#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 4.64 -0.17 4.25 -1.09 -1.26 -5.02 121.20 122.56 1yko s ILE 2 Ca 0.00 1.98 -0.03 0.00 -2.23 0.00 0.00 60.65 60.37 1yko s ILE 2 Cb 0.00 -4.30 -0.02 0.00 -1.58 0.00 0.00 42.46 36.56 1yko s ILE 2 CO 0.00 -0.20 -0.05 -1.61 -1.23 0.00 0.00 174.94 171.85 1yko s GLU 3 N 3.25 3.56 0.41 2.79 0.41 -1.26 -5.12 118.70 122.73 1yko s GLU 3 Ca 0.45 -0.57 0.04 0.00 -0.41 0.00 0.00 54.97 54.47 1yko s GLU 3 Cb -0.15 -2.89 0.07 0.00 -1.78 0.00 0.00 34.13 29.38 1yko s GLU 3 CO 0.07 0.14 0.56 1.28 -0.49 0.00 0.00 175.26 176.82 1yko n LEU 4 N 3.82 0.00 -4.76 1.80 4.32 -1.26 -5.06 117.00 115.86 1yko n LEU 4 Ca -0.18 -1.50 -0.41 0.00 -0.02 0.00 0.00 56.01 53.90 1yko n LEU 4 Cb 0.52 -0.32 -0.03 0.00 -1.62 0.00 0.00 43.42 41.97 1yko n LEU 4 CO 0.32 -0.70 0.93 -0.76 -1.22 0.00 0.00 177.39 175.96 1yko s LEU 5 N 0.00 4.46 0.40 2.23 1.43 -1.26 -4.98 118.68 120.96 1yko s LEU 5 Ca 0.40 2.49 -0.24 0.00 -1.03 0.00 0.00 54.13 55.75 1yko s LEU 5 Cb -0.03 -3.63 -0.09 0.00 0.03 0.00 0.00 46.19 42.47 1yko s LEU 5 CO 0.26 -0.43 1.09 -2.84 0.23 0.00 0.00 176.35 174.66 1yko s PRO 6 N -1.19 4.12 0.36 1.29 0.02 -1.26 -5.00 135.00 133.34 1yko s PRO 6 Ca 0.50 1.62 -0.27 0.00 0.02 0.00 0.00 61.00 62.88 1yko s PRO 6 Cb -0.37 -2.59 -0.09 0.00 0.02 0.00 0.00 34.50 31.47 1yko s PRO 6 CO 0.45 -0.20 1.16 -2.00 -0.33 0.00 0.00 177.00 176.09 1yko s GLU 7 N -2.41 4.25 0.17 5.54 2.12 -1.26 -4.96 118.70 122.14 1yko s GLU 7 Ca 0.57 1.86 -0.32 0.00 0.36 0.00 0.00 54.97 57.45 1yko s GLU 7 Cb -0.25 -2.84 -0.11 0.00 0.26 0.00 0.00 34.13 31.18 1yko s GLU 7 CO 0.31 -0.16 1.77 0.99 -0.54 0.00 0.00 175.26 177.63 1yko s THR 8 N -1.33 2.26 0.55 -1.70 2.01 -1.26 -4.94 115.64 111.22 1yko s THR 8 Ca 0.53 0.03 -0.22 0.00 0.31 0.00 0.00 61.69 62.35 1yko s THR 8 Cb -0.32 -3.02 -0.05 0.00 0.01 0.00 0.00 72.50 69.12 1yko s THR 8 CO 0.40 0.00 1.34 -2.84 -0.69 0.00 0.00 174.62 172.83 1yko s PRO 9 N 1.88 3.15 0.54 4.92 0.02 -1.26 -5.02 135.00 139.23 1yko s PRO 9 Ca 0.78 2.18 -0.11 0.00 0.02 0.00 0.00 61.00 63.87 1yko s PRO 9 Cb -0.48 -2.24 -0.05 0.00 0.02 0.00 0.00 34.50 31.75 1yko s PRO 9 CO 0.34 -1.16 0.93 0.45 -0.33 0.00 0.00 177.00 177.23 1yko s SER 10 N -1.02 6.36 0.05 2.53 0.15 -1.26 -5.10 113.70 115.41 1yko s SER 10 Ca 0.72 1.30 -0.03 0.00 0.70 0.00 0.00 55.95 58.63 1yko s SER 10 Cb -0.39 -2.41 -0.03 0.00 -1.71 0.00 0.00 66.02 61.49 1yko s SER 10 CO 0.46 -0.68 0.04 -1.10 1.20 0.00 0.00 173.24 173.16 1yko s GLN 11 N -4.67 0.64 0.55 5.44 -1.52 -1.18 -4.89 119.66 114.02 1yko s GLN 11 Ca 0.54 -1.04 -0.22 0.00 -1.95 0.00 0.00 55.36 52.69 1yko s GLN 11 Cb -0.11 0.24 -0.05 0.00 -0.22 0.00 0.00 33.01 32.87 1yko s GLN 11 CO 0.44 -0.15 1.34 -2.37 -0.25 0.00 0.00 175.29 174.30 1yko n THR 12 N 0.29 3.83 0.25 -0.19 5.66 -1.19 -4.75 114.28 118.18 1yko n THR 12 Ca -0.16 -0.50 0.14 0.00 -3.05 0.00 0.00 64.05 60.48 1yko n THR 12 Cb 0.60 -1.63 0.61 0.00 -1.55 0.00 0.00 70.33 68.36 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 1.38 1.04 0.00 1.79 0.00 -1.75 -3.49 119.26 118.22 1yko h ALA 13 Ca -0.51 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.31 1yko h ALA 13 Cb 1.31 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.08 1yko h ALA 13 CO 0.57 0.13 0.00 0.41 0.00 0.00 0.00 179.25 180.36 1yko n GLY 14 N -0.02 -1.96 0.24 0.00 0.00 -1.26 -4.02 105.19 98.17 1yko n GLY 14 Ca 0.00 -1.51 0.10 0.00 0.00 0.00 0.00 46.02 44.60 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 0.00 0.00 -0.91 1.61 0.13 -1.93 -3.09 132.00 127.80 1yko h PRO 15 Ca 0.00 0.00 -0.53 0.00 -0.87 0.00 0.00 66.00 64.60 1yko h PRO 15 Cb 0.00 0.00 -0.28 0.00 0.13 0.00 0.00 31.00 30.85 1yko h PRO 15 CO 0.00 0.19 0.57 0.66 -0.23 0.00 0.00 178.00 179.19 1yko n TYR 16 N -3.76 2.87 0.19 1.56 4.01 -1.26 -4.57 117.16 116.20 1yko n TYR 16 Ca -0.02 -2.21 0.06 0.00 -0.16 0.00 0.00 57.90 55.58 1yko n TYR 16 Cb 0.30 -1.03 0.53 0.00 -0.31 0.00 0.00 39.34 38.83 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 1.05 1.08 -0.30 -0.72 3.04 -1.67 -2.81 116.25 115.92 1yko h VAL 17 Ca 0.57 -0.33 -0.02 0.00 -1.01 0.00 0.00 66.70 65.91 1yko h VAL 17 Cb 2.03 1.06 -0.02 0.00 -2.01 0.00 0.00 31.29 32.36 1yko h VAL 17 CO 1.16 0.10 0.10 0.45 -1.01 0.00 0.00 177.57 178.37 1yko h HIS 18 N 0.11 0.42 0.00 3.17 3.86 -1.86 -1.93 115.15 118.92 1yko h HIS 18 Ca 0.03 -0.01 -0.02 0.00 -1.16 0.00 0.00 60.37 59.20 1yko h HIS 18 Cb 0.14 -0.13 -0.00 0.00 1.06 0.00 0.00 27.41 28.48 1yko h HIS 18 CO 0.00 0.35 -0.09 -0.84 0.86 0.00 0.00 177.93 178.21 1yko h ILE 19 N 0.42 0.72 0.00 2.45 3.07 -1.73 -1.05 117.51 121.39 1yko h ILE 19 Ca 0.10 -0.37 -0.10 0.00 1.55 0.00 0.00 64.86 66.05 1yko h ILE 19 Cb 0.13 1.22 -0.02 0.00 -0.27 0.00 0.00 36.82 37.88 1yko h ILE 19 CO -0.01 0.09 -1.69 0.61 -1.05 0.00 0.00 178.15 176.10 1yko n GLY 20 N -1.00 -0.59 0.04 0.16 0.00 -1.05 -4.57 105.19 98.18 1yko n GLY 20 Ca -0.02 -0.26 0.01 0.00 0.00 0.00 0.00 46.02 45.75 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 -2.17 0.62 -2.88 0.99 4.77 -0.75 -4.83 117.00 112.76 1yko n LEU 21 Ca -0.10 -0.75 -0.12 0.00 -0.03 0.00 0.00 56.01 55.01 1yko n LEU 21 Cb 0.59 0.00 0.03 0.00 -2.33 0.00 0.00 43.42 41.71 1yko n LEU 21 CO 0.26 0.15 0.10 0.00 -1.33 0.00 0.00 177.39 176.57 1yko n ALA 22 N -0.47 -0.12 -0.28 -1.18 0.00 -0.42 -4.99 120.51 113.04 1yko n ALA 22 Ca 0.01 -2.02 0.07 0.00 0.00 0.00 0.00 53.44 51.50 1yko n ALA 22 Cb 0.04 -1.14 0.22 0.00 0.00 0.00 0.00 19.45 18.57 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 3.57 0.37 -0.43 0.00 4.07 -1.74 -2.31 115.31 118.84 1yko h LEU 23 Ca -0.06 0.11 -0.05 0.00 0.08 0.00 0.00 57.88 57.96 1yko h LEU 23 Cb 1.02 0.07 -0.02 0.00 1.08 0.00 0.00 40.66 42.81 1yko h LEU 23 CO 0.31 0.12 0.06 -0.08 -1.08 0.00 0.00 178.44 177.78 1yko h GLU 24 N 0.49 0.71 0.00 1.13 4.81 -1.88 -2.18 114.58 117.68 1yko h GLU 24 Ca 0.46 -0.19 0.00 0.00 -0.13 0.00 0.00 59.36 59.49 1yko h GLU 24 Cb 0.71 -0.08 0.00 0.00 0.63 0.00 0.00 28.75 30.01 1yko h GLU 24 CO -0.41 0.75 0.00 0.00 -0.73 0.00 0.00 179.01 178.62 1yko h ALA 25 N 0.94 1.00 -0.02 2.92 0.00 -1.81 -2.17 119.26 120.12 1yko h ALA 25 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.04 1yko h ALA 25 Cb 0.38 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.17 1yko h ALA 25 CO 0.01 0.00 -0.06 0.00 0.00 0.00 0.00 179.25 179.20 1yko n ALA 26 N -1.89 2.66 -1.66 0.00 0.00 -0.90 -4.94 120.51 113.79 1yko n ALA 26 Ca 0.02 -0.50 -0.08 0.00 0.00 0.00 0.00 53.44 52.87 1yko n ALA 26 Cb 0.26 -1.07 -0.02 0.00 