#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2w0c s GLY 22 N 0.00 0.74 0.21 3.41 0.00 -1.26 -5.05 107.32 105.37 2w0c s GLY 22 Ca 0.00 -0.52 -0.10 0.00 0.00 0.00 0.00 44.72 44.10 2w0c s GLY 22 CO 0.00 1.05 1.85 1.41 0.00 0.00 0.00 173.10 177.41 2w0c h LEU 23 N 8.22 0.75 -0.78 0.66 4.07 -2.05 0.11 115.31 126.28 2w0c h LEU 23 Ca -0.23 -0.00 -0.12 0.00 0.08 0.00 0.00 57.88 57.61 2w0c h LEU 23 Cb 1.12 -0.17 -0.01 0.00 1.08 0.00 0.00 40.66 42.68 2w0c h LEU 23 CO 0.35 0.52 -0.31 0.44 -1.08 0.00 0.00 178.44 178.36 2w0c h ASP 24 N 0.89 0.59 0.30 -0.43 5.19 -1.99 -0.60 116.42 120.37 2w0c h ASP 24 Ca 0.28 -0.23 -0.10 0.00 -0.62 0.00 0.00 57.03 56.36 2w0c h ASP 24 Cb -0.00 -0.16 -0.01 0.00 0.18 0.00 0.00 39.33 39.33 2w0c h ASP 24 CO -0.10 0.86 -0.42 0.00 -3.12 0.00 0.00 179.24 176.46 2w0c h ALA 25 N 1.17 1.16 0.10 3.45 0.00 -1.75 -1.94 119.26 121.45 2w0c h ALA 25 Ca 0.06 -0.41 -0.00 0.00 0.00 0.00 0.00 54.91 54.55 2w0c h ALA 25 Cb 0.78 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.49 2w0c h ALA 25 CO 0.06 0.58 -0.05 -0.07 0.00 0.00 0.00 179.25 179.78 2w0c h LEU 26 N 0.14 -0.11 -1.24 0.00 4.07 -0.60 -3.08 115.31 114.49 2w0c h LEU 26 Ca 0.01 -0.44 0.16 0.00 0.08 0.00 0.00 57.88 57.69 2w0c h LEU 26 Cb 0.81 0.03 -0.08 0.00 1.08 0.00 0.00 40.66 42.50 2w0c h LEU 26 CO 0.06 0.44 0.59 0.40 -1.08 0.00 0.00 178.44 178.85 2w0c h ILE 27 N -0.72 0.79 -0.29 1.22 2.04 -1.07 0.22 117.51 119.71 2w0c h ILE 27 Ca -0.01 -0.24 0.01 0.00 1.00 0.00 0.00 64.86 65.62 2w0c h ILE 27 Cb 0.55 0.04 -0.02 0.00 -0.74 0.00 0.00 36.82 36.65 2w0c h ILE 27 CO 0.02 0.13 0.17 0.77 0.00 0.00 0.00 178.15 179.24 2w0c h SER 28 N 0.69 0.29 -0.87 1.72 4.64 -1.43 0.56 113.55 119.14 2w0c h SER 28 Ca 0.48 -0.00 0.14 0.00 -0.47 0.00 0.00 61.79 61.95 2w0c h SER 28 Cb 0.81 -0.06 -0.09 0.00 -0.31 0.00 0.00 62.40 62.74 2w0c h SER 28 CO -0.24 0.21 0.47 1.23 -0.87 0.00 0.00 176.83 177.63 2w0c h GLY 29 N 0.36 1.43 1.88 -0.77 0.00 -0.51 0.76 103.07 106.22 2w0c h GLY 29 Ca 0.11 -0.28 -0.12 0.00 0.00 0.00 0.00 47.33 47.04 2w0c h GLY 29 CO -0.04 -0.01 -0.50 1.49 0.00 0.00 0.00 176.54 177.48 2w0c h TRP 30 N 0.68 0.16 -0.23 5.60 4.06 -0.78 0.37 115.95 125.80 2w0c h TRP 30 Ca 0.47 -0.05 -0.19 0.00 2.06 0.00 0.00 58.89 61.18 2w0c h TRP 30 Cb 0.64 -0.03 0.00 0.00 -1.00 0.00 0.00 29.16 28.77 2w0c h TRP 30 CO -0.07 0.61 -0.60 0.00 -3.56 0.00 0.00 178.44 174.82 2w0c h ALA 31 N 1.38 0.38 0.00 1.49 0.00 0.82 -3.12 119.26 120.22 2w0c h ALA 31 Ca 0.00 -0.53 0.00 0.00 0.00 0.00 0.00 54.91 54.38 2w0c h ALA 31 Cb 0.93 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.67 2w0c h ALA 31 CO 0.07 0.63 0.00 0.00 0.00 0.00 0.00 179.25 179.95 2w0c h ARG 32 N 0.57 0.00 -0.41 0.00 3.08 0.59 -2.96 114.38 115.23 