#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kym s ALA -1 N 0.00 1.28 -1.07 3.17 0.00 -1.26 -5.06 121.76 118.83 2kym s ALA -1 Ca 0.00 -1.28 -0.23 0.00 0.00 0.00 0.00 51.96 50.45 2kym s ALA -1 Cb 0.00 0.01 -0.11 0.00 0.00 0.00 0.00 23.12 23.02 2kym s ALA -1 CO 0.00 -0.02 1.93 -0.35 0.00 0.00 0.00 175.76 177.32 2kym n PRO 1 N 0.38 1.55 -2.42 0.00 -0.04 -1.26 -4.94 135.00 128.26 2kym n PRO 1 Ca -0.15 -2.30 -0.37 0.00 -0.04 0.00 0.00 63.50 60.64 2kym n PRO 1 Cb 0.58 -3.52 -0.03 0.00 -0.04 0.00 0.00 33.50 30.49 2kym n PRO 1 CO 0.00 0.00 0.00 -0.48 -0.04 0.00 0.00 175.50 174.98 2kym s LEU 2 N 8.54 4.17 0.17 1.53 2.34 -1.26 -4.87 118.68 129.30 2kym s LEU 2 Ca 0.66 2.19 0.09 0.00 0.06 0.00 0.00 54.13 57.13 2kym s LEU 2 Cb 0.03 -4.10 -0.04 0.00 -0.56 0.00 0.00 46.19 41.52 2kym s LEU 2 CO 0.14 -0.58 -0.12 -0.36 -1.06 0.00 0.00 176.35 174.36 2kym s PHE 3 N -1.53 2.58 0.10 3.48 0.40 -1.18 -2.34 117.98 119.50 2kym s PHE 3 Ca 0.57 -0.24 0.06 0.00 -0.60 0.00 0.00 56.93 56.72 2kym s PHE 3 Cb -0.26 -1.28 -0.03 0.00 0.51 0.00 0.00 43.02 41.95 2kym s PHE 3 CO 0.33 0.49 -0.15 0.00 0.70 0.00 0.00 175.22 176.60 2kym s ALA 4 N -1.61 1.42 -0.13 5.36 0.00 -0.44 -1.07 121.76 125.28 2kym s ALA 4 Ca 0.23 -1.20 0.03 0.00 0.00 0.00 0.00 51.96 51.02 2kym s ALA 4 Cb -0.09 -0.09 0.01 0.00 0.00 0.00 0.00 23.12 22.95 2kym s ALA 4 CO 0.14 0.14 -0.22 0.54 0.00 0.00 0.00 175.76 176.36 2kym s VAL 5 N -1.80 2.01 0.16 0.00 0.11 -0.42 -1.21 120.40 119.25 2kym s VAL 5 Ca 0.05 -0.95 -0.31 0.00 -2.93 0.00 0.00 61.98 57.84 2kym s VAL 5 Cb -0.07 -1.77 -0.09 0.00 -1.53 0.00 0.00 36.38 32.92 2kym s VAL 5 CO 0.03 0.54 1.45 0.42 -3.33 0.00 0.00 175.10 174.21 2kym s THR 6 N 0.77 2.96 -0.21 5.04 -4.23 -1.15 -0.56 115.64 118.26 2kym s THR 6 Ca -0.08 0.72 0.19 0.00 -1.18 0.00 0.00 61.69 61.33 2kym s THR 6 Cb -0.16 -3.46 -0.28 0.00 1.34 0.00 0.00 72.50 69.94 2kym s THR 6 CO -0.01 0.07 0.50 0.18 -0.54 0.00 0.00 174.62 174.83 2kym n LEU 7 N 3.52 0.19 -4.18 4.79 4.77 -1.23 -0.05 117.00 124.82 2kym n LEU 7 Ca 0.11 -0.11 -0.13 0.00 -0.03 0.00 0.00 56.01 55.85 2kym n LEU 7 Cb 0.41 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.39 2kym n LEU 7 CO 0.60 0.05 -0.40 -0.31 -1.33 0.00 0.00 177.39 175.99 2kym s TYR 8 N -3.22 1.00 -0.59 -1.77 1.51 -1.26 -4.66 117.35 108.37 2kym s TYR 8 Ca -0.04 -0.74 -0.26 0.00 -1.01 0.00 0.00 57.07 55.01 2kym s TYR 8 Cb 0.13 -0.55 0.04 0.00 -0.11 0.00 0.00 41.96 41.46 2kym s TYR 8 CO 0.80 -0.04 1.10 -2.00 -1.11 0.00 0.00 175.55 174.30 2kym s GLU 9 N -3.18 3.41 -0.58 -0.62 2.56 -1.26 -3.92 118.70 115.11 2kym s GLU 9 Ca 0.08 -0.01 -0.25 0.00 0.00 0.00 0.00 54.97 54.79 2kym s GLU 9 Cb 0.00 -4.05 0.04 0.00 2.00 0.00 0.00 34.13 32.12 2kym s GLU 9 CO -0.01 -1.66 1.02 0.12 -0.56 0.00 0.00 175.26 174.17 2kym s PHE 10 N 4.63 2.71 -0.79 5.30 5.36 -0.20 -4.95 117.98 130.03 2kym s PHE 10 Ca 0.37 0.04 -0.25 0.00 -0.96 0.00 0.00 56.93 56.13 2kym s PHE 10 Cb -0.10 -4.23 0.04 0.00 -0.34 0.00 0.00 43.02 38.40 2kym s PHE 10 CO 0.22 -1.47 1.27 0.15 -1.46 0.00 0.00 175.22 173.93 2kym s LYS 11 N 4.30 3.27 0.32 10.12 1.02 -1.26 -2.61 119.74 134.90 2kym s LYS 11 Ca 0.33 -0.52 -0.28 0.00 0.02 0.00 0.00 55.97 55.52 2kym s LYS 11 Cb -0.11 -4.43 -0.13 0.00 -0.52 0.00 0.00 37.83 32.63 2kym s LYS 11 CO 0.20 -2.11 1.11 0.00 -0.92 0.00 0.00 175.35 173.63 2kym n ALA 12 N 9.01 0.38 -0.06 5.17 0.00 -1.26 -4.92 120.51 128.83 2kym n ALA 12 Ca 0.08 0.36 -0.05 0.00 0.00 0.00 0.00 53.44 53.84 2kym n ALA 12 Cb 0.49 -2.11 -0.10 0.00 0.00 0.00 0.00 19.45 17.72 2kym n ALA 12 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 2kym n GLU 13 N 0.60 1.70 -4.35 0.00 0.28 -1.26 -4.96 120.64 112.64 2kym n GLU 13 Ca 0.08 -0.02 -0.25 0.00 -0.16 0.00 0.00 57.16 56.81 2kym n GLU 13 Cb 0.34 -1.34 -0.07 0.00 1.43 0.00 0.00 31.44 31.81 2kym n GLU 13 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 177.13 177.51 2kym n ARG 14 N -2.43 0.61 -0.11 3.44 5.12 -1.26 -5.03 116.66 117.00 2kym n