#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 -2.54 3.23 2.13 -1.26 -5.10 120.64 117.10 2vxf n GLU -1 Ca 0.00 0.00 -0.34 0.00 0.66 0.00 0.00 57.16 57.48 2vxf n GLU -1 Cb 0.00 -0.07 -0.03 0.00 0.27 0.00 0.00 31.44 31.60 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 -2.93 6.34 0.37 4.31 1.01 -1.26 -4.94 116.67 119.57 2vxf s ASP 0 Ca 0.00 1.93 0.09 0.00 0.71 0.00 0.00 52.55 55.27 2vxf s ASP 0 Cb 0.00 -2.56 0.72 0.00 1.01 0.00 0.00 42.92 42.09 2vxf s ASP 0 CO 0.00 -0.78 1.87 1.55 0.21 0.00 0.00 175.17 178.02 2vxf h PRO 1 N 1.55 0.24 -0.15 8.23 0.13 -1.99 -2.30 132.00 137.71 2vxf h PRO 1 Ca -0.49 -0.06 -0.08 0.00 -0.87 0.00 0.00 66.00 64.49 2vxf h PRO 1 Cb 1.22 -0.03 -0.01 0.00 0.13 0.00 0.00 31.00 32.31 2vxf h PRO 1 CO 0.59 0.42 -0.26 0.77 -0.23 0.00 0.00 178.00 179.29 2vxf h SER 2 N 0.22 0.28 0.30 1.44 0.02 -1.92 -2.58 113.55 111.31 2vxf h SER 2 Ca 0.04 -0.09 -0.07 0.00 -0.84 0.00 0.00 61.79 60.84 2vxf h SER 2 Cb 0.46 -0.08 -0.01 0.00 0.14 0.00 0.00 62.40 62.91 2vxf h SER 2 CO 0.03 0.55 -0.31 1.23 -1.14 0.00 0.00 176.83 177.18 2vxf h GLY 3 N 0.99 0.03 1.38 -3.77 0.00 -1.79 -2.79 103.07 97.12 2vxf h GLY 3 Ca 0.04 -0.02 -0.05 0.00 0.00 0.00 0.00 47.33 47.30 2vxf h GLY 3 CO 0.04 0.02 0.12 -1.33 0.00 0.00 0.00 176.54 175.39 2vxf h GLY 4 N 0.96 0.84 -6.77 4.60 0.00 -1.41 -3.42 103.07 97.87 2vxf h GLY 4 Ca 0.00 -0.48 -0.29 0.00 0.00 0.00 0.00 47.33 46.56 2vxf h GLY 4 CO 0.04 0.45 -0.64 -1.59 0.00 0.00 0.00 176.54 174.80 2vxf s THR 5 N -5.19 -0.18 0.37 4.70 2.01 -1.05 -5.14 115.64 111.15 2vxf s THR 5 Ca -0.09 0.31 -0.26 0.00 0.31 0.00 0.00 61.69 61.96 2vxf s THR 5 Cb 0.16 -0.26 -0.09 0.00 0.01 0.00 0.00 72.50 72.32 2vxf s THR 5 CO 0.79 0.13 1.09 -2.16 -0.69 0.00 0.00 174.62 173.78 2vxf s PRO 6 N 1.95 4.26 0.30 4.92 0.04 -1.25 -4.72 135.00 140.50 2vxf s PRO 6 Ca -0.00 1.65 0.07 0.00 0.04 0.00 0.00 61.00 62.76 2vxf s PRO 6 Cb -0.12 -2.73 0.47 0.00 0.04 0.00 0.00 34.50 32.16 2vxf s PRO 6 CO -0.05 -0.09 1.70 1.88 0.04 0.00 0.00 177.00 180.48 2vxf h TYR 7 N 2.86 0.23 -3.42 0.56 0.05 -1.99 -3.44 116.97 111.81 2vxf h TYR 7 Ca -0.48 -0.06 -0.53 0.00 0.05 0.00 0.00 58.73 57.71 2vxf h TYR 7 Cb 1.22 -0.05 0.06 0.00 1.01 0.00 0.00 36.73 38.97 2vxf h TYR 7 CO 0.57 0.59 0.77 0.42 -1.05 0.00 0.00 178.16 179.47 2vxf s ILE 8 N -4.09 2.54 0.00 -2.88 1.01 -1.26 -2.15 121.20 114.37 2vxf s ILE 8 Ca -0.04 0.46 0.00 0.00 0.00 0.00 0.00 60.65 61.07 2vxf s ILE 8 Cb 0.13 -3.30 0.00 0.00 0.01 0.00 0.00 42.46 39.31 2vxf s ILE 8 CO 0.77 0.08 0.00 0.61 0.00 0.00 0.00 174.94 176.39 2vxf n GLY 9 N 2.04 0.57 3.94 6.18 0.00 -0.69 -5.00 105.19 112.22 2vxf n GLY 9 Ca 0.06 0.00 -0.27 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 -2.86 6.35 0.02 1.61 0.01 -0.91 -4.89 113.70 113.03 2vxf s SER 