#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 3.71 0.15 -5.12 0.00 -1.26 -5.08 121.76 114.16 2kym s ALA -1 Ca 0.00 -1.38 -0.31 0.00 0.00 0.00 0.00 51.96 50.27 2kym s ALA -1 Cb 0.00 -1.42 -0.08 0.00 0.00 0.00 0.00 23.12 21.62 2kym s ALA -1 CO 0.00 0.23 1.34 -1.25 0.00 0.00 0.00 175.76 176.08 2kym s PRO 1 N -3.90 4.36 0.03 0.00 0.04 -1.26 -5.04 135.00 129.23 2kym s PRO 1 Ca 0.34 2.04 0.03 0.00 0.04 0.00 0.00 61.00 63.45 2kym s PRO 1 Cb -0.08 -3.23 -0.02 0.00 0.04 0.00 0.00 34.50 31.21 2kym s PRO 1 CO 0.26 -0.34 -0.09 -0.48 0.04 0.00 0.00 177.00 176.39 2kym s LEU 2 N 0.55 2.15 0.06 -3.56 0.05 -1.26 -4.90 118.68 111.77 2kym s LEU 2 Ca 0.61 -0.37 0.06 0.00 0.05 0.00 0.00 54.13 54.47 2kym s LEU 2 Cb -0.36 -0.33 -0.03 0.00 -2.05 0.00 0.00 46.19 43.42 2kym s LEU 2 CO 0.34 -0.04 -0.16 -0.36 -0.55 0.00 0.00 176.35 175.58 2kym s PHE 3 N -0.80 1.37 0.36 3.48 0.40 -1.24 -3.85 117.98 117.70 2kym s PHE 3 Ca -0.03 -0.41 0.07 0.00 -0.60 0.00 0.00 56.93 55.96 2kym s PHE 3 Cb -0.07 -0.78 -0.07 0.00 0.51 0.00 0.00 43.02 42.61 2kym s PHE 3 CO 0.00 0.08 -0.00 0.00 0.70 0.00 0.00 175.22 176.00 2kym s ALA 4 N -1.07 2.84 -0.04 5.36 0.00 0.44 -2.39 121.76 126.89 2kym s ALA 4 Ca 0.01 -2.17 0.01 0.00 0.00 0.00 0.00 51.96 49.82 2kym s ALA 4 Cb -0.09 0.26 0.02 0.00 0.00 0.00 0.00 23.12 23.31 2kym s ALA 4 CO 0.02 -0.13 -0.05 0.54 0.00 0.00 0.00 175.76 176.14 2kym s VAL 5 N -2.88 0.55 0.34 0.00 0.11 -0.32 -0.12 120.40 118.08 2kym s VAL 5 Ca 0.34 -0.14 -0.27 0.00 -2.93 0.00 0.00 61.98 58.99 2kym s VAL 5 Cb 0.08 -0.57 -0.09 0.00 -1.53 0.00 0.00 36.38 34.27 2kym s VAL 5 CO 0.16 0.22 1.13 0.42 -3.33 0.00 0.00 175.10 173.70 2kym s THR 6 N 0.85 3.37 -0.04 5.04 -4.23 -0.09 -0.58 115.64 119.96 2kym s THR 6 Ca -0.12 1.24 0.03 0.00 -1.18 0.00 0.00 61.69 61.66 2kym s THR 6 Cb -0.14 -3.73 -0.04 0.00 1.34 0.00 0.00 72.50 69.93 2kym s THR 6 CO 0.00 0.19 0.07 0.18 -0.54 0.00 0.00 174.62 174.53 2kym n LEU 7 N 0.56 0.03 -4.40 4.79 4.77 -1.25 -0.09 117.00 121.43 2kym n LEU 7 Ca 0.02 -0.15 -0.20 0.00 -0.03 0.00 0.00 56.01 55.66 2kym n LEU 7 Cb 0.46 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.45 2kym n LEU 7 CO 0.52 0.01 -0.30 -0.31 -1.33 0.00 0.00 177.39 175.97 2kym s TYR 8 N -1.91 1.80 -0.40 -1.77 1.51 -1.26 -4.66 117.35 110.67 2kym s TYR 8 Ca -0.00 -0.93 -0.20 0.00 -1.01 0.00 0.00 57.07 54.92 2kym s TYR 8 Cb 0.02 -1.11 0.01 0.00 -0.11 0.00 0.00 41.96 40.77 2kym s TYR 8 CO 0.11 -0.00 0.61 -2.00 -1.11 0.00 0.00 175.55 173.15 2kym s GLU 9 N -3.87 3.44 -0.22 -0.62 2.56 -1.26 -3.18 118.70 115.55 2kym s GLU 9 Ca 0.33 -0.24 -0.18 0.00 0.00 0.00 0.00 54.97 54.89 2kym s GLU 9 Cb 0.07 -3.89 -0.03 0.00 2.00 0.00 0.00 34.13 32.28 2kym s GLU 9 CO 0.13 -0.86 0.50 0.12 -0.56 0.00 0.00 175.26 174.59 2kym s PHE 10 N 2.68 3.34 -0.51 5.30 5.36 0.76 -4.94 117.98 129.97 2kym s PHE 10 Ca 0.22 0.72 -0.14 0.00 -0.96 0.00 0.00 56.93 56.77 2kym s PHE 10 Cb -0.15 -2.67 0.12 0.00 -0.34 0.00 0.00 43.02 39.98 2kym s PHE 10 CO 0.17 -0.14 0.44 0.15 -1.46 0.00 0.00 175.22 174.37 2kym s LYS 11 N 1.78 2.85 