ARG 14 Ca -0.19 -3.37 -0.04 0.00 -1.93 0.00 0.00 57.85 52.32 2kym n ARG 14 Cb 0.86 1.76 0.17 0.00 -1.16 0.00 0.00 32.46 34.09 2kym n ARG 14 CO 0.00 0.00 0.00 -0.44 -1.93 0.00 0.00 177.63 175.26 2kym h ASP 15 N 1.55 0.75 -0.31 0.55 3.32 -2.05 -2.61 116.42 117.62 2kym h ASP 15 Ca -0.32 -0.17 -0.04 0.00 0.02 0.00 0.00 57.03 56.52 2kym h ASP 15 Cb 1.18 -0.20 -0.02 0.00 0.22 0.00 0.00 39.33 40.52 2kym h ASP 15 CO 0.50 0.81 0.07 0.44 -1.72 0.00 0.00 179.24 179.35 2kym h ASP 16 N 0.73 0.55 -3.80 6.45 3.32 -1.97 -3.42 116.42 118.28 2kym h ASP 16 Ca 0.15 -0.09 -0.49 0.00 0.02 0.00 0.00 57.03 56.62 2kym h ASP 16 Cb 0.43 -0.14 -0.00 0.00 0.22 0.00 0.00 39.33 39.84 2kym h ASP 16 CO 0.02 0.57 0.41 -1.61 -1.72 0.00 0.00 179.24 176.90 2kym s GLU 17 N -5.11 4.70 -0.16 3.56 0.41 -0.99 -3.59 118.70 117.53 2kym s GLU 17 Ca -0.08 1.62 -0.02 0.00 -0.41 0.00 0.00 54.97 56.08 2kym s GLU 17 Cb 0.16 -3.16 -0.02 0.00 -1.78 0.00 0.00 34.13 29.34 2kym s GLU 17 CO 0.77 0.32 -0.09 -1.17 -0.49 0.00 0.00 175.26 174.60 2kym s LEU 18 N -1.46 2.87 -0.03 1.80 2.96 -1.26 -4.72 118.68 118.85 2kym s LEU 18 Ca 0.44 -0.31 -0.30 0.00 -0.22 0.00 0.00 54.13 53.75 2kym s LEU 18 Cb -0.28 -1.68 -0.04 0.00 0.50 0.00 0.00 46.19 44.69 2kym s LEU 18 CO 0.35 0.12 1.31 1.51 -1.32 0.00 0.00 176.35 178.31 2kym s ASP 19 N 0.66 6.94 0.04 3.68 -4.77 -1.26 -4.52 116.67 117.44 2kym s ASP 19 Ca -0.05 1.97 0.00 0.00 -3.30 0.00 0.00 52.55 51.18 2kym s ASP 19 Cb -0.15 -2.56 -0.03 0.00 -1.09 0.00 0.00 42.92 39.09 2kym s ASP 19 CO 0.02 -0.66 -0.04 0.54 0.70 0.00 0.00 175.17 175.73 2kym s VAL 20 N 2.30 0.27 0.26 2.11 0.11 -1.07 -5.00 120.40 119.39 2kym s VAL 20 Ca 0.60 -1.20 0.10 0.00 -2.93 0.00 0.00 61.98 58.55 2kym s VAL 20 Cb -0.28 -0.68 -0.04 0.00 -1.53 0.00 0.00 36.38 33.84 2kym s VAL 20 CO 0.24 -0.60 -0.05 -0.44 -3.33 0.00 0.00 175.10 170.93 2kym s SER 21 N -1.88 4.35 -0.03 3.54 0.01 -1.26 -1.04 113.70 117.39 2kym s SER 21 Ca -0.08 -0.71 -0.30 0.00 1.31 0.00 0.00 55.95 56.17 2kym s SER 21 Cb -0.05 -0.74 -0.05 0.00 0.21 0.00 0.00 66.02 65.39 2kym s SER 21 CO -0.03 0.02 1.47 -2.16 0.41 0.00 0.00 173.24 172.95 2kym s PRO 22 N -3.59 4.24 0.00 12.44 0.04 -1.25 -2.98 135.00 143.90 2kym s PRO 22 Ca 0.31 2.01 0.00 0.00 0.04 0.00 0.00 61.00 63.36 2kym s PRO 22 Cb -0.06 -3.70 0.00 0.00 0.04 0.00 0.00 34.50 30.77 2kym s PRO 22 CO 0.19 -0.68 0.00 0.41 0.04 0.00 0.00 177.00 176.96 2kym n GLY 23 N 3.79 0.95 3.95 0.56 0.00 0.93 -4.96 105.19 110.42 2kym n GLY 23 Ca 0.14 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.93 2kym n GLY 23 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2kym s GLU 24 N -0.55 2.98 -0.16 1.61 0.41 -1.16 -4.93 118.70 116.90 2kym s GLU 24 Ca 0.00 -0.43 -0.03 0.00 -0.41 0.00 0.00 54.97 54.10 2kym s GLU 24 Cb 0.00 -2.50 -0.02 0.00 -1.78 0.00 0.00 34.13 29.83 2kym s GLU 24 CO 0.00 -0.39 -0.06 -0.80 -0.49 0.00 0.00 175.26 173.52 2kym s ASN 25 N -4.25 4.52 0.05 -0.19 -0.87 -1.26 -2.93 114.94 110.01 2kym s ASN 25 Ca 0.50 -0.22 0.06 0.00 -1.57 0.00 0.00 52.86 51.63 2kym s ASN 25 Cb -0.10 -1.73 -0.02 0.00 -0.02 0.00 0.00 41.25 39.37 2kym s ASN 25 CO 0.39 0.14 -0.16 -0.76 -2.57 0.00 0.00 177.10 174.13 2kym s LEU 26 N 0.54 2.20 -0.24 0.60 1.43 -0.35 -2.97 118.68 119.89 2kym s LEU 26 Ca -0.04 -0.52 -0.14 0.00 -1.03 0.00 0.00 54.13 52.40 2kym s LEU 26 Cb -0.15 -0.72 -0.04 0.00 0.03 0.00 0.00 46.19 45.32 2kym s LEU 26 CO 0.03 0.05 0.33 -0.55 0.23 0.00 0.00 176.35 176.44 2kym s SER 27 N -1.30 6.29 0.41 2.29 0.15 -0.32 -1.32 113.70 119.90 2kym s SER 27 Ca 0.03 0.33 -0.25 0.00 0.70 0.00 0.00 55.95 56.77 2kym s SER 27 Cb -0.09 -2.19 -0.08 0.00 -1.71 0.00 0.00 66.02 61.95 2kym s SER 27 CO 0.02 -0.08 1.17 -0.63 1.20 0.00 0.00 173.24 174.92 2kym s ILE 28 N 1.53 3.12 0.00 6.45 -1.09 -0.99 -1.36 121.20 128.85 2kym s ILE 28 Ca 0.15 0.92 0.00 0.00 -2.23 0.00 0.00 60.65 59.49 2kym s ILE 28 Cb -0.15 -3.51 0.00 0.00 -1.58 0.00 0.00 42.46 37.22 2kym s ILE 28 CO 0.08 0.07 0.00 0.00 -1.23 