#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1faa s GLU 2 N 0.00 2.29 0.06 3.23 0.41 -1.26 -5.12 118.70 118.32 1faa s GLU 2 Ca 0.00 -1.55 0.02 0.00 -0.41 0.00 0.00 54.97 53.03 1faa s GLU 2 Cb 0.00 -2.63 -0.04 0.00 -1.78 0.00 0.00 34.13 29.68 1faa s GLU 2 CO 0.00 -0.86 0.13 -1.17 -0.49 0.00 0.00 175.26 172.87 1faa s LEU 3 N -4.68 4.03 -0.00 1.80 1.98 -1.26 -5.11 118.68 115.43 1faa s LEU 3 Ca 0.62 0.11 0.07 0.00 -2.89 0.00 0.00 54.13 52.04 1faa s LEU 3 Cb -0.06 -2.65 -0.02 0.00 0.66 0.00 0.00 46.19 44.12 1faa s LEU 3 CO 0.39 0.18 -0.23 0.00 -1.89 0.00 0.00 176.35 174.80 1faa s ALA 4 N -1.42 1.88 0.27 5.97 0.00 -1.26 -5.04 121.76 122.16 1faa s ALA 4 Ca 0.31 -1.00 0.03 0.00 0.00 0.00 0.00 51.96 51.29 1faa s ALA 4 Cb -0.12 -0.46 -0.03 0.00 0.00 0.00 0.00 23.12 22.51 1faa s ALA 4 CO 0.24 0.46 0.43 -0.51 0.00 0.00 0.00 175.76 176.37 1faa s LEU 5 N -0.67 4.20 0.00 0.00 1.43 -1.26 -5.10 118.68 117.29 1faa s LEU 5 Ca 0.09 0.23 0.00 0.00 -1.03 0.00 0.00 54.13 53.42 1faa s LEU 5 Cb -0.09 -3.05 0.00 0.00 0.03 0.00 0.00 46.19 43.09 1faa s LEU 5 CO -0.00 -0.14 0.00 0.61 0.23 0.00 0.00 176.35 177.04 1faa n GLY 6 N -1.45 3.41 0.27 -3.19 0.00 -1.26 -4.83 105.19 98.13 1faa n GLY 6 Ca -0.07 -1.33 0.06 0.00 0.00 0.00 0.00 46.02 44.68 1faa n GLY 6 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1faa h THR 7 N 0.78 0.48 -0.62 2.61 2.02 -1.99 -1.08 112.91 115.11 1faa h THR 7 Ca 0.00 -0.08 0.12 0.00 0.77 0.00 0.00 66.41 67.21 1faa h THR 7 Cb 0.00 0.22 -0.12 0.00 -1.74 0.00 0.00 68.15 66.51 1faa h THR 7 CO 0.00 0.04 -0.27 -0.61 0.37 0.00 0.00 175.52 175.05 1faa h GLN 8 N 0.24 -0.10 -0.14 6.66 4.15 -1.99 0.49 115.11 124.42 1faa h GLN 8 Ca 0.42 0.01 -0.17 0.00 0.77 0.00 0.00 58.65 59.68 1faa h GLN 8 Cb 0.73 0.02 -0.01 0.00 0.21 0.00 0.00 27.48 28.44 1faa h GLN 8 CO -0.54 -0.07 -0.62 0.93 -1.93 0.00 0.00 178.83 176.61 1faa h GLU 9 N -0.10 0.48 -0.35 1.69 3.07 -1.61 -2.94 114.58 114.81 1faa h GLU 9 Ca 0.27 -0.33 -0.15 0.00 -0.50 0.00 0.00 59.36 58.65 1faa h GLU 9 Cb 0.53 0.05 -0.01 0.00 -0.84 0.00 0.00 28.75 28.48 1faa h GLU 9 CO -0.68 0.95 -0.37 0.52 -1.40 0.00 0.00 179.01 178.02 1faa h MET 10 N 0.35 0.82 -0.15 2.33 2.86 -0.82 -2.72 114.93 117.60 1faa h MET 10 Ca -0.01 -0.41 -0.05 0.00 -2.06 0.00 0.00 59.70 57.17 1faa h MET 10 Cb 1.17 0.01 -0.01 0.00 0.06 0.00 0.00 31.60 32.82 1faa h MET 10 CO 0.11 1.05 -0.14 0.93 1.06 0.00 0.00 176.91 179.92 1faa h GLU 11 N 0.67 0.24 0.00 1.72 5.08 -0.93 -2.30 114.58 119.05 1faa h GLU 11 Ca 0.06 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1faa h GLU 11 Cb 0.93 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 30.15 1faa h GLU 11 CO 0.09 0.38 0.00 0.00 -1.00 0.00 0.00 179.01 178.48 1faa n ALA 12 N -2.49 1.99 0.21 3.43 0.00 -1.04 -3.81 120.51 118.81 1faa n ALA 12 Ca -0.01 0.03 0.03 0.00 0.00 0.00 0.00 53.44 53.49 1faa n ALA 12 Cb 0.27 -1.43 -0.04 0.00 0.00 0.00 0.00 19.45 18.25 1faa n ALA 12 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 177.50 177.94 1faa n ILE 13 N -2.24 0.00 -1.87 0.00 -5.35 -0.91 -4.96 119.36 104.03 1faa n ILE 13 Ca 0.04 -0.29 -0.38 0.00 -0.27 0.00 0.00 62.75 61.85 1faa n ILE 13 Cb 0.34 0.81 0.04 0.00 -1.74 0.00 0.00 39.64 39.09 1faa n ILE 13 CO 0.00 0.00 0.00 0.68 -1.76 0.00 0.00 176.55 175.47 1faa s VAL 14 N -1.84 2.27 0.00 7.28 -7.23 -0.96 -2.27 120.40 117.65 1faa s VAL 14 Ca 0.01 0.20 0.00 0.00 -1.81 0.00 0.00 61.98 60.38 1faa s VAL 14 Cb 0.05 -3.10 0.00 0.00 0.56 0.00 0.00 36.38 33.89 1faa s VAL 14 CO 0.26 -0.01 0.00 0.61 -0.31 0.00 0.00 175.10 175.65 1faa n GLY 15 N 0.69 1.97 3.53 2.32 0.00 -1.23 -5.01 105.19 107.46 1faa n GLY 15 Ca 0.11 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.88 1faa n GLY 15 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1faa s LYS 16 N -0.34 1.83 -0.19 1.61 1.02 -0.96 -3.90 119.74 118.81 1faa s LYS 16 Ca 0.00 -2.06 -0.05 0.00 0.02 0.00 0.00 55.97 53.88 1faa s LYS 16 Cb 0.00 -1.03 -0.03 0.00 -0.52 0.00 0.00 37.83 36.25 1faa