#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 4.92 -0.13 4.25 -1.09 -1.26 -5.05 121.20 122.85 1yko s ILE 2 Ca 0.00 1.48 -0.02 0.00 -2.23 0.00 0.00 60.65 59.88 1yko s ILE 2 Cb 0.00 -4.07 -0.03 0.00 -1.58 0.00 0.00 42.46 36.78 1yko s ILE 2 CO 0.00 0.05 -0.06 -1.61 -1.23 0.00 0.00 174.94 172.09 1yko s GLU 3 N 2.12 3.36 0.51 2.79 0.41 -1.26 -5.12 118.70 121.50 1yko s GLU 3 Ca 0.35 -0.55 0.07 0.00 -0.41 0.00 0.00 54.97 54.44 1yko s GLU 3 Cb -0.16 -2.78 0.03 0.00 -1.78 0.00 0.00 34.13 29.44 1yko s GLU 3 CO 0.11 0.37 0.52 -0.51 -0.49 0.00 0.00 175.26 175.26 1yko s LEU 4 N -0.01 3.08 0.26 1.80 1.02 -1.26 -5.07 118.68 118.50 1yko s LEU 4 Ca -0.00 -0.93 -0.30 0.00 0.02 0.00 0.00 54.13 52.92 1yko s LEU 4 Cb -0.13 -1.67 -0.11 0.00 0.02 0.00 0.00 46.19 44.30 1yko s LEU 4 CO 0.03 -1.02 1.54 -0.76 0.02 0.00 0.00 176.35 176.16 1yko s LEU 5 N -4.35 4.37 0.34 1.79 1.43 -1.26 -4.95 118.68 116.05 1yko s LEU 5 Ca 0.48 2.80 -0.27 0.00 -1.03 0.00 0.00 54.13 56.10 1yko s LEU 5 Cb -0.04 -3.62 -0.09 0.00 0.03 0.00 0.00 46.19 42.46 1yko s LEU 5 CO 0.29 -0.82 1.17 -2.84 0.23 0.00 0.00 176.35 174.37 1yko s PRO 6 N -0.16 4.32 0.41 1.29 0.02 -1.26 -4.99 135.00 134.63 1yko s PRO 6 Ca 0.63 1.88 -0.25 0.00 0.02 0.00 0.00 61.00 63.28 1yko s PRO 6 Cb -0.45 -2.92 -0.08 0.00 0.02 0.00 0.00 34.50 31.07 1yko s PRO 6 CO 0.43 -0.10 1.22 -2.00 -0.33 0.00 0.00 177.00 176.22 1yko s GLU 7 N -1.92 3.97 0.18 5.54 2.12 -1.26 -4.95 118.70 122.38 1yko s GLU 7 Ca 0.51 1.94 -0.32 0.00 0.36 0.00 0.00 54.97 57.47 1yko s GLU 7 Cb -0.32 -2.66 -0.12 0.00 0.26 0.00 0.00 34.13 31.29 1yko s GLU 7 CO 0.42 -0.42 1.77 2.41 -0.54 0.00 0.00 175.26 178.90 1yko n THR 8 N 0.01 0.15 -1.91 -1.70 -1.04 -1.26 -4.94 114.28 103.58 1yko n THR 8 Ca 0.05 -0.03 -0.37 0.00 -2.04 0.00 0.00 64.05 61.66 1yko n THR 8 Cb 0.46 -2.05 0.04 0.00 -1.82 0.00 0.00 70.33 66.96 1yko n THR 8 CO 0.00 0.00 0.00 -2.84 -0.64 0.00 0.00 175.07 171.59 1yko s PRO 9 N 1.79 2.96 0.45 -2.82 0.02 -1.26 -5.02 135.00 131.12 1yko s PRO 9 Ca 0.78 1.98 -0.15 0.00 0.02 0.00 0.00 61.00 63.63 1yko s PRO 9 Cb -0.49 -2.02 -0.08 0.00 0.02 0.00 0.00 34.50 31.93 1yko s PRO 9 CO 0.34 -1.25 0.88 0.45 -0.33 0.00 0.00 177.00 177.09 1yko s SER 10 N -1.38 6.63 0.03 2.53 0.15 -1.26 -5.09 113.70 115.31 1yko s SER 10 Ca 0.76 1.39 -0.01 0.00 0.70 0.00 0.00 55.95 58.80 1yko s SER 10 Cb -0.34 -2.43 -0.03 0.00 -1.71 0.00 0.00 66.02 61.51 1yko s SER 10 CO 0.38 -0.46 -0.02 -1.10 1.20 0.00 0.00 173.24 173.24 1yko s GLN 11 N -3.82 0.46 0.60 5.44 -1.52 -1.19 -4.89 119.66 114.76 1yko s GLN 11 Ca 0.56 -0.88 -0.19 0.00 -1.95 0.00 0.00 55.36 52.90 1yko s GLN 11 Cb -0.10 0.16 -0.04 0.00 -0.22 0.00 0.00 33.01 32.81 1yko s GLN 11 CO 0.28 -0.08 1.04 -2.37 -0.25 0.00 0.00 175.29 173.91 1yko n THR 12 N 0.89 3.91 0.23 -0.19 5.66 -1.20 -4.78 114.28 118.79 1yko n THR 12 Ca -0.19 -0.50 0.09 0.00 -3.05 0.00 0.00 64.05 60.39 1yko n THR 12 Cb 0.58 -1.23 0.54 0.00 -1.55 0.00 0.00 70.33 68.67 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 0.55 1.23 0.00 1.79 0.00 -1.74 -3.49 119.26 117.60 1yko h ALA 13 Ca -0.49 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.21 1yko h ALA 13 Cb 1.36 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.11 1yko h ALA 13 CO 0.52 0.29 0.00 0.41 0.00 0.00 0.00 179.25 180.46 1yko n GLY 14 N -0.38 -1.64 0.19 0.00 0.00 -1.26 -4.05 105.19 98.04 1yko n GLY 14 Ca -0.01 -1.55 0.00 0.00 0.00 0.00 0.00 46.02 44.46 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 0.12 -0.78 1.61 0.13 -1.94 -3.17 132.00 127.97 1yko h PRO 15 Ca 0.00 -0.05 -0.06 0.00 -0.87 0.00 0.00 66.00 65.02 1yko h PRO 15 Cb 0.00 -0.00 -0.04 0.00 0.13 0.00 0.00 31.00 31.09 1yko h PRO 15 CO 0.00 0.50 0.08 0.66 -0.23 0.00 0.00 178.00 179.01 1yko n TYR 16 N -4.05 1.50 -0.22 1.56 4.01 -1.26 -4.48 117.16 114.20 1yko n TYR 16 Ca -0.02 -0.65 0.25 0.00 -0.16 0.00 0.00 57.90 57.33 1yko n TYR 16 Cb 0.45 -0.44 0.63 0.00 -0.31 0.00 0.00 39.34 39.66 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 2.26 0.59 -0.60 -0.72 3.04 -1.69 -1.93 116.25 117.20 1yko h VAL 17 Ca 0.08 -0.06 -0.00 0.00 -1.01 0.00 0.00 66.70 65.70 1yko h VAL 17 Cb 1.62 0.38 -0.03 0.00 -2.01 0.00 0.00 31.29 31.25 1yko h VAL 17 CO 0.40 0.03 0.36 0.45 -1.01 0.00 0.00 177.57 177.81 1yko h HIS 18 N 0.19 0.78 0.00 3.17 3.86 -1.85 -2.23 115.15 119.07 1yko h HIS 18 Ca 0.47 0.00 -0.01 0.00 -1.16 0.00 0.00 60.37 59.67 1yko h HIS 18 Cb 1.52 -0.26 -0.00 0.00 1.06 0.00 0.00 27.41 29.73 1yko h HIS 18 CO -0.00 0.52 -0.03 -0.84 0.86 0.00 0.00 177.93 178.44 1yko h ILE 19 N 0.82 0.38 0.00 2.45 3.07 -1.56 0.60 117.51 123.27 1yko h ILE 19 Ca 0.22 -0.14 -0.04 0.00 1.55 0.00 0.00 64.86 66.44 1yko h ILE 19 Cb -0.03 1.10 -0.01 0.00 -0.27 0.00 0.00 36.82 37.61 1yko h ILE 19 CO -0.04 0.03 -1.63 0.61 -1.05 0.00 0.00 178.15 176.07 1yko n GLY 20 N -1.06 -0.58 0.00 0.16 0.00 -1.00 -4.59 105.19 98.11 1yko n GLY 20 Ca -0.03 -0.28 0.00 0.00 0.00 0.00 0.00 46.02 45.71 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 -2.03 0.40 -2.90 0.99 4.77 -0.87 -4.86 117.00 112.49 1yko n LEU 21 Ca -0.05 -0.55 -0.13 0.00 -0.03 0.00 0.00 56.01 55.25 1yko n LEU 21 Cb 0.43 0.00 0.03 0.00 -2.33 0.00 0.00 43.42 41.55 1yko n LEU 21 CO 0.26 0.10 0.08 0.00 -1.33 0.00 0.00 177.39 176.51 1yko n ALA 22 N -0.30 0.12 -0.27 -1.18 0.00 0.17 -4.99 120.51 114.06 1yko n ALA 22 Ca 0.00 -2.15 0.06 0.00 0.00 0.00 0.00 53.44 51.35 1yko n ALA 22 Cb 0.04 -1.11 0.20 0.00 0.00 0.00 0.00 19.45 18.59 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 3.44 0.38 -0.47 0.00 4.07 -1.71 -2.10 115.31 118.92 1yko h LEU 23 Ca -0.05 0.10 -0.08 0.00 0.08 0.00 0.00 57.88 57.93 1yko h LEU 23 Cb 1.02 0.05 -0.02 0.00 1.08 0.00 0.00 40.66 42.80 1yko h LEU 23 CO 0.31 0.15 -0.03 -0.08 -1.08 0.00 0.00 178.44 177.72 1yko h GLU 24 N 0.52 0.85 0.00 1.13 4.81 -1.88 -2.08 114.58 117.93 1yko h GLU 24 Ca 0.43 -0.28 0.00 0.00 -0.13 0.00 0.00 59.36 59.38 1yko h GLU 24 Cb 0.64 -0.07 0.00 0.00 0.63 0.00 0.00 28.75 29.95 1yko h GLU 24 CO -0.38 0.91 0.00 0.00 -0.73 0.00 0.00 179.01 178.80 1yko h ALA 25 N 0.91 1.00 -0.01 2.92 0.00 -1.82 -1.86 119.26 120.40 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 0.54 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.33 1yko h ALA 25 CO 0.03 0.00 -0.19 0.00 0.00 0.00 0.00 179.25 179.09 1yko n ALA 26 N -2.08 2.94 -1.43 0.00 0.00 -0.82 -4.93 120.51 114.19 1yko n ALA 26 Ca 0.00 -0.36 -0.05 0.00 0.00 0.00 0.00 53.44 53.03 1yko n ALA 26 Cb 0.28 -1.20 -0.02 0.00 