0.00 0.00 0.00 19.45 18.62 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 1.25 0.56 3.63 0.00 0.00 -0.82 -4.96 105.19 104.85 1yko n GLY 27 Ca 0.17 -0.62 -0.26 0.00 0.00 0.00 0.00 46.02 45.30 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 -2.79 4.58 0.32 1.61 0.01 -0.85 -5.06 114.94 112.77 1yko s ASN 28 Ca 0.00 -0.47 -0.29 0.00 -0.71 0.00 0.00 52.86 51.39 1yko s ASN 28 Cb 0.00 -0.91 -0.10 0.00 0.41 0.00 0.00 41.25 40.65 1yko s ASN 28 CO 0.00 0.09 1.31 -2.16 -1.51 0.00 0.00 177.10 174.83 1yko s PRO 29 N -2.95 4.36 0.59 -0.60 0.04 -1.26 -4.08 135.00 131.10 1yko s PRO 29 Ca 0.27 2.20 -0.06 0.00 0.04 0.00 0.00 61.00 63.45 1yko s PRO 29 Cb -0.09 -3.08 0.01 0.00 0.04 0.00 0.00 34.50 31.37 1yko s PRO 29 CO 0.17 -0.19 0.90 0.95 0.04 0.00 0.00 177.00 178.87 1yko s THR 30 N -1.01 3.71 0.70 1.26 -4.23 -1.26 -4.90 115.64 109.91 1yko s THR 30 Ca 0.50 0.02 -0.01 0.00 -1.18 0.00 0.00 61.69 61.02 1yko s THR 30 Cb -0.39 -3.47 0.11 0.00 1.34 0.00 0.00 72.50 70.09 1yko s THR 30 CO 0.51 -0.49 0.97 -0.13 -0.54 0.00 0.00 174.62 174.94 1yko s ARG 31 N -4.98 1.79 0.12 3.99 0.52 -1.26 -5.02 118.95 114.10 1yko s ARG 31 Ca 0.54 -1.05 -0.25 0.00 -0.52 0.00 0.00 55.73 54.45 1yko s ARG 31 Cb -0.11 -2.34 -0.06 0.00 0.52 0.00 0.00 34.95 32.96 1yko s ARG 31 CO 0.45 -1.36 1.65 -0.44 0.02 0.00 0.00 175.30 175.62 1yko h ASP 32 N -0.46 -0.65 -3.30 0.23 3.32 -2.08 -3.41 116.42 110.07 1yko h ASP 32 Ca -0.37 0.09 -0.66 0.00 0.02 0.00 0.00 57.03 56.11 1yko h ASP 32 Cb 1.27 0.27 -0.30 0.00 0.22 0.00 0.00 39.33 40.79 1yko h ASP 32 CO 0.42 -0.29 -0.76 -1.10 -1.72 0.00 0.00 179.24 175.79 1yko s GLN 33 N -6.09 3.23 0.11 3.56 -0.21 -1.26 -5.12 119.66 113.89 1yko s GLN 33 Ca -0.15 -0.71 0.10 0.00 0.02 0.00 0.00 55.36 54.62 1yko s GLN 33 Cb 0.09 -2.88 -0.04 0.00 1.00 0.00 0.00 33.01 31.18 1yko s GLN 33 CO 0.66 -0.21 -0.24 -1.21 -2.12 0.00 0.00 175.29 172.17 1yko s GLU 34 N 1.41 1.29 -0.44 2.91 0.41 -1.26 -5.11 118.70 117.91 1yko s GLU 34 Ca 0.05 -1.25 -0.17 0.00 -0.41 0.00 0.00 54.97 53.19 1yko s GLU 34 Cb -0.14 -1.67 0.03 0.00 -1.78 0.00 0.00 34.13 30.57 1yko s GLU 34 CO -0.06 0.39 0.44 0.42 -0.49 0.00 0.00 175.26 175.96 1yko s ILE 35 N -1.09 5.10 0.00 -1.63 1.01 -1.26 -5.03 121.20 118.30 1yko s ILE 35 Ca 0.10 -0.49 0.00 0.00 0.00 0.00 0.00 60.65 60.27 1yko s ILE 35 Cb -0.10 -4.07 0.00 0.00 0.01 0.00 0.00 42.46 38.30 1yko s ILE 35 CO 0.05 -0.47 0.00 1.87 0.00 0.00 0.00 174.94 176.39 1yko n TRP 36 N 5.57 0.00 1.88 3.97 -0.00 -1.26 -4.54 117.44 123.05 1yko n TRP 36 Ca -0.08 0.00 0.15 0.00 -0.00 0.00 0.00 57.50 57.57 1yko n TRP 36 Cb 0.47 0.00 0.90 0.00 -0.00 0.00 0.00 31.31 32.68 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 -4.30 5.87 6.94 -0.84 -2.30 115.26 120.63 1yko n ASN 37 Ca 0.00 -0.87 -0.45 0.00 -0.02 0.00 0.00 54.58 53.23 1yko n ASN 37 Cb 0.00 -0.03 -0.03 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 -2.07 3.44 0.14 -3.83 0.52 -1.26 -1.31 118.95 114.58 1yko s ARG 38 Ca 0.44 -2.45 -0.01 0.00 -0.52 0.00 0.00 55.73 53.19 1yko s ARG 38 Cb 0.21 -4.33 -0.06 0.00 0.52 0.00 0.00 34.95 31.29 1yko s ARG 38 CO 0.37 -1.28 1.33 -0.07 0.02 0.00 0.00 175.30 175.68 1yko h LEU 39 N 7.71 0.40 -8.62 2.53 4.07 -1.54 -3.45 115.31 116.40 1yko h LEU 39 Ca 0.08 -0.32 -0.68 0.00 0.08 0.00 0.00 57.88 57.03 1yko h LEU 39 Cb 1.03 -0.12 -0.28 0.00 1.08 0.00 0.00 40.66 42.37 1yko h LEU 39 CO 0.76 1.13 -0.82 0.00 -1.08 0.00 0.00 178.44 178.42 1yko s ALA 40 N -3.21 2.43 0.19 1.53 0.00 -1.23 -1.21 121.76 120.26 1yko s ALA 40 Ca -0.04 -0.98 -0.15 0.00 0.00 0.00 0.00 51.96 50.79 1yko s ALA 40 Cb 0.09 -0.92 -0.07 0.00 0.00 0.00 0.00 23.12 22.22 1yko s ALA 40 CO 0.85 0.39 0.60 0.15 0.00 0.00 0.00 175.76 177.76 1yko s LYS 41 N -0.12 4.01 0.31 0.00 1.02 -0.32 -4.83 119.74 119.81 1yko s LYS 41 Ca -0.03 0.55 0.21 0.00 0.02 0.00 0.00 55.97 56.72 1yko s LYS 41 Cb -0.14 -2.82 1.08 0.00 -0.52 0.00 0.00 37.83 35.43 1yko s LYS 41 CO 0.04 0.40 1.18 -2.30 -0.92 0.00 0.00 175.35 173.75 1yko n PRO 42 N 0.52 -0.03 -0.56 -1.68 -0.02 -1.26 -0.46 135.00 131.50 1yko n PRO 42 Ca -0.03 0.98 0.05 0.00 -2.02 0.00 0.00 63.50 62.49 1yko n PRO 42 Cb 0.52 -1.86 0.27 0.00 -0.02 0.00 0.00 33.50 32.41 1yko n PRO 42 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 1yko n ASP 43 N -4.40 4.03 -4.80 2.55 5.75 -1.26 -4.96 116.55 113.47 1yko n ASP 43 Ca 0.30 -2.54 -0.36 0.00 -0.01 0.00 0.00 54.79 52.17 1yko n ASP 43 Cb 1.10 -0.58 -0.06 0.00 -1.03 0.00 0.00 41.12 40.54 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 -2.07 3.33 0.32 2.12 0.00 0.39 -5.04 121.76 120.80 1yko s ALA 44 Ca 0.37 0.31 -0.29 0.00 0.00 0.00 0.00 51.96 52.35 1yko s ALA 44 Cb 0.27 -2.96 -0.10 0.00 0.00 0.00 0.00 23.12 20.33 1yko s ALA 44 CO 0.13 0.27 1.23 -1.25 0.00 0.00 0.00 175.76 176.13 1yko s PRO 45 N -2.00 4.45 0.00 0.00 0.04 -1.26 -4.92 135.00 131.30 1yko s PRO 45 Ca 0.46 2.06 0.00 0.00 0.04 0.00 0.00 61.00 63.56 1yko s PRO 45 Cb -0.17 -3.10 0.00 0.00 0.04 0.00 0.00 34.50 31.27 1yko s PRO 45 CO 0.22 -0.05 0.00 0.41 0.04 0.00 0.00 177.00 177.62 1yko n GLY 46 N 0.93 1.21 3.56 0.56 0.00 -1.26 -4.47 105.19 105.72 1yko n GLY 46 Ca -0.00 -2.27 -0.43 0.00 0.00 0.00 0.00 46.02 43.32 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 -1.23 3.48 -0.21 1.61 2.12 -1.26 -4.94 118.70 118.27 1yko s GLU 47 Ca 0.00 0.13 -0.29 0.00 0.36 0.00 0.00 54.97 55.17 1yko s GLU 47 Cb 0.00 -4.01 -0.03 0.00 0.26 0.00 0.00 34.13 30.36 1yko s GLU 47 CO 0.00 -1.55 1.62 -1.01 -0.54 0.00 0.00 175.26 173.78 1yko s HIS 48 N 4.51 2.09 0.31 5.30 3.76 -1.26 -1.58 115.29 128.41 1yko s HIS 48 Ca 0.39 0.53 0.11 0.00 -0.15 0.00 0.00 55.06 55.94 1yko s HIS 48 Cb -0.09 -3.98 -0.05 0.00 1.11 0.00 0.00 32.58 29.57 1yko s HIS 48 CO 0.24 -3.00 -0.12 0.96 -0.85 0.00 0.00 174.74 171.97 1yko s ILE 49 N 5.17 2.51 -0.14 0.60 -4.36 0.23 -4.49 121.20 120.73 1yko s ILE 49 Ca 0.72 -2.25 0.02 0.00 -0.26 0.00 0.00 60.65 58.88 1yko s ILE 49 Cb -0.25 -2.52 0.01 0.00 1.25 0.00 0.00 42.46 40.95 1yko s ILE 49 CO 0.29 -0.31 -0.19 -0.22 0.24 0.00 0.00 174.94 174.75 1yko s LEU 50 N -3.58 1.98 -0.11 0.37 2.96 -0.43 -2.05 118.68 117.82 1yko s LEU 50 Ca 0.32 -0.55 -0.01 0.00 -0.22 0.00 0.00 54.13 53.66 1yko s LEU 50 Cb -0.02 -1.34 -0.03 0.00 0.50 0.00 0.00 46.19 45.30 1yko s LEU 50 CO 0.16 0.04 -0.05 -0.76 -1.32 0.00 0.00 176.35 174.43 1yko s LEU 51 N 0.96 3.25 -0.03 -0.68 1.43 0.84 -1.71 118.68 122.75 1yko s LEU 51 Ca -0.05 -0.05 -0.13 0.00 -1.03 0.00 0.00 54.13 52.88 1yko s LEU 51 Cb -0.15 -1.74 0.02 0.00 0.03 0.00 0.00 