 N -2.03 2.96 -2.28 5.00 0.00 -1.26 -4.88 120.51 118.03 2vxf n ALA 18 Ca -0.03 -0.88 -0.18 0.00 0.00 0.00 0.00 53.44 52.35 2vxf n ALA 18 Cb 0.07 -1.03 -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 0.42 -1.80 -4.13 0.00 4.71 -0.60 -4.66 120.64 114.58 2vxf n GLU 19 Ca 0.14 0.90 -0.33 0.00 -0.01 0.00 0.00 57.16 57.86 2vxf n GLU 19 Cb 0.60 -5.50 -0.07 0.00 -1.01 0.00 0.00 31.44 25.46 2vxf n GLU 19 CO 0.00 0.00 0.00 0.42 0.09 0.00 0.00 177.13 177.64 2vxf s ILE 20 N -2.84 4.61 -0.25 -3.67 1.01 -1.26 -4.49 121.20 114.32 2vxf s ILE 20 Ca 0.00 -0.47 -0.08 0.00 0.00 0.00 0.00 60.65 60.10 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 0.34 0.09 -0.60 0.00 0.00 0.00 174.94 174.77 2vxf s ARG 21 N -1.76 3.76 -0.12 2.79 3.52 -1.26 -2.64 118.95 123.24 2vxf s ARG 21 Ca 0.23 -0.43 -0.01 0.00 -0.13 0.00 0.00 55.73 55.39 2vxf s ARG 21 Cb -0.12 -3.37 -0.02 0.00 -1.56 0.00 0.00 34.95 29.87 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 1.46 2.92 -0.03 5.12 2.02 -0.78 -2.24 117.35 125.81 2vxf s TYR 22 Ca 0.06 -0.32 0.05 0.00 -0.37 0.00 0.00 57.07 56.49 2vxf s TYR 22 Cb -0.15 -1.85 -0.02 0.00 -0.40 0.00 0.00 41.96 39.54 2vxf s TYR 22 CO 0.05 0.01 -0.18 -2.00 -1.57 0.00 0.00 175.55 171.86 2vxf s GLU 23 N 0.03 2.35 0.20 -0.62 -6.30 -0.95 -1.36 118.70 112.05 2vxf s GLU 23 Ca -0.02 -0.79 -0.18 0.00 -2.50 0.00 0.00 54.97 51.48 2vxf s GLU 23 Cb -0.14 -2.26 0.07 0.00 0.00 0.00 0.00 34.13 31.79 2vxf s GLU 23 CO 0.03 0.60 0.88 0.41 0.02 0.00 0.00 175.26 177.21 2vxf n GLY 24 N 2.26 0.75 3.68 -1.50 0.00 -1.07 -1.51 105.19 107.79 2vxf n GLY 24 Ca -0.17 -1.14 -0.35 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 4.35 -0.23 -0.61 -1.09 -1.10 -2.03 121.20 118.36 2vxf s ILE 25 Ca 0.19 -0.23 -0.29 0.00 -2.23 0.00 0.00 60.65 58.10 2vxf s ILE 25 Cb -0.03 -2.84 -0.04 0.00 -1.58 0.00 0.00 42.46 37.98 2vxf s ILE 25 CO 0.06 0.59 1.90 -0.22 -1.23 0.00 0.00 174.94 176.04 2vxf s LEU 26 N -0.76 3.67 -0.23 2.97 2.96 -0.83 -2.85 118.68 123.61 2vxf s LEU 26 Ca 0.12 1.69 -0.17 0.00 -0.22 0.00 0.00 54.13 55.55 2vxf s LEU 26 Cb -0.12 -3.52 -0.13 0.00 0.50 0.00 0.00 46.19 42.92 2vxf s LEU 26 CO 0.02 -1.61 -0.14 0.00 -1.32 0.00 