10 Ca 0.00 0.23 -0.26 0.00 1.31 0.00 0.00 55.95 57.23 2vxf s SER 10 Cb 0.00 -1.94 -0.05 0.00 0.21 0.00 0.00 66.02 64.25 2vxf s SER 10 CO 0.00 0.06 0.81 -0.54 0.41 0.00 0.00 173.24 173.98 2vxf s LYS 11 N -3.12 4.52 0.03 12.44 1.02 -1.26 -2.06 119.74 131.31 2vxf s LYS 11 Ca 0.35 1.13 0.04 0.00 0.02 0.00 0.00 55.97 57.51 2vxf s LYS 11 Cb -0.11 -3.40 -0.02 0.00 -0.52 0.00 0.00 37.83 33.77 2vxf s LYS 11 CO 0.28 0.16 -0.11 0.42 -0.92 0.00 0.00 175.35 175.18 2vxf s ILE 12 N 0.37 0.84 -0.13 2.17 1.01 -0.87 -2.25 121.20 122.35 2vxf s ILE 12 Ca 0.42 -0.90 0.01 0.00 0.00 0.00 0.00 60.65 60.18 2vxf s ILE 12 Cb -0.20 -0.79 -0.01 0.00 0.01 0.00 0.00 42.46 41.46 2vxf s ILE 12 CO 0.24 -0.08 -0.15 -0.55 0.00 0.00 0.00 174.94 174.39 2vxf s SER 13 N -1.10 3.86 -0.05 3.58 0.15 -0.79 -2.64 113.70 116.72 2vxf s SER 13 Ca -0.02 -0.37 0.06 0.00 0.70 0.00 0.00 55.95 56.33 2vxf s SER 13 Cb -0.07 -1.58 -0.01 0.00 -1.71 0.00 0.00 66.02 62.65 2vxf s SER 13 CO 0.01 0.16 -0.23 -0.22 1.20 0.00 0.00 173.24 174.16 2vxf s LEU 14 N 0.35 2.03 -0.22 3.45 2.96 -0.58 -2.25 118.68 124.41 2vxf s LEU 14 Ca -0.12 -0.45 -0.05 0.00 -0.22 0.00 0.00 54.13 53.29 2vxf s LEU 14 Cb -0.16 -1.24 -0.02 0.00 0.50 0.00 0.00 46.19 45.27 2vxf s LEU 14 CO 0.06 0.23 -0.01 -0.63 -1.32 0.00 0.00 176.35 174.68 2vxf s ILE 15 N -0.20 3.67 0.61 6.68 1.01 -0.71 -1.90 121.20 130.36 2vxf s ILE 15 Ca -0.01 -0.39 0.01 0.00 0.00 0.00 0.00 60.65 60.25 2vxf s ILE 15 Cb -0.12 -2.68 0.06 0.00 0.01 0.00 0.00 42.46 39.73 2vxf s ILE 15 CO 0.02 0.41 0.85 -0.44 0.00 0.00 0.00 174.94 175.78 2vxf s SER 16 N 1.40 4.98 0.62 3.58 0.01 -1.08 -1.09 113.70 122.13 2vxf s SER 16 Ca 0.05 -0.12 0.42 0.00 1.31 0.00 0.00 55.95 57.61 2vxf s SER 16 Cb -0.14 -0.60 2.27 0.00 0.21 0.00 0.00 66.02 67.75 2vxf s SER 16 CO -0.01 -1.38 2.28 0.50 0.41 0.00 0.00 173.24 175.04 2vxf h LYS 17 N -0.13 0.00 -0.66 12.44 3.64 -1.14 -1.53 116.57 129.19 2vxf h LYS 17 Ca -0.40 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 58.98 2vxf h LYS 17 Cb 1.29 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.11 2vxf h LYS 17 CO 0.49 0.00 0.00 0.00 -2.27 0.00 0.00 179.45 177.67 2vxf n ALA 18 N -2.04 2.96 -2.27 5.00 0.00 -1.26 -4.88 120.51 118.01 2vxf n ALA 18 Ca -0.03 -0.87 -0.18 0.00 0.00 0.00 0.00 53.44 52.36 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 0.41 -1.78 -4.09 0.00 1.02 -0.58 -4.88 120.64 110.74 2vxf n GLU 19 Ca 0.14 0.92 -0.32 0.00 -0.02 0.00 0.00 57.16 57.88 2vxf n GLU 19 Cb 0.60 -5.52 -0.07 0.00 -0.02 0.00 0.00 31.44 26.43 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 -2.86 4.62 -0.24 -3.67 1.01 -1.26 -4.49 121.20 114.31 2vxf s ILE 20 Ca 0.00 -0.56 -0.07 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 39.28 2vxf s ILE 20 CO 0.00 0.26 0.07 -0.60 