#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3f6c s LEU 1 N 0.00 3.45 0.27 -3.43 1.02 -1.25 -4.86 118.68 113.87 3f6c s LEU 1 Ca 0.00 1.75 0.09 0.00 0.02 0.00 0.00 54.13 55.99 3f6c s LEU 1 Cb 0.00 -4.52 -0.05 0.00 0.02 0.00 0.00 46.19 41.63 3f6c s LEU 1 CO 0.00 -1.14 -0.14 0.54 0.02 0.00 0.00 176.35 175.63 3f6c s ASN 2 N -3.01 3.17 0.03 2.29 6.03 -1.26 -1.11 114.94 121.08 3f6c s ASN 2 Ca 0.62 -1.08 -0.01 0.00 -1.03 0.00 0.00 52.86 51.36 3f6c s ASN 2 Cb -0.15 -0.24 -0.02 0.00 -3.03 0.00 0.00 41.25 37.81 3f6c s ASN 2 CO 0.40 -0.12 -0.01 0.00 -2.03 0.00 0.00 177.10 175.33 3f6c s ALA 3 N -2.75 0.18 -0.09 3.54 0.00 0.66 -1.31 121.76 121.99 3f6c s ALA 3 Ca 0.28 -0.71 0.02 0.00 0.00 0.00 0.00 51.96 51.55 3f6c s ALA 3 Cb -0.01 0.18 -0.02 0.00 0.00 0.00 0.00 23.12 23.28 3f6c s ALA 3 CO 0.12 -0.22 -0.16 0.42 0.00 0.00 0.00 175.76 175.92 3f6c s ILE 4 N -2.12 2.82 -0.25 0.00 1.01 -0.11 -0.17 121.20 122.38 3f6c s ILE 4 Ca -0.10 -0.78 -0.11 0.00 0.00 0.00 0.00 60.65 59.67 3f6c s ILE 4 Cb -0.05 -2.13 -0.05 0.00 0.01 0.00 0.00 42.46 40.24 3f6c s ILE 4 CO -0.03 0.56 0.19 -0.63 0.00 0.00 0.00 174.94 175.02 3f6c s ILE 5 N -0.08 5.33 -0.41 2.92 1.01 -0.87 -1.36 121.20 127.74 3f6c s ILE 5 Ca -0.03 0.22 0.03 0.00 0.00 0.00 0.00 60.65 60.87 3f6c s ILE 5 Cb -0.14 -3.53 0.11 0.00 0.01 0.00 0.00 42.46 38.92 3f6c s ILE 5 CO 0.04 0.31 0.15 -0.63 0.00 0.00 0.00 174.94 174.81 3f6c s ILE 6 N 1.25 2.21 -0.28 2.92 1.01 0.73 -0.35 121.20 128.69 3f6c s ILE 6 Ca 0.08 -2.65 -0.20 0.00 0.00 0.00 0.00 60.65 57.88 3f6c s ILE 6 Cb -0.14 -2.59 0.09 0.00 0.01 0.00 0.00 42.46 39.83 3f6c s ILE 6 CO 0.06 -0.70 0.76 -0.62 0.00 0.00 0.00 174.94 174.44 3f6c s ASP 7 N 0.47 -0.79 0.00 3.58 -1.08 -0.53 -0.74 116.67 117.59 3f6c s ASP 7 Ca 0.14 1.36 0.24 0.00 -0.52 0.00 0.00 52.55 53.76 3f6c s ASP 7 Cb -0.22 1.35 0.40 0.00 -1.46 0.00 0.00 42.92 43.00 3f6c s ASP 7 CO -0.06 -0.22 1.39 -0.90 0.52 0.00 0.00 175.17 175.89 3f6c n ASP 8 N 3.49 3.11 -4.56 -0.34 5.75 -1.26 -4.36 116.55 118.37 3f6c n ASP 8 Ca -0.17 -1.96 -0.42 0.00 -0.01 0.00 0.00 54.79 52.23 3f6c n ASP 8 Cb 0.57 -0.15 -0.07 0.00 -1.03 0.00 0.00 41.12 40.44 3f6c n ASP 8 CO 0.00 0.00 0.00 -1.00 -0.11 0.00 0.00 177.20 176.09 3f6c s HIS 9 N -1.70 3.13 0.24 2.11 3.76 -1.26 -4.96 115.29 116.61 3f6c s HIS 9 Ca 0.35 0.27 -0.07 0.00 -0.15 0.00 0.00 55.06 55.46 3f6c s HIS 9 Cb 0.21 -3.19 0.41 0.00 1.11 0.00 0.00 32.58 31.13 3f6c s HIS 9 CO 0.31 -0.68 1.66 -1.35 -0.85 0.00 0.00 174.74 173.83 3f6c h PRO 10 N 8.55 0.15 -0.21 8.40 0.11 -2.00 -0.01 132.00 146.99 3f6c h PRO 10 Ca -0.26 -0.01 -0.06 0.00 0.11 0.00 0.00 66.00 65.78 3f6c h PRO 10 Cb 1.11 -0.03 -0.01 0.00 0.11 0.00 0.00 31.00 32.18 3f6c h PRO 10 CO 0.85 0.10 -0.11 1.25 -0.21 0.00 0.00 178.00 179.87 3f6c h LEU 11 N 0.15 0.46 -0.86 2.35 5.85 -2.00 -2.63 115.31 118.63 3f6c h LEU 11 Ca 0.39 -0.42 -0.09 0.00 0.84 0.00 0.00 57.88 58.60 3f6c h LEU 11 Cb 0.68 -0.13 -0.02 0.00 0.37 0.00 0.00 40.66 41.56 3f6c h LEU 11 CO -0.59 0.78 -0.17 0.00 -0.34 0.00 0.00 178.44 178.13 3f6c h ALA 12 N 0.70 1.03 -0.35 1.25 0.00 -1.87 -1.70 119.26 118.32 3f6c h ALA 12 Ca 0.05 -0.33 0.07 0.00 0.00 0.00 0.00 54.91 54.69 3f6c h ALA 12 Cb 0.61 -0.15 -0.06 0.00 0.00 0.00 0.00 17.79 18.19 3f6c h ALA 12 CO 0.03 0.58 -0.02 0.82 0.00 0.00 0.00 179.25 180.66 3f6c h ILE 13 N 0.59 0.71 -0.52 0.00 2.04 -0.88 0.15 117.51 119.61 3f6c h ILE 13 Ca 0.10 -0.02 -0.06 0.00 1.00 0.00 0.00 64.86 65.87 3f6c h ILE 13 Cb 0.62 0.63 -0.02 0.00 -0.74 0.00 0.00 36.82 37.32 3f6c h ILE 13 CO 0.04 0.01 0.08 0.00 0.00 0.00 0.00 178.15 178.28 3f6c h ALA 14 N 1.32 0.69 -0.46 1.87 0.00 -1.20 -1.10 119.26 120.38 3f6c h ALA 14 Ca 0.17 -0.24 -0.05 0.00 0.00 0.00 0.00 54.91 54.79 3f6c h ALA 14 Cb 0.25 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.82 3f6c h ALA 14 CO -0.31 0.43 0.08 0.00 0.00 0.00 0.00 179.25 179.44 3f6c h ALA 15 N 0.98 0.61 -0.42 0.00 0.00 -0.98 -1.06 119.26 118.39 3f6c h ALA 15 Ca 0.16 -0.23 -0.12 0.00 0.00 0.00 0.00 54.91 54.71 3f6c h ALA 15 Cb 0.41 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 3f6c h ALA 15 CO 0.01 0.34 -0.23 0.82 0.00 0.00 0.00 179.25 180.19 3f6c h ILE 16 N 0.63 1.28 -0.42 0.00 2.04 -0.63 -1.32 117.51 119.08 3f6c h ILE 16 Ca 0.14 -1.38 0.01 