0.00 176.35 173.30 2vxf n TYR 27 N 9.99 0.44 -3.83 5.38 9.36 -1.11 -1.88 117.16 135.50 2vxf n TYR 27 Ca 0.24 0.19 -0.12 0.00 3.32 0.00 0.00 57.90 61.53 2vxf n TYR 27 Cb 0.45 -0.96 -0.12 0.00 -0.63 0.00 0.00 39.34 38.09 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 0.02 -0.15 2.97 -4.23 -1.13 -4.85 115.64 105.80 2vxf s THR 28 Ca -0.32 -0.18 0.00 0.00 -1.18 0.00 0.00 61.69 60.01 2vxf s THR 28 Cb 0.09 -0.27 -0.00 0.00 1.34 0.00 0.00 72.50 73.66 2vxf s THR 28 CO 0.49 -0.10 -0.16 -0.63 -0.54 0.00 0.00 174.62 173.69 2vxf s ILE 29 N -0.29 2.68 -0.52 2.99 1.01 -1.26 -2.10 121.20 123.70 2vxf s ILE 29 Ca -0.04 -0.77 -0.04 0.00 0.00 0.00 0.00 60.65 59.80 2vxf s ILE 29 Cb -0.03 -2.12 0.14 0.00 0.01 0.00 0.00 42.46 40.46 2vxf s ILE 29 CO 0.01 0.52 0.34 -0.62 0.00 0.00 0.00 174.94 175.18 2vxf s ASP 30 N 0.70 5.31 0.16 3.58 -1.08 -0.76 -4.95 116.67 119.63 2vxf s ASP 30 Ca -0.07 -2.43 -0.09 0.00 -0.52 0.00 0.00 52.55 49.43 2vxf s ASP 30 Cb -0.16 -1.86 0.00 0.00 -1.46 0.00 0.00 42.92 39.44 2vxf s ASP 30 CO 0.02 -0.47 1.51 0.74 0.52 0.00 0.00 175.17 177.48 2vxf h THR 31 N 5.80 1.27 -0.02 1.71 2.02 -1.98 -2.45 112.91 119.27 2vxf h THR 31 Ca -0.08 -1.51 0.00 0.00 0.77 0.00 0.00 66.41 65.59 2vxf h THR 31 Cb 1.00 1.33 -0.00 0.00 -1.74 0.00 0.00 68.15 68.74 2vxf h THR 31 CO 0.72 0.51 0.01 -0.33 0.37 0.00 0.00 175.52 176.80 2vxf h GLU 32 N 0.76 0.00 -0.31 6.66 5.08 -1.94 -1.95 114.58 122.88 2vxf h GLU 32 Ca 0.07 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.43 2vxf h GLU 32 Cb 0.93 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.18 2vxf h GLU 32 CO 0.09 0.00 0.00 0.09 -1.00 0.00 0.00 179.01 178.19 2vxf n ASN 33 N -4.43 3.12 -3.98 1.42 3.02 -1.21 -4.98 115.26 108.22 2vxf n ASN 33 Ca -0.03 -2.24 -0.29 0.00 -0.03 0.00 0.00 54.58 51.99 2vxf n ASN 33 Cb 0.10 -0.30 -0.00 0.00 -0.61 0.00 0.00 39.78 38.98 2vxf n ASN 33 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 2vxf n SER 34 N 0.23 -2.45 -4.13 6.41 7.64 -0.73 -4.90 113.62 115.68 2vxf n SER 34 Ca 0.13 -0.92 -0.16 0.00 1.01 0.00 0.00 58.87 58.93 2vxf n SER 34 Cb 0.53 -3.33 -0.12 0.00 -1.01 0.00 0.00 64.21 60.28 2vxf n SER 34 