0.00 0.00 174.94 173.86 2kym s ALA 30 N -1.71 -2.51 0.45 0.00 0.00 -1.25 -4.72 121.76 112.01 2kym s ALA 30 Ca 0.00 0.80 0.03 0.00 0.00 0.00 0.00 51.96 52.79 2kym s ALA 30 Cb 0.00 0.36 -0.03 0.00 0.00 0.00 0.00 23.12 23.45 2kym s ALA 30 CO 0.00 -1.08 0.05 -3.38 0.00 0.00 0.00 175.76 171.36 2kym s HIS 31 N -2.07 1.90 -0.27 0.00 -3.43 -0.87 -0.06 115.29 110.49 2kym s HIS 31 Ca 0.18 -1.05 -0.01 0.00 -0.80 0.00 0.00 55.06 53.38 2kym s HIS 31 Cb 0.06 -1.44 0.13 0.00 -1.43 0.00 0.00 32.58 29.91 2kym s HIS 31 CO -0.06 0.04 0.31 -0.47 -2.00 0.00 0.00 174.74 172.56 2kym s TYR 32 N -3.01 -0.55 -1.91 0.38 5.04 0.44 -0.50 117.35 117.23 2kym s TYR 32 Ca 0.17 0.08 0.00 0.00 -2.44 0.00 0.00 57.07 54.88 2kym s TYR 32 Cb 0.03 -0.35 0.00 0.00 0.35 0.00 0.00 41.96 42.00 2kym s TYR 32 CO 0.09 -0.86 0.00 -0.25 -1.34 0.00 0.00 175.55 173.20 2kym n ASP 33 N 5.32 -5.57 -1.48 4.32 9.92 -1.26 -1.24 116.55 126.55 2kym n ASP 33 Ca -0.02 0.45 -0.19 0.00 -0.53 0.00 0.00 54.79 54.49 2kym n ASP 33 Cb 0.48 -4.66 -0.08 0.00 -0.64 0.00 0.00 41.12 36.22 2kym n ASP 33 CO 0.00 0.00 0.00 -1.22 0.13 0.00 0.00 177.20 176.11 2kym n TYR 34 N -2.34 -0.02 0.03 1.24 4.02 -1.26 -4.78 117.16 114.04 2kym n TYR 34 Ca -0.18 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.71 2kym n TYR 34 Cb 0.66 -3.24 0.00 0.00 -0.02 0.00 0.00 39.34 36.74 2kym n TYR 34 CO 0.00 0.00 0.00 -0.85 -1.01 0.00 0.00 176.86 175.00 2kym n GLU 35 N -2.45 2.03 -3.72 -0.72 0.28 -0.38 -4.88 120.64 110.80 2kym n GLU 35 Ca -0.19 -0.33 -0.12 0.00 -0.16 0.00 0.00 57.16 56.35 2kym n GLU 35 Cb 0.63 -0.83 -0.10 0.00 1.43 0.00 0.00 31.44 32.57 2kym n GLU 35 CO 0.00 0.00 0.00 -1.58 -0.16 0.00 0.00 177.13 175.39 2kym s TRP 36 N -0.43 -0.52 0.06 -1.84 0.52 -1.09 -4.15 118.94 111.49 2kym s TRP 36 Ca 0.01 1.19 0.10 0.00 0.02 0.00 0.00 56.10 57.41 2kym s TRP 36 Cb 0.00 0.20 -0.03 0.00 -1.15 0.00 0.00 33.47 32.50 2kym s TRP 36 CO 0.01 -0.27 -0.26 -0.06 0.02 0.00 0.00 176.95 176.39 2kym s PHE 37 N 0.72 2.31 -0.67 -1.98 0.08 0.97 -0.42 117.98 118.99 2kym s PHE 37 Ca -0.04 -0.41 -0.14 0.00 0.12 0.00 0.00 56.93 56.46 2kym s PHE 37 Cb -0.05 -1.35 0.17 0.00 -0.57 0.00 0.00 43.02 41.21 2kym s PHE 37 CO -0.05 0.17 0.61 0.42 -0.10 0.00 0.00 175.22 176.27 2kym s ILE 38 N -0.86 5.29 -0.11 0.64 -1.09 0.91 -1.30 121.20 124.68 2kym s ILE 38 Ca 0.12 -2.01 -0.01 0.00 -2.23 0.00 0.00 60.65 56.52 2kym s ILE 38 Cb -0.10 -4.33 -0.03 0.00 -1.58 0.00 0.00 42.46 36.42 2kym s ILE 38 CO 0.03 -0.94 -0.06 0.00 -1.23 0.00 0.00 174.94 172.74 2kym s ALA 39 N 0.87 2.96 0.21 9.38 0.00 -1.26 -0.02 121.76 133.90 2kym s ALA 39 Ca 0.10 -0.86 0.08 0.00 0.00 0.00 0.00 51.96 51.29 2kym s ALA 39 Cb -0.20 -1.36 -0.04 0.00 0.00 0.00 0.00 23.12 21.51 2kym s ALA 39 CO -0.03 0.40 0.01 -1.59 0.00 0.00 0.00 175.76 174.55 2kym s LYS 40 N -0.22 2.39 -0.21 0.00 -2.85 -0.47 -3.65 119.74 114.73 2kym s LYS 40 Ca 0.03 -1.21 -0.29 0.00 -1.00 0.00 0.00 55.97 53.50 2kym s LYS 40 Cb -0.13 -2.30 -0.03 0.00 -2.06 0.00 0.00 37.83 33.31 2kym s LYS 40 CO 0.03 0.42 1.60 -1.25 0.10 0.00 0.00 175.35 176.25 2kym s PRO 41 N -3.24 3.84 0.20 1.78 0.04 -1.26 -1.17 135.00 135.19 2kym s PRO 41 Ca 0.29 1.69 -0.00 0.00 0.04 0.00 0.00 61.00 63.02 2kym s PRO 41 Cb -0.08 -4.02 0.13 0.00 0.04 0.00 0.00 34.50 30.57 2kym s PRO 41 CO 0.19 -1.24 1.49 0.82 0.04 0.00 0.00 177.00 178.30 2kym h ILE 42 N 6.08 1.36 0.00 0.56 2.04 -1.90 -3.36 117.51 122.29 2kym h ILE 42 Ca -0.34 -1.99 -0.06 0.00 1.00 0.00 0.00 64.86 63.47 2kym h ILE 42 Cb 1.15 1.98 -0.01 0.00 -0.74 0.00 0.00 36.82 39.20 2kym h ILE 42 CO 1.00 0.60 -0.68 -1.13 0.00 0.00 0.00 178.15 177.94 2kym h ASN 43 N 0.29 0.00 -4.07 1.72 -1.24 -1.90 -3.47 115.58 106.90 2kym h ASN 43 Ca -0.01 -0.16 -0.52 0.00 0.71 0.00 0.00 56.30 56.32 2kym h ASN 43 Cb 1.18 0.00 0.09 0.00 0.73 0.00 0.00 38.32 40.32 2kym h ASN 43 CO 0.11 0.95 0.47 -0.13 -1.29 0.00 0.00 177.43 177.54 2kym s ARG 43 N -2.23 3.29 -0.05 6.67 0.52 -1.26 -4.94 118.95 120.95 2kym s ARG 43 