0.00 1.00 0.00 0.00 64.86 64.63 3f6c h ILE 16 Cb 0.38 1.27 -0.02 0.00 -0.74 0.00 0.00 36.82 37.71 3f6c h ILE 16 CO 0.01 0.47 0.26 -0.09 0.00 0.00 0.00 178.15 178.80 3f6c h ARG 17 N 0.71 0.52 -0.24 2.37 2.43 -1.06 -0.25 114.38 118.85 3f6c h ARG 17 Ca 0.09 -0.03 -0.08 0.00 -0.81 0.00 0.00 59.98 59.15 3f6c h ARG 17 Cb 0.80 -0.12 -0.01 0.00 -0.42 0.00 0.00 29.97 30.22 3f6c h ARG 17 CO 0.07 0.34 -0.18 -0.91 -1.51 0.00 0.00 179.97 177.77 3f6c h ASN 18 N 0.53 0.41 -0.28 -3.80 2.35 -1.11 -1.66 115.58 112.03 3f6c h ASN 18 Ca 0.16 -0.12 -0.06 0.00 -0.55 0.00 0.00 56.30 55.74 3f6c h ASN 18 Cb -0.02 -0.11 -0.01 0.00 0.05 0.00 0.00 38.32 38.23 3f6c h ASN 18 CO -0.06 0.62 -0.05 0.25 -1.65 0.00 0.00 177.43 176.54 3f6c h LEU 19 N 0.39 0.53 -0.20 1.61 5.85 -0.65 -1.91 115.31 120.94 3f6c h LEU 19 Ca 0.07 -0.36 -0.02 0.00 0.84 0.00 0.00 57.88 58.41 3f6c h LEU 19 Cb 0.55 -0.15 -0.01 0.00 0.37 0.00 0.00 40.66 41.42 3f6c h LEU 19 CO 0.04 0.76 0.06 -0.07 -0.34 0.00 0.00 178.44 178.89 3f6c h LEU 20 N 0.30 0.30 -0.90 2.25 3.38 -0.66 -2.52 115.31 117.46 3f6c h LEU 20 Ca 0.07 -0.22 -0.01 0.00 0.09 0.00 0.00 57.88 57.81 3f6c h LEU 20 Cb 0.52 -0.08 -0.04 0.00 0.09 0.00 0.00 40.66 41.15 3f6c h LEU 20 CO 0.03 0.43 0.51 0.40 0.09 0.00 0.00 178.44 179.90 3f6c h ILE 21 N 0.14 1.26 0.00 1.22 2.04 -1.29 -1.04 117.51 119.84 3f6c h ILE 21 Ca 0.06 -0.61 -0.01 0.00 1.00 0.00 0.00 64.86 65.30 3f6c h ILE 21 Cb 0.25 0.03 -0.00 0.00 -0.74 0.00 0.00 36.82 36.36 3f6c h ILE 21 CO -0.00 0.28 -0.05 0.50 0.00 0.00 0.00 178.15 178.88 3f6c h LYS 22 N 1.25 0.00 -0.55 2.37 3.64 -1.19 -2.73 116.57 119.36 3f6c h LYS 22 Ca 0.32 0.00 -0.17 0.00 -1.27 0.00 0.00 60.65 59.53 3f6c h LYS 22 Cb 0.00 0.00 -0.10 0.00 -0.41 0.00 0.00 32.23 31.72 3f6c h LYS 22 CO -0.05 0.05 0.15 0.09 -2.27 0.00 0.00 179.45 177.41 3f6c n ASN 23 N -3.91 4.07 -3.47 4.20 3.02 -0.51 -4.96 115.26 113.71 3f6c n ASN 23 Ca -0.03 -3.30 -0.24 0.00 -0.03 0.00 0.00 54.58 50.98 3f6c n ASN 23 Cb 0.14 -0.68 0.06 0.00 -0.61 0.00 0.00 39.78 38.69 3f6c n ASN 23 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 3f6c n ASP 24 N -0.49 -6.08 -4.27 6.41 2.03 -1.02 -5.00 116.55 108.13 3f6c n ASP 24 Ca 0.35 -0.49 -0.33 0.00 0.52 0.00 0.00 54.79 54.84 3f6c n ASP 24 Cb 1.20 -4.83 -0.15 0.00 -0.72 0.00 0.00 41.12 36.62 3f6c n ASP 24 CO 0.00 0.00 0.00 -0.63 -1.92 0.00 0.00 177.20 174.65 3f6c s ILE 25 N -3.27 2.62 0.26 5.18 1.01 -0.55 -3.90 121.20 122.55 3f6c s ILE 25 Ca 0.51 -0.79 -0.17 0.00 0.00 0.00 0.00 60.65 60.20 3f6c s ILE 25 Cb -0.23 -2.09 -0.08 0.00 0.01 0.00 0.00 42.46 40.06 3f6c s ILE 25 CO 0.63 0.52 0.72 -1.61 0.00 0.00 0.00 174.94 175.20 3f6c s GLU 26 N 0.68 4.13 -0.29 2.79 2.02 -0.27 -3.63 118.70 124.12 3f6c s GLU 26 Ca -0.08 0.76 -0.10 0.00 0.02 0.00 0.00 54.97 55.57 3f6c s GLU 26 Cb -0.16 -2.70 -0.02 0.00 0.10 0.00 0.00 34.13 31.35 3f6c s GLU 26 CO 0.02 0.30 0.15 0.42 0.02 0.00 0.00 175.26 176.17 3f6c s ILE 27 N -1.71 4.73 0.07 -1.63 1.01 -1.26 -0.25 121.20 122.16 3f6c s ILE 27 Ca 0.47 -0.24 0.08 0.00 0.00 0.00 0.00 60.65 60.97 3f6c s ILE 27 Cb -0.14 -3.34 -0.22 0.00 0.01 0.00 0.00 42.46 38.77 3f6c s ILE 27 CO 0.19 0.15 1.08 -0.07 0.00 0.00 0.00 174.94 176.30 3f6c h LEU 28 N 8.34 0.02 -7.00 2.97 3.38 -0.94 -3.47 115.31 118.61 3f6c h LEU 28 Ca -0.34 -0.02 0.06 0.00 0.09 0.00 0.00 57.88 57.67 3f6c h LEU 28 Cb 1.16 -0.00 -0.22 0.00 0.09 0.00 0.00 40.66 41.69 3f6c h LEU 28 CO 0.60 1.02 0.48 0.00 0.09 0.00 0.00 178.44 180.63 3f6c s ALA 29 N -2.67 -1.90 -0.11 1.53 0.00 -1.25 -5.06 121.76 112.29 3f6c s ALA 29 Ca -0.01 1.53 0.02 0.00 0.00 0.00 0.00 51.96 53.50 3f6c s ALA 29 Cb 0.09 -0.56 0.01 0.00 0.00 0.00 0.00 23.12 22.66 3f6c s ALA 29 CO 0.82 -0.33 -0.17 -1.21 0.00 0.00 0.00 175.76 174.87 3f6c s GLU 30 N -1.17 2.42 0.06 0.00 2.02 -1.26 -2.05 118.70 118.71 3f6c s GLU 30 Ca -0.03 -0.64 0.08 0.00 0.02 0.00 0.00 54.97 54.40 3f6c s GLU 30 Cb -0.00 -2.01 -0.03 0.00 0.10 0.00 0.00 34.13 32.18 3f6c s GLU 30 CO 0.03 -0.04 -0.20 -0.51 0.02 0.00 0.00 175.26 174.57 3f6c s LEU 31 N 0.90 2.55 -0.05 1.80 1.43 0.52 -4.99 118.68 120.85 3f6c s LEU 31 Ca -0.08 -0.48 0.08 0.00 -1.03 0.00 0.00 54.13 52.62 3f6c s LEU 31 Cb -0.15 -1.48 0.14 0.00 0.03 0.00 0.00 46.19 44.73 3f6c s LEU 31 CO -0.01 0.24 1.09 0.35 