0.00 0.00 0.00 19.45 18.51 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 1.31 0.60 3.69 0.00 0.00 -0.70 -4.97 105.19 105.12 1yko n GLY 27 Ca 0.13 -0.78 -0.26 0.00 0.00 0.00 0.00 46.02 45.12 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 -2.89 4.91 0.38 1.61 0.01 -0.81 -5.05 114.94 113.10 1yko s ASN 28 Ca 0.00 -0.37 -0.27 0.00 -0.71 0.00 0.00 52.86 51.51 1yko s ASN 28 Cb 0.00 -1.09 -0.09 0.00 0.41 0.00 0.00 41.25 40.48 1yko s ASN 28 CO 0.00 0.07 1.28 -2.16 -1.51 0.00 0.00 177.10 174.78 1yko s PRO 29 N -3.11 4.13 0.52 -0.60 0.04 -1.26 -4.04 135.00 130.68 1yko s PRO 29 Ca 0.29 2.13 -0.03 0.00 0.04 0.00 0.00 61.00 63.42 1yko s PRO 29 Cb -0.09 -2.86 0.00 0.00 0.04 0.00 0.00 34.50 31.59 1yko s PRO 29 CO 0.20 -0.35 0.79 0.95 0.04 0.00 0.00 177.00 178.63 1yko s THR 30 N -1.24 3.88 0.61 1.26 -4.23 -1.26 -4.87 115.64 109.79 1yko s THR 30 Ca 0.54 -0.21 0.00 0.00 -1.18 0.00 0.00 61.69 60.85 1yko s THR 30 Cb -0.37 -3.49 0.06 0.00 1.34 0.00 0.00 72.50 70.04 1yko s THR 30 CO 0.49 -0.43 0.85 -0.13 -0.54 0.00 0.00 174.62 174.86 1yko s ARG 31 N -4.78 2.27 0.20 3.99 0.52 -1.26 -5.02 118.95 114.88 1yko s ARG 31 Ca 0.51 -0.85 -0.11 0.00 -0.52 0.00 0.00 55.73 54.76 1yko s ARG 31 Cb -0.10 -2.42 0.26 0.00 0.52 0.00 0.00 34.95 33.21 1yko s ARG 31 CO 0.42 -0.96 1.70 -0.44 0.02 0.00 0.00 175.30 176.05 1yko h ASP 32 N -0.14 -0.02 -3.18 0.23 3.32 -2.08 -3.40 116.42 111.16 1yko h ASP 32 Ca -0.40 0.11 -0.64 0.00 0.02 0.00 0.00 57.03 56.12 1yko h ASP 32 Cb 1.29 0.15 -0.35 0.00 0.22 0.00 0.00 39.33 40.65 1yko h ASP 32 CO 0.49 0.00 -0.85 -1.10 -1.72 0.00 0.00 179.24 176.06 1yko s GLN 33 N -6.12 2.65 0.12 3.56 -0.21 -1.26 -5.13 119.66 113.27 1yko s GLN 33 Ca -0.13 -0.71 0.07 0.00 0.02 0.00 0.00 55.36 54.61 1yko s GLN 33 Cb 0.17 -2.24 -0.04 0.00 1.00 0.00 0.00 33.01 31.90 1yko s GLN 33 CO 0.74 -0.11 -0.18 -1.21 -2.12 0.00 0.00 175.29 172.41 1yko s GLU 34 N 1.09 1.11 -0.47 2.91 0.41 -1.26 -5.11 118.70 117.37 1yko s GLU 34 Ca -0.02 -1.22 -0.16 0.00 -0.41 0.00 0.00 54.97 53.15 1yko s GLU 34 Cb -0.14 -1.20 0.06 0.00 -1.78 0.00 0.00 34.13 31.06 1yko s GLU 34 CO -0.06 0.26 0.42 0.42 -0.49 0.00 0.00 175.26 175.81 1yko s ILE 35 N -1.64 5.18 0.00 -1.63 1.01 -1.26 -5.03 121.20 117.83 1yko s ILE 35 Ca 0.09 -0.89 0.00 0.00 0.00 0.00 0.00 60.65 59.84 1yko s ILE 35 Cb -0.08 -4.12 0.00 0.00 0.01 0.00 0.00 42.46 38.27 1yko s ILE 35 CO 0.04 -0.57 0.00 1.87 0.00 0.00 0.00 174.94 176.29 1yko n TRP 36 N 5.36 0.00 1.98 3.97 -0.00 -1.26 -4.48 117.44 123.01 1yko n TRP 36 Ca -0.11 0.00 0.06 0.00 -0.00 0.00 0.00 57.50 57.45 1yko n TRP 36 Cb 0.45 0.00 0.38 0.00 -0.00 0.00 0.00 31.31 32.13 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 -4.26 5.87 6.94 -0.66 -2.22 115.26 120.94 1yko n ASN 37 Ca 0.00 -1.58 -0.44 0.00 -0.02 0.00 0.00 54.58 52.54 1yko n ASN 37 Cb 0.00 0.00 -0.05 0.00 -2.36 0.00 0.00 39.78 37.37 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 3.15 0.04 -3.83 0.52 -1.26 -1.12 118.95 114.45 1yko s ARG 38 Ca 0.19 -2.31 -0.16 0.00 -0.52 0.00 0.00 55.73 52.93 1yko s ARG 38 Cb 0.09 -4.19 -0.28 0.00 0.52 0.00 0.00 34.95 31.09 1yko s ARG 38 CO 0.15 -1.26 1.09 -0.07 0.02 0.00 0.00 175.30 175.24 1yko h LEU 39 N 7.82 0.82 -8.74 2.53 4.07 -1.45 -3.46 115.31 116.90 1yko h LEU 39 Ca -0.01 -0.82 -0.68 0.00 0.08 0.00 0.00 57.88 56.46 1yko h LEU 39 Cb 1.03 -0.26 -0.26 0.00 1.08 0.00 0.00 40.66 42.26 1yko h LEU 39 CO 0.79 1.55 -0.78 0.00 -1.08 0.00 0.00 178.44 178.92 1yko s ALA 40 N -3.00 2.58 0.22 1.53 0.00 -1.20 -1.34 121.76 120.55 1yko s ALA 40 Ca -0.10 -0.95 -0.14 0.00 0.00 0.00 0.00 51.96 50.76 1yko s ALA 40 Cb 0.05 -1.02 -0.08 0.00 0.00 0.00 0.00 23.12 22.07 1yko s ALA 40 CO 0.91 0.42 0.63 0.15 0.00 0.00 0.00 175.76 177.87 1yko s LYS 41 N -0.25 4.00 0.55 0.00 1.02 -0.13 -4.82 119.74 120.11 1yko s LYS 41 Ca 0.01 0.55 0.49 0.00 0.02 0.00 0.00 55.97 57.05 1yko s LYS 41 Cb -0.13 -2.73 1.72 0.00 -0.52 0.00 0.00 37.83 36.16 1yko s LYS 41 CO 0.03 0.35 1.56 -2.30 -0.92 0.00 0.00 175.35 174.07 1yko n PRO 42 N 0.29 -0.00 -0.78 -1.68 -0.02 -1.26 -0.77 135.00 130.77 1yko n PRO 42 Ca -0.01 1.09 0.05 0.00 -2.02 0.00 0.00 63.50 62.61 1yko n PRO 42 Cb 0.52 -2.50 0.34 0.00 -0.02 0.00 0.00 33.50 31.84 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 -3.97 5.01 -4.81 2.55 5.75 -1.26 -4.96 116.55 114.85 1yko n ASP 43 Ca 0.44 -2.82 -0.37 0.00 -0.01 0.00 0.00 54.79 52.04 1yko n ASP 43 Cb 1.99 -0.67 -0.06 0.00 -1.03 0.00 0.00 41.12 41.36 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 -2.52 3.45 0.49 2.12 0.00 0.05 -5.06 121.76 120.29 1yko s ALA 44 Ca 0.47 0.14 -0.21 0.00 0.00 0.00 0.00 51.96 52.35 1yko s ALA 44 Cb 0.36 -2.78 -0.07 0.00 0.00 0.00 0.00 23.12 20.63 1yko s ALA 44 CO 0.13 0.35 1.12 -1.25 0.00 0.00 0.00 175.76 176.11 1yko s PRO 45 N -1.80 3.66 0.00 0.00 0.04 -1.26 -4.93 135.00 130.70 1yko s PRO 45 Ca 0.40 1.63 0.00 0.00 0.04 0.00 0.00 61.00 63.07 1yko s PRO 45 Cb -0.17 -2.23 0.00 0.00 0.04 0.00 0.00 34.50 32.14 1yko s PRO 45 CO 0.21 -0.60 0.00 0.41 0.04 0.00 0.00 177.00 177.06 1yko n GLY 46 N 0.23 1.27 3.55 0.56 0.00 -1.26 -4.61 105.19 104.93 1yko n GLY 46 Ca 0.09 -2.18 -0.43 0.00 0.00 0.00 0.00 46.02 43.51 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 -1.43 3.43 -0.03 1.61 2.12 -1.26 -4.96 118.70 118.18 1yko s GLU 47 Ca 0.00 -0.02 -0.30 0.00 0.36 0.00 0.00 54.97 55.01 1yko s GLU 47 Cb 0.00 -4.02 -0.06 0.00 0.26 0.00 0.00 34.13 30.31 1yko s GLU 47 CO 0.00 -1.51 1.59 -1.01 -0.54 0.00 0.00 175.26 173.79 1yko s HIS 48 N 4.25 2.26 0.27 5.30 3.76 -1.26 -1.77 115.29 128.09 1yko s HIS 48 Ca 0.36 0.37 0.07 0.00 -0.15 0.00 0.00 55.06 55.70 1yko s HIS 48 Cb -0.10 -3.86 -0.06 0.00 1.11 0.00 0.00 32.58 29.67 1yko s HIS 48 CO 0.23 -3.50 -0.07 0.96 -0.85 0.00 0.00 174.74 171.50 1yko s ILE 49 N 3.45 1.66 -0.09 0.60 -4.36 0.25 -4.62 121.20 118.09 1yko s ILE 49 Ca 0.71 -2.14 0.03 0.00 -0.26 0.00 0.00 60.65 58.99 1yko s ILE 49 Cb -0.34 -2.40 0.00 0.00 1.25 0.00 0.00 42.46 40.98 1yko s ILE 49 CO 0.29 -0.33 -0.20 -0.22 0.24 0.00 0.00 174.94 174.71 1yko s LEU 50 N -3.43 1.96 -0.07 0.37 2.96 -0.75 -2.21 118.68 117.50 1yko s LEU 50 Ca 0.29 -0.49 0.01 0.00 -0.22 0.00 0.00 54.13 53.72 1yko s LEU 50 Cb 0.03 -1.24 -0.03 0.00 0.50 0.00 0.00 46.19 45.45 1yko s LEU 50 CO 0.11 0.12 -0.09 -0.76 -1.32 0.00 0.00 176.35 174.41 1yko s LEU 51 N 0.48 3.05 -0.04 -0.68 1.43 0.64 -1.85 118.68 121.71 1yko s LEU 51 Ca -0.17 -0.09 -0.16 0.00 -1.03 0.00 0.00 54.13 52.68 1yko s LEU 51 Cb -0.17 -1.66 0.03 