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 2vxf s THR 35 N -3.56 0.89 -0.01 0.44 -4.23 -0.93 -2.28 115.64 105.96 2vxf s THR 35 Ca 0.38 -1.22 0.03 0.00 -1.18 0.00 0.00 61.69 59.70 2vxf s THR 35 Cb -0.20 -0.90 -0.01 0.00 1.34 0.00 0.00 72.50 72.73 2vxf s THR 35 CO 0.87 -0.29 -0.10 -0.69 -0.54 0.00 0.00 174.62 173.87 2vxf s VAL 36 N -1.33 0.79 -0.15 2.29 1.01 -0.95 -1.82 120.40 120.23 2vxf s VAL 36 Ca -0.05 -0.43 -0.02 0.00 0.00 0.00 0.00 61.98 61.48 2vxf s VAL 36 Cb -0.10 -0.66 -0.02 0.00 0.00 0.00 0.00 36.38 35.60 2vxf s VAL 36 CO 0.02 0.22 -0.08 0.00 0.00 0.00 0.00 175.10 175.26 2vxf s ALA 37 N -0.23 2.80 -0.05 5.51 0.00 -0.89 -2.26 121.76 126.64 2vxf s ALA 37 Ca 0.04 -0.90 0.05 0.00 0.00 0.00 0.00 51.96 51.15 2vxf s ALA 37 Cb -0.04 -1.42 -0.02 0.00 0.00 0.00 0.00 23.12 21.64 2vxf s ALA 37 CO -0.00 0.15 -0.19 -0.51 0.00 0.00 0.00 175.76 175.20 2vxf s LEU 38 N 0.50 2.42 0.30 0.00 1.43 -0.97 -2.75 118.68 119.61 2vxf s LEU 38 Ca -0.06 -0.33 0.09 0.00 -1.03 0.00 0.00 54.13 52.80 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 0.31 -0.00 0.00 0.23 0.00 0.00 176.35 176.93 2vxf s ALA 39 N -0.56 3.17 -1.08 4.21 0.00 -1.13 -2.25 121.76 124.12 2vxf s ALA 39 Ca 0.08 -1.81 -0.16 0.00 0.00 0.00 0.00 51.96 50.07 2vxf s ALA 39 Cb -0.11 -0.56 -0.02 0.00 0.00 0.00 0.00 23.12 22.43 2vxf s ALA 39 CO 0.01 0.17 0.81 1.17 0.00 0.00 0.00 175.76 177.91 2vxf n LYS 40 N -0.91 -1.43 -4.62 0.00 4.81 -0.77 -2.70 118.16 112.54 2vxf n LYS 40 Ca -0.05 0.61 -0.29 0.00 -0.87 0.00 0.00 58.31 57.72 2vxf n LYS 40 Cb 0.61 -4.48 -0.14 0.00 0.02 0.00 0.00 35.03 31.04 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 -3.40 2.08 0.06 3.15 0.11 -0.97 -4.16 120.40 117.28 2vxf s VAL 41 Ca 0.43 -1.52 0.04 0.00 -2.93 0.00 0.00 61.98 58.00 2vxf s VAL 41 Cb -0.13 -1.82 -0.03 0.00 -1.53 0.00 0.00 36.38 32.87 2vxf s VAL 41 CO 0.83 0.20 -0.12 -0.13 -3.33 0.00 0.00 175.10 172.56 2vxf s ARG 42 N -1.60 0.70 -0.17 1.54 0.52 -0.57 -2.18 118.95 117.19 2vxf s ARG 42 Ca 0.12 -0.87 -0.12 0.00 -0.52 0.00 0.00 55.73 54.33 2vxf s ARG 42 Cb -0.10 -0.61 -0.05 0.00 0.52 0.00 0.00 34.95 34.71 2vxf s ARG 42 CO 0.04 0.13 0.23 -1.54 0.02 0.00 0.00 175.30 174.17 2vxf s SER 