0.23 0.00 0.00 176.35 178.25 3f6c n THR 32 N 1.45 1.34 -3.58 5.49 -2.24 -1.26 -1.45 114.28 114.02 3f6c n THR 32 Ca -0.16 -1.43 -0.11 0.00 -2.27 0.00 0.00 64.05 60.08 3f6c n THR 32 Cb 0.52 0.24 -0.03 0.00 -2.10 0.00 0.00 70.33 68.96 3f6c n THR 32 CO 0.00 0.00 0.00 -1.83 -0.57 0.00 0.00 175.07 172.67 3f6c s GLU 33 N -1.66 1.24 0.06 -0.78 4.04 -1.26 -4.45 118.70 115.88 3f6c s GLU 33 Ca 0.14 -0.66 0.24 0.00 0.04 0.00 0.00 54.97 54.73 3f6c s GLU 33 Cb 0.11 0.53 0.27 0.00 0.02 0.00 0.00 34.13 35.06 3f6c s GLU 33 CO 0.03 -0.52 1.23 0.41 -1.84 0.00 0.00 175.26 174.57 3f6c n GLY 34 N -0.32 -1.30 0.36 -3.83 0.00 0.24 -4.36 105.19 95.99 3f6c n GLY 34 Ca -0.15 -0.33 0.04 0.00 0.00 0.00 0.00 46.02 45.58 3f6c n GLY 34 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 3f6c h GLY 35 N 4.65 1.14 -1.65 -0.02 0.00 -1.81 -2.54 103.07 102.84 3f6c h GLY 35 Ca 0.00 -0.38 0.00 0.00 0.00 0.00 0.00 47.33 46.95 3f6c h GLY 35 CO 0.00 0.30 0.00 1.44 0.00 0.00 0.00 176.54 178.28 3f6c n SER 36 N -4.47 2.97 0.16 0.19 7.64 -1.26 -4.70 113.62 114.15 3f6c n SER 36 Ca 0.11 -1.87 -0.14 0.00 1.01 0.00 0.00 58.87 57.98 3f6c n SER 36 Cb 0.16 -0.21 -0.08 0.00 -1.01 0.00 0.00 64.21 63.08 3f6c n SER 36 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3f6c h ALA 37 N 3.07 -0.34 -0.60 -0.43 0.00 -1.66 -0.82 119.26 118.49 3f6c h ALA 37 Ca 0.00 -0.08 0.01 0.00 0.00 0.00 0.00 54.91 54.84 3f6c h ALA 37 Cb 0.78 0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.67 3f6c h ALA 37 CO 0.00 -0.68 0.39 0.28 0.00 0.00 0.00 179.25 179.24 3f6c h VAL 38 N -0.36 1.13 -0.64 0.00 2.07 -1.84 -0.34 116.25 116.27 3f6c h VAL 38 Ca -0.03 -0.27 -0.04 0.00 0.82 0.00 0.00 66.70 67.17 3f6c h VAL 38 Cb 0.27 0.28 -0.03 0.00 -1.52 0.00 0.00 31.29 30.29 3f6c h VAL 38 CO 0.06 0.14 0.23 -0.61 0.02 0.00 0.00 177.57 177.41 3f6c h GLN 39 N 0.79 0.97 -0.45 1.57 5.75 -1.85 -0.55 115.11 121.35 3f6c h GLN 39 Ca 0.22 -0.19 -0.08 0.00 -0.15 0.00 0.00 58.65 58.45 3f6c h GLN 39 Cb -0.07 -0.15 -0.02 0.00 1.07 0.00 0.00 27.48 28.32 3f6c h GLN 39 CO -0.06 0.84 -0.03 0.00 -2.65 0.00 0.00 178.83 176.92 3f6c h ARG 40 N 0.91 0.81 -0.77 1.69 2.47 -0.68 -1.02 114.38 117.79 3f6c h ARG 40 Ca 0.21 -0.28 -0.02 0.00 -1.26 0.00 0.00 59.98 58.63 3f6c h ARG 40 Cb 0.25 -0.06 -0.04 0.00 -1.65 0.00 0.00 29.97 28.47 3f6c h ARG 40 CO -0.01 0.89 0.40 0.28 0.56 0.00 0.00 179.97 182.08 3f6c h VAL 41 N 0.65 1.24 -0.03 2.04 2.07 -0.98 0.35 116.25 121.59 3f6c h VAL 41 Ca 0.12 -0.64 -0.11 0.00 0.82 0.00 0.00 66.70 66.89 3f6c h VAL 41 Cb 0.54 0.24 -0.01 0.00 -1.52 0.00 0.00 31.29 30.54 3f6c h VAL 41 CO 0.03 0.28 -0.51 -0.33 0.02 0.00 0.00 177.57 177.05 3f6c h GLU 42 N 1.08 0.08 0.04 1.57 5.08 -0.81 -1.05 114.58 120.57 3f6c h GLU 42 Ca 0.27 -0.04 -0.07 0.00 -1.00 0.00 0.00 59.36 58.51 3f6c h GLU 42 Cb 0.08 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.34 3f6c h GLU 42 CO -0.04 0.58 -0.30 1.15 -1.00 0.00 0.00 179.01 179.40 3f6c h THR 43 N 0.06 1.66 0.00 1.13 2.02 -1.00 -3.37 112.91 113.40 3f6c h THR 43 Ca -0.00 -2.31 0.00 0.00 0.77 0.00 0.00 66.41 64.87 3f6c h THR 43 Cb 0.93 3.19 0.00 0.00 -1.74 0.00 0.00 68.15 70.54 3f6c h THR 43 CO 0.07 0.62 -0.44 -0.07 0.37 0.00 0.00 175.52 176.08 3f6c h LEU 44 N -0.70 0.00 -2.73 2.58 3.38 -0.95 -3.49 115.31 113.41 3f6c h LEU 44 Ca -0.05 -0.04 -0.44 0.00 0.09 0.00 0.00 57.88 57.44 3f6c h LEU 44 Cb 1.19 0.00 0.06 0.00 0.09 0.00 0.00 40.66 42.00 3f6c h LEU 44 CO 0.06 0.02 -0.91 0.29 0.09 0.00 0.00 178.44 177.98 3f6c n LYS 45 N -2.66 -2.17 -1.97 1.13 5.02 -0.40 -4.97 118.16 112.13 3f6c n LYS 45 Ca 0.03 0.48 -0.33 0.00 -2.02 0.00 0.00 58.31 56.46 3f6c n LYS 45 Cb 0.51 -4.40 0.02 0.00 -0.02 0.00 0.00 35.03 31.14 3f6c n LYS 45 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 3f6c s PRO 46 N -6.05 3.09 0.23 1.97 0.04 -1.26 -4.96 135.00 128.06 3f6c s PRO 46 Ca 0.31 1.40 0.10 0.00 0.04 0.00 0.00 61.00 62.86 3f6c s PRO 46 Cb -0.11 -1.99 0.16 0.00 0.04 0.00 0.00 34.50 32.60 3f6c s PRO 46 CO 0.86 -1.03 1.49 -0.44 0.04 0.00 0.00 177.00 177.92 3f6c h ASP 47 N 0.47 0.00 -3.77 6.66 3.32 -1.58 -3.45 116.42 118.07 3f6c h ASP 47 Ca -0.48 0.00 -0.45 0.00 0.02 0.00 0.00 57.03 56.12 3f6c h ASP 47 Cb 1.24 0.00 -0.31 0.00 0.22 0.00 0.00 39.33 40.48 3f6c h ASP 47 CO 0.56 