0.00 0.00 0.00 174.94 174.67 2vxf s ARG 21 N -1.99 3.71 -0.09 2.79 3.52 -1.26 -2.64 118.95 122.99 2vxf s ARG 21 Ca 0.25 -0.46 0.01 0.00 -0.13 0.00 0.00 55.73 55.41 2vxf s ARG 21 Cb -0.12 -3.32 -0.02 0.00 -1.56 0.00 0.00 34.95 29.93 2vxf s ARG 21 CO 0.17 -0.13 -0.10 0.71 -0.81 0.00 0.00 175.30 175.14 2vxf s TYR 22 N 1.45 2.84 -0.02 5.12 2.02 -0.80 -2.39 117.35 125.57 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 -1.75 -0.02 0.00 -0.40 0.00 0.00 41.96 39.64 2vxf s TYR 22 CO 0.04 0.11 -0.22 -2.00 -1.57 0.00 0.00 175.55 171.91 2vxf s GLU 23 N -0.35 2.23 0.22 -0.62 2.12 -0.95 -1.53 118.70 119.82 2vxf s GLU 23 Ca 0.04 -0.86 -0.18 0.00 0.36 0.00 0.00 54.97 54.33 2vxf s GLU 23 Cb -0.12 -2.16 0.06 0.00 0.26 0.00 0.00 34.13 32.17 2vxf s GLU 23 CO 0.02 0.58 0.87 0.41 -0.54 0.00 0.00 175.26 176.60 2vxf n GLY 24 N 2.30 0.78 3.64 -1.50 0.00 -1.08 -1.57 105.19 107.76 2vxf n GLY 24 Ca -0.16 -1.16 -0.33 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 3.93 -0.17 -0.61 -1.09 -1.10 -2.05 121.20 117.99 2vxf s ILE 25 Ca 0.19 -0.58 -0.29 0.00 -2.23 0.00 0.00 60.65 57.73 2vxf s ILE 25 Cb -0.03 -2.70 -0.04 0.00 -1.58 0.00 0.00 42.46 38.11 2vxf s ILE 25 CO 0.07 0.45 1.80 -0.22 -1.23 0.00 0.00 174.94 175.81 2vxf s LEU 26 N -1.28 3.91 -0.24 2.97 2.96 -0.87 -2.70 118.68 123.42 2vxf s LEU 26 Ca 0.17 1.88 -0.16 0.00 -0.22 0.00 0.00 54.13 55.80 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 -1.36 -0.24 0.00 -1.32 0.00 0.00 176.35 173.50 2vxf n TYR 27 N 8.91 0.24 -3.84 5.38 9.36 -1.06 -1.70 117.16 134.45 2vxf n TYR 27 Ca 0.21 0.10 -0.12 0.00 3.32 0.00 0.00 57.90 61.41 2vxf n TYR 27 Cb 0.44 -0.93 -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 -2.53 0.03 -0.16 2.97 -4.23 -1.12 -4.86 115.64 105.74 2vxf s THR 28 Ca -0.34 -0.24 -0.00 0.00 -1.18 0.00 0.00 61.69 59.93 2vxf s THR 28 Cb 0.11 -0.30 -0.00 0.00 1.34 0.00 0.00 72.50 73.64 2vxf s THR 28 CO 0.49 -0.13 -0.13 -0.63 -0.54 0.00 0.00 174.62 173.67 2vxf s ILE 29 N -0.41 2.81 -0.48 2.99 1.01 -1.26 -2.13 121.20 123.73 2vxf s ILE 29 Ca -0.05 -0.72 -0.04 0.00 0.00 0.00 0.00 60.65 59.85 2vxf s ILE 29 Cb -0.03 -2.20 0.13 0.00 0.01 0.00 0.00 42.46 40.36 2vxf s ILE 29 CO 0.01 0.50 0.29 -0.62 0.00 0.00 0.00 174.94 175.12 2vxf s ASP 30 N 0.85 5.32 0.19 3.58 3.68 -0.80 -4.95 116.67 124.53 2vxf s ASP 30 Ca -0.04 -2.26 -0.04 0.00 2.13 0.00 0.00 52.55 52.34 2vxf s ASP 30 Cb -0.15 -1.86 0.11 0.00 -1.45 0.00 0.00 42.92 39.57 2vxf s ASP 30 CO -0.00 -0.51 1.51 0.74 0.13 0.00 0.00 175.17 177.04 2vxf h THR 31 N 6.01 1.31 -0.11 1.71 2.02 -1.98 -2.41 112.91 119.47 2vxf h THR 31 Ca -0.10 -1.75 0.03 0.00 0.77 0.00 0.00 66.41 65.36 2vxf h THR 31 Cb 1.02 1.71 -0.00 0.00 -1.74 0.00 0.00 68.15 69.14 2vxf h THR 31 CO 0.72 0.55 0.08 -0.08 0.37 0.00 0.00 