2w0c h ARG 32 Ca -0.01 0.00 -0.11 0.00 0.07 0.00 0.00 59.98 59.94 2w0c h ARG 32 Cb 1.21 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 31.25 2w0c h ARG 32 CO 0.13 0.00 -0.17 -0.24 -1.07 0.00 0.00 179.97 178.62 2w0c h VAL 33 N 0.00 1.27 0.00 2.04 3.04 -0.23 -3.01 116.25 119.35 2w0c h VAL 33 Ca 0.00 -1.26 -0.08 0.00 -1.01 0.00 0.00 66.70 64.35 2w0c h VAL 33 Cb 0.80 1.13 -0.01 0.00 -2.01 0.00 0.00 31.29 31.20 2w0c h VAL 33 CO 0.00 0.43 -0.36 -0.33 -1.01 0.00 0.00 177.57 176.29 2w0c h GLU 34 N 0.70 0.00 -0.47 4.17 5.08 -1.46 -3.05 114.58 119.55 2w0c h GLU 34 Ca 0.11 0.00 -0.14 0.00 -1.00 0.00 0.00 59.36 58.33 2w0c h GLU 34 Cb 0.67 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.91 2w0c h GLU 34 CO 0.05 0.36 -0.24 1.96 -1.00 0.00 0.00 179.01 180.14 2w0c h GLN 35 N 0.00 1.00 -0.02 2.33 4.20 -1.50 -1.66 115.11 119.46 2w0c h GLN 35 Ca -0.00 -0.44 -0.14 0.00 0.06 0.00 0.00 58.65 58.13 2w0c h GLN 35 Cb 0.79 -0.02 -0.02 0.00 0.30 0.00 0.00 27.48 28.53 2w0c h GLN 35 CO 0.05 1.12 -0.62 0.82 -0.67 0.00 0.00 178.83 179.53 2w0c h ILE 36 N 0.85 1.43 -0.51 2.54 2.04 -1.53 -1.37 117.51 120.96 2w0c h ILE 36 Ca 0.10 -2.09 -0.09 0.00 1.00 0.00 0.00 64.86 63.79 2w0c h ILE 36 Cb 0.83 2.11 -0.02 0.00 -0.74 0.00 0.00 36.82 39.00 2w0c h ILE 36 CO 0.07 0.60 -0.03 0.11 0.00 0.00 0.00 178.15 178.91 2w0c h LYS 37 N 0.06 0.87 -0.00 2.37 1.57 -1.46 -2.90 116.57 117.08 2w0c h LYS 37 Ca -0.01 -0.26 -0.08 0.00 -1.87 0.00 0.00 60.65 58.43 2w0c h LYS 37 Cb 1.11 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 33.32 2w0c h LYS 37 CO 0.09 0.89 -0.38 0.00 -0.57 0.00 0.00 179.45 179.47 2w0c h ALA 38 N 1.16 1.37 -0.52 3.86 0.00 -0.88 -1.62 119.26 122.63 2w0c h ALA 38 Ca 0.15 -0.35 -0.07 0.00 0.00 0.00 0.00 54.91 54.64 2w0c h ALA 38 Cb 0.52 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.23 2w0c h ALA 38 CO 0.03 0.48 0.03 0.00 0.00 0.00 0.00 179.25 179.79 2w0c h ALA 39 N 1.61 1.08 -0.14 0.00 0.00 -1.07 -2.20 119.26 118.55 2w0c h ALA 39 Ca -0.00 -0.26 -0.15 0.00 0.00 0.00 0.00 54.91 54.50 2w0c h ALA 39 Cb 0.68 -0.21 0.01 0.00 0.00 0.00 0.00 17.79 18.26 2w0c h ALA 39 CO 0.05 0.59 -0.51 0.87 0.00 0.00 0.00 179.25 180.25 2w0c h LYS 40 N 0.80 0.58 -0.01 0.00 1.57 -1.35 -3.29 116.57 114.88 2w0c h LYS 40 Ca 0.16 -0.45 -0.01 0.00 -1.87 0.00 0.00 60.65 58.48 2w0c h LYS 40 Cb 0.44 0.08 -0.00 0.00 0.08 0.00 0.00 32.23 32.83 2w0c h LYS 40 CO 0.02 1.07 -0.06 0.00 -0.57 0.00 0.00 179.45 179.90 2w0c h ALA 41 N 0.52 1.89 -0.18 3.86 0.00 -1.17 -2.56 119.26 121.62 2w0c h ALA 41 Ca -0.02 -0.06 -0.12 0.00 0.00 0.00 0.00 54.91 54.71 2w0c h ALA 41 Cb 1.14 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.90 2w0c h ALA 41 CO 0.11 0.08 -0.40 0.66 0.00 0.00 0.00 179.25 179.71 