#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1yko s ILE 2 N 0.00 4.90 -0.10 4.25 -1.09 -1.26 -5.05 121.20 122.86 1yko s ILE 2 Ca 0.00 1.30 -0.01 0.00 -2.23 0.00 0.00 60.65 59.70 1yko s ILE 2 Cb 0.00 -4.03 -0.03 0.00 -1.58 0.00 0.00 42.46 36.82 1yko s ILE 2 CO 0.00 -0.05 -0.04 -1.61 -1.23 0.00 0.00 174.94 172.01 1yko s GLU 3 N 2.69 3.09 0.39 2.79 0.41 -1.26 -5.12 118.70 121.69 1yko s GLU 3 Ca 0.30 -0.50 0.05 0.00 -0.41 0.00 0.00 54.97 54.41 1yko s GLU 3 Cb -0.15 -2.74 0.05 0.00 -1.78 0.00 0.00 34.13 29.51 1yko s GLU 3 CO 0.09 0.55 0.41 1.28 -0.49 0.00 0.00 175.26 177.09 1yko n LEU 4 N 2.60 0.00 -4.74 1.80 4.32 -1.26 -5.07 117.00 114.64 1yko n LEU 4 Ca -0.18 -1.84 -0.41 0.00 -0.02 0.00 0.00 56.01 53.56 1yko n LEU 4 Cb 0.53 -0.15 -0.03 0.00 -1.62 0.00 0.00 43.42 42.15 1yko n LEU 4 CO 0.29 -0.56 1.01 -0.76 -1.22 0.00 0.00 177.39 176.15 1yko s LEU 5 N 0.00 4.41 0.44 2.23 1.43 -1.26 -4.98 118.68 120.95 1yko s LEU 5 Ca 0.31 2.51 -0.23 0.00 -1.03 0.00 0.00 54.13 55.68 1yko s LEU 5 Cb -0.02 -3.62 -0.08 0.00 0.03 0.00 0.00 46.19 42.50 1yko s LEU 5 CO 0.20 -0.57 1.14 -2.84 0.23 0.00 0.00 176.35 174.51 1yko s PRO 6 N -0.41 3.89 0.56 1.29 0.02 -1.26 -5.02 135.00 134.07 1yko s PRO 6 Ca 0.56 1.72 -0.19 0.00 0.02 0.00 0.00 61.00 63.11 1yko s PRO 6 Cb -0.38 -2.47 -0.05 0.00 0.02 0.00 0.00 34.50 31.62 1yko s PRO 6 CO 0.41 -0.43 1.12 -2.00 -0.33 0.00 0.00 177.00 175.77 1yko s GLU 7 N -2.61 3.29 0.05 5.54 2.12 -1.26 -4.97 118.70 120.87 1yko s GLU 7 Ca 0.61 1.55 -0.31 0.00 0.36 0.00 0.00 54.97 57.18 1yko s GLU 7 Cb -0.27 -2.00 -0.07 0.00 0.26 0.00 0.00 34.13 32.05 1yko s GLU 7 CO 0.33 -0.88 1.45 0.99 -0.54 0.00 0.00 175.26 176.62 1yko s THR 8 N -1.90 3.43 0.43 -1.70 2.01 -1.26 -4.96 115.64 111.69 1yko s THR 8 Ca 0.71 0.91 -0.26 0.00 0.31 0.00 0.00 61.69 63.36 1yko s THR 8 Cb -0.23 -3.58 -0.08 0.00 0.01 0.00 0.00 72.50 68.62 1yko s THR 8 CO 0.29 0.02 1.40 -2.84 -0.69 0.00 0.00 174.62 172.80 1yko s PRO 9 N 2.05 3.79 0.46 4.92 0.02 -1.26 -5.01 135.00 139.97 1yko s PRO 9 Ca 0.66 2.35 -0.20 0.00 0.02 0.00 0.00 61.00 63.84 1yko s PRO 9 Cb -0.35 -2.70 -0.10 0.00 0.02 0.00 0.00 34.50 31.37 1yko s PRO 9 CO 0.29 -0.71 0.97 0.45 -0.33 0.00 0.00 177.00 177.67 1yko s SER 10 N -0.55 6.76 0.04 2.53 0.15 -1.26 -5.08 113.70 116.29 1yko s SER 10 Ca 0.59 1.72 0.00 0.00 0.70 0.00 0.00 55.95 58.96 1yko s SER 10 Cb -0.42 -2.54 -0.03 0.00 -1.71 0.00 0.00 66.02 61.32 1yko s SER 10 CO 0.55 -0.49 -0.04 -1.10 1.20 0.00 0.00 173.24 173.36 1yko s GLN 11 N -3.34 0.52 0.59 5.44 -1.52 -1.20 -4.88 119.66 115.27 1yko s GLN 11 Ca 0.62 -0.94 -0.19 0.00 -1.95 0.00 0.00 55.36 52.90 1yko s GLN 11 Cb -0.11 0.04 -0.04 0.00 -0.22 0.00 0.00 33.01 32.68 1yko s GLN 11 CO 0.17 -0.05 1.10 -2.37 -0.25 0.00 0.00 175.29 173.89 1yko n THR 12 N 0.84 3.88 0.27 -0.19 5.66 -1.21 -4.80 114.28 118.73 1yko n THR 12 Ca -0.19 -0.50 0.16 0.00 -3.05 0.00 0.00 64.05 60.47 1yko n THR 12 Cb 0.58 -1.31 0.72 0.00 -1.55 0.00 0.00 70.33 68.78 1yko n THR 12 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1yko h ALA 13 N 0.73 1.05 -0.18 1.79 0.00 -1.74 -3.49 119.26 117.42 1yko h ALA 13 Ca -0.49 -0.06 0.02 0.00 0.00 0.00 0.00 54.91 54.38 1yko h ALA 13 Cb 1.35 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 19.12 1yko h ALA 13 CO 0.53 0.08 -0.06 0.41 0.00 0.00 0.00 179.25 180.21 1yko n GLY 14 N -0.21 -2.37 0.23 0.00 0.00 -1.26 -4.00 105.19 97.57 1yko n GLY 14 Ca -0.00 -1.45 0.08 0.00 0.00 0.00 0.00 46.02 44.64 1yko n GLY 14 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1yko h PRO 15 N -0.07 0.00 -0.88 1.61 0.13 -1.93 -3.08 132.00 127.78 1yko h PRO 15 Ca -0.01 0.00 -0.28 0.00 -0.87 0.00 0.00 66.00 64.85 1yko h PRO 15 Cb 0.07 0.00 -0.16 0.00 0.13 0.00 0.00 31.00 31.04 1yko h PRO 15 CO 0.00 0.22 0.35 0.66 -0.23 0.00 0.00 178.00 179.00 1yko n TYR 16 N -3.92 2.24 -0.13 1.56 4.01 -1.26 -4.50 117.16 115.16 1yko n TYR 16 Ca -0.02 -1.25 0.17 0.00 -0.16 0.00 0.00 57.90 56.64 1yko n TYR 16 Cb 0.30 -0.69 0.55 0.00 -0.31 0.00 0.00 39.34 39.20 1yko n TYR 16 CO 0.00 0.00 0.00 -0.24 -0.46 0.00 0.00 176.86 176.16 1yko h VAL 17 N 1.69 0.77 -0.17 -0.72 3.04 -1.67 -2.27 116.25 116.92 1yko h VAL 17 Ca 0.34 -0.11 0.00 0.00 -1.01 0.00 0.00 66.70 65.93 1yko h VAL 17 Cb 2.26 0.43 -0.01 0.00 -2.01 0.00 0.00 31.29 31.96 1yko h VAL 17 CO 0.73 0.06 0.11 0.45 -1.01 0.00 0.00 177.57 177.91 1yko h HIS 18 N 0.31 0.21 -0.07 3.17 3.86 -1.87 -2.52 115.15 118.23 1yko h HIS 18 Ca 0.35 0.00 -0.07 0.00 -1.16 0.00 0.00 60.37 59.50 1yko h HIS 18 Cb 0.93 -0.07 -0.01 0.00 1.06 0.00 0.00 27.41 29.32 1yko h HIS 18 CO -0.00 0.13 -0.27 -0.84 0.86 0.00 0.00 177.93 177.81 1yko h ILE 19 N 0.22 1.23 0.00 2.45 3.07 -1.65 -0.42 117.51 122.41 1yko h ILE 19 Ca 0.06 -1.06 -0.08 0.00 1.55 0.00 0.00 64.86 65.33 1yko h ILE 19 Cb -0.02 1.47 -0.02 0.00 -0.27 0.00 0.00 36.82 37.99 1yko h ILE 19 CO -0.01 0.31 -2.08 0.61 -1.05 0.00 0.00 178.15 175.93 1yko n GLY 20 N -0.63 -0.99 0.00 0.16 0.00 -1.06 -4.42 105.19 98.25 1yko n GLY 20 Ca -0.01 -0.47 0.00 0.00 0.00 0.00 0.00 46.02 45.53 1yko n GLY 20 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1yko n LEU 21 N -2.36 0.06 -3.00 0.99 4.77 -0.97 -4.83 117.00 111.65 1yko n LEU 21 Ca -0.11 -0.52 -0.15 0.00 -0.03 0.00 0.00 56.01 55.20 1yko n LEU 21 Cb 0.70 0.00 0.01 0.00 -2.33 0.00 0.00 43.42 41.80 1yko n LEU 21 CO 0.45 0.01 -0.01 0.00 -1.33 0.00 0.00 177.39 176.51 1yko n ALA 22 N -0.93 0.80 -0.34 -1.18 0.00 -0.19 -4.96 120.51 113.70 1yko n ALA 22 Ca 0.00 -2.56 0.17 0.00 0.00 0.00 0.00 53.44 51.05 1yko n ALA 22 Cb 0.00 -1.03 0.38 0.00 0.00 0.00 0.00 19.45 18.80 1yko n ALA 22 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 1yko h LEU 23 N 3.27 0.68 -0.35 0.00 4.07 -1.70 -1.44 115.31 119.83 1yko h LEU 23 Ca 0.00 0.12 -0.12 0.00 0.08 0.00 0.00 57.88 57.96 1yko h LEU 23 Cb 1.00 0.01 -0.01 0.00 1.08 0.00 0.00 40.66 42.74 1yko h LEU 23 CO 0.36 0.15 -0.26 -0.08 -1.08 0.00 0.00 178.44 177.53 1yko h GLU 24 N 0.61 0.80 0.00 1.13 4.81 -1.87 -1.88 114.58 118.18 1yko h GLU 24 Ca 0.62 -0.39 -0.03 0.00 -0.13 0.00 0.00 59.36 59.43 1yko h GLU 24 Cb 1.17 -0.00 -0.00 0.00 0.63 0.00 0.00 28.75 30.54 1yko h GLU 24 CO -0.43 1.02 -0.12 0.00 -0.73 0.00 0.00 179.01 178.75 1yko h ALA 25 N 0.76 1.03 -0.00 2.92 0.00 -1.67 -2.39 119.26 119.91 1yko h ALA 25 Ca 0.07 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1yko h ALA 25 Cb 0.83 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.60 1yko h ALA 25 CO 0.07 0.15 -0.26 0.00 0.00 0.00 0.00 179.25 179.21 1yko n ALA 26 N -2.17 3.03 -1.22 0.00 0.00 -0.63 -4.93 120.51 114.58 1yko n ALA 26 Ca 0.00 -0.29 -0.02 0.00 0.00 0.00 0.00 53.44 53.13 1yko n ALA 26 Cb 0.37 -1.24 -0.01 0.00 0.00 0.00 0.00 19.45 18.56 1yko n ALA 26 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1yko n GLY 27 N 1.41 0.52 3.79 0.00 0.00 -0.90 -4.98 105.19 105.03 1yko n GLY 27 Ca 0.09 -0.95 -0.24 0.00 0.00 0.00 0.00 46.02 44.93 1yko n GLY 27 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1yko s ASN 28 N -2.96 5.41 0.33 1.61 0.01 -0.72 -5.05 114.94 113.57 1yko s ASN 28 Ca 0.00 -0.25 -0.28 0.00 -0.71 0.00 0.00 52.86 51.62 1yko s ASN 28 Cb 0.00 -1.35 -0.10 0.00 0.41 0.00 0.00 41.25 40.21 1yko s ASN 28 CO 0.00 0.00 1.25 -2.16 -1.51 0.00 0.00 177.10 174.68 1yko s PRO 29 N -3.55 4.37 0.64 -0.60 0.04 -1.26 -4.20 135.00 130.44 1yko s PRO 29 Ca 0.32 2.09 -0.06 0.00 0.04 0.00 0.00 61.00 63.39 1yko s PRO 29 Cb -0.08 -3.05 0.03 0.00 0.04 0.00 0.00 34.50 31.44 1yko s PRO 29 CO 0.24 -0.13 0.95 0.95 0.04 0.00 0.00 177.00 179.05 1yko s THR 30 N -1.17 2.95 0.63 1.26 -4.23 -1.26 -4.90 115.64 108.92 1yko s THR 30 Ca 0.49 -0.16 0.04 0.00 -1.18 0.00 0.00 61.69 60.88 1yko s THR 30 Cb -0.37 -3.22 0.10 0.00 1.34 0.00 0.00 72.50 70.35 1yko s THR 30 CO 0.49 -0.22 0.87 -0.13 -0.54 0.00 0.00 174.62 175.09 1yko s ARG 31 N -5.10 2.07 0.16 3.99 0.52 -1.26 -5.02 118.95 114.31 1yko s ARG 31 Ca 0.57 -1.29 -0.16 0.00 -0.52 0.00 0.00 55.73 54.33 1yko s ARG 31 Cb -0.11 -2.49 0.10 0.00 0.52 0.00 0.00 34.95 32.97 1yko s ARG 31 CO 0.45 -1.08 1.71 -0.44 0.02 0.00 0.00 175.30 175.95 1yko h ASP 32 N -0.13 -0.11 -3.33 0.23 3.32 -2.08 -3.41 116.42 110.92 1yko h ASP 32 Ca -0.35 0.08 -0.68 0.00 0.02 0.00 0.00 57.03 56.11 1yko h ASP 32 Cb 1.28 0.14 -0.33 0.00 0.22 0.00 0.00 39.33 40.64 1yko h ASP 32 CO 0.42 -0.02 -0.87 -1.10 -1.72 0.00 0.00 179.24 175.95 1yko s GLN 33 N -6.17 3.07 0.02 3.56 -0.21 -1.26 -5.13 119.66 113.54 1yko s GLN 33 Ca -0.13 -0.87 0.03 0.00 0.02 0.00 0.00 55.36 54.41 1yko s GLN 33 Cb 0.14 -2.33 -0.02 0.00 1.00 0.00 0.00 33.01 31.80 1yko s GLN 33 CO 0.71 0.17 -0.10 -1.21 -2.12 0.00 0.00 175.29 172.74 1yko s GLU 34 N 0.37 0.71 -0.45 2.91 0.41 -1.26 -5.12 118.70 116.27 1yko s GLU 34 Ca -0.18 -0.58 -0.21 0.00 -0.41 0.00 0.00 54.97 53.59 1yko s GLU 34 Cb -0.18 -0.64 0.03 0.00 -1.78 0.00 0.00 34.13 31.56 1yko s GLU 34 CO 0.08 0.16 0.66 0.42 -0.49 0.00 0.00 175.26 176.09 1yko s ILE 35 N -0.74 4.80 0.00 -1.63 1.01 -1.26 -5.01 121.20 118.37 1yko s ILE 35 Ca -0.01 0.08 0.00 0.00 0.00 0.00 0.00 60.65 60.72 1yko s ILE 35 Cb -0.07 -4.24 0.00 0.00 0.01 0.00 0.00 42.46 38.17 1yko s ILE 35 CO 0.00 -0.65 0.00 1.87 0.00 0.00 0.00 174.94 176.17 1yko n TRP 36 N 6.33 0.00 1.94 3.97 -0.00 -1.26 -4.51 117.44 123.91 1yko n TRP 36 Ca -0.02 0.00 0.07 0.00 -0.00 0.00 0.00 57.50 57.55 1yko n TRP 36 Cb 0.48 0.00 0.42 0.00 -0.00 0.00 0.00 31.31 32.20 1yko n TRP 36 CO 0.00 0.00 0.00 0.27 -0.00 0.00 0.00 177.69 177.96 1yko n ASN 37 N 0.00 0.00 -4.20 5.87 6.94 -0.56 -2.13 115.26 121.18 1yko n ASN 37 Ca 0.00 -1.50 -0.41 0.00 -0.02 0.00 0.00 54.58 52.65 1yko n ASN 37 Cb 0.00 0.00 -0.07 0.00 -2.36 0.00 0.00 39.78 37.35 1yko n ASN 37 CO 0.00 0.00 0.00 -0.13 -1.03 0.00 0.00 177.26 176.10 1yko s ARG 38 N -2.00 2.96 0.10 -3.83 0.52 -1.26 -1.38 118.95 114.05 1yko s ARG 38 Ca 0.21 -2.43 -0.02 0.00 -0.52 0.00 0.00 55.73 52.97 1yko s ARG 38 Cb 0.10 -4.02 -0.22 0.00 0.52 0.00 0.00 34.95 31.33 1yko s ARG 38 CO 0.16 -1.22 1.20 -0.07 0.02 0.00 0.00 175.30 175.40 1yko h LEU 39 N 7.46 0.38 -8.57 2.53 4.07 -1.53 -3.46 115.31 116.20 1yko h LEU 39 Ca 0.01 -0.38 -0.68 0.00 0.08 0.00 0.00 57.88 56.91 1yko h LEU 39 Cb 1.00 -0.12 -0.29 0.00 1.08 0.00 0.00 40.66 42.33 1yko h LEU 39 CO 0.75 1.26 -0.84 0.00 -1.08 0.00 0.00 178.44 178.53 1yko s ALA 40 N -2.81 2.35 0.29 1.53 0.00 -1.20 -1.09 121.76 120.83 1yko s ALA 40 Ca -0.04 -0.99 -0.11 0.00 0.00 0.00 0.00 51.96 50.82 1yko s ALA 40 Cb 0.08 -0.86 -0.08 0.00 0.00 0.00 0.00 23.12 22.26 1yko s ALA 40 CO 0.87 0.39 0.64 0.15 0.00 0.00 0.00 175.76 177.81 1yko s LYS 41 N -0.08 3.86 0.51 0.00 1.02 -0.07 -4.81 119.74 120.17 1yko s LYS 41 Ca -0.05 0.42 0.39 0.00 0.02 0.00 0.00 55.97 56.75 1yko s LYS 41 Cb -0.14 -2.54 1.56 0.00 -0.52 0.00 0.00 37.83 36.18 1yko s LYS 41 CO 0.04 0.21 1.67 -1.35 -0.92 0.00 0.00 175.35 175.00 1yko h PRO 42 N 2.24 0.05 -0.77 -1.68 0.11 -2.00 -0.84 132.00 129.10 1yko h PRO 42 Ca -0.47 -0.00 -0.09 0.00 0.11 0.00 0.00 66.00 65.54 1yko h PRO 42 Cb 1.17 -0.01 -0.06 0.00 0.11 0.00 0.00 31.00 32.22 1yko h PRO 42 CO 0.67 0.03 0.12 -0.40 -0.21 0.00 0.00 178.00 178.21 1yko n ASP 43 N -4.26 4.24 -4.80 -2.05 5.75 -1.26 -4.94 116.55 109.23 1yko n ASP 43 Ca 0.36 -2.80 -0.39 0.00 -0.01 0.00 0.00 54.79 51.95 1yko n ASP 43 Cb 1.55 -0.66 -0.06 0.00 -1.03 0.00 0.00 41.12 40.92 1yko n ASP 43 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1yko s ALA 44 N -2.32 3.55 0.56 2.12 0.00 -0.32 -5.03 121.76 120.32 1yko s ALA 44 Ca 0.40 0.10 -0.20 0.00 0.00 0.00 0.00 51.96 52.27 1yko s ALA 44 Cb 0.32 -2.71 -0.05 0.00 0.00 0.00 0.00 23.12 20.68 1yko s ALA 44 CO 0.11 0.36 1.20 -1.25 0.00 0.00 0.00 175.76 176.17 1yko s PRO 45 N -1.04 3.15 0.00 0.00 0.04 -1.26 -4.91 135.00 130.98 1yko s PRO 45 Ca 0.31 1.81 0.00 0.00 0.04 0.00 0.00 61.00 63.15 1yko s PRO 45 Cb -0.20 -2.02 0.00 0.00 0.04 0.00 0.00 34.50 32.31 1yko s PRO 45 CO 0.20 -1.06 0.00 0.41 0.04 0.00 0.00 177.00 176.60 1yko n GLY 46 N 0.45 -1.98 3.55 0.56 0.00 -1.26 -4.60 105.19 101.91 1yko n GLY 46 Ca 0.12 -2.19 -0.43 0.00 0.00 0.00 0.00 46.02 43.52 1yko n GLY 46 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1yko s GLU 47 N -0.73 3.44 -0.14 1.61 2.12 -1.26 -4.98 118.70 118.75 1yko s GLU 47 Ca 0.00 -0.07 -0.29 0.00 0.36 0.00 0.00 54.97 54.97 1yko s GLU 47 Cb 0.00 -3.93 -0.02 0.00 0.26 0.00 0.00 34.13 30.44 1yko s GLU 47 CO 0.00 -1.09 1.38 -1.01 -0.54 0.00 0.00 175.26 174.00 1yko s HIS 48 N 3.27 2.58 0.26 5.30 3.76 -1.26 -1.79 115.29 127.41 1yko s HIS 48 Ca 0.30 0.77 0.10 0.00 -0.15 0.00 0.00 55.06 56.08 1yko s HIS 48 Cb -0.12 -3.64 -0.05 0.00 1.11 0.00 0.00 32.58 29.88 1yko s HIS 48 CO 0.22 -2.32 -0.17 0.96 -0.85 0.00 0.00 174.74 172.58 1yko s ILE 49 N 3.72 2.17 -0.11 0.60 -4.36 0.40 -4.49 121.20 119.13 1yko s ILE 49 Ca 0.60 -2.32 0.02 0.00 -0.26 0.00 0.00 60.65 58.69 1yko s ILE 49 Cb -0.25 -2.23 -0.01 0.00 1.25 0.00 0.00 42.46 41.23 1yko s ILE 49 CO 0.19 -0.46 -0.19 -0.22 0.24 0.00 0.00 174.94 174.50 1yko s LEU 50 N -3.44 2.39 -0.07 0.37 2.96 -0.02 -2.23 118.68 118.62 1yko s LEU 50 Ca 0.27 -0.45 0.03 0.00 -0.22 0.00 0.00 54.13 53.76 1yko s LEU 50 Cb -0.03 -1.50 -0.02 0.00 0.50 0.00 0.00 46.19 45.14 1yko s LEU 50 CO 0.12 0.17 -0.14 -0.76 -1.32 0.00 0.00 176.35 174.41 1yko s LEU 51 N 0.32 2.70 0.07 -0.68 1.43 0.36 -1.60 118.68 121.27 1yko s LEU 51 Ca -0.15 -0.25 -0.12 0.00 -1.03 0.00 