0.79 10.12 1.02 -1.26 -1.71 119.74 133.33 2kym s LYS 11 Ca 0.23 -1.66 -0.14 0.00 0.02 0.00 0.00 55.97 54.42 2kym s LYS 11 Cb -0.15 -4.16 0.07 0.00 -0.52 0.00 0.00 37.83 33.07 2kym s LYS 11 CO 0.09 -1.24 1.20 0.00 -0.92 0.00 0.00 175.35 174.49 2kym s ALA 12 N 1.54 1.92 0.00 5.17 0.00 -1.26 -4.94 121.76 124.18 2kym s ALA 12 Ca 0.04 0.84 0.00 0.00 0.00 0.00 0.00 51.96 52.83 2kym s ALA 12 Cb -0.28 -3.48 0.00 0.00 0.00 0.00 0.00 23.12 19.36 2kym s ALA 12 CO 0.03 -2.18 0.00 -0.85 0.00 0.00 0.00 175.76 172.76 2kym n GLU 13 N -3.17 1.39 -3.78 0.00 0.28 -1.26 -4.94 120.64 109.15 2kym n GLU 13 Ca 0.13 0.00 -0.21 0.00 -0.16 0.00 0.00 57.16 56.92 2kym n GLU 13 Cb 0.50 -0.93 -0.05 0.00 1.43 0.00 0.00 31.44 32.40 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 1.09 -0.11 3.44 5.12 -1.26 -5.03 116.66 117.78 2kym n ARG 14 Ca 0.00 -2.48 -0.09 0.00 -1.93 0.00 0.00 57.85 53.34 2kym n ARG 14 Cb 0.43 0.77 0.05 0.00 -1.16 0.00 0.00 32.46 32.55 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 0.87 0.88 -0.10 0.55 3.32 -2.04 -2.90 116.42 117.00 2kym h ASP 15 Ca -0.27 -0.34 -0.04 0.00 0.02 0.00 0.00 57.03 56.40 2kym h ASP 15 Cb 0.86 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 40.15 2kym h ASP 15 CO 0.45 1.08 -0.05 -2.24 -1.72 0.00 0.00 179.24 176.76 2kym h ASP 16 N 0.73 0.33 -3.99 6.45 3.04 -1.96 -3.43 116.42 117.59 2kym h ASP 16 Ca 0.09 -0.06 -0.46 0.00 -3.24 0.00 0.00 57.03 53.37 2kym h ASP 16 Cb 0.79 -0.09 -0.01 0.00 -1.04 0.00 0.00 39.33 38.98 2kym h ASP 16 CO 0.07 0.43 0.35 -0.70 -2.04 0.00 0.00 179.24 177.34 2kym s GLU 17 N -4.88 4.32 -0.12 4.15 2.56 -1.09 -3.61 118.70 120.03 2kym s GLU 17 Ca -0.06 1.24 0.00 0.00 0.00 0.00 0.00 54.97 56.15 2kym s GLU 17 Cb 0.16 -2.42 0.02 0.00 2.00 0.00 0.00 34.13 33.89 2kym s GLU 17 CO 0.74 0.04 -0.11 -1.17 -0.56 0.00 0.00 175.26 174.21 2kym s LEU 18 N -2.76 1.44 0.34 2.70 2.96 -1.26 -4.72 118.68 117.38 2kym s LEU 18 Ca 0.58 -0.37 -0.26 0.00 -0.22 0.00 0.00 54.13 53.86 2kym s LEU 18 Cb -0.14 -0.97 -0.09 0.00 0.50 0.00 0.00 46.19 45.49 2kym s LEU 18 CO 0.18 -0.07 1.01 1.51 -1.32 0.00 0.00 176.35 177.66 2kym s ASP 19 N 1.46 7.13 0.04 3.68 1.47 -1.26 -4.60 116.67 124.58 2kym s ASP 19 Ca 0.02 1.99 -0.14 0.00 1.18 0.00 0.00 52.55 55.60 2kym s ASP 19 Cb -0.13 -2.59 0.02 0.00 -0.34 0.00 0.00 42.92 39.88 2kym s ASP 19 CO -0.07 -0.23 0.30 0.54 0.68 0.00 0.00 175.17 176.40 2kym s VAL 20 N -1.54 0.08 0.19 2.11 0.11 -0.69 -4.95 120.40 115.70 2kym s VAL 20 Ca 0.52 -0.67 0.06 0.00 -2.93 0.00 0.00 61.98 58.95 2kym s VAL 20 Cb -0.22 -0.93 -0.04 0.00 -1.53 0.00 0.00 36.38 33.66 2kym s VAL 20 CO 0.28 -0.37 0.15 -0.44 -3.33 0.00 0.00 175.10 171.39 2kym s SER 21 N -2.04 5.50 0.31 3.54 0.01 -1.26 -0.17 113.70 119.59 2kym s SER 21 Ca -0.05 -0.17 -0.29 0.00 1.31 0.00 0.00 55.95 56.75 2kym s SER 21 Cb -0.01 -1.42 -0.10 0.00 0.21 0.00 0.00 66.02 64.70 2kym s SER 21 CO -0.03 0.04 1.23 -2.16 0.41 0.00 0.00 173.24 172.73 2kym s PRO 22 N -3.28 4.47 0.00 12.44 0.04 -1.19 -3.08 135.00 144.40 2kym s PRO 22 Ca 0.31 2.05 0.00 0.00 0.04 