s LYS 16 CO 0.00 -0.25 -0.01 0.08 -0.92 0.00 0.00 175.35 174.25 1faa s VAL 17 N -3.12 3.95 -0.11 3.17 1.01 -1.26 -4.27 120.40 119.77 1faa s VAL 17 Ca 0.30 -0.32 0.03 0.00 0.00 0.00 0.00 61.98 61.98 1faa s VAL 17 Cb 0.07 -2.77 -0.01 0.00 0.00 0.00 0.00 36.38 33.67 1faa s VAL 17 CO 0.14 0.45 -0.20 -0.89 0.00 0.00 0.00 175.10 174.60 1faa s THR 18 N 0.80 2.40 -0.04 3.92 2.01 -0.82 -4.98 115.64 118.92 1faa s THR 18 Ca 0.00 -0.90 -0.24 0.00 0.31 0.00 0.00 61.69 60.86 1faa s THR 18 Cb -0.14 -1.95 -0.04 0.00 0.01 0.00 0.00 72.50 70.38 1faa s THR 18 CO 0.02 0.55 0.73 -0.70 -0.69 0.00 0.00 174.62 174.53 1faa s GLU 19 N 0.34 4.45 0.41 4.92 2.12 -1.26 -1.09 118.70 128.59 1faa s GLU 19 Ca -0.16 0.95 0.07 0.00 0.36 0.00 0.00 54.97 56.19 1faa s GLU 19 Cb -0.17 -3.43 -0.08 0.00 0.26 0.00 0.00 34.13 30.71 1faa s GLU 19 CO 0.08 0.11 0.01 0.14 -0.54 0.00 0.00 175.26 175.07 1faa s VAL 20 N 0.59 2.01 0.43 3.70 -7.23 -0.06 -4.90 120.40 114.94 1faa s VAL 20 Ca 0.39 -1.99 0.03 0.00 -1.81 0.00 0.00 61.98 58.59 1faa s VAL 20 Cb -0.19 -3.00 -0.01 0.00 0.56 0.00 0.00 36.38 33.74 1faa s VAL 20 CO 0.20 -0.00 0.10 -0.46 -0.31 0.00 0.00 175.10 174.63 1faa n ASN 21 N -0.98 1.86 0.00 4.85 6.94 -1.26 -4.50 115.26 122.17 1faa n ASN 21 Ca -0.05 -3.15 0.02 0.00 -0.02 0.00 0.00 54.58 51.38 1faa n ASN 21 Cb 0.67 0.82 0.11 0.00 -2.36 0.00 0.00 39.78 39.03 1faa n ASN 21 CO 0.00 0.00 0.00 2.29 -1.03 0.00 0.00 177.26 178.52 1faa n LYS 22 N -1.00 0.05 -0.05 -3.83 -0.00 -1.26 -1.64 118.16 110.42 1faa n LYS 22 Ca -0.10 0.30 -0.01 0.00 -0.00 0.00 0.00 58.31 58.49 1faa n LYS 22 Cb 0.61 -1.50 -0.14 0.00 -0.00 0.00 0.00 35.03 34.01 1faa n LYS 22 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.40 177.15 1faa n ASP 23 N -1.35 0.86 -0.29 -5.58 8.00 -1.26 -4.57 116.55 112.35 1faa n ASP 23 Ca 0.02 0.00 0.08 0.00 0.71 0.00 0.00 54.79 55.60 1faa n ASP 23 Cb 0.04 1.29 -0.02 0.00 -0.02 0.00 0.00 41.12 42.41 1faa n ASP 23 CO 0.00 0.00 0.00 0.35 -0.39 0.00 0.00 177.20 177.16 1faa n THR 24 N -2.42 0.00 0.37 -3.53 -2.24 -0.90 -4.63 114.28 100.93 1faa n THR 24 Ca -0.18 -0.29 -0.15 0.00 -2.27 0.00 0.00 64.05 61.16 1faa n THR 24 Cb 0.81 1.15 -0.07 0.00 -2.10 0.00 0.00 70.33 70.12 1faa n THR 24 CO 0.00 0.00 0.00 0.15 -0.57 0.00 0.00 175.07 174.65 1faa h PHE 25 N 1.42 -0.88 -0.85 4.78 3.57 -1.56 -3.15 116.94 120.26 1faa h PHE 25 Ca 0.00 -0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.48 1faa h PHE 25 Cb 0.51 0.29 -0.04 0.00 2.79 0.00 0.00 35.95 39.50 1faa h PHE 25 CO 0.00 -0.55 0.55 -1.49 -2.23 0.00 0.00 178.31 174.59 1faa h TRP 26 N -1.07 1.08 -0.26 0.41 4.06 -1.86 -1.48 115.95 116.84 1faa h TRP 26 Ca -0.10 0.02 0.07 0.00 2.06 0.00 0.00 58.89 60.94 1faa h TRP 26 Cb 0.73 -0.36 -0.01 0.00 -1.00 0.00 0.00 29.16 28.52 1faa h TRP 26 CO 0.04 0.69 0.19 -1.35 -3.56 0.00 0.00 178.44 174.45 1faa h PRO 27 N 1.16 0.00 0.04 0.49 0.11 -1.82 0.27 132.00 132.25 1faa h PRO 27 Ca 0.31 0.00 -0.05 0.00 0.11 0.00 0.00 66.00 66.37 1faa h PRO 27 Cb -0.11 0.00 0.01 0.00 0.11 0.00 0.00 31.00 31.00 1faa h PRO 27 CO -0.06 0.00 -0.21 0.82 -0.21 0.00 0.00 178.00 178.33 1faa h ILE 28 N 0.00 1.73 -0.79 4.15 2.04 -1.35 -2.97 117.51 120.31 1faa h ILE 28 Ca 0.12 -2.40 0.04 0.00 1.00 0.00 0.00 64.86 63.63 1faa h ILE 28 Cb 0.49 3.35 -0.05 0.00 -0.74 0.00 0.00 36.82 39.87 1faa h ILE 28 CO -0.00 0.64 0.50 0.58 0.00 0.00 0.00 178.15 179.86 1faa h VAL 29 N -0.84 1.08 -0.13 1.67 2.07 -0.89 -1.97 116.25 117.24 1faa h VAL 29 Ca -0.04 -0.32 -0.05 0.00 0.82 0.00 0.00 66.70 67.11 1faa h VAL 29 Cb 1.17 0.06 -0.01 0.00 -1.52 0.00 0.00 31.29 30.98 1faa h VAL 29 CO 0.04 0.17 -0.16 0.11 0.02 0.00 0.00 177.57 177.76 1faa h LYS 30 N 0.94 0.21 -0.00 1.57 1.57 -0.59 -2.21 116.57 118.06 1faa h LYS 30 Ca 0.33 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 59.06 1faa h LYS 30 Cb 0.08 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.36 1faa h LYS 30 CO -0.14 0.38 -0.12 0.00 -0.57 0.00 0.00 179.45 179.00 1faa n ALA 31 N -2.49 