Ca -0.18 1.76 0.17 0.00 -0.52 0.00 0.00 55.73 56.96 2kym s ARG 43 Cb 0.03 -2.08 0.54 0.00 0.52 0.00 0.00 34.95 33.96 2kym s ARG 43 CO 0.32 -0.93 1.46 1.47 0.02 0.00 0.00 175.30 177.63 2kym n LEU 44 N -1.21 3.84 0.00 2.53 -0.00 -1.26 -4.62 117.00 116.28 2kym n LEU 44 Ca 0.11 -2.24 0.00 0.00 -0.00 0.00 0.00 56.01 53.89 2kym n LEU 44 Cb 0.49 -0.43 0.00 0.00 -0.00 0.00 0.00 43.42 43.48 2kym n LEU 44 CO 0.45 0.82 0.09 0.61 -0.00 0.00 0.00 177.39 179.36 2kym n GLY 45 N 0.89 -2.13 3.60 1.47 0.00 -1.26 -5.01 105.19 102.74 2kym n GLY 45 Ca 0.20 0.12 0.01 0.00 0.00 0.00 0.00 46.02 46.35 2kym n GLY 45 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2kym s GLY 46 N 0.00 -0.37 0.45 -0.02 0.00 -1.26 -5.14 107.32 100.98 2kym s GLY 46 Ca 0.00 1.36 -0.23 0.00 0.00 0.00 0.00 44.72 45.85 2kym s GLY 46 CO 0.00 0.37 1.17 2.56 0.00 0.00 0.00 173.10 177.20 2kym s PRO 47 N -2.05 3.80 0.00 2.90 0.04 -1.26 -4.50 135.00 133.92 2kym s PRO 47 Ca 0.14 1.79 0.00 0.00 0.04 0.00 0.00 61.00 62.96 2kym s PRO 47 Cb 0.04 -2.44 0.00 0.00 0.04 0.00 0.00 34.50 32.14 2kym s PRO 47 CO -0.05 -0.52 0.00 0.41 0.04 0.00 0.00 177.00 176.88 2kym n GLY 48 N 0.47 5.80 2.92 0.56 0.00 -1.24 -4.96 105.19 108.74 2kym n GLY 48 Ca 0.07 -1.53 -0.24 0.00 0.00 0.00 0.00 46.02 44.32 2kym n GLY 48 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2kym s LEU 49 N 0.00 1.27 -0.02 0.99 0.20 -1.24 -4.19 118.68 115.69 2kym s LEU 49 Ca 0.00 -0.24 0.01 0.00 0.69 0.00 0.00 54.13 54.59 2kym s LEU 49 Cb 0.00 -0.70 0.02 0.00 -0.43 0.00 0.00 46.19 45.07 2kym s LEU 49 CO 0.00 -0.07 -0.02 0.54 -0.29 0.00 0.00 176.35 176.51 2kym s VAL 50 N 1.28 0.25 0.67 1.68 0.11 -0.42 -4.43 120.40 119.54 2kym s VAL 50 Ca -0.04 -0.02 -0.14 0.00 -2.93 0.00 0.00 61.98 58.84 2kym s VAL 50 Cb -0.14 -0.29 0.01 0.00 -1.53 0.00 0.00 36.38 34.43 2kym s VAL 50 CO -0.03 0.13 1.11 -2.16 -3.33 0.00 0.00 175.10 170.82 2kym s PRO 51 N 0.61 2.73 0.54 1.54 0.04 -1.26 -0.02 135.00 139.18 2kym s PRO 51 Ca -0.06 1.36 0.32 0.00 0.04 0.00 0.00 61.00 62.66 2kym s PRO 51 Cb -0.09 -1.94 1.43 0.00 0.04 0.00 0.00 34.50 33.93 2kym s PRO 51 CO -0.01 -1.30 2.02 0.28 0.04 0.00 0.00 177.00 178.03 2kym h VAL 52 N -0.11 0.19 0.00 -0.36 2.07 -1.89 -2.01 116.25 114.13 2kym h VAL 52 Ca -0.46 -0.57 0.00 0.00 0.82 0.00 0.00 66.70 66.49 2kym h VAL 52 Cb 1.24 1.47 0.00 0.00 -1.52 0.00 0.00 31.29 32.49 2kym h VAL 52 CO 0.54 0.06 0.00 -1.20 0.02 0.00 0.00 177.57 176.99 2kym n SER 53 N -3.23 0.00 -0.17 0.57 7.64 -1.26 -2.79 113.62 114.38 2kym n SER 53 Ca -0.00 -0.45 0.07 0.00 1.01 0.00 0.00 58.87 59.51 2kym n SER 53 Cb 0.29 -0.15 0.10 0.00 -1.01 0.00 0.00 64.21 63.44 2kym n SER 53 CO 0.00 0.00 0.00 -1.22 -3.01 0.00 0.00 175.04 170.81 2kym n TYR 54 N -1.15 0.00 -3.75 1.43 4.02 -0.76 -4.95 117.16 112.00 2kym n TYR 54 Ca 0.16 -0.75 -0.11 0.00 -0.01 0.00 0.00 57.90 57.19 2kym n TYR 54 Cb 0.16 -0.12 -0.07 0.00 -0.02 0.00 0.00 39.34 39.29 2kym n TYR 54 CO 0.00 0.00 0.00 0.14 -1.01 0.00 0.00 176.86 175.99 2kym s VAL 55 N -2.16 0.09 -0.24 -0.72 -7.23 -1.12 -3.52 120.40 105.51 2kym s VAL 55 Ca 0.24 -0.77 0.01 0.00 -1.81 0.00 0.00 61.98 59.65 2kym s VAL 55 Cb 0.21 -1.09 0.06 0.00 0.56 0.00 0.00 36.38 36.11 2kym s VAL 55 CO 0.02 -0.42 -0.08 -0.60 -0.31 0.00 0.00 175.10 173.71 2kym s ARG 56 N -3.18 1.86 0.00 4.82 3.52 0.27 -4.76 118.95 121.48 2kym s ARG 56 Ca -0.01 -1.06 -0.30 0.00 -0.13 0.00 0.00 55.73 54.23 2kym s ARG 56 Cb 0.01 -2.64 -0.07 0.00 -1.56 0.00 0.00 34.95 30.69 2kym s ARG 56 CO -0.07 -0.56 1.73 0.42 -0.81 0.00 0.00 175.30 176.01 2kym s ILE 57 N 1.32 3.30 0.29 4.11 -1.09 -1.26 -1.29 121.20 126.56 2kym s ILE 57 Ca -0.06 0.48 0.03 0.00 -2.23 0.00 0.00 60.65 58.86 2kym s ILE 57 Cb -0.19 -3.31 -0.04 0.00 -1.58 0.00 0.00 42.46 37.35 2kym s ILE 57 CO -0.06 -0.03 0.15 0.27 -1.23 0.00 0.00 174.94 174.04 2kym s ILE 58 N 3.76 0.32 -0.15 2.92 -4.36 -0.24 -4.44 121.20 119.02 2kym s ILE 58 Ca 0.77 -2.00 0.00 0.00 -0.26 0.00 0.00 60.65 59.16 2kym s ILE 