46.19 44.35 1yko s LEU 51 CO -0.04 0.28 0.29 -1.48 0.23 0.00 0.00 176.35 175.63 1yko s LEU 52 N -0.32 0.94 0.07 1.79 -0.00 -0.99 -0.03 118.68 120.14 1yko s LEU 52 Ca 0.05 0.14 -0.27 0.00 -0.00 0.00 0.00 54.13 54.05 1yko s LEU 52 Cb -0.12 1.16 0.09 0.00 -0.00 0.00 0.00 46.19 47.32 1yko s LEU 52 CO 0.02 -0.38 1.14 -0.83 -0.00 0.00 0.00 176.35 176.30 1yko s GLY 53 N -1.09 -0.24 0.27 -3.48 0.00 -1.04 -1.83 107.32 99.91 1yko s GLY 53 Ca -0.12 0.27 0.10 0.00 0.00 0.00 0.00 44.72 44.98 1yko s GLY 53 CO 0.03 0.97 -0.16 1.20 0.00 0.00 0.00 173.10 175.14 1yko s GLN 54 N -2.64 1.60 -0.15 2.90 -0.21 -1.25 -1.72 119.66 118.18 1yko s GLN 54 Ca 0.16 -1.74 0.01 0.00 0.02 0.00 0.00 55.36 53.81 1yko s GLN 54 Cb 0.01 -1.55 0.02 0.00 1.00 0.00 0.00 33.01 32.48 1yko s GLN 54 CO 0.00 0.25 -0.18 0.08 -2.12 0.00 0.00 175.29 173.32 1yko s VAL 55 N -2.67 1.82 -0.00 1.09 1.01 -1.26 -1.24 120.40 119.15 1yko s VAL 55 Ca 0.28 -0.81 0.03 0.00 0.00 0.00 0.00 61.98 61.48 1yko s VAL 55 Cb -0.02 -1.66 -0.03 0.00 0.00 0.00 0.00 36.38 34.66 1yko s VAL 55 CO 0.13 0.50 -0.05 -0.31 0.00 0.00 0.00 175.10 175.37 1yko s TYR 56 N 1.23 2.92 0.00 5.22 1.51 0.13 -0.66 117.35 127.70 1yko s TYR 56 Ca 0.01 -0.01 0.00 0.00 -1.01 0.00 0.00 57.07 56.06 1yko s TYR 56 Cb -0.14 -1.62 0.00 0.00 -0.11 0.00 0.00 41.96 40.09 1yko s TYR 56 CO -0.09 0.39 0.00 -0.40 -1.11 0.00 0.00 175.55 174.34 1yko n ASP 57 N 1.56 0.00 0.02 2.29 5.68 -0.34 -1.76 116.55 123.99 1yko n ASP 57 Ca -0.15 -0.26 0.11 0.00 -0.50 0.00 0.00 54.79 53.99 1yko n ASP 57 Cb 0.53 0.00 0.48 0.00 -1.14 0.00 0.00 41.12 40.99 1yko n ASP 57 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1yko n GLY 58 N 5.00 -1.33 0.75 6.12 0.00 -1.26 -2.91 105.19 111.55 1yko n GLY 58 Ca 0.00 -0.06 0.08 0.00 0.00 0.00 0.00 46.02 46.04 1yko n GLY 58 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1yko n ASN 59 N -1.63 2.68 0.00 1.61 3.02 -1.26 -4.73 115.26 114.95 1yko n ASN 59 Ca 0.05 -1.78 0.00 0.00 -0.03 0.00 0.00 54.58 52.82 1yko n ASN 59 Cb 0.28 -0.10 0.00 0.00 -0.61 0.00 0.00 39.78 39.35 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 0.96 0.56 3.88 7.41 0.00 -1.15 -5.05 105.19 111.80 1yko n GLY 60 Ca 0.12 -0.13 -0.33 0.00 0.00 0.00 0.00 46.02 45.68 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 -2.00 3.51 0.18 1.61 3.76 -1.26 -4.81 115.29 116.27 1yko s HIS 61 Ca 0.00 0.78 -0.30 0.00 -0.15 0.00 0.00 55.06 55.39 1yko s HIS 61 Cb 0.00 -2.17 -0.09 0.00 1.11 0.00 0.00 32.58 31.43 1yko s HIS 61 CO 0.00 0.41 1.35 -0.51 -0.85 0.00 0.00 174.74 175.14 1yko s LEU 62 N -2.40 4.40 -0.76 0.89 1.43 -1.26 -1.20 118.68 119.78 1yko s LEU 62 Ca 0.40 2.41 -0.19 0.00 -1.03 0.00 0.00 54.13 55.72 1yko s LEU 62 Cb -0.13 -3.60 0.12 0.00 0.03 0.00 0.00 46.19 42.61 1yko s LEU 62 CO 0.21 -0.58 0.91 -0.69 0.23 0.00 0.00 176.35 176.43 1yko s VAL 63 N 0.40 4.79 -1.91 -1.59 1.01 0.16 -4.89 120.40 118.37 1yko s VAL 63 Ca 0.59 -1.27 0.05 0.00 0.00 0.00 0.00 61.98 61.35 1yko s VAL 63 Cb -0.37 -4.63 0.15 0.00 0.00 0.00 0.00 36.38 31.53 1yko s VAL 63 CO 0.36 -1.32 1.10 0.54 0.00 0.00 0.00 175.10 175.79 1yko n ARG 64 N 6.38 1.44 -0.33 2.72 1.74 -1.26 -3.94 116.66 123.41 1yko n ARG 64 Ca 0.07 -0.63 0.04 0.00 -0.77 0.00 0.00 57.85 56.56 1yko n ARG 64 Cb 0.46 -1.18 0.06 0.00 -1.02 0.00 0.00 32.46 30.79 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 0.01 1.06 -4.80 0.55 5.68 -1.24 -3.49 116.55 114.32 1yko n ASP 65 Ca 0.06 -2.50 -0.33 0.00 -0.50 0.00 0.00 54.79 51.52 1yko n ASP 65 Cb 0.17 -0.31 0.00 0.00 -1.14 0.00 0.00 41.12 39.85 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 -1.86 5.87 -0.06 -1.12 1.04 -1.24 -4.62 113.70 111.70 1yko s SER 66 Ca 0.15 1.88 0.01 0.00 0.48 0.00 0.00 55.95 58.47 1yko s SER 66 Cb 0.13 -2.54 0.02 0.00 0.10 0.00 0.00 66.02 63.73 1yko s SER 66 CO 0.01 -1.11 -0.07 0.12 0.98 0.00 0.00 173.24 173.18 1yko s PHE 67 N -2.29 1.00 0.05 5.02 5.36 0.50 -2.22 117.98 125.40 1yko s PHE 67 Ca 0.65 -0.34 0.09 0.00 -0.96 0.00 0.00 56.93 56.37 1yko s PHE 67 Cb -0.17 -0.83 -0.03 0.00 -0.34 0.00 0.00 43.02 41.65 1yko s PHE 67 CO 0.33 -0.25 -0.25 -0.51 -1.46 0.00 0.00 175.22 173.07 1yko s LEU 68 N 0.98 2.18 -0.04 6.12 1.02 0.04 -0.71 118.68 128.28 1yko s LEU 68 Ca -0.10 -0.59 0.05 0.00 0.02 0.00 0.00 54.13 53.52 1yko s LEU 68 Cb -0.14 -1.21 -0.01 0.00 0.02 0.00 0.00 46.19 44.85 1yko s LEU 68 CO 0.00 0.23 -0.20 -1.61 0.02 0.00 0.00 176.35 174.79 1yko s GLU 69 N -1.29 1.91 0.12 1.70 2.02 -0.58 -1.71 118.70 120.87 1yko s GLU 69 Ca 0.11 -0.70 0.10 0.00 0.02 0.00 0.00 54.97 54.50 1yko s GLU 69 Cb -0.10 -1.69 -0.04 0.00 0.10 0.00 0.00 34.13 32.41 1yko s GLU 69 CO 0.02 0.32 -0.25 0.14 0.02 0.00 0.00 175.26 175.51 1yko s VAL 70 N -0.13 2.08 -0.09 2.63 -7.23 -0.14 -1.04 120.40 116.49 1yko s VAL 70 Ca -0.01 -1.68 -0.03 0.00 -1.81 0.00 0.00 61.98 58.45 1yko s VAL 70 Cb -0.11 -1.85 0.05 0.00 0.56 0.00 0.00 36.38 35.02 1yko s VAL 70 CO 0.02 0.05 0.12 0.86 -0.31 0.00 0.00 175.10 175.84 1yko s TRP 71 N -1.09 -0.06 0.08 2.82 -0.11 -0.17 -2.67 118.94 117.74 1yko s TRP 71 Ca 0.12 0.37 -0.06 0.00 1.22 0.00 0.00 56.10 57.74 1yko s TRP 71 Cb -0.10 -0.39 -0.01 0.00 -1.50 0.00 0.00 33.47 31.47 1yko s TRP 71 CO 0.05 -0.29 0.13 1.14 -4.62 0.00 0.00 176.95 173.36 1yko s GLN 72 N 2.24 0.79 0.58 5.86 -2.07 -0.50 -0.79 119.66 125.77 1yko s GLN 72 Ca 0.04 -1.06 -0.05 0.00 -1.82 0.00 0.00 55.36 52.47 1yko s GLN 72 Cb -0.13 0.30 0.02 0.00 -1.09 0.00 0.00 33.01 32.11 1yko s GLN 72 CO -0.06 -0.23 0.87 0.00 -1.32 0.00 0.00 175.29 174.56 1yko s ALA 73 N -3.89 3.39 0.89 2.60 0.00 -1.26 -4.51 121.76 118.97 1yko s ALA 73 Ca 0.07 -0.82 -0.02 0.00 0.00 0.00 0.00 51.96 51.18 1yko s ALA 73 Cb 0.06 -2.50 0.04 0.00 0.00 0.00 0.00 23.12 20.72 1yko s ALA 73 CO -0.10 -0.80 0.23 -0.40 0.00 0.00 0.00 175.76 174.70 1yko n ASP 74 N -2.54 0.07 -0.01 0.00 5.68 0.23 -4.28 116.55 115.70 1yko n ASP 74 Ca 0.05 -1.11 0.10 0.00 -0.50 0.00 0.00 54.79 53.33 1yko n ASP 74 Cb 0.58 -0.17 0.52 0.00 -1.14 0.00 0.00 41.12 40.91 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 -1.66 1.99 -0.01 2.12 0.00 -1.78 0.34 119.26 120.26 1yko h ALA 75 Ca -0.08 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.82 1yko h ALA 75 Cb 0.22 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.93 1yko h ALA 75 CO 0.06 -0.08 -0.13 0.09 0.00 0.00 0.00 179.25 179.19 1yko n ASN 76 N -4.47 0.73 -0.51 0.00 3.02 -1.26 -3.81 115.26 108.96 1yko n ASN 76 Ca 0.06 -0.80 0.00 0.00 -0.03 0.00 0.00 54.58 53.82 1yko n ASN 76 Cb 0.28 -0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.45 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 1.27 0.92 3.18 7.41 0.00 -0.50 -4.76 105.19 112.71 1yko n GLY 77 Ca 0.15 -0.62 -0.25 0.00 0.00 0.00 0.00 46.02 45.30 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 -4.59 1.41 -0.37 1.61 2.02 -1.26 -4.71 118.70 112.80 1yko s GLU 78 Ca 0.00 -0.70 -0.20 0.00 0.02 0.00 0.00 54.97 54.09 1yko s GLU 78 Cb 0.00 -1.39 0.01 0.00 0.10 0.00 0.00 34.13 32.85 1yko s GLU 78 CO 0.00 0.38 0.64 0.71 0.02 0.00 0.00 175.26 177.00 1yko s TYR 79 N -0.51 3.13 -1.01 1.61 1.51 -1.26 -0.60 117.35 120.22 1yko s TYR 79 Ca 0.07 0.27 -0.18 0.00 -1.01 0.00 0.00 57.07 56.22 1yko s TYR 79 Cb -0.07 -3.19 0.13 0.00 -0.11 0.00 0.00 41.96 38.72 1yko s TYR 79 CO -0.00 -0.68 1.24 -0.65 -1.11 0.00 0.00 175.55 174.36 1yko s GLN 80 N 2.74 3.71 0.30 -0.62 -1.52 -1.26 -4.87 119.66 118.13 1yko s GLN 80 Ca 0.24 -1.86 0.10 0.00 -1.95 0.00 0.00 55.36 51.90 1yko s GLN 80 Cb -0.14 -5.02 0.45 0.00 -0.22 0.00 0.00 33.01 28.08 1yko s GLN 80 CO 0.16 -1.84 1.67 0.38 -0.25 0.00 0.00 175.29 175.41 1yko h ASP 81 N 8.57 0.03 -1.65 5.90 2.03 -1.97 -3.24 116.42 126.09 1yko h ASP 81 Ca 0.20 -0.01 -0.51 0.00 -0.73 0.00 0.00 57.03 55.98 1yko h ASP 81 Cb 0.99 -0.01 -0.07 0.00 -0.83 0.00 0.00 39.33 39.41 1yko h ASP 81 CO 1.18 0.57 1.19 0.00 -1.03 0.00 0.00 179.24 181.15 1yko s ALA 82 N -3.80 2.44 0.09 4.15 0.00 -1.26 -4.97 121.76 118.42 1yko s ALA 82 Ca -0.02 -1.50 -0.31 0.00 0.00 0.00 0.00 51.96 50.14 1yko s ALA 82 Cb 0.13 -4.40 -0.06 0.00 0.00 0.00 0.00 23.12 18.79 1yko s ALA 82 CO 0.76 -3.76 1.21 -0.47 0.00 0.00 0.00 175.76 173.50 1yko s TYR 83 N 6.93 3.42 -0.27 0.00 5.04 -1.26 -5.01 117.35 126.21 1yko s TYR 83 Ca 0.51 1.30 -0.23 0.00 -2.44 0.00 0.00 57.07 56.20 1yko s TYR 83 Cb -0.06 -3.44 0.07 0.00 0.35 0.00 0.00 41.96 38.88 1yko s TYR 83 CO 0.06 -1.34 0.71 1.21 -1.34 0.00 0.00 175.55 174.85 1yko s ASN 84 N 0.84 -0.78 0.11 4.32 3.84 -1.26 -5.05 114.94 116.96 1yko s ASN 84 Ca 0.58 1.46 0.24 0.00 0.21 0.00 0.00 52.86 55.35 1yko s ASN 84 Cb -0.31 1.45 0.94 0.00 -0.55 0.00 0.00 41.25 42.79 1yko s ASN 84 CO 0.31 -0.25 1.75 0.18 -2.79 0.00 0.00 177.10 176.31 1yko n LEU 85 N 2.98 0.37 -0.00 3.21 4.77 -1.26 -3.11 117.00 123.95 1yko n LEU 85 Ca -0.15 0.55 0.13 0.00 -0.03 0.00 0.00 56.01 56.51 1yko n LEU 85 Cb 0.56 -0.46 0.36 0.00 -2.33 0.00 0.00 43.42 41.54 1yko n LEU 85 CO 0.02 -0.21 0.60 -0.62 -1.33 0.00 0.00 177.39 175.86 1yko n GLU 86 N -1.87 0.01 -1.95 3.23 1.02 -1.26 -4.92 120.64 114.91 1yko n GLU 86 Ca 0.05 -0.01 -0.33 0.00 -0.02 0.00 0.00 57.16 56.85 1yko n GLU 86 Cb 0.31 -1.50 0.03 0.00 -0.02 0.00 0.00 31.44 30.26 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 -2.99 5.40 0.14 1.62 0.01 -1.18 -4.96 114.94 112.98 1yko s ASN 87 Ca 0.12 2.01 -0.08 0.00 -0.71 0.00 0.00 52.86 54.21 1yko s ASN 87 Cb 0.18 -2.56 -0.04 0.00 0.41 0.00 0.00 41.25 39.24 1yko s ASN 87 CO 0.65 -1.43 1.39 0.00 -1.51 0.00 0.00 177.10 176.20 1yko h ALA 88 N 0.43 0.47 -3.67 0.60 0.00 -1.91 -3.45 119.26 111.74 1yko h ALA 88 Ca -0.48 -0.58 -0.28 0.00 0.00 0.00 0.00 54.91 53.58 1yko h ALA 88 Cb 1.25 -0.05 -0.30 0.00 0.00 0.00 0.00 17.79 18.69 1yko h ALA 88 CO 0.55 0.71 -0.73 0.12 0.00 0.00 0.00 179.25 179.90 1yko s PHE 89 N -3.79 0.12 -0.07 0.00 5.36 -1.26 -1.18 117.98 117.16 1yko s PHE 89 Ca -0.08 0.02 0.04 0.00 -0.96 0.00 0.00 56.93 55.94 1yko s PHE 89 Cb 0.10 -0.15 0.00 0.00 -0.34 0.00 0.00 43.02 42.63 1yko s PHE 89 CO 0.87 -0.04 -0.19 -0.80 -1.46 0.00 0.00 175.22 173.60 1yko s ASN 90 N 0.37 2.49 0.28 6.13 0.01 -0.35 -4.94 114.94 118.91 1yko s ASN 90 Ca -0.03 -0.43 0.25 0.00 -0.71 0.00 0.00 52.86 51.94 1yko s ASN 90 Cb -0.05 -0.98 0.90 0.00 0.41 0.00 0.00 41.25 41.53 1yko s ASN 90 CO -0.01 0.13 1.76 0.28 -1.51 0.00 0.00 177.10 177.75 1yko h SER 91 N 6.60 0.00 -3.29 -1.22 0.02 -1.79 -3.44 113.55 110.43 1yko h SER 91 Ca -0.27 0.00 -0.64 0.00 -0.84 0.00 0.00 61.79 60.04 1yko h SER 91 Cb 1.20 0.00 -0.13 0.00 0.14 0.00 0.00 62.40 63.62 1yko h SER 91 CO 0.47 0.00 -0.68 0.12 -1.14 0.00 0.00 176.83 175.60 1yko s PHE 92 N -3.25 2.90 -0.07 3.45 5.36 -1.26 -1.42 117.98 123.69 1yko s PHE 92 Ca 0.07 -0.08 -0.31 0.00 -0.96 0.00 0.00 56.93 55.64 1yko s PHE 92 Cb 0.10 -1.48 0.12 0.00 -0.34 0.00 0.00 43.02 41.42 1yko s PHE 92 CO 0.51 0.48 1.02 0.20 -1.46 0.00 0.00 175.22 175.97 1yko s GLY 93 N -2.43 -0.39 0.09 13.12 0.00 -1.09 -4.82 107.32 111.80 1yko s GLY 93 Ca 0.25 1.22 0.07 0.00 0.00 0.00 0.00 44.72 46.26 1yko s GLY 93 CO 0.17 0.40 -0.17 0.50 0.00 0.00 0.00 173.10 174.00 1yko s ARG 94 N -2.84 0.98 0.19 2.90 0.52 -0.97 -0.96 118.95 118.77 1yko s ARG 94 Ca 0.07 -1.09 -0.12 0.00 -0.52 0.00 0.00 55.73 54.07 1yko s ARG 94 Cb -0.01 -1.09 0.00 0.00 0.52 0.00 0.00 34.95 34.38 1yko s ARG 94 CO -0.07 0.24 0.39 -0.08 0.02 0.00 0.00 175.30 175.81 1yko s THR 95 N -1.35 0.04 0.17 0.02 -1.32 -0.69 -1.99 115.64 110.52 1yko s THR 95 Ca 0.03 -1.20 -0.17 0.00 -1.21 0.00 0.00 61.69 59.14 1yko s THR 95 Cb -0.09 -1.83 0.03 0.00 -1.51 0.00 0.00 72.50 69.10 1yko s THR 95 CO 0.03 -0.19 0.48 0.00 -2.21 0.00 0.00 174.62 172.74 1yko s ALA 96 N -3.95 -0.95 -0.15 11.08 0.00 -1.26 -0.78 121.76 125.76 1yko s ALA 96 Ca 0.16 -0.14 -0.03 0.00 0.00 0.00 0.00 51.96 51.95 1yko s ALA 96 Cb 0.01 0.81 -0.03 0.00 0.00 0.00 0.00 23.12 23.92 1yko s ALA 96 CO 0.01 -0.75 -0.05 0.95 0.00 0.00 0.00 175.76 175.92 1yko s THR 97 N -3.85 3.76 0.49 0.00 -4.23 -0.94 -4.23 115.64 106.64 1yko s THR 97 Ca 0.07 -0.41 0.02 0.00 -1.18 0.00 0.00 61.69 60.19 1yko s THR 97 Cb 0.00 -2.63 0.02 0.00 1.34 0.00 0.00 72.50 71.23 1yko s THR 97 CO -0.06 0.50 0.20 0.35 -0.54 0.00 0.00 174.62 175.07 1yko n THR 98 N 3.46 0.00 0.17 3.99 -2.24 0.12 -3.67 114.28 116.11 1yko n THR 98 Ca -0.18 -2.12 0.04 0.00 -2.27 0.00 0.00 64.05 59.52 1yko n THR 98 Cb 0.53 0.18 0.22 0.00 -2.10 0.00 0.00 70.33 69.15 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 0.93 0.00 0.17 4.78 0.04 -1.95 -2.77 116.94 118.14 1yko h PHE 99 Ca -0.36 0.00 -0.26 0.00 2.80 0.00 0.00 57.97 60.15 1yko h PHE 99 Cb 1.18 0.00 0.02 0.00 2.20 0.00 0.00 35.95 39.35 1yko h PHE 99 CO 0.00 0.45 -1.23 -0.44 -0.60 0.00 0.00 178.31 176.50 1yko h ASP 100 N 0.00 0.55 -4.26 2.17 3.32 -1.96 -3.41 116.42 112.83 1yko h ASP 100 Ca -0.00 -0.92 -0.64 0.00 0.02 0.00 0.00 57.03 55.49 1yko h ASP 100 Cb 1.10 -0.18 -0.41 0.00 0.22 0.00 0.00 39.33 40.06 1yko h ASP 100 CO 0.06 1.57 -0.64 0.00 -1.72 0.00 0.00 179.24 178.51 1yko s ALA 101 N -2.50 3.16 -0.81 3.45 0.00 -1.22 -4.96 121.76 118.90 1yko s