175.52 177.16 2vxf h GLU 32 N 0.46 0.00 -0.15 6.66 4.81 -1.94 -2.01 114.58 122.42 2vxf h GLU 32 Ca 0.02 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.25 2vxf h GLU 32 Cb 1.06 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.44 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 -4.41 2.70 -3.93 1.04 3.02 -1.22 -4.99 115.26 107.46 2vxf n ASN 33 Ca -0.00 -2.41 -0.27 0.00 -0.03 0.00 0.00 54.58 51.87 2vxf n ASN 33 Cb 0.19 -0.26 -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 -0.24 -2.62 0.00 0.00 177.26 174.40 2vxf n SER 34 N -0.40 -1.55 -4.13 6.41 2.88 -0.76 -4.89 113.62 111.18 2vxf n SER 34 Ca 0.11 -0.93 -0.17 0.00 -1.33 0.00 0.00 58.87 56.54 2vxf n SER 34 Cb 0.50 -3.36 -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 -3.71 0.97 -0.02 2.46 -4.23 -0.92 -2.38 115.64 107.81 2vxf s THR 35 Ca 0.20 -1.15 0.04 0.00 -1.18 0.00 0.00 61.69 59.59 2vxf s THR 35 Cb -0.10 -0.93 -0.01 0.00 1.34 0.00 0.00 72.50 72.80 2vxf s THR 35 CO 0.87 -0.20 -0.13 -0.69 -0.54 0.00 0.00 174.62 173.93 2vxf s VAL 36 N -1.16 1.06 -0.16 2.29 1.01 -0.94 -1.91 120.40 120.59 2vxf s VAL 36 Ca -0.03 -0.55 -0.03 0.00 0.00 0.00 0.00 61.98 61.37 2vxf s VAL 36 Cb -0.09 -0.90 -0.02 0.00 0.00 0.00 0.00 36.38 35.36 2vxf s VAL 36 CO 0.02 0.31 -0.06 0.00 0.00 0.00 0.00 175.10 175.37 2vxf s ALA 37 N -0.14 2.89 -0.05 5.51 0.00 -0.90 -2.25 121.76 126.83 2vxf s ALA 37 Ca 0.02 -0.88 0.05 0.00 0.00 0.00 0.00 51.96 51.14 2vxf s ALA 37 Cb -0.07 -1.51 -0.02 0.00 0.00 0.00 0.00 23.12 21.52 2vxf s ALA 37 CO 0.00 0.13 -0.19 -0.51 0.00 0.00 0.00 175.76 175.19 2vxf s LEU 38 N 0.52 2.43 0.34 0.00 1.43 -0.96 -2.57 118.68 119.87 2vxf s LEU 38 Ca -0.04 -0.33 0.09 0.00 -1.03 0.00 0.00 54.13 52.81 2vxf s LEU 38 Cb -0.15 -1.47 -0.05 0.00 0.03 0.00 0.00 46.19 44.56 2vxf s LEU 38 CO 0.03 0.31 0.05 0.00 0.23 0.00 0.00 176.35 176.97 2vxf s ALA 39 N -0.54 3.28 -1.19 4.21 0.00 -1.10 -2.21 121.76 124.22 2vxf s ALA 39 Ca 0.07 -1.91 -0.13 0.00 0.00 0.00 0.00 51.96 50.00 2vxf s ALA 39 Cb -0.11 -0.49 -0.01 0.00 0.00 0.00 0.00 23.12 22.51 2vxf s ALA 39 CO 0.01 0.07 0.75 1.63 0.00 0.00 0.00 175.76 178.22 2vxf n LYS 40 N -1.00 -2.30 -4.47 0.00 4.76 -0.95 -2.70 118.16 111.50 2vxf n LYS 40 Ca -0.04 0.54 -0.29 0.00 -2.87 0.00 0.00 58.31 55.65 2vxf n LYS 40 Cb 0.62 -4.59 -0.13 0.00 -1.84 0.00 0.00 35.03 29.08 2vxf n LYS 40 CO 0.00 0.00 0.00 0.54 -1.37 0.00 0.00 177.40 176.57 2vxf s VAL 41 N -3.55 2.17 0.02 -0.18 0.11 -1.02 -4.22 120.40 113.73 2vxf s VAL 41 Ca 0.33 -1.66 0.00 0.00 -2.93 0.00 0.00 61.98 57.72 2vxf s VAL 41 Cb -0.10 -1.91 -0.02 0.00 -1.53 0.00 0.00 36.38 32.82 2vxf s VAL 41 CO 0.84 0.12 -0.03 0.00 -3.33 0.00 0.00 175.10 172.70 2vxf s ARG 42 N -1.88 0.33 -0.16 1.54 1.70 -0.61 -2.01 118.95 117.86 2vxf s ARG 42 Ca 0.13 -0.63 -0.12 0.00 -0.47 0.00 0.00 55.73 54.64 2vxf s ARG 42 Cb -0.10 0.08 -0.05 0.00 -0.57 0.00 0.00 34.95 34.31 2vxf s ARG 42 CO 0.05 -0.04 0.23 -1.54 -1.08 0.00 0.00 175.30 172.92 2vxf s SER 43 N -1.48 6.39 0.11 -2.89 1.04 -1.26 -2.23 113.70 113.38 2vxf s SER 43 Ca -0.15 0.45 -0.13 0.00 0.48 0.00 0.00 55.95 56.60 2vxf s SER 43 Cb -0.10 -2.15 -0.14 0.00 0.10 0.00 0.00 66.02 63.74 2vxf s SER 43 CO -0.01 0.18 1.33 -0.26 0.98 0.00 0.00 173.24 175.46 2vxf h PHE 44 N 6.31 1.07 0.00 5.02 0.04 -1.88 -3.49 116.94 124.02 2vxf h PHE 44 Ca -0.44 -0.45 0.00 0.00 2.80 0.00 0.00 57.97 59.89 2vxf h PHE 44 Cb 1.17 -0.18 0.00 0.00 2.20 0.00 0.00 35.95 39.15 2vxf h PHE 44 CO 0.62 1.28 0.00 0.41 -0.60 0.00 0.00 178.31 180.02 2vxf n GLY 45 N 0.61 1.11 0.11 -1.45 0.00 -1.26 -5.01 105.19 99.30 2vxf n GLY 45 Ca -0.07 -1.02 0.01 0.00 0.00 0.00 0.00 46.02 44.94 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 0.34 0.18 2.61 -2.24 -1.26 -4.31 114.28 108.99 2vxf n THR 46 Ca 0.00 -0.67 0.03 0.00 -2.27 0.00 0.00 64.05 61.14 2vxf n THR 46 Cb 0.00 0.86 0.40 0.00 -2.10 0.00 0.00 70.33 69.49 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 0.46 0.05 -0.35 -0.78 4.81 -1.95 -2.84 114.58 113.97 2vxf h GLU 47 Ca 0.00 -0.01 -0.01 0.00 -0.13 0.00 0.00 59.36 59.21 2vxf h GLU 47 Cb 0.25 -0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.61 2vxf h GLU 47 CO 0.00 0.32 0.19 0.22 -0.73 0.00 0.00 179.01 179.01 2vxf h ASP 48 N 0.04 0.42 -2.58 1.04 -0.00 -1.91 -3.36 116.42 110.08 2vxf h ASP 48 Ca 0.01 -0.02 -0.52 0.00 -0.00 0.00 0.00 57.03 56.49 2vxf h ASP 48 Cb 0.51 -0.11 -0.38 0.00 -0.00 0.00 0.00 39.33 39.35 2vxf h ASP 48 CO 0.04 0.35 -0.79 -0.13 -0.00 0.00 0.00 179.24 178.70 2vxf s ARG 49 N -5.35 0.38 0.35 0.28 1.81 -1.07 -5.13 118.95 110.22 2vxf s ARG 49 Ca -0.08 -0.85 -0.28 0.00 -1.72 0.00 0.00 55.73 52.79 2vxf s ARG 49 Cb 0.17 -1.14 -0.12 0.00 -0.45 0.00 0.00 34.95 33.42 2vxf s ARG 49 CO 0.73 -1.11 1.42 -2.30 -0.68 0.00 0.00 175.30 173.36 2vxf n PRO 50 N 4.67 2.45 -4.39 3.54 -0.02 -1.24 -4.89 135.00 135.13 2vxf n PRO 50 Ca 0.03 0.86 -0.19 0.00 -2.02 0.00 0.00 63.50 62.18 2vxf n PRO 50 Cb 0.41 -2.54 -0.10 0.00 -0.02 0.00 0.00 33.50 31.24 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 -0.95 1.38 -1.81 3.45 -4.23 -1.26 -5.03 115.64 107.19 2vxf s THR 51 Ca 0.56 -2.08 0.28 0.00 -1.18 0.00 0.00 61.69 59.26 2vxf s THR 51 Cb -0.52 -2.40 0.70 0.00 1.34 0.00 0.00 72.50 71.62 2vxf s THR 51 CO 0.61 -0.31 2.00 0.47 -0.54 0.00 0.00 174.62 176.85 2vxf n ASP 52 N -0.51 0.00 -4.27 3.99 8.00 -1.26 -4.56 116.55 117.94 2vxf n ASP 52 Ca -0.05 -0.63 -0.39 0.00 0.71 0.00 0.00 54.79 54.43 2vxf n ASP 52 Cb 0.64 -0.09 -0.11 0.00 -0.02 0.00 0.00 41.12 41.53 2vxf n ASP 52 CO 0.00 0.00 0.00 -0.60 -0.39 0.00 0.00 177.20 