58 Cb -0.37 -2.53 -0.00 0.00 1.25 0.00 0.00 42.46 40.80 2kym s ILE 58 CO 0.33 0.00 -0.15 -1.81 0.24 0.00 0.00 174.94 173.55 2kym s ASP 59 N -3.34 3.72 0.54 4.36 1.11 -1.20 -3.07 116.67 118.79 2kym s ASP 59 Ca 0.37 -0.44 0.29 0.00 0.18 0.00 0.00 52.55 52.94 2kym s ASP 59 Cb 0.06 -1.57 1.46 0.00 1.07 0.00 0.00 42.92 43.93 2kym s ASP 59 CO 0.17 0.10 1.93 0.25 1.18 0.00 0.00 175.17 178.79 2kym h LEU 60 N 7.19 0.00 0.00 1.23 7.12 -1.89 0.35 115.31 129.31 2kym h LEU 60 Ca -0.31 0.00 -0.18 0.00 0.13 0.00 0.00 57.88 57.52 2kym h LEU 60 Cb 1.20 0.00 -0.03 0.00 -0.53 0.00 0.00 40.66 41.29 2kym h LEU 60 CO 0.56 0.00 -1.48 0.23 -0.13 0.00 0.00 178.44 177.62 2kym n MET 61 N -4.22 0.62 -3.22 1.25 2.81 -1.26 -4.60 117.12 108.50 2kym n MET 61 Ca 0.14 0.21 -0.24 0.00 -1.81 0.00 0.00 57.70 56.00 2kym n MET 61 Cb 0.80 -1.79 -0.07 0.00 -0.71 0.00 0.00 33.22 31.45 2kym n MET 61 CO 0.00 0.00 0.00 -0.25 1.51 0.00 0.00 175.97 177.23 2kym n ASP 62 N -2.87 -0.33 0.00 7.83 8.00 0.80 -4.95 116.55 125.03 2kym n ASP 62 Ca -0.11 -2.62 0.07 0.00 0.71 0.00 0.00 54.79 52.84 2kym n ASP 62 Cb 0.86 -0.41 0.32 0.00 -0.02 0.00 0.00 41.12 41.86 2kym n ASP 62 CO 0.00 0.00 0.00 -0.81 -0.39 0.00 0.00 177.20 176.00 2kym n PRO 63 N 1.96 0.05 -0.01 -0.24 -0.04 0.89 -2.17 135.00 135.44 2kym n PRO 63 Ca 0.23 0.23 0.09 0.00 -0.04 0.00 0.00 63.50 64.02 2kym n PRO 63 Cb 0.52 -1.50 -0.14 0.00 -0.04 0.00 0.00 33.50 32.34 2kym n PRO 63 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2kym n ALA 64 N -1.45 3.11 -0.00 0.55 0.00 -1.26 -3.87 120.51 117.59 2kym n ALA 64 Ca 0.04 -0.47 -0.12 0.00 0.00 0.00 0.00 53.44 52.89 2kym n ALA 64 Cb 0.15 -0.65 -0.10 0.00 0.00 0.00 0.00 19.45 18.85 2kym n ALA 64 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 2kym h LYS 65 N 0.00 -0.08 -0.77 0.00 3.64 -1.81 -3.26 116.57 114.28 2kym h LYS 65 Ca 0.00 0.01 -0.12 0.00 -1.27 0.00 0.00 60.65 59.26 2kym h LYS 65 Cb 0.76 0.02 -0.07 0.00 -0.41 0.00 0.00 32.23 32.53 2kym h LYS 65 CO 0.00 0.49 0.15 0.66 -2.27 0.00 0.00 179.45 178.48 2kym n TYR 66 N -4.83 1.85 0.14 1.91 4.02 -1.22 -4.11 117.16 114.93 2kym n TYR 66 Ca -0.08 -0.86 0.12 0.00 -0.01 0.00 0.00 57.90 57.06 2kym n TYR 66 Cb 0.30 -0.53 0.05 0.00 -0.02 0.00 0.00 39.34 39.14 2kym n TYR 66 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2kym h ALA 67 N 2.86 0.65 0.00 -0.72 0.00 -1.67 -3.31 119.26 117.07 2kym h ALA 67 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.06 2kym h ALA 67 Cb 1.90 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.69 2kym h ALA 67 CO 0.53 0.00 -0.86 0.66 0.00 0.00 0.00 179.25 179.57 2kym h SER 68 N 0.00 0.00 -3.13 0.00 4.64 -1.77 -3.47 113.55 109.82 2kym h SER 68 Ca 0.00 -0.00 -0.58 0.00 -0.47 0.00 0.00 61.79 60.74 2kym h SER 68 Cb 1.00 0.00 0.16 0.00 -0.31 0.00 0.00 62.40 63.25 2kym h SER 68 CO 0.00 0.00 -0.12 0.55 -0.87 0.00 0.00 176.83 176.40 2kym n VAL 69 N -2.73 2.73 -3.51 0.95 3.14 -1.24 -4.93 118.33 112.73 2kym n VAL 69 Ca 0.01 -0.50 -0.42 0.00 -2.96 0.00 0.00 64.34 60.47 2kym n VAL 69 Cb 0.55 -0.91 -0.05 0.00 -1.06 0.00 0.00 33.84 32.36 2kym n VAL 69 CO 0.00 0.00 0.00 -1.81 -6.46 0.00 0.00 176.83 168.56 2kym s ASP 70 N -1.09 6.09 0.53 6.55 1.01 -1.26 -4.91 116.67 123.58 2kym s ASP 70 Ca 0.70 -2.84 0.30 0.00 0.71 0.00 0.00 52.55 51.41 2kym s ASP 70 Cb -0.47 -2.04 1.45 0.00 1.01 0.00 0.00 42.92 42.86 2kym s ASP 70 CO 0.53 -0.46 1.89 0.71 0.21 0.00 0.00 175.17 178.05 2kym h THR 71 N 4.92 0.57 -0.14 -1.27 1.35 -1.86 -0.38 112.91 116.10 2kym h THR 71 Ca 0.06 -0.01 -0.00 0.00 -0.55 0.00 0.00 66.41 65.91 2kym h THR 71 Cb 0.99 0.54 -0.01 0.00 -1.73 0.00 0.00 68.15 67.94 2kym h THR 71 CO 0.74 0.01 0.08 0.22 -0.25 0.00 0.00 175.52 176.32 2kym h TYR 72 N 0.03 0.19 -2.36 4.73 3.20 -1.91 -3.41 116.97 117.44 2kym h TYR 72 Ca 0.42 -0.00 -0.57 0.00 3.14 0.00 0.00 58.73 61.71 2kym h TYR 72 Cb 1.63 -0.06 -0.01 0.00 1.54 0.00 0.00 36.73 39.83 2kym h TYR 72 CO -0.00 0.18 1.33 -0.51 -1.64 0.00 0.00 178.16 177.52 