0.00 54.13 52.58 1yko s LEU 51 Cb -0.17 -1.56 0.02 0.00 0.03 0.00 0.00 46.19 44.50 1yko s LEU 51 CO 0.07 0.29 0.28 -1.48 0.23 0.00 0.00 176.35 175.74 1yko s LEU 52 N -0.37 0.98 0.00 1.79 -0.00 -0.96 -0.48 118.68 119.63 1yko s LEU 52 Ca 0.04 -0.34 0.00 0.00 -0.00 0.00 0.00 54.13 53.82 1yko s LEU 52 Cb -0.12 1.32 0.00 0.00 -0.00 0.00 0.00 46.19 47.39 1yko s LEU 52 CO 0.02 -0.68 0.00 0.61 -0.00 0.00 0.00 176.35 176.30 1yko n GLY 53 N 0.29 0.42 3.49 -3.48 0.00 -1.15 -0.92 105.19 103.84 1yko n GLY 53 Ca -0.17 -0.82 -0.24 0.00 0.00 0.00 0.00 46.02 44.78 1yko n GLY 53 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1yko s GLN 54 N -2.00 1.71 -0.12 1.61 -0.21 -1.26 -2.20 119.66 117.20 1yko s GLN 54 Ca 0.00 -1.81 0.03 0.00 0.02 0.00 0.00 55.36 53.60 1yko s GLN 54 Cb 0.00 -1.74 -0.00 0.00 1.00 0.00 0.00 33.01 32.27 1yko s GLN 54 CO 0.00 0.28 -0.21 0.08 -2.12 0.00 0.00 175.29 173.31 1yko s VAL 55 N -2.55 2.25 0.10 1.09 1.01 -1.26 -1.27 120.40 119.78 1yko s VAL 55 Ca 0.30 -0.94 0.08 0.00 0.00 0.00 0.00 61.98 61.43 1yko s VAL 55 Cb -0.03 -1.89 -0.04 0.00 0.00 0.00 0.00 36.38 34.43 1yko s VAL 55 CO 0.15 0.55 -0.16 -0.31 0.00 0.00 0.00 175.10 175.33 1yko s TYR 56 N 0.46 2.59 0.00 5.22 1.51 0.31 -0.96 117.35 126.47 1yko s TYR 56 Ca -0.15 -0.24 0.00 0.00 -1.01 0.00 0.00 57.07 55.68 1yko s TYR 56 Cb -0.17 -1.38 0.00 0.00 -0.11 0.00 0.00 41.96 40.30 1yko s TYR 56 CO 0.06 0.38 0.00 -0.40 -1.11 0.00 0.00 175.55 174.48 1yko n ASP 57 N 0.88 0.00 0.26 2.29 5.68 -0.41 -1.97 116.55 123.28 1yko n ASP 57 Ca -0.15 -0.51 0.17 0.00 -0.50 0.00 0.00 54.79 53.80 1yko n ASP 57 Cb 0.52 0.00 0.71 0.00 -1.14 0.00 0.00 41.12 41.21 1yko n ASP 57 CO 0.00 0.00 0.00 1.23 -1.33 0.00 0.00 177.20 177.10 1yko h GLY 58 N 0.00 0.00 -2.17 6.12 0.00 -1.89 -2.83 103.07 102.30 1yko h GLY 58 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1yko h GLY 58 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 176.54 177.24 1yko n ASN 59 N -2.93 3.30 -0.04 0.19 3.02 -1.26 -4.72 115.26 112.82 1yko n ASN 59 Ca 0.00 -1.99 -0.01 0.00 -0.03 0.00 0.00 54.58 52.56 1yko n ASN 59 Cb 0.26 -0.18 -0.00 0.00 -0.61 0.00 0.00 39.78 39.25 1yko n ASN 59 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1yko n GLY 60 N 1.46 0.44 3.89 7.41 0.00 -1.07 -5.04 105.19 112.29 1yko n GLY 60 Ca 0.18 -0.87 -0.34 0.00 0.00 0.00 0.00 46.02 44.99 1yko n GLY 60 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1yko s HIS 61 N -2.01 3.57 0.27 1.61 3.76 -1.26 -4.84 115.29 116.38 1yko s HIS 61 Ca 0.00 0.45 -0.30 0.00 -0.15 0.00 0.00 55.06 55.06 1yko s HIS 61 Cb 0.00 -1.89 -0.10 0.00 1.11 0.00 0.00 32.58 31.70 1yko s HIS 61 CO 0.00 0.66 1.40 -0.51 -0.85 0.00 0.00 174.74 175.43 1yko s LEU 62 N -1.71 4.40 -0.68 0.89 1.43 -1.26 -1.29 118.68 120.45 1yko s LEU 62 Ca 0.25 2.67 -0.17 0.00 -1.03 0.00 0.00 54.13 55.85 1yko s LEU 62 Cb -0.13 -3.63 0.15 0.00 0.03 0.00 0.00 46.19 42.61 1yko s LEU 62 CO 0.15 -0.65 0.71 -0.69 0.23 0.00 0.00 176.35 176.10 1yko s VAL 63 N -0.33 5.14 -0.59 -1.59 1.01 -0.14 -4.89 120.40 119.00 1yko s VAL 63 Ca 0.56 -1.61 0.05 0.00 0.00 0.00 0.00 61.98 60.97 1yko s VAL 63 Cb -0.41 -4.48 0.30 0.00 0.00 0.00 0.00 36.38 31.80 1yko s VAL 63 CO 0.46 -1.07 1.06 0.54 0.00 0.00 0.00 175.10 176.09 1yko n ARG 64 N 5.40 2.28 -1.15 2.72 1.74 -1.26 -3.94 116.66 122.45 1yko n ARG 64 Ca -0.00 -1.20 0.01 0.00 -0.77 0.00 0.00 57.85 55.89 1yko n ARG 64 Cb 0.44 -1.72 -0.00 0.00 -1.02 0.00 0.00 32.46 30.16 1yko n ARG 64 CO 0.00 0.00 0.00 -0.40 -1.52 0.00 0.00 177.63 175.71 1yko n ASP 65 N 0.16 0.40 -4.85 0.55 5.68 -1.18 -3.39 116.55 113.92 1yko n ASP 65 Ca 0.13 -1.94 -0.32 0.00 -0.50 0.00 0.00 54.79 52.17 1yko n ASP 65 Cb 0.69 -0.16 -0.04 0.00 -1.14 0.00 0.00 41.12 40.46 1yko n ASP 65 CO 0.00 0.00 0.00 -0.94 -1.33 0.00 0.00 177.20 174.93 1yko s SER 66 N -1.51 6.66 -0.06 -1.12 1.04 -1.22 -4.52 113.70 112.97 1yko s SER 66 Ca 0.19 1.44 0.02 0.00 0.48 0.00 0.00 55.95 58.07 1yko s SER 66 Cb 0.22 -2.45 0.02 0.00 0.10 0.00 0.00 66.02 63.91 1yko s SER 66 CO -0.10 -0.46 -0.08 0.12 0.98 0.00 0.00 173.24 173.70 1yko s PHE 67 N -2.43 1.11 0.01 5.02 5.36 0.11 -2.12 117.98 125.05 1yko s PHE 67 Ca 0.57 -0.38 0.07 0.00 -0.96 0.00 0.00 56.93 56.23 1yko s PHE 67 Cb -0.10 -0.88 -0.02 0.00 -0.34 0.00 0.00 43.02 41.68 1yko s PHE 67 CO 0.27 -0.24 -0.21 -0.51 -1.46 0.00 0.00 175.22 173.07 1yko s LEU 68 N 0.83 2.10 -0.09 6.12 1.02 -0.40 -0.35 118.68 127.92 1yko s LEU 68 Ca -0.12 -0.45 0.03 0.00 0.02 0.00 0.00 54.13 53.62 1yko s LEU 68 Cb -0.15 -1.03 0.00 0.00 0.02 0.00 0.00 46.19 45.04 1yko s LEU 68 CO 0.01 0.21 -0.20 -1.61 0.02 0.00 0.00 176.35 174.78 1yko s GLU 69 N -0.83 2.61 0.12 1.70 2.02 -0.44 -1.29 118.70 122.60 1yko s GLU 69 Ca 0.08 -0.73 0.08 0.00 0.02 0.00 0.00 54.97 54.42 1yko s GLU 69 Cb -0.08 -2.01 -0.04 0.00 0.10 0.00 0.00 34.13 32.09 1yko s GLU 69 CO 0.00 0.13 -0.11 0.14 0.02 0.00 0.00 175.26 175.44 1yko s VAL 70 N 0.45 3.27 -0.14 2.63 -7.23 -0.39 -0.95 120.40 118.05 1yko s VAL 70 Ca -0.17 -1.35 -0.04 0.00 -1.81 0.00 0.00 61.98 58.60 1yko s VAL 70 Cb -0.17 -2.53 0.07 0.00 0.56 0.00 0.00 36.38 34.30 1yko s VAL 70 CO 0.07 0.08 0.19 0.86 -0.31 0.00 0.00 175.10 176.00 1yko s TRP 71 N -1.26 -0.22 0.16 2.82 -0.11 0.03 -2.58 118.94 117.76 1yko s TRP 71 Ca 0.21 0.47 -0.03 0.00 1.22 0.00 0.00 56.10 57.96 1yko s TRP 71 Cb -0.11 -0.29 -0.03 0.00 -1.50 0.00 0.00 33.47 31.54 1yko s TRP 71 CO 0.13 -0.42 0.14 1.14 -4.62 0.00 0.00 176.95 173.33 1yko s GLN 72 N 2.31 1.06 0.54 5.86 -2.07 -0.46 -1.03 119.66 125.88 1yko s GLN 72 Ca 0.04 -1.41 0.00 0.00 -1.82 0.00 0.00 55.36 52.18 1yko s GLN 72 Cb -0.14 0.29 0.03 0.00 -1.09 0.00 0.00 33.01 32.10 1yko s GLN 72 CO -0.09 -0.34 0.77 0.00 -1.32 0.00 0.00 175.29 174.32 1yko s ALA 73 N -4.05 3.78 0.86 2.60 0.00 -1.26 -4.55 121.76 119.15 1yko s ALA 73 Ca 0.25 -1.20 0.00 0.00 0.00 0.00 0.00 51.96 51.01 1yko s ALA 73 Cb 0.06 -2.15 0.00 0.00 0.00 0.00 0.00 23.12 21.03 1yko s ALA 73 CO 0.04 -0.70 0.00 -0.40 0.00 0.00 0.00 175.76 174.70 1yko n ASP 74 N -2.33 0.00 0.25 0.00 5.68 -0.38 -4.34 116.55 115.43 1yko n ASP 74 Ca 0.06 -0.90 0.11 0.00 -0.50 0.00 0.00 54.79 53.56 1yko n ASP 74 Cb 0.59 0.00 0.66 0.00 -1.14 0.00 0.00 41.12 41.23 1yko n ASP 74 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1yko h ALA 75 N -1.68 1.30 -0.01 2.12 0.00 -1.81 0.22 119.26 119.39 1yko h ALA 75 Ca 0.00 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.77 1yko h ALA 75 Cb 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.77 1yko h ALA 75 CO 0.00 0.19 -0.04 0.09 0.00 0.00 0.00 179.25 179.49 1yko n ASN 76 N -3.70 1.49 -0.26 0.00 3.02 -1.26 -3.95 115.26 110.60 1yko n ASN 76 Ca -0.02 -1.43 -0.01 0.00 -0.03 0.00 0.00 54.58 53.10 1yko n ASN 76 Cb 0.27 0.02 0.00 0.00 -0.61 0.00 0.00 39.78 39.46 1yko n ASN 76 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1yko n GLY 77 N 1.21 0.49 3.33 7.41 0.00 -0.87 -4.79 105.19 111.97 1yko n GLY 77 Ca 0.18 -0.79 -0.31 0.00 0.00 0.00 0.00 46.02 45.10 1yko n GLY 77 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1yko s GLU 78 N -4.34 2.07 -0.39 1.61 2.02 -1.26 -4.67 118.70 113.75 1yko s GLU 78 Ca 0.01 -0.95 -0.22 0.00 0.02 0.00 0.00 54.97 53.83 1yko s GLU 78 Cb -0.00 -2.05 0.01 0.00 0.10 0.00 0.00 34.13 32.19 1yko s GLU 78 CO 0.01 0.55 0.71 0.71 0.02 0.00 0.00 175.26 177.27 1yko s TYR 79 N -0.65 3.10 -0.68 1.61 1.51 -1.26 -1.25 117.35 119.72 1yko s TYR 79 Ca 0.10 0.33 -0.20 0.00 -1.01 0.00 0.00 57.07 56.30 1yko s TYR 79 Cb -0.10 -3.35 0.10 0.00 -0.11 0.00 0.00 41.96 38.50 1yko s TYR 79 CO -0.00 -0.76 0.89 -0.65 -1.11 0.00 0.00 175.55 173.92 1yko s GLN 80 N 2.96 3.18 0.10 -0.62 -1.52 -1.26 -4.90 119.66 117.59 1yko s GLN 80 Ca 0.27 -1.22 0.00 0.00 -1.95 0.00 0.00 55.36 52.47 1yko s GLN 80 Cb -0.14 -4.36 -0.25 0.00 -0.22 0.00 0.00 33.01 28.04 1yko s GLN 80 CO 0.17 -1.69 1.20 0.38 -0.25 0.00 0.00 175.29 175.10 1yko h ASP 81 N 9.25 0.25 -1.45 5.90 2.03 -1.98 -3.25 116.42 127.17 1yko h ASP 81 Ca -0.20 -0.27 -0.42 0.00 -0.73 0.00 0.00 57.03 55.41 1yko h ASP 81 Cb 1.07 -0.08 -0.05 0.00 -0.83 0.00 0.00 39.33 39.44 1yko h ASP 81 CO 1.13 1.20 1.09 0.00 -1.03 0.00 0.00 179.24 181.64 1yko s ALA 82 N -2.69 2.02 -0.10 4.15 0.00 -1.26 -4.94 121.76 118.93 1yko s ALA 82 Ca -0.02 -1.11 -0.30 0.00 0.00 0.00 0.00 51.96 50.54 1yko s ALA 82 Cb 0.08 -4.41 -0.03 0.00 0.00 0.00 0.00 23.12 18.76 1yko s ALA 82 CO 0.86 -4.23 1.28 -0.47 0.00 0.00 0.00 175.76 173.20 1yko s TYR 83 N 9.14 2.90 -0.18 0.00 5.04 -1.26 -5.00 117.35 127.98 1yko s TYR 83 Ca 0.66 1.00 -0.12 0.00 -2.44 0.00 0.00 57.07 56.17 1yko s TYR 83 Cb -0.09 -3.52 0.06 0.00 0.35 0.00 0.00 41.96 38.75 1yko s TYR 83 CO 0.10 -1.81 0.44 1.21 -1.34 0.00 0.00 175.55 174.16 1yko s ASN 84 N 1.90 -0.53 0.00 4.32 3.84 -1.26 -5.04 114.94 118.16 1yko s ASN 84 Ca 0.57 0.94 0.20 0.00 0.21 0.00 0.00 52.86 54.79 1yko s ASN 84 Cb -0.24 0.86 0.94 0.00 -0.55 0.00 0.00 41.25 42.26 1yko s ASN 84 CO 0.19 -0.18 1.65 0.18 -2.79 0.00 0.00 177.10 176.14 1yko n LEU 85 N 3.79 0.00 0.03 3.21 4.77 -1.26 -2.64 117.00 124.90 1yko n LEU 85 Ca -0.20 0.40 0.12 0.00 -0.03 0.00 0.00 56.01 56.31 1yko n LEU 85 Cb 0.56 -0.40 0.28 0.00 -2.33 0.00 0.00 43.42 41.52 1yko n LEU 85 CO 0.09 -0.13 0.50 -0.62 -1.33 0.00 0.00 177.39 175.90 1yko n GLU 86 N -1.40 0.14 -2.41 3.23 1.02 -1.26 -4.91 120.64 115.04 1yko n GLU 86 Ca 0.07 0.05 -0.35 0.00 -0.02 0.00 0.00 57.16 56.90 1yko n GLU 86 Cb 0.20 -1.59 -0.02 0.00 -0.02 0.00 0.00 31.44 30.01 1yko n GLU 86 CO 0.00 0.00 0.00 -0.80 1.18 0.00 0.00 177.13 177.51 1yko s ASN 87 N -3.60 6.24 0.29 1.62 0.01 -1.08 -4.95 114.94 113.47 1yko s ASN 87 Ca 0.09 2.09 0.05 0.00 -0.71 0.00 0.00 52.86 54.38 1yko s ASN 87 Cb 0.16 -2.58 0.43 0.00 0.41 0.00 0.00 41.25 39.67 1yko s ASN 87 CO 0.68 -0.85 1.71 0.00 -1.51 0.00 0.00 177.10 177.12 1yko h ALA 88 N 1.77 1.10 -3.67 0.60 0.00 -1.91 -3.44 119.26 113.71 1yko h ALA 88 Ca -0.49 -0.38 -0.24 0.00 0.00 0.00 0.00 54.91 53.79 1yko h ALA 88 Cb 1.23 -0.10 -0.27 0.00 0.00 0.00 0.00 17.79 18.65 1yko h ALA 88 CO 0.59 0.57 -0.72 0.12 0.00 0.00 0.00 179.25 179.81 1yko s PHE 89 N -4.29 0.11 -0.06 0.00 5.36 -1.26 -0.89 117.98 116.94 1yko s PHE 89 Ca -0.06 -0.07 0.03 0.00 -0.96 0.00 0.00 56.93 55.87 1yko s PHE 89 Cb 0.13 -0.07 0.01 0.00 -0.34 0.00 0.00 43.02 42.75 1yko s PHE 89 CO 0.78 -0.02 -0.14 -0.80 -1.46 0.00 0.00 175.22 173.58 1yko s ASN 90 N -0.19 1.96 0.26 6.13 0.01 -0.25 -4.98 114.94 117.88 1yko s ASN 90 Ca -0.01 -0.33 0.25 0.00 -0.71 0.00 0.00 52.86 52.06 1yko s ASN 90 Cb -0.01 -0.81 0.92 0.00 0.41 0.00 0.00 41.25 41.76 1yko s ASN 90 CO -0.00 0.08 1.75 0.28 -1.51 0.00 0.00 177.10 177.69 1yko h SER 91 N 6.74 0.00 -3.66 -1.22 0.02 -1.80 -3.44 113.55 110.20 1yko h SER 91 Ca -0.30 0.00 -0.67 0.00 -0.84 0.00 0.00 61.79 59.98 1yko h SER 91 Cb 1.19 0.00 -0.17 0.00 0.14 0.00 0.00 62.40 63.56 1yko h SER 91 CO 0.48 0.00 -0.74 0.12 -1.14 0.00 0.00 176.83 175.55 1yko s PHE 92 N -3.25 2.75 0.10 3.45 5.36 -1.26 -1.35 117.98 123.79 1yko s PHE 92 Ca 0.07 -0.14 -0.25 0.00 -0.96 0.00 0.00 56.93 55.65 1yko s PHE 92 Cb 0.10 -1.50 0.08 0.00 -0.34 0.00 0.00 43.02 41.37 1yko s PHE 92 CO 0.49 0.37 0.70 0.20 -1.46 0.00 0.00 175.22 175.52 1yko s GLY 93 N -1.80 -0.57 0.08 13.12 0.00 -1.07 -4.82 107.32 112.27 1yko s GLY 93 Ca 0.19 0.67 0.06 0.00 0.00 0.00 0.00 44.72 45.63 1yko s GLY 93 CO 0.10 0.22 -0.16 0.50 0.00 0.00 0.00 173.10 173.76 1yko s ARG 94 N -3.54 0.92 0.27 2.90 0.52 -0.91 -1.26 118.95 117.86 1yko s ARG 94 Ca 0.02 -1.02 -0.09 0.00 -0.52 0.00 0.00 55.73 54.12 1yko s ARG 94 Cb -0.01 -1.02 -0.01 0.00 0.52 0.00 0.00 34.95 34.44 1yko s ARG 94 CO -0.12 0.23 0.44 -0.08 0.02 0.00 0.00 175.30 175.80 1yko s THR 95 N -1.23 0.00 0.18 0.02 -1.32 -0.41 -1.50 115.64 111.38 1yko s THR 95 Ca 0.01 -1.52 -0.22 0.00 -1.21 0.00 0.00 61.69 58.74 1yko s THR 95 Cb -0.10 -2.38 0.06 0.00 -1.51 0.00 0.00 72.50 68.57 1yko s THR 95 CO 0.03 0.00 0.62 0.00 -2.21 0.00 0.00 174.62 173.06 1yko s ALA 96 N -3.73 -1.50 -0.18 11.08 0.00 -1.26 -1.27 121.76 124.89 1yko s ALA 96 Ca 0.26 0.31 -0.01 0.00 0.00 0.00 0.00 51.96 52.52 1yko s ALA 96 Cb 0.00 0.88 -0.00 0.00 0.00 0.00 0.00 23.12 24.00 1yko s ALA 96 CO 0.12 -0.82 -0.11 0.95 0.00 0.00 0.00 175.76 175.90 1yko s THR 97 N -3.79 2.96 0.31 0.00 -4.23 -0.90 -4.10 115.64 105.88 1yko s THR 97 Ca 0.03 -0.65 0.03 0.00 -1.18 0.00 0.00 61.69 59.92 1yko s THR 97 Cb -0.02 -2.29 0.03 0.00 1.34 0.00 0.00 72.50 71.56 1yko s THR 97 CO -0.09 0.48 0.23 0.35 -0.54 0.00 0.00 174.62 175.06 1yko n THR 98 N 4.34 0.00 0.20 3.99 -2.24 0.18 -3.13 114.28 117.62 1yko n THR 98 Ca -0.19 -1.20 0.08 0.00 -2.27 0.00 0.00 64.05 60.47 1yko n THR 98 Cb 0.51 -0.26 0.24 0.00 -2.10 0.00 0.00 70.33 68.73 1yko n THR 98 CO 0.00 0.00 0.00 -0.26 -0.57 0.00 0.00 175.07 174.24 1yko h PHE 99 N 0.57 0.00 0.07 4.78 0.04 -1.94 -2.95 116.94 117.51 1yko h PHE 99 Ca -0.19 0.00 -0.19 0.00 2.80 0.00 0.00 57.97 60.39 1yko h PHE 99 Cb 0.70 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.85 1yko h PHE 99 CO 0.00 0.25 -0.97 -0.44 -0.60 0.00 0.00 178.31 176.55 1yko h ASP 100 N 0.00 0.22 -4.09 2.17 3.32 -1.96 -3.41 116.42 112.67 1yko h ASP 100 Ca -0.00 -0.82 -0.67 0.00 0.02 0.00 0.00 57.03 55.55 1yko h ASP 100 Cb 1.03 -0.07 -0.38 0.00 0.22 0.00 0.00 39.33 40.13 1yko h ASP 100 CO 0.03 1.42 -0.53 0.00 -1.72 0.00 0.00 179.24 178.44 1yko s ALA 101 N -2.39 3.35 -1.08 3.45 0.00 -1.24 -4.95 121.76 118.92 1yko s ALA 101 Ca -0.21 -3.09 0.00 0.00 0.00 0.00 0.00 51.96 48.66 1yko s ALA 101 Cb 0.03 -2.37 0.00 0.00 0.00 0.00 0.00 23.12 20.78 1yko s ALA 101 CO 0.72 -1.99 0.53 0.41 0.00 0.00 0.00 175.76 175.43 1yko n GLY 102 N 3.57 1.29 2.84 0.00 0.00 -1.11 0.49 105.19 112.27 1yko n GLY 102 Ca 0.05 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.92 1yko n GLY 102 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1yko s GLU 103 N -1.08 0.13 0.26 1.61 2.12 -1.26 -4.60 118.70 115.89 1yko s GLU 103 Ca 0.00 0.05 -0.05 0.00 0.36 0.00 0.00 54.97 55.33 1yko s GLU 103 Cb 0.00 -0.27 -0.05 0.00 0.26 0.00 0.00 34.13 34.07 1yko s GLU 103 CO 0.00 -0.07 0.53 1.67 -0.54 0.00 0.00 175.26 176.84 1yko s TRP 104 N 0.59 3.47 0.13 5.30 1.48 -0.93 -4.75 118.94 124.23 1yko s TRP 104 Ca -0.05 0.63 0.05 0.00 -1.06 0.00 0.00 56.10 55.67 1yko s TRP 104 Cb -0.08 -2.09 -0.04 0.00 -1.16 0.00 0.00 33.47 30.10 1yko s TRP 104 CO -0.01 0.22 -0.13 0.95 -4.06 0.00 0.00 176.95 173.92 1yko s THR 105 N -2.01 1.26 -0.17 0.66 -4.23 -1.26 -2.93 115.64 106.97 1yko s THR 105 Ca 0.44 -1.81 -0.10 0.00 -1.18 0.00 0.00 61.69 59.04 1yko s THR 105 Cb -0.11 -1.60 0.06 0.00 1.34 0.00 0.00 72.50 72.19 1yko s THR 105 CO 0.29 -0.52 0.41 -0.22 -0.54 0.00 0.00 174.62 174.04 1yko s LEU 106 N -2.65 -0.02 -0.27 4.79 2.96 0.36 -4.83 118.68 119.02 1yko s LEU 106 Ca 0.11 0.89 -0.05 0.00 -0.22 0.00 0.00 54.13 54.85 1yko s LEU 106 Cb -0.03 1.36 0.01 0.00 0.50 0.00 0.00 46.19 48.04 1yko s LEU 106 CO 0.02 -0.19 0.03 -1.00 -1.32 0.00 0.00 176.35 173.89 1yko s HIS 107 N 1.23 3.10 0.11 5.38 3.76 -0.48 -0.49 115.29 127.90 1yko s HIS 107 Ca -0.08 -1.13 -0.03 0.00 -0.15 0.00 0.00 55.06 53.67 1yko s HIS 107 Cb -0.08 -2.18 0.01 0.00 1.11 0.00 0.00 32.58 31.44 1yko s HIS 107 CO -0.11 -0.61 0.19 -2.37 -0.85 0.00 0.00 174.74 170.99 1yko n THR 108 N 4.80 0.00 -4.28 1.30 5.66 -0.95 -1.50 114.28 119.32 1yko n THR 108 Ca -0.15 -0.38 -0.24 0.00 -3.05 0.00 0.00 64.05 60.22 1yko n THR 108 Cb 0.48 0.30 -0.07 0.00 -1.55 0.00 0.00 70.33 69.49 1yko n THR 108 CO 0.00 0.00 0.00 0.68 -3.05 0.00 0.00 175.07 172.70 1yko s VAL 109 N -2.66 3.48 -0.03 1.08 -7.23 -1.26 -0.45 120.40 113.33 1yko s VAL 109 Ca 0.06 -1.79 -0.30 0.00 -1.81 0.00 0.00 61.98 58.15 1yko s VAL 109 Cb -0.01 -2.83 -0.05 0.00 0.56 0.00 0.00 36.38 34.06 1yko s VAL 109 CO 0.05 -0.30 1.40 -0.75 -0.31 0.00 0.00 175.10 175.19 1yko s LYS 110 N -3.44 4.27 0.53 4.82 2.20 -0.74 -4.86 119.74 122.52 1yko s LYS 110 Ca 0.30 1.93 -0.21 0.00 -0.36 0.00 0.00 55.97 57.63 1yko s LYS 110 Cb -0.07 -3.64 -0.05 0.00 -1.51 0.00 0.00 37.83 32.56 1yko s LYS 110 CO 0.19 -0.61 1.21 -1.25 -0.36 0.00 0.00 175.35 174.53 1yko s PRO 111 N 2.69 3.32 0.82 4.03 0.04 -1.26 -4.17 135.00 140.46 1yko s PRO 111 Ca 0.63 1.85 -0.08 0.00 0.04 0.00 0.00 61.00 63.43 1yko s PRO 111 Cb -0.30 -2.15 0.14 0.00 0.04 0.00 0.00 34.50 32.23 1yko s PRO 111 CO 0.25 -0.93 1.14 0.20 0.04 0.00 0.00 177.00 177.69 1yko s GLY 112 N -1.43 1.75 0.04 0.56 0.00 0.71 -4.72 107.32 104.22 1yko s GLY 112 Ca 0.71 -1.31 -0.30 0.00 0.00 0.00 0.00 44.72 43.82 1yko s GLY 112 CO 0.35 -0.70 0.99 0.14 0.00 0.00 0.00 173.10 173.88 1yko s VAL 113 N -3.48 4.69 0.06 1.40 1.01 -1.26 -4.53 120.40 118.30 1yko s VAL 113 Ca 0.68 2.01 0.09 0.00 0.00 0.00 0.00 61.98 64.76 1yko s VAL 113 Cb -0.06 -4.29 -0.03 0.00 0.00 0.00 0.00 36.38 32.00 1yko s VAL 113 CO 0.48 0.20 -0.25 0.68 0.00 0.00 0.00 175.10 176.21 1yko s VAL 114 N 0.72 2.05 0.24 2.92 -7.23 -1.25 -4.60 120.40 113.25 1yko s VAL 114 Ca 0.51 -1.43 -0.09 0.00 -1.81 0.00 0.00 61.98 59.16 1yko s VAL 114 Cb -0.22 -1.78 -0.07 0.00 0.56 0.00 0.00 36.38 34.87 1yko s VAL 114 CO 0.29 0.26 0.56 0.20 -0.31 0.00 0.00 175.10 176.10 1yko s ASN 115 N -1.42 6.60 0.86 4.85 -0.87 -1.26 -1.08 114.94 122.61 1yko s ASN 115 Ca 0.11 0.90 -0.04 0.00 -1.57 0.00 0.00 52.86 52.26 1yko s ASN 115 Cb -0.10 -2.22 0.07 0.00 -0.02 0.00 0.00 41.25 38.99 1yko s ASN 115 CO 0.03 -0.10 0.45 -0.46 -2.57 0.00 0.00 177.10 174.45 1yko n ASN 116 N -0.29 0.17 0.04 -1.22 6.94 -0.38 -4.89 115.26 115.63 1yko n ASN 116 Ca 0.00 -1.25 0.07 0.00 -0.02 0.00 0.00 54.58 53.39 1yko n ASN 116 Cb 0.53 -0.33 0.49 0.00 -2.36 0.00 0.00 39.78 38.11 1yko n ASN 116 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1yko h ALA 117 N -1.51 1.86 -0.00 -2.53 0.00 -1.99 -1.87 119.26 113.21 1yko h ALA 117 Ca -0.15 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.74 1yko h ALA 117 Cb 0.44 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.12 1yko h ALA 117 CO 0.12 0.10 -0.12 0.00 0.00 0.00 0.00 179.25 179.34 1yko n ALA 118 N -2.50 2.76 -0.02 0.00 0.00 -1.26 -4.92 120.51 114.56 1yko n ALA 118 Ca 0.03 -0.24 0.00 0.00 0.00 0.00 0.00 53.44 53.23 1yko n ALA 118 Cb 0.15 -1.34 0.00 0.00 0.00 0.00 0.00 19.45 18.25 1yko n ALA 118 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1yko n GLY 119 N 1.33 0.52 3.71 0.00 0.00 -0.70 -5.06 105.19 104.98 1yko n GLY 119 Ca 0.13 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.73 1yko n GLY 119 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1yko s VAL 120 N -2.19 3.99 0.20 1.61 1.01 -1.26 -4.66 120.40 119.10 1yko s VAL 120 Ca 0.00 1.42 -0.30 0.00 0.00 0.00 0.00 61.98 63.09 1yko s VAL 120 Cb 0.00 -3.91 -0.09 0.00 0.00 0.00 0.00 36.38 32.38 1yko s VAL 120 CO 0.00 0.09 1.34 -2.16 0.00 0.00 0.00 175.10 174.37 1yko s PRO 121 N 1.24 4.36 0.10 2.72 0.04 -1.26 -1.25 135.00 140.94 1yko s PRO 121 Ca 0.59 2.09 -0.03 0.00 0.04 0.00 0.00 61.00 63.69 1yko s PRO 121 Cb -0.30 -3.19 -0.05 0.00 0.04 0.00 0.00 34.50 31.01 1yko s PRO 121 CO 0.28 -0.30 0.30 -1.64 0.04 0.00 0.00 177.00 175.69 1yko s MET 122 N -0.02 3.55 0.73 4.56 -1.94 -0.24 -4.49 119.30 121.45 1yko s MET 122 Ca 0.58 -0.21 -0.13 0.00 -1.71 0.00 0.00 55.69 54.22 1yko s MET 122 Cb -0.37 -2.95 0.03 0.00 2.01 0.00 0.00 34.83 33.55 1yko s MET 122 CO 0.38 0.54 1.11 0.00 -0.01 0.00 0.00 175.02 177.04 1yko s ALA 123 N -1.56 2.31 -0.09 3.03 0.00 -1.26 -3.95 121.76 120.24 1yko s ALA 123 Ca 0.37 0.43 -0.32 0.00 0.00 0.00 0.00 51.96 52.44 1yko s ALA 123 Cb -0.13 -3.31 -0.10 0.00 0.00 0.00 0.00 23.12 19.59 1yko s ALA 123 CO 0.25 -1.60 2.00 -2.30 0.00 0.00 0.00 175.76 174.11 1yko n PRO 124 N -3.04 2.27 -4.14 0.00 -0.02 -1.26 -4.85 135.00 123.97 1yko n PRO 124 Ca 0.10 0.79 -0.09 0.00 -2.02 0.00 0.00 63.50 62.28 1yko n PRO 124 Cb 0.52 -2.85 -0.10 0.00 -0.02 0.00 0.00 33.50 31.05 1yko n PRO 124 CO 0.00 0.00 0.00 -3.38 1.98 0.00 0.00 175.50 174.10 1yko s HIS 125 N 5.21 0.78 -0.11 6.00 -3.43 -1.26 -4.23 115.29 118.25 1yko s HIS 125 Ca 0.94 -1.13 0.01 0.00 -0.80 0.00 0.00 55.06 54.09 1yko s HIS 125 Cb -0.56 -0.47 0.02 0.00 -1.43 0.00 0.00 