2.75 0.41 3.86 0.00 -0.80 -4.16 120.51 120.08 1faa n ALA 31 Ca -0.01 -0.25 0.11 0.00 0.00 0.00 0.00 53.44 53.29 1faa n ALA 31 Cb 0.28 -1.34 0.46 0.00 0.00 0.00 0.00 19.45 18.85 1faa n ALA 31 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1faa n ALA 32 N -1.05 1.64 -0.81 0.00 0.00 -0.83 -4.86 120.51 114.61 1faa n ALA 32 Ca 0.13 0.07 0.00 0.00 0.00 0.00 0.00 53.44 53.64 1faa n ALA 32 Cb 0.28 -1.36 0.00 0.00 0.00 0.00 0.00 19.45 18.37 1faa n ALA 32 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1faa n GLY 33 N -0.04 2.80 1.32 0.00 0.00 -1.26 -1.68 105.19 106.33 1faa n GLY 33 Ca 0.02 -0.32 0.11 0.00 0.00 0.00 0.00 46.02 45.84 1faa n GLY 33 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1faa n ASP 34 N 3.83 3.84 -4.72 1.61 5.75 -1.26 -3.95 116.55 121.65 1faa n ASP 34 Ca 0.00 -2.03 -0.42 0.00 -0.01 0.00 0.00 54.79 52.34 1faa n ASP 34 Cb 0.00 -0.48 -0.03 0.00 -1.03 0.00 0.00 41.12 39.58 1faa n ASP 34 CO 0.00 0.00 0.00 -0.54 -0.11 0.00 0.00 177.20 176.55 1faa s LYS 35 N -1.10 4.54 0.56 0.11 1.02 -0.68 -4.83 119.74 119.36 1faa s LYS 35 Ca 0.48 1.65 -0.20 0.00 0.02 0.00 0.00 55.97 57.92 1faa s LYS 35 Cb 0.25 -3.35 -0.05 0.00 -0.52 0.00 0.00 37.83 34.17 1faa s LYS 35 CO 0.32 -0.06 1.20 -2.14 -0.92 0.00 0.00 175.35 173.75 1faa s PRO 36 N 0.47 3.16 -0.06 -1.68 0.02 -1.26 -4.71 135.00 130.94 1faa s PRO 36 Ca 0.53 1.81 0.06 0.00 0.02 0.00 0.00 61.00 63.41 1faa s PRO 36 Cb -0.27 -2.02 -0.01 0.00 0.02 0.00 0.00 34.50 32.22 1faa s PRO 36 CO 0.31 -1.05 -0.25 0.08 -0.33 0.00 0.00 177.00 175.76 1faa s VAL 37 N -1.60 2.06 -0.10 3.83 1.01 0.12 -1.34 120.40 124.38 1faa s VAL 37 Ca 0.74 -1.06 0.03 0.00 0.00 0.00 0.00 61.98 61.69 1faa s VAL 37 Cb -0.30 -1.74 -0.01 0.00 0.00 0.00 0.00 36.38 34.33 1faa s VAL 37 CO 0.33 0.57 -0.19 -0.69 0.00 0.00 0.00 175.10 175.12 1faa s VAL 38 N -0.13 2.53 -0.15 2.92 1.01 0.88 -0.14 120.40 127.32 1faa s VAL 38 Ca -0.05 -0.86 0.02 0.00 0.00 0.00 0.00 61.98 61.09 1faa s VAL 38 Cb -0.14 -2.00 0.01 0.00 0.00 0.00 0.00 36.38 34.25 1faa s VAL 38 CO 0.04 0.55 -0.20 -0.22 0.00 0.00 0.00 175.10 175.27 1faa s LEU 39 N 0.15 2.07 -0.46 3.92 2.96 0.47 -0.43 118.68 127.37 1faa s LEU 39 Ca -0.10 -0.61 -0.18 0.00 -0.22 0.00 0.00 54.13 53.02 1faa s LEU 39 Cb -0.16 -1.42 0.04 0.00 0.50 0.00 0.00 46.19 45.15 1faa s LEU 39 CO 0.06 0.04 0.51 -0.62 -1.32 0.00 0.00 176.35 175.02 1faa s ASP 40 N 1.05 6.21 -0.32 3.68 2.15 -0.36 -0.89 116.67 128.19 1faa s ASP 40 Ca -0.02 -0.78 -0.16 0.00 0.43 0.00 0.00 52.55 52.02 1faa s ASP 40 Cb -0.14 -2.25 -0.02 0.00 -0.30 0.00 0.00 42.92 40.21 1faa s ASP 40 CO -0.07 -0.71 0.40 -0.04 -0.17 0.00 0.00 175.17 174.58 1faa s MET 41 N 2.31 3.73 0.37 4.34 -1.94 0.51 -0.99 119.30 127.64 1faa s MET 41 Ca 0.13 -0.20 0.05 0.00 -1.71 0.00 0.00 55.69 53.96 1faa s MET 41 Cb -0.18 -3.75 -0.03 0.00 2.01 0.00 0.00 34.83 32.88 1faa s MET 41 CO 0.13 -0.47 0.19 -0.59 -0.01 0.00 0.00 175.02 174.27 1faa s PHE 42 N 2.12 1.75 0.09 -0.03 -0.71 -0.80 -2.11 117.98 118.29 1faa s PHE 42 Ca 0.14 -1.44 0.03 0.00 -1.04 0.00 0.00 56.93 54.62 1faa s PHE 42 Cb -0.16 -0.96 -0.04 0.00 -1.21 0.00 0.00 43.02 40.65 1faa s PHE 42 CO 0.11 -0.54 -0.08 0.95 -1.34 0.00 0.00 175.22 174.32 1faa s THR 43 N -3.33 0.77 0.03 -4.49 -4.23 -1.26 0.03 115.64 103.15 1faa s THR 43 Ca 0.31 -1.64 0.31 0.00 -1.18 0.00 0.00 61.69 59.49 1faa s THR 43 Cb 0.02 -1.33 0.33 0.00 1.34 0.00 0.00 72.50 72.87 1faa s THR 43 CO 0.20 -0.64 1.95 1.56 -0.54 0.00 0.00 174.62 177.14 1faa h GLN 44 N 3.52 0.00 -0.63 3.99 1.08 -1.98 -2.15 115.11 118.93 1faa h GLN 44 Ca -0.36 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 56.84 1faa h GLN 44 Cb 1.18 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.61 1faa h GLN 44 CO 0.55 0.00 0.00 -2.67 -0.95 0.00 0.00 178.83 175.76 1faa n TRP 45 N -2.71 1.13 -3.10 2.96 4.27 -1.26 -4.90 117.44 113.83 1faa n TRP 45 Ca -0.00 -0.56 -0.44 0.00 -3.89 0.00 0.00 57.50 52.61 1faa n TRP 45 Cb 0.18 -0.12 -0.05 0.00 -1.36 0.00 0.00 