#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 2.57 1.08 3.17 0.00 -1.25 -5.05 121.76 122.28 2kym s ALA -1 Ca 0.00 0.08 -0.15 0.00 0.00 0.00 0.00 51.96 51.89 2kym s ALA -1 Cb 0.00 -3.18 0.23 0.00 0.00 0.00 0.00 23.12 20.17 2kym s ALA -1 CO 0.00 -1.36 1.10 -1.25 0.00 0.00 0.00 175.76 174.25 2kym s PRO 1 N -5.03 -0.25 -0.23 0.00 0.04 -1.26 -4.96 135.00 123.30 2kym s PRO 1 Ca 0.59 0.28 -0.08 0.00 0.04 0.00 0.00 61.00 61.83 2kym s PRO 1 Cb -0.15 -1.68 0.10 0.00 0.04 0.00 0.00 34.50 32.82 2kym s PRO 1 CO 0.55 -3.13 0.50 -1.17 0.04 0.00 0.00 177.00 173.79 2kym s LEU 2 N -6.66 -0.81 -0.01 -3.56 0.20 -1.26 -5.08 118.68 101.49 2kym s LEU 2 Ca 0.67 1.20 0.04 0.00 0.69 0.00 0.00 54.13 56.74 2kym s LEU 2 Cb -0.15 1.70 -0.01 0.00 -0.43 0.00 0.00 46.19 47.30 2kym s LEU 2 CO 0.57 -0.23 -0.15 -0.36 -0.29 0.00 0.00 176.35 175.90 2kym s PHE 3 N 2.67 1.34 0.12 5.38 0.08 -1.24 -2.49 117.98 123.84 2kym s PHE 3 Ca -0.04 -0.26 0.03 0.00 0.12 0.00 0.00 56.93 56.78 2kym s PHE 3 Cb -0.12 -0.87 -0.04 0.00 -0.57 0.00 0.00 43.02 41.42 2kym s PHE 3 CO -0.15 -0.03 -0.08 0.00 -0.10 0.00 0.00 175.22 174.85 2kym s ALA 4 N -0.30 1.17 -0.10 5.36 0.00 -0.48 -0.65 121.76 126.76 2kym s ALA 4 Ca 0.05 -1.39 0.02 0.00 0.00 0.00 0.00 51.96 50.64 2kym s ALA 4 Cb -0.06 0.10 0.01 0.00 0.00 0.00 0.00 23.12 23.17 2kym s ALA 4 CO -0.00 -0.16 -0.16 0.54 0.00 0.00 0.00 175.76 175.97 2kym s VAL 5 N -3.40 1.55 0.08 0.00 0.11 -0.27 -0.62 120.40 117.86 2kym s VAL 5 Ca 0.13 -0.69 -0.31 0.00 -2.93 0.00 0.00 61.98 58.18 2kym s VAL 5 Cb 0.03 -1.40 -0.08 0.00 -1.53 0.00 0.00 36.38 33.41 2kym s VAL 5 CO -0.02 0.45 1.52 0.42 -3.33 0.00 0.00 175.10 174.14 2kym s THR 6 N 0.81 3.19 -0.23 5.04 -4.23 -0.80 -1.04 115.64 118.37 2kym s THR 6 Ca -0.10 0.72 0.20 0.00 -1.18 0.00 0.00 61.69 61.33 2kym s THR 6 Cb -0.16 -3.46 -0.29 0.00 1.34 0.00 0.00 72.50 69.93 2kym s THR 6 CO 0.01 0.02 0.53 0.18 -0.54 0.00 0.00 174.62 174.82 2kym n LEU 7 N 4.92 0.21 -4.24 4.79 4.77 -1.24 -0.08 117.00 126.15 2kym n LEU 7 Ca 0.14 -0.12 -0.13 0.00 -0.03 0.00 0.00 56.01 55.87 2kym n LEU 7 Cb 0.41 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.40 2kym n LEU 7 CO 0.61 0.05 -0.39 -0.31 -1.33 0.00 0.00 177.39 176.02 2kym s TYR 8 N -3.26 1.19 -0.57 -1.77 1.51 -1.26 -4.66 117.35 108.54 2kym s TYR 8 Ca -0.04 -0.83 -0.24 0.00 -1.01 0.00 0.00 57.07 54.95 2kym s TYR 8 Cb 0.13 -0.64 0.04 0.00 -0.11 0.00 0.00 41.96 41.39 2kym s TYR 8 CO 0.82 -0.01 0.95 -2.00 -1.11 0.00 0.00 175.55 174.20 2kym s GLU 9 N -3.79 3.31 -0.12 -0.62 2.12 -1.26 -3.77 118.70 114.56 2kym s GLU 9 Ca 0.17 -0.32 -0.25 0.00 0.36 0.00 0.00 54.97 54.93 2kym s GLU 9 Cb 0.04 -4.07 -0.02 0.00 0.26 0.00 0.00 34.13 30.33 2kym s GLU 9 CO 0.00 -1.53 0.80 0.12 -0.54 0.00 0.00 175.26 174.11 2kym s PHE 10 N 3.99 3.49 -0.52 5.30 5.36 -0.08 -4.96 117.98 130.56 2kym s PHE 10 Ca 0.30 1.28 -0.14 0.00 -0.96 0.00 0.00 56.93 57.41 2kym s PHE 10 Cb -0.13 -2.95 0.13 0.00 -0.34 0.00 0.00 43.02 39.72 2kym s PHE 10 CO 0.18 -0.12 0.45 0.15 -1.46 0.00 0.00 175.22 174.43 2kym s LYS 11 N 1.62 2.85 0.59 10.12 1.02 -1.26 -2.54 119.74 132.13 2kym s LYS 11 Ca 0.39 -1.71 -0.18 0.00 0.02 0.00 0.00 55.97 54.48 2kym s LYS 11 Cb -0.17 -4.19 -0.06 0.00 -0.52 0.00 0.00 37.83 32.88 2kym s LYS 11 CO 0.16 -1.28 0.80 0.00 -0.92 0.00 0.00 175.35 174.10 2kym n ALA 12 N 5.15 -0.34 0.00 5.17 0.00 -1.25 -4.94 120.51 124.30 2kym n ALA 12 Ca -0.12 -0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.32 2kym n ALA 12 Cb 0.40 -2.00 0.00 0.00 0.00 0.00 0.00 19.45 17.85 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 -0.64 1.24 -3.85 0.00 0.28 -1.26 -4.98 120.64 111.44 2kym n GLU 13 Ca 0.13 0.00 -0.25 0.00 -0.16 0.00 0.00 57.16 56.88 2kym n GLU 13 Cb 0.47 -0.92 -0.03 0.00 1.43 0.00 0.00 31.44 32.39 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 -2.14 0.87 -0.01 3.44 5.12 -1.26 -5.02 116.66 117.66 2kym n ARG 14 Ca 0.00 -3.02 -0.06 0.00 -1.93 0.00 0.00 57.85 52.84 2kym n ARG 14 Cb 0.42 0.56 0.14 0.00 -1.16 0.00 0.00 32.46 32.42 2kym n ARG 14 CO 0.00 0.00 0.00 0.38 -1.93 0.00 0.00 177.63 176.08 2kym h ASP 15 N 0.78 0.59 -0.45 0.55 3.04 -2.04 -3.06 116.42 115.83 2kym h ASP 15 Ca -0.32 -0.23 -0.11 0.00 -3.24 0.00 0.00 57.03 53.12 2kym h ASP 15 Cb 1.08 -0.16 -0.01 0.00 -1.04 0.00 0.00 39.33 39.20 2kym h ASP 15 CO 0.52 0.87 -0.17 -2.24 -2.04 0.00 0.00 179.24 176.18 2kym h ASP 16 N 0.49 0.92 -3.54 4.15 2.03 -1.96 -3.45 116.42 115.06 2kym h ASP 16 Ca 0.06 -0.39 -0.46 0.00 -0.73 0.00 0.00 57.03 55.51 2kym h ASP 16 Cb 0.78 -0.25 0.21 0.00 -0.83 0.00 0.00 39.33 39.24 2kym h ASP 16 CO 0.06 1.10 0.07 -1.61 -1.03 0.00 0.00 179.24 177.83 2kym s GLU 17 N -4.71 -0.39 0.01 4.15 0.41 -1.16 -3.61 118.70 113.41 2kym s GLU 17 Ca -0.12 1.03 -0.04 0.00 -0.41 0.00 0.00 54.97 55.43 2kym s GLU 17 Cb 0.11 -1.60 -0.01 0.00 -1.78 0.00 0.00 34.13 30.85 2kym s GLU 17 CO 0.85 -3.42 0.05 -1.17 -0.49 0.00 0.00 175.26 171.08 2kym s LEU 18 N -7.04 1.90 -0.13 1.80 2.96 -1.26 -4.76 118.68 112.15 2kym s LEU 18 Ca 0.68 -0.35 -0.15 0.00 -0.22 0.00 0.00 54.13 54.09 2kym s LEU 18 Cb -0.24 0.39 -0.05 0.00 0.50 0.00 0.00 46.19 46.79 2kym s LEU 18 CO 0.63 -0.34 0.36 1.51 -1.32 0.00 0.00 176.35 177.19 2kym s ASP 19 N -1.42 6.55 -0.02 3.68 -4.77 -1.26 -3.81 116.67 115.62 2kym s ASP 19 Ca -0.15 0.65 -0.13 0.00 -3.30 0.00 0.00 52.55 49.61 2kym s ASP 19 Cb -0.09 -2.22 0.02 0.00 -1.09 0.00 0.00 42.92 39.54 2kym s ASP 19 CO 0.00 0.10 0.28 0.54 0.70 0.00 0.00 175.17 176.79 2kym s VAL 20 N 0.30 0.06 0.27 2.11 0.11 -1.05 -5.01 120.40 117.19 2kym s VAL 20 Ca 0.20 -0.49 0.09 0.00 -2.93 0.00 0.00 61.98 58.84 2kym s VAL 20 Cb -0.14 -0.57 -0.04 0.00 -1.53 0.00 0.00 36.38 34.10 2kym s VAL 20 CO 0.07 -0.27 0.07 -0.44 -3.33 0.00 0.00 175.10 171.20 2kym s SER 21 N -1.27 4.86 0.07 3.54 0.01 -1.26 -0.90 113.70 118.75 2kym s SER 21 Ca -0.13 -0.53 -0.31 0.00 1.31 0.00 0.00 55.95 56.29 2kym s SER 21 Cb -0.06 -1.01 -0.07 0.00 0.21 0.00 0.00 66.02 65.10 2kym s SER 21 CO 0.04 -0.04 1.39 -2.16 0.41 0.00 0.00 173.24 172.88 2kym s PRO 22 N -3.74 4.31 0.00 12.44 0.04 -1.25 -3.05 135.00 143.75 2kym s PRO 22 Ca 0.32 2.03 0.00 0.00 0.04 0.00 0.00 61.00 63.39 2kym s PRO 22 Cb -0.07 -3.38 0.00 0.00 0.04 0.00 0.00 34.50 31.10 2kym s PRO 22 CO 0.22 -0.48 0.00 0.41 0.04 0.00 0.00 177.00 177.18 2kym n GLY 23 N 3.55 0.70 3.91 0.56 0.00 0.89 -4.97 105.19 109.83 2kym n GLY 23 Ca 0.12 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.86 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 3.62 -0.06 1.61 0.41 -1.17 -4.92 118.70 117.64 2kym s GLU 24 Ca 0.00 -0.01 -0.12 0.00 -0.41 0.00 0.00 54.97 54.44 2kym s GLU 24 Cb 0.00 -2.64 -0.05 0.00 -1.78 0.00 0.00 34.13 29.66 2kym s GLU 24 CO 0.00 0.19 0.29 -0.80 -0.49 0.00 0.00 175.26 174.46 2kym s ASN 25 N -3.25 6.62 0.01 -0.19 -0.87 -1.26 -1.91 114.94 114.08 2kym s ASN 25 Ca 0.44 0.74 0.04 0.00 -1.57 0.00 0.00 52.86 52.50 2kym s ASN 25 Cb -0.11 -2.17 -0.01 0.00 -0.02 0.00 0.00 41.25 38.94 2kym s ASN 25 CO 0.31 0.34 -0.11 -0.76 -2.57 0.00 0.00 177.10 174.31 2kym s LEU 26 N -0.94 2.07 -0.32 0.60 2.01 0.21 -3.78 118.68 118.54 2kym s LEU 26 Ca 0.20 -0.28 -0.12 0.00 0.01 0.00 0.00 54.13 53.94 2kym s LEU 26 Cb -0.15 -0.54 -0.02 0.00 0.01 0.00 0.00 46.19 45.49 2kym s LEU 26 CO 0.09 0.09 0.21 -0.55 1.01 0.00 0.00 176.35 177.20 2kym s SER 27 N -0.55 5.95 0.28 2.29 0.15 -0.56 -1.38 113.70 119.88 2kym s SER 27 Ca 0.03 -0.32 -0.20 0.00 0.70 0.00 0.00 55.95 56.15 2kym s SER 27 Cb -0.05 -2.11 -0.09 0.00 -1.71 0.00 0.00 66.02 62.06 2kym s SER 27 CO 0.00 -0.17 0.79 -0.63 1.20 0.00 0.00 173.24 174.43 2kym s ILE 28 N 1.71 4.50 -0.01 6.45 1.01 -1.04 -0.45 121.20 133.38 2kym s ILE 28 Ca 0.06 1.35 0.01 0.00 0.00 0.00 0.00 60.65 62.07 2kym s ILE 28 Cb -0.17 -3.82 -0.02 0.00 0.01 0.00 0.00 42.46 38.46 2kym s ILE 28 CO 0.10 0.07 0.01 0.00 