2w0c h SER 42 N 0.01 0.43 -2.66 0.00 4.64 -1.46 -3.45 113.55 111.06 2w0c h SER 42 Ca 0.00 -0.18 -0.56 0.00 -0.47 0.00 0.00 61.79 60.57 2w0c h SER 42 Cb 0.11 -0.12 -0.04 0.00 -0.31 0.00 0.00 62.40 62.04 2w0c h SER 42 CO 0.01 0.79 -0.50 -0.89 -0.87 0.00 0.00 176.83 175.37 2w0c s THR 43 N -4.22 5.14 0.32 2.95 2.01 -0.97 -5.02 115.64 115.86 2w0c s THR 43 Ca -0.06 -0.72 0.12 0.00 0.31 0.00 0.00 61.69 61.34 2w0c s THR 43 Cb 0.13 -3.62 0.05 0.00 0.01 0.00 0.00 72.50 69.07 2w0c s THR 43 CO 0.80 -0.05 1.74 1.23 -0.69 0.00 0.00 174.62 177.64 2w0c h GLY 44 N 2.37 0.00 2.00 4.40 0.00 -1.87 -3.07 103.07 106.90 2w0c h GLY 44 Ca -0.48 0.00 -0.07 0.00 0.00 0.00 0.00 47.33 46.78 2w0c h GLY 44 CO 0.68 0.00 -0.33 1.46 0.00 0.00 0.00 176.54 178.36 2w0c h GLN 45 N 0.00 0.00 -0.31 4.80 4.20 -1.95 -2.79 115.11 119.06 2w0c h GLN 45 Ca -0.00 0.00 -0.09 0.00 0.06 0.00 0.00 58.65 58.62 2w0c h GLN 45 Cb 0.84 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.60 2w0c h GLN 45 CO 0.06 0.33 -0.17 0.78 -0.67 0.00 0.00 178.83 179.16 2w0c h GLY 46 N 1.51 0.60 1.25 3.46 0.00 -1.61 -1.82 103.07 106.46 2w0c h GLY 46 Ca -0.00 -0.45 -0.18 0.00 0.00 0.00 0.00 47.33 46.70 2w0c h GLY 46 CO 0.04 0.41 -0.57 3.21 0.00 0.00 0.00 176.54 179.64 2w0c h ARG 47 N 0.50 0.78 0.00 4.80 3.08 -1.59 -3.18 114.38 118.77 2w0c h ARG 47 Ca 0.08 -0.50 -0.07 0.00 0.07 0.00 0.00 59.98 59.56 2w0c h ARG 47 Cb 0.58 0.06 -0.01 0.00 0.08 0.00 0.00 29.97 30.68 2w0c h ARG 47 CO 0.04 1.13 -0.33 -0.24 -1.07 0.00 0.00 179.97 179.50 2w0c h VAL 48 N 0.59 0.78 -0.44 2.04 3.04 -1.38 -2.83 116.25 118.06 2w0c h VAL 48 Ca 0.01 -1.38 -0.09 0.00 -1.01 0.00 0.00 66.70 64.23 2w0c h VAL 48 Cb 1.16 1.87 -0.02 0.00 -2.01 0.00 0.00 31.29 32.29 2w0c h VAL 48 CO 0.12 0.32 -0.07 -0.33 -1.01 0.00 0.00 177.57 176.59 2w0c h GLU 49 N 0.00 0.77 -0.00 4.17 5.08 -1.32 -3.07 114.58 120.21 2w0c h GLU 49 Ca -0.00 -0.24 0.00 0.00 -1.00 0.00 0.00 59.36 58.12 2w0c h GLU 49 Cb 0.84 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 30.02 2w0c h GLU 49 CO 0.04 0.83 -0.08 1.04 -1.00 0.00 0.00 179.01 179.85 2w0c n GLN 50 N -4.18 0.84 0.18 2.33 6.02 -1.08 -4.07 117.38 117.41 2w0c n GLN 50 Ca 0.02 -0.28 0.02 0.00 -0.01 0.00 0.00 57.00 56.75 2w0c n GLN 50 Cb 0.34 -1.49 0.35 0.00 1.02 0.00 0.00 30.24 30.46 2w0c n GLN 50 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2w0c h ALA 51 N 3.75 1.37 0.00 -1.58 0.00 -1.42 -3.08 119.26 118.30 2w0c h ALA 51 Ca 0.00 -0.34 0.00 0.00 0.00 0.00 0.00 54.91 54.57 2w0c h ALA 51 Cb 0.32 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.05 2w0c h ALA 51 CO 0.00 0.47 -0.05 -1.33 0.00 0.00 0.00 179.25 178.34 2w0c n MET 52 N -4.10 0.03 -2.31 0.00 2.81 -1.26 -4.83 117.12 107.47 2w0c n MET 52 Ca -0.02 0.02 -0.43 0.00 -1.81 0.00 0.00 57.70 55.47 2w0c n MET 52 Cb 0.41 -1.53 -0.02 0.00 -0.71 0.00 0.00 33.22 31.36 2w0c n MET 52 CO 0.00 0.00 0.00 0.99 1.51 0.00 0.00 175.97 178.47 2w0c s THR 53 N -3.01 4.02 0.48 2.03 2.01 -1.17 -5.02 115.64 114.98 2w0c s THR 53 Ca 0.13 1.18 0.07 0.00 0.31 0.00 0.00 61.69 63.38 2w0c s THR 53 Cb 0.18 -3.95 0.07 0.00 0.01 0.00 0.00 72.50 68.80 2w0c s THR 53 CO 0.55 -0.32 0.57 -0.81 -0.69 0.00 0.00 174.62 173.92 2w0c n PRO 54 N 7.22 0.71 -4.02 4.92 -0.04 -1.26 -5.12 135.00 137.42 2w0c n PRO 54 Ca 0.16 -2.70 -0.31 0.00 -0.04 0.00 0.00 63.50 60.60 2w0c n PRO 54 Cb 0.46 -0.04 -0.15 0.00 -0.04 0.00 0.00 33.50 33.72 2w0c n PRO 54 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 2w0c s GLU 55 N -4.10 2.07 0.20 0.54 2.02 -1.26 -5.12 118.70 113.06 2w0c s GLU 55 Ca 0.43 -1.08 -0.04 0.00 0.02 0.00 0.00 54.97 54.30 2w0c s GLU 55 Cb -0.03 -2.66 -0.03 0.00 0.10 0.00 0.00 34.13 31.50 2w0c s GLU 55 CO 0.27 -0.51 0.21 -0.51 0.02 0.00 0.00 175.26 174.74 2w0c s LEU 56 N 1.27 0.99 -0.39 1.80 1.02 -1.26 -5.05 118.68 117.05 2w0c s LEU 56 Ca -0.05 -1.25 0.06 0.00 0.02 0.00 0.00 54.13 52.91 2w0c s LEU 56 Cb -0.18 0.72 0.67 0.00 0.02 0.00 0.00 46.19 47.42 2w0c s LEU 56 CO -0.07 -0.90 1.83 0.47 0.02 0.00 0.00 176.35 177.70 2w0c n ASP 57 N -0.28 3.91 -4.05 2.29 9.92 -1.26 -4.88 116.55 122.20 2w0c n ASP 57 Ca 0.00 -3.52 -0.32 0.00 -0.53 0.00 0.00 54.79 50.43 2w0c n ASP 57 Cb 0.65 -0.79 -0.15 0.00 -0.64 0.00 0.00 41.12 40.19 2w0c n ASP 57 CO 0.00 0.00 0.00 0.20 0.13 0.00 0.00 177.20 177.53 2w0c s ASN 58 N -1.38 4.38 0.06 -2.24 0.01 -1.26 -5.11 114.94 109.40 2w0c s ASN 58 Ca 0.55 -1.41 0.05 0.00 -0.71 0.00 0.00 52.86 51.34 2w0c s ASN 58 Cb 0.46 -1.50 -0.03 0.00 0.41 0.00 0.00 41.25 40.59 2w0c s ASN 58 CO 0.10 -0.21 -0.15 -0.83 -1.51 0.00 0.00 177.10 174.50 2w0c s GLY 59 N 1.13 0.88 -0.52 0.66 0.00 -1.26 -5.11 107.32 103.11 2w0c s GLY 59 Ca -0.07 -0.96 -0.00 0.00 0.00 0.00 0.00 44.72 43.68 2w0c s GLY 59 CO -0.05 -0.96 0.30 0.00 0.00 0.00 0.00 173.10 172.38 2w0c s ALA 60 N -1.07 3.34 0.30 3.20 0.00 -1.26 -5.10 121.76 121.17 2w0c s ALA 60 Ca 0.01 -3.01 0.00 0.00 0.00 0.00 0.00 51.96 48.96 2w0c s ALA 60 Cb -0.09 -2.40 -0.04 0.00 0.00 0.00 0.00 23.12 20.59 2w0c s ALA 60 CO 0.02 -1.96 0.49 0.00 0.00 0.00 0.00 175.76 174.31 2w0c s ALA 61 N 0.28 3.75 -0.44 0.00 0.00 -1.26 -5.08 121.76 119.01 2w0c s ALA 61 Ca 0.14 -0.90 0.05 0.00 0.00 0.00 0.00 51.96 51.25 2w0c s ALA 61 Cb -0.22 -2.05 0.17 0.00 0.00 0.00 0.00 23.12 21.02 2w0c s ALA 61 CO -0.03 0.13 0.52 0.54 0.00 0.00 0.00 175.76 176.92 2w0c s VAL 62 N -2.16 -0.50 -0.32 0.00 0.11 -1.26 -5.12 120.40 111.14 2w0c s VAL 62 Ca 0.39 -1.22 -0.11 0.00 -2.93 0.00 0.00 61.98 58.11 2w0c s VAL 62 Cb -0.10 -0.47 -0.01 0.00 -1.53 0.00 0.00 36.38 34.26 2w0c s VAL 62 CO 0.33 -0.45 0.20 0.54 -3.33 0.00 0.00 175.10 172.39 2w0c s VAL 63 N 0.99 4.97 -0.03 2.04 0.11 -1.26 -5.06 120.40 122.17 2w0c s VAL 63 Ca 0.25 -0.28 -0.28 0.00 -2.93 0.00 0.00 61.98 58.73 2w0c s VAL 63 Cb -0.04 -3.53 0.06 0.00 -1.53 0.00 0.00 36.38 31.34 2w0c s VAL 63 CO -0.08 0.04 0.62 0.54 -3.33 0.00 0.00 175.10 172.90 2w0c s VAL 64 N 1.67 0.01 0.60 2.04 0.11 -1.26 -5.16 120.40 118.42 2w0c s VAL 64 Ca 0.05 -0.07 -0.18 0.00 -2.93 0.00 0.00 61.98 58.85 2w0c s VAL 64 Cb -0.17 -0.95 -0.03 0.00 -1.53 0.00 0.00 36.38 33.70 2w0c s VAL 64 CO 0.09 -0.04 1.16 -1.61 -3.33 0.00 0.00 175.10 171.37 2w0c s GLU 65 N -1.43 2.98 -0.01 1.54 2.02 -1.26 -5.06 118.70 117.47 2w0c s GLU 65 Ca -0.10 1.66 0.00 0.00 0.02 0.00 0.00 54.97 56.55 2w0c s GLU 65 Cb -0.01 -1.95 0.01 0.00 0.10 0.00 0.00 34.13 32.29 2w0c s GLU 65 CO 0.07 -1.16 -0.01 0.00 0.02 0.00 0.00 175.26 174.19 2w0c s ALA 66 N -1.85 0.21 0.63 5.21 0.00 -1.26 -5.16 121.76 119.54 2w0c s ALA 66 Ca 0.73 0.07 -0.12 0.00 0.00 0.00 0.00 51.96 52.64 2w0c s ALA 66 Cb -0.26 -0.17 -0.03 0.00 0.00 0.00 0.00 23.12 22.66 2w0c s ALA 66 CO 0.34 -0.02 1.04 -1.25 0.00 0.00 0.00 175.76 175.87 2w0c s PRO 67 N 0.51 3.40 -0.00 0.00 0.04 -1.26 -5.09 135.00 132.60 2w0c s PRO 67 Ca -0.05 0.88 0.01 0.00 0.04 0.00 0.00 61.00 61.88 2w0c s PRO 67 Cb -0.07 -2.05 -0.00 0.00 0.04 0.00 0.00 34.50 32.41 2w0c s PRO 67 CO -0.01 -0.73 -0.03 0.15 0.04 0.00 0.00 177.00 176.42 2w0c s LYS 68 N -4.92 0.25 0.38 4.56 1.02 -1.26 -5.13 119.74 114.65 2w0c s LYS 68 Ca 0.57 -0.10 0.00 0.00 0.02 0.00 0.00 55.97 56.46 2w0c s LYS 68 Cb -0.12 -0.25 0.00 0.00 -0.52 0.00 0.00 37.83 36.93 2w0c s LYS 68 CO 0.50 0.06 0.00 1.63 -0.92 0.00 0.00 175.35 176.62 2w0c n LYS 69 N 3.05 -2.07 -3.33 1.68 5.02 -1.26 -5.06 118.16 116.19 2w0c n LYS 69 Ca -0.13 1.69 0.02 0.00 -2.02 0.00 0.00 58.31 57.87 2w0c n LYS 69 Cb 0.59 -2.38 -0.03 0.00 -0.02 0.00 0.00 35.03 33.18 2w0c n LYS 69 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2w0c s ALA 70 N -3.87 -2.80 -0.01 7.82 0.00 -1.26 -5.17 121.76 116.46 2w0c s ALA 70 Ca 0.00 1.91 0.00 0.00 0.00 0.00 0.00 51.96 53.88 2w0c s ALA 70 Cb 0.00 -2.15 0.01 0.00 0.00 0.00 0.00 23.12 20.98 2w0c s ALA 70 CO 0.00 -1.09 -0.01 0.00 0.00 0.00 0.00 175.76 174.67 2w0c s ALA 71 N 2.60 0.21 0.00 0.00 0.00 -1.26 -4.93 121.76 118.38 2w0c s ALA 71 Ca -0.00 0.06 0.00 0.00 0.00 0.00 0.00 51.96 52.02 2w0c s ALA 71 Cb -0.08 -0.17 0.00 0.00 0.00 0.00 0.00 23.12 22.87 2w0c s ALA 71 CO -0.16 -0.02 0.00 1.04 0.00 0.00 0.00 175.76 176.62 2w0c n GLN 72 N 3.59 0.00 -0.03 0.00 6.02 -1.26 -4.93 117.38 120.77 2w0c n GLN 72 Ca -0.20 0.00 -0.15 0.00 -0.01 0.00 0.00 57.00 56.64 2w0c n GLN 72 Cb 0.55 0.00 -0.09 0.00 1.02 0.00 0.00 30.24 31.72 2w0c n GLN 72 CO 0.00 0.00 0.00 -1.00 -1.01 0.00 0.00 177.06 175.05 2w0c h PRO 73 N 0.00 0.43 -0.33 -1.09 0.13 -2.00 -1.56 132.00 127.58 2w0c h PRO 73 Ca 0.00 -0.34 -0.12 0.00 -0.87 0.00 0.00 66.00 64.67 2w0c h PRO 73 Cb 0.00 0.07 -0.01 0.00 0.13 0.00 0.00 31.00 31.19 2w0c h PRO 73 CO 0.00 0.98 -0.27 0.66 -0.23 0.00 0.00 178.00 179.13 2w0c h SER 74 N -0.01 0.68 0.64 1.44 4.64 -1.92 -3.09 113.55 115.93 2w0c h SER 74 Ca -0.02 -0.26 -0.03 0.00 -0.47 0.00 0.00 61.79 61.01 2w0c h SER 74 Cb 1.04 -0.19 0.00 0.00 -0.31 0.00 0.00 62.40 62.95 2w0c h SER 74 CO 0.08 0.92 -0.33 -0.33 -0.87 0.00 0.00 176.83 176.31 2w0c h GLU 75 N 0.58 -0.85 -0.98 4.77 5.08 -1.94 0.47 114.58 121.71 2w0c h GLU 75 Ca 0.07 0.06 0.27 0.00 -1.00 0.00 0.00 59.36 58.77 2w0c h GLU 75 Cb 0.76 0.19 -0.14 0.00 0.50 0.00 0.00 28.75 30.07 2w0c h GLU 75 CO 0.06 -0.57 0.53 1.15 -1.00 0.00 0.00 179.01 179.19 2w0c h THR 76 N -0.88 0.42 -0.17 1.13 2.02 -1.34 0.72 112.91 114.81 2w0c h THR 76 Ca -0.09 -0.15 -0.19 0.00 0.77 0.00 0.00 66.41 66.76 2w0c h THR 76 Cb 0.68 -0.05 0.01 0.00 -1.74 0.00 0.00 68.15 67.05 2w0c h THR 76 CO 0.13 0.08 -0.63 -0.07 0.37 0.00 0.00 175.52 175.40 2w0c h LEU 77 N 0.43 0.84 -0.54 2.58 4.07 -1.51 -2.59 115.31 118.58 2w0c h LEU 77 Ca 0.67 -0.61 0.00 0.00 0.08 0.00 0.00 57.88 58.02 2w0c h LEU 77 Cb 1.38 -0.25 0.00 0.00 1.08 0.00 0.00 40.66 42.88 2w0c h LEU 77 CO -0.55 1.31 0.00 0.55 -1.08 0.00 0.00 178.44 178.67 2w0c n VAL 78 N -4.06 0.12 -0.09 1.22 3.14 0.99 -2.68 118.33 116.97 2w0c n VAL 78 Ca -0.07 -0.17 -0.09 0.00 -2.96 0.00 0.00 64.34 61.04 2w0c n VAL 78 Cb 0.67 0.04 -0.14 0.00 -1.06 0.00 0.00 33.84 33.35 2w0c n VAL 78 CO 0.00 0.00 0.00 0.49 -6.46 0.00 0.00 176.83 170.86 2w0c n PHE 79 N -0.22 0.00 -0.04 1.45 3.01 0.21 -4.45 117.46 117.42 2w0c n PHE 79 Ca 0.14 0.00 -0.13 0.00 1.01 0.00 0.00 57.45 58.47 2w0c n PHE 79 Cb 0.18 -0.89 -0.07 0.00 -0.01 0.00 0.00 39.48 38.69 2w0c n PHE 79 CO 0.00 0.00 0.00 0.78 1.01 0.00 0.00 176.76 178.55 2w0c h GLY 80 N 3.51 0.27 1.20 1.37 0.00 -1.31 -3.05 103.07 105.05 2w0c h GLY 80 Ca -0.49 -0.25 -0.19 0.00 0.00 0.00 0.00 47.33 46.40 2w0c h GLY 80 CO 0.02 0.23 -0.57 -0.24 0.00 0.00 0.00 176.54 175.99 2w0c h VAL 81 N -0.12 1.28 0.00 4.60 3.04 -1.78 -2.99 116.25 120.29 2w0c h VAL 81 Ca 0.02 -1.76 -0.22 0.00 -1.01 0.00 0.00 66.70 63.74 2w0c h VAL 81 Cb 0.54 1.67 -0.00 0.00 -2.01 0.00 0.00 31.29 31.49 2w0c h VAL 81 CO 0.02 0.57 -0.93 1.55 -1.01 0.00 0.00 177.57 177.77 2w0c h PRO 82 N 0.64 0.35 -0.86 4.17 0.13 -1.78 -2.27 132.00 132.38 2w0c h PRO 82 Ca 0.01 -0.38 0.04 0.00 -0.87 0.00 0.00 66.00 64.79 2w0c h PRO 82 Cb 1.17 0.11 -0.05 0.00 0.13 0.00 0.00 31.00 32.36 2w0c h PRO 82 CO 0.12 1.07 0.55 