31.31 29.95 1faa n TRP 45 CO 0.00 0.00 0.00 0.00 -2.29 0.00 0.00 177.69 175.40 1faa h GLY 47 N 9.98 -1.34 0.73 0.00 0.00 -1.90 -2.42 103.07 108.11 1faa h GLY 47 Ca -0.28 0.55 0.18 0.00 0.00 0.00 0.00 47.33 47.78 1faa h GLY 47 CO 1.03 -0.45 0.46 -2.55 0.00 0.00 0.00 176.54 175.03 1faa h PRO 48 N -1.20 0.00 -0.08 4.80 0.11 -1.96 -1.58 132.00 132.10 1faa h PRO 48 Ca -0.10 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 66.00 1faa h PRO 48 Cb 0.96 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.07 1faa h PRO 48 CO 0.10 0.00 0.02 0.00 -0.21 0.00 0.00 178.00 177.91 1faa h LYS 50 N -0.08 0.93 -0.02 0.00 1.57 -0.85 -2.58 116.57 115.53 1faa h LYS 50 Ca 0.02 -0.28 -0.01 0.00 -1.87 0.00 0.00 60.65 58.51 1faa h LYS 50 Cb 0.23 -0.09 -0.00 0.00 0.08 0.00 0.00 32.23 32.45 1faa h LYS 50 CO -0.00 0.93 -0.03 0.00 -0.57 0.00 0.00 179.45 179.78 1faa h ALA 51 N 0.96 1.91 0.00 3.86 0.00 -1.26 -1.76 119.26 122.97 1faa h ALA 51 Ca 0.16 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 1faa h ALA 51 Cb 0.49 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.26 1faa h ALA 51 CO 0.02 0.07 -0.27 0.52 0.00 0.00 0.00 179.25 179.59 1faa h MET 52 N 0.03 0.00 -0.72 0.00 2.86 -0.92 -3.39 114.93 112.79 1faa h MET 52 Ca 0.01 0.00 0.14 0.00 -2.06 0.00 0.00 59.70 57.78 1faa h MET 52 Cb 0.08 0.00 -0.14 0.00 0.06 0.00 0.00 31.60 31.60 1faa h MET 52 CO 0.00 0.06 -0.26 0.00 1.06 0.00 0.00 176.91 177.77 1faa h ALA 53 N 1.94 0.27 -0.08 6.32 0.00 -0.93 -0.56 119.26 126.23 1faa h ALA 53 Ca -0.00 0.25 -0.06 0.00 0.00 0.00 0.00 54.91 55.10 1faa h ALA 53 Cb 1.05 0.70 -0.01 0.00 0.00 0.00 0.00 17.79 19.53 1faa h ALA 53 CO 0.01 -0.53 -0.22 -1.35 0.00 0.00 0.00 179.25 177.16 1faa h PRO 54 N -0.06 0.13 -0.29 0.00 0.11 -1.76 -1.70 132.00 128.44 1faa h PRO 54 Ca 0.32 -0.03 -0.17 0.00 0.11 0.00 0.00 66.00 66.22 1faa h PRO 54 Cb 0.56 -0.01 -0.00 0.00 0.11 0.00 0.00 31.00 31.65 1faa h PRO 54 CO -0.77 0.35 -0.51 0.87 -0.21 0.00 0.00 178.00 177.73 1faa h LYS 55 N 0.12 0.82 -0.78 1.05 1.57 -1.40 -2.32 116.57 115.62 1faa h LYS 55 Ca 0.02 -0.50 -0.03 0.00 -1.87 0.00 0.00 60.65 58.27 1faa h LYS 55 Cb 0.46 0.05 -0.04 0.00 0.08 0.00 0.00 32.23 32.79 1faa h LYS 55 CO 0.03 1.13 0.37 -0.92 -0.57 0.00 0.00 179.45 179.49 1faa h TYR 56 N 0.64 1.13 0.00 -1.35 3.20 -0.99 -0.98 116.97 118.63 1faa h TYR 56 Ca 0.02 -0.06 -0.06 0.00 3.14 0.00 0.00 58.73 61.78 1faa h TYR 56 Cb 1.10 -0.35 -0.01 0.00 1.54 0.00 0.00 36.73 39.01 1faa h TYR 56 CO 0.06 0.83 -0.28 0.93 -1.64 0.00 0.00 178.16 178.06 1faa h GLU 57 N 1.10 0.00 -0.20 1.82 5.08 -1.21 -1.69 114.58 119.49 1faa h GLU 57 Ca 0.27 0.00 -0.15 0.00 -1.00 0.00 0.00 59.36 58.48 1faa h GLU 57 Cb 0.12 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.38 1faa h GLU 57 CO -0.03 0.28 -0.47 -0.22 -1.00 0.00 0.00 179.01 177.57 1faa h LYS 58 N 0.00 0.66 -0.87 2.33 1.63 -0.73 -2.63 116.57 116.97 1faa h LYS 58 Ca -0.00 -0.45 0.03 0.00 -0.85 0.00 0.00 60.65 59.37 1faa h LYS 58 Cb 0.56 0.07 -0.05 0.00 -0.60 0.00 0.00 32.23 32.21 1faa h LYS 58 CO 0.04 1.07 0.57 -0.07 -3.45 0.00 0.00 179.45 177.61 1faa h LEU 59 N 0.36 0.95 -1.64 5.20 3.38 -0.79 -1.72 115.31 121.05 1faa h LEU 59 Ca -0.00 -0.01 -0.04 0.00 0.09 0.00 0.00 57.88 57.91 1faa h LEU 59 Cb 1.08 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 41.61 1faa h LEU 59 CO 0.10 0.66 -0.21 0.00 0.09 0.00 0.00 178.44 179.08 1faa h ALA 60 N 1.36 1.45 0.10 1.53 0.00 -1.18 -1.44 119.26 121.08 1faa h ALA 60 Ca 0.34 -0.19 -0.26 0.00 0.00 0.00 0.00 54.91 54.81 1faa h ALA 60 Cb -0.02 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 17.74 1faa h ALA 60 CO -0.11 0.26 -1.18 0.93 0.00 0.00 0.00 179.25 179.14 1faa h GLU 61 N 0.00 0.23 -0.07 0.00 5.08 -1.00 -3.27 114.58 115.56 1faa h GLU 61 Ca -0.00 -0.38 -0.25 0.00 -1.00 0.00 0.00 59.36 57.72 1faa h GLU 61 Cb 0.42 0.14 0.02 0.00 0.50 0.00 0.00 28.75 29.83 1faa h GLU 61 CO 0.03 1.17 -0.93 0.93 -1.00 0.00 0.00 179.01 179.21 1faa h GLU 62 N 0.07 0.75 -3.67 2.33 