0.00 0.00 0.00 174.94 175.12 2kym s ALA 30 N -2.05 -1.74 0.40 0.00 0.00 -1.25 -4.72 121.76 112.39 2kym s ALA 30 Ca -0.01 -0.24 0.04 0.00 0.00 0.00 0.00 51.96 51.75 2kym s ALA 30 Cb 0.01 0.77 -0.03 0.00 0.00 0.00 0.00 23.12 23.86 2kym s ALA 30 CO 0.06 -1.08 0.11 -3.38 0.00 0.00 0.00 175.76 171.48 2kym s HIS 31 N -2.19 1.81 -0.30 0.00 -0.00 -1.02 -1.03 115.29 112.56 2kym s HIS 31 Ca 0.22 -1.22 -0.03 0.00 -0.00 0.00 0.00 55.06 54.03 2kym s HIS 31 Cb -0.02 -1.19 0.10 0.00 -0.00 0.00 0.00 32.58 31.48 2kym s HIS 31 CO 0.04 -0.23 0.13 -0.47 -0.00 0.00 0.00 174.74 174.20 2kym s TYR 32 N -3.23 0.70 -1.42 0.38 5.04 0.87 -0.12 117.35 119.58 2kym s TYR 32 Ca 0.25 -1.14 0.00 0.00 -2.44 0.00 0.00 57.07 53.74 2kym s TYR 32 Cb 0.04 -1.11 0.00 0.00 0.35 0.00 0.00 41.96 41.23 2kym s TYR 32 CO 0.14 -0.84 0.00 -3.47 -1.34 0.00 0.00 175.55 170.04 2kym n ASP 33 N 5.07 -4.30 -1.55 4.32 2.03 -1.26 0.01 116.55 120.87 2kym n ASP 33 Ca -0.04 0.23 -0.18 0.00 0.52 0.00 0.00 54.79 55.33 2kym n ASP 33 Cb 0.42 -3.75 -0.05 0.00 -0.72 0.00 0.00 41.12 37.01 2kym n ASP 33 CO 0.00 0.00 0.00 -1.22 -1.92 0.00 0.00 177.20 174.06 2kym n TYR 34 N -2.90 -0.26 -0.04 -0.67 4.02 -1.26 -4.84 117.16 111.21 2kym n TYR 34 Ca -0.17 0.00 -0.09 0.00 -0.01 0.00 0.00 57.90 57.63 2kym n TYR 34 Cb 0.57 -3.17 -0.03 0.00 -0.02 0.00 0.00 39.34 36.70 2kym n TYR 34 CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 176.86 176.24 2kym n GLU 35 N -2.55 0.23 -4.36 -0.72 -0.58 0.10 -4.92 120.64 107.84 2kym n GLU 35 Ca -0.19 0.10 -0.32 0.00 -0.42 0.00 0.00 57.16 56.33 2kym n GLU 35 Cb 0.60 -0.90 -0.10 0.00 -0.57 0.00 0.00 31.44 30.48 2kym n GLU 35 CO 0.00 0.00 0.00 -1.58 -0.48 0.00 0.00 177.13 175.07 2kym s TRP 36 N -2.26 3.00 -0.11 -0.32 0.52 -1.05 -2.63 118.94 116.08 2kym s TRP 36 Ca -0.15 0.03 0.02 0.00 0.02 0.00 0.00 56.10 56.03 2kym s TRP 36 Cb 0.05 -1.65 -0.01 0.00 -1.15 0.00 0.00 33.47 30.71 2kym s TRP 36 CO 0.19 0.42 -0.20 -0.06 0.02 0.00 0.00 176.95 177.33 2kym s PHE 37 N -1.04 2.66 -0.80 -1.98 0.08 0.98 -0.09 117.98 117.79 2kym s PHE 37 Ca 0.18 -0.88 -0.21 0.00 0.12 0.00 0.00 56.93 56.14 2kym s PHE 37 Cb -0.11 -1.76 0.09 0.00 -0.57 0.00 0.00 43.02 40.67 2kym s PHE 37 CO 0.09 -0.33 1.07 0.42 -0.10 0.00 0.00 175.22 176.37 2kym s ILE 38 N 0.33 4.45 0.22 0.64 -1.09 -0.20 -1.24 121.20 124.31 2kym s ILE 38 Ca -0.16 -0.88 0.08 0.00 -2.23 0.00 0.00 60.65 57.46 2kym s ILE 38 Cb -0.17 -4.76 -0.04 0.00 -1.58 0.00 0.00 42.46 35.91 2kym s ILE 38 CO 0.08 -1.52 0.05 0.00 -1.23 0.00 0.00 174.94 172.32 2kym s ALA 39 N 3.60 3.30 0.12 9.38 0.00 -1.26 -0.31 121.76 136.60 2kym s ALA 39 Ca 0.29 -1.47 0.04 0.00 0.00 0.00 0.00 51.96 50.82 2kym s ALA 39 Cb -0.10 -1.01 -0.04 0.00 0.00 0.00 0.00 23.12 21.96 2kym s ALA 39 CO 0.01 0.36 -0.10 -1.59 0.00 0.00 0.00 175.76 174.43 2kym s LYS 40 N -3.41 0.96 -0.22 0.00 -2.85 0.40 -2.83 119.74 111.80 2kym s LYS 40 Ca 0.30 -1.32 -0.29 0.00 -1.00 0.00 0.00 55.97 53.66 2kym s LYS 40 Cb -0.08 -0.57 -0.03 0.00 -2.06 0.00 0.00 37.83 35.09 2kym s LYS 40 CO 0.21 0.08 1.61 -1.25 0.10 0.00 0.00 175.35 176.09 2kym s PRO 41 N -3.34 3.81 -0.04 1.78 0.04 -1.26 -1.50 135.00 134.50 2kym s PRO 41 Ca 0.12 1.67 -0.22 0.00 0.04 0.00 0.00 61.00 62.61 2kym s PRO 41 Cb 0.00 -4.03 -0.30 0.00 0.04 0.00 0.00 34.50 30.21 2kym s PRO 41 CO 0.00 -1.27 0.92 0.82 0.04 0.00 0.00 177.00 177.51 2kym h ILE 42 N 6.12 1.51 0.19 0.56 2.04 -1.92 -3.38 117.51 122.62 2kym h ILE 42 Ca -0.34 -2.47 -0.00 0.00 1.00 0.00 0.00 64.86 63.06 2kym h ILE 42 Cb 1.15 3.12 -0.02 0.00 -0.74 0.00 0.00 36.82 40.33 2kym h ILE 42 CO 1.00 0.70 -0.31 0.78 0.00 0.00 0.00 178.15 180.32 2kym h ASN 43 N -0.34 -0.91 -1.49 1.72 4.21 -1.91 -3.44 115.58 113.42 2kym h ASN 43 Ca -0.13 0.08 -0.46 0.00 1.21 0.00 0.00 56.30 57.00 2kym h ASN 43 Cb 1.58 0.32 -0.01 0.00 -1.12 0.00 0.00 38.32 39.09 2kym h ASN 43 CO 0.15 -0.37 -0.33 0.00 -1.29 0.00 0.00 177.43 175.59 2kym s ARG 