0.00 0.00 61.00 63.41 2kym s PRO 22 Cb -0.09 -3.12 0.00 0.00 0.04 0.00 0.00 34.50 31.33 2kym s PRO 22 CO 0.24 -0.03 0.00 0.41 0.04 0.00 0.00 177.00 177.65 2kym n GLY 23 N 0.98 0.83 3.85 0.56 0.00 0.88 -4.93 105.19 107.36 2kym n GLY 23 Ca -0.00 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.67 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 -0.67 3.98 -0.20 1.61 0.41 -1.18 -4.88 118.70 117.78 2kym s GLU 24 Ca 0.00 0.51 -0.20 0.00 -0.41 0.00 0.00 54.97 54.87 2kym s GLU 24 Cb 0.00 -2.84 -0.03 0.00 -1.78 0.00 0.00 34.13 29.48 2kym s GLU 24 CO 0.00 0.42 0.60 -0.80 -0.49 0.00 0.00 175.26 174.99 2kym s ASN 25 N -1.86 6.66 0.05 -0.19 -0.87 -1.26 -0.92 114.94 116.55 2kym s ASN 25 Ca 0.41 0.80 0.07 0.00 -1.57 0.00 0.00 52.86 52.57 2kym s ASN 25 Cb -0.14 -2.34 -0.03 0.00 -0.02 0.00 0.00 41.25 38.72 2kym s ASN 25 CO 0.20 -0.25 -0.18 -0.76 -2.57 0.00 0.00 177.10 173.54 2kym s LEU 26 N 1.83 2.63 -0.36 0.60 2.01 0.82 -3.87 118.68 122.34 2kym s LEU 26 Ca 0.28 -0.43 -0.13 0.00 0.01 0.00 0.00 54.13 53.85 2kym s LEU 26 Cb -0.16 -1.53 0.00 0.00 0.01 0.00 0.00 46.19 44.52 2kym s LEU 26 CO 0.10 0.25 0.24 -0.55 1.01 0.00 0.00 176.35 177.40 2kym s SER 27 N -1.51 5.96 0.34 2.29 0.15 -0.36 -0.42 113.70 120.15 2kym s SER 27 Ca 0.15 -0.68 -0.26 0.00 0.70 0.00 0.00 55.95 55.87 2kym s SER 27 Cb -0.11 -2.11 -0.10 0.00 -1.71 0.00 0.00 66.02 62.00 2kym s SER 27 CO 0.06 -0.32 0.98 -0.63 1.20 0.00 0.00 173.24 174.53 2kym s ILE 28 N 1.67 4.03 -0.03 6.45 1.01 -1.25 -0.95 121.20 132.14 2kym s ILE 28 Ca 0.05 1.67 -0.00 0.00 0.00 0.00 0.00 60.65 62.37 2kym s ILE 28 Cb -0.18 -3.91 -0.02 0.00 0.01 0.00 0.00 42.46 38.36 2kym s ILE 28 CO 0.09 0.12 -0.03 0.00 0.00 0.00 0.00 174.94 175.12 2kym s ALA 30 N -2.05 -0.60 0.44 0.00 0.00 -1.25 -4.55 121.76 113.75 2kym s ALA 30 Ca -0.04 -0.75 0.03 0.00 0.00 0.00 0.00 51.96 51.20 2kym s ALA 30 Cb 0.01 0.84 -0.02 0.00 0.00 0.00 0.00 23.12 23.95 2kym s ALA 30 CO 0.06 -0.96 0.10 -3.38 0.00 0.00 0.00 175.76 171.58 2kym s HIS 31 N -3.05 1.80 -0.25 0.00 -0.00 -0.60 -0.44 115.29 112.75 2kym s HIS 31 Ca 0.17 -1.21 -0.02 0.00 -0.00 0.00 0.00 55.06 54.01 2kym s HIS 31 Cb -0.04 -1.28 0.14 0.00 -0.00 0.00 0.00 32.58 31.39 2kym s HIS 31 CO 0.11 -0.16 0.37 -0.47 -0.00 0.00 0.00 174.74 174.59 2kym s TYR 32 N -3.11 -0.81 -1.96 0.38 5.04 0.75 -0.83 117.35 116.82 2kym s TYR 32 Ca 0.18 0.63 0.00 0.00 -2.44 0.00 0.00 57.07 55.44 2kym s TYR 32 Cb 0.02 -0.07 0.00 0.00 0.35 0.00 0.00 41.96 42.26 2kym s TYR 32 CO 0.11 -0.78 0.00 -0.25 -1.34 0.00 0.00 175.55 173.29 2kym n ASP 33 N 5.36 -4.88 -1.73 4.32 8.00 -1.26 -1.04 116.55 125.32 2kym n ASP 33 Ca -0.03 0.46 -0.20 0.00 0.71 0.00 0.00 54.79 55.73 2kym n ASP 33 Cb 0.50 -4.36 -0.07 0.00 -0.02 0.00 0.00 41.12 37.17 2kym n ASP 33 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 2kym n TYR 34 N -2.24 -0.25 -0.00 1.24 4.02 -1.26 -4.76 117.16 113.91 2kym n TYR 34 Ca -0.19 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.71 2kym n TYR 34 Cb 0.61 -3.44 -0.02 0.00 -0.02 0.00 0.00 39.34 36.47 