176.21 2vxf s ARG 53 N -2.19 2.59 0.37 -1.24 3.52 -1.26 -5.08 118.95 115.67 2vxf s ARG 53 Ca 0.37 -1.34 -0.28 0.00 -0.13 0.00 0.00 55.73 54.35 2vxf s ARG 53 Cb 0.19 -3.64 -0.10 0.00 -1.56 0.00 0.00 34.95 29.84 2vxf s ARG 53 CO 0.36 -0.83 1.38 -1.25 -0.81 0.00 0.00 175.30 174.15 2vxf s PRO 54 N 1.41 4.14 -0.03 5.12 0.04 -1.26 -5.02 135.00 139.41 2vxf s PRO 54 Ca 0.01 2.35 0.04 0.00 0.04 0.00 0.00 61.00 63.45 2vxf s PRO 54 Cb -0.21 -2.95 -0.03 0.00 0.04 0.00 0.00 34.50 31.35 2vxf s PRO 54 CO 0.02 -0.42 -0.13 0.42 0.04 0.00 0.00 177.00 176.94 2vxf s ILE 55 N -1.16 3.18 0.74 0.56 -1.09 -1.26 -5.11 121.20 117.06 2vxf s ILE 55 Ca 0.53 -0.79 -0.12 0.00 -2.23 0.00 0.00 60.65 58.03 2vxf s ILE 55 Cb -0.42 -2.29 0.04 0.00 -1.58 0.00 0.00 42.46 38.21 2vxf s ILE 55 CO 0.56 0.51 1.11 0.00 -1.23 0.00 0.00 174.94 175.89 2vxf s ALA 56 N -0.82 2.26 1.04 9.38 0.00 -1.26 -4.99 121.76 127.36 2vxf s ALA 56 Ca 0.13 0.42 -0.11 0.00 0.00 0.00 0.00 51.96 52.40 2vxf s ALA 56 Cb -0.11 -3.31 0.21 0.00 0.00 0.00 0.00 23.12 19.91 2vxf s ALA 56 CO 0.03 -1.69 1.09 -2.14 0.00 0.00 0.00 175.76 173.05 2vxf s PRO 57 N -4.56 0.08 0.16 0.00 0.02 -1.26 -4.99 135.00 124.45 2vxf s PRO 57 Ca 0.64 1.18 -0.16 0.00 0.02 0.00 0.00 61.00 62.69 2vxf s PRO 57 Cb -0.19 -1.64 -0.07 0.00 0.02 0.00 0.00 34.50 32.61 2vxf s PRO 57 CO 0.51 -3.15 0.59 1.03 -0.33 0.00 0.00 177.00 175.64 2vxf s ARG 58 N -4.57 4.05 0.00 5.54 0.52 -1.26 -4.91 118.95 118.32 2vxf s ARG 58 Ca 0.67 0.58 0.00 0.00 -0.52 0.00 0.00 55.73 56.47 2vxf s ARG 58 Cb -0.24 -2.93 0.00 0.00 0.52 0.00 0.00 34.95 32.30 2vxf s ARG 58 CO 0.61 0.46 0.00 -3.47 0.02 0.00 0.00 175.30 172.93 2vxf n ASP 59 N 0.82 0.00 -4.11 0.23 -0.08 -1.26 -5.15 116.55 106.99 2vxf n ASP 59 Ca -0.05 0.00 -0.24 0.00 -1.51 0.00 0.00 54.79 52.99 2vxf n ASP 59 Cb 0.52 0.27 -0.09 0.00 2.34 0.00 0.00 41.12 44.16 2vxf n ASP 59 CO 0.00 0.00 0.00 -1.83 0.12 0.00 0.00 177.20 175.49 2vxf s GLU 60 N -1.61 1.85 0.35 -0.67 -1.05 -1.26 -5.17 118.70 111.14 2vxf s GLU 60 Ca 0.00 -2.11 0.07 0.00 -0.15 0.00 0.00 54.97 52.79 2vxf s GLU 60 Cb 0.00 -0.54 -0.02 0.00 -0.44 0.00 0.00 34.13 33.14 2vxf s GLU 60 CO 0.00 -0.45 0.40 0.99 0.95 0.00 0.00 175.26 177.15 2vxf s THR 61 N -3.28 3.64 -0.21 1.83 2.01 -1.26 -4.97 115.64 113.40 2vxf s THR 61 Ca 0.27 -1.17 -0.09 0.00 0.31 0.00 0.00 61.69 61.01 2vxf s THR 61 Cb 0.04 -3.25 -0.04 0.00 0.01 0.00 0.00 72.50 69.25 2vxf s THR 61 CO 0.15 -0.14 0.10 -0.36 -0.69 0.00 0.00 174.62 173.69 2vxf s PHE 62 N -2.27 3.30 0.12 4.92 0.40 -0.85 -4.99 117.98 118.61 2vxf s PHE 62 Ca 0.45 0.14 -0.14 0.00 -0.60 0.00 0.00 56.93 56.78 2vxf s PHE 62 Cb -0.08 -2.16 -0.04 0.00 0.51 0.00 0.00 43.02 41.26 2vxf s PHE 62 CO 0.29 0.13 1.50 0.93 0.70 0.00 0.00 175.22 178.78 2vxf h GLU 63 N 6.99 