0.73 -0.80 -0.63 -1.72 0.00 0.00 179.24 177.38 3f6c s ILE 48 N -3.23 0.89 -0.11 0.35 1.01 -0.55 -0.87 121.20 118.70 3f6c s ILE 48 Ca 0.00 -0.41 0.02 0.00 0.00 0.00 0.00 60.65 60.26 3f6c s ILE 48 Cb 0.11 -0.80 0.02 0.00 0.01 0.00 0.00 42.46 41.80 3f6c s ILE 48 CO 0.77 0.28 -0.14 -0.69 0.00 0.00 0.00 174.94 175.16 3f6c s VAL 49 N 0.26 1.42 -0.27 2.92 1.01 0.46 -0.94 120.40 125.26 3f6c s VAL 49 Ca -0.05 -0.59 -0.10 0.00 0.00 0.00 0.00 61.98 61.24 3f6c s VAL 49 Cb -0.10 -1.31 -0.05 0.00 0.00 0.00 0.00 36.38 34.92 3f6c s VAL 49 CO 0.01 0.43 0.16 -0.63 0.00 0.00 0.00 175.10 175.07 3f6c s ILE 50 N 1.03 5.11 -0.16 2.22 -1.09 -0.46 -1.34 121.20 126.50 3f6c s ILE 50 Ca -0.06 0.10 0.01 0.00 -2.23 0.00 0.00 60.65 58.47 3f6c s ILE 50 Cb -0.15 -3.42 0.03 0.00 -1.58 0.00 0.00 42.46 37.34 3f6c s ILE 50 CO -0.02 0.28 -0.15 -0.63 -1.23 0.00 0.00 174.94 173.20 3f6c s ILE 51 N 1.60 1.68 0.17 2.92 1.01 -0.06 -0.20 121.20 128.33 3f6c s ILE 51 Ca 0.07 -0.76 -0.30 0.00 0.00 0.00 0.00 60.65 59.66 3f6c s ILE 51 Cb -0.15 -1.59 -0.07 0.00 0.01 0.00 0.00 42.46 40.65 3f6c s ILE 51 CO 0.08 0.42 1.02 -0.62 0.00 0.00 0.00 174.94 175.85 3f6c s ASP 52 N 1.43 7.42 0.60 3.58 2.15 0.08 -0.70 116.67 131.24 3f6c s ASP 52 Ca 0.04 1.96 0.38 0.00 0.43 0.00 0.00 52.55 55.36 3f6c s ASP 52 Cb -0.13 -2.60 1.89 0.00 -0.30 0.00 0.00 42.92 41.77 3f6c s ASP 52 CO -0.11 -0.09 2.19 -0.37 -0.17 0.00 0.00 175.17 176.62 3f6c h VAL 53 N 3.72 0.11 -0.45 1.11 -1.51 -1.40 -2.53 116.25 115.30 3f6c h VAL 53 Ca -0.44 -0.27 -0.04 0.00 -1.23 0.00 0.00 66.70 64.73 3f6c h VAL 53 Cb 1.21 1.24 -0.02 0.00 -2.13 0.00 0.00 31.29 31.59 3f6c h VAL 53 CO 0.71 0.02 0.03 0.47 -1.23 0.00 0.00 177.57 177.57 3f6c n ASP 54 N -3.19 4.67 -4.73 4.19 8.00 -1.26 -4.05 116.55 120.18 3f6c n ASP 54 Ca -0.02 -3.05 -0.42 0.00 0.71 0.00 0.00 54.79 52.01 3f6c n ASP 54 Cb 0.18 -0.63 -0.02 0.00 -0.02 0.00 0.00 41.12 40.63 3f6c n ASP 54 CO 0.00 0.00 0.00 2.30 -0.39 0.00 0.00 177.20 179.11 3f6c n ILE 55 N -0.06 1.06 -1.34 0.53 -5.35 -0.95 -4.94 119.36 108.31 3f6c n ILE 55 Ca 0.27 -0.27 -0.29 0.00 -0.27 0.00 0.00 62.75 62.20 3f6c n ILE 55 Cb 1.08 -1.83 0.15 0.00 -1.74 0.00 0.00 39.64 37.31 3f6c n ILE 55 CO 0.00 0.00 0.00 -2.16 -1.76 0.00 0.00 176.55 172.63 3f6c s PRO 56 N -0.57 0.84 3.12 6.28 0.04 -1.26 -4.41 135.00 139.04 3f6c s PRO 56 Ca 0.64 0.44 0.00 0.00 0.04 0.00 0.00 61.00 62.13 3f6c s PRO 56 Cb -0.54 -1.79 0.00 0.00 0.04 0.00 0.00 34.50 32.21 3f6c s PRO 56 CO 0.50 -2.44 0.00 0.41 0.04 0.00 0.00 177.00 175.51 3f6c n GLY 57 N -1.60 0.07 3.65 0.56 0.00 -1.26 -0.59 105.19 106.02 3f6c n GLY 57 Ca 0.06 -1.10 -0.48 0.00 0.00 0.00 0.00 46.02 44.49 3f6c n GLY 57 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3f6c n VAL 58 N 0.00 0.09 -1.66 1.61 0.31 -1.26 -4.81 118.33 112.62 3f6c n VAL 58 Ca 0.00 -0.02 -0.33 0.00 -0.01 0.00 0.00 64.34 63.99 3f6c n VAL 58 Cb 0.00 -1.39 0.06 0.00 -0.91 0.00 0.00 33.84 31.60 3f6c n VAL 58 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 3f6c s ASN 59 N 1.35 5.01 0.19 4.52 2.20 -1.26 -3.94 114.94 123.00 3f6c s ASN 59 Ca 0.83 1.95 -0.12 0.00 -0.94 0.00 0.00 52.86 54.58 3f6c s ASN 59 Cb -0.77 -2.54 0.20 0.00 -2.00 0.00 0.00 41.25 36.14 3f6c s ASN 59 CO 0.43 -1.70 1.75 1.23 -2.94 0.00 0.00 177.10 175.88 3f6c h GLY 60 N -0.21 0.73 1.76 0.45 0.00 -1.77 -0.13 103.07 103.90 3f6c h GLY 60 Ca -0.46 -0.12 -0.14 0.00 0.00 0.00 0.00 47.33 46.62 3f6c h GLY 60 CO 0.54 0.02 -0.55 -2.22 0.00 0.00 0.00 176.54 174.33 3f6c h ILE 61 N 0.39 1.36 -0.61 2.60 1.08 -1.89 -1.93 117.51 118.51 3f6c h ILE 61 Ca 0.26 -1.85 -0.07 0.00 -0.39 0.00 0.00 64.86 62.81 3f6c h ILE 61 Cb 0.28 1.90 -0.02 0.00 -3.07 0.00 0.00 36.82 35.90 3f6c h ILE 61 CO -0.25 0.55 0.11 -0.61 -0.69 0.00 0.00 178.15 177.26 3f6c h GLN 62 N 0.20 1.00 -0.27 2.37 5.75 -1.72 0.08 115.11 122.52 3f6c h GLN 62 Ca 0.00 -0.26 0.02 0.00 -0.15 0.00 0.00 58.65 58.26 3f6c h GLN 62 Cb 1.03 -0.12 -0.02 0.00 1.07 0.00 0.00 27.48 29.43 3f6c h GLN 62 CO 0.09 0.94 0.13 0.28 -2.65 0.00 0.00 178.83 177.61 3f6c h VAL 63 N 0.91 0.98 -0.40 2.39 2.07 -0.66 0.14 116.25 121.68 3f6c h VAL 63 Ca 0.19 -0.09 0.08 0.00 0.82 0.00 0.00 66.70 67.69 3f6c h VAL 63 Cb 0.41 0.69 -0.07 0.00 -1.52 0.00 0.00 31.29 30.79 3f6c h VAL 63 CO 0.01 0.05 -0.09 0.25 0.02 0.00 0.00 177.57 177.81 3f6c h LEU 64 N 0.27 -0.35 -0.55 2.57 5.85 -1.11 -0.35 115.31 121.64 3f6c h LEU 64 Ca 0.11 0.12 -0.06 0.00 0.84 0.00 0.00 57.88 58.89 3f6c h LEU 64 Cb 0.05 0.24 -0.02 0.00 0.37 0.00 0.00 40.66 41.29 3f6c h LEU 64 CO -0.09 -0.12 0.10 -0.33 -0.34 0.00 0.00 178.44 177.66 3f6c h GLU 65 N 0.01 0.90 -0.62 1.25 5.08 -0.41 -2.03 114.58 118.76 3f6c h GLU 65 Ca 0.19 -0.24 -0.08 0.00 -1.00 0.00 0.00 59.36 58.23 3f6c h GLU 65 Cb 0.29 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.41 3f6c h GLU 65 CO -0.40 0.87 0.06 1.15 -1.00 0.00 0.00 179.01 179.69 3f6c h THR 66 N 0.80 1.26 -0.44 1.13 2.02 -0.54 -0.73 112.91 116.40 3f6c h THR 66 Ca 0.17 -1.06 -0.03 0.00 0.77 0.00 0.00 66.41 66.26 3f6c h THR 66 Cb 0.40 0.71 -0.02 0.00 -1.74 0.00 0.00 68.15 67.50 3f6c h THR 66 CO 0.01 0.39 0.15 -0.07 0.37 0.00 0.00 175.52 176.37 3f6c h LEU 67 N 0.96 0.62 -0.59 2.58 3.38 -0.81 -0.36 115.31 121.10 3f6c h LEU 67 Ca 0.19 -0.19 -0.04 0.00 0.09 0.00 0.00 57.88 57.92 3f6c h LEU 67 Cb 0.47 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 41.03 3f6c h LEU 67 CO 0.02 0.64 0.20 0.03 0.09 0.00 0.00 178.44 179.42 3f6c h ARG 68 N 0.56 0.91 -0.88 1.13 2.47 -1.23 -1.07 114.38 116.27 3f6c h ARG 68 Ca 0.14 -0.19 0.10 0.00 -1.26 0.00 0.00 59.98 58.77 3f6c h ARG 68 Cb 0.23 -0.14 -0.06 0.00 -1.65 0.00 0.00 29.97 28.35 3f6c h ARG 68 CO -0.01 0.80 0.57 -0.22 0.56 0.00 0.00 179.97 181.67 3f6c h LYS 69 N 0.83 0.85 -0.62 0.04 3.64 -0.75 -0.74 116.57 119.82 3f6c h LYS 69 Ca 0.19 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.52 3f6c h LYS 69 Cb 0.26 -0.19 0.00 0.00 -0.41 0.00 0.00 32.23 31.89 3f6c h LYS 69 CO -0.01 0.56 0.00 0.54 -2.27 0.00 0.00 179.45 178.27 3f6c n ARG 70 N -4.53 2.46 -1.55 1.90 1.74 -0.18 -4.91 116.66 111.60 3f6c n ARG 70 Ca 0.15 -1.44 -0.11 0.00 -0.77 0.00 0.00 57.85 55.68 3f6c n ARG 70 Cb 0.31 -1.63 -0.04 0.00 -1.02 0.00 0.00 32.46 30.08 3f6c n ARG 70 CO 0.00 0.00 0.00 1.04 -1.52 0.00 0.00 177.63 177.15 3f6c n GLN 71 N 0.41 -0.78 -1.82 5.56 1.13 -0.28 -4.98 117.38 116.62 3f6c n GLN 71 Ca 0.13 0.78 -0.42 0.00 -1.94 0.00 0.00 57.00 55.55 3f6c n GLN 71 Cb 0.54 -4.78 -0.03 0.00 0.11 0.00 0.00 30.24 26.09 3f6c n GLN 71 CO 0.00 0.00 0.00 -0.47 -1.44 0.00 0.00 177.06 175.15 3f6c s TYR 72 N -2.44 2.44 -1.10 1.08 5.04 -0.45 -4.90 117.35 117.03 3f6c s TYR 72 Ca 0.00 0.22 0.12 0.00 -2.44 0.00 0.00 57.07 54.97 3f6c s TYR 72 Cb 0.00 -4.07 0.33 0.00 0.35 0.00 0.00 41.96 38.57 3f6c s TYR 72 CO 0.00 -4.27 1.26 0.43 -1.34 0.00 0.00 175.55 171.63 3f6c n SER 73 N 5.25 2.97 -2.77 4.32 7.64 -1.26 -4.61 113.62 125.16 3f6c n SER 73 Ca 0.16 -1.96 -0.08 0.00 1.01 0.00 0.00 58.87 58.00 3f6c n SER 73 Cb 0.39 -0.24 0.05 0.00 -1.01 0.00 0.00 64.21 63.39 3f6c n SER 73 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3f6c n GLY 74 N 0.66 0.00 3.68 0.23 0.00 -1.26 -5.04 105.19 103.47 3f6c n GLY 74 Ca 0.13 -1.87 -0.40 0.00 0.00 0.00 0.00 46.02 43.87 3f6c n GLY 74 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3f6c s ILE 75 N -1.27 4.97 -0.15 -0.61 1.01 -0.04 -4.96 121.20 120.15 3f6c s ILE 75 Ca 0.23 1.46 0.01 0.00 0.00 0.00 0.00 60.65 62.35 3f6c s ILE 75 Cb -0.01 -4.06 0.02 0.00 0.01 0.00 0.00 42.46 38.42 3f6c s ILE 75 CO 0.16 0.13 -0.19 -0.63 0.00 0.00 0.00 174.94 174.41 3f6c s ILE 76 N 1.61 1.88 -0.18 2.92 1.01 -1.26 -0.41 121.20 126.78 3f6c s ILE 76 Ca 0.36 -0.85 -0.01 0.00 0.00 0.00 0.00 60.65 60.15 3f6c s ILE 76 Cb -0.17 -1.70 0.00 0.00 0.01 0.00 0.00 42.46 40.61 3f6c s ILE 76 CO 0.14 0.51 -0.13 -0.63 0.00 0.00 0.00 174.94 174.83 3f6c s ILE 77 N 1.12 2.71 0.03 2.92 -1.09 -0.45 -0.50 121.20 125.94 3f6c s ILE 77 Ca -0.01 -0.74 -0.20 0.00 -2.23 0.00 0.00 60.65 57.48 3f6c s ILE 77 Cb -0.14 -2.17 -0.06 0.00 -1.58 0.00 0.00 42.46 38.51 3f6c s ILE 77 CO -0.07 0.50 0.58 -0.63 -1.23 0.00 0.00 174.94 174.09 3f6c s ILE 78 N 1.11 4.83 0.11 2.92 -1.09 -0.35 -0.88 121.20 127.85 3f6c s ILE 78 Ca 0.00 1.23 0.09 0.00 -2.23 0.00 0.00 60.65 59.75 3f6c s ILE 78 Cb -0.14 -3.92 -0.04 0.00 -1.58 0.00 0.00 42.46 36.78 3f6c s ILE 78 CO -0.04 0.48 -0.23 0.68 -1.23 0.00 0.00 174.94 174.60 3f6c s VAL 79 N -0.62 1.87 0.01 2.92 -7.23 0.13 -0.78 120.40 116.69 3f6c s VAL 79 Ca 0.30 -1.59 0.00 0.00 -1.81 0.00 0.00 