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 -2.44 1.81 -4.53 -0.72 0.28 -0.21 -4.91 120.64 109.92 2kym n GLU 35 Ca -0.20 -0.01 -0.22 0.00 -0.16 0.00 0.00 57.16 56.56 2kym n GLU 35 Cb 0.66 -1.05 -0.16 0.00 1.43 0.00 0.00 31.44 32.32 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 -2.09 1.19 -0.04 -1.84 0.52 -0.88 -3.01 118.94 112.78 2kym s TRP 36 Ca -0.01 -0.31 0.06 0.00 0.02 0.00 0.00 56.10 55.87 2kym s TRP 36 Cb 0.01 -0.83 -0.02 0.00 -1.15 0.00 0.00 33.47 31.48 2kym s TRP 36 CO 0.08 -0.12 -0.23 -0.06 0.02 0.00 0.00 176.95 176.65 2kym s PHE 37 N 0.12 2.45 -0.77 -1.98 0.08 0.13 -0.17 117.98 117.83 2kym s PHE 37 Ca -0.03 -0.44 -0.18 0.00 0.12 0.00 0.00 56.93 56.40 2kym s PHE 37 Cb -0.09 -1.56 0.14 0.00 -0.57 0.00 0.00 43.02 40.94 2kym s PHE 37 CO 0.01 -0.03 0.88 0.42 -0.10 0.00 0.00 175.22 176.40 2kym s ILE 38 N -0.52 4.95 0.09 0.64 -1.09 0.41 -1.12 121.20 124.55 2kym s ILE 38 Ca 0.07 -1.51 0.05 0.00 -2.23 0.00 0.00 60.65 57.03 2kym s ILE 38 Cb -0.11 -4.60 -0.04 0.00 -1.58 0.00 0.00 42.46 36.13 2kym s ILE 38 CO 0.00 -1.26 -0.03 0.00 -1.23 0.00 0.00 174.94 172.43 2kym s ALA 39 N 2.17 3.19 0.20 9.38 0.00 -1.08 0.11 121.76 135.73 2kym s ALA 39 Ca 0.21 -1.14 0.09 0.00 0.00 0.00 0.00 51.96 51.11 2kym s ALA 39 Cb -0.14 -1.11 -0.05 0.00 0.00 0.00 0.00 23.12 21.83 2kym s ALA 39 CO -0.03 0.68 -0.17 -1.59 0.00 0.00 0.00 175.76 174.66 2kym s LYS 40 N -2.23 1.36 0.63 0.00 -2.85 -0.13 -2.50 119.74 114.02 2kym s LYS 40 Ca 0.24 -1.54 -0.16 0.00 -1.00 0.00 0.00 55.97 53.51 2kym s LYS 40 Cb -0.11 -1.31 -0.01 0.00 -2.06 0.00 0.00 37.83 34.33 2kym s LYS 40 CO 0.16 0.24 1.11 -1.25 0.10 0.00 0.00 175.35 175.72 2kym s PRO 41 N -3.27 2.92 0.00 1.78 0.04 -1.26 -1.22 135.00 133.99 2kym s PRO 41 Ca 0.21 1.44 0.00 0.00 0.04 0.00 0.00 61.00 62.69 2kym s PRO 41 Cb -0.03 -1.96 0.00 0.00 0.04 0.00 0.00 34.50 32.54 2kym s PRO 41 CO 0.08 -1.16 0.02 -0.89 0.04 0.00 0.00 177.00 175.09 2kym n ILE 42 N -2.17 0.00 -0.01 0.56 5.41 -1.25 -4.04 119.36 117.86 2kym n ILE 42 Ca 0.11 -0.50 -0.03 0.00 1.00 0.00 0.00 62.75 63.33 2kym n ILE 42 Cb 0.52 1.00 -0.01 0.00 -0.71 0.00 0.00 39.64 40.44 2kym n ILE 42 CO 0.00 0.00 0.00 0.59 0.00 0.00 0.00 176.55 177.14 2kym n ASN 43 N -0.95 0.42 0.00 4.38 3.02 -1.26 -4.86 115.26 116.01 2kym n ASN 43 Ca 0.00 0.03 0.00 0.00 -0.03 0.00 0.00 54.58 54.58 2kym n ASN 43 Cb 0.00 -0.08 0.00 0.00 -0.61 0.00 0.00 39.78 39.09 2kym n ASN 43 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 2kym n ARG 43 N -3.08 0.00 0.00 3.52 1.74 -1.26 -4.93 116.66 112.65 2kym n ARG 43 Ca -0.05 0.71 0.00 0.00 -0.77 0.00 0.00 57.85 57.74 2kym n ARG 43 Cb 0.54 -1.50 0.00 0.00 -1.02 0.00 0.00 32.46 30.48 2kym n ARG 43 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 2kym n LEU 44 N -2.42 0.00 0.00 0.55 4.32 -1.26 -5.12 117.00 113.07 2kym n LEU 44 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 55.99 2kym n LEU 44 Cb 0.00 0.12 0.00 0.00 -1.62 0.00 0.00 43.42 41.92 2kym n LEU 44 CO 0.00 -0.21 0.00 0.61 -1.22 0.00 0.00 177.39 176.57 2kym n GLY 45 N -0.20 -0.34 3.38 -0.72 0.00 -1.26 -4.81 105.19 101.24 2kym n GLY 45 Ca 0.00 -0.06 -0.24 0.00 0.00 0.00 0.00 46.02 45.71 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 1.55 -0.24 -0.02 0.00 -1.26 -4.93 107.32 102.42 2kym s GLY 46 Ca 0.00 -1.56 -0.29 0.00 0.00 0.00 0.00 44.72 42.88 2kym s GLY 46 CO 0.00 -1.59 1.62 2.56 0.00 0.00 0.00 173.10 175.69 2kym s PRO 47 N -2.69 3.74 0.31 2.90 0.04 -1.26 -4.06 135.00 133.97 2kym s PRO 47 Ca 0.18 1.61 0.09 0.00 0.04 0.00 0.00 61.00 62.92 2kym s PRO 47 Cb -0.07 -4.05 -0.06 0.00 0.04 0.00 0.00 34.50 30.36 2kym s PRO 47 CO 0.08 -1.36 -0.11 0.20 0.04 0.00 0.00 177.00 175.85 2kym s GLY 48 N 4.40 2.00 -0.20 0.56 0.00 -1.04 -4.93 107.32 108.11 2kym s GLY 48 Ca 0.72 -1.98 -0.05 0.00 0.00 0.00 0.00 44.72 43.41 2kym s GLY 48 CO 0.30 -1.96 -0.01 -2.27 0.00 0.00 0.00 173.10 169.16 2kym s LEU 49 N -3.53 3.22 -0.06 0.66 0.20 -1.24 -2.62 118.68 115.31 2kym s LEU 49 Ca 0.31 -0.21 -0.03 0.00 0.69 0.00 0.00 54.13 54.88 2kym s LEU 49 Cb 0.01 -1.81 0.03 0.00 -0.43 0.00 0.00 46.19 43.99 2kym s LEU 49 CO 0.14 0.07 0.13 0.54 -0.29 0.00 0.00 176.35 176.94 2kym s VAL 50 N 0.99 -0.03 0.60 1.68 0.11 -0.28 -4.01 120.40 119.46 2kym s VAL 50 Ca 0.01 0.12 -0.17 0.00 -2.93 0.00 0.00 61.98 59.02 2kym s VAL 50 Cb -0.14 -0.21 -0.03 0.00 -1.53 0.00 0.00 36.38 34.46 2kym s VAL 50 CO 0.02 0.05 1.12 -2.16 -3.33 0.00 0.00 175.10 170.80 2kym s PRO 51 N 0.82 3.09 0.60 1.54 0.04 -1.26 0.17 135.00 140.00 2kym s PRO 51 Ca -0.06 1.50 0.38 0.00 0.04 0.00 0.00 61.00 62.86 2kym s PRO 51 Cb -0.08 -1.98 1.85 0.00 0.04 0.00 0.00 34.50 34.33 2kym s PRO 51 CO -0.04 -1.04 2.17 0.28 0.04 0.00 0.00 177.00 178.41 2kym h VAL 52 N 0.64 0.09 0.00 -0.36 2.07 -1.87 -1.08 116.25 115.73 2kym h VAL 52 Ca -0.48 -0.29 0.00 0.00 0.82 0.00 0.00 66.70 66.75 2kym h VAL 52 Cb 1.25 1.26 0.00 0.00 -1.52 0.00 0.00 31.29 32.29 2kym h VAL 52 CO 0.56 0.02 0.00 -1.20 0.02 0.00 0.00 177.57 176.96 2kym n SER 53 N -3.17 0.00 -0.20 0.57 7.64 -1.26 -2.96 113.62 114.24 2kym n SER 53 Ca -0.01 -1.02 0.05 0.00 1.01 0.00 0.00 58.87 58.90 2kym n SER 53 Cb 0.19 0.00 0.07 0.00 -1.01 0.00 0.00 64.21 63.47 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 -0.98 0.00 -3.70 1.43 4.02 -0.41 -4.95 117.16 112.57 2kym n TYR 54 Ca 0.23 -0.58 -0.10 0.00 -0.01 0.00 0.00 57.90 57.44 2kym n TYR 54 Cb 0.10 -0.10 -0.05 0.00 -0.02 0.00 0.00 39.34 39.27 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 -1.62 0.09 -0.09 -0.72 -7.23 -1.16 -3.74 120.40 105.94 2kym s VAL 55 Ca 0.17 -0.75 0.03 0.00 -1.81 0.00 0.00 61.98 59.62 2kym s VAL 55 Cb 0.15 -1.24 0.01 0.00 0.56 0.00 0.00 36.38 35.86 2kym s VAL 55 CO 0.02 -0.39 -0.19 -0.60 -0.31 0.00 0.00 175.10 173.62 2kym s ARG 56 N -3.82 2.49 -0.43 4.82 3.52 0.26 -4.87 118.95 120.91 2kym s ARG 56 Ca 0.04 -0.68 -0.28 0.00 -0.13 0.00 0.00 55.73 54.68 2kym s ARG 56 Cb 0.03 -1.94 0.02 0.00 -1.56 0.00 0.00 34.95 31.50 2kym s ARG 56 CO -0.11 0.10 1.04 0.42 -0.81 0.00 0.00 175.30 175.94 2kym s ILE 57 N 0.53 4.39 0.36 4.11 -1.09 -1.26 -1.18 121.20 127.06 2kym s ILE 57 Ca -0.16 1.20 0.03 