0.77 -2.61 0.44 4.39 -1.94 -2.70 114.58 119.92 2vxf h GLU 63 Ca -0.38 -0.33 -0.12 0.00 0.34 0.00 0.00 59.36 58.87 2vxf h GLU 63 Cb 1.16 -0.03 -0.28 0.00 -0.10 0.00 0.00 28.75 29.50 2vxf h GLU 63 CO 0.70 0.94 -0.39 -0.47 -1.16 0.00 0.00 179.01 178.63 2vxf s TYR 64 N -4.67 -0.69 0.05 4.33 6.14 -1.26 -2.24 117.35 119.02 2vxf s TYR 64 Ca -0.12 1.37 0.05 0.00 0.64 0.00 0.00 57.07 59.00 2vxf s TYR 64 Cb 0.10 0.23 -0.03 0.00 0.42 0.00 0.00 41.96 42.69 2vxf s TYR 64 CO 0.83 -0.43 -0.14 0.42 0.64 0.00 0.00 175.55 176.87 2vxf s ILE 65 N 2.35 1.07 -0.10 3.14 1.01 -0.94 -5.03 121.20 122.70 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 -1.01 -0.03 0.00 0.01 0.00 0.00 42.46 41.32 2vxf s ILE 65 CO -0.12 -0.13 -0.06 -0.63 0.00 0.00 0.00 174.94 174.01 2vxf s ILE 66 N -1.07 3.75 -0.01 2.92 1.01 -1.26 -2.26 121.20 124.29 2vxf s ILE 66 Ca -0.01 -0.44 0.06 0.00 0.00 0.00 0.00 60.65 60.26 2vxf s ILE 66 Cb -0.09 -2.58 -0.02 0.00 0.01 0.00 0.00 42.46 39.79 2vxf s ILE 66 CO 0.02 0.56 -0.19 -0.36 0.00 0.00 0.00 174.94 174.97 2vxf s PHE 67 N -0.32 1.67 0.09 3.97 0.08 -0.95 -5.04 117.98 117.48 2vxf s PHE 67 Ca 0.05 -0.32 0.03 0.00 0.12 0.00 0.00 56.93 56.80 2vxf s PHE 67 Cb -0.12 -1.06 -0.04 0.00 -0.57 0.00 0.00 43.02 41.23 2vxf s PHE 67 CO 0.02 -0.01 0.12 1.03 -0.10 0.00 0.00 175.22 176.28 2vxf s ARG 68 N -0.55 3.00 0.58 0.44 0.52 -1.26 -2.21 118.95 119.47 2vxf s ARG 68 Ca 0.07 -0.68 0.28 0.00 -0.52 0.00 0.00 55.73 54.89 2vxf s ARG 68 Cb -0.07 -2.78 1.65 0.00 0.52 0.00 0.00 34.95 34.27 2vxf s ARG 68 CO -0.00 0.56 2.11 0.78 0.02 0.00 0.00 175.30 178.77 2vxf h GLY 69 N 3.06 0.00 0.91 -3.53 0.00 -1.81 -2.23 103.07 99.46 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 0.67 0.00 0.05 0.23 0.00 0.00 0.00 176.54 177.49 2vxf h SER 70 N 0.00 0.54 0.80 0.19 0.87 -1.94 -3.21 113.55 110.80 2vxf h SER 70 Ca 0.08 -0.27 -0.24 0.00 -1.23 0.00 0.00 61.79 60.13 2vxf h SER 70 Cb 0.44 -0.14 -0.02 0.00 -0.44 0.00 0.00 62.40 62.23 2vxf h SER 70 CO -0.00 0.67 -1.20 -2.24 -0.53 0.00 0.00 176.83 173.53 2vxf h ASP 71 N 0.39 0.11 -3.50 6.23 3.04 -1.83 -3.45 116.42 117.40 2vxf h ASP 71 Ca 0.10 -0.14 -0.53 0.00 -3.24 0.00 0.00 57.03 53.23 2vxf h ASP 71 Cb 0.37 -0.04 0.06 0.00 -1.04 0.00 0.00 39.33 38.68 2vxf h ASP 71 CO 0.01 1.11 0.73 -0.63 -2.04 0.00 0.00 179.24 178.41 2vxf s ILE 72 N -2.67 2.70 -0.20 4.15 1.01 -0.91 -0.54 121.20 124.74 2vxf s ILE 72 Ca -0.02 0.61 0.02 0.00 0.00 0.00 0.00 60.65 61.26 2vxf s ILE 72 Cb 0.09 -3.39 -0.13 0.00 0.01 0.00 0.00 42.46 39.04 2vxf s ILE 72 CO 0.83 0.11 -0.17 1.17 0.00 0.00 0.00 174.94 176.88 2vxf n LYS 73 N 1.98 0.51 -3.88 2.79 4.81 -0.25 -4.83 118.16 119.29 2vxf n LYS 73 Ca 0.05 0.11 -0.11 0.00 -0.87 0.00 0.00 58.31 57.49 2vxf n LYS 73 Cb 0.41 -1.39 -0.13 0.00 0.02 0.00 