ALA 101 Ca -0.15 -3.20 0.00 0.00 0.00 0.00 0.00 51.96 48.62 1yko s ALA 101 Cb 0.03 -2.13 0.00 0.00 0.00 0.00 0.00 23.12 21.02 1yko s ALA 101 CO 0.84 -2.03 0.53 0.41 0.00 0.00 0.00 175.76 175.52 1yko n GLY 102 N 3.15 1.42 2.83 0.00 0.00 -1.05 0.16 105.19 111.70 1yko n GLY 102 Ca 0.06 0.00 -0.16 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 -0.78 0.19 0.21 1.61 2.12 -1.26 -4.62 118.70 116.17 1yko s GLU 103 Ca 0.00 0.07 -0.08 0.00 0.36 0.00 0.00 54.97 55.32 1yko s GLU 103 Cb 0.00 -0.35 -0.06 0.00 0.26 0.00 0.00 34.13 33.97 1yko s GLU 103 CO 0.00 -0.10 0.50 1.67 -0.54 0.00 0.00 175.26 176.79 1yko s TRP 104 N 0.78 3.44 0.04 5.30 1.48 -0.70 -4.74 118.94 124.55 1yko s TRP 104 Ca -0.07 0.76 0.04 0.00 -1.06 0.00 0.00 56.10 55.76 1yko s TRP 104 Cb -0.11 -2.17 -0.02 0.00 -1.16 0.00 0.00 33.47 30.01 1yko s TRP 104 CO -0.02 0.30 -0.13 0.95 -4.06 0.00 0.00 176.95 174.00 1yko s THR 105 N -1.81 0.98 -0.07 0.66 -4.23 -1.26 -2.49 115.64 107.42 1yko s THR 105 Ca 0.45 -0.98 -0.03 0.00 -1.18 0.00 0.00 61.69 59.95 1yko s THR 105 Cb -0.11 -0.91 0.04 0.00 1.34 0.00 0.00 72.50 72.86 1yko s THR 105 CO 0.23 -0.06 0.14 -0.22 -0.54 0.00 0.00 174.62 174.17 1yko s LEU 106 N -1.19 0.61 -0.29 4.79 2.96 0.95 -4.85 118.68 121.68 1yko s LEU 106 Ca -0.00 0.29 -0.07 0.00 -0.22 0.00 0.00 54.13 54.12 1yko s LEU 106 Cb -0.08 0.32 -0.00 0.00 0.50 0.00 0.00 46.19 46.93 1yko s LEU 106 CO 0.01 -0.16 0.09 -1.00 -1.32 0.00 0.00 176.35 173.97 1yko s HIS 107 N 1.34 3.14 0.07 5.38 3.76 -0.43 -0.11 115.29 128.44 1yko s HIS 107 Ca -0.07 -0.79 -0.01 0.00 -0.15 0.00 0.00 55.06 54.03 1yko s HIS 107 Cb -0.12 -2.27 0.00 0.00 1.11 0.00 0.00 32.58 31.31 1yko s HIS 107 CO -0.06 -0.51 0.11 -2.37 -0.85 0.00 0.00 174.74 171.06 1yko n THR 108 N 4.90 0.00 -4.26 1.30 5.66 -0.87 -1.51 114.28 119.50 1yko n THR 108 Ca -0.15 -0.29 -0.23 0.00 -3.05 0.00 0.00 64.05 60.33 1yko n THR 108 Cb 0.49 0.20 -0.07 0.00 -1.55 0.00 0.00 70.33 69.40 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 -2.60 3.60 -0.05 1.08 -7.23 -1.26 -0.60 120.40 113.33 1yko s VAL 109 Ca 0.05 -1.80 -0.30 0.00 -1.81 0.00 0.00 61.98 58.11 1yko s VAL 109 Cb -0.00 -2.92 -0.04 0.00 0.56 0.00 0.00 36.38 33.98 1yko s VAL 109 CO 0.03 -0.35 1.35 -0.75 -0.31 0.00 0.00 175.10 175.08 1yko s LYS 110 N -3.62 4.28 0.51 4.82 2.20 -0.61 -4.84 119.74 122.47 1yko s LYS 110 Ca 0.31 1.86 -0.22 0.00 -0.36 0.00 0.00 55.97 57.56 1yko s LYS 110 Cb -0.07 -3.65 -0.06 0.00 -1.51 0.00 0.00 37.83 32.54 1yko s LYS 110 CO 0.20 -0.60 1.24 -1.25 -0.36 0.00 0.00 175.35 174.58 1yko s PRO 111 N 2.73 3.43 0.81 4.03 0.04 -1.26 -4.17 135.00 140.61 1yko s PRO 111 Ca 0.61 1.93 -0.09 0.00 0.04 0.00 0.00 61.00 63.50 1yko s PRO 111 Cb -0.28 -2.28 0.13 0.00 0.04 0.00 0.00 34.50 32.11 1yko s PRO 111 CO 0.23 -0.86 1.14 0.20 0.04 0.00 0.00 177.00 177.75 1yko s GLY 112 N -1.26 1.73 0.18 0.56 0.00 0.11 -4.74 107.32 103.90 1yko s GLY 112 Ca 0.68 -1.21 -0.30 0.00 0.00 0.00 0.00 44.72 43.89 1yko s GLY 112 CO 0.39 -0.62 1.02 0.14 0.00 0.00 0.00 173.10 174.03 1yko s VAL 113 N -3.48 4.09 0.09 1.40 1.01 -1.26 -4.52 120.40 117.72 1yko s VAL 113 Ca 0.67 1.85 0.07 0.00 0.00 0.00 0.00 61.98 64.57 1yko s VAL 113 Cb -0.07 -4.18 -0.03 0.00 0.00 0.00 0.00 36.38 32.10 1yko s VAL 113 CO 0.48 0.34 -0.19 0.68 0.00 0.00 0.00 175.10 176.41 1yko s VAL 114 N -0.42 1.57 0.25 2.92 -7.23 -1.26 -4.46 120.40 111.77 1yko s VAL 114 Ca 0.47 -1.42 -0.05 0.00 -1.81 0.00 0.00 61.98 59.16 1yko s VAL 114 Cb -0.27 -1.43 -0.06 0.00 0.56 0.00 0.00 36.38 35.19 1yko s VAL 114 CO 0.33 -0.05 0.51 0.20 -0.31 0.00 0.00 175.10 175.78 1yko s ASN 115 N -1.74 6.48 0.85 4.85 -0.87 -1.26 -1.02 114.94 122.24 1yko s ASN 115 Ca 0.05 0.71 -0.05 0.00 -1.57 0.00 0.00 52.86 51.99 1yko s ASN 115 Cb -0.10 -2.14 0.09 0.00 -0.02 0.00 0.00 41.25 39.09 1yko s ASN 115 CO 0.03 -0.12 0.57 -0.46 -2.57 0.00 0.00 177.10 174.55 1yko n ASN 116 N -0.60 0.24 0.23 -1.22 0.23 -0.19 -4.88 115.26 109.07 1yko n ASN 116 Ca -0.02 -1.33 0.07 0.00 -0.53 0.00 0.00 54.58 52.77 1yko n ASN 116 Cb 0.53 -0.42 0.57 0.00 -2.08 0.00 0.00 39.78 38.39 1yko n ASN 116 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1yko h ALA 117 N -1.45 1.86 -0.00 -2.53 0.00 -2.00 -2.06 119.26 113.08 1yko h ALA 117 Ca -0.18 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.66 1yko h ALA 117 Cb 0.56 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.32 1yko h ALA 117 CO 0.15 0.11 -0.17 0.00 0.00 0.00 0.00 179.25 179.33 1yko n ALA 118 N -2.52 2.82 -0.16 0.00 0.00 -1.26 -4.93 120.51 114.45 1yko n ALA 118 Ca -0.02 -0.23 0.00 0.00 0.00 0.00 0.00 53.44 53.19 1yko n ALA 118 Cb 0.15 -1.33 0.00 0.00 0.00 0.00 0.00 19.45 18.27 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 1.42 0.58 3.69 0.00 0.00 -0.77 -5.07 105.19 105.04 1yko n GLY 119 Ca 0.09 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.70 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 -2.33 4.89 0.22 1.61 1.01 -1.26 -4.71 120.40 119.83 1yko s VAL 120 Ca 0.00 1.74 -0.30 0.00 0.00 0.00 0.00 61.98 63.42 1yko s VAL 120 Cb 0.00 -4.18 -0.09 0.00 0.00 0.00 0.00 36.38 32.10 1yko s VAL 120 CO 0.00 0.09 1.38 -2.16 0.00 0.00 0.00 175.10 174.41 1yko s PRO 121 N 1.65 4.33 0.26 2.72 0.04 -1.26 -1.02 135.00 141.72 1yko s PRO 121 Ca 0.42 2.18 0.00 0.00 0.04 0.00 0.00 61.00 63.64 1yko s PRO 121 Cb -0.18 -3.15 -0.04 0.00 0.04 0.00 0.00 34.50 31.17 1yko s PRO 121 CO 0.17 -0.34 0.45 -1.64 0.04 0.00 0.00 177.00 175.68 1yko s MET 122 N -0.23 3.51 0.64 4.56 -1.94 -0.18 -4.50 119.30 121.15 1yko s MET 122 Ca 0.58 -0.37 -0.14 0.00 -1.71 0.00 0.00 55.69 54.05 1yko s MET 122 Cb -0.39 -2.78 -0.01 0.00 2.01 0.00 0.00 34.83 33.66 1yko s MET 122 CO 0.41 0.32 1.06 0.00 -0.01 0.00 0.00 175.02 176.79 1yko s ALA 123 N -2.03 2.67 -0.10 3.03 0.00 -1.26 -4.12 121.76 119.94 1yko s ALA 123 Ca 0.39 0.30 -0.31 0.00 0.00 0.00 0.00 51.96 52.33 1yko s ALA 123 Cb -0.10 -3.22 -0.09 0.00 0.00 0.00 0.00 23.12 19.70 1yko s ALA 123 CO 0.31 -1.04 2.03 -2.30 0.00 0.00 0.00 175.76 174.76 1yko n PRO 124 N -2.50 2.26 -4.15 0.00 -0.02 -1.26 -4.86 135.00 124.47 1yko n PRO 124 Ca 0.08 0.77 -0.10 0.00 -2.02 0.00 0.00 63.50 62.24 1yko n PRO 124 Cb 0.53 -2.90 -0.10 0.00 -0.02 0.00 0.00 33.50 31.01 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 5.57 0.79 -0.15 6.00 -3.43 -1.26 -4.18 115.29 118.63 1yko s HIS 125 Ca 0.95 -0.96 0.00 0.00 -0.80 0.00 0.00 55.06 54.26 1yko s HIS 125 Cb -0.53 -0.48 0.02 0.00 -1.43 0.00 0.00 32.58 30.16 1yko s HIS 125 CO 0.44 -0.21 -0.14 0.42 -2.00 0.00 0.00 