1.96 -0.23 0.00 0.00 178.00 181.47 2w0c h GLN 83 N 0.19 1.03 -0.53 0.86 4.20 -1.59 0.68 115.11 119.96 2w0c h GLN 83 Ca -0.07 -0.06 -0.06 0.00 0.06 0.00 0.00 58.65 58.51 2w0c h GLN 83 Cb 1.57 -0.23 -0.02 0.00 0.30 0.00 0.00 27.48 29.09 2w0c h GLN 83 CO 0.16 0.68 0.08 0.87 -0.67 0.00 0.00 178.83 179.95 2w0c h LYS 84 N 1.07 0.88 -0.72 1.46 1.57 -1.56 -0.66 116.57 118.60 2w0c h LYS 84 Ca 0.34 -0.24 -0.05 0.00 -1.87 0.00 0.00 60.65 58.83 2w0c h LYS 84 Cb 0.02 -0.10 -0.03 0.00 0.08 0.00 0.00 32.23 32.20 2w0c h LYS 84 CO -0.12 0.87 0.24 1.15 -0.57 0.00 0.00 179.45 181.02 2w0c h THR 85 N 0.77 1.26 -0.07 -0.16 2.02 -0.65 -1.74 112.91 114.33 2w0c h THR 85 Ca 0.16 -0.87 -0.01 0.00 0.77 0.00 0.00 66.41 66.46 2w0c h THR 85 Cb 0.42 0.44 -0.00 0.00 -1.74 0.00 0.00 68.15 67.27 2w0c h THR 85 CO 0.01 0.34 0.00 -0.07 0.37 0.00 0.00 175.52 176.18 2w0c h LEU 86 N 1.07 0.12 -1.23 2.58 4.07 0.40 -2.81 115.31 119.51 2w0c h LEU 86 Ca 0.24 -0.29 0.17 0.00 0.08 0.00 0.00 57.88 58.07 2w0c h LEU 86 Cb 0.28 -0.03 -0.08 0.00 1.08 0.00 0.00 40.66 41.91 2w0c h LEU 86 CO -0.01 0.39 0.60 -0.07 -1.08 0.00 0.00 178.44 178.26 2w0c h LEU 87 N -0.14 0.66 -1.07 1.67 4.07 -0.92 0.27 115.31 119.86 2w0c h LEU 87 Ca 0.02 0.06 -0.07 0.00 0.08 0.00 0.00 57.88 57.96 2w0c h LEU 87 Cb 0.32 -0.07 -0.02 0.00 1.08 0.00 0.00 40.66 41.97 2w0c h LEU 87 CO 0.00 0.30 -0.13 -0.07 -1.08 0.00 0.00 178.44 177.46 2w0c h LEU 88 N 0.68 0.49 -0.31 1.67 4.07 -1.27 -2.35 115.31 118.30 2w0c h LEU 88 Ca 0.49 -0.13 -0.03 0.00 0.08 0.00 0.00 57.88 58.29 2w0c h LEU 88 Cb 0.84 -0.13 -0.01 0.00 1.08 0.00 0.00 40.66 42.44 2w0c h LEU 88 CO -0.25 0.66 0.06 1.23 -1.08 0.00 0.00 178.44 179.06 2w0c h GLY 89 N 0.93 0.54 1.00 0.83 0.00 -0.26 -2.30 103.07 103.81 2w0c h GLY 89 Ca 0.09 -0.35 0.01 0.00 0.00 0.00 0.00 47.33 47.07 2w0c h GLY 89 CO 0.03 0.33 0.40 0.74 0.00 0.00 0.00 176.54 178.04 2w0c h PHE 90 N 0.33 0.76 -0.86 5.60 -1.00 -1.10 0.28 116.94 120.96 2w0c h PHE 90 Ca 0.09 0.02 0.03 0.00 2.81 0.00 0.00 57.97 60.93 2w0c h PHE 90 Cb 0.32 -0.26 -0.05 0.00 3.61 0.00 0.00 35.95 39.58 2w0c h PHE 90 CO 0.02 0.47 0.56 0.78 -1.61 0.00 0.00 178.31 178.54 2w0c h GLY 91 N 0.82 1.22 1.11 -1.45 0.00 -1.37 0.34 103.07 103.74 2w0c h GLY 91 Ca 0.22 -0.42 -0.18 0.00 0.00 0.00 0.00 47.33 46.95 2w0c h GLY 91 CO -0.05 0.37 -0.56 -1.33 0.00 0.00 0.00 176.54 174.97 2w0c h GLY 92 N 1.07 0.90 1.82 4.60 0.00 -0.97 -2.66 103.07 107.83 2w0c h GLY 92 Ca 0.34 -1.09 -0.12 0.00 0.00 0.00 0.00 47.33 46.46 2w0c h GLY 92 CO -0.10 0.98 -0.50 1.41 0.00 0.00 0.00 176.54 178.33 2w0c h LEU 93 N 0.58 0.21 -0.10 3.11 4.07 -0.53 -2.62 115.31 120.03 2w0c h LEU 93 Ca 0.00 -0.10 -0.03 0.00 0.08 0.00 0.00 57.88 57.83 2w0c h LEU 93 Cb 1.17 -0.06 -0.00 0.00 1.08 