43 N -1.66 6.36 0.09 0.23 1.04 -1.26 -2.23 113.70 116.26 2vxf s SER 43 Ca -0.05 0.41 -0.13 0.00 0.48 0.00 0.00 55.95 56.66 2vxf s SER 43 Cb -0.10 -2.14 -0.17 0.00 0.10 0.00 0.00 66.02 63.70 2vxf s SER 43 CO 0.02 0.15 1.27 -0.26 0.98 0.00 0.00 173.24 175.40 2vxf h PHE 44 N 6.54 1.05 0.00 5.02 0.04 -1.86 -3.49 116.94 124.24 2vxf h PHE 44 Ca -0.42 -0.48 0.00 0.00 2.80 0.00 0.00 57.97 59.87 2vxf h PHE 44 Cb 1.16 -0.15 0.00 0.00 2.20 0.00 0.00 35.95 39.16 2vxf h PHE 44 CO 0.60 1.32 0.00 0.41 -0.60 0.00 0.00 178.31 180.04 2vxf n GLY 45 N 0.78 0.11 0.12 -1.45 0.00 -1.26 -5.01 105.19 98.48 2vxf n GLY 45 Ca -0.08 -1.11 0.01 0.00 0.00 0.00 0.00 46.02 44.84 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 0.62 0.27 2.61 -2.24 -1.26 -4.29 114.28 109.39 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 0.71 0.95 0.00 -2.10 0.00 0.00 70.33 69.88 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 0.43 0.00 -0.31 -0.78 5.08 -1.95 -1.22 114.58 115.83 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 0.38 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.61 2vxf h GLU 47 CO 0.00 0.00 0.18 0.22 -1.00 0.00 0.00 179.01 178.41 2vxf h ASP 48 N 0.00 0.37 -2.34 1.42 -0.00 -1.86 -3.36 116.42 110.64 2vxf h ASP 48 Ca 0.04 -0.02 -0.44 0.00 -0.00 0.00 0.00 57.03 56.61 2vxf h ASP 48 Cb 0.32 -0.09 -0.36 0.00 -0.00 0.00 0.00 39.33 39.20 2vxf h ASP 48 CO -0.00 0.29 -0.73 -0.13 -0.00 0.00 0.00 179.24 178.67 2vxf s ARG 49 N -5.34 0.43 0.32 0.28 1.81 -0.46 -5.06 118.95 110.92 2vxf s ARG 49 Ca -0.07 -0.70 -0.29 0.00 -1.72 0.00 0.00 55.73 52.95 2vxf s ARG 49 Cb 0.17 -0.94 -0.11 0.00 -0.45 0.00 0.00 34.95 33.62 2vxf s ARG 49 CO 0.72 -1.11 1.52 -1.25 -0.68 0.00 0.00 175.30 174.50 2vxf s PRO 50 N 1.76 4.15 0.31 3.54 0.04 -1.25 -4.98 135.00 138.57 2vxf s PRO 50 Ca 0.13 2.52 0.07 0.00 0.04 0.00 0.00 61.00 63.76 2vxf s PRO 50 Cb -0.17 -3.02 -0.06 0.00 0.04 0.00 0.00 34.50 31.29 2vxf s PRO 50 CO -0.18 -0.54 -0.06 0.95 0.04 0.00 0.00 177.00 177.20 2vxf s THR 51 N -0.46 1.83 -1.84 1.26 -4.23 -1.26 -5.02 115.64 105.92 2vxf s THR 51 Ca 0.58 -2.14 0.28 0.00 -1.18 0.00 0.00 61.69 59.23 2vxf s THR 51 Cb -0.46 -2.54 0.71 0.00 1.34 