174.74 173.25 1yko s ILE 126 N -3.70 1.57 0.01 -5.38 1.01 -0.69 -4.60 121.20 109.42 1yko s ILE 126 Ca 0.11 -0.65 -0.30 0.00 0.00 0.00 0.00 60.65 59.80 1yko s ILE 126 Cb 0.06 -1.49 -0.04 0.00 0.01 0.00 0.00 42.46 41.00 1yko s ILE 126 CO -0.06 0.44 1.10 0.20 0.00 0.00 0.00 174.94 176.62 1yko s ASN 127 N 1.48 7.19 -0.01 3.58 0.01 0.03 -0.59 114.94 126.64 1yko s ASN 127 Ca 0.05 1.82 0.06 0.00 -0.71 0.00 0.00 52.86 54.08 1yko s ASN 127 Cb -0.13 -2.57 -0.02 0.00 0.41 0.00 0.00 41.25 38.94 1yko s ASN 127 CO -0.11 -0.41 -0.21 -0.63 -1.51 0.00 0.00 177.10 174.24 1yko s ILE 128 N 1.29 1.63 -0.13 0.60 1.01 0.40 -1.00 121.20 125.00 1yko s ILE 128 Ca 0.55 -0.93 0.02 0.00 0.00 0.00 0.00 60.65 60.29 1yko s ILE 128 Cb -0.25 -1.36 0.01 0.00 0.01 0.00 0.00 42.46 40.87 1yko s ILE 128 CO 0.27 0.42 -0.18 -0.44 0.00 0.00 0.00 174.94 175.00 1yko s SER 129 N -0.60 2.78 -0.21 3.58 0.01 -0.21 -0.87 113.70 118.18 1yko s SER 129 Ca 0.08 -0.52 -0.05 0.00 1.31 0.00 0.00 55.95 56.77 1yko s SER 129 Cb -0.08 -1.27 -0.03 0.00 0.21 0.00 0.00 66.02 64.86 1yko s SER 129 CO -0.00 0.04 0.01 -0.22 0.41 0.00 0.00 173.24 173.48 1yko s LEU 130 N 0.96 3.31 0.13 2.44 2.96 0.89 -1.53 118.68 127.84 1yko s LEU 130 Ca -0.06 -0.19 0.10 0.00 -0.22 0.00 0.00 54.13 53.77 1yko s LEU 130 Cb -0.15 -1.85 -0.04 0.00 0.50 0.00 0.00 46.19 44.66 1yko s LEU 130 CO -0.03 0.05 -0.25 -0.36 -1.32 0.00 0.00 176.35 174.45 1yko s PHE 131 N 1.07 2.17 0.00 5.38 0.40 0.11 -1.75 117.98 125.36 1yko s PHE 131 Ca 0.03 -0.39 0.00 0.00 -0.60 0.00 0.00 56.93 55.97 1yko s PHE 131 Cb -0.14 -1.16 0.00 0.00 0.51 0.00 0.00 43.02 42.22 1yko s PHE 131 CO 0.02 0.32 0.00 0.00 0.70 0.00 0.00 175.22 176.26 1yko n ALA 132 N 0.87 0.00 -1.89 5.36 0.00 -1.26 -0.37 120.51 123.23 1yko n ALA 132 Ca -0.18 0.00 -0.41 0.00 0.00 0.00 0.00 53.44 52.86 1yko n ALA 132 Cb 0.54 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.94 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 4.65 0.00 0.00 1.70 -1.26 -2.87 118.95 119.17 1yko s ARG 133 Ca 0.00 1.73 0.00 0.00 -0.47 0.00 0.00 55.73 56.99 1yko s ARG 133 Cb 0.00 -3.24 0.00 0.00 -0.57 0.00 0.00 34.95 31.14 1yko s ARG 133 CO 0.00 0.19 0.00 0.41 -1.08 0.00 0.00 175.30 174.82 1yko n GLY 134 N 1.59 0.96 3.13 3.88 0.00 -1.26 -4.99 105.19 108.50 1yko n GLY 134 Ca 0.00 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.65 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 -2.49 3.56 0.18 -0.61 1.01 -1.14 -4.98 121.20 116.74 1yko s ILE 135 Ca 0.00 -2.20 -0.13 0.00 0.00 0.00 0.00 60.65 58.32 1yko s ILE 135 Cb 0.00 -3.39 0.09 0.00 0.01 0.00 0.00 42.46 39.17 1yko s ILE 135 CO 0.00 -0.75 1.85 0.78 0.00 0.00 0.00 174.94 176.82 1yko h ASN 136 N 7.91 0.67 -3.85 3.58 2.35 -1.89 -3.37 115.58 120.98 1yko h ASN 136 Ca -0.12 -0.02 -0.53 0.00 -0.55 0.00 0.00 56.30 55.09 1yko h ASN 136 Cb 1.03 -0.16 -0.31 0.00 0.05 0.00 0.00 38.32 38.92 1yko h ASN 136 CO 0.73 0.48 -0.82 -0.51 -1.65 0.00 0.00 177.43 175.66 1yko s ILE 137 N -6.15 1.26 0.41 2.81 2.07 -1.26 -3.12 121.20 117.23 1yko s ILE 137 Ca -0.13 -0.62 -0.25 0.00 -1.41 0.00 0.00 60.65 58.24 1yko s ILE 137 Cb 0.13 -1.10 -0.11 0.00 0.13 0.00 0.00 42.46 41.52 1yko s ILE 137 CO 0.75 0.37 1.06 0.00 -1.91 0.00 0.00 174.94 175.21 1yko n HIS 138 N 3.22 1.35 -3.47 3.50 1.44 -1.26 -4.99 115.22 115.00 1yko n HIS 138 Ca -0.18 0.56 -0.37 0.00 -2.01 0.00 0.00 57.72 55.71 1yko n HIS 138 Cb 0.53 -2.26 -0.06 0.00 0.12 0.00 0.00 29.99 28.32 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 -0.67 4.32 -0.17 2.39 1.43 -0.72 -4.87 118.68 120.38 1yko s LEU 139 Ca 0.62 0.71 -0.08 0.00 -1.03 0.00 0.00 54.13 54.36 1yko s LEU 139 Cb -0.56 -2.51 -0.04 0.00 0.03 0.00 0.00 46.19 43.11 1yko s LEU 139 CO 0.57 0.14 0.09 -1.00 0.23 0.00 0.00 176.35 176.38 1yko s HIS 140 N 0.08 3.36 0.23 0.29 3.76 -1.26 -0.08 115.29 121.67 1yko s HIS 140 Ca 0.21 0.25 -0.11 0.00 -0.15 0.00 0.00 55.06 55.25 1yko s HIS 140 Cb -0.14 -2.05 -0.01 0.00 1.11 0.00 0.00 32.58 31.48 1yko s HIS 140 CO 0.08 0.33 0.42 -0.08 -0.85 0.00 0.00 174.74 174.65 1yko s THR 141 N -0.00 0.01 0.04 1.30 -1.32 -0.05 0.03 115.64 115.64 1yko s THR 141 Ca 0.08 -1.46 0.07 0.00 -1.21 0.00 0.00 61.69 59.16 1yko s THR 141 Cb -0.12 -2.20 -0.02 0.00 -1.51 0.00 0.00 72.50 68.65 1yko s THR 141 CO 0.00 -0.02 -0.19 -0.13 -2.21 0.00 0.00 174.62 172.07 1yko s ARG 142 N -4.03 1.32 -0.21 7.08 0.52 -1.26 -0.45 118.95 121.93 1yko s ARG 142 Ca 0.24 -0.89 -0.06 0.00 -0.52 0.00 0.00 55.73 54.50 1yko s ARG 142 Cb 0.01 -1.41 -0.03 0.00 0.52 0.00 0.00 34.95 34.04 1yko s ARG 142 CO 0.08 0.36 0.03 -1.17 0.02 0.00 0.00 175.30 174.63 1yko s LEU 143 N -1.10 3.43 0.28 2.53 0.20 0.24 -4.77 118.68 119.48 1yko s LEU 143 Ca 0.06 -0.13 0.11 0.00 0.69 0.00 0.00 54.13 54.86 1yko s LEU 143 Cb -0.08 -1.88 -0.05 0.00 -0.43 0.00 0.00 46.19 43.75 1yko s LEU 143 CO 0.01 0.07 -0.09 -0.31 -0.29 0.00 0.00 176.35 175.74 1yko s TYR 144 N 0.98 2.49 -0.08 5.38 1.51 0.28 -1.71 117.35 126.20 1yko s TYR 144 Ca 0.03 -0.30 -0.01 0.00 -1.01 0.00 0.00 57.07 55.78 1yko s TYR 144 Cb -0.14 -1.14 -0.03 0.00 -0.11 0.00 0.00 41.96 40.54 1yko s TYR 144 CO 0.02 0.65 -0.03 -0.06 -1.11 0.00 0.00 175.55 175.02 1yko s PHE 145 N -2.44 3.06 -0.34 2.71 0.40 -1.26 0.30 117.98 120.41 1yko s PHE 145 Ca 0.31 0.12 0.27 0.00 -0.60 0.00 0.00 56.93 57.02 1yko s PHE 145 Cb -0.05 -1.75 1.04 0.00 0.51 0.00 0.00 43.02 42.77 1yko s PHE 145 CO 0.18 0.41 1.79 0.38 0.70 0.00 0.00 175.22 178.68 1yko h ASP 146 N 5.19 0.00 -0.47 1.36 2.03 -1.82 -2.96 116.42 119.75 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 1.18 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.68 1yko h ASP 146 CO 0.53 0.00 0.00 -0.90 -1.03 0.00 0.00 179.24 177.84 1yko n ASP 147 N -2.53 2.70 -0.86 4.15 5.75 -1.26 -3.82 116.55 120.69 1yko n ASP 147 Ca 0.02 -1.97 0.01 0.00 -0.01 0.00 0.00 54.79 52.84 1yko n ASP 147 Cb 0.29 -0.31 0.20 0.00 -1.03 0.00 0.00 41.12 40.27 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 0.98 1.72 -0.40 0.11 -0.58 -1.12 -4.85 120.64 116.50 1yko n GLU 148 Ca 0.17 -3.22 0.32 0.00 -0.42 0.00 0.00 57.16 54.01 1yko n GLU 148 Cb 0.44 -1.71 0.60 0.00 -0.57 0.00 0.00 31.44 30.20 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 0.98 2.57 -0.28 0.62 0.00 -1.76 -0.19 119.26 121.20 1yko h ALA 149 Ca 0.11 0.09 -0.14 0.00 0.00 0.00 0.00 54.91 54.96 1yko h ALA 149 Cb 1.32 0.14 -0.00 0.00 0.00 0.00 0.00 17.79 19.25 1yko h ALA 149 CO 0.19 -1.11 -0.39 1.96 0.00 0.00 0.00 179.25 179.91 1yko h GLN 150 N 0.19 0.76 0.00 0.00 4.20 -1.94 -2.91 