43 N -4.68 2.66 0.00 0.81 1.70 -1.26 -5.09 118.95 113.09 2kym s ARG 43 Ca -0.10 -1.41 0.00 0.00 -0.47 0.00 0.00 55.73 53.75 2kym s ARG 43 Cb 0.03 -2.54 0.00 0.00 -0.57 0.00 0.00 34.95 31.87 2kym s ARG 43 CO 0.36 -0.22 0.24 1.28 -1.08 0.00 0.00 175.30 175.89 2kym n LEU 44 N -1.67 0.65 0.00 -1.89 4.77 -1.26 -4.62 117.00 112.97 2kym n LEU 44 Ca 0.05 0.49 0.00 0.00 -0.03 0.00 0.00 56.01 56.52 2kym n LEU 44 Cb 0.61 -0.35 0.00 0.00 -2.33 0.00 0.00 43.42 41.35 2kym n LEU 44 CO 0.41 -0.35 0.00 0.61 -1.33 0.00 0.00 177.39 176.73 2kym n GLY 45 N 1.30 1.79 3.62 -0.72 0.00 -1.26 -4.66 105.19 105.25 2kym n GLY 45 Ca 0.00 0.44 -0.01 0.00 0.00 0.00 0.00 46.02 46.45 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 -0.36 0.30 -0.02 0.00 -1.26 -5.12 107.32 100.86 2kym s GLY 46 Ca 0.00 0.99 -0.29 0.00 0.00 0.00 0.00 44.72 45.42 2kym s GLY 46 CO 0.00 0.27 1.23 2.56 0.00 0.00 0.00 173.10 177.17 2kym s PRO 47 N -2.52 4.46 0.00 2.90 0.04 -1.26 -4.42 135.00 134.20 2kym s PRO 47 Ca 0.12 2.06 0.00 0.00 0.04 0.00 0.00 61.00 63.22 2kym s PRO 47 Cb 0.02 -3.12 0.00 0.00 0.04 0.00 0.00 34.50 31.44 2kym s PRO 47 CO -0.04 -0.05 0.00 0.41 0.04 0.00 0.00 177.00 177.36 2kym n GLY 48 N 1.07 5.31 3.12 0.56 0.00 -1.13 -4.97 105.19 109.15 2kym n GLY 48 Ca 0.00 -1.42 -0.12 0.00 0.00 0.00 0.00 46.02 44.48 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 0.26 -0.05 0.99 0.20 -1.24 -4.30 118.68 114.54 2kym s LEU 49 Ca 0.00 0.63 -0.02 0.00 0.69 0.00 0.00 54.13 55.43 2kym s LEU 49 Cb 0.00 0.91 0.03 0.00 -0.43 0.00 0.00 46.19 46.70 2kym s LEU 49 CO 0.00 -0.17 0.10 0.54 -0.29 0.00 0.00 176.35 176.53 2kym s VAL 50 N 1.32 -0.04 0.59 1.68 0.11 -0.38 -4.31 120.40 119.37 2kym s VAL 50 Ca -0.09 0.14 -0.17 0.00 -2.93 0.00 0.00 61.98 58.92 2kym s VAL 50 Cb -0.10 -0.17 -0.03 0.00 -1.53 0.00 0.00 36.38 34.55 2kym s VAL 50 CO -0.10 0.06 1.12 -2.16 -3.33 0.00 0.00 175.10 170.69 2kym s PRO 51 N 0.83 3.11 0.60 1.54 0.04 -1.26 -0.01 135.00 139.85 2kym s PRO 51 Ca -0.07 1.51 0.36 0.00 0.04 0.00 0.00 61.00 62.84 2kym s PRO 51 Cb -0.09 -1.98 1.93 0.00 0.04 0.00 0.00 34.50 34.40 2kym s PRO 51 CO -0.04 -1.03 2.23 0.28 0.04 0.00 0.00 177.00 178.49 2kym h VAL 52 N 0.67 0.25 0.00 -0.36 2.07 -1.82 -0.15 116.25 116.91 2kym h VAL 52 Ca -0.49 -0.20 0.00 0.00 0.82 0.00 0.00 66.70 66.84 2kym h VAL 52 Cb 1.25 1.15 0.00 0.00 -1.52 0.00 0.00 31.29 32.18 2kym h VAL 52 CO 0.56 0.03 0.00 -0.24 0.02 0.00 0.00 177.57 177.93 2kym n SER 53 N -3.38 0.00 -0.12 0.57 2.88 -1.26 -2.84 113.62 109.46 2kym n SER 53 Ca -0.02 -0.46 0.07 0.00 -1.33 0.00 0.00 58.87 57.13 2kym n SER 53 Cb 0.14 -0.16 0.09 0.00 -0.75 0.00 0.00 64.21 63.54 2kym n SER 53 CO 0.00 0.00 0.00 -1.22 -1.23 0.00 0.00 175.04 172.59 2kym n TYR 54 N -1.16 0.00 -3.66 0.66 4.02 -0.07 -4.93 117.16 112.02 2kym n TYR 54 Ca 0.17 -0.74 -0.15 0.00 -0.01 0.00 0.00 57.90 57.16 2kym n TYR 54 Cb 0.17 -0.11 -0.08 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 -2.06 0.03 -0.21 -0.72 -7.23 -1.13 -3.61 120.40 105.46 2kym s VAL 55 Ca 0.21 -0.26 -0.01 0.00 -1.81 0.00 0.00 61.98 60.11 2kym s VAL 55 Cb 0.19 -0.77 0.02 0.00 0.56 0.00 0.00 36.38 36.37 2kym s VAL 55 CO 0.02 -0.14 -0.11 -0.60 -0.31 0.00 0.00 175.10 173.96 2kym s ARG 56 N -1.18 3.01 -0.19 4.82 3.52 -0.21 -4.82 118.95 123.91 2kym s ARG 56 Ca -0.12 -0.84 -0.29 0.00 -0.13 0.00 0.00 55.73 54.35 2kym s ARG 56 Cb -0.03 -2.83 -0.03 0.00 -1.56 0.00 0.00 34.95 30.51 2kym s ARG 56 CO 0.06 -0.28 1.57 0.42 -0.81 0.00 0.00 175.30 176.26 2kym s ILE 57 N 1.34 3.76 0.28 4.11 -1.09 -1.26 -1.11 121.20 127.24 2kym s ILE 57 Ca 0.03 0.88 0.02 0.00 -2.23 0.00 0.00 60.65 59.35 2kym s ILE 57 Cb -0.15 -3.72 -0.04 0.00 -1.58 0.00 0.00 42.46 36.97 2kym s ILE 57 CO -0.07 -0.24 0.12 0.27 -1.23 0.00 0.00 174.94 173.79 2kym s ILE 58 N 4.74 0.48 0.07 2.92 -4.36 0.18 -4.45 121.20 120.77 2kym s ILE 58 Ca 0.69 -2.00 0.07 0.00 -0.26 0.00 0.00 60.65 59.15 2kym s ILE 