0.00 0.03 0.00 0.00 46.19 44.42 1yko s LEU 51 CO 0.07 0.33 0.36 -1.48 0.23 0.00 0.00 176.35 175.86 1yko s LEU 52 N -0.63 0.65 0.16 1.79 -0.00 -1.06 -0.26 118.68 119.32 1yko s LEU 52 Ca 0.09 0.26 -0.24 0.00 -0.00 0.00 0.00 54.13 54.24 1yko s LEU 52 Cb -0.11 1.40 0.08 0.00 -0.00 0.00 0.00 46.19 47.55 1yko s LEU 52 CO 0.02 -0.42 1.03 -0.83 -0.00 0.00 0.00 176.35 176.15 1yko s GLY 53 N -1.08 -0.04 0.19 -3.48 0.00 -1.12 -2.00 107.32 99.80 1yko s GLY 53 Ca -0.11 -0.11 0.08 0.00 0.00 0.00 0.00 44.72 44.57 1yko s GLY 53 CO 0.04 1.47 -0.15 1.20 0.00 0.00 0.00 173.10 175.66 1yko s GLN 54 N -2.56 1.28 -0.10 2.90 -0.21 -1.25 -2.17 119.66 117.55 1yko s GLN 54 Ca 0.18 -1.51 0.03 0.00 0.02 0.00 0.00 55.36 54.08 1yko s GLN 54 Cb -0.02 -1.14 -0.00 0.00 1.00 0.00 0.00 33.01 32.85 1yko s GLN 54 CO 0.04 0.20 -0.22 0.08 -2.12 0.00 0.00 175.29 173.27 1yko s VAL 55 N -2.68 2.26 0.02 1.09 1.01 -1.26 -1.30 120.40 119.53 1yko s VAL 55 Ca 0.19 -0.95 0.08 0.00 0.00 0.00 0.00 61.98 61.30 1yko s VAL 55 Cb -0.02 -1.88 -0.03 0.00 0.00 0.00 0.00 36.38 34.45 1yko s VAL 55 CO 0.06 0.55 -0.24 -0.31 0.00 0.00 0.00 175.10 175.17 1yko s TYR 56 N 0.32 2.40 0.00 5.22 1.51 0.40 -0.64 117.35 126.57 1yko s TYR 56 Ca -0.17 -0.37 0.00 0.00 -1.01 0.00 0.00 57.07 55.52 1yko s TYR 56 Cb -0.17 -1.46 0.00 0.00 -0.11 0.00 0.00 41.96 40.22 1yko s TYR 56 CO 0.08 0.10 0.00 -0.40 -1.11 0.00 0.00 175.55 174.23 1yko n ASP 57 N 1.99 0.00 0.23 2.29 5.68 -0.42 -1.35 116.55 124.97 1yko n ASP 57 Ca -0.17 -0.85 0.16 0.00 -0.50 0.00 0.00 54.79 53.43 1yko n ASP 57 Cb 0.52 0.00 0.68 0.00 -1.14 0.00 0.00 41.12 41.17 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 -2.50 6.12 0.00 -1.89 -2.53 103.07 102.27 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 -2.73 3.89 -0.16 0.19 3.02 -1.26 -4.74 115.26 113.47 1yko n ASN 59 Ca 0.01 -2.06 -0.02 0.00 -0.03 0.00 0.00 54.58 52.47 1yko n ASN 59 Cb 0.23 -0.46 -0.01 0.00 -0.61 0.00 0.00 39.78 38.93 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 1.38 0.55 3.90 7.41 0.00 -0.95 -5.03 105.19 112.45 1yko n GLY 60 Ca 0.23 -0.41 -0.30 0.00 0.00 0.00 0.00 46.02 45.53 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 -1.97 3.47 0.30 1.61 3.76 -1.26 -4.82 115.29 116.37 1yko s HIS 61 Ca 0.00 0.56 -0.29 0.00 -0.15 0.00 0.00 55.06 55.18 1yko s HIS 61 Cb 0.00 -2.02 -0.10 0.00 1.11 0.00 0.00 32.58 31.58 1yko s HIS 61 CO 0.00 0.37 1.22 -0.51 -0.85 0.00 0.00 174.74 174.96 1yko s LEU 62 N -2.94 4.48 -0.72 0.89 1.43 -1.26 -1.30 118.68 119.25 1yko s LEU 62 Ca 0.42 2.49 -0.16 0.00 -1.03 0.00 0.00 54.13 55.84 1yko s LEU 62 Cb -0.12 -3.64 0.17 0.00 0.03 0.00 0.00 46.19 42.63 1yko s LEU 62 CO 0.26 -0.37 0.72 -0.69 0.23 0.00 0.00 176.35 176.50 1yko s VAL 63 N -1.04 5.27 -2.03 -1.59 1.01 0.19 -4.87 120.40 117.34 1yko s VAL 63 Ca 0.48 -1.86 0.15 0.00 0.00 0.00 0.00 61.98 60.75 1yko s VAL 63 Cb -0.36 -4.47 0.40 0.00 0.00 0.00 0.00 36.38 31.95 1yko s VAL 63 CO 0.47 -1.05 1.53 0.54 0.00 0.00 0.00 175.10 176.58 1yko n ARG 64 N 5.00 1.12 -0.24 2.72 1.74 -1.26 -3.81 116.66 121.94 1yko n ARG 64 Ca 0.03 -0.19 0.05 0.00 -0.77 0.00 0.00 57.85 56.97 1yko n ARG 64 Cb 0.44 -1.24 0.07 0.00 -1.02 0.00 0.00 32.46 30.71 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 -0.54 1.23 -4.79 0.55 5.68 -1.25 -3.53 116.55 113.90 1yko n ASP 65 Ca 0.11 -2.45 -0.34 0.00 -0.50 0.00 0.00 54.79 51.61 1yko n ASP 65 Cb 0.09 -0.28 -0.03 0.00 -1.14 0.00 0.00 41.12 39.76 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 -1.82 6.23 -0.08 -1.12 1.04 -1.25 -4.68 113.70 112.03 1yko s SER 66 Ca 0.15 1.99 0.02 0.00 0.48 0.00 0.00 55.95 58.59 1yko s SER 66 Cb 0.13 -2.57 0.01 0.00 0.10 0.00 0.00 66.02 63.70 1yko s SER 66 CO 0.01 -0.86 -0.16 0.12 0.98 0.00 0.00 173.24 173.34 1yko s PHE 67 N -1.92 1.84 -0.02 5.02 5.36 0.10 -1.99 117.98 126.38 1yko s PHE 67 Ca 0.68 -0.76 0.07 0.00 -0.96 0.00 0.00 56.93 55.96 1yko s PHE 67 Cb -0.18 -1.31 -0.02 0.00 -0.34 0.00 0.00 43.02 41.17 1yko s PHE 67 CO 0.22 -0.36 -0.22 -0.51 -1.46 0.00 0.00 175.22 172.88 1yko s LEU 68 N 0.69 2.04 -0.08 6.12 1.02 -0.07 -0.42 118.68 127.98 1yko s LEU 68 Ca -0.13 -0.41 0.05 0.00 0.02 0.00 0.00 54.13 53.66 1yko s LEU 68 Cb -0.16 -1.16 -0.00 0.00 0.02 0.00 0.00 46.19 44.89 1yko s LEU 68 CO 0.03 0.27 -0.23 -1.61 0.02 0.00 0.00 176.35 174.84 1yko s GLU 69 N -0.50 2.63 0.05 1.70 2.02 -0.64 -0.91 118.70 123.05 1yko s GLU 69 Ca 0.08 -0.82 0.08 0.00 0.02 0.00 0.00 54.97 54.33 1yko s GLU 69 Cb -0.09 -2.09 -0.03 0.00 0.10 0.00 0.00 34.13 32.02 1yko s GLU 69 CO -0.01 0.24 -0.22 0.14 0.02 0.00 0.00 175.26 175.44 1yko s VAL 70 N 0.16 2.52 -0.12 2.63 -7.23 -0.42 -0.90 120.40 117.05 1yko s VAL 70 Ca -0.12 -1.30 -0.03 0.00 -1.81 0.00 0.00 61.98 58.73 1yko s VAL 70 Cb -0.16 -2.04 0.04 0.00 0.56 0.00 0.00 36.38 34.79 1yko s VAL 70 CO 0.06 0.33 0.04 0.86 -0.31 0.00 0.00 175.10 176.08 1yko s TRP 71 N -0.89 0.50 0.05 2.82 -0.11 0.11 -2.48 118.94 118.95 1yko s TRP 71 Ca 0.14 -0.28 -0.04 0.00 1.22 0.00 0.00 56.10 57.14 1yko s TRP 71 Cb -0.10 -0.76 -0.02 0.00 -1.50 0.00 0.00 33.47 31.09 1yko s TRP 71 CO 0.04 -0.41 0.06 1.14 -4.62 0.00 0.00 176.95 173.16 1yko s GLN 72 N 2.03 0.63 0.66 5.86 -2.07 -0.31 -1.12 119.66 125.35 1yko s GLN 72 Ca 0.03 -0.96 -0.08 0.00 -1.82 0.00 0.00 55.36 52.53 1yko s GLN 72 Cb -0.14 0.24 0.02 0.00 -1.09 0.00 0.00 33.01 32.04 1yko s GLN 72 CO -0.06 -0.15 1.00 0.00 -1.32 0.00 0.00 175.29 174.76 1yko s ALA 73 N -3.28 3.10 0.97 2.60 0.00 -1.26 -4.48 121.76 119.41 1yko s ALA 73 Ca 0.01 -0.61 -0.02 0.00 0.00 0.00 0.00 51.96 51.33 1yko s ALA 73 Cb 0.03 -2.77 0.03 0.00 0.00 0.00 0.00 23.12 20.41 1yko s ALA 73 CO -0.08 -1.05 0.17 -0.40 0.00 0.00 0.00 175.76 174.40 1yko n ASP 74 N -2.83 0.02 0.25 0.00 5.68 0.33 -4.34 116.55 115.66 1yko n ASP 74 Ca 0.06 -1.07 0.11 0.00 -0.50 0.00 0.00 54.79 53.39 1yko n ASP 74 Cb 0.58 -0.13 0.65 0.00 -1.14 0.00 0.00 41.12 41.09 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 -1.90 1.31 -0.08 2.12 0.00 -1.82 0.46 119.26 119.35 1yko h ALA 75 Ca -0.05 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.72 1yko h ALA 75 Cb 0.15 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.92 1yko h ALA 75 CO 0.04 0.19 0.00 0.09 0.00 0.00 0.00 179.25 179.57 1yko n ASN 76 N -3.73 1.83 -0.65 0.00 3.02 -1.26 -3.99 115.26 110.49 1yko n ASN 76 Ca -0.02 -1.64 -0.02 0.00 -0.03 0.00 0.00 54.58 52.86 1yko n ASN 76 Cb 0.27 -0.04 0.01 0.00 -0.61 0.00 0.00 39.78 39.40 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 