0.00 -2.23 0.00 0.00 60.65 59.49 2kym s ILE 57 Cb -0.17 -4.49 -0.01 0.00 -1.58 0.00 0.00 42.46 36.21 2kym s ILE 57 CO 0.06 -0.79 0.12 2.30 -1.23 0.00 0.00 174.94 175.39 2kym n ILE 58 N 6.43 0.00 -4.53 2.92 -5.35 -1.00 -4.43 119.36 113.38 2kym n ILE 58 Ca 0.10 -2.07 -0.24 0.00 -0.27 0.00 0.00 62.75 60.26 2kym n ILE 58 Cb 0.48 0.72 -0.17 0.00 -1.74 0.00 0.00 39.64 38.94 2kym n ILE 58 CO 0.00 0.00 0.00 -0.62 -1.76 0.00 0.00 176.55 174.17 2kym s ASP 59 N -3.20 1.73 0.58 7.28 -1.08 -1.22 -3.63 116.67 117.13 2kym s ASP 59 Ca 0.17 -0.29 0.28 0.00 -0.52 0.00 0.00 52.55 52.19 2kym s ASP 59 Cb 0.01 -0.80 1.57 0.00 -1.46 0.00 0.00 42.92 42.23 2kym s ASP 59 CO 0.12 0.02 2.02 -0.07 0.52 0.00 0.00 175.17 177.79 2kym h LEU 60 N 7.02 0.00 0.01 -1.34 3.38 -1.91 0.31 115.31 122.79 2kym h LEU 60 Ca -0.31 0.00 -0.31 0.00 0.09 0.00 0.00 57.88 57.35 2kym h LEU 60 Cb 1.18 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 41.88 2kym h LEU 60 CO 0.47 0.00 -1.82 0.23 0.09 0.00 0.00 178.44 177.41 2kym n MET 61 N -3.84 0.65 -3.24 1.13 2.81 -1.26 -4.65 117.12 108.72 2kym n MET 61 Ca 0.04 0.26 -0.24 0.00 -1.81 0.00 0.00 57.70 55.95 2kym n MET 61 Cb 0.46 -1.75 -0.08 0.00 -0.71 0.00 0.00 33.22 31.14 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 -3.04 -0.25 0.11 7.83 9.92 -0.02 -4.95 116.55 126.15 2kym n ASP 62 Ca -0.20 -2.60 0.11 0.00 -0.53 0.00 0.00 54.79 51.57 2kym n ASP 62 Cb 1.06 -0.48 0.46 0.00 -0.64 0.00 0.00 41.12 41.52 2kym n ASP 62 CO 0.00 0.00 0.00 -0.81 0.13 0.00 0.00 177.20 176.52 2kym n PRO 63 N 1.98 0.16 0.02 -0.24 -0.04 0.90 -2.20 135.00 135.57 2kym n PRO 63 Ca 0.24 0.39 0.11 0.00 -0.04 0.00 0.00 63.50 64.20 2kym n PRO 63 Cb 0.52 -1.80 -0.08 0.00 -0.04 0.00 0.00 33.50 32.10 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 -1.72 3.37 -0.00 0.55 0.00 -1.26 -3.62 120.51 117.82 2kym n ALA 64 Ca 0.02 -0.47 -0.12 0.00 0.00 0.00 0.00 53.44 52.88 2kym n ALA 64 Cb 0.22 -0.86 -0.09 0.00 0.00 0.00 0.00 19.45 18.71 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 -0.78 0.00 3.64 -1.82 -3.28 116.57 114.25 2kym h LYS 65 Ca 0.00 0.01 -0.13 0.00 -1.27 0.00 0.00 60.65 59.26 2kym h LYS 65 Cb 0.81 0.02 -0.08 0.00 -0.41 0.00 0.00 32.23 32.57 2kym h LYS 65 CO 0.00 0.50 0.16 0.66 -2.27 0.00 0.00 179.45 178.50 2kym n TYR 66 N -4.81 1.86 0.25 1.91 4.02 -1.22 -4.11 117.16 115.06 2kym n TYR 66 Ca -0.08 -0.87 0.12 0.00 -0.01 0.00 0.00 57.90 57.05 2kym n TYR 66 Cb 0.31 -0.54 0.09 0.00 -0.02 0.00 0.00 39.34 39.18 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 2.82 0.65 0.00 -0.72 0.00 -1.62 -3.32 119.26 117.07 2kym h ALA 67 Ca 0.16 0.00 -0.04 0.00 0.00 0.00 0.00 54.91 55.03 2kym h ALA 67 Cb 1.91 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 19.69 2kym h ALA 67 CO 0.53 0.00 -1.66 -1.13 0.00 0.00 0.00 179.25 177.00 2kym n SER 68 N -2.64 0.35 -4.57 0.00 3.41 -1.26 -4.97 113.62 103.94 2kym n SER 68 Ca 0.02 0.14 -0.41 0.00 -0.26 0.00 0.00 58.87 58.36 2kym n SER 68 Cb 0.52 1.27 0.02 0.00 -0.26 0.00 0.00 64.21 65.75 2kym n SER 68 CO 0.00 0.00 0.00 0.55 -0.16 0.00 0.00 175.04 175.43 2kym n VAL 69 N -2.48 2.48 -3.22 -3.33 3.14 -1.25 -4.92 118.33 108.74 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 0.63 -0.99 -0.07 0.00 -1.06 0.00 0.00 33.84 32.35 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 -0.90 6.21 0.21 6.55 2.15 -1.26 -4.92 116.67 124.71 2kym s ASP 70 Ca 0.66 -0.91 -0.02 0.00 0.43 0.00 0.00 52.55 52.71 2kym s ASP 70 Cb -0.54 -2.26 0.16 0.00 -0.30 0.00 0.00 42.92 39.99 2kym s ASP 70 CO 0.55 -0.79 1.54 0.71 -0.17 0.00 0.00 175.17 177.01 2kym h THR 71 N 5.82 1.32 -0.82 1.71 1.35 -1.90 -3.13 112.91 117.26 2kym h THR 71 Ca -0.27 -1.72 -0.00 0.00 -0.55 0.00 0.00 66.41 63.86 2kym h THR 71 Cb 1.10 1.71 -0.04 0.00 -1.73 0.00 0.00 68.15 69.19 2kym h THR 71 CO 0.92 0.54 0.51 0.22 -0.25 0.00 0.00 175.52 177.45 2kym h TYR 72 N 0.42 1.07 -2.20 4.73 3.20 -1.91 -3.41 116.97 118.87 2kym h TYR 72 Ca 0.02 0.00 -0.56 0.00 3.14 0.00 0.00 58.73 61.33 2kym h TYR 72 Cb 1.02 -0.35 -0.01 0.00 1.54 0.00 0.00 36.73 38.92 2kym h TYR 72 CO 0.04 0.70 1.42 0.34 -1.64 0.00 0.00 178.16 179.02 2kym s ASP 73 N -6.03 5.47 0.57 -2.11 2.15 -1.18 -4.82 116.67 110.72 2kym s ASP 73 Ca -0.13 1.43 0.28 0.00 0.43 0.00 0.00 52.55 54.56 2kym s ASP 73 Cb 0.16 -2.52 1.50 0.00 -0.30 0.00 0.00 42.92 41.77 2kym s ASP 73 CO 0.80 -2.02 1.98 0.08 -0.17 0.00 0.00 175.17 175.84 2kym h ARG 74 N 14.82 0.00 0.34 4.34 -0.00 -1.86 -1.69 114.38 130.33 2kym h ARG 74 Ca -0.35 0.00 -0.02 0.00 -0.00 0.00 0.00 59.98 59.62 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 1.03 0.00 -0.17 0.93 -0.00 0.00 0.00 179.97 181.77 2kym h GLU 75 N 0.00 -0.45 0.65 0.08 5.08 -1.92 -1.58 114.58 116.44 2kym h GLU 75 Ca 0.20 0.03 -0.03 0.00 -1.00 0.00 0.00 59.36 58.56 2kym h GLU 75 Cb 0.96 0.10 0.00 0.00 0.50 0.00 0.00 28.75 30.32 2kym h GLU 75 CO -0.00 -0.13 -0.32 1.96 -1.00 0.00 0.00 179.01 179.52 2kym h GLN 76 N -0.82 -0.86 -0.77 2.33 4.20 -1.58 -1.75 115.11 115.87 2kym h GLN 76 Ca -0.05 0.06 0.20 0.00 0.06 0.00 0.00 58.65 58.92 2kym h GLN 76 Cb 0.52 0.19 -0.04 0.00 0.30 0.00 0.00 27.48 28.46 2kym h GLN 76 CO 0.08 -0.57 0.54 -0.24 -0.67 0.00 0.00 178.83 177.96 2kym h VAL 77 N -0.89 0.67 0.37 -0.54 3.04 -1.44 -1.31 116.25 116.14 2kym h VAL 77 Ca -0.09 -0.05 -0.02 0.00 -1.01 0.00 0.00 66.70 65.53 2kym h VAL 77 Cb 0.69 0.51 0.00 0.00 -2.01 0.00 0.00 31.29 30.48 2kym h VAL 77 CO 0.14 0.03 -0.18 0.24 -1.01 0.00 0.00 177.57 176.78 2kym h MET 78 N 0.15 -0.48 -0.86 4.17 2.86 -0.76 -1.47 114.93 118.54 2kym h MET 78 Ca 0.38 0.03 0.13 0.00 -2.06 0.00 0.00 59.70 58.17 2kym h MET 78 Cb 1.26 0.11 -0.06 0.00 0.06 0.00 0.00 31.60 32.96 2kym h MET 78 CO -0.06 -0.16 0.56 0.87 1.06 0.00 0.00 176.91 179.17 2kym h LYS 79 N -0.90 0.69 0.35 1.72 1.57 -0.55 0.24 116.57 119.68 2kym h LYS 79 Ca -0.05 -0.04 -0.02 0.00 -1.87 0.00 0.00 60.65 58.67 2kym h LYS 79 Cb 0.54 -0.15 0.00 0.00 0.08 0.00 0.00 32.23 32.70 2kym h LYS 79 CO 0.08 0.45 -0.17 0.82 -0.57 0.00 0.00 179.45 180.07 2kym h ILE 80 N 0.71 0.61 -0.59 1.86 2.04 -1.24 0.19 117.51 121.09 2kym h ILE 80 Ca 0.42 -0.57 -0.00 