61.98 58.88 3f6c s VAL 79 Cb -0.19 -1.68 -0.01 0.00 0.56 0.00 0.00 36.38 35.06 3f6c s VAL 79 CO 0.18 -0.01 -0.02 -0.55 -0.31 0.00 0.00 175.10 174.39 3f6c s SER 80 N -1.92 0.18 0.43 4.85 0.15 -0.65 -0.97 113.70 115.76 3f6c s SER 80 Ca 0.09 -0.26 0.13 0.00 0.70 0.00 0.00 55.95 56.60 3f6c s SER 80 Cb -0.10 0.04 0.93 0.00 -1.71 0.00 0.00 66.02 65.19 3f6c s SER 80 CO 0.05 -0.14 1.97 0.00 1.20 0.00 0.00 173.24 176.31 3f6c h ALA 81 N 5.38 1.64 -3.00 5.45 0.00 -1.96 0.44 119.26 127.21 3f6c h ALA 81 Ca -0.28 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.45 3f6c h ALA 81 Cb 1.21 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.95 3f6c h ALA 81 CO 0.46 0.27 0.00 0.36 0.00 0.00 0.00 179.25 180.33 3f6c n LYS 82 N -4.31 0.00 0.00 0.00 0.00 -1.26 -3.50 118.16 109.09 3f6c n LYS 82 Ca -0.02 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.29 3f6c n LYS 82 Cb 0.25 0.00 0.00 0.00 -0.00 0.00 0.00 35.03 35.28 3f6c n LYS 82 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 177.40 179.37 3f6c n PHE 86 N 0.00 0.00 1.20 5.58 -1.74 -1.26 -4.76 117.46 116.48 3f6c n PHE 86 Ca 0.00 0.00 0.14 0.00 -0.56 0.00 0.00 57.45 57.03 3f6c n PHE 86 Cb 0.00 -0.03 0.56 0.00 1.52 0.00 0.00 39.48 41.53 3f6c n PHE 86 CO 0.00 0.00 0.00 0.98 -0.56 0.00 0.00 176.76 177.18 3f6c n TYR 87 N -0.06 0.00 -0.25 2.97 -0.00 -1.26 -3.78 117.16 114.78 3f6c n TYR 87 Ca 0.00 0.00 0.03 0.00 -0.00 0.00 0.00 57.90 57.93 3f6c n TYR 87 Cb 0.00 -0.31 0.16 0.00 -0.00 0.00 0.00 39.34 39.19 3f6c n TYR 87 CO 0.00 0.00 0.00 0.78 -0.00 0.00 0.00 176.86 177.64 3f6c h GLY 88 N 4.99 1.12 0.96 2.98 0.00 -1.95 -2.75 103.07 108.41 3f6c h GLY 88 Ca 0.00 -0.19 0.01 0.00 0.00 0.00 0.00 47.33 47.15 3f6c h GLY 88 CO 0.00 -0.01 0.29 1.70 0.00 0.00 0.00 176.54 178.51 3f6c h LYS 89 N 0.54 0.56 -0.94 4.80 3.11 -1.93 0.00 116.57 122.72 3f6c h LYS 89 Ca 0.38 -0.03 -0.00 0.00 -2.81 0.00 0.00 60.65 58.19 3f6c h LYS 89 Cb 0.50 -0.13 -0.05 0.00 -1.00 0.00 0.00 32.23 31.56 3f6c h LYS 89 CO -0.33 0.37 0.57 1.25 -2.81 0.00 0.00 179.45 178.50 3f6c h HIS 90 N 0.58 1.23 -0.34 1.91 2.76 -1.77 -0.55 115.15 118.97 3f6c h HIS 90 Ca 0.17 0.00 -0.12 0.00 -2.20 0.00 0.00 60.37 58.22 3f6c h HIS 90 Cb -0.04 -0.40 -0.01 0.00 1.55 0.00 0.00 27.41 28.51 3f6c h HIS 90 CO -0.05 0.81 -0.29 0.00 -1.30 0.00 0.00 177.93 177.09 3f6c h ALA 92 N 1.07 0.83 0.00 0.00 0.00 -0.61 -1.11 119.26 119.44 3f6c h ALA 92 Ca 0.07 -0.12 -0.07 0.00 0.00 0.00 0.00 54.91 54.80 3f6c h ALA 92 Cb 0.80 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.32 3f6c h ALA 92 CO 0.07 0.36 -0.31 -0.44 0.00 0.00 0.00 179.25 178.93 3f6c h ASP 93 N 0.89 0.00 0.10 0.00 3.32 -0.76 -2.30 116.42 117.68 3f6c h ASP 93 Ca 0.23 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.28 3f6c h ASP 93 Cb 0.06 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.61 3f6c h ASP 93 CO -0.03 0.31 -0.05 0.00 -1.72 0.00 0.00 179.24 177.75 3f6c n ALA 94 N -2.35 2.69 -0.25 3.45 0.00 -0.44 -4.93 120.51 118.68 3f6c n ALA 94 Ca -0.01 -0.33 0.00 0.00 0.00 0.00 0.00 53.44 53.10 3f6c n ALA 94 Cb 0.41 -1.30 0.00 0.00 0.00 0.00 0.00 19.45 18.56 3f6c n ALA 94 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3f6c n GLY 95 N 1.17 0.89 3.79 0.00 0.00 -0.86 -4.63 105.19 105.54 3f6c n GLY 95 Ca 0.19 -0.26 -0.33 0.00 0.00 0.00 0.00 46.02 45.61 3f6c n GLY 95 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3f6c s ALA 96 N -2.00 2.64 -0.58 4.61 0.00 -0.46 -4.88 121.76 121.10 3f6c s ALA 96 Ca 0.00 0.52 0.24 0.00 0.00 0.00 0.00 51.96 52.72 3f6c s ALA 96 Cb 0.00 -3.28 0.45 0.00 0.00 0.00 0.00 23.12 20.29 3f6c s ALA 96 CO 0.00 -0.95 1.48 -0.91 0.00 0.00 0.00 175.76 175.39 3f6c h ASN 97 N 0.45 0.00 -4.98 0.00 4.21 -1.12 -3.43 115.58 110.71 3f6c h ASN 97 Ca -0.47 -0.08 0.18 0.00 1.21 0.00 0.00 56.30 57.14 3f6c h ASN 97 Cb 1.24 0.00 -0.13 0.00 -1.12 0.00 0.00 38.32 38.31 3f6c h ASN 97 CO 0.56 0.04 0.58 -0.83 -1.29 0.00 0.00 177.43 176.49 3f6c s GLY 98 N -3.83 -0.36 -0.07 2.83 0.00 -1.15 -1.87 107.32 102.88 3f6c s GLY 98 Ca 0.07 0.75 -0.03 0.00 0.00 0.00 0.00 44.72 45.51 3f6c s GLY 98 CO 0.68 0.22 0.14 -0.12 0.00 0.00 0.00 173.10 174.02 3f6c s PHE 99 N -2.98 -0.14 -0.06 1.90 5.36 -0.47 -1.21 117.98 120.38 3f6c s PHE 99 Ca 0.09 0.52 0.02 0.00 -0.96 