58 Cb -0.26 -2.58 -0.04 0.00 1.25 0.00 0.00 42.46 40.84 2kym s ILE 58 CO 0.27 0.00 -0.15 -0.62 0.24 0.00 0.00 174.94 174.68 2kym s ASP 59 N -3.35 4.02 0.18 4.36 -1.08 -1.25 -3.59 116.67 115.97 2kym s ASP 59 Ca 0.36 -0.42 -0.02 0.00 -0.52 0.00 0.00 52.55 51.95 2kym s ASP 59 Cb 0.07 -0.68 0.08 0.00 -1.46 0.00 0.00 42.92 40.92 2kym s ASP 59 CO 0.15 0.22 1.46 -0.07 0.52 0.00 0.00 175.17 177.46 2kym h LEU 60 N 4.16 0.54 0.00 -1.34 3.38 -1.98 0.24 115.31 120.31 2kym h LEU 60 Ca -0.49 -0.33 -0.12 0.00 0.09 0.00 0.00 57.88 57.04 2kym h LEU 60 Cb 1.16 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 41.74 2kym h LEU 60 CO 0.49 1.05 -0.68 0.24 0.09 0.00 0.00 178.44 179.63 2kym h MET 61 N 0.33 0.00 -1.11 1.13 2.86 -2.04 -3.40 114.93 112.70 2kym h MET 61 Ca -0.02 0.00 -0.34 0.00 -2.06 0.00 0.00 59.70 57.28 2kym h MET 61 Cb 1.22 0.00 -0.24 0.00 0.06 0.00 0.00 31.60 32.64 2kym h MET 61 CO 0.12 0.47 -0.72 -3.47 1.06 0.00 0.00 176.91 174.37 2kym n ASP 62 N -3.16 -1.92 0.00 1.22 -0.08 -1.18 -4.97 116.55 106.46 2kym n ASP 62 Ca -0.00 -2.91 0.07 0.00 -1.51 0.00 0.00 54.79 50.44 2kym n ASP 62 Cb 0.76 0.84 0.32 0.00 2.34 0.00 0.00 41.12 45.38 2kym n ASP 62 CO 0.00 0.00 0.00 -0.81 0.12 0.00 0.00 177.20 176.51 2kym n PRO 63 N 2.11 0.07 0.03 -0.67 -0.04 0.82 -2.02 135.00 135.30 2kym n PRO 63 Ca 0.18 0.22 0.11 0.00 -0.04 0.00 0.00 63.50 63.97 2kym n PRO 63 Cb 0.56 -1.50 0.03 0.00 -0.04 0.00 0.00 33.50 32.55 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 -1.43 3.35 -0.02 0.55 0.00 -1.26 -3.48 120.51 118.22 2kym n ALA 64 Ca 0.05 -0.39 -0.12 0.00 0.00 0.00 0.00 53.44 52.97 2kym n ALA 64 Cb 0.15 -0.98 -0.10 0.00 0.00 0.00 0.00 19.45 18.52 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 -0.06 -0.77 0.00 3.64 -1.79 -3.29 116.57 114.30 2kym h LYS 65 Ca 0.00 0.00 -0.12 0.00 -1.27 0.00 0.00 60.65 59.26 2kym h LYS 65 Cb 0.74 0.01 -0.07 0.00 -0.41 0.00 0.00 32.23 32.50 2kym h LYS 65 CO 0.00 0.56 0.15 0.66 -2.27 0.00 0.00 179.45 178.55 2kym n TYR 66 N -4.78 1.85 0.12 1.91 4.02 -1.25 -4.11 117.16 114.92 2kym n TYR 66 Ca -0.08 -0.86 0.09 0.00 -0.01 0.00 0.00 57.90 57.04 2kym n TYR 66 Cb 0.32 -0.53 0.02 0.00 -0.02 0.00 0.00 39.34 39.13 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 0.63 0.00 -0.72 0.00 -1.62 -3.33 119.26 117.07 2kym h ALA 67 Ca 0.15 -0.16 -0.04 0.00 0.00 0.00 0.00 54.91 54.87 2kym h ALA 67 Cb 1.89 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 19.72 2kym h ALA 67 CO 0.53 0.18 -1.60 0.45 0.00 0.00 0.00 179.25 178.81 2kym n SER 68 N -2.82 0.40 -4.53 0.00 2.88 -1.26 -4.97 113.62 103.31 2kym n SER 68 Ca -0.01 0.16 -0.38 0.00 -1.33 0.00 0.00 58.87 57.31 2kym n SER 68 Cb 0.60 1.19 0.04 0.00 -0.75 0.00 0.00 64.21 65.29 2kym n SER 68 CO 0.00 0.00 0.00 0.55 -1.23 0.00 0.00 175.04 174.36 2kym n VAL 69 N -2.50 2.82 -3.37 2.46 3.14 -1.25 -4.93 118.33 114.70 2kym n VAL 69 Ca -0.05 -0.50 -0.44 0.00 -2.96 0.00 0.00 64.34 60.39 2kym n VAL 69 Cb 0.62 -0.89 -0.08 0.00 -1.06 0.00 0.00 33.84 32.43 2kym n VAL 69 CO 0.00 0.00 0.00 -0.62 -6.46 0.00 0.00 176.83 169.75 2kym s ASP 70 N -1.16 6.15 0.16 6.55 -1.08 -1.26 -4.93 116.67 121.10 2kym s ASP 70 Ca 0.71 -1.23 -0.10 0.00 -0.52 0.00 0.00 52.55 51.41 2kym s ASP 70 Cb -0.45 -2.19 0.02 0.00 -1.46 0.00 0.00 42.92 38.84 2kym s ASP 70 CO 0.52 -0.65 1.55 0.71 0.52 0.00 0.00 175.17 177.81 2kym h THR 71 N 5.75 1.27 -0.70 1.71 1.35 -1.90 -3.11 112.91 117.28 2kym h THR 71 Ca -0.28 -1.40 0.10 0.00 -0.55 0.00 0.00 66.41 64.27 2kym h THR 71 Cb 1.11 1.16 -0.07 0.00 -1.73 0.00 0.00 68.15 68.62 2kym h THR 71 CO 0.87 0.48 0.33 0.22 -0.25 0.00 0.00 175.52 177.17 2kym h TYR 72 N 0.84 0.58 -2.27 4.73 3.20 -1.92 -3.39 116.97 118.74 2kym h TYR 72 Ca 0.10 0.03 -0.57 0.00 3.14 0.00 0.00 58.73 61.43 2kym h TYR 72 Cb 0.82 -0.15 -0.01 0.00 1.54 0.00 0.00 36.73 38.92 2kym h TYR 72 CO 0.05 0.18 1.40 -0.51 -1.64 0.00 0.00 178.16 177.65 2kym s ASP 73 N -5.46 5.57 0.60 -2.11 1.11 -1.17 -4.82 116.67 110.39 2kym s ASP 73 Ca -0.13 1.52 0.29 0.00 0.18 0.00 0.00 52.55 54.41 2kym s ASP 73 Cb 0.18 -2.52 1.63 0.00 1.07 0.00 0.00 42.92 43.29 2kym s ASP 73 CO 0.76 -1.93 2.05 0.08 1.18 0.00 0.00 175.17 177.31 2kym h ARG 74 N 14.39 0.00 0.33 8.23 -0.00 -1.86 -1.94 114.38 133.52 2kym h ARG 74 Ca -0.36 0.00 -0.02 0.00 -0.00 0.00 0.00 59.98 59.60 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 1.01 0.00 -0.16 0.93 -0.00 0.00 0.00 179.97 181.76 2kym h GLU 75 N 0.00 -0.42 0.66 0.08 5.08 -1.91 -1.52 114.58 116.55 2kym h GLU 75 Ca 0.11 0.03 -0.03 0.00 -1.00 0.00 0.00 59.36 58.47 2kym h GLU 75 Cb 0.65 0.10 0.00 0.00 0.50 0.00 0.00 28.75 30.00 2kym h GLU 75 CO -0.00 -0.11 -0.35 1.96 -1.00 0.00 0.00 179.01 179.50 2kym h GLN 76 N -0.76 -0.90 -0.78 2.33 1.08 -1.61 -1.69 115.11 112.78 2kym h GLN 76 Ca -0.04 0.06 0.20 0.00 -1.45 0.00 0.00 58.65 57.42 2kym h GLN 76 Cb 0.51 0.20 -0.04 0.00 -0.05 0.00 0.00 27.48 28.10 2kym h GLN 76 CO 0.07 -0.60 0.54 -0.24 -0.95 0.00 0.00 178.83 177.66 2kym h VAL 77 N -0.94 0.66 0.26 -0.54 3.04 -1.53 -1.35 116.25 115.85 2kym h VAL 77 Ca -0.09 -0.05 -0.01 0.00 -1.01 0.00 0.00 66.70 65.54 2kym h VAL 77 Cb 0.74 0.51 0.00 0.00 -2.01 0.00 0.00 31.29 30.53 2kym h VAL 77 CO 0.12 0.02 -0.12 0.24 -1.01 0.00 0.00 177.57 176.82 2kym h MET 78 N 0.14 -0.33 -1.00 4.17 2.86 -0.72 -1.47 114.93 118.57 2kym h MET 78 Ca 0.38 0.02 0.10 0.00 -2.06 0.00 0.00 59.70 58.14 2kym h MET 78 Cb 1.30 0.08 -0.08 0.00 0.06 0.00 0.00 31.60 32.95 2kym h MET 78 CO -0.06 0.01 0.64 0.87 1.06 0.00 0.00 176.91 179.44 2kym h LYS 79 N -0.76 1.04 0.33 1.72 1.57 -0.42 0.10 116.57 120.16 2kym h LYS 79 Ca -0.04 -0.06 -0.02 0.00 -1.87 0.00 0.00 60.65 58.67 2kym h LYS 79 Cb 0.50 -0.23 0.00 0.00 0.08 0.00 0.00 32.23 32.58 2kym h LYS 79 CO 0.06 0.69 -0.16 0.82 -0.57 0.00 0.00 179.45 180.28 2kym h ILE 80 N 1.07 0.68 -0.00 1.86 2.04 -1.27 -1.16 117.51 120.72 2kym h ILE 80 Ca 0.47 -0.43 0.00 0.00 1.00 0.00 0.00 64.86 65.90 2kym h ILE 80 Cb 0.36 0.90 -0.00 0.00 -0.74 0.00 0.00 36.82 37.34 2kym h ILE 80 CO -0.23 0.08 0.00 0.40 0.00 0.00 0.00 178.15 178.41 2kym h ILE 81 N -0.70 0.96 0.13 -0.67 2.04 -0.88 0.16 117.51 118.55 2kym h ILE 81 Ca -0.05 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.81 2kym h ILE 81 Cb 0.48 1.00 0.00 0.00 -0.74 0.00 0.00 36.82 37.56 2kym h ILE 81 CO 0.08 0.00 -0.06 -0.78 0.00 0.00 0.00 178.15 177.38 2kym h ASP 82 N 0.00 -0.14 0.23 1.72 3.58 -0.62 -1.49 116.42 119.69 2kym h ASP 82 Ca 0.00 -0.39 -0.08 0.00 0.42 0.00 0.00 57.03 56.98 2kym h ASP 82 Cb 0.00 0.04 -0.01 0.00 1.72 0.00 0.00 39.33 41.08 2kym h ASP 82 CO -0.00 0.36 -0.31 -0.33 -2.88 0.00 0.00 179.24 176.08 2kym h GLU 83 N -0.71 0.14 -0.00 0.28 3.07 -0.89 -1.95 114.58 114.52 2kym h GLU 83 Ca -0.02 -0.05 0.00 0.00 -0.50 0.00 0.00 59.36 58.79 2kym h GLU 83 Cb 0.52 -0.01 0.00 0.00 -0.84 0.00 0.00 28.75 28.42 2kym h GLU 83 CO 0.03 0.45 -0.04 1.19 -1.40 0.00 0.00 179.01 179.24 2kym n PHE 84 N -4.13 0.00 -3.99 4.33 3.01 0.53 -4.92 117.46 112.30 2kym n PHE 84 Ca -0.01 0.00 -0.30 0.00 1.01 0.00 0.00 57.45 58.14 2kym n PHE 84 Cb 0.39 -0.30 0.00 0.00 -0.01 0.00 0.00 39.48 39.56 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 -1.27 -4.44 -2.70 -1.08 4.01 -0.65 -3.91 118.16 108.12 2kym n LYS 85 Ca 0.13 0.51 -0.43 0.00 -0.51 0.00 0.00 58.31 58.00 2kym n LYS 85 Cb 0.27 -5.19 -0.02 0.00 -0.51 0.00 0.00 35.03 29.57 2kym n LYS 85 CO 0.00 0.00 0.00 0.42 -1.11 0.00 0.00 177.40 176.71 2kym s ILE 86 N -3.44 4.67 0.68 -0.18 1.01 -0.66 -4.86 121.20 118.42 2kym s ILE 86 Ca 0.51 1.86 -0.14 0.00 0.00 0.00 0.00 60.65 62.87 2kym s ILE 86 Cb -0.26 -4.30 0.01 0.00 0.01 0.00 0.00 42.46 37.92 2kym s ILE 86 CO 0.87 -0.24 1.11 -2.16 0.00 0.00 0.00 174.94 174.52 2kym s PRO 87 N 3.24 2.72 0.94 2.79 0.04 -1.26 -4.77 135.00 138.69 2kym s PRO 87 Ca 0.42 1.35 -0.15 0.00 0.04 0.00 0.00 61.00 62.67 2kym