5.08 -0.94 -3.41 114.58 114.78 1faa h GLU 62 Ca -0.11 -0.72 -0.75 0.00 -1.00 0.00 0.00 59.36 56.79 1faa h GLU 62 Cb 1.91 0.18 -0.30 0.00 0.50 0.00 0.00 28.75 31.04 1faa h GLU 62 CO 0.19 1.30 -0.08 0.71 -1.00 0.00 0.00 179.01 180.13 1faa s TYR 63 N -3.51 3.65 -1.22 4.33 2.02 -0.58 -4.91 117.35 117.14 1faa s TYR 63 Ca -0.10 -2.40 0.24 0.00 -0.37 0.00 0.00 57.07 54.44 1faa s TYR 63 Cb 0.08 -3.53 1.11 0.00 -0.40 0.00 0.00 41.96 39.21 1faa s TYR 63 CO 0.92 -0.91 1.77 1.28 -1.57 0.00 0.00 175.55 177.04 1faa n LEU 64 N 3.58 0.00 -1.68 -1.29 4.77 -1.26 -3.05 117.00 118.07 1faa n LEU 64 Ca 0.13 0.39 -0.07 0.00 -0.03 0.00 0.00 56.01 56.43 1faa n LEU 64 Cb 0.42 -0.39 0.25 0.00 -2.33 0.00 0.00 43.42 41.37 1faa n LEU 64 CO 0.34 -0.08 0.96 -0.90 -1.33 0.00 0.00 177.39 176.38 1faa n ASP 65 N -1.39 3.96 -3.89 -1.43 5.75 -1.26 -4.71 116.55 113.58 1faa n ASP 65 Ca 0.09 -3.39 -0.12 0.00 -0.01 0.00 0.00 54.79 51.35 1faa n ASP 65 Cb 0.23 -0.71 -0.14 0.00 -1.03 0.00 0.00 41.12 39.48 1faa n ASP 65 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 1faa s VAL 66 N -3.09 0.06 -0.27 2.12 1.01 -1.17 -4.24 120.40 114.82 1faa s VAL 66 Ca 0.51 -0.10 -0.10 0.00 0.00 0.00 0.00 61.98 62.30 1faa s VAL 66 Cb 0.43 -0.07 -0.04 0.00 0.00 0.00 0.00 36.38 36.70 1faa s VAL 66 CO 0.09 -0.03 0.14 -0.63 0.00 0.00 0.00 175.10 174.68 1faa s ILE 67 N -0.13 4.90 -0.24 2.22 1.01 -0.45 -4.65 121.20 123.85 1faa s ILE 67 Ca -0.01 0.02 -0.08 0.00 0.00 0.00 0.00 60.65 60.57 1faa s ILE 67 Cb -0.01 -3.32 -0.04 0.00 0.01 0.00 0.00 42.46 39.10 1faa s ILE 67 CO -0.00 0.28 0.10 -0.36 0.00 0.00 0.00 174.94 174.96 1faa s PHE 68 N 1.70 3.16 0.30 3.97 0.40 -1.26 -0.08 117.98 126.16 1faa s PHE 68 Ca 0.07 -0.16 0.05 0.00 -0.60 0.00 0.00 56.93 56.29 1faa s PHE 68 Cb -0.16 -2.25 -0.06 0.00 0.51 0.00 0.00 43.02 41.07 1faa s PHE 68 CO 0.08 -0.20 -0.01 -0.51 0.70 0.00 0.00 175.22 175.28 1faa s LEU 69 N 1.40 2.38 -0.03 -0.37 1.43 0.42 -1.95 118.68 121.97 1faa s LEU 69 Ca 0.06 -1.26 -0.05 0.00 -1.03 0.00 0.00 54.13 51.85 1faa s LEU 69 Cb -0.15 -0.53 0.01 0.00 0.03 0.00 0.00 46.19 45.54 1faa s LEU 69 CO 0.05 -0.45 0.12 -1.59 0.23 0.00 0.00 176.35 174.71 1faa s LYS 70 N -3.79 0.25 -0.09 1.70 -2.85 -0.25 -1.22 119.74 113.49 1faa s LYS 70 Ca 0.32 -0.04 0.01 0.00 -1.00 0.00 0.00 55.97 55.25 1faa s LYS 70 Cb 0.06 0.11 0.02 0.00 -2.06 0.00 0.00 37.83 35.96 1faa s LYS 70 CO 0.13 -0.05 -0.09 -1.17 0.10 0.00 0.00 175.35 174.27 1faa s LEU 71 N -0.45 1.38 -0.32 2.77 2.96 -0.16 -0.88 118.68 123.98 1faa s LEU 71 Ca -0.05 -0.28 -0.29 0.00 -0.22 0.00 0.00 54.13 53.29 1faa s LEU 71 Cb -0.03 -0.79 0.02 0.00 0.50 0.00 0.00 46.19 45.89 1faa s LEU 71 CO 0.00 -0.05 1.07 -0.62 -1.32 0.00 0.00 176.35 175.44 1faa s ASP 72 N 1.19 6.93 -1.30 3.68 -1.08 -1.26 -1.91 116.67 122.92 1faa s ASP 72 Ca -0.05 1.05 -0.14 0.00 -0.52 0.00 0.00 52.55 52.88 1faa s ASP 72 Cb -0.14 -2.54 0.11 0.00 -1.46 0.00 0.00 42.92 38.89 1faa s ASP 72 CO -0.02 -0.88 1.76 0.00 0.52 0.00 0.00 175.17 176.55 1faa n ASN 74 N 6.34 0.55 0.00 0.00 0.23 -1.26 -4.84 115.26 116.28 1faa n ASN 74 Ca 0.44 0.00 -0.13 0.00 -0.53 0.00 0.00 54.58 54.36 1faa n ASN 74 Cb 0.42 0.00 -0.10 0.00 -2.08 0.00 0.00 39.78 38.02 1faa n ASN 74 CO 0.00 0.00 0.00 -0.61 -0.93 0.00 0.00 177.26 175.72 1faa h GLN 75 N 0.00 -0.05 0.00 -3.83 5.75 -2.00 -2.42 115.11 112.57 1faa h GLN 75 Ca 0.00 0.00 -0.01 0.00 -0.15 0.00 0.00 58.65 58.49 1faa h GLN 75 Cb 0.00 0.01 -0.00 0.00 1.07 0.00 0.00 27.48 28.56 1faa h GLN 75 CO 0.00 0.44 -0.05 1.49 -2.65 0.00 0.00 178.83 178.06 1faa h GLU 76 N -0.56 0.00 -0.36 1.69 4.57 -1.97 -2.72 114.58 115.23 1faa h GLU 76 Ca -0.00 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.18 1faa h GLU 76 Cb 0.51 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.10 1faa h GLU 76 CO 0.01 0.05 0.00 0.09 -1.18 0.00 0.00 179.01 177.98 1faa n ASN 77 N -3.64 3.27 -0.29 1.04 3.02 -1.23 -4.66 115.26 112.78 1faa n ASN 77 Ca -0.02 -2.25 0.08 0.00 -0.03 0.00 0.00 54.58 