2kym s ASP 73 N -5.40 5.89 0.60 -2.11 1.11 -0.15 -4.83 116.67 111.79 2kym s ASP 73 Ca -0.13 1.83 0.30 0.00 0.18 0.00 0.00 52.55 54.72 2kym s ASP 73 Cb 0.07 -2.52 1.65 0.00 1.07 0.00 0.00 42.92 43.19 2kym s ASP 73 CO 0.69 -1.62 2.04 0.08 1.18 0.00 0.00 175.17 177.54 2kym h ARG 74 N 13.00 0.00 0.27 8.23 -0.00 -1.84 -1.86 114.38 132.18 2kym h ARG 74 Ca -0.39 0.00 -0.01 0.00 -0.00 0.00 0.00 59.98 59.57 2kym h ARG 74 Cb 1.21 0.00 0.00 0.00 -0.00 0.00 0.00 29.97 31.18 2kym h ARG 74 CO 0.98 0.00 -0.13 0.93 -0.00 0.00 0.00 179.97 181.75 2kym h GLU 75 N 0.00 -0.35 0.79 0.08 5.08 -1.91 -1.63 114.58 116.64 2kym h GLU 75 Ca 0.10 0.02 -0.04 0.00 -1.00 0.00 0.00 59.36 58.45 2kym h GLU 75 Cb 0.65 0.08 0.01 0.00 0.50 0.00 0.00 28.75 29.99 2kym h GLU 75 CO -0.00 -0.02 -0.39 1.96 -1.00 0.00 0.00 179.01 179.56 2kym h GLN 76 N -0.70 -1.03 -0.86 2.33 1.08 -1.61 -1.64 115.11 112.68 2kym h GLN 76 Ca -0.04 0.07 0.22 0.00 -1.45 0.00 0.00 58.65 57.46 2kym h GLN 76 Cb 0.48 0.23 -0.05 0.00 -0.05 0.00 0.00 27.48 28.10 2kym h GLN 76 CO 0.06 -0.69 0.59 -0.24 -0.95 0.00 0.00 178.83 177.60 2kym h VAL 77 N -1.07 0.63 0.20 -0.54 3.04 -1.55 -1.26 116.25 115.70 2kym h VAL 77 Ca -0.11 -0.06 -0.01 0.00 -1.01 0.00 0.00 66.70 65.51 2kym h VAL 77 Cb 0.83 0.43 0.00 0.00 -2.01 0.00 0.00 31.29 30.54 2kym h VAL 77 CO 0.17 0.03 -0.09 0.24 -1.01 0.00 0.00 177.57 176.91 2kym h MET 78 N 0.18 -0.25 -0.90 4.17 2.86 -0.82 -1.59 114.93 118.58 2kym h MET 78 Ca 0.43 0.02 0.10 0.00 -2.06 0.00 0.00 59.70 58.18 2kym h MET 78 Cb 1.39 0.06 -0.07 0.00 0.06 0.00 0.00 31.60 33.04 2kym h MET 78 CO -0.08 0.11 0.58 0.87 1.06 0.00 0.00 176.91 179.44 2kym h LYS 79 N -0.67 0.85 0.38 1.72 1.57 -0.32 0.27 116.57 120.38 2kym h LYS 79 Ca -0.03 -0.05 -0.02 0.00 -1.87 0.00 0.00 60.65 58.68 2kym h LYS 79 Cb 0.48 -0.19 0.00 0.00 0.08 0.00 0.00 32.23 32.60 2kym h LYS 79 CO 0.04 0.56 -0.18 0.82 -0.57 0.00 0.00 179.45 180.12 2kym h ILE 80 N 0.88 0.55 -0.68 1.86 2.04 -1.26 0.26 117.51 121.15 2kym h ILE 80 Ca 0.42 -0.53 0.01 0.00 1.00 0.00 0.00 64.86 65.76 2kym h ILE 80 Cb 0.44 0.79 -0.03 0.00 -0.74 0.00 0.00 36.82 37.27 2kym h ILE 80 CO -0.18 0.09 0.45 0.40 0.00 0.00 0.00 178.15 178.91 2kym h ILE 81 N -0.85 1.18 0.09 -0.67 2.04 -0.94 0.21 117.51 118.57 2kym h ILE 81 Ca -0.05 -0.32 -0.00 0.00 1.00 0.00 0.00 64.86 65.48 2kym h ILE 81 Cb 0.54 0.17 0.00 0.00 -0.74 0.00 0.00 36.82 36.79 2kym h ILE 81 CO 0.09 0.17 -0.04 -0.78 0.00 0.00 0.00 178.15 177.58 2kym h ASP 82 N 0.93 -0.11 0.12 1.72 3.58 -0.44 0.16 116.42 122.37 2kym h ASP 82 Ca 0.25 -0.44 -0.01 0.00 0.42 0.00 0.00 57.03 57.26 2kym h ASP 82 Cb -0.11 0.03 0.00 0.00 1.72 0.00 0.00 39.33 40.97 2kym h ASP 82 CO -0.05 0.43 -0.06 -0.33 -2.88 0.00 0.00 179.24 176.35 2kym h GLU 83 N -0.69 -0.15 0.00 0.28 5.08 -0.29 -1.64 114.58 117.17 2kym h GLU 83 Ca -0.01 0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2kym h GLU 83 Cb 0.54 0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.82 2kym h GLU 83 CO 0.02 -0.09 0.00 1.19 -1.00 0.00 0.00 179.01 179.13 2kym n PHE 84 N -5.15 0.20 -3.53 4.33 3.01 0.71 -4.89 117.46 112.15 2kym n PHE 84 Ca -0.08 0.08 -0.19 0.00 1.01 0.00 0.00 57.45 58.27 2kym n PHE 84 Cb 0.09 -0.63 0.07 0.00 -0.01 0.00 0.00 39.48 39.01 2kym n PHE 84 CO 0.00 0.00 0.00 1.63 1.01 0.00 0.00 176.76 179.40 2kym n LYS 85 N -1.69 -6.19 -2.60 -1.08 4.76 -0.34 -3.87 118.16 107.15 2kym n LYS 85 Ca 0.03 0.78 -0.42 0.00 -2.87 0.00 0.00 58.31 55.83 2kym n LYS 85 Cb 0.19 -5.66 -0.03 0.00 -1.84 0.00 0.00 35.03 27.69 2kym n LYS 85 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 2kym s ILE 86 N -3.45 4.59 0.73 -0.18 1.01 0.41 -4.62 121.20 119.69 2kym s ILE 86 Ca 0.05 1.87 -0.12 0.00 0.00 0.00 0.00 60.65 62.45 2kym s ILE 86 Cb -0.02 -4.20 0.04 0.00 0.01 0.00 0.00 42.46 38.28 2kym s ILE 86 CO 0.76 0.01 1.10 -2.16 0.00 0.00 0.00 174.94 174.65 2kym s PRO 87 N 2.00 2.44 0.71 2.79 0.04 -1.26 -4.78 135.00 136.93 2kym s PRO 87 Ca 0.51 1.25 -0.05 0.00 0.04 