0.00 0.00 40.66 42.85 2w0c h LEU 93 CO 0.12 0.67 -0.04 -0.07 -1.08 0.00 0.00 178.44 178.04 2w0c h LEU 94 N 0.15 0.20 -1.43 1.67 4.07 -0.34 -0.54 115.31 119.09 2w0c h LEU 94 Ca 0.01 -0.41 -0.05 0.00 0.08 0.00 0.00 57.88 57.51 2w0c h LEU 94 Cb 0.93 -0.06 -0.01 0.00 1.08 0.00 0.00 40.66 42.61 2w0c h LEU 94 CO 0.07 0.57 -0.11 1.62 -1.08 0.00 0.00 178.44 179.51 2w0c h VAL 95 N -0.16 1.17 -0.16 1.22 3.04 -1.50 0.50 116.25 120.37 2w0c h VAL 95 Ca 0.02 -0.73 -0.18 0.00 -1.01 0.00 0.00 66.70 64.80 2w0c h VAL 95 Cb 0.49 1.18 -0.00 0.00 -2.01 0.00 0.00 31.29 30.95 2w0c h VAL 95 CO 0.01 0.23 -0.65 -0.07 -1.01 0.00 0.00 177.57 176.08 2w0c h LEU 96 N 0.22 0.69 -0.43 3.16 4.07 -1.44 -1.62 115.31 119.95 2w0c h LEU 96 Ca 0.05 -0.41 -0.17 0.00 0.08 0.00 0.00 57.88 57.43 2w0c h LEU 96 Cb 0.34 -0.20 -0.00 0.00 1.08 0.00 0.00 40.66 41.88 2w0c h LEU 96 CO 0.02 1.16 -0.49 1.23 -1.08 0.00 0.00 178.44 179.27 2w0c h GLY 97 N 0.98 0.83 1.74 0.83 0.00 -0.34 -3.00 103.07 104.11 2w0c h GLY 97 Ca -0.01 -0.92 -0.15 0.00 0.00 0.00 0.00 47.33 46.25 2w0c h GLY 97 CO 0.12 0.83 -0.62 1.41 0.00 0.00 0.00 176.54 178.27 2w0c h LEU 98 N 0.60 0.30 -0.81 3.11 4.07 -0.03 -3.07 115.31 119.48 2w0c h LEU 98 Ca 0.03 -0.18 -0.12 0.00 0.08 0.00 0.00 57.88 57.69 2w0c h LEU 98 Cb 1.07 -0.09 -0.02 0.00 1.08 0.00 0.00 40.66 42.70 2w0c h LEU 98 CO 0.11 0.85 -0.58 1.62 -1.08 0.00 0.00 178.44 179.35 2w0c h VAL 99 N 0.19 1.39 -0.05 1.22 3.04 -1.33 -2.77 116.25 117.93 2w0c h VAL 99 Ca -0.01 -2.02 -0.10 0.00 -1.01 0.00 0.00 66.70 63.56 2w0c h VAL 99 Cb 1.14 2.10 -0.01 0.00 -2.01 0.00 0.00 31.29 32.51 2w0c h VAL 99 CO 0.10 0.57 -0.42 0.24 -1.01 0.00 0.00 177.57 177.05 2w0c h MET 100 N 0.00 0.11 -0.22 4.17 2.86 -1.48 -2.62 114.93 117.76 2w0c h MET 100 Ca -0.01 -0.05 -0.11 0.00 -2.06 0.00 0.00 59.70 57.48 2w0c h MET 100 Cb 1.05 -0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.70 2w0c h MET 100 CO 0.08 0.51 -0.34 0.00 1.06 0.00 0.00 176.91 178.22 2w0c h ARG 101 N 0.09 0.45 0.00 1.72 3.08 -1.41 -2.94 114.38 115.37 2w0c h ARG 101 Ca 0.01 -0.20 -0.06 0.00 0.07 0.00 0.00 59.98 59.79 2w0c h ARG 101 Cb 0.78 -0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.81 2w0c h ARG 101 CO 0.06 0.74 -0.30 0.78 -1.07 0.00 0.00 179.97 180.17 2w0c h GLY 102 N 1.08 0.00 0.88 0.04 0.00 -1.21 -2.88 103.07 100.97 2w0c h GLY 102 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.38 2w0c h GLY 102 CO 0.06 0.00 -0.06 0.70 0.00 0.00 0.00 176.54 177.24 2w0c n ASN 103 N -3.92 0.42 0.00 0.19 4.13 -1.02 -5.12 115.26 109.94 2w0c n ASN 103 Ca -0.02 -0.69 0.04 0.00 1.68 0.00 0.00 54.58 55.59 2w0c n ASN 103 Cb 0.37 -0.08 0.21 0.00 -1.54 0.00 0.00 39.78 38.75 2w0c n ASN 103 CO 0.00 0.00 0.00 0.29 0.28 0.00 0.00 177.26 177.83