32.58 30.13 1yko s HIS 125 CO 0.46 -0.41 -0.13 0.42 -2.00 0.00 0.00 174.74 173.08 1yko s ILE 126 N -3.93 1.37 -0.17 -5.38 1.01 -0.72 -4.62 121.20 108.76 1yko s ILE 126 Ca 0.17 -0.55 -0.27 0.00 0.00 0.00 0.00 60.65 60.00 1yko s ILE 126 Cb 0.07 -1.28 -0.01 0.00 0.01 0.00 0.00 42.46 41.26 1yko s ILE 126 CO -0.03 0.42 0.92 0.20 0.00 0.00 0.00 174.94 176.45 1yko s ASN 127 N 1.14 7.05 -0.03 3.58 0.01 -0.20 -0.99 114.94 125.51 1yko s ASN 127 Ca -0.04 1.30 0.06 0.00 -0.71 0.00 0.00 52.86 53.47 1yko s ASN 127 Cb -0.14 -2.50 -0.02 0.00 0.41 0.00 0.00 41.25 39.00 1yko s ASN 127 CO -0.03 -0.48 -0.22 -0.63 -1.51 0.00 0.00 177.10 174.23 1yko s ILE 128 N 2.39 2.38 -0.17 0.60 1.01 -0.38 -0.79 121.20 126.23 1yko s ILE 128 Ca 0.42 -0.98 0.01 0.00 0.00 0.00 0.00 60.65 60.09 1yko s ILE 128 Cb -0.17 -1.86 0.02 0.00 0.01 0.00 0.00 42.46 40.46 1yko s ILE 128 CO 0.12 0.58 -0.17 -0.44 0.00 0.00 0.00 174.94 175.03 1yko s SER 129 N -0.63 2.95 -0.20 3.58 0.01 -0.12 -0.95 113.70 118.35 1yko s SER 129 Ca 0.10 -0.59 -0.08 0.00 1.31 0.00 0.00 55.95 56.69 1yko s SER 129 Cb -0.10 -1.34 -0.04 0.00 0.21 0.00 0.00 66.02 64.75 1yko s SER 129 CO -0.00 -0.03 0.07 -0.22 0.41 0.00 0.00 173.24 173.47 1yko s LEU 130 N 1.38 3.80 0.08 2.44 2.96 0.73 -1.32 118.68 128.75 1yko s LEU 130 Ca 0.05 0.05 0.07 0.00 -0.22 0.00 0.00 54.13 54.08 1yko s LEU 130 Cb -0.13 -1.97 -0.03 0.00 0.50 0.00 0.00 46.19 44.55 1yko s LEU 130 CO -0.12 0.14 -0.18 -0.36 -1.32 0.00 0.00 176.35 174.50 1yko s PHE 131 N 0.60 1.59 0.00 5.38 0.40 0.53 -1.69 117.98 124.79 1yko s PHE 131 Ca 0.04 -0.42 0.00 0.00 -0.60 0.00 0.00 56.93 55.95 1yko s PHE 131 Cb -0.13 -0.89 0.00 0.00 0.51 0.00 0.00 43.02 42.51 1yko s PHE 131 CO 0.01 0.14 0.00 0.00 0.70 0.00 0.00 175.22 176.07 1yko n ALA 132 N 1.27 0.00 -2.06 5.36 0.00 -1.26 0.09 120.51 123.90 1yko n ALA 132 Ca -0.20 0.00 -0.41 0.00 0.00 0.00 0.00 53.44 52.83 1yko n ALA 132 Cb 0.54 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.96 1yko n ALA 132 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.50 176.52 1yko s ARG 133 N -2.00 4.40 0.00 0.00 1.70 -1.26 -2.34 118.95 119.45 1yko s ARG 133 Ca 0.00 2.01 0.00 0.00 -0.47 0.00 0.00 55.73 57.27 1yko s ARG 133 Cb 0.00 -3.22 0.00 0.00 -0.57 0.00 0.00 34.95 31.16 1yko s ARG 133 CO 0.00 -0.26 0.00 0.41 -1.08 0.00 0.00 175.30 174.37 1yko n GLY 134 N 2.55 0.48 3.23 3.88 0.00 -1.26 -5.00 105.19 109.08 1yko n GLY 134 Ca 0.07 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.68 1yko n GLY 134 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1yko s ILE 135 N -2.14 4.22 0.19 -0.61 1.01 -0.99 -4.97 121.20 117.92 1yko s ILE 135 Ca 0.00 -1.66 -0.10 0.00 0.00 0.00 0.00 60.65 58.89 1yko s ILE 135 Cb 0.00 -3.72 0.10 0.00 0.01 0.00 0.00 42.46 38.85 1yko s ILE 135 CO 0.00 -0.69 1.73 0.78 0.00 0.00 0.00 174.94 176.76 1yko h ASN 136 N 8.44 0.96 -3.60 3.58 2.35 -1.91 -3.36 115.58 122.04 1yko h ASN 136 Ca -0.22 -0.20 -0.43 0.00 -0.55 0.00 0.00 56.30 54.90 1yko h ASN 136 Cb 1.08 -0.25 -0.32 0.00 0.05 0.00 0.00 38.32 38.87 1yko h ASN 136 CO 0.83 0.90 -0.79 -0.51 -1.65 0.00 0.00 177.43 176.21 1yko s ILE 137 N -5.45 0.74 0.43 2.81 2.07 -1.26 -3.22 121.20 117.32 1yko s ILE 137 Ca -0.12 -0.29 -0.23 0.00 -1.41 0.00 0.00 60.65 58.59 1yko s ILE 137 Cb 0.14 -0.70 -0.10 0.00 0.13 0.00 0.00 42.46 41.92 1yko s ILE 137 CO 0.82 0.25 0.92 0.00 -1.91 0.00 0.00 174.94 175.02 1yko n HIS 138 N 3.67 0.83 -3.60 3.50 1.44 -1.26 -4.98 115.22 114.82 1yko n HIS 138 Ca -0.22 0.56 -0.37 0.00 -2.01 0.00 0.00 57.72 55.68 1yko n HIS 138 Cb 0.52 -2.18 -0.09 0.00 0.12 0.00 0.00 29.99 28.37 1yko n HIS 138 CO 0.00 0.00 0.00 -0.51 -2.81 0.00 0.00 176.34 173.02 1yko s LEU 139 N -0.21 4.14 -0.11 2.39 1.43 -0.68 -4.89 118.68 120.76 1yko s LEU 139 Ca 0.64 0.24 -0.15 0.00 -1.03 0.00 0.00 54.13 53.83 1yko s LEU 139 Cb -0.56 -2.21 -0.05 0.00 0.03 0.00 0.00 46.19 43.41 1yko s LEU 139 CO 0.56 0.05 0.37 -1.00 0.23 0.00 0.00 176.35 176.56 1yko s HIS 140 N 0.99 3.54 0.32 0.29 3.76 -1.26 -0.19 115.29 122.74 1yko s HIS 140 Ca 0.11 0.77 -0.07 0.00 -0.15 0.00 0.00 55.06 55.72 1yko s HIS 140 Cb -0.13 -2.38 0.01 0.00 1.11 0.00 0.00 32.58 31.19 1yko s HIS 140 CO 0.04 0.33 0.51 -0.08 -0.85 0.00 0.00 174.74 174.70 1yko s THR 141 N 0.09 0.00 0.07 1.30 -1.32 -0.12 -0.16 115.64 115.49 1yko s THR 141 Ca 0.21 -1.48 0.04 0.00 -1.21 0.00 0.00 61.69 59.25 1yko s THR 141 Cb -0.14 -2.56 -0.03 0.00 -1.51 0.00 0.00 72.50 68.26 1yko s THR 141 CO 0.08 0.00 -0.12 -0.13 -2.21 0.00 0.00 174.62 172.24 1yko s ARG 142 N -3.22 0.75 -0.17 7.08 0.52 -1.26 -1.25 118.95 121.40 1yko s ARG 142 Ca 0.27 -0.94 -0.02 0.00 -0.52 0.00 0.00 55.73 54.52 1yko s ARG 142 Cb -0.01 -0.65 -0.01 0.00 0.52 0.00 0.00 34.95 34.80 1yko s ARG 142 CO 0.16 0.13 -0.08 -1.17 0.02 0.00 0.00 175.30 174.37 1yko s LEU 143 N -1.81 2.90 0.27 2.53 0.20 -0.16 -4.73 118.68 117.87 1yko s LEU 143 Ca -0.03 -0.31 0.12 0.00 0.69 0.00 0.00 54.13 54.59 1yko s LEU 143 Cb -0.09 -1.70 -0.05 0.00 -0.43 0.00 0.00 46.19 43.93 1yko s LEU 143 CO 0.02 0.09 -0.18 -0.31 -0.29 0.00 0.00 176.35 175.68 1yko s TYR 144 N 0.80 2.35 -0.03 5.38 1.51 0.64 -1.75 117.35 126.25 1yko s TYR 144 Ca -0.03 -0.32 -0.01 0.00 -1.01 0.00 0.00 57.07 55.71 1yko s TYR 144 Cb -0.15 -1.04 -0.04 0.00 -0.11 0.00 0.00 41.96 40.62 1yko s TYR 144 CO 0.01 0.68 0.06 -0.06 -1.11 0.00 0.00 175.55 175.13 1yko s PHE 145 N -2.37 3.25 -0.05 2.71 0.40 -1.26 0.45 117.98 121.11 1yko s PHE 145 Ca 0.29 0.21 0.27 0.00 -0.60 0.00 0.00 56.93 57.10 1yko s PHE 145 Cb -0.06 -1.76 0.87 0.00 0.51 0.00 0.00 43.02 42.59 1yko s PHE 145 CO 0.15 0.54 1.80 0.38 0.70 0.00 0.00 175.22 178.78 1yko h ASP 146 N 4.46 0.00 -0.14 1.36 2.03 -1.84 -3.09 116.42 119.20 1yko h ASP 146 Ca -0.50 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 55.80 1yko h ASP 146 Cb 1.19 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.69 1yko h ASP 146 CO 0.59 0.10 0.00 -0.90 -1.03 0.00 0.00 179.24 178.00 1yko n ASP 147 N -3.18 1.13 -1.45 4.15 5.75 -1.26 -3.46 116.55 118.23 1yko n ASP 147 Ca 0.01 -1.69 -0.12 0.00 -0.01 0.00 0.00 54.79 52.98 1yko n ASP 147 Cb 0.43 -0.09 0.12 0.00 -1.03 0.00 0.00 41.12 40.56 1yko n ASP 147 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 1yko n GLU 148 N -0.00 2.52 -0.11 0.11 -0.58 -1.17 -4.84 120.64 116.57 1yko n GLU 148 Ca 0.14 -3.60 0.25 0.00 -0.42 0.00 0.00 57.16 53.53 1yko n GLU 148 Cb 0.23 -1.98 0.71 0.00 -0.57 0.00 0.00 31.44 29.83 1yko n GLU 148 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1yko h ALA 149 N 1.53 2.70 -0.01 0.62 0.00 -1.75 -1.19 119.26 121.17 1yko h ALA 149 Ca 0.26 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.14 1yko h ALA 149 Cb 1.38 0.06 0.00 0.00 