0.00 0.00 61.00 62.75 2kym s PRO 87 Cb -0.21 -1.91 0.08 0.00 0.04 0.00 0.00 34.50 32.50 2kym s PRO 87 CO 0.20 -1.51 1.00 0.95 0.04 0.00 0.00 177.00 177.68 2kym s THR 88 N -2.71 2.29 0.15 1.26 -4.23 -1.26 -2.05 115.64 109.09 2kym s THR 88 Ca 0.63 -0.37 -0.20 0.00 -1.18 0.00 0.00 61.69 60.57 2kym s THR 88 Cb -0.18 -2.92 0.04 0.00 1.34 0.00 0.00 72.50 70.78 2kym s THR 88 CO 0.51 0.00 1.65 0.58 -0.54 0.00 0.00 174.62 176.82 2kym h VAL 89 N -0.58 0.51 -0.30 2.29 2.07 -1.10 -0.22 116.25 118.91 2kym h VAL 89 Ca -0.43 0.00 0.07 0.00 0.82 0.00 0.00 66.70 67.16 2kym h VAL 89 Cb 1.30 0.51 -0.07 0.00 -1.52 0.00 0.00 31.29 31.50 2kym h VAL 89 CO 0.53 0.00 -0.19 -0.33 0.02 0.00 0.00 177.57 177.60 2kym h GLU 90 N -0.14 -0.15 -0.94 1.57 5.08 -1.94 0.15 114.58 118.21 2kym h GLU 90 Ca 0.15 0.01 0.05 0.00 -1.00 0.00 0.00 59.36 58.57 2kym h GLU 90 Cb 0.37 0.03 -0.06 0.00 0.50 0.00 0.00 28.75 29.60 2kym h GLU 90 CO -0.37 -0.10 0.61 1.96 -1.00 0.00 0.00 179.01 180.11 2kym h GLN 91 N -0.16 1.11 -0.66 2.33 1.08 -1.78 -1.12 115.11 115.92 2kym h GLN 91 Ca 0.16 -0.07 -0.07 0.00 -1.45 0.00 0.00 58.65 57.22 2kym h GLN 91 Cb 0.40 -0.25 -0.03 0.00 -0.05 0.00 0.00 27.48 27.55 2kym h GLN 91 CO -0.40 0.74 0.14 2.35 -0.95 0.00 0.00 178.83 180.70 2kym h TRP 92 N 1.15 1.14 0.20 2.96 7.01 0.26 -0.77 115.95 127.91 2kym h TRP 92 Ca 0.39 -0.15 -0.01 0.00 2.11 0.00 0.00 58.89 61.23 2kym h TRP 92 Cb 0.07 -0.32 0.00 0.00 -2.10 0.00 0.00 29.16 26.81 2kym h TRP 92 CO -0.01 0.95 -0.10 0.87 -2.79 0.00 0.00 178.44 177.36 2kym h LYS 93 N 1.01 -0.26 -0.63 2.65 1.79 -0.04 -1.03 116.57 120.06 2kym h LYS 93 Ca 0.21 0.02 0.02 0.00 -2.18 0.00 0.00 60.65 58.71 2kym h LYS 93 Cb 0.40 0.06 -0.04 0.00 -1.58 0.00 0.00 32.23 31.08 2kym h LYS 93 CO 0.01 -0.04 0.40 0.22 -1.08 0.00 0.00 179.45 178.96 2kym h ASP 94 N -0.46 0.66 -0.15 0.86 3.58 -1.19 0.17 116.42 119.90 2kym h ASP 94 Ca -0.03 -0.01 0.01 0.00 0.42 0.00 0.00 57.03 57.42 2kym h ASP 94 Cb 0.35 -0.15 -0.01 0.00 1.72 0.00 0.00 39.33 41.24 2kym h ASP 94 CO 0.05 0.47 0.07 1.56 -2.88 0.00 0.00 179.24 178.51 2kym h GLN 95 N 0.79 0.15 -0.53 0.28 1.08 -1.06 -0.60 115.11 115.22 2kym h GLN 95 Ca 0.24 -0.01 -0.10 0.00 -1.45 0.00 0.00 58.65 57.34 2kym h GLN 95 Cb -0.02 -0.03 -0.02 0.00 -0.05 0.00 0.00 27.48 27.35 2kym h GLN 95 CO -0.08 0.10 -0.05 1.79 -0.95 0.00 0.00 178.83 179.64 2kym h THR 96 N 0.16 1.26 0.72 -0.54 1.35 -0.88 -0.06 112.91 114.92 2kym h THR 96 Ca 0.06 -1.16 -0.04 0.00 -0.55 0.00 0.00 66.41 64.72 2kym h THR 96 Cb 0.01 0.90 0.01 0.00 -1.73 0.00 0.00 68.15 67.33 2kym h THR 96 CO -0.04 0.41 -0.35 0.03 -0.25 0.00 0.00 175.52 175.33 2kym h ARG 97 N 0.86 -0.93 -0.76 4.72 3.08 -0.35 -0.50 114.38 120.50 2kym h ARG 97 Ca 0.15 0.06 -0.04 0.00 0.07 0.00 0.00 59.98 60.23 2kym h ARG 97 Cb 0.57 0.21 -0.03 0.00 0.08 0.00 0.00 29.97 30.80 2kym h ARG 97 CO 0.03 -0.61 0.34 0.00 -1.07 0.00 0.00 179.97 178.66 2kym h ARG 98 N -1.00 1.11 -0.64 0.04 3.08 -1.12 0.23 114.38 116.08 2kym h ARG 98 Ca -0.10 -0.18 0.02 0.00 0.07 0.00 0.00 59.98 59.79 2kym h ARG 98 Cb 0.75 -0.19 -0.04 0.00 0.08 0.00 0.00 29.97 30.57 2kym h ARG 98 CO 0.16 0.88 0.41 -0.92 -1.07 0.00 0.00 179.97 179.44 2kym h TYR 99 N 1.10 0.78 0.00 3.04 3.20 -0.88 -2.29 116.97 121.92 2kym h TYR 99 Ca 0.26 0.02 -0.11 0.00 3.14 0.00 0.00 58.73 62.04 2kym h TYR 99 Cb 0.16 -0.26 -0.02 0.00 1.54 0.00 0.00 36.73 38.15 2kym h TYR 99 CO 0.02 0.47 -0.54 0.87 -1.64 0.00 0.00 178.16 177.34 2kym h LYS 100 N 0.83 0.00 0.00 1.82 1.79 -0.77 -3.46 116.57 116.78 2kym h LYS 100 Ca 0.25 0.00 -0.33 0.00 -2.18 0.00 0.00 60.65 58.39 2kym h LYS 100 Cb -0.05 0.00 0.13 0.00 -1.58 0.00 0.00 32.23 30.73 2kym h LYS 100 CO -0.07 0.54 0.32 0.39 -1.08 0.00 0.00 179.45 179.55 2kym n GLU 101 N -3.24 -1.01 -3.26 3.15 -0.58 0.79 -4.42 120.64 112.07 2kym n GLU 101 Ca 0.02 -1.56 -0.20 0.00 -0.42 0.00 0.00 57.16 54.99 2kym n GLU 101 Cb 0.75 -1.05 0.06 0.00 -0.57 0.00 0.00 31.44 30.63 2kym n GLU 101 CO 0.00 0.00 0.00 0.45 -0.48 0.00 0.00 177.13 177.10 2kym n SER 102 N -3.67 -5.72 -2.04 1.62 2.88 -1.26 -4.92 113.62 100.51 2kym n SER 102 Ca 0.13 -0.39 0.00 0.00 -1.33 0.00 0.00 58.87 57.28 2kym n SER 102 Cb 0.44 -4.41 0.00 0.00 -0.75 0.00 0.00 64.21 59.49 2kym n SER 102 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 2kym n SER 103 N -2.25 0.00 -4.86 -3.46 3.41 -1.26 -5.06 113.62 100.14 2kym n SER 103 Ca -0.03 -0.94 -0.31 0.00 -0.26 0.00 0.00 58.87 57.33 2kym n SER 103 Cb 0.57 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.52 2kym n SER 103 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 2kym s ILE 104 N -0.68 4.61 1.03 -1.33 1.01 -1.26 -5.02 121.20 119.56 2kym s ILE 104 Ca 0.00 0.95 -0.18 0.00 0.00 0.00 0.00 60.65 61.42 2kym s ILE 104 Cb 0.00 -3.80 0.01 0.00 0.01 0.00 0.00 42.46 38.68 2kym s ILE 104 CO 0.00 -1.01 -0.17 0.00 0.00 0.00 0.00 174.94 173.76 2kym n GLN 105 N -2.48 -0.71 -4.37 2.79 -0.00 -1.26 -5.01 117.38 106.34 2kym n GLN 105 Ca 0.06 -0.19 -0.29 0.00 -0.00 0.00 0.00 57.00 56.59 2kym n GLN 105 Cb 0.54 -1.57 -0.12 0.00 -0.00 0.00 0.00 30.24 29.09 2kym n GLN 105 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.06 177.48 2kym s ILE 106 N -2.23 2.49 0.00 -0.39 -1.09 -1.26 -5.14 121.20 113.58 2kym s ILE 106 Ca 0.51 -1.74 0.00 0.00 -2.23 0.00 0.00 60.65 57.19 2kym s ILE 106 Cb -0.13 -2.14 0.00 0.00 -1.58 0.00 0.00 42.46 38.61 2kym s ILE 106 CO 0.69 0.04 0.00 0.61 -1.23 0.00 0.00 174.94 175.05 2kym n GLY 107 N 0.70 1.85 3.70 6.18 0.00 -1.26 -5.04 105.19 111.32 2kym n GLY 107 Ca -0.16 -1.54 -0.42 0.00 0.00 0.00 0.00 46.02 43.91 2kym n GLY 107 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2kym s ASN 108 N -0.93 7.20 0.00 1.61 3.84 -1.26 -4.91 114.94 120.49 2kym s ASN 108 Ca 0.00 1.78 0.00 0.00 0.21 0.00 0.00 52.86 54.85 2kym s ASN 108 Cb 0.00 -2.57 0.00 0.00 -0.55 0.00 0.00 41.25 38.13 2kym s ASN 108 CO 0.00 -0.41 0.00 0.61 -2.79 0.00 0.00 177.10 174.51 2kym n GLY 109 N 3.11 -0.01 3.55 1.21 0.00 -1.26 -5.00 105.19 106.79 2kym n GLY 109 Ca 0.08 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.75 2kym n GLY 109 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2kym n HIS 110 N -2.18 1.37 0.00 1.61 8.25 -1.26 -4.82 115.22 118.18 2kym n HIS 110 Ca 0.00 0.13 0.00 0.00 -0.26 0.00 0.00 57.72 57.59 2kym n HIS 110 Cb 0.00 -2.62 0.00 0.00 1.12 0.00 0.00 29.99 28.49 2kym n HIS 110 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2kym n GLY 111 N 6.07 0.27 3.59 -1.41 0.00 -1.26 -5.03 105.19 107.42 2kym n GLY 111 Ca 0.39 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.40 2kym n GLY 111 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2kym s GLN 112 N -0.53 0.51 0.72 1.61 0.74 -1.26 -5.17 119.66 116.28 2kym s GLN 112 Ca 0.00 1.24 -0.06 0.00 0.05 0.00 0.00 55.36 56.59 2kym s GLN 112 Cb 0.00 0.69 0.08 0.00 1.10 0.00 0.00 33.01 34.89 2kym s GLN 112 CO 0.00 -0.17 1.02 -1.12 -0.55 0.00 0.00 175.29 174.47 2kym s SER 113 N 2.65 4.61 -0.09 6.67 0.01 -1.26 -5.03 113.70 121.26 2kym s SER 113 Ca -0.06 0.27 0.13 0.00 1.31 0.00 0.00 55.95 57.60 2kym s SER 113 Cb -0.10 -0.84 -0.19 0.00 0.21 0.00 0.00 66.02 65.11 2kym s SER 113 CO -0.19 -1.71 0.14 0.00 0.41 0.00 0.00 173.24 171.89 2kym n GLN 114 N -2.94 1.35 -2.60 12.44 0.00 -1.26 -5.05 117.38 119.32 2kym n GLN 114 Ca 0.10 -0.05 -0.09 0.00 0.00 0.00 0.00 57.00 56.96 2kym n GLN 114 Cb 0.60 -1.34 0.04 0.00 0.00 0.00 0.00 30.24 29.54 2kym n GLN 114 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 2kym n GLY 115 N 2.01 -0.36 0.66 2.61 0.00 -1.26 -4.99 105.19 103.86 2kym n GLY 115 Ca -0.15 0.24 -0.02 0.00 0.00 0.00 0.00 46.02 46.09 2kym n GLY 115 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2kym n LEU 116 N -2.59 0.99 -0.80 0.99 4.77 -1.26 -5.37 117.00 113.72 2kym n LEU 116 Ca -0.05 0.01 0.13 0.00 -0.03 0.00 0.00 56.01 56.07 2kym n LEU 116 Cb 0.58 -0.05 0.24 0.00 -2.33 0.00 0.00 43.42 41.85 2kym n LEU 116 CO 0.37 0.18 0.71 1.21 -1.33 0.00 0.00 177.39 178.53