52.36 1faa n ASN 77 Cb 0.16 -0.33 0.24 0.00 -0.61 0.00 0.00 39.78 39.23 1faa n ASN 77 CO 0.00 0.00 0.00 0.50 -2.62 0.00 0.00 177.26 175.14 1faa h LYS 78 N 2.15 0.49 0.53 3.52 3.64 -1.10 -1.78 116.57 124.02 1faa h LYS 78 Ca 0.00 -0.03 -0.02 0.00 -1.27 0.00 0.00 60.65 59.33 1faa h LYS 78 Cb 0.94 -0.11 -0.01 0.00 -0.41 0.00 0.00 32.23 32.63 1faa h LYS 78 CO 0.06 0.32 -0.44 1.79 -2.27 0.00 0.00 179.45 178.92 1faa h THR 79 N 0.51 0.00 -0.84 1.00 1.35 -1.83 -0.57 112.91 112.53 1faa h THR 79 Ca 0.47 0.00 0.07 0.00 -0.55 0.00 0.00 66.41 66.40 1faa h THR 79 Cb 0.76 0.00 -0.06 0.00 -1.73 0.00 0.00 68.15 67.12 1faa h THR 79 CO -0.42 0.00 0.52 0.25 -0.25 0.00 0.00 175.52 175.61 1faa h LEU 80 N -0.94 0.80 0.26 3.87 5.85 -1.87 -0.41 115.31 122.87 1faa h LEU 80 Ca -0.07 0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.68 1faa h LEU 80 Cb 0.79 -0.14 -0.02 0.00 0.37 0.00 0.00 40.66 41.66 1faa h LEU 80 CO -0.00 0.50 -0.25 0.00 -0.34 0.00 0.00 178.44 178.35 1faa h ALA 81 N 1.41 -0.53 -0.96 1.25 0.00 -1.15 0.54 119.26 119.83 1faa h ALA 81 Ca 0.37 -0.08 0.06 0.00 0.00 0.00 0.00 54.91 55.26 1faa h ALA 81 Cb 0.20 0.36 -0.06 0.00 0.00 0.00 0.00 17.79 18.29 1faa h ALA 81 CO -0.18 -0.83 0.62 0.87 0.00 0.00 0.00 179.25 179.73 1faa h LYS 82 N -0.54 1.10 -0.17 0.00 1.57 -0.68 -1.14 116.57 116.71 1faa h LYS 82 Ca -0.01 -0.07 -0.07 0.00 -1.87 0.00 0.00 60.65 58.63 1faa h LYS 82 Cb 0.50 -0.25 -0.01 0.00 0.08 0.00 0.00 32.23 32.55 1faa h LYS 82 CO -0.05 0.73 -0.22 1.49 -0.57 0.00 0.00 179.45 180.83 1faa h GLU 83 N 1.13 0.29 0.00 3.15 4.81 -0.52 -1.98 114.58 121.46 1faa h GLU 83 Ca 0.40 -0.09 0.00 0.00 -0.13 0.00 0.00 59.36 59.54 1faa h GLU 83 Cb 0.13 -0.03 0.00 0.00 0.63 0.00 0.00 28.75 29.48 1faa h GLU 83 CO -0.15 0.50 -0.18 1.28 -0.73 0.00 0.00 179.01 179.74 1faa n LEU 84 N -4.18 0.33 -1.87 1.64 4.77 0.13 -5.00 117.00 112.82 1faa n LEU 84 Ca -0.01 0.37 -0.00 0.00 -0.03 0.00 0.00 56.01 56.34 1faa n LEU 84 Cb 0.35 -0.38 0.00 0.00 -2.33 0.00 0.00 43.42 41.06 1faa n LEU 84 CO 0.40 -0.01 -0.12 0.61 -1.33 0.00 0.00 177.39 176.94 1faa n GLY 85 N 1.45 -2.78 3.09 -0.72 0.00 -0.64 -5.07 105.19 100.52 1faa n GLY 85 Ca 0.06 0.03 -0.26 0.00 0.00 0.00 0.00 46.02 45.86 1faa n GLY 85 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1faa s ILE 86 N -0.69 1.34 -0.02 -0.61 2.07 -1.25 -4.98 121.20 117.05 1faa s ILE 86 Ca 0.02 -0.63 0.06 0.00 -1.41 0.00 0.00 60.65 58.68 1faa s ILE 86 Cb -0.00 -1.18 -0.09 0.00 0.13 0.00 0.00 42.46 41.31 1faa s ILE 86 CO 0.23 0.40 0.10 0.54 -1.91 0.00 0.00 174.94 174.30 1faa n ARG 87 N 3.49 1.10 -3.94 3.50 1.74 -1.26 -4.97 116.66 116.33 1faa n ARG 87 Ca -0.20 -0.04 -0.10 0.00 -0.77 0.00 0.00 57.85 56.74 1faa n ARG 87 Cb 0.52 -1.15 -0.06 0.00 -1.02 0.00 0.00 32.46 30.76 1faa n ARG 87 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 1faa s VAL 88 N -2.33 0.04 0.01 1.55 0.11 -1.26 -5.17 120.40 113.35 1faa s VAL 88 Ca -0.02 -1.30 0.04 0.00 -2.93 0.00 0.00 61.98 57.76 1faa s VAL 88 Cb 0.03 -1.89 -0.01 0.00 -1.53 0.00 0.00 36.38 32.97 1faa s VAL 88 CO 0.25 -0.19 -0.12 0.68 -3.33 0.00 0.00 175.10 172.39 1faa s VAL 89 N -3.97 0.95 0.49 2.04 -7.23 -1.26 -3.93 120.40 107.50 1faa s VAL 89 Ca 0.18 -0.70 -0.14 0.00 -1.81 0.00 0.00 61.98 59.51 1faa s VAL 89 Cb 0.02 -0.83 -0.07 0.00 0.56 0.00 0.00 36.38 36.06 1faa s VAL 89 CO 0.02 0.13 0.92 -2.16 -0.31 0.00 0.00 175.10 173.70 1faa s PRO 90 N -0.64 3.86 -0.03 4.82 0.04 -1.26 -4.82 135.00 136.97 1faa s PRO 90 Ca 0.03 0.78 0.02 0.00 0.04 0.00 0.00 61.00 61.86 1faa s PRO 90 Cb -0.06 -2.21 0.01 0.00 0.04 0.00 0.00 34.50 32.28 1faa s PRO 90 CO 0.00 -0.23 -0.08 0.99 0.04 0.00 0.00 177.00 177.73 1faa s THR 91 N -2.60 0.70 -0.15 1.26 2.01 -0.90 -0.44 115.64 115.51 1faa s THR 91 Ca 0.56 -0.28 -0.02 0.00 0.31 0.00 0.00 61.69 62.26 1faa s THR 91 Cb -0.10 -0.65 -0.02 0.00 0.01 0.00 0.00 72.50 71.74 1faa s THR 91 CO 0.34 0.23 -0.09 -0.36 -0.69 0.00 0.00 174.62 174.05 1faa s PHE 92 N 0.42 2.90 -0.12 4.92 0.08 