1.20 0.66 3.22 7.41 0.00 -0.66 -4.78 105.19 112.24 1yko n GLY 77 Ca 0.18 -0.65 -0.26 0.00 0.00 0.00 0.00 46.02 45.29 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 -4.84 1.48 -0.39 1.61 2.02 -1.26 -4.68 118.70 112.64 1yko s GLU 78 Ca 0.04 -0.82 -0.21 0.00 0.02 0.00 0.00 54.97 54.00 1yko s GLU 78 Cb -0.02 -1.51 0.01 0.00 0.10 0.00 0.00 34.13 32.72 1yko s GLU 78 CO 0.05 0.40 0.69 0.71 0.02 0.00 0.00 175.26 177.13 1yko s TYR 79 N -0.64 3.09 -0.84 1.61 1.51 -1.26 -0.52 117.35 120.31 1yko s TYR 79 Ca 0.07 0.26 -0.19 0.00 -1.01 0.00 0.00 57.07 56.20 1yko s TYR 79 Cb -0.08 -3.34 0.12 0.00 -0.11 0.00 0.00 41.96 38.55 1yko s TYR 79 CO 0.01 -0.77 1.04 -0.65 -1.11 0.00 0.00 175.55 174.06 1yko s GLN 80 N 2.92 3.46 0.20 -0.62 -1.52 -1.26 -4.87 119.66 117.96 1yko s GLN 80 Ca 0.26 -1.58 0.09 0.00 -1.95 0.00 0.00 55.36 52.18 1yko s GLN 80 Cb -0.14 -4.70 0.07 0.00 -0.22 0.00 0.00 33.01 28.02 1yko s GLN 80 CO 0.18 -1.73 1.44 0.38 -0.25 0.00 0.00 175.29 175.30 1yko h ASP 81 N 8.95 0.00 -0.76 5.90 2.03 -1.98 -3.23 116.42 127.33 1yko h ASP 81 Ca 0.03 0.00 -0.41 0.00 -0.73 0.00 0.00 57.03 55.92 1yko h ASP 81 Cb 1.04 0.00 -0.06 0.00 -0.83 0.00 0.00 39.33 39.48 1yko h ASP 81 CO 1.10 0.81 1.14 0.00 -1.03 0.00 0.00 179.24 181.25 1yko s ALA 82 N -3.13 2.10 0.03 4.15 0.00 -1.26 -4.94 121.76 118.71 1yko s ALA 82 Ca 0.00 -1.97 -0.30 0.00 0.00 0.00 0.00 51.96 49.69 1yko s ALA 82 Cb 0.11 -4.59 -0.07 0.00 0.00 0.00 0.00 23.12 18.57 1yko s ALA 82 CO 0.79 -4.49 1.57 -0.47 0.00 0.00 0.00 175.76 173.17 1yko s TYR 83 N 8.54 2.48 -0.20 0.00 5.04 -1.26 -4.99 117.35 126.97 1yko s TYR 83 Ca 0.63 0.46 -0.15 0.00 -2.44 0.00 0.00 57.07 55.56 1yko s TYR 83 Cb -0.03 -3.86 0.06 0.00 0.35 0.00 0.00 41.96 38.48 1yko s TYR 83 CO 0.01 -3.42 0.50 1.21 -1.34 0.00 0.00 175.55 172.52 1yko s ASN 84 N 2.40 -0.58 0.00 4.32 3.84 -1.26 -5.05 114.94 118.61 1yko s ASN 84 Ca 0.71 1.04 0.26 0.00 0.21 0.00 0.00 52.86 55.08 1yko s ASN 84 Cb -0.36 1.00 1.41 0.00 -0.55 0.00 0.00 41.25 42.74 1yko s ASN 84 CO 0.30 -0.19 1.89 0.18 -2.79 0.00 0.00 177.10 176.49 1yko n LEU 85 N 3.44 0.00 0.05 3.21 4.77 -1.26 -2.80 117.00 124.41 1yko n LEU 85 Ca -0.17 0.16 0.11 0.00 -0.03 0.00 0.00 56.01 56.09 1yko n LEU 85 Cb 0.56 -0.16 0.04 0.00 -2.33 0.00 0.00 43.42 41.52 1yko n LEU 85 CO 0.08 -0.03 0.03 -0.62 -1.33 0.00 0.00 177.39 175.52 1yko n GLU 86 N -1.16 0.39 -2.13 3.23 1.02 -1.26 -4.94 120.64 115.79 1yko n GLU 86 Ca 0.15 0.03 -0.38 0.00 -0.02 0.00 0.00 57.16 56.95 1yko n GLU 86 Cb 0.15 -1.67 0.00 0.00 -0.02 0.00 0.00 31.44 29.91 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 -4.39 5.99 0.39 1.62 0.01 -1.12 -4.94 114.94 112.50 1yko s ASN 87 Ca 0.02 2.44 0.20 0.00 -0.71 0.00 0.00 52.86 54.81 1yko s ASN 87 Cb 0.13 -2.61 0.73 0.00 0.41 0.00 0.00 41.25 39.90 1yko s ASN 87 CO 0.79 -1.05 1.75 0.00 -1.51 0.00 0.00 177.10 177.08 1yko h ALA 88 N 1.99 1.01 -3.43 0.60 0.00 -1.91 -3.44 119.26 114.08 1yko h ALA 88 Ca -0.50 -0.31 -0.20 0.00 0.00 0.00 0.00 54.91 53.90 1yko h ALA 88 Cb 1.26 -0.06 -0.27 0.00 0.00 0.00 0.00 17.79 18.73 1yko h ALA 88 CO 0.60 0.43 -0.57 0.12 0.00 0.00 0.00 179.25 179.83 1yko s PHE 89 N -3.64 -0.13 -0.06 0.00 5.36 -1.26 -0.96 117.98 117.30 1yko s PHE 89 Ca 0.00 0.33 0.02 0.00 -0.96 0.00 0.00 56.93 56.32 1yko s PHE 89 Cb 0.11 0.05 0.01 0.00 -0.34 0.00 0.00 43.02 42.85 1yko s PHE 89 CO 0.68 -0.07 -0.10 -0.80 -1.46 0.00 0.00 175.22 173.47 1yko s ASN 90 N 0.06 1.53 0.25 6.13 0.01 -0.45 -4.97 114.94 117.50 1yko s ASN 90 Ca -0.00 -0.25 0.25 0.00 -0.71 0.00 0.00 52.86 52.15 1yko s ASN 90 Cb -0.01 -0.69 0.91 0.00 0.41 0.00 0.00 41.25 41.87 1yko s ASN 90 CO 0.00 0.02 1.75 0.28 -1.51 0.00 0.00 177.10 177.64 1yko h SER 91 N 6.95 0.00 -3.18 -1.22 0.02 -1.78 -3.44 113.55 110.91 1yko h SER 91 Ca -0.33 0.00 -0.63 0.00 -0.84 0.00 0.00 61.79 59.99 1yko h SER 91 Cb 1.18 0.00 -0.14 0.00 0.14 0.00 0.00 62.40 63.58 1yko h SER 91 CO 0.48 0.00 -0.71 0.12 -1.14 0.00 0.00 176.83 175.58 1yko s PHE 92 N -3.24 2.75 -0.05 3.45 5.36 -1.26 -1.16 117.98 123.84 1yko s PHE 92 Ca 0.07 -0.16 -0.30 0.00 -0.96 0.00 0.00 56.93 55.57 1yko s PHE 92 Cb 0.10 -1.38 0.11 0.00 -0.34 0.00 0.00 43.02 41.52 1yko s PHE 92 CO 0.49 0.48 1.03 0.20 -1.46 0.00 0.00 175.22 175.96 1yko s GLY 93 N -2.62 -0.38 0.09 13.12 0.00 -1.03 -4.80 107.32 111.70 1yko s GLY 93 Ca 0.24 1.07 0.06 0.00 0.00 0.00 0.00 44.72 46.09 1yko s GLY 93 CO 0.16 0.34 -0.14 0.50 0.00 0.00 0.00 173.10 173.95 1yko s ARG 94 N -2.86 0.91 0.22 2.90 0.52 -0.94 -1.30 118.95 118.40 1yko s ARG 94 Ca 0.08 -1.08 -0.10 0.00 -0.52 0.00 0.00 55.73 54.11 1yko s ARG 94 Cb -0.01 -0.88 -0.01 0.00 0.52 0.00 0.00 34.95 34.58 1yko s ARG 94 CO -0.06 0.18 0.39 -0.08 0.02 0.00 0.00 175.30 175.76 1yko s THR 95 N -1.61 0.01 0.18 0.02 -1.32 -0.09 -1.65 115.64 111.19 1yko s THR 95 Ca 0.03 -1.47 -0.20 0.00 -1.21 0.00 0.00 61.69 58.83 1yko s THR 95 Cb -0.08 -2.16 0.05 0.00 -1.51 0.00 0.00 72.50 68.79 1yko s THR 95 CO 0.03 -0.06 0.57 0.00 -2.21 0.00 0.00 174.62 172.95 1yko s ALA 96 N -4.03 -1.26 -0.14 11.08 0.00 -1.26 -0.89 121.76 125.26 1yko s ALA 96 Ca 0.24 0.09 -0.03 0.00 0.00 0.00 0.00 51.96 52.26 1yko s ALA 96 Cb 0.01 0.85 -0.02 0.00 0.00 0.00 0.00 23.12 23.95 1yko s ALA 96 CO 0.07 -0.80 -0.06 0.95 0.00 0.00 0.00 175.76 175.92 1yko s THR 97 N -3.82 3.69 0.51 0.00 -4.23 -0.84 -4.20 115.64 106.75 1yko s THR 97 Ca 0.05 -0.43 0.05 0.00 -1.18 0.00 0.00 61.69 60.17 1yko s THR 97 Cb -0.01 -2.60 0.01 0.00 1.34 0.00 0.00 72.50 71.24 1yko s THR 97 CO -0.07 0.51 0.27 0.42 -0.54 0.00 0.00 174.62 175.21 1yko s THR 98 N 0.29 1.69 0.23 3.99 -4.23 0.25 -3.77 115.64 114.10 1yko s THR 98 Ca -0.05 -1.64 0.18 0.00 -1.18 0.00 0.00 61.69 59.00 1yko s THR 98 Cb -0.14 -2.33 0.12 0.00 1.34 0.00 0.00 72.50 71.48 1yko s THR 98 CO 0.04 0.00 1.76 -0.26 -0.54 0.00 0.00 174.62 175.61 1yko h PHE 99 N 1.02 0.00 0.14 3.99 0.04 -1.95 -2.29 116.94 117.89 1yko h PHE 99 Ca -0.40 0.00 -0.19 0.00 2.80 0.00 0.00 57.97 60.18 1yko h PHE 99 Cb 1.30 0.00 0.02 0.00 2.20 0.00 0.00 35.95 39.47 1yko h PHE 99 CO 1.03 0.39 -0.83 -0.44 -0.60 0.00 0.00 178.31 177.85 1yko h ASP 100 N 0.00 0.48 -4.04 2.17 3.32 -1.95 -3.39 116.42 113.00 1yko h ASP 100 Ca -0.00 -0.95 -0.63 0.00 0.02 0.00 0.00 57.03 55.46 1yko h ASP 100 Cb 0.84 -0.16 -0.41 0.00 0.22 0.00 0.00 39.33 39.82 1yko h ASP 100 CO 0.05 1.40 -0.62 0.00 -1.72 0.00 0.00 179.24 178.35 1yko s ALA 101 N -2.44 3.42 -1.46 3.45 0.00 -1.18 -4.95 121.76 118.61 1yko s ALA 101 Ca -0.13 -3.41 0.00 0.00 0.00 