115.11 115.41 1yko h GLN 150 Ca 0.73 -0.44 -0.16 0.00 0.06 0.00 0.00 58.65 58.84 1yko h GLN 150 Cb 2.18 0.03 -0.02 0.00 0.30 0.00 0.00 27.48 29.97 1yko h GLN 150 CO -0.36 1.07 -0.75 0.00 -0.67 0.00 0.00 178.83 178.11 1yko h ALA 151 N 0.68 0.57 -0.16 3.87 0.00 -1.54 -3.25 119.26 119.43 1yko h ALA 151 Ca 0.03 -0.68 -0.11 0.00 0.00 0.00 0.00 54.91 54.14 1yko h ALA 151 Cb 0.98 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.64 1yko h ALA 151 CO 0.09 0.94 -0.40 -0.91 0.00 0.00 0.00 179.25 178.97 1yko h ASN 152 N 0.00 0.37 1.60 0.00 2.35 -1.10 -1.51 115.58 117.29 1yko h ASN 152 Ca -0.01 -0.16 0.00 0.00 -0.55 0.00 0.00 56.30 55.58 1yko h ASN 152 Cb 1.51 -0.10 0.00 0.00 0.05 0.00 0.00 38.32 39.78 1yko h ASN 152 CO 0.10 0.74 0.00 0.00 -1.65 0.00 0.00 177.43 176.62 1yko h ALA 153 N 1.28 1.00 0.00 -0.83 0.00 -1.57 -3.18 119.26 115.96 1yko h ALA 153 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1yko h ALA 153 Cb 0.84 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.63 1yko h ALA 153 CO 0.07 0.00 -1.55 1.63 0.00 0.00 0.00 179.25 179.40 1yko n LYS 154 N -2.92 0.52 -1.64 0.00 4.76 -1.06 -4.95 118.16 112.86 1yko n LYS 154 Ca 0.03 -0.09 -0.44 0.00 -2.87 0.00 0.00 58.31 54.95 1yko n LYS 154 Cb 0.44 -1.59 -0.04 0.00 -1.84 0.00 0.00 35.03 32.01 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 11.40 0.00 0.14 0.00 0.13 -1.92 -1.47 132.00 140.28 1yko h PRO 156 Ca -0.47 0.00 -0.26 0.00 -0.87 0.00 0.00 66.00 64.40 1yko h PRO 156 Cb 1.25 0.00 0.01 0.00 0.13 0.00 0.00 31.00 32.39 1yko h PRO 156 CO 0.95 0.05 -1.26 0.28 -0.23 0.00 0.00 178.00 177.78 1yko h VAL 157 N 0.00 1.20 0.00 1.56 2.07 -1.95 -3.29 116.25 115.83 1yko h VAL 157 Ca -0.00 -2.48 -0.06 0.00 0.82 0.00 0.00 66.70 64.98 1yko h VAL 157 Cb 0.21 2.90 -0.01 0.00 -1.52 0.00 0.00 31.29 32.87 1yko h VAL 157 CO 0.01 0.73 -0.27 0.25 0.02 0.00 0.00 177.57 178.30 1yko h LEU 158 N -0.25 0.00 -0.63 2.57 5.85 -1.83 -2.13 115.31 118.89 1yko h LEU 158 Ca -0.25 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.47 1yko h LEU 158 Cb 1.79 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.82 1yko h LEU 158 CO 0.12 0.27 0.00 0.59 -0.34 0.00 0.00 178.44 179.08 1yko n ASN 159 N -3.66 0.97 0.06 1.25 3.02 -0.58 -3.36 115.26 112.96 1yko n ASN 159 Ca -0.01 -1.42 0.12 0.00 -0.03 0.00 0.00 54.58 53.24 1yko n ASN 159 Cb 0.39 -0.03 0.28 0.00 -0.61 0.00 0.00 39.78 39.81 1yko n ASN 159 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 1yko n LEU 160 N -0.21 0.66 -4.60 3.41 4.77 -0.80 -4.69 117.00 115.55 1yko n LEU 160 Ca 0.19 0.32 -0.42 0.00 -0.03 0.00 0.00 56.01 56.07 1yko n LEU 160 Cb 0.25 -0.25 -0.04 0.00 -2.33 0.00 0.00 43.42 41.04 1yko n LEU 160 CO 0.15 -0.07 0.67 -0.63 -1.33 0.00 0.00 177.39 176.19 1yko s ILE 161 N -3.12 4.66 0.15 -0.08 1.01 -1.21 -4.97 121.20 117.63 1yko s ILE 161 Ca 0.09 1.05 -0.24 0.00 0.00 0.00 0.00 60.65 61.55 1yko s ILE 161 Cb 0.14 -4.27 0.02 0.00 0.01 0.00 0.00 42.46 38.35 1yko s ILE 161 CO 0.67 -0.48 1.62 -0.33 0.00 0.00 0.00 174.94 176.42 1yko h GLU 162 N 8.47 -0.28 -5.65 2.79 5.08 -1.90 -3.41 114.58 119.67 1yko h GLU 162 Ca -0.24 0.02 -0.60 0.00 -1.00 0.00 0.00 59.36 57.55 1yko h GLU 162 Cb 1.09 0.06 -0.10 0.00 0.50 0.00 0.00 28.75 30.30 1yko h GLU 162 CO 0.95 -0.19 0.13 -0.65 -1.00 0.00 0.00 179.01 178.25 1yko s GLN 163 N -6.05 4.20 0.54 2.33 -1.52 -1.26 -4.98 119.66 112.93 1yko s GLN 163 Ca -0.15 0.62 0.20 0.00 -1.95 0.00 0.00 55.36 54.08 1yko s GLN 163 Cb 0.12 -3.59 1.44 0.00 -0.22 0.00 0.00 33.01 30.76 1yko s GLN 163 CO 0.67 -0.26 2.17 -1.35 -0.25 0.00 0.00 175.29 176.28 1yko h PRO 164 N 7.52 0.00 0.00 2.91 0.11 -1.99 -2.71 132.00 137.84 1yko h PRO 164 Ca -0.31 0.00 -0.06 0.00 0.11 0.00 0.00 66.00 65.74 1yko h PRO 164 Cb 1.14 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.24 1yko h PRO 164 CO 0.77 0.00 -0.29 1.96 -0.21 0.00 0.00 178.00 180.23 1yko h GLN 165 N 0.00 0.00 0.00 1.05 7.50 -1.97 -2.71 115.11 118.98 1yko h GLN 165 Ca 0.01 0.00 -0.03 0.00 0.50 0.00 0.00 58.65 59.13 1yko h GLN 165 Cb 0.05 0.00 -0.00 0.00 0.05 0.00 0.00 27.48 27.57 1yko h GLN 165 CO -0.00 0.29 -0.25 0.00 -1.50 0.00 0.00 178.83 177.37 1yko h ARG 166 N 0.00 0.00 0.00 1.46 3.08 -1.88 -3.26 114.38 113.78 1yko h ARG 166 Ca -0.00 0.00 -0.09 0.00 0.07 0.00 0.00 59.98 59.96 1yko h ARG 166 Cb 0.58 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.62 1yko h ARG 166 CO 0.04 0.13 -0.42 0.00 -1.07 0.00 0.00 179.97 178.65 1yko h ARG 167 N 0.00 0.00 0.00 0.04 3.08 -1.53 -2.97 114.38 113.00 1yko h ARG 167 Ca -0.01 0.00 -0.03 0.00 0.07 0.00 0.00 59.98 60.01 1yko h ARG 167 Cb 1.11 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 31.15 1yko h ARG 167 CO 0.02 0.42 -0.14 0.93 -1.07 0.00 0.00 179.97 180.12 1yko h GLU 168 N 0.00 0.00 0.00 0.04 5.08 -1.61 -2.67 114.58 115.41 1yko h GLU 168 Ca -0.00 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.34 1yko h GLU 168 Cb 0.86 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.11 1yko h GLU 168 CO 0.05 0.14 -0.09 1.79 -1.00 0.00 0.00 179.01 179.90 1yko h THR 169 N 0.00 0.24 -0.00 1.13 1.35 -1.70 -2.80 112.91 111.13 1yko h THR 169 Ca -0.00 -0.73 0.00 0.00 -0.55 0.00 0.00 66.41 65.13 1yko h THR 169 Cb 0.42 1.59 0.00 0.00 -1.73 0.00 0.00 68.15 68.43 1yko h THR 169 CO 0.02 0.09 -0.49 0.18 -0.25 0.00 0.00 175.52 175.06 1yko n LEU 170 N -3.24 0.95 -4.62 3.87 4.77 -1.01 -4.84 117.00 112.88 1yko n LEU 170 Ca 0.00 -0.26 -0.40 0.00 -0.03 0.00 0.00 56.01 55.32 1yko n LEU 170 Cb 0.34 -0.14 -0.08 0.00 -2.33 0.00 0.00 43.42 41.22 1yko n LEU 170 CO 0.30 0.20 0.24 -0.63 -1.33 0.00 0.00 177.39 176.17 1yko s ILE 171 N -2.77 5.07 0.01 -0.08 1.01 -1.06 -0.56 121.20 122.83 1yko s ILE 171 Ca 0.16 0.88 -0.24 0.00 0.00 0.00 0.00 60.65 61.45 1yko s ILE 171 Cb 0.18 -3.83 -0.05 0.00 0.01 0.00 0.00 42.46 38.77 1yko s ILE 171 CO 0.65 0.09 0.73 0.00 0.00 0.00 0.00 174.94 176.41 1yko s ALA 172 N 2.29 3.37 0.02 9.38 0.00 0.15 -4.91 121.76 132.05 1yko s ALA 172 Ca 0.21 0.21 -0.26 0.00 0.00 0.00 0.00 51.96 52.13 1yko s ALA 172 Cb -0.16 -2.96 -0.05 0.00 0.00 0.00 0.00 23.12 19.96 1yko s ALA 172 CO 0.09 0.03 0.79 0.15 0.00 0.00 0.00 175.76 176.82 1yko s LYS 173 N 0.18 4.51 -0.06 0.00 1.02 -0.90 -2.35 119.74 122.13 1yko s LYS 173 Ca 0.38 1.10 -0.30 0.00 0.02 0.00 0.00 55.97 57.16 1yko s LYS 173 Cb -0.19 -3.39 -0.02 0.00 -0.52 0.00 0.00 37.83 33.70 1yko s LYS 173 CO 0.21 0.19 1.02 0.50 -0.92 0.00 0.00 175.35 176.35 1yko s ARG 174 N 0.27 4.46 0.17 1.68 3.52 -1.26 -0.57 118.95 127.22 1yko s ARG 174 Ca 0.41 