0.12 -0.36 117.98 125.94 1faa s PHE 92 Ca -0.06 -0.59 -0.00 0.00 0.12 0.00 0.00 56.93 56.39 1faa s PHE 92 Cb -0.10 -1.92 -0.02 0.00 -0.57 0.00 0.00 43.02 40.40 1faa s PHE 92 CO 0.01 -0.22 -0.11 0.15 -0.10 0.00 0.00 175.22 174.95 1faa s LYS 93 N 0.55 3.33 -0.18 0.44 -0.14 -0.07 -0.66 119.74 123.02 1faa s LYS 93 Ca -0.06 -0.65 -0.04 0.00 -1.36 0.00 0.00 55.97 53.86 1faa s LYS 93 Cb -0.15 -2.66 -0.02 0.00 -1.68 0.00 0.00 37.83 33.32 1faa s LYS 93 CO 0.03 0.28 -0.03 0.42 -0.76 0.00 0.00 175.35 175.29 1faa s ILE 94 N 0.20 3.77 0.18 2.17 1.09 -0.54 -0.39 121.20 127.67 1faa s ILE 94 Ca -0.07 -0.39 0.10 0.00 -1.10 0.00 0.00 60.65 59.20 1faa s ILE 94 Cb -0.15 -2.67 -0.04 0.00 -1.06 0.00 0.00 42.46 38.54 1faa s ILE 94 CO 0.05 0.46 -0.19 -0.76 -0.10 0.00 0.00 174.94 174.40 1faa s LEU 95 N 0.73 2.63 -0.20 2.97 1.02 0.80 0.14 118.68 126.78 1faa s LEU 95 Ca -0.02 -0.73 -0.09 0.00 0.02 0.00 0.00 54.13 53.31 1faa s LEU 95 Cb -0.14 -1.37 0.07 0.00 0.02 0.00 0.00 46.19 44.77 1faa s LEU 95 CO 0.02 0.13 0.45 -0.75 0.02 0.00 0.00 176.35 176.22 1faa s LYS 96 N -2.62 0.41 -1.24 1.70 2.20 0.12 -0.71 119.74 119.61 1faa s LYS 96 Ca 0.21 0.95 -0.00 0.00 -0.36 0.00 0.00 55.97 56.77 1faa s LYS 96 Cb -0.09 0.15 -0.00 0.00 -1.51 0.00 0.00 37.83 36.38 1faa s LYS 96 CO 0.11 -0.19 0.88 0.39 -0.36 0.00 0.00 175.35 176.18 1faa n GLU 97 N 4.70 -5.94 -1.06 4.03 -0.58 -1.25 -2.62 120.64 117.91 1faa n GLU 97 Ca -0.17 0.76 -0.02 0.00 -0.42 0.00 0.00 57.16 57.30 1faa n GLU 97 Cb 0.53 -5.60 -0.01 0.00 -0.57 0.00 0.00 31.44 25.80 1faa n GLU 97 CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74 1faa n ASN 98 N -3.10 -5.30 -4.17 1.62 4.13 -1.26 -4.98 115.26 102.20 1faa n ASN 98 Ca -0.29 0.05 -0.20 0.00 1.68 0.00 0.00 54.58 55.81 1faa n ASN 98 Cb 0.67 -2.98 -0.13 0.00 -1.54 0.00 0.00 39.78 35.80 1faa n ASN 98 CO 0.00 0.00 0.00 -0.44 0.28 0.00 0.00 177.26 177.10 1faa s SER 99 N -2.10 1.78 -0.07 6.41 0.01 -1.08 -5.10 113.70 113.56 1faa s SER 99 Ca 0.00 -0.53 -0.30 0.00 1.31 0.00 0.00 55.95 56.44 1faa s SER 99 Cb 0.00 -0.10 -0.03 0.00 0.21 0.00 0.00 66.02 66.10 1faa s SER 99 CO 0.00 0.01 1.16 -0.69 0.41 0.00 0.00 173.24 174.13 1faa s VAL 100 N -1.00 4.36 -0.51 3.43 1.01 -1.26 -0.70 120.40 125.73 1faa s VAL 100 Ca 0.01 1.67 0.06 0.00 0.00 0.00 0.00 61.98 63.72 1faa s VAL 100 Cb -0.09 -4.07 -0.01 0.00 0.00 0.00 0.00 36.38 32.21 1faa s VAL 100 CO 0.02 -0.00 0.46 1.33 0.00 0.00 0.00 175.10 176.90 1faa n VAL 101 N 4.62 0.00 -3.63 2.92 0.24 0.12 -4.92 118.33 117.68 1faa n VAL 101 Ca 0.11 -0.43 -0.08 0.00 -2.04 0.00 0.00 64.34 61.90 1faa n VAL 101 Cb 0.47 1.06 -0.02 0.00 -1.47 0.00 0.00 33.84 33.88 1faa n VAL 101 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 1faa s GLY 102 N -1.03 -0.36 -0.24 7.63 0.00 -0.99 -4.98 107.32 107.34 1faa s GLY 102 Ca 0.05 0.35 -0.19 0.00 0.00 0.00 0.00 44.72 44.93 1faa s GLY 102 CO 0.15 0.11 0.61 1.85 0.00 0.00 0.00 173.10 175.83 1faa s GLU 103 N -3.50 0.68 -0.08 2.90 2.12 -1.26 -1.47 118.70 118.08 1faa s GLU 103 Ca 0.07 0.95 0.02 0.00 0.36 0.00 0.00 54.97 56.37 1faa s GLU 103 Cb -0.02 0.25 0.01 0.00 0.26 0.00 0.00 34.13 34.63 1faa s GLU 103 CO -0.04 -0.11 -0.12 0.08 -0.54 0.00 0.00 175.26 174.53 1faa s VAL 104 N 0.80 1.20 -0.11 3.70 1.01 0.17 -4.98 120.40 122.20 1faa s VAL 104 Ca -0.04 -0.49 -0.01 0.00 0.00 0.00 0.00 61.98 61.44 1faa s VAL 104 Cb -0.05 -1.11 -0.03 0.00 0.00 0.00 0.00 36.38 35.19 1faa s VAL 104 CO -0.06 0.38 -0.05 0.42 0.00 0.00 0.00 175.10 175.78 1faa s THR 105 N 0.87 3.83 0.00 3.92 -4.23 -1.26 0.15 115.64 118.92 1faa s THR 105 Ca -0.10 -0.41 0.00 0.00 -1.18 0.00 0.00 61.69 60.00 1faa s THR 105 Cb -0.15 -2.62 0.00 0.00 1.34 0.00 0.00 72.50 71.07 1faa s THR 105 CO 0.01 0.56 0.00 0.61 -0.54 0.00 0.00 174.62 175.26 1faa n GLY 106 N 2.77 -0.53 2.23 3.99 0.00 0.41 -4.53 105.19 109.54 1faa n GLY 106 Ca -0.18 -1.71 -0.29 0.00 0.00 0.00 0.00 46.02 43.84 1faa n GLY 106 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1faa n ALA 