0.00 0.00 56.93 56.60 3f6c s PHE 99 Cb -0.00 -0.24 0.01 0.00 -0.34 0.00 0.00 43.02 42.45 3f6c s PHE 99 CO -0.04 -0.23 -0.12 0.08 -1.46 0.00 0.00 175.22 173.46 3f6c s VAL 100 N 1.94 1.09 -0.01 3.12 1.01 0.04 -4.14 120.40 123.44 3f6c s VAL 100 Ca -0.00 -0.45 -0.30 0.00 0.00 0.00 0.00 61.98 61.22 3f6c s VAL 100 Cb -0.12 -1.00 -0.04 0.00 0.00 0.00 0.00 36.38 35.22 3f6c s VAL 100 CO -0.05 0.35 1.19 -0.44 0.00 0.00 0.00 175.10 176.14 3f6c s SER 101 N 0.67 7.07 0.28 3.32 0.01 -1.26 -1.64 113.70 122.16 3f6c s SER 101 Ca -0.14 1.88 0.26 0.00 1.31 0.00 0.00 55.95 59.25 3f6c s SER 101 Cb -0.16 -2.57 0.82 0.00 0.21 0.00 0.00 66.02 64.33 3f6c s SER 101 CO 0.03 -0.53 1.75 0.11 0.41 0.00 0.00 173.24 175.02 3f6c h LYS 102 N 7.22 0.00 -0.35 12.44 1.57 -0.30 -3.27 116.57 133.88 3f6c h LYS 102 Ca -0.37 0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.38 3f6c h LYS 102 Cb 1.18 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 33.47 3f6c h LYS 102 CO 0.85 0.00 0.10 -0.22 -0.57 0.00 0.00 179.45 179.61 3f6c h LYS 103 N 0.00 0.50 -0.33 3.15 3.64 -1.76 -2.09 116.57 119.68 3f6c h LYS 103 Ca 0.00 -0.07 0.00 0.00 -1.27 0.00 0.00 60.65 59.31 3f6c h LYS 103 Cb 0.67 -0.09 0.00 0.00 -0.41 0.00 0.00 32.23 32.40 3f6c h LYS 103 CO 0.00 0.45 0.00 0.39 -2.27 0.00 0.00 179.45 178.02 3f6c n GLU 104 N -4.36 1.78 0.00 1.90 4.71 -1.23 -5.02 120.64 118.42 3f6c n GLU 104 Ca 0.02 -1.22 0.00 0.00 -0.01 0.00 0.00 57.16 55.95 3f6c n GLU 104 Cb 0.17 -1.27 0.00 0.00 -1.01 0.00 0.00 31.44 29.33 3f6c n GLU 104 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 3f6c n GLY 105 N 1.05 -3.63 0.14 0.62 0.00 -0.79 -4.75 105.19 97.83 3f6c n GLY 105 Ca 0.12 -2.09 0.12 0.00 0.00 0.00 0.00 46.02 44.17 3f6c n GLY 105 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 3f6c h MET 106 N 0.00 0.00 -0.79 1.61 2.86 -1.94 -3.31 114.93 113.36 3f6c h MET 106 Ca 0.00 0.00 0.13 0.00 -2.06 0.00 0.00 59.70 57.77 3f6c h MET 106 Cb 0.00 0.00 -0.06 0.00 0.06 0.00 0.00 31.60 31.60 3f6c h MET 106 CO 0.00 0.00 0.52 -0.97 1.06 0.00 0.00 176.91 177.52 3f6c h ASN 107 N 0.00 0.54 0.44 1.22 -0.73 -1.99 -1.30 115.58 113.75 3f6c h ASN 107 Ca 0.00 0.02 -0.09 0.00 1.87 0.00 0.00 56.30 58.10 3f6c h ASN 107 Cb 0.97 -0.08 -0.01 0.00 0.27 0.00 0.00 38.32 39.47 3f6c h ASN 107 CO 0.00 0.29 -0.45 0.78 -0.37 0.00 0.00 177.43 177.69 3f6c h ASN 108 N 0.58 0.01 -0.25 1.15 -0.26 -1.87 -1.62 115.58 113.32 3f6c h ASN 108 Ca 0.38 -0.00 -0.09 0.00 -0.56 0.00 0.00 56.30 56.03 3f6c h ASN 108 Cb 0.66 -0.00 -0.00 0.00 -1.06 0.00 0.00 38.32 37.92 3f6c h ASN 108 CO -0.14 0.46 -0.20 0.40 -1.06 0.00 0.00 177.43 176.88 3f6c h ILE 109 N 0.01 1.31 -0.50 2.81 2.04 -1.46 -0.94 117.51 120.78 3f6c h ILE 109 Ca -0.00 -1.34 -0.07 0.00 1.00 0.00 0.00 64.86 64.44 3f6c h ILE 109 Cb 0.79 1.63 -0.02 0.00 -0.74 0.00 0.00 36.82 38.48 3f6c h ILE 109 CO 0.06 0.42 0.01 -0.29 0.00 0.00 0.00 178.15 178.35 3f6c h ILE 110 N 0.29 1.25 -0.89 -0.67 6.09 -1.48 -1.34 117.51 120.75 3f6c h ILE 110 Ca 0.05 -1.01 -0.01 0.00 -1.37 0.00 0.00 64.86 62.51 3f6c h ILE 110 Cb 0.74 0.85 -0.04 0.00 0.47 0.00 0.00 36.82 38.84 3f6c h ILE 110 CO 0.05 0.36 0.51 0.00 -3.07 0.00 0.00 178.15 176.00 3f6c h ALA 111 N 1.23 1.22 -0.61 0.18 0.00 -1.23 0.02 119.26 120.07 3f6c h ALA 111 Ca 0.15 -0.12 -0.09 0.00 0.00 0.00 0.00 54.91 54.85 3f6c h ALA 111 Cb 0.45 -0.36 -0.02 0.00 0.00 0.00 0.00 17.79 17.87 3f6c h ALA 111 CO 0.02 0.65 0.02 0.00 0.00 0.00 0.00 179.25 179.94 3f6c h ALA 112 N 1.32 0.82 -0.54 0.00 0.00 -0.81 0.36 119.26 120.41 3f6c h ALA 112 Ca 0.32 -0.30 -0.09 0.00 0.00 0.00 0.00 54.91 54.84 3f6c h ALA 112 Cb -0.00 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.54 3f6c h ALA 112 CO -0.05 0.65 -0.00 0.82 0.00 0.00 0.00 179.25 180.66 3f6c h ILE 113 N 0.96 1.26 -0.44 0.00 2.04 -0.81 -0.66 117.51 119.87 3f6c h ILE 113 Ca 0.18 -1.12 -0.01 0.00 1.00 0.00 0.00 64.86 64.90 3f6c h ILE 113 Cb 0.54 0.90 -0.02 0.00 -0.74 0.00 0.00 36.82 37.50 3f6c h ILE 113 CO 0.03 0.40 0.22 -0.33 0.00 0.00 0.00 178.15 178.47 3f6c h GLU 114 N 0.84 0.62 -0.57 2.37 5.08 -0.83 0.13 114.58 122.23 3f6c h GLU 114 Ca 0.15 -0.09 0.05 0.00 -1.00 0.00 0.00 59.36 58.47 3f6c h GLU 114 Cb 0.54 -0.12 -0.05 0.00 0.50 0.00 0.00 28.75 29.63 3f6c h GLU 114 CO 0.03 0.52 