s PRO 87 Cb -0.14 -1.94 0.18 0.00 0.04 0.00 0.00 34.50 32.64 2kym s PRO 87 CO 0.09 -1.31 1.30 0.99 0.04 0.00 0.00 177.00 178.11 2kym s THR 88 N -2.43 2.00 0.10 1.26 2.01 -1.26 -2.43 115.64 114.89 2kym s THR 88 Ca 0.66 -0.01 -0.26 0.00 0.31 0.00 0.00 61.69 62.39 2kym s THR 88 Cb -0.20 -2.99 -0.11 0.00 0.01 0.00 0.00 72.50 69.20 2kym s THR 88 CO 0.44 0.00 1.67 0.58 -0.69 0.00 0.00 174.62 176.62 2kym h VAL 89 N -1.55 0.62 -0.47 3.82 2.07 -0.86 -1.09 116.25 118.79 2kym h VAL 89 Ca -0.44 0.00 0.09 0.00 0.82 0.00 0.00 66.70 67.17 2kym h VAL 89 Cb 1.25 0.62 -0.08 0.00 -1.52 0.00 0.00 31.29 31.55 2kym h VAL 89 CO 0.42 0.00 -0.05 -0.33 0.02 0.00 0.00 177.57 177.63 2kym h GLU 90 N -0.37 0.06 -0.90 1.57 5.08 -1.94 0.82 114.58 118.91 2kym h GLU 90 Ca 0.01 -0.00 0.03 0.00 -1.00 0.00 0.00 59.36 58.40 2kym h GLU 90 Cb 0.35 -0.01 -0.05 0.00 0.50 0.00 0.00 28.75 29.54 2kym h GLU 90 CO -0.06 0.04 0.59 1.96 -1.00 0.00 0.00 179.01 180.54 2kym h GLN 91 N 0.06 1.11 -0.53 2.33 1.08 -1.86 -1.11 115.11 116.20 2kym h GLN 91 Ca 0.23 -0.07 -0.05 0.00 -1.45 0.00 0.00 58.65 57.31 2kym h GLN 91 Cb 0.35 -0.25 -0.02 0.00 -0.05 0.00 0.00 27.48 27.51 2kym h GLN 91 CO -0.43 0.73 0.12 2.35 -0.95 0.00 0.00 178.83 180.66 2kym h TRP 92 N 1.14 0.89 0.04 2.96 7.01 0.16 -0.54 115.95 127.62 2kym h TRP 92 Ca 0.36 -0.11 -0.00 0.00 2.11 0.00 0.00 58.89 61.25 2kym h TRP 92 Cb -0.01 -0.25 0.00 0.00 -2.10 0.00 0.00 29.16 26.80 2kym h TRP 92 CO -0.01 0.79 -0.02 0.87 -2.79 0.00 0.00 178.44 177.27 2kym h LYS 93 N 0.74 -0.05 -0.80 2.65 1.79 -0.36 -1.16 116.57 119.39 2kym h LYS 93 Ca 0.16 0.00 -0.01 0.00 -2.18 0.00 0.00 60.65 58.62 2kym h LYS 93 Cb 0.35 0.01 -0.04 0.00 -1.58 0.00 0.00 32.23 30.97 2kym h LYS 93 CO 0.00 0.06 0.45 -0.44 -1.08 0.00 0.00 179.45 178.44 2kym h ASP 94 N -0.15 0.99 0.10 0.86 5.19 -1.16 0.51 116.42 122.76 2kym h ASP 94 Ca -0.01 -0.09 -0.00 0.00 -0.62 0.00 0.00 57.03 56.31 2kym h ASP 94 Cb 0.13 -0.25 0.00 0.00 0.18 0.00 0.00 39.33 39.39 2kym h ASP 94 CO 0.01 0.79 -0.05 1.56 -3.12 0.00 0.00 179.24 178.43 2kym h GLN 95 N 1.10 -0.14 -0.30 3.56 4.20 -0.91 -1.18 115.11 121.44 2kym h GLN 95 Ca 0.28 0.01 -0.03 0.00 0.06 0.00 0.00 58.65 58.97 2kym h GLN 95 Cb 0.02 0.03 -0.01 0.00 0.30 0.00 0.00 27.48 27.82 2kym h GLN 95 CO -0.05 -0.09 0.08 1.79 -0.67 0.00 0.00 178.83 179.89 2kym h THR 96 N -0.15 1.21 -0.13 -0.54 1.35 -1.03 0.59 112.91 114.21 2kym h THR 96 Ca -0.01 -0.69 0.05 0.00 -0.55 0.00 0.00 66.41 65.21 2kym h THR 96 Cb 0.12 1.10 -0.05 0.00 -1.73 0.00 0.00 68.15 67.58 2kym h THR 96 CO 0.02 0.23 -0.22 0.03 -0.25 0.00 0.00 175.52 175.33 2kym h ARG 97 N 0.32 -0.26 -0.25 4.72 2.47 -0.77 0.10 114.38 120.70 2kym h ARG 97 Ca 0.09 0.02 -0.10 0.00 -1.26 0.00 0.00 59.98 58.74 2kym h ARG 97 Cb 0.27 0.06 -0.01 0.00 -1.65 0.00 0.00 29.97 28.64 2kym h ARG 97 CO -0.00 -0.18 -0.26 0.00 0.56 0.00 0.00 179.97 180.09 2kym h ARG 98 N -0.27 0.49 -0.69 0.04 3.08 -1.17 -2.42 114.38 113.43 2kym h ARG 98 Ca 0.10 -0.19 -0.04 0.00 0.07 0.00 0.00 59.98 59.92 2kym h ARG 98 Cb 0.42 -0.03 -0.03 0.00 0.08 0.00 0.00 29.97 30.41 2kym h ARG 98 CO -0.29 0.71 0.27 -0.92 -1.07 0.00 0.00 179.97 178.67 2kym h TYR 99 N 0.43 1.04 0.00 3.04 3.20 0.01 -2.21 116.97 122.48 2kym h TYR 99 Ca 0.06 -0.07 -0.09 0.00 3.14 0.00 0.00 58.73 61.77 2kym h TYR 99 Cb 0.68 -0.31 -0.01 0.00 1.54 0.00 0.00 36.73 38.62 2kym h TYR 99 CO 0.02 0.80 -0.43 0.87 -1.64 0.00 0.00 178.16 177.78 2kym h LYS 100 N 1.00 0.00 -7.21 1.82 1.57 -0.61 -3.46 116.57 109.69 2kym h LYS 100 Ca 0.23 0.00 -0.46 0.00 -1.87 0.00 0.00 60.65 58.56 2kym h LYS 100 Cb 0.20 0.00 0.09 0.00 0.08 0.00 0.00 32.23 32.60 2kym h LYS 100 CO -0.02 0.43 0.15 -1.21 -0.57 0.00 0.00 179.45 178.23 2kym s GLU 101 N -3.37 1.76 -1.52 3.15 0.41 -0.83 -4.38 118.70 113.92 2kym s GLU 101 Ca 0.01 -0.80 -0.13 0.00 -0.41 0.00 0.00 54.97 53.64 2kym s GLU 101 Cb 0.10 -2.26 0.08 0.00 -1.78 0.00 0.00 34.13 30.27 2kym