0.00 35.03 33.94 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 -5.89 0.01 -0.07 3.14 2.15 -1.12 -5.03 116.67 109.87 2vxf s ASP 74 Ca -0.26 -0.05 0.01 0.00 0.43 0.00 0.00 52.55 52.69 2vxf s ASP 74 Cb 0.07 0.10 0.02 0.00 -0.30 0.00 0.00 42.92 42.81 2vxf s ASP 74 CO 0.46 -0.10 -0.09 -0.22 -0.17 0.00 0.00 175.17 175.05 2vxf s LEU 75 N -0.37 1.44 -0.02 -1.34 0.20 -1.26 -1.74 118.68 115.59 2vxf s LEU 75 Ca -0.04 -0.25 0.04 0.00 0.69 0.00 0.00 54.13 54.56 2vxf s LEU 75 Cb -0.03 -0.73 -0.01 0.00 -0.43 0.00 0.00 46.19 44.99 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 0.99 1.07 -0.04 3.68 2.01 -0.95 -5.05 115.64 117.35 2vxf s THR 76 Ca -0.09 -0.57 -0.04 0.00 0.31 0.00 0.00 61.69 61.31 2vxf s THR 76 Cb -0.15 -0.90 -0.04 0.00 0.01 0.00 0.00 72.50 71.42 2vxf s THR 76 CO 0.00 0.31 0.15 -0.69 -0.69 0.00 0.00 174.62 173.69 2vxf s VAL 77 N -0.22 5.30 -0.06 3.82 1.01 -1.26 -1.88 120.40 127.09 2vxf s VAL 77 Ca 0.03 -0.10 -0.03 0.00 0.00 0.00 0.00 61.98 61.89 2vxf s VAL 77 Cb -0.06 -3.41 -0.27 0.00 0.00 0.00 0.00 36.38 32.64 2vxf s VAL 77 CO -0.00 0.42 0.59 0.00 0.00 0.00 0.00 175.10 176.11 2vxf s GLU 79 N -2.58 4.04 0.63 0.00 0.41 -1.26 -5.03 118.70 114.90 2vxf s GLU 79 Ca -0.15 0.80 -0.16 0.00 -0.41 0.00 0.00 54.97 55.06 2vxf s GLU 79 Cb 0.07 -3.71 -0.02 0.00 -1.78 0.00 0.00 34.13 28.69 2vxf s GLU 79 CO 0.81 -0.71 1.10 -1.25 -0.49 0.00 0.00 175.26 174.72 2vxf s PRO 80 N 3.13 3.01 0.78 0.39 0.04 -1.26 -5.00 135.00 136.08 2vxf s PRO 80 Ca 0.37 1.36 -0.13 0.00 0.04 0.00 0.00 61.00 62.64 2vxf s PRO 80 Cb -0.14 -1.98 0.07 0.00 0.04 0.00 0.00 34.50 32.49 2vxf s PRO 80 CO 0.12 -1.08 1.16 -2.14 0.04 0.00 0.00 177.00 175.10 2vxf s PRO 81 N -4.00 1.93 0.17 0.56 0.02 -1.26 -5.00 135.00 127.41 2vxf s PRO 81 Ca 0.67 1.57 -0.20 0.00 0.02 0.00 0.00 61.00 63.05 2vxf s PRO 81 Cb -0.19 -1.83 -0.08 0.00 0.02 0.00 0.00 34.50 32.42 2vxf s PRO 81 CO 0.39 -1.95 0.68 0.21 -0.33 0.00 0.00 177.00 175.99 2vxf s LYS 82 N -4.28 4.28 0.19 5.54 2.20 -1.26 -5.02 119.74 121.39 2vxf s LYS 82 Ca 0.69 0.86 -0.30 0.00 -0.36 0.00 0.00 55.97 56.86 2vxf s LYS 82 Cb -0.25 -3.05 -0.09 0.00 -1.51 0.00 0.00 37.83 32.93 2vxf s LYS 82 CO 0.50 0.50 1.39 -1.25 -0.36 0.00 0.00 175.35 176.13 2vxf s PRO 83 N -1.60 4.32 -0.01 4.03 0.04 -1.26 -5.02 135.00 135.49 2vxf s PRO 83 Ca 0.38 2.16 0.04 0.00 0.04 0.00 0.00 61.00 63.62 2vxf s PRO 83 Cb -0.19 -3.18 -0.01 0.00 0.04 0.00 0.00 34.50 31.17 2vxf s PRO 83 CO 0.21 -0.38 -0.13 -1.50 0.04 0.00 0.00 177.00 175.24 2vxf s ILE 84 N 0.40 1.07 -2.70 0.56 1.10 -1.26 -5.27 121.20 115.10 2vxf s ILE 84 Ca 0.60 -0.57 0.22 0.00 -0.51 0.00 0.00 60.65 60.39 2vxf s ILE 84 Cb -0.39 -0.90 0.17 0.00 0.15 0.00 0.00 42.46 41.49 2vxf s ILE 84 CO 0.37 0.31 1.18 0.23 -2.11 0.00 0.00 174.94 174.92