107 N -0.51 7.04 -2.38 4.61 0.00 -1.26 -4.74 120.51 123.27 1faa n ALA 107 Ca 0.00 -2.97 -0.42 0.00 0.00 0.00 0.00 53.44 50.05 1faa n ALA 107 Cb 0.00 -2.89 0.00 0.00 0.00 0.00 0.00 19.45 16.56 1faa n ALA 107 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1faa n LYS 108 N 2.90 3.91 -0.08 0.00 5.02 -1.26 -4.77 118.16 123.87 1faa n LYS 108 Ca 0.64 -3.67 0.25 0.00 -2.02 0.00 0.00 58.31 53.50 1faa n LYS 108 Cb 0.49 -2.82 0.72 0.00 -0.02 0.00 0.00 35.03 33.39 1faa n LYS 108 CO 0.00 0.00 0.00 0.10 -0.52 0.00 0.00 177.40 176.98 1faa h TYR 109 N 5.51 0.00 -0.20 2.13 -0.00 -1.98 0.86 116.97 123.28 1faa h TYR 109 Ca 0.41 0.00 -0.07 0.00 -0.00 0.00 0.00 58.73 59.07 1faa h TYR 109 Cb 0.57 0.00 -0.00 0.00 -0.00 0.00 0.00 36.73 37.30 1faa h TYR 109 CO 1.27 0.00 -0.15 0.38 -0.00 0.00 0.00 178.16 179.66 1faa h ASP 110 N 0.00 0.47 0.26 0.10 2.03 -2.00 -0.98 116.42 116.31 1faa h ASP 110 Ca 0.34 -0.45 -0.11 0.00 -0.73 0.00 0.00 57.03 56.08 1faa h ASP 110 Cb 1.43 -0.13 -0.01 0.00 -0.83 0.00 0.00 39.33 39.79 1faa h ASP 110 CO -0.00 0.83 -0.42 0.11 -1.03 0.00 0.00 179.24 178.72 1faa h LYS 111 N 0.12 0.21 -0.25 4.15 1.79 -1.32 -2.40 116.57 118.88 1faa h LYS 111 Ca 0.04 -0.10 -0.01 0.00 -2.18 0.00 0.00 60.65 58.39 1faa h LYS 111 Cb 0.68 -0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 31.32 1faa h LYS 111 CO 0.04 0.60 0.11 1.25 -1.08 0.00 0.00 179.45 180.37 1faa h LEU 112 N 0.17 0.33 -1.66 2.94 5.85 -0.92 -1.20 115.31 120.82 1faa h LEU 112 Ca 0.01 -0.14 -0.00 0.00 0.84 0.00 0.00 57.88 58.59 1faa h LEU 112 Cb 0.83 -0.08 -0.02 0.00 0.37 0.00 0.00 40.66 41.76 1faa h LEU 112 CO 0.06 0.38 0.18 0.25 -0.34 0.00 0.00 178.44 178.96 1faa h LEU 113 N 0.26 0.35 -0.16 2.25 7.12 -0.95 -1.21 115.31 122.97 1faa h LEU 113 Ca 0.08 -0.02 -0.04 0.00 0.13 0.00 0.00 57.88 58.03 1faa h LEU 113 Cb 0.14 -0.09 -0.00 0.00 -0.53 0.00 0.00 40.66 40.18 1faa h LEU 113 CO -0.01 0.28 -0.07 -0.33 -0.13 0.00 0.00 178.44 178.18 1faa h GLU 114 N 0.41 0.33 -0.50 1.25 5.08 -0.90 -2.37 114.58 117.87 1faa h GLU 114 Ca 0.11 -0.14 -0.02 0.00 -1.00 0.00 0.00 59.36 58.31 1faa h GLU 114 Cb -0.01 -0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.21 1faa h GLU 114 CO -0.02 0.64 0.24 0.00 -1.00 0.00 0.00 179.01 178.87 1faa h ALA 115 N 0.68 1.48 -0.46 3.43 0.00 -0.76 -0.07 119.26 123.56 1faa h ALA 115 Ca 0.04 -0.11 -0.12 0.00 0.00 0.00 0.00 54.91 54.72 1faa h ALA 115 Cb 0.54 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.11 1faa h ALA 115 CO 0.02 0.42 -0.18 0.82 0.00 0.00 0.00 179.25 180.33 1faa h ILE 116 N 0.70 1.27 -0.33 0.00 2.04 -1.18 -0.40 117.51 119.61 1faa h ILE 116 Ca 0.18 -1.31 -0.13 0.00 1.00 0.00 0.00 64.86 64.59 1faa h ILE 116 Cb 0.08 1.10 -0.01 0.00 -0.74 0.00 0.00 36.82 37.26 1faa h ILE 116 CO -0.02 0.45 -0.32 1.56 0.00 0.00 0.00 178.15 179.82 1faa h GLN 117 N 0.78 0.80 -0.31 2.37 1.08 -0.86 -2.82 115.11 116.15 1faa h GLN 117 Ca 0.11 -0.42 -0.01 0.00 -1.45 0.00 0.00 58.65 56.89 1faa h GLN 117 Cb 0.71 0.01 -0.01 0.00 -0.05 0.00 0.00 27.48 28.14 1faa h GLN 117 CO 0.05 1.05 0.16 0.00 -0.95 0.00 0.00 178.83 179.14 1faa h ALA 118 N 0.73 0.40 -0.53 3.87 0.00 -0.85 -2.82 119.26 120.07 1faa h ALA 118 Ca 0.05 -0.09 0.04 0.00 0.00 0.00 0.00 54.91 54.91 1faa h ALA 118 Cb 0.90 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 18.53 1faa h ALA 118 CO 0.08 -0.05 0.35 0.00 0.00 0.00 0.00 179.25 179.63 1faa h ALA 119 N 1.02 1.77 0.00 0.00 0.00 -1.04 -1.97 119.26 119.02 1faa h ALA 119 Ca 0.11 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.99 1faa h ALA 119 Cb 0.10 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 17.73 1faa h ALA 119 CO -0.01 0.17 0.00 0.54 0.00 0.00 0.00 179.25 179.95 1faa n ARG 120 N -4.47 0.59 0.00 0.00 1.74 -1.06 -4.86 116.66 108.59 1faa n ARG 120 Ca 0.06 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.14 1faa n ARG 120 Cb 0.16 -1.19 0.00 0.00 -1.02 0.00 0.00 32.46 30.40 1faa n ARG 120 CO 0.00 0.00 0.00 0.43 -1.52 0.00 0.00 177.63 176.54