0.00 0.00 72.50 71.55 2vxf s THR 51 CO 0.53 -0.25 2.00 -0.67 -0.54 0.00 0.00 174.62 175.69 2vxf n ASP 52 N -0.67 0.00 -4.26 3.99 2.03 -1.26 -4.54 116.55 111.85 2vxf n ASP 52 Ca -0.05 -0.66 -0.39 0.00 0.52 0.00 0.00 54.79 54.21 2vxf n ASP 52 Cb 0.64 -0.08 -0.11 0.00 -0.72 0.00 0.00 41.12 40.84 2vxf n ASP 52 CO 0.00 0.00 0.00 -0.13 -1.92 0.00 0.00 177.20 175.15 2vxf s ARG 53 N -2.16 2.56 0.40 -0.67 0.52 -1.26 -5.08 118.95 113.26 2vxf s ARG 53 Ca 0.38 -1.35 -0.27 0.00 -0.52 0.00 0.00 55.73 53.97 2vxf s ARG 53 Cb 0.19 -3.61 -0.09 0.00 0.52 0.00 0.00 34.95 31.96 2vxf s ARG 53 CO 0.35 -0.82 1.38 -2.14 0.02 0.00 0.00 175.30 174.09 2vxf s PRO 54 N 1.39 3.98 -0.06 3.54 0.02 -1.26 -5.02 135.00 137.60 2vxf s PRO 54 Ca 0.01 2.34 -0.02 0.00 0.02 0.00 0.00 61.00 63.35 2vxf s PRO 54 Cb -0.21 -2.83 -0.04 0.00 0.02 0.00 0.00 34.50 31.44 2vxf s PRO 54 CO 0.02 -0.55 0.07 0.42 -0.33 0.00 0.00 177.00 176.63 2vxf s ILE 55 N -1.19 4.79 0.69 2.83 -1.09 -1.26 -5.09 121.20 120.88 2vxf s ILE 55 Ca 0.56 -0.20 -0.14 0.00 -2.23 0.00 0.00 60.65 58.63 2vxf s ILE 55 Cb -0.42 -3.11 0.02 0.00 -1.58 0.00 0.00 42.46 37.36 2vxf s ILE 55 CO 0.55 0.50 1.12 0.00 -1.23 0.00 0.00 174.94 175.88 2vxf s ALA 56 N -1.06 2.37 1.03 9.38 0.00 -1.26 -5.00 121.76 127.22 2vxf s ALA 56 Ca 0.18 0.55 -0.12 0.00 0.00 0.00 0.00 51.96 52.58 2vxf s ALA 56 Cb -0.12 -3.33 0.21 0.00 0.00 0.00 0.00 23.12 19.87 2vxf s ALA 56 CO 0.08 -1.45 1.08 -2.14 0.00 0.00 0.00 175.76 173.33 2vxf s PRO 57 N -4.19 0.17 0.27 0.00 0.02 -1.26 -4.93 135.00 125.08 2vxf s PRO 57 Ca 0.67 1.11 -0.30 0.00 0.02 0.00 0.00 61.00 62.50 2vxf s PRO 57 Cb -0.21 -1.66 -0.10 0.00 0.02 0.00 0.00 34.50 32.55 2vxf s PRO 57 CO 0.44 -3.07 1.36 1.03 -0.33 0.00 0.00 177.00 176.43 2vxf s ARG 58 N -4.61 4.33 0.31 5.54 0.52 -1.26 -4.85 118.95 118.93 2vxf s ARG 58 Ca 0.67 2.21 0.00 0.00 -0.52 0.00 0.00 55.73 58.09 2vxf s ARG 58 Cb -0.23 -3.11 0.00 0.00 0.52 0.00 0.00 34.95 32.13 2vxf s ARG 58 CO 0.61 -0.29 0.00 -0.25 0.02 0.00 0.00 175.30 175.39 2vxf n ASP 59 N 1.80 -1.87 -4.62 0.23 8.00 -1.26 -5.15 116.55 113.68 2vxf n ASP 59 Ca 0.04 0.58 -0.26 0.00 0.71 0.00 0.00 54.79 55.85 2vxf n ASP 59 Cb 0.41 1.88 -0.10 0.00 -0.02 0.00 0.00 41.12 43.29 2vxf n ASP 59 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 2vxf s GLU 60 N -1.78 1.98 0.29 -1.24 2.02 -1.26 -5.15 118.70 113.56 2vxf s GLU 60 Ca 0.00 -1.96 0.07 0.00 0.02 0.00 0.00 54.97 53.10 2vxf s GLU 60 Cb 0.00 -1.76 -0.03 0.00 0.10 0.00 0.00 34.13 32.44 2vxf s GLU 60 CO 0.00 0.03 0.33 0.99 0.02 0.00 0.00 175.26 176.63 2vxf s THR 61 N -2.63 4.31 -0.22 3.63 2.01 -1.26 -4.99 115.64 116.48 2vxf s THR 61 Ca 0.35 -1.19 -0.12 0.00 0.31 0.00 0.00 61.69 61.04 2vxf s THR 61 Cb 0.05 -3.46 -0.05 0.00 0.01 0.00 0.00 72.50 69.06 2vxf s THR 61 CO 0.18 -0.25 0.24 -0.36 -0.69 0.00 0.00 174.62 173.75 2vxf s PHE 62 N -2.15 3.34 0.06 4.92 0.40 -0.93 -4.99 117.98 118.63 2vxf s PHE 62 Ca 0.38 0.37 -0.20 0.00 -0.60 0.00 0.00 56.93 56.89 2vxf s PHE 62 Cb -0.08 -2.35 -0.12 0.00 0.51 0.00 0.00 43.02 40.98 2vxf s PHE 62 CO 0.28 0.06 1.40 1.49 0.70 0.00 0.00 175.22 179.15 2vxf h GLU 63 N 7.40 0.39 -2.72 0.44 4.81 -1.94 -2.56 114.58 120.40 2vxf h GLU 63 Ca -0.38 -0.18 -0.16 0.00 -0.13 0.00 0.00 59.36 58.51 2vxf h GLU 63 Cb 1.17 -0.01 -0.30 0.00 0.63 0.00 0.00 28.75 30.24 2vxf h GLU 63 CO 0.68 0.71 -0.44 -0.47 -0.73 0.00 0.00 179.01 178.76 2vxf s TYR 64 N -4.51 -0.57 0.05 0.92 6.14 -1.26 -1.84 117.35 116.27 2vxf s TYR 64 Ca -0.14 1.19 0.04 0.00 0.64 0.00 0.00 57.07 58.81 2vxf s TYR 64 Cb 0.06 0.13 -0.02 0.00 0.42 0.00 0.00 41.96 42.55 2vxf s TYR 64 CO 0.75 -0.39 -0.13 0.42 0.64 0.00 0.00 175.55 176.84 2vxf s ILE 65 N 2.28 1.01 -0.10 3.14 1.01 -0.95 -5.03 121.20 122.57 2vxf s ILE 65 Ca -0.02 -1.06 -0.00 0.00 0.00 0.00 0.00 60.65 59.57 2vxf s ILE 65 Cb -0.11 -0.95 -0.03 0.00 0.01 0.00 0.00 42.46 41.38 2vxf s ILE 65 CO -0.11 -0.10 -0.07 -0.63 0.00 0.00 0.00 174.94 174.03 2vxf s ILE 66 N -1.00 3.65 0.03 2.92 1.01 -1.26 -2.29 121.20 124.26 2vxf s ILE 66 Ca -0.01 -0.48 0.06 0.00 0.00 0.00 0.00 60.65 60.23 2vxf s ILE 66 Cb -0.08 -2.52 -0.02 0.00 0.01 0.00 0.00 42.46 39.84 2vxf s ILE 66 CO 0.01 0.56 -0.18 -0.36 0.00 0.00 0.00 174.94 174.97 2vxf s PHE 67 N -0.38 1.63 0.12 3.97 0.08 -0.96 -5.04 117.98 117.39 2vxf s PHE 67 Ca 0.05 -0.35 0.04 0.00 0.12 0.00 0.00 56.93 56.80 2vxf s PHE 67 Cb -0.12 -0.98 -0.04 0.00 -0.57 0.00 0.00 43.02 41.30 2vxf s PHE 67 CO 0.02 0.05 0.07 1.03 -0.10 0.00 0.00 175.22 176.30 2vxf s ARG 68 N -0.99 2.78 0.58 0.44 0.52 -1.26 -2.24 118.95 118.78 2vxf s ARG 68 Ca 0.06 -0.81 0.28 0.00 -0.52 0.00 0.00 55.73 54.74 2vxf s ARG 68 Cb -0.08 -2.63 1.64 0.00 0.52 0.00 0.00 34.95 34.40 2vxf s ARG 68 CO 0.01 0.52 2.11 0.78 0.02 0.00 0.00 175.30 178.74 2vxf h GLY 69 N 2.99 0.00 0.89 -3.53 0.00 -1.80 -2.13 103.07 99.48 2vxf h GLY 69 Ca -0.47 0.00 -0.04 0.00 0.00 0.00 0.00 47.33 46.82 2vxf h GLY 69 CO 0.63 0.00 0.03 1.76 0.00 0.00 0.00 176.54 178.96 2vxf h SER 70 N 0.00 0.49 0.82 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 60.52 2vxf h SER 70 Cb 0.46 -0.13 -0.03 0.00 0.14 0.00 0.00 62.40 62.85 2vxf h SER 70 CO -0.00 0.65 -1.19 -2.24 -1.14 0.00 0.00 176.83 172.90 2vxf h ASP 71 N 0.32 0.10 -3.98 3.07 2.03 -1.82 -3.46 116.42 112.68 2vxf h ASP 71 Ca 0.09 -0.12 -0.52 0.00 -0.73 0.00 0.00 57.03 55.75 2vxf h ASP 71 Cb 0.38 -0.03 0.09 0.00 -0.83 0.00 0.00 39.33 38.93 2vxf h ASP 71 CO 0.01 1.10 0.57 -0.63 -1.03 0.00 0.00 179.24 179.26 2vxf s ILE 72 N -2.68 2.68 -0.18 4.15 1.01 -0.86 0.40 121.20 125.73 2vxf s ILE 72 Ca -0.02 0.56 -0.02 0.00 0.00 0.00 0.00 60.65 61.18 2vxf s ILE 72 Cb 0.09 -3.31 -0.10 0.00 0.01 0.00 0.00 42.46 39.14 2vxf s ILE 72 CO 0.83 0.04 -0.18 1.17 0.00 0.00 0.00 174.94 176.81 2vxf n LYS 73 N -0.24 0.42 -3.73 2.79 4.81 0.16 -4.72 118.16 117.64 2vxf n LYS 73 Ca 0.06 0.12 -0.13 0.00 -0.87 0.00 0.00 58.31 57.49 2vxf n LYS 73 Cb 0.45 -1.29 -0.08 0.00 0.02 0.00 0.00 35.03 34.14 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 -5.98 -0.22 -0.06 3.14 -1.08 -1.09 -5.02 116.67 106.36 2vxf s ASP 74 Ca -0.24 0.05 0.02 0.00 -0.52 0.00 0.00 52.55 51.86 2vxf s ASP 74 Cb 0.07 0.35 0.01 0.00 -1.46 0.00 0.00 42.92 41.90 2vxf s ASP 74 CO 0.38 -0.52 -0.11 -0.22 0.52 0.00 0.00 175.17 175.21 2vxf s LEU 75 N -1.58 1.60 0.02 -1.34 0.20 -1.26 -1.83 118.68 114.49 2vxf s LEU 75 Ca -0.10 -0.28 0.04 0.00 0.69 0.00 0.00 54.13 54.47 2vxf s LEU 75 Cb -0.03 -0.78 -0.01 0.00 -0.43 0.00 0.00 46.19 44.93 2vxf s LEU 75 CO 0.02 0.02 -0.11 -0.89 -0.29 0.00 0.00 176.35 175.10 2vxf s