0.00 0.00 51.96 48.41 1yko s ALA 101 Cb 0.01 -2.16 0.00 0.00 0.00 0.00 0.00 23.12 20.97 1yko s ALA 101 CO 0.83 -2.04 0.53 0.41 0.00 0.00 0.00 175.76 175.49 1yko n GLY 102 N 2.82 0.25 2.94 0.00 0.00 -0.87 0.85 105.19 111.18 1yko n GLY 102 Ca 0.09 0.00 -0.19 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 -1.46 0.77 0.28 1.61 2.12 -1.26 -4.63 118.70 116.14 1yko s GLU 103 Ca 0.00 -0.18 -0.05 0.00 0.36 0.00 0.00 54.97 55.10 1yko s GLU 103 Cb 0.00 -0.76 -0.05 0.00 0.26 0.00 0.00 34.13 33.58 1yko s GLU 103 CO 0.00 0.02 0.54 1.67 -0.54 0.00 0.00 175.26 176.96 1yko s TRP 104 N 0.46 3.48 0.06 5.30 1.48 -0.92 -4.72 118.94 124.07 1yko s TRP 104 Ca -0.06 0.63 0.03 0.00 -1.06 0.00 0.00 56.10 55.64 1yko s TRP 104 Cb -0.10 -2.09 -0.03 0.00 -1.16 0.00 0.00 33.47 30.09 1yko s TRP 104 CO 0.00 0.19 -0.09 0.95 -4.06 0.00 0.00 176.95 173.94 1yko s THR 105 N -2.06 0.71 -0.12 0.66 -4.23 -1.26 -2.78 115.64 106.56 1yko s THR 105 Ca 0.44 -1.24 -0.06 0.00 -1.18 0.00 0.00 61.69 59.65 1yko s THR 105 Cb -0.11 -0.85 0.05 0.00 1.34 0.00 0.00 72.50 72.94 1yko s THR 105 CO 0.30 -0.40 0.27 -0.22 -0.54 0.00 0.00 174.62 174.03 1yko s LEU 106 N -1.79 0.27 -0.32 4.79 2.96 0.63 -4.83 118.68 120.39 1yko s LEU 106 Ca -0.05 0.59 -0.09 0.00 -0.22 0.00 0.00 54.13 54.35 1yko s LEU 106 Cb -0.08 0.82 0.01 0.00 0.50 0.00 0.00 46.19 47.43 1yko s LEU 106 CO 0.00 -0.18 0.14 -1.00 -1.32 0.00 0.00 176.35 174.00 1yko s HIS 107 N 1.40 3.19 0.13 5.38 3.76 -0.28 -0.26 115.29 128.61 1yko s HIS 107 Ca -0.08 -0.78 -0.02 0.00 -0.15 0.00 0.00 55.06 54.03 1yko s HIS 107 Cb -0.10 -2.35 0.01 0.00 1.11 0.00 0.00 32.58 31.25 1yko s HIS 107 CO -0.09 -0.53 0.20 -2.37 -0.85 0.00 0.00 174.74 171.10 1yko n THR 108 N 4.95 0.00 -4.27 1.30 5.66 -0.94 -1.25 114.28 119.73 1yko n THR 108 Ca -0.14 -0.56 -0.26 0.00 -3.05 0.00 0.00 64.05 60.05 1yko n THR 108 Cb 0.48 0.38 -0.08 0.00 -1.55 0.00 0.00 70.33 69.56 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 3.41 0.05 1.08 -7.23 -1.26 -0.58 120.40 113.26 1yko s VAL 109 Ca 0.09 -1.65 -0.31 0.00 -1.81 0.00 0.00 61.98 58.31 1yko s VAL 109 Cb -0.01 -2.73 -0.07 0.00 0.56 0.00 0.00 36.38 34.13 1yko s VAL 109 CO 0.07 -0.17 1.47 -0.75 -0.31 0.00 0.00 175.10 175.40 1yko s LYS 110 N -3.06 4.27 0.66 4.82 2.20 -0.73 -4.86 119.74 123.03 1yko s LYS 110 Ca 0.27 2.09 -0.16 0.00 -0.36 0.00 0.00 55.97 57.82 1yko s LYS 110 Cb -0.08 -3.50 0.00 0.00 -1.51 0.00 0.00 37.83 32.74 1yko s LYS 110 CO 0.17 -0.59 1.14 -1.25 -0.36 0.00 0.00 175.35 174.46 1yko s PRO 111 N 2.16 2.71 0.48 4.03 0.04 -1.26 -4.17 135.00 139.00 1yko s PRO 111 Ca 0.67 1.51 -0.04 0.00 0.04 0.00 0.00 61.00 63.18 1yko s PRO 111 Cb -0.35 -1.93 0.10 0.00 0.04 0.00 0.00 34.50 32.36 1yko s PRO 111 CO 0.29 -1.34 0.66 0.41 0.04 0.00 0.00 177.00 177.06 1yko n GLY 112 N -0.20 -0.02 3.75 0.56 0.00 0.15 -4.74 105.19 104.69 1yko n GLY 112 Ca 0.11 -1.89 -0.39 0.00 0.00 0.00 0.00 46.02 43.85 1yko n GLY 112 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1yko s VAL 113 N -2.08 4.79 0.04 1.61 1.01 -1.26 -4.61 120.40 119.90 1yko s VAL 113 Ca 0.41 1.49 0.06 0.00 0.00 0.00 0.00 61.98 63.94 1yko s VAL 113 Cb -0.02 -4.05 -0.02 0.00 0.00 0.00 0.00 36.38 32.29 1yko s VAL 113 CO 0.28 0.39 -0.17 0.68 0.00 0.00 0.00 175.10 176.28 1yko s VAL 114 N -0.13 1.33 0.38 2.92 -7.23 -1.26 -4.52 120.40 111.91 1yko s VAL 114 Ca 0.36 -1.08 -0.07 0.00 -1.81 0.00 0.00 61.98 59.38 1yko s VAL 114 Cb -0.20 -1.18 -0.05 0.00 0.56 0.00 0.00 36.38 35.50 1yko s VAL 114 CO 0.21 0.09 0.70 0.20 -0.31 0.00 0.00 175.10 175.99 1yko s ASN 115 N -1.15 6.44 0.73 4.85 -0.87 -1.26 -1.16 114.94 122.52 1yko s ASN 115 Ca 0.04 0.95 -0.02 0.00 -1.57 0.00 0.00 52.86 52.26 1yko s ASN 115 Cb -0.08 -2.25 0.06 0.00 -0.02 0.00 0.00 41.25 38.96 1yko s ASN 115 CO 0.01 -0.37 0.35 -0.46 -2.57 0.00 0.00 177.10 174.07 1yko n ASN 116 N -1.39 0.24 -0.10 -1.22 6.94 -0.09 -4.88 115.26 114.76 1yko n ASN 116 Ca 0.01 -1.26 0.02 0.00 -0.02 0.00 0.00 54.58 53.33 1yko n ASN 116 Cb 0.54 -0.25 0.33 0.00 -2.36 0.00 0.00 39.78 38.04 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 -1.16 1.55 -0.00 -2.53 0.00 -1.99 -2.22 119.26 112.90 1yko h ALA 117 Ca -0.12 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.73 1yko h ALA 117 Cb 0.37 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 17.93 1yko h ALA 117 CO 0.10 0.39 -0.00 0.00 0.00 0.00 0.00 179.25 179.74 1yko n ALA 118 N -2.45 2.67 -0.65 0.00 0.00 -1.26 -4.90 120.51 113.92 1yko n ALA 118 Ca 0.05 -0.23 0.00 0.00 0.00 0.00 0.00 53.44 53.26 1yko n ALA 118 Cb 0.07 -1.48 0.00 0.00 0.00 0.00 0.00 19.45 18.04 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 1.03 0.79 3.70 0.00 0.00 -0.83 -5.05 105.19 104.83 1yko n GLY 119 Ca 0.23 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.84 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 -2.98 4.93 0.21 1.61 1.01 -1.26 -4.73 120.40 119.19 1yko s VAL 120 Ca 0.00 1.73 -0.30 0.00 0.00 0.00 0.00 61.98 63.41 1yko s VAL 120 Cb 0.00 -4.17 -0.09 0.00 0.00 0.00 0.00 36.38 32.12 1yko s VAL 120 CO 0.00 0.15 1.33 -2.16 0.00 0.00 0.00 175.10 174.42 1yko s PRO 121 N 1.28 4.37 0.15 2.72 0.04 -1.26 -0.91 135.00 141.39 1yko s PRO 121 Ca 0.43 2.09 -0.01 0.00 0.04 0.00 0.00 61.00 63.56 1yko s PRO 121 Cb -0.19 -3.18 -0.04 0.00 0.04 0.00 0.00 34.50 31.14 1yko s PRO 121 CO 0.20 -0.27 0.33 -1.64 0.04 0.00 0.00 177.00 175.66 1yko s MET 122 N -0.24 3.51 0.57 4.56 -1.94 -0.31 -4.46 119.30 121.00 1yko s MET 122 Ca 0.57 -0.36 -0.17 0.00 -1.71 0.00 0.00 55.69 54.01 1yko s MET 122 Cb -0.37 -2.90 -0.04 0.00 2.01 0.00 0.00 34.83 33.52 1yko s MET 122 CO 0.40 0.48 1.08 0.00 -0.01 0.00 0.00 175.02 176.96 1yko s ALA 123 N -1.74 2.70 -0.28 3.03 0.00 -1.26 -4.11 121.76 120.11 1yko s ALA 123 Ca 0.38 0.57 -0.36 0.00 0.00 0.00 0.00 51.96 52.54 1yko s ALA 123 Cb -0.12 -3.28 -0.12 0.00 0.00 0.00 0.00 23.12 19.60 1yko s ALA 123 CO 0.28 -0.79 2.04 -2.30 0.00 0.00 0.00 175.76 174.99 1yko n PRO 124 N -1.71 1.34 -4.15 0.00 -0.02 -1.26 -4.89 135.00 124.30 1yko n PRO 124 Ca 0.10 0.43 -0.11 0.00 -2.02 0.00 0.00 63.50 61.90 1yko n PRO 124 Cb 0.52 -2.45 -0.10 0.00 -0.02 0.00 0.00 33.50 31.45 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 5.95 0.84 -0.14 6.00 -3.43 -1.26 -4.20 115.29 119.05 1yko s HIS 125 Ca 1.04 -0.89 0.01 0.00 -0.80 0.00 0.00 55.06 54.42 1yko s HIS 125 Cb -0.85 -0.50 0.02 0.00 -1.43 0.00 0.00 32.58 29.82 1yko s HIS 125 CO 0.53 -0.16 -0.17 0.42 -2.00 0.00 0.00 174.74 173.36 1yko s ILE 126 N -3.43 1.72 -0.07 -5.38 1.01 -0.87 -4.61 121.20 109.57 1yko s ILE 126 Ca 0.09 -0.75 -0.27 0.00 0.00 0.00 0.00 60.65 59.72 1yko s ILE 126 Cb 0.04 -1.56 -0.02 0.00 0.01 0.00 0.00 42.46 40.92 1yko s ILE 126 CO -0.05 0.48 0.88 0.20 0.00 0.00 0.00 174.94 176.46 1yko s ASN 127 N 1.16 7.16 0.02 3.58 0.01 -0.27 -1.19 114.94 125.40 1yko s ASN 127 Ca -0.01 1.41 0.08 0.00 -0.71 0.00 0.00 52.86 53.62 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 -0.06 -0.29 -0.23 -0.63 -1.51 0.00 0.00 177.10 174.38 1yko s ILE 128 N 1.39 1.84 -0.14 0.60 1.01 -0.21 -0.71 121.20 124.98 1yko s ILE 128 Ca 0.45 -1.15 0.01 0.00 0.00 0.00 0.00 60.65 59.95 1yko s ILE 128 Cb -0.19 -1.56 0.02 0.00 0.01 0.00 0.00 42.46 40.74 1yko s ILE 128 CO 0.20 0.37 -0.16 -0.44 0.00 0.00 0.00 174.94 174.91 1yko s SER 129 N -0.93 2.68 -0.21 3.58 0.01 -0.08 -1.43 113.70 117.33 1yko s SER 129 Ca 0.09 -0.49 -0.07 0.00 1.31 0.00 0.00 55.95 56.79 1yko s SER 129 Cb -0.09 -1.20 -0.04 0.00 0.21 0.00 0.00 66.02 64.90 1yko s SER 129 CO 0.01 -0.01 0.07 -0.22 0.41 0.00 0.00 173.24 173.49 1yko s LEU 130 N 1.23 3.67 0.08 2.44 2.96 0.71 -1.62 118.68 128.15 1yko s LEU 130 Ca -0.00 -0.03 0.08 0.00 -0.22 0.00 0.00 54.13 53.96 1yko s LEU 130 Cb -0.14 -1.95 -0.03 0.00 0.50 0.00 0.00 46.19 44.57 1yko s LEU 130 CO -0.07 0.10 -0.21 -0.36 -1.32 0.00 0.00 176.35 174.49 1yko s PHE 131 N 0.84 1.79 -0.06 5.38 0.40 0.44 -1.90 117.98 124.87 1yko s PHE 131 Ca 0.04 -0.40 -0.31 0.00 -0.60 0.00 0.00 56.93 55.66 1yko s PHE 131 Cb -0.14 -1.02 0.13 0.00 0.51 0.00 0.00 43.02 42.50 1yko s PHE 131 CO 0.02 0.16 1.36 0.00 0.70 0.00 0.00 175.22 177.46 1yko s ALA 132 N -1.00 -2.44 0.21 5.36 0.00 -1.26 0.02 121.76 122.64 1yko s ALA 132 Ca 0.07 0.67 -0.30 0.00 0.00 0.00 0.00 51.96 52.40 1yko s ALA 132 Cb -0.09 0.43 -0.08 0.00 0.00 0.00 0.00 23.12 23.38 1yko s ALA 132 CO 0.03 -1.08 1.18 -0.98 0.00 0.00 0.00 175.76 174.91 1yko s ARG 133 N -2.16 4.51 0.00 0.00 1.70 -1.26 -2.54 118.95 119.21 1yko s ARG 133 Ca 0.18 1.88 0.00 0.00 -0.47 0.00 0.00 55.73 57.32 1yko s ARG 133 Cb 0.05 -3.22 0.00 0.00 -0.57 0.00 0.00 34.95 31.21 1yko s ARG 133 CO -0.05 -0.04 0.00 0.41 -1.08 0.00 0.00 175.30 174.55 1yko n GLY 134 N 1.95 0.72 3.17 3.88 0.00 -1.26 -4.99 105.19 108.66 1yko n GLY 134 Ca 0.03 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.67 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 -2.19 3.68 0.16 -0.61 1.01 -1.05 -4.97 121.20 117.21 1yko s ILE 135 Ca 0.00 -1.83 -0.12 0.00 0.00 0.00 0.00 60.65 58.70 1yko s ILE 135 Cb 0.00 -3.42 0.05 0.00 0.01 0.00 0.00 42.46 39.10 1yko s ILE 135 CO 0.00 -0.65 1.67 0.78 0.00 0.00 0.00 174.94 176.74 1yko h ASN 136 N 8.22 0.83 -3.41 3.58 2.35 -1.90 -3.36 115.58 121.88 1yko h ASN 136 Ca -0.17 -0.24 -0.48 0.00 -0.55 0.00 0.00 56.30 54.86 1yko h ASN 136 Cb 1.06 -0.22 -0.34 0.00 0.05 0.00 0.00 38.32 38.87 1yko h ASN 136 CO 0.74 0.85 -0.80 -0.51 -1.65 0.00 0.00 177.43 176.07 1yko s ILE 137 N -5.29 0.90 0.55 2.81 2.07 -1.26 -3.15 121.20 117.83 1yko s ILE 137 Ca -0.13 -0.33 -0.19 0.00 -1.41 0.00 0.00 60.65 58.60 1yko s ILE 137 Cb 0.12 -0.86 -0.08 0.00 0.13 0.00 0.00 42.46 41.78 1yko s ILE 137 CO 0.81 0.31 0.75 0.00 -1.91 0.00 0.00 174.94 174.89 1yko n HIS 138 N 4.00 0.10 -3.85 3.50 1.44 -1.26 -4.99 115.22 114.16 1yko n HIS 138 Ca -0.23 0.47 -0.36 0.00 -2.01 0.00 0.00 57.72 55.59 1yko n HIS 138 Cb 0.51 -2.06 -0.08 0.00 0.12 0.00 0.00 29.99 28.49 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 -0.34 4.19 -0.10 2.39 1.43 -0.80 -4.90 118.68 120.56 1yko s LEU 139 Ca 0.70 0.29 -0.06 0.00 -1.03 0.00 0.00 54.13 54.03 1yko s LEU 139 Cb -0.46 -2.05 -0.04 0.00 0.03 0.00 0.00 46.19 43.67 1yko s LEU 139 CO 0.52 0.27 0.14 -1.00 0.23 0.00 0.00 176.35 176.52 1yko s HIS 140 N -0.20 3.58 0.29 0.29 3.76 -1.26 -0.21 115.29 121.55 1yko s HIS 140 Ca 0.10 0.49 -0.18 0.00 -0.15 0.00 0.00 55.06 55.32 1yko s HIS 140 Cb -0.12 -1.92 0.02 0.00 1.11 0.00 0.00 32.58 31.68 1yko s HIS 140 CO 0.01 0.72 0.67 -0.08 -0.85 0.00 0.00 174.74 175.21 1yko s THR 141 N -1.08 0.00 0.05 1.30 -1.32 -0.51 -0.89 115.64 113.19 1yko s THR 141 Ca 0.17 -1.10 0.06 0.00 -1.21 0.00 0.00 61.69 59.61 1yko s THR 141 Cb -0.12 -2.21 -0.03 0.00 -1.51 0.00 0.00 72.50 68.63 1yko s THR 141 CO 0.07 0.00 -0.16 -0.13 -2.21 0.00 0.00 174.62 172.18 1yko s ARG 142 N -3.64 1.03 -0.27 7.08 0.52 -1.26 -1.05 118.95 121.37 1yko s ARG 142 Ca 0.15 -0.89 -0.05 0.00 -0.52 0.00 0.00 55.73 54.42 1yko s ARG 142 Cb -0.05 -1.10 0.01 0.00 0.52 0.00 0.00 34.95 34.33 1yko s ARG 142 CO 0.09 0.27 0.02 -1.17 0.02 0.00 0.00 175.30 174.52 1yko s LEU 143 N -1.36 3.48 0.30 2.53 0.20 -0.34 -4.72 118.68 118.78 1yko s LEU 143 Ca 0.03 -0.69 0.08 0.00 0.69 0.00 0.00 54.13 54.23 1yko s LEU 143 Cb -0.09 -1.79 -0.03 0.00 -0.43 0.00 0.00 46.19 43.85 1yko s LEU 143 CO 0.02 -0.14 0.20 -0.31 -0.29 0.00 0.00 176.35 175.83 1yko s TYR 144 N 1.44 2.91 -0.09 5.38 1.51 0.96 -2.04 117.35 127.42 1yko s TYR 144 Ca 0.02 -0.25 -0.01 0.00 -1.01 0.00 0.00 57.07 55.83 1yko s TYR 144 Cb -0.16 -1.58 -0.03 0.00 -0.11 0.00 0.00 41.96 40.08 1yko s TYR 144 CO -0.01 0.37 -0.04 -0.06 -1.11 0.00 0.00 175.55 174.70 1yko s PHE 145 N -2.28 3.02 0.25 2.71 0.40 -1.26 0.21 117.98 121.03 1yko s PHE 145 Ca 0.37 0.02 0.31 0.00 -0.60 0.00 0.00 56.93 57.02 1yko s PHE 145 Cb -0.06 -1.78 1.38 0.00 0.51 0.00 0.00 43.02 43.08 1yko s PHE 145 CO 0.25 0.31 2.00 0.38 0.70 0.00 0.00 175.22 178.86 1yko h ASP 146 N 5.47 0.00 -0.34 1.36 2.03 -1.80 -2.70 116.42 120.44 1yko h ASP 146 Ca -0.46 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 55.84 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 0.55 0.09 0.00 -0.90 -1.03 0.00 0.00 179.24 177.95 1yko n ASP 147 N -3.30 2.33 -1.89 4.15 5.75 -1.26 -3.66 116.55 118.66 1yko n ASP 147 Ca -0.01 -2.13 -0.18 0.00 -0.01 0.00 0.00 54.79 52.46 1yko n ASP 147 Cb 0.30 -0.34 0.05 0.00 -1.03 0.00 0.00 41.12 40.09 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 0.48 3.16 -0.34 0.11 -0.58 -1.02 -4.88 120.64 117.56 1yko n GLU 148 Ca 0.12 -3.98 0.12 0.00 -0.42 0.00 0.00 57.16 53.01 1yko n GLU 148 Cb 0.42 -2.11 0.31 0.00 -0.57 0.00 0.00 31.44 29.49 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 2.04 1.62 -0.34 0.62 0.00 -1.76 -0.48 119.26 120.97 1yko h ALA 149 Ca 0.27 0.08 -0.05 0.00 0.00 0.00 0.00 54.91 55.22 1yko h ALA 149 Cb 1.45 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 19.17 1yko h ALA 149 CO 0.61 -0.07 0.03 1.96 0.00 0.00 0.00 179.25 181.78 1yko h GLN 150 N 0.73 0.58 -0.10 0.00 4.20 -1.93 -2.61 