0.00 0.00 0.00 17.79 19.22 1yko h ALA 149 CO 0.54 -0.94 -0.02 1.96 0.00 0.00 0.00 179.25 180.79 1yko h GLN 150 N 0.00 0.03 -0.32 0.00 4.20 -1.92 -3.11 115.11 113.99 1yko h GLN 150 Ca 0.36 -0.02 -0.10 0.00 0.06 0.00 0.00 58.65 58.95 1yko h GLN 150 Cb 1.45 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 29.22 1yko h GLN 150 CO -0.00 0.60 -0.22 0.00 -0.67 0.00 0.00 178.83 178.54 1yko h ALA 151 N 0.43 1.02 -0.61 3.87 0.00 -1.79 -3.14 119.26 119.04 1yko h ALA 151 Ca 0.00 -0.35 -0.03 0.00 0.00 0.00 0.00 54.91 54.53 1yko h ALA 151 Cb 0.60 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 18.23 1yko h ALA 151 CO 0.00 0.58 0.26 -0.91 0.00 0.00 0.00 179.25 179.19 1yko h ASN 152 N 0.54 0.79 1.34 0.00 2.35 -1.32 -1.95 115.58 117.34 1yko h ASN 152 Ca 0.08 -0.09 0.00 0.00 -0.55 0.00 0.00 56.30 55.74 1yko h ASN 152 Cb 0.67 -0.20 0.00 0.00 0.05 0.00 0.00 38.32 38.84 1yko h ASN 152 CO 0.05 0.70 0.00 0.00 -1.65 0.00 0.00 177.43 176.53 1yko h ALA 153 N 1.42 1.00 -0.01 -0.83 0.00 -1.49 -3.04 119.26 116.30 1yko h ALA 153 Ca 0.21 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.12 1yko h ALA 153 Cb 0.14 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.93 1yko h ALA 153 CO -0.02 0.00 -0.43 1.63 0.00 0.00 0.00 179.25 180.43 1yko n LYS 154 N -2.88 1.38 -2.05 0.00 4.76 -0.93 -4.94 118.16 113.50 1yko n LYS 154 Ca 0.02 -0.92 -0.42 0.00 -2.87 0.00 0.00 58.31 54.12 1yko n LYS 154 Cb 0.38 -1.40 -0.03 0.00 -1.84 0.00 0.00 35.03 32.14 1yko n LYS 154 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1yko h PRO 156 N 9.08 0.00 0.14 0.00 0.13 -1.92 -1.34 132.00 138.10 1yko h PRO 156 Ca -0.39 0.00 -0.35 0.00 -0.87 0.00 0.00 66.00 64.39 1yko h PRO 156 Cb 1.18 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.30 1yko h PRO 156 CO 0.95 0.00 -1.88 0.28 -0.23 0.00 0.00 178.00 177.12 1yko h VAL 157 N 0.00 0.75 0.00 1.56 2.07 -1.95 -3.31 116.25 115.37 1yko h VAL 157 Ca 0.00 -2.40 -0.10 0.00 0.82 0.00 0.00 66.70 65.02 1yko h VAL 157 Cb 0.31 2.60 -0.01 0.00 -1.52 0.00 0.00 31.29 32.66 1yko h VAL 157 CO 0.00 0.87 -0.50 0.25 0.02 0.00 0.00 177.57 178.21 1yko h LEU 158 N 0.05 0.00 0.00 2.57 5.85 -1.83 -2.58 115.31 119.36 1yko h LEU 158 Ca -0.39 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.33 1yko h LEU 158 Cb 2.03 0.00 0.00 0.00 0.37 0.00 0.00 40.66 43.06 1yko h LEU 158 CO 0.11 0.50 0.00 0.59 -0.34 0.00 0.00 178.44 179.30 1yko n ASN 159 N -3.92 0.00 0.14 1.25 3.02 -0.53 -2.94 115.26 112.29 1yko n ASN 159 Ca -0.01 0.33 0.13 0.00 -0.03 0.00 0.00 54.58 55.00 1yko n ASN 159 Cb 0.52 -0.44 0.37 0.00 -0.61 0.00 0.00 39.78 39.61 1yko n ASN 159 CO 0.00 0.00 0.00 -0.07 -2.62 0.00 0.00 177.26 174.57 1yko h LEU 160 N 0.00 0.00 -8.53 3.41 3.38 -1.54 -3.41 115.31 108.62 1yko h LEU 160 Ca 0.00 0.00 -0.59 0.00 0.09 0.00 0.00 57.88 57.38 1yko h LEU 160 Cb 0.42 0.00 -0.11 0.00 0.09 0.00 0.00 40.66 41.07 1yko h LEU 160 CO 0.00 0.00 0.69 -0.63 0.09 0.00 0.00 178.44 178.59 1yko s ILE 161 N -3.17 4.28 0.17 1.22 1.01 -1.15 -4.94 121.20 118.61 1yko s ILE 161 Ca 0.09 0.51 -0.25 0.00 0.00 0.00 0.00 60.65 61.00 1yko s ILE 161 Cb 0.10 -4.59 0.06 0.00 0.01 0.00 0.00 42.46 38.04 1yko s ILE 161 CO 0.59 -1.16 1.57 -0.33 0.00 0.00 0.00 174.94 175.61 1yko h GLU 162 N 9.36 -0.19 -5.59 2.79 5.08 -1.88 -3.40 114.58 120.75 1yko h GLU 162 Ca -0.26 0.01 -0.60 0.00 -1.00 0.00 0.00 59.36 57.51 1yko h GLU 162 Cb 1.07 0.04 -0.11 0.00 0.50 0.00 0.00 28.75 30.26 1yko h GLU 162 CO 1.11 -0.12 0.23 -0.65 -1.00 0.00 0.00 179.01 178.58 1yko s GLN 163 N -5.84 4.14 0.41 2.33 -1.52 -1.26 -4.97 119.66 112.94 1yko s GLN 163 Ca -0.14 0.65 0.13 0.00 -1.95 0.00 0.00 55.36 54.05 1yko s GLN 163 Cb 0.14 -3.64 0.99 0.00 -0.22 0.00 0.00 33.01 30.28 1yko s GLN 163 CO 0.67 -0.42 1.93 -1.35 -0.25 0.00 0.00 175.29 175.87 1yko h PRO 164 N 7.80 0.47 -0.01 2.91 0.11 -1.98 -2.23 132.00 139.07 1yko h PRO 164 Ca -0.26 -0.03 -0.02 0.00 0.11 0.00 0.00 66.00 65.80 1yko h PRO 164 Cb 1.12 -0.11 -0.00 0.00 0.11 0.00 0.00 31.00 32.12 1yko h PRO 164 CO 0.80 0.31 -0.09 1.96 -0.21 0.00 0.00 178.00 180.77 1yko h GLN 165 N 0.48 0.01 0.00 1.05 7.50 -1.96 -2.25 115.11 119.94 1yko h GLN 165 Ca 0.36 -0.00 -0.07 0.00 0.50 0.00 0.00 58.65 59.43 1yko h GLN 165 Cb 0.71 -0.00 -0.01 0.00 0.05 0.00 0.00 27.48 28.23 1yko h GLN 165 CO -0.12 0.10 -0.37 0.00 -1.50 0.00 0.00 178.83 176.94 1yko h ARG 166 N 0.01 0.00 0.00 1.46 3.08 -1.80 -3.24 114.38 113.88 1yko h ARG 166 Ca 0.00 0.00 -0.07 0.00 0.07 0.00 0.00 59.98 59.98 1yko h ARG 166 Cb 0.16 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.20 1yko h ARG 166 CO 0.01 0.32 -0.35 0.00 -1.07 0.00 0.00 179.97 178.88 1yko h ARG 167 N 0.00 0.00 0.00 0.04 3.08 -1.43 -2.92 114.38 113.14 1yko h ARG 167 Ca -0.01 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.04 1yko h ARG 167 Cb 1.26 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.31 1yko h ARG 167 CO 0.04 0.35 0.00 0.93 -1.07 0.00 0.00 179.97 180.22 1yko h GLU 168 N 0.00 0.00 0.00 0.04 5.08 -1.58 -2.82 114.58 115.30 1yko h GLU 168 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1yko h GLU 168 Cb 0.76 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.01 1yko h GLU 168 CO 0.05 0.00 -0.05 1.79 -1.00 0.00 0.00 179.01 179.80 1yko h THR 169 N 0.00 0.00 -0.00 1.13 1.35 -1.70 -3.18 112.91 110.51 1yko h THR 169 Ca 0.00 -0.78 0.00 0.00 -0.55 0.00 0.00 66.41 65.08 1yko h THR 169 Cb 0.34 1.75 0.00 0.00 -1.73 0.00 0.00 68.15 68.51 1yko h THR 169 CO 0.00 0.00 -0.64 0.18 -0.25 0.00 0.00 175.52 174.81 1yko n LEU 170 N -2.72 0.84 -4.66 3.87 4.77 -1.06 -4.82 117.00 113.22 1yko n LEU 170 Ca 0.04 -0.25 -0.39 0.00 -0.03 0.00 0.00 56.01 55.38 1yko n LEU 170 Cb 0.49 -0.13 -0.07 0.00 -2.33 0.00 0.00 43.42 41.38 1yko n LEU 170 CO 0.33 0.19 0.27 -0.63 -1.33 0.00 0.00 177.39 176.22 1yko s ILE 171 N -2.91 5.08 -0.15 -0.08 1.01 -1.20 -0.26 121.20 122.69 1yko s ILE 171 Ca 0.12 1.01 -0.19 0.00 0.00 0.00 0.00 60.65 61.59 1yko s ILE 171 Cb 0.17 -3.87 -0.04 0.00 0.01 0.00 0.00 42.46 38.74 1yko s ILE 171 CO 0.73 0.15 0.51 0.00 0.00 0.00 0.00 174.94 176.34 1yko s ALA 172 N 1.75 3.50 0.06 9.38 0.00 0.17 -4.92 121.76 131.70 1yko s ALA 172 Ca 0.25 -0.26 -0.30 0.00 0.00 0.00 0.00 51.96 51.65 1yko s ALA 172 Cb -0.16 -2.74 -0.05 0.00 0.00 0.00 0.00 23.12 20.17 1yko s ALA 172 CO 0.10 -0.20 1.14 0.15 0.00 0.00 0.00 175.76 176.95 1yko s LYS 173 N 1.09 4.47 0.00 0.00 -0.14 -0.82 -2.53 119.74 121.81 1yko s LYS 173 Ca 0.26 1.69 -0.30 0.00 -1.36 0.00 0.00 55.97 56.26 1yko s LYS 173 Cb -0.15 -3.37 -0.03 0.00 -1.68 0.00 0.00 37.83 32.60 1yko s LYS 173 CO 0.10 -0.19 1.04 0.50 -0.76 0.00 0.00 175.35 176.05 1yko s ARG 174 N 0.94 4.51 0.14 1.68 3.52 -1.26 -0.38 