0.31 0.00 -1.00 0.00 0.00 179.01 178.87 3f6c h ALA 115 N 1.07 0.74 -0.47 3.43 0.00 -0.73 -2.04 119.26 121.25 3f6c h ALA 115 Ca 0.15 0.02 -0.10 0.00 0.00 0.00 0.00 54.91 54.97 3f6c h ALA 115 Cb 0.10 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 3f6c h ALA 115 CO -0.02 -0.02 -0.12 0.00 0.00 0.00 0.00 179.25 179.09 3f6c h ALA 116 N 1.30 0.89 0.00 0.00 0.00 -0.42 0.03 119.26 121.05 3f6c h ALA 116 Ca 0.25 -0.34 -0.02 0.00 0.00 0.00 0.00 54.91 54.81 3f6c h ALA 116 Cb 0.13 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 17.74 3f6c h ALA 116 CO -0.16 0.63 -0.08 0.87 0.00 0.00 0.00 179.25 180.52 3f6c h LYS 117 N 0.79 0.00 -0.01 0.00 1.57 -0.68 -2.14 116.57 116.10 3f6c h LYS 117 Ca 0.13 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.91 3f6c h LYS 117 Cb 0.64 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.95 3f6c h LYS 117 CO 0.04 0.08 -0.02 0.09 -0.57 0.00 0.00 179.45 179.07 3f6c n ASN 118 N -4.33 1.18 0.00 0.86 3.02 -0.74 -4.91 115.26 110.34 3f6c n ASN 118 Ca -0.03 -1.34 0.00 0.00 -0.03 0.00 0.00 54.58 53.18 3f6c n ASN 118 Cb 0.16 0.01 0.00 0.00 -0.61 0.00 0.00 39.78 39.33 3f6c n ASN 118 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3f6c n GLY 119 N 1.16 0.77 3.51 7.41 0.00 -0.80 -5.08 105.19 112.16 3f6c n GLY 119 Ca 0.19 -0.25 -0.24 0.00 0.00 0.00 0.00 46.02 45.72 3f6c n GLY 119 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3f6c s TYR 120 N -2.00 2.27 0.32 1.61 2.02 -0.08 -5.00 117.35 116.48 3f6c s TYR 120 Ca 0.00 -0.55 0.09 0.00 -0.37 0.00 0.00 57.07 56.24 3f6c s TYR 120 Cb 0.00 -1.28 -0.06 0.00 -0.40 0.00 0.00 41.96 40.22 3f6c s TYR 120 CO 0.00 0.50 -0.11 0.00 -1.57 0.00 0.00 175.55 174.37 3f6c s TYR 122 N -2.67 0.54 0.05 0.00 5.04 -0.78 -4.96 117.35 114.56 3f6c s TYR 122 Ca 0.31 -0.98 0.02 0.00 -2.44 0.00 0.00 57.07 53.99 3f6c s TYR 122 Cb 0.01 -1.01 -0.03 0.00 0.35 0.00 0.00 41.96 41.28 3f6c s TYR 122 CO 0.15 -0.81 -0.08 -0.06 -1.34 0.00 0.00 175.55 173.40 3f6c s PHE 123 N 2.02 0.76 0.52 4.97 0.08 -1.26 -1.37 117.98 123.71 3f6c s PHE 123 Ca 0.09 -0.55 -0.22 0.00 0.12 0.00 0.00 56.93 56.37 3f6c s PHE 123 Cb -0.16 -0.45 -0.07 0.00 -0.57 0.00 0.00 43.02 41.77 3f6c s PHE 123 CO -0.33 -0.07 1.16 -2.30 -0.10 0.00 0.00 175.22 173.58 3f6c n PRO 124 N 1.23 1.43 -4.81 0.24 -0.02 -1.26 -5.00 135.00 126.81 3f6c n PRO 124 Ca -0.21 0.52 -0.33 0.00 -2.02 0.00 0.00 63.50 61.46 3f6c n PRO 124 Cb 0.55 -2.32 -0.14 0.00 -0.02 0.00 0.00 33.50 31.57 3f6c n PRO 124 CO 0.00 0.00 0.00 0.12 1.98 0.00 0.00 175.50 177.60 3f6c s PHE 125 N -1.34 2.77 -0.20 6.00 5.36 -1.26 -4.95 117.98 124.36 3f6c s PHE 125 Ca 0.70 -0.44 0.01 0.00 -0.96 0.00 0.00 56.93 56.24 3f6c s PHE 125 Cb -0.46 -1.76 0.04 0.00 -0.34 0.00 0.00 43.02 40.50 3f6c s PHE 125 CO 0.51 -0.05 -0.13 -1.12 -1.46 0.00 0.00 175.22 172.97 3f6c s SER 126 N -0.08 3.51 0.45 6.13 0.01 -1.26 -4.99 113.70 117.47 3f6c s SER 126 Ca -0.02 -0.91 0.25 0.00 1.31 0.00 0.00 55.95 56.58 3f6c s SER 126 Cb -0.14 -1.36 0.73 0.00 0.21 0.00 0.00 66.02 65.46 3f6c s SER 126 CO 0.04 -0.11 1.74 0.25 0.41 0.00 0.00 173.24 175.57 3f6c h LEU 127 N 7.93 0.00 -0.94 2.44 5.85 -1.99 -3.27 115.31 125.33 3f6c h LEU 127 Ca -0.31 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.41 3f6c h LEU 127 Cb 1.10 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.13 3f6c h LEU 127 CO 0.52 0.13 0.00 0.78 -0.34 0.00 0.00 178.44 179.52 3f6c h ASN 128 N 0.00 0.00 0.50 1.25 4.21 -1.95 -0.07 115.58 119.53 3f6c h ASN 128 Ca -0.00 0.00 -0.04 0.00 1.21 0.00 0.00 56.30 57.47 3f6c h ASN 128 Cb 0.86 0.00 -0.01 0.00 -1.12 0.00 0.00 38.32 38.05 3f6c h ASN 128 CO 0.02 0.00 -0.21 -0.09 -1.29 0.00 0.00 177.43 175.86 3f6c h ARG 129 N 0.00 0.00 0.00 0.81 2.43 -2.01 -3.33 114.38 112.28 3f6c h ARG 129 Ca 0.00 0.00 -0.00 0.00 -0.81 0.00 0.00 59.98 59.17 3f6c h ARG 129 Cb 0.36 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 29.91 3f6c h ARG 129 CO 0.00 0.21 -1.03 1.19 -1.51 0.00 0.00 179.97 178.82 3f6c n PHE 130 N -3.69 0.00 -0.90 2.20 3.72 -0.20 -5.21 117.46 113.38 3f6c n PHE 130 Ca -0.01 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.39 3f6c n PHE 130 Cb 0.32 -0.02 0.00 0.00 -0.94 0.00 0.00 39.48 38.85 3f6c n PHE 130 CO 0.00 0.00 0.00 0.28 -0.05 0.00 0.00 176.76 176.99