THR 76 N 0.71 0.89 -0.00 3.68 2.01 -0.99 -5.05 115.64 116.89 2vxf s THR 76 Ca -0.14 -0.71 -0.07 0.00 0.31 0.00 0.00 61.69 61.08 2vxf s THR 76 Cb -0.16 -0.79 -0.05 0.00 0.01 0.00 0.00 72.50 71.52 2vxf s THR 76 CO 0.03 0.08 0.27 -0.69 -0.69 0.00 0.00 174.62 173.62 2vxf s VAL 77 N -0.58 5.30 -0.22 3.82 1.01 -1.26 -1.88 120.40 126.59 2vxf s VAL 77 Ca 0.02 0.21 0.05 0.00 0.00 0.00 0.00 61.98 62.26 2vxf s VAL 77 Cb -0.06 -3.56 -0.20 0.00 0.00 0.00 0.00 36.38 32.56 2vxf s VAL 77 CO 0.00 0.39 -0.05 0.00 0.00 0.00 0.00 175.10 175.44 2vxf s GLU 79 N -2.52 3.70 0.49 0.00 2.02 -1.26 -5.08 118.70 116.06 2vxf s GLU 79 Ca -0.26 -0.50 -0.19 0.00 0.02 0.00 0.00 54.97 54.04 2vxf s GLU 79 Cb 0.08 -3.73 -0.08 0.00 0.10 0.00 0.00 34.13 30.50 2vxf s GLU 79 CO 0.68 -0.32 1.01 -1.25 0.02 0.00 0.00 175.26 175.40 2vxf s PRO 80 N 1.74 3.84 0.59 0.39 0.04 -1.26 -4.92 135.00 135.42 2vxf s PRO 80 Ca 0.06 1.23 -0.18 0.00 0.04 0.00 0.00 61.00 62.16 2vxf s PRO 80 Cb -0.17 -2.11 -0.04 0.00 0.04 0.00 0.00 34.50 32.23 2vxf s PRO 80 CO 0.11 -0.38 1.12 -1.25 0.04 0.00 0.00 177.00 176.64 2vxf s PRO 81 N -3.46 3.14 0.27 0.56 0.04 -1.26 -5.05 135.00 129.24 2vxf s PRO 81 Ca 0.64 1.52 0.06 0.00 0.04 0.00 0.00 61.00 63.27 2vxf s PRO 81 Cb -0.14 -1.98 -0.03 0.00 0.04 0.00 0.00 34.50 32.39 2vxf s PRO 81 CO 0.22 -1.00 0.36 0.15 0.04 0.00 0.00 177.00 176.77 2vxf s LYS 82 N -3.60 3.22 0.40 4.56 1.02 -1.26 -4.91 119.74 119.17 2vxf s LYS 82 Ca 0.70 -0.92 -0.27 0.00 0.02 0.00 0.00 55.97 55.51 2vxf s LYS 82 Cb -0.23 -2.79 -0.09 0.00 -0.52 0.00 0.00 37.83 34.21 2vxf s LYS 82 CO 0.33 0.30 1.39 -2.14 -0.92 0.00 0.00 175.35 174.31 2vxf s PRO 83 N -4.01 3.97 -0.06 -1.68 0.02 -1.26 -4.89 135.00 127.09 2vxf s PRO 83 Ca 0.37 2.36 0.06 0.00 0.02 0.00 0.00 61.00 63.80 2vxf s PRO 83 Cb -0.09 -2.82 -0.01 0.00 0.02 0.00 0.00 34.50 31.60 2vxf s PRO 83 CO 0.29 -0.56 -0.24 0.42 -0.33 0.00 0.00 177.00 176.57 2vxf s ILE 84 N -1.19 1.99 0.00 2.83 1.01 -1.26 -5.17 121.20 119.41 2vxf s ILE 84 Ca 0.56 -1.02 0.00 0.00 0.00 0.00 0.00 60.65 60.19 2vxf s ILE 84 Cb -0.42 -1.69 0.00 0.00 0.01 0.00 0.00 42.46 40.36 2vxf s ILE 84 CO 0.56 0.55 0.23 0.23 0.00 0.00 0.00 174.94 176.51