115.11 115.98 1yko h GLN 150 Ca 0.57 -0.17 -0.19 0.00 0.06 0.00 0.00 58.65 58.92 1yko h GLN 150 Cb 0.88 -0.06 -0.00 0.00 0.30 0.00 0.00 27.48 28.60 1yko h GLN 150 CO -0.39 0.68 -0.71 0.00 -0.67 0.00 0.00 178.83 177.75 1yko h ALA 151 N 0.87 0.58 -0.01 3.87 0.00 -1.85 -3.17 119.26 119.54 1yko h ALA 151 Ca 0.10 -0.59 -0.05 0.00 0.00 0.00 0.00 54.91 54.37 1yko h ALA 151 Cb 0.41 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 1yko h ALA 151 CO 0.01 0.74 -0.22 -0.91 0.00 0.00 0.00 179.25 178.88 1yko h ASN 152 N 0.33 0.02 1.75 0.00 2.35 -1.06 -1.56 115.58 117.41 1yko h ASN 152 Ca -0.03 -0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.72 1yko h ASN 152 Cb 1.29 -0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.65 1yko h ASN 152 CO 0.13 0.23 0.00 0.00 -1.65 0.00 0.00 177.43 176.14 1yko h ALA 153 N 1.77 1.00 0.00 -0.83 0.00 -1.44 -3.27 119.26 116.49 1yko h ALA 153 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1yko h ALA 153 Cb 0.39 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.18 1yko h ALA 153 CO 0.03 0.00 -1.27 1.63 0.00 0.00 0.00 179.25 179.63 1yko n LYS 154 N -3.04 0.68 -1.67 0.00 4.76 -0.84 -4.98 118.16 113.07 1yko n LYS 154 Ca 0.03 -0.07 -0.43 0.00 -2.87 0.00 0.00 58.31 54.97 1yko n LYS 154 Cb 0.47 -1.42 -0.03 0.00 -1.84 0.00 0.00 35.03 32.21 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 9.64 0.00 0.07 0.00 0.13 -1.92 -2.17 132.00 137.75 1yko h PRO 156 Ca -0.49 0.00 -0.19 0.00 -0.87 0.00 0.00 66.00 64.46 1yko h PRO 156 Cb 1.24 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.37 1yko h PRO 156 CO 0.94 0.07 -0.94 0.28 -0.23 0.00 0.00 178.00 178.12 1yko h VAL 157 N 0.00 1.28 0.00 1.56 2.07 -1.95 -3.32 116.25 115.90 1yko h VAL 157 Ca -0.00 -2.38 -0.04 0.00 0.82 0.00 0.00 66.70 65.10 1yko h VAL 157 Cb 0.29 2.88 -0.01 0.00 -1.52 0.00 0.00 31.29 32.93 1yko h VAL 157 CO 0.01 0.62 -0.20 0.25 0.02 0.00 0.00 177.57 178.27 1yko h LEU 158 N -0.60 0.00 -0.39 2.57 5.85 -1.88 -2.15 115.31 118.71 1yko h LEU 158 Ca -0.21 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.51 1yko h LEU 158 Cb 1.48 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.51 1yko h LEU 158 CO 0.02 0.20 0.00 0.59 -0.34 0.00 0.00 178.44 178.90 1yko n ASN 159 N -4.01 0.60 0.04 1.25 3.02 -0.83 -3.18 115.26 112.16 1yko n ASN 159 Ca -0.02 -1.29 0.12 0.00 -0.03 0.00 0.00 54.58 53.36 1yko n ASN 159 Cb 0.28 -0.01 0.29 0.00 -0.61 0.00 0.00 39.78 39.73 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 -0.49 0.56 -4.53 3.41 4.77 -0.81 -4.66 117.00 115.25 1yko n LEU 160 Ca 0.20 0.27 -0.43 0.00 -0.03 0.00 0.00 56.01 56.02 1yko n LEU 160 Cb 0.19 -0.27 -0.05 0.00 -2.33 0.00 0.00 43.42 40.97 1yko n LEU 160 CO 0.16 -0.02 0.63 -0.63 -1.33 0.00 0.00 177.39 176.20 1yko s ILE 161 N -3.09 4.56 0.17 -0.08 1.01 -1.19 -4.96 121.20 117.61 1yko s ILE 161 Ca 0.09 0.37 -0.24 0.00 0.00 0.00 0.00 60.65 60.88 1yko s ILE 161 Cb 0.15 -4.40 0.06 0.00 0.01 0.00 0.00 42.46 38.27 1yko s ILE 161 CO 0.67 -0.86 1.58 -0.33 0.00 0.00 0.00 174.94 176.00 1yko h GLU 162 N 9.10 -0.24 -5.68 2.79 5.08 -1.89 -3.41 114.58 120.32 1yko h GLU 162 Ca -0.25 0.02 -0.59 0.00 -1.00 0.00 0.00 59.36 57.53 1yko h GLU 162 Cb 1.08 0.05 -0.09 0.00 0.50 0.00 0.00 28.75 30.29 1yko h GLU 162 CO 1.01 -0.16 0.11 -0.65 -1.00 0.00 0.00 179.01 178.32 1yko s GLN 163 N -5.93 4.23 0.53 2.33 -1.52 -1.26 -4.98 119.66 113.06 1yko s GLN 163 Ca -0.15 0.62 0.19 0.00 -1.95 0.00 0.00 55.36 54.08 1yko s GLN 163 Cb 0.14 -3.57 1.38 0.00 -0.22 0.00 0.00 33.01 30.74 1yko s GLN 163 CO 0.67 -0.21 2.16 -1.35 -0.25 0.00 0.00 175.29 176.32 1yko h PRO 164 N 7.41 0.00 0.00 2.91 0.11 -1.98 -2.56 132.00 137.88 1yko h PRO 164 Ca -0.32 0.00 -0.04 0.00 0.11 0.00 0.00 66.00 65.75 1yko h PRO 164 Cb 1.15 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.25 1yko h PRO 164 CO 0.77 0.00 -0.19 1.96 -0.21 0.00 0.00 178.00 180.34 1yko h GLN 165 N 0.00 0.00 0.00 1.05 7.50 -1.96 -2.67 115.11 119.03 1yko h GLN 165 Ca 0.01 0.00 -0.15 0.00 0.50 0.00 0.00 58.65 59.01 1yko h GLN 165 Cb 0.05 0.00 -0.02 0.00 0.05 0.00 0.00 27.48 27.56 1yko h GLN 165 CO -0.00 0.19 -0.89 0.00 -1.50 0.00 0.00 178.83 176.63 1yko h ARG 166 N 0.00 0.00 -0.08 1.46 3.08 -1.85 -3.31 114.38 113.68 1yko h ARG 166 Ca -0.00 0.00 -0.08 0.00 0.07 0.00 0.00 59.98 59.97 1yko h ARG 166 Cb 0.59 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.63 1yko h ARG 166 CO 0.02 0.54 -0.33 0.00 -1.07 0.00 0.00 179.97 179.14 1yko h ARG 167 N 0.00 0.16 0.00 0.04 3.08 -1.49 -2.98 114.38 113.19 1yko h ARG 167 Ca -0.06 -0.06 -0.01 0.00 0.07 0.00 0.00 59.98 59.92 1yko h ARG 167 Cb 1.54 -0.01 -0.00 0.00 0.08 0.00 0.00 29.97 31.58 1yko h ARG 167 CO 0.07 0.47 -0.05 0.93 -1.07 0.00 0.00 179.97 180.32 1yko h GLU 168 N 0.14 0.00 0.00 0.04 5.08 -1.63 -2.48 114.58 115.73 1yko h GLU 168 Ca 0.02 0.00 -0.07 0.00 -1.00 0.00 0.00 59.36 58.31 1yko h GLU 168 Cb 0.65 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.89 1yko h GLU 168 CO 0.05 0.05 -0.32 1.79 -1.00 0.00 0.00 179.01 179.58 1yko h THR 169 N 0.00 0.89 -0.01 1.13 1.35 -1.71 -2.58 112.91 111.98 1yko h THR 169 Ca -0.00 -1.28 0.00 0.00 -0.55 0.00 0.00 66.41 64.58 1yko h THR 169 Cb 0.15 1.77 0.00 0.00 -1.73 0.00 0.00 68.15 68.34 1yko h THR 169 CO 0.01 0.32 -0.01 0.18 -0.25 0.00 0.00 175.52 175.77 1yko n LEU 170 N -3.66 1.16 -4.66 3.87 4.77 -0.93 -4.85 117.00 112.71 1yko n LEU 170 Ca -0.01 -0.38 -0.36 0.00 -0.03 0.00 0.00 56.01 55.23 1yko n LEU 170 Cb 0.44 -0.00 -0.09 0.00 -2.33 0.00 0.00 43.42 41.43 1yko n LEU 170 CO 0.36 0.19 -0.19 -0.63 -1.33 0.00 0.00 177.39 175.79 1yko s ILE 171 N -2.01 5.25 -0.13 -0.08 1.01 -0.97 -0.03 121.20 124.23 1yko s ILE 171 Ca 0.40 0.14 -0.20 0.00 0.00 0.00 0.00 60.65 60.99 1yko s ILE 171 Cb 0.21 -3.43 -0.04 0.00 0.01 0.00 0.00 42.46 39.21 1yko s ILE 171 CO 0.35 0.37 0.55 0.00 0.00 0.00 0.00 174.94 176.21 1yko s ALA 172 N 0.91 3.47 -0.03 9.38 0.00 0.13 -4.92 121.76 130.70 1yko s ALA 172 Ca 0.07 -0.18 -0.29 0.00 0.00 0.00 0.00 51.96 51.56 1yko s ALA 172 Cb -0.13 -2.78 -0.03 0.00 0.00 0.00 0.00 23.12 20.18 1yko s ALA 172 CO 0.03 -0.18 0.97 0.15 0.00 0.00 0.00 175.76 176.73 1yko s LYS 173 N 1.02 4.51 -0.01 0.00 1.02 -0.93 -2.21 119.74 123.14 1yko s LYS 173 Ca 0.28 1.37 -0.30 0.00 0.02 0.00 0.00 55.97 57.34 1yko s LYS 173 Cb -0.16 -3.48 -0.04 0.00 -0.52 0.00 0.00 37.83 33.63 1yko s LYS 173 CO 0.12 -0.12 1.23 0.50 -0.92 0.00 0.00 175.35 176.16 1yko s ARG 174 N 1.28 4.37 0.16 1.68 3.52 -1.26 -0.82 118.95 127.87 