s GLU 101 CO 0.71 -1.43 1.01 0.45 -0.49 0.00 0.00 175.26 175.50 2kym n SER 102 N -2.91 -4.99 -2.15 -0.19 2.88 -1.26 -4.93 113.62 100.08 2kym n SER 102 Ca 0.13 -0.76 -0.02 0.00 -1.33 0.00 0.00 58.87 56.89 2kym n SER 102 Cb 0.60 -3.99 0.02 0.00 -0.75 0.00 0.00 64.21 60.08 2kym n SER 102 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 2kym n SER 103 N -2.85 0.00 0.00 -3.46 7.64 -1.26 -4.93 113.62 108.76 2kym n SER 103 Ca 0.04 -1.03 0.00 0.00 1.01 0.00 0.00 58.87 58.89 2kym n SER 103 Cb 0.53 -0.08 0.00 0.00 -1.01 0.00 0.00 64.21 63.65 2kym n SER 103 CO 0.00 0.00 0.00 -0.38 -3.01 0.00 0.00 175.04 171.65 2kym n ILE 104 N -2.14 0.00 -0.73 0.44 2.08 -1.26 -4.68 119.36 113.06 2kym n ILE 104 Ca 0.01 1.47 -0.32 0.00 0.56 0.00 0.00 62.75 64.47 2kym n ILE 104 Cb 0.04 -2.26 0.15 0.00 -0.75 0.00 0.00 39.64 36.83 2kym n ILE 104 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 2kym n GLN 105 N -2.32 -0.80 -5.13 0.38 10.64 -1.26 -4.99 117.38 113.91 2kym n GLN 105 Ca 0.00 -0.20 -0.32 0.00 -1.83 0.00 0.00 57.00 54.65 2kym n GLN 105 Cb 0.00 -1.87 -0.16 0.00 -0.86 0.00 0.00 30.24 27.34 2kym n GLN 105 CO 0.00 0.00 0.00 0.42 -1.83 0.00 0.00 177.06 175.65 2kym s ILE 106 N -2.37 2.32 0.00 -0.39 1.01 -1.26 -4.93 121.20 115.57 2kym s ILE 106 Ca 0.58 -0.94 0.00 0.00 0.00 0.00 0.00 60.65 60.29 2kym s ILE 106 Cb -0.19 -1.89 0.00 0.00 0.01 0.00 0.00 42.46 40.39 2kym s ILE 106 CO 0.66 0.56 0.00 0.61 0.00 0.00 0.00 174.94 176.77 2kym n GLY 107 N 3.29 0.44 3.28 6.18 0.00 -1.26 -5.09 105.19 112.02 2kym n GLY 107 Ca -0.18 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.52 2kym n GLY 107 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2kym s ASN 108 N 0.43 3.21 0.00 1.61 2.20 -1.26 -5.03 114.94 116.10 2kym s ASN 108 Ca 0.00 -0.49 0.00 0.00 -0.94 0.00 0.00 52.86 51.43 2kym s ASN 108 Cb 0.00 -1.00 0.00 0.00 -2.00 0.00 0.00 41.25 38.25 2kym s ASN 108 CO 0.00 0.23 0.00 0.61 -2.94 0.00 0.00 177.10 175.00 2kym n GLY 109 N 3.06 0.98 2.22 0.45 0.00 -1.26 -4.98 105.19 105.65 2kym n GLY 109 Ca -0.18 -1.65 -0.21 0.00 0.00 0.00 0.00 46.02 43.98 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 0.08 -3.27 0.00 1.61 8.25 -1.26 -5.05 115.22 115.58 2kym n HIS 110 Ca 0.00 -0.57 0.00 0.00 -0.26 0.00 0.00 57.72 56.89 2kym n HIS 110 Cb 0.00 -0.87 0.00 0.00 1.12 0.00 0.00 29.99 30.24 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 -4.01 0.20 3.68 -1.41 0.00 -1.26 -4.69 105.19 97.69 2kym n GLY 111 Ca 0.10 0.00 -0.49 0.00 0.00 0.00 0.00 46.02 45.63 2kym n GLY 111 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2kym n GLN 112 N -0.39 2.00 -3.89 1.61 3.00 -1.26 -4.96 117.38 113.49 2kym n GLN 112 Ca 0.00 0.73 -0.10 0.00 -0.01 0.00 0.00 57.00 57.62 2kym n GLN 112 Cb 0.00 -2.53 -0.09 0.00 0.00 0.00 0.00 30.24 27.62 2kym n GLN 112 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.06 175.94 2kym s SER 113 N 2.97 0.10 0.07 1.08 0.01 -1.26 -5.12 113.70 111.55 2kym s SER 113 Ca 0.89 -0.41 -0.34 0.00 1.31 0.00 0.00 55.95 57.40 2kym s SER 113 Cb -0.75 0.24 -0.14 0.00 0.21 0.00 0.00 66.02 65.59 2kym s SER 113 CO 0.49 -0.49 1.65 1.67 0.41 0.00 0.00 173.24 176.97 2kym n GLN 114 N 0.90 2.03 -2.82 12.44 -0.06 -1.26 -4.90 117.38 123.70 2kym n GLN 114 Ca -0.20 0.73 -0.43 0.00 -2.00 0.00 0.00 57.00 55.11 2kym n GLN 114 Cb 0.58 -2.51 -0.04 0.00 -4.06 0.00 0.00 30.24 24.21 2kym n GLN 114 CO 0.00 0.00 0.00 0.20 -0.20 0.00 0.00 177.06 177.06 2kym s GLY 115 N 1.87 1.35 -0.01 1.69 0.00 -1.26 -4.77 107.32 106.19 2kym s GLY 115 Ca 0.84 -1.44 0.05 0.00 0.00 0.00 0.00 44.72 44.17 2kym s GLY 115 CO 0.44 2.11 0.09 1.47 0.00 0.00 0.00 173.10 177.20 2kym n LEU 116 N 7.71 0.00 0.00 0.66 -0.00 -1.26 -5.22 117.00 118.89 2kym n LEU 116 Ca 0.00 0.00 0.05 0.00 -0.00 0.00 0.00 56.01 56.06 2kym n LEU 116 Cb 0.47 0.02 0.29 0.00 -0.00 0.00 0.00 43.42 44.20 2kym n LEU 116 CO 0.64 0.02 0.51 1.21 -0.00 0.00 0.00 177.39 179.78