1.44 0.03 0.00 -0.13 0.00 0.00 55.73 57.48 1yko s ARG 174 Cb -0.20 -3.51 -0.01 0.00 -1.56 0.00 0.00 34.95 29.67 1yko s ARG 174 CO 0.23 -0.24 0.13 0.00 -0.81 0.00 0.00 175.30 174.61 1yko s GLU 176 N -2.70 0.45 -0.28 0.00 2.02 -1.26 -2.09 118.70 114.83 1yko s GLU 176 Ca 0.18 0.17 0.00 0.00 0.02 0.00 0.00 54.97 55.33 1yko s GLU 176 Cb 0.01 -0.86 0.05 0.00 0.10 0.00 0.00 34.13 33.43 1yko s GLU 176 CO 0.13 -0.30 -0.05 0.08 0.02 0.00 0.00 175.26 175.13 1yko s VAL 177 N 1.98 2.66 -1.44 2.63 1.01 -1.02 -4.74 120.40 121.49 1yko s VAL 177 Ca 0.04 -1.44 -0.10 0.00 0.00 0.00 0.00 61.98 60.48 1yko s VAL 177 Cb -0.12 -2.52 0.04 0.00 0.00 0.00 0.00 36.38 33.78 1yko s VAL 177 CO -0.05 -0.04 1.06 0.47 0.00 0.00 0.00 175.10 176.54 1yko n ASP 178 N 4.56 -5.80 0.00 3.32 8.00 -1.26 -2.13 116.55 123.24 1yko n ASP 178 Ca -0.14 -0.60 0.00 0.00 0.71 0.00 0.00 54.79 54.76 1yko n ASP 178 Cb 0.43 -4.59 0.00 0.00 -0.02 0.00 0.00 41.12 36.94 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 -1.85 0.43 3.79 0.44 0.00 -1.26 -5.01 105.19 101.72 1yko n GLY 179 Ca 0.01 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.69 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 -0.43 3.15 -0.24 1.61 2.47 -0.90 -5.06 119.74 120.33 1yko s LYS 180 Ca 0.00 -0.38 -0.29 0.00 -1.56 0.00 0.00 55.97 53.74 1yko s LYS 180 Cb 0.00 -2.93 -0.02 0.00 -1.46 0.00 0.00 37.83 33.42 1yko s LYS 180 CO 0.00 0.69 1.60 0.99 0.16 0.00 0.00 175.35 178.79 1yko s THR 181 N -1.09 3.72 0.16 3.43 2.01 -1.26 -2.43 115.64 120.18 1yko s THR 181 Ca 0.19 0.80 0.09 0.00 0.31 0.00 0.00 61.69 63.08 1yko s THR 181 Cb -0.12 -3.75 -0.04 0.00 0.01 0.00 0.00 72.50 68.61 1yko s THR 181 CO 0.09 -0.32 -0.20 0.00 -0.69 0.00 0.00 174.62 173.50 1yko s ALA 182 N 5.24 2.11 -0.04 7.40 0.00 -0.89 -1.32 121.76 134.27 1yko s ALA 182 Ca 0.71 -1.48 0.01 0.00 0.00 0.00 0.00 51.96 51.20 1yko s ALA 182 Cb -0.24 -0.23 0.02 0.00 0.00 0.00 0.00 23.12 22.66 1yko s ALA 182 CO 0.29 0.31 -0.06 0.71 0.00 0.00 0.00 175.76 177.01 1yko s TYR 183 N -1.78 0.77 -0.21 0.00 1.51 -0.69 -1.00 117.35 115.95 1yko s TYR 183 Ca 0.15 -0.21 -0.07 0.00 -1.01 0.00 0.00 57.07 55.93 1yko s TYR 183 Cb -0.07 -0.63 -0.04 0.00 -0.11 0.00 0.00 41.96 41.11 1yko s TYR 183 CO 0.07 -0.15 0.07 0.50 -1.11 0.00 0.00 175.55 174.93 1yko s ARG 184 N 0.65 3.87 -0.29 -0.62 3.52 0.27 -2.33 118.95 124.01 1yko s ARG 184 Ca -0.09 -0.39 -0.00 0.00 -0.13 0.00 0.00 55.73 55.12 1yko s ARG 184 Cb -0.12 -3.26 0.09 0.00 -1.56 0.00 0.00 34.95 30.09 1yko s ARG 184 CO 0.00 0.11 0.06 0.12 -0.81 0.00 0.00 175.30 174.78 1yko s PHE 185 N 0.83 2.03 -0.12 5.12 5.36 -0.76 -2.13 117.98 128.32 1yko s PHE 185 Ca 0.04 -1.81 -0.14 0.00 -0.96 0.00 0.00 56.93 54.05 1yko s PHE 185 Cb -0.14 -1.78 -0.05 0.00 -0.34 0.00 0.00 43.02 40.71 1yko s PHE 185 CO 0.02 -0.84 0.32 -0.51 -1.46 0.00 0.00 175.22 172.76 1yko s ASP 186 N 1.51 6.54 -0.21 6.13 1.01 -1.26 -3.95 116.67 126.43 1yko s ASP 186 Ca 0.06 0.63 -0.08 0.00 0.71 0.00 0.00 52.55 53.88 1yko s ASP 186 Cb -0.18 -2.20 -0.04 0.00 1.01 0.00 0.00 42.92 41.52 1yko s ASP 186 CO -0.18 0.17 0.07 -0.63 0.21 0.00 0.00 175.17 174.81 1yko s ILE 187 N 0.01 4.65 -0.34 0.77 1.01 -0.37 -4.97 121.20 121.96 1yko s ILE 187 Ca 0.19 -0.07 -0.02 0.00 0.00 0.00 0.00 60.65 60.75 1yko s ILE 187 Cb -0.14 -3.13 0.08 0.00 0.01 0.00 0.00 42.46 39.28 1yko s ILE 187 CO 0.07 0.41 0.08 -0.13 0.00 0.00 0.00 174.94 175.36 1yko s ARG 188 N 0.86 2.18 0.16 2.79 0.52 -1.26 -0.70 118.95 123.51 1yko s ARG 188 Ca 0.04 -1.53 -0.13 0.00 -0.52 0.00 0.00 55.73 53.59 1yko s ARG 188 Cb -0.14 -3.33 0.06 0.00 0.52 0.00 0.00 34.95 32.06 1yko s ARG 188 CO 0.02 -0.82 1.73 0.82 0.02 0.00 0.00 175.30 177.08 1yko h ILE 189 N 6.44 1.21 -4.04 1.52 2.04 -1.61 -0.12 117.51 122.95 1yko h ILE 189 Ca -0.16 -0.64 -0.13 0.00 1.00 0.00 0.00 64.86 64.92 1yko h ILE 189 Cb 1.05 0.61 -0.17 0.00 -0.74 0.00 0.00 36.82 37.58 1yko h ILE 189 CO 0.59 0.25 -0.63 -1.58 0.00 0.00 0.00 178.15 176.78 1yko s GLN 190 N -5.61 0.54 0.83 2.37 0.74 -1.26 -4.75 119.66 112.52 1yko s GLN 190 Ca -0.13 -0.93 0.00 0.00 0.05 0.00 0.00 55.36 54.35 1yko s GLN 190 Cb 0.12 0.20 0.00 0.00 1.10 0.00 0.00 33.01 34.43 1yko s GLN 190 CO 0.78 -0.11 0.00 0.41 -0.55 0.00 0.00 175.29 175.82 1yko n GLY 191 N 0.65 0.17 3.69 2.59 0.00 -1.26 -4.22 105.19 106.81 1yko n GLY 191 Ca -0.18 -1.59 -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 4.35 -0.53 1.61 2.12 -1.26 -3.01 118.70 121.98 1yko s GLU 192 Ca 0.00 1.79 -0.01 0.00 0.36 0.00 0.00 54.97 57.11 1yko s GLU 192 Cb 0.00 -3.51 0.00 0.00 0.26 0.00 0.00 34.13 30.88 1yko s GLU 192 CO 0.00 -0.45 0.09 0.41 -0.54 0.00 0.00 175.26 174.77 1yko n GLY 193 N 3.42 0.19 3.72 -1.50 0.00 -1.26 -4.97 105.19 104.79 1yko n GLY 193 Ca 0.11 -0.56 -0.42 0.00 0.00 0.00 0.00 46.02 45.15 1yko n GLY 193 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1yko s GLU 194 N -4.59 4.14 0.31 1.61 2.12 -1.16 -4.64 118.70 116.49 1yko s GLU 194 Ca 0.04 2.55 -0.29 0.00 0.36 0.00 0.00 54.97 57.64 1yko s GLU 194 Cb -0.02 -3.09 -0.10 0.00 0.26 0.00 0.00 34.13 31.18 1yko s GLU 194 CO 0.05 -0.71 1.30 0.99 -0.54 0.00 0.00 175.26 176.35 1yko s THR 195 N 1.10 2.83 0.05 -1.70 2.01 -0.06 -4.96 115.64 114.92 1yko s THR 195 Ca 0.73 0.81 -0.31 0.00 0.31 0.00 0.00 61.69 63.23 1yko s THR 195 Cb -0.48 -3.51 -0.06 0.00 0.01 0.00 0.00 72.50 68.45 1yko s THR 195 CO 0.33 0.18 1.35 -0.69 -0.69 0.00 0.00 174.62 175.10 1yko s VAL 196 N -0.96 3.65 -0.03 3.82 1.01 -1.26 -4.95 120.40 121.68 1yko s VAL 196 Ca 0.50 1.13 0.05 0.00 0.00 0.00 0.00 61.98 63.66 1yko s VAL 196 Cb -0.39 -3.73 -0.02 0.00 0.00 0.00 0.00 36.38 32.24 1yko s VAL 196 CO 0.50 0.05 -0.18 -0.36 0.00 0.00 0.00 175.10 175.11 1yko s PHE 197 N 1.62 2.59 0.33 5.22 0.08 -1.26 -4.70 117.98 121.86 1yko s PHE 197 Ca 0.63 -0.24 0.07 0.00 0.12 0.00 0.00 56.93 57.51 1yko s PHE 197 Cb -0.33 -1.58 -0.01 0.00 -0.57 0.00 0.00 43.02 40.53 1yko s PHE 197 CO 0.28 0.14 0.43 -0.06 -0.10 0.00 0.00 175.22 175.91 1yko s PHE 198 N -0.72 3.09 -0.02 0.36 0.08 0.10 -4.98 117.98 115.90 1yko s PHE 198 Ca 0.11 -0.22 -0.00 0.00 0.12 0.00 0.00 56.93 56.94 1yko s PHE 198 Cb -0.10 -1.94 0.02 0.00 -0.57 0.00 0.00 43.02 40.43 1yko s PHE 198 CO 0.01 0.04 0.04 0.34 -0.10 0.00 0.00 175.22 175.55 1yko s ASP 199 N -4.13 0.03 0.00 1.36 3.68 -1.26 -4.29 116.67 112.06 1yko s ASP 199 Ca 0.44 0.07 0.00 0.00 2.13 0.00 0.00 52.55 55.18 1yko s ASP 199 Cb -0.09 -0.02 0.00 0.00 -1.45 0.00 0.00 42.92 41.36 1yko s ASP 199 CO 0.30 -0.10 0.00 2.22 0.13 0.00 0.00 175.17 177.72