1yko s ARG 174 Ca 0.50 1.75 0.03 0.00 -0.13 0.00 0.00 55.73 57.88 1yko s ARG 174 Cb -0.20 -3.49 -0.01 0.00 -1.56 0.00 0.00 34.95 29.68 1yko s ARG 174 CO 0.25 -0.41 0.12 0.00 -0.81 0.00 0.00 175.30 174.45 1yko s GLU 176 N -2.64 0.78 -0.25 0.00 2.02 -1.26 -1.61 118.70 115.75 1yko s GLU 176 Ca 0.17 -0.05 0.02 0.00 0.02 0.00 0.00 54.97 55.13 1yko s GLU 176 Cb 0.01 -0.89 0.06 0.00 0.10 0.00 0.00 34.13 33.41 1yko s GLU 176 CO 0.12 -0.15 -0.09 0.08 0.02 0.00 0.00 175.26 175.25 1yko s VAL 177 N 1.22 1.88 -1.34 2.63 1.01 -1.02 -4.78 120.40 119.99 1yko s VAL 177 Ca -0.06 -1.43 -0.06 0.00 0.00 0.00 0.00 61.98 60.42 1yko s VAL 177 Cb -0.14 -2.05 0.02 0.00 0.00 0.00 0.00 36.38 34.21 1yko s VAL 177 CO -0.02 -0.05 1.06 0.47 0.00 0.00 0.00 175.10 176.57 1yko n ASP 178 N 4.54 -4.48 0.00 3.32 8.00 -1.26 -2.47 116.55 124.20 1yko n ASP 178 Ca -0.13 -0.63 0.00 0.00 0.71 0.00 0.00 54.79 54.74 1yko n ASP 178 Cb 0.43 -4.79 0.00 0.00 -0.02 0.00 0.00 41.12 36.74 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 -1.69 0.48 3.89 0.44 0.00 -1.26 -4.99 105.19 102.06 1yko n GLY 179 Ca -0.10 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.60 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 -0.56 3.39 -0.02 1.61 2.47 -1.03 -5.07 119.74 120.53 1yko s LYS 180 Ca 0.00 -0.37 -0.30 0.00 -1.56 0.00 0.00 55.97 53.74 1yko s LYS 180 Cb 0.00 -3.05 -0.05 0.00 -1.46 0.00 0.00 37.83 33.27 1yko s LYS 180 CO 0.00 0.65 1.37 0.99 0.16 0.00 0.00 175.35 178.53 1yko s THR 181 N -1.36 3.82 0.10 3.43 2.01 -1.26 -2.42 115.64 119.96 1yko s THR 181 Ca 0.29 1.18 0.03 0.00 0.31 0.00 0.00 61.69 63.50 1yko s THR 181 Cb -0.13 -3.76 -0.04 0.00 0.01 0.00 0.00 72.50 68.59 1yko s THR 181 CO 0.21 -0.01 -0.09 0.00 -0.69 0.00 0.00 174.62 174.03 1yko s ALA 182 N 2.47 1.12 -0.03 7.40 0.00 -0.63 -1.82 121.76 130.26 1yko s ALA 182 Ca 0.62 -1.26 0.02 0.00 0.00 0.00 0.00 51.96 51.34 1yko s ALA 182 Cb -0.30 0.06 0.01 0.00 0.00 0.00 0.00 23.12 22.89 1yko s ALA 182 CO 0.25 -0.09 -0.07 0.71 0.00 0.00 0.00 175.76 176.57 1yko s TYR 183 N -2.81 0.82 -0.21 0.00 1.51 -0.77 -0.75 117.35 115.14 1yko s TYR 183 Ca 0.08 -0.22 -0.08 0.00 -1.01 0.00 0.00 57.07 55.84 1yko s TYR 183 Cb -0.00 -0.64 -0.04 0.00 -0.11 0.00 0.00 41.96 41.16 1yko s TYR 183 CO -0.01 -0.14 0.10 0.50 -1.11 0.00 0.00 175.55 174.89 1yko s ARG 184 N 0.50 3.96 -0.31 -0.62 3.52 0.00 -2.57 118.95 123.44 1yko s ARG 184 Ca -0.07 -0.34 -0.00 0.00 -0.13 0.00 0.00 55.73 55.18 1yko s ARG 184 Cb -0.11 -3.34 0.10 0.00 -1.56 0.00 0.00 34.95 30.03 1yko s ARG 184 CO 0.01 0.13 0.09 0.12 -0.81 0.00 0.00 175.30 174.83 1yko s PHE 185 N 0.81 1.89 -0.11 5.12 5.36 -0.85 -2.20 117.98 128.00 1yko s PHE 185 Ca 0.05 -1.81 -0.13 0.00 -0.96 0.00 0.00 56.93 54.08 1yko s PHE 185 Cb -0.13 -1.79 -0.05 0.00 -0.34 0.00 0.00 43.02 40.71 1yko s PHE 185 CO 0.02 -0.87 0.29 -0.51 -1.46 0.00 0.00 175.22 172.69 1yko s ASP 186 N 1.56 6.53 -0.21 6.13 1.01 -1.26 -3.92 116.67 126.49 1yko s ASP 186 Ca 0.09 0.62 -0.07 0.00 0.71 0.00 0.00 52.55 53.90 1yko s ASP 186 Cb -0.17 -2.18 -0.03 0.00 1.01 0.00 0.00 42.92 41.55 1yko s ASP 186 CO -0.22 0.23 0.06 -0.63 0.21 0.00 0.00 175.17 174.81 1yko s ILE 187 N -0.27 4.49 -0.37 0.77 1.01 -0.42 -4.96 121.20 121.45 1yko s ILE 187 Ca 0.18 -0.13 -0.05 0.00 0.00 0.00 0.00 60.65 60.66 1yko s ILE 187 Cb -0.14 -3.06 0.07 0.00 0.01 0.00 0.00 42.46 39.35 1yko s ILE 187 CO 0.06 0.40 0.14 -0.13 0.00 0.00 0.00 174.94 175.41 1yko s ARG 188 N 0.98 2.37 0.22 2.79 0.52 -1.26 -0.45 118.95 124.12 1yko s ARG 188 Ca 0.04 -1.46 -0.06 0.00 -0.52 0.00 0.00 55.73 53.73 1yko s ARG 188 Cb -0.14 -3.48 0.19 0.00 0.52 0.00 0.00 34.95 32.04 1yko s ARG 188 CO 0.03 -0.84 1.70 0.82 0.02 0.00 0.00 175.30 177.03 1yko h ILE 189 N 6.30 1.26 -3.37 1.52 2.04 -1.50 0.38 117.51 124.13 1yko h ILE 189 Ca -0.19 -1.07 -0.14 0.00 1.00 0.00 0.00 64.86 64.46 1yko h ILE 189 Cb 1.07 0.80 -0.21 0.00 -0.74 0.00 0.00 36.82 37.74 1yko h ILE 189 CO 0.64 0.39 -0.43 -1.58 0.00 0.00 0.00 178.15 177.17 1yko s GLN 190 N -5.04 0.53 0.00 2.37 0.74 -1.26 -4.76 119.66 112.24 1yko s GLN 190 Ca -0.11 -0.33 0.00 0.00 0.05 0.00 0.00 55.36 54.98 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 0.84 -0.13 0.00 0.41 -0.55 0.00 0.00 175.29 175.85 1yko n GLY 191 N 1.43 0.04 3.68 2.59 0.00 -1.26 -3.99 105.19 107.68 1yko n GLY 191 Ca -0.22 -1.82 -0.42 0.00 0.00 0.00 0.00 46.02 43.56 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 4.31 -0.06 1.61 2.12 -1.26 -2.91 118.70 122.51 1yko s GLU 192 Ca 0.00 1.80 0.00 0.00 0.36 0.00 0.00 54.97 57.13 1yko s GLU 192 Cb 0.00 -3.60 0.00 0.00 0.26 0.00 0.00 34.13 30.79 1yko s GLU 192 CO 0.00 -0.54 0.00 0.41 -0.54 0.00 0.00 175.26 174.59 1yko n GLY 193 N 3.53 0.39 3.68 -1.50 0.00 -1.26 -4.99 105.19 105.04 1yko n GLY 193 Ca 0.12 -0.98 -0.45 0.00 0.00 0.00 0.00 46.02 44.71 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 -2.17 2.21 -2.37 1.61 2.13 -1.14 -4.63 120.64 116.28 1yko n GLU 194 Ca -0.01 0.79 -0.41 0.00 0.66 0.00 0.00 57.16 58.20 1yko n GLU 194 Cb 0.22 -2.53 -0.04 0.00 0.27 0.00 0.00 31.44 29.37 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 0.46 3.32 0.02 6.31 2.01 0.12 -4.93 115.64 122.96 1yko s THR 195 Ca 0.73 1.27 -0.30 0.00 0.31 0.00 0.00 61.69 63.70 1yko s THR 195 Cb -0.63 -3.81 -0.06 0.00 0.01 0.00 0.00 72.50 68.01 1yko s THR 195 CO 0.43 0.28 1.35 -0.69 -0.69 0.00 0.00 174.62 175.30 1yko s VAL 196 N -0.88 3.76 -0.01 3.82 1.01 -1.26 -4.93 120.40 121.90 1yko s VAL 196 Ca 0.48 1.18 0.04 0.00 0.00 0.00 0.00 61.98 63.67 1yko s VAL 196 Cb -0.34 -3.76 -0.03 0.00 0.00 0.00 0.00 36.38 32.25 1yko s VAL 196 CO 0.43 0.02 -0.10 -0.36 0.00 0.00 0.00 175.10 175.09 1yko s PHE 197 N 2.00 2.80 0.30 5.22 0.08 -1.26 -4.68 117.98 122.44 1yko s PHE 197 Ca 0.62 -0.09 0.07 0.00 0.12 0.00 0.00 56.93 57.65 1yko s PHE 197 Cb -0.31 -1.60 -0.03 0.00 -0.57 0.00 0.00 43.02 40.51 1yko s PHE 197 CO 0.27 0.31 0.33 -0.06 -0.10 0.00 0.00 175.22 175.96 1yko s PHE 198 N -0.90 3.11 -0.03 0.36 0.08 -0.07 -4.99 117.98 115.54 1yko s PHE 198 Ca 0.15 -0.18 0.00 0.00 0.12 0.00 0.00 56.93 57.02 1yko s PHE 198 Cb -0.11 -1.71 0.03 0.00 -0.57 0.00 0.00 43.02 40.66 1yko s PHE 198 CO 0.05 0.27 0.02 0.34 -0.10 0.00 0.00 175.22 175.79 1yko s ASP 199 N -4.00 0.41 0.00 1.36 3.68 -1.26 -4.31 116.67 112.54 1yko s ASP 199 Ca 0.39 0.00 0.00 0.00 2.13 0.00 0.00 52.55 55.07 1yko s ASP 199 Cb -0.08 -0.17 0.00 0.00 -1.45 0.00 0.00 42.92 41.22 1yko s ASP 199 CO 0.28 -0.13 0.00 2.22 0.13 0.00 0.00 175.17 177.67