118.95 128.09 1yko s ARG 174 Ca 0.57 1.51 0.03 0.00 -0.13 0.00 0.00 55.73 57.70 1yko s ARG 174 Cb -0.28 -3.45 -0.01 0.00 -1.56 0.00 0.00 34.95 29.66 1yko s ARG 174 CO 0.29 -0.15 0.13 0.00 -0.81 0.00 0.00 175.30 174.76 1yko s GLU 176 N -2.54 0.54 -0.26 0.00 2.02 -1.26 -2.13 118.70 115.07 1yko s GLU 176 Ca 0.16 0.11 0.03 0.00 0.02 0.00 0.00 54.97 55.29 1yko s GLU 176 Cb 0.01 -0.88 0.06 0.00 0.10 0.00 0.00 34.13 33.42 1yko s GLU 176 CO 0.11 -0.27 -0.10 0.08 0.02 0.00 0.00 175.26 175.11 1yko s VAL 177 N 1.81 2.16 -1.32 2.63 1.01 -1.08 -4.77 120.40 120.83 1yko s VAL 177 Ca 0.02 -1.67 -0.06 0.00 0.00 0.00 0.00 61.98 60.27 1yko s VAL 177 Cb -0.13 -2.29 0.01 0.00 0.00 0.00 0.00 36.38 33.97 1yko s VAL 177 CO -0.04 -0.06 1.09 0.47 0.00 0.00 0.00 175.10 176.56 1yko n ASP 178 N 4.43 -4.69 -0.43 3.32 8.00 -1.26 -2.59 116.55 123.32 1yko n ASP 178 Ca -0.13 -0.60 -0.06 0.00 0.71 0.00 0.00 54.79 54.72 1yko n ASP 178 Cb 0.42 -4.93 -0.02 0.00 -0.02 0.00 0.00 41.12 36.56 1yko n ASP 178 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1yko n GLY 179 N -1.70 0.73 3.64 0.44 0.00 -1.26 -5.00 105.19 102.04 1yko n GLY 179 Ca -0.09 -0.22 -0.31 0.00 0.00 0.00 0.00 46.02 45.39 1yko n GLY 179 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1yko s LYS 180 N -2.03 2.52 -0.18 1.61 2.47 -1.07 -5.08 119.74 117.99 1yko s LYS 180 Ca 0.00 -0.79 -0.29 0.00 -1.56 0.00 0.00 55.97 53.33 1yko s LYS 180 Cb 0.00 -2.51 -0.03 0.00 -1.46 0.00 0.00 37.83 33.83 1yko s LYS 180 CO 0.00 0.57 1.47 0.99 0.16 0.00 0.00 175.35 178.54 1yko s THR 181 N -1.15 3.91 0.10 3.43 2.01 -1.26 -2.64 115.64 120.04 1yko s THR 181 Ca 0.21 1.07 0.07 0.00 0.31 0.00 0.00 61.69 63.35 1yko s THR 181 Cb -0.11 -3.80 -0.03 0.00 0.01 0.00 0.00 72.50 68.56 1yko s THR 181 CO 0.12 -0.22 -0.18 0.00 -0.69 0.00 0.00 174.62 173.66 1yko s ALA 182 N 4.29 1.60 -0.05 7.40 0.00 -0.90 -0.84 121.76 133.25 1yko s ALA 182 Ca 0.65 -1.20 0.02 0.00 0.00 0.00 0.00 51.96 51.43 1yko s ALA 182 Cb -0.25 -0.18 0.01 0.00 0.00 0.00 0.00 23.12 22.71 1yko s ALA 182 CO 0.24 0.27 -0.10 0.71 0.00 0.00 0.00 175.76 176.88 1yko s TYR 183 N -1.37 1.15 -0.22 0.00 1.51 -0.63 -0.72 117.35 117.08 1yko s TYR 183 Ca 0.05 -0.37 -0.11 0.00 -1.01 0.00 0.00 57.07 55.63 1yko s TYR 183 Cb -0.09 -0.87 -0.05 0.00 -0.11 0.00 0.00 41.96 40.84 1yko s TYR 183 CO 0.04 -0.21 0.17 0.50 -1.11 0.00 0.00 175.55 174.94 1yko s ARG 184 N 0.61 4.14 -0.33 -0.62 3.52 0.49 -2.27 118.95 124.48 1yko s ARG 184 Ca -0.11 -0.21 0.00 0.00 -0.13 0.00 0.00 55.73 55.28 1yko s ARG 184 Cb -0.14 -3.48 0.11 0.00 -1.56 0.00 0.00 34.95 29.87 1yko s ARG 184 CO 0.02 0.16 0.12 0.12 -0.81 0.00 0.00 175.30 174.91 1yko s PHE 185 N 0.75 1.87 -0.02 5.12 5.36 -0.09 -1.95 117.98 129.02 1yko s PHE 185 Ca 0.09 -1.93 -0.17 0.00 -0.96 0.00 0.00 56.93 53.96 1yko s PHE 185 Cb -0.12 -1.81 -0.05 0.00 -0.34 0.00 0.00 43.02 40.69 1yko s PHE 185 CO 0.02 -0.87 0.46 -0.51 -1.46 0.00 0.00 175.22 172.87 1yko s ASP 186 N 1.35 6.83 -0.17 6.13 1.01 -1.26 -4.00 116.67 126.56 1yko s ASP 186 Ca 0.11 0.99 -0.04 0.00 0.71 0.00 0.00 52.55 54.32 1yko s ASP 186 Cb -0.19 -2.28 -0.03 0.00 1.01 0.00 0.00 42.92 41.43 1yko s ASP 186 CO -0.19 0.22 -0.02 -0.63 0.21 0.00 0.00 175.17 174.77 1yko s ILE 187 N -0.61 3.99 -0.32 0.77 1.01 -0.40 -4.96 121.20 120.69 1yko s ILE 187 Ca 0.25 -0.31 -0.00 0.00 0.00 0.00 0.00 60.65 60.59 1yko s ILE 187 Cb -0.17 -2.77 0.07 0.00 0.01 0.00 0.00 42.46 39.60 1yko s ILE 187 CO 0.14 0.47 0.03 -0.13 0.00 0.00 0.00 174.94 175.44 1yko s ARG 188 N 0.58 2.18 0.24 2.79 0.52 -1.26 -0.53 118.95 123.47 1yko s ARG 188 Ca -0.02 -1.47 -0.03 0.00 -0.52 0.00 0.00 55.73 53.70 1yko s ARG 188 Cb -0.14 -3.21 0.27 0.00 0.52 0.00 0.00 34.95 32.38 1yko s ARG 188 CO 0.02 -0.74 1.69 0.82 0.02 0.00 0.00 175.30 177.11 1yko h ILE 189 N 6.52 1.26 -3.38 1.52 2.04 -1.67 0.29 117.51 124.09 1yko h ILE 189 Ca -0.17 -1.21 -0.14 0.00 1.00 0.00 0.00 64.86 64.34 1yko h ILE 189 Cb 1.05 1.11 -0.20 0.00 -0.74 0.00 0.00 36.82 38.04 1yko h ILE 189 CO 0.55 0.41 -0.43 -1.58 0.00 0.00 0.00 178.15 177.10 1yko s GLN 190 N -4.72 0.54 0.83 2.37 0.74 -1.26 -4.78 119.66 113.38 1yko s GLN 190 Ca -0.09 -0.35 0.00 0.00 0.05 0.00 0.00 55.36 54.97 1yko s GLN 190 Cb 0.14 0.23 0.00 0.00 1.10 0.00 0.00 33.01 34.48 1yko s GLN 190 CO 0.82 -0.14 0.00 0.41 -0.55 0.00 0.00 175.29 175.83 1yko n GLY 191 N 1.37 0.53 3.70 2.59 0.00 -1.26 -4.09 105.19 108.02 1yko n GLY 191 Ca -0.22 -1.55 -0.42 0.00 0.00 0.00 0.00 46.02 43.83 1yko n GLY 191 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1yko s GLU 192 N 0.00 4.38 -0.48 1.61 2.12 -1.26 -2.98 118.70 122.08 1yko s GLU 192 Ca 0.00 1.75 0.00 0.00 0.36 0.00 0.00 54.97 57.08 1yko s GLU 192 Cb 0.00 -3.47 0.00 0.00 0.26 0.00 0.00 34.13 30.92 1yko s GLU 192 CO 0.00 -0.38 0.00 0.41 -0.54 0.00 0.00 175.26 174.75 1yko n GLY 193 N 3.34 0.39 3.68 -1.50 0.00 -1.26 -4.97 105.19 104.87 1yko n GLY 193 Ca 0.10 -0.73 -0.45 0.00 0.00 0.00 0.00 46.02 44.94 1yko n GLY 193 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1yko n GLU 194 N -2.00 2.37 -2.19 1.61 2.13 -1.16 -4.63 120.64 116.77 1yko n GLU 194 Ca -0.06 0.86 -0.39 0.00 0.66 0.00 0.00 57.16 58.22 1yko n GLU 194 Cb 0.41 -2.66 -0.02 0.00 0.27 0.00 0.00 31.44 29.44 1yko n GLU 194 CO 0.00 0.00 0.00 0.99 -0.41 0.00 0.00 177.13 177.71 1yko s THR 195 N 1.45 2.91 0.03 6.31 2.01 0.09 -4.95 115.64 123.48 1yko s THR 195 Ca 0.79 0.83 -0.30 0.00 0.31 0.00 0.00 61.69 63.32 1yko s THR 195 Cb -0.62 -3.49 -0.05 0.00 0.01 0.00 0.00 72.50 68.35 1yko s THR 195 CO 0.38 0.13 1.26 -0.69 -0.69 0.00 0.00 174.62 175.00 1yko s VAL 196 N -1.28 3.94 0.01 3.82 1.01 -1.26 -4.94 120.40 121.70 1yko s VAL 196 Ca 0.54 1.36 0.06 0.00 0.00 0.00 0.00 61.98 63.94 1yko s VAL 196 Cb -0.35 -3.87 -0.03 0.00 0.00 0.00 0.00 36.38 32.12 1yko s VAL 196 CO 0.45 0.06 -0.16 -0.36 0.00 0.00 0.00 175.10 175.10 1yko s PHE 197 N 1.56 2.63 0.31 5.22 0.08 -1.26 -4.66 117.98 121.87 1yko s PHE 197 Ca 0.60 -0.21 0.07 0.00 0.12 0.00 0.00 56.93 57.51 1yko s PHE 197 Cb -0.30 -1.53 -0.02 0.00 -0.57 0.00 0.00 43.02 40.60 1yko s PHE 197 CO 0.27 0.23 0.32 -0.06 -0.10 0.00 0.00 175.22 175.89 1yko s PHE 198 N -0.86 3.04 -0.02 0.36 0.08 0.77 -4.99 117.98 116.36 1yko s PHE 198 Ca 0.14 -0.22 0.00 0.00 0.12 0.00 0.00 56.93 56.97 1yko s PHE 198 Cb -0.11 -1.75 0.03 0.00 -0.57 0.00 0.00 43.02 40.62 1yko s PHE 198 CO 0.04 0.22 0.02 0.34 -0.10 0.00 0.00 175.22 175.74 1yko s ASP 199 N -4.01 0.20 0.00 1.36 3.68 -1.26 -4.37 116.67 112.27 1yko s ASP 199 Ca 0.40 0.01 0.00 0.00 2.13 0.00 0.00 52.55 55.09 1yko s ASP 199 Cb -0.07 -0.13 0.00 0.00 -1.45 0.00 0.00 42.92 41.27 1yko s ASP 199 CO 0.28 -0.11 0.00 2.22 0.13 0.00 0.00 175.17 177.68