0.00 1.00 0.00 0.00 64.86 65.71 2kym h ILE 80 Cb 0.62 0.88 -0.03 0.00 -0.74 0.00 0.00 36.82 37.55 2kym h ILE 80 CO -0.18 0.10 0.36 0.40 0.00 0.00 0.00 178.15 178.83 2kym h ILE 81 N -0.81 1.17 0.01 -0.67 2.04 -0.80 0.24 117.51 118.68 2kym h ILE 81 Ca -0.05 -0.36 -0.00 0.00 1.00 0.00 0.00 64.86 65.45 2kym h ILE 81 Cb 0.52 0.33 0.00 0.00 -0.74 0.00 0.00 36.82 36.94 2kym h ILE 81 CO 0.08 0.17 -0.00 -0.78 0.00 0.00 0.00 178.15 177.62 2kym h ASP 82 N 0.81 -0.01 -0.25 1.72 3.58 -0.51 -0.53 116.42 121.24 2kym h ASP 82 Ca 0.21 -0.55 -0.01 0.00 0.42 0.00 0.00 57.03 57.10 2kym h ASP 82 Cb -0.04 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 41.00 2kym h ASP 82 CO -0.04 0.55 0.11 -0.33 -2.88 0.00 0.00 179.24 176.65 2kym h GLU 83 N -0.57 0.36 0.00 0.28 4.39 -0.41 -2.08 114.58 116.55 2kym h GLU 83 Ca -0.00 -0.06 0.00 0.00 0.34 0.00 0.00 59.36 59.64 2kym h GLU 83 Cb 0.56 -0.06 0.00 0.00 -0.10 0.00 0.00 28.75 29.15 2kym h GLU 83 CO 0.00 0.38 0.00 1.19 -1.16 0.00 0.00 179.01 179.43 2kym n PHE 84 N -4.80 0.72 -3.39 4.33 3.01 0.83 -4.91 117.46 113.24 2kym n PHE 84 Ca -0.03 0.28 -0.17 0.00 1.01 0.00 0.00 57.45 58.53 2kym n PHE 84 Cb 0.11 -0.95 0.07 0.00 -0.01 0.00 0.00 39.48 38.71 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 -2.15 -4.24 -2.99 -1.08 4.01 -0.41 -4.13 118.16 107.18 2kym n LYS 85 Ca 0.03 0.81 -0.40 0.00 -0.51 0.00 0.00 58.31 58.24 2kym n LYS 85 Cb 0.24 -5.69 -0.05 0.00 -0.51 0.00 0.00 35.03 29.02 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 -3.41 4.88 0.80 -0.18 1.01 -0.34 -4.64 121.20 119.33 2kym s ILE 86 Ca 0.23 1.59 -0.11 0.00 0.00 0.00 0.00 60.65 62.36 2kym s ILE 86 Cb -0.04 -4.10 0.07 0.00 0.01 0.00 0.00 42.46 38.41 2kym s ILE 86 CO 0.75 0.30 1.09 -2.16 0.00 0.00 0.00 174.94 174.92 2kym s PRO 87 N 0.41 2.04 0.39 2.79 0.04 -1.26 -4.79 135.00 134.62 2kym s PRO 87 Ca 0.39 1.10 0.04 0.00 0.04 0.00 0.00 61.00 62.57 2kym s PRO 87 Cb -0.19 -1.88 -0.00 0.00 0.04 0.00 0.00 34.50 32.47 2kym s PRO 87 CO 0.21 -1.78 0.56 0.99 0.04 0.00 0.00 177.00 177.03 2kym s THR 88 N -2.91 3.87 0.16 1.26 2.01 -1.26 -1.56 115.64 117.21 2kym s THR 88 Ca 0.62 -0.81 -0.21 0.00 0.31 0.00 0.00 61.69 61.59 2kym s THR 88 Cb -0.17 -3.37 0.06 0.00 0.01 0.00 0.00 72.50 69.02 2kym s THR 88 CO 0.56 -0.19 1.63 0.58 -0.69 0.00 0.00 174.62 176.51 2kym h VAL 89 N 0.65 0.40 -0.25 3.82 2.07 -1.31 0.84 116.25 122.47 2kym h VAL 89 Ca -0.45 0.00 0.06 0.00 0.82 0.00 0.00 66.70 67.13 2kym h VAL 89 Cb 1.26 0.40 -0.07 0.00 -1.52 0.00 0.00 31.29 31.36 2kym h VAL 89 CO 0.54 0.00 -0.19 -0.33 0.02 0.00 0.00 177.57 177.60 2kym h GLU 90 N -0.20 -0.18 -0.76 1.57 5.08 -1.95 0.26 114.58 118.41 2kym h GLU 90 Ca 0.16 0.01 0.04 0.00 -1.00 0.00 0.00 59.36 58.57 2kym h GLU 90 Cb 0.45 0.04 -0.05 0.00 0.50 0.00 0.00 28.75 29.69 2kym h GLU 90 CO -0.43 -0.12 0.47 1.96 -1.00 0.00 0.00 179.01 179.90 2kym h GLN 91 N -0.18 0.87 -0.42 2.33 1.08 -1.77 -0.77 115.11 116.25 2kym h GLN 91 Ca 0.14 -0.05 -0.07 0.00 -1.45 0.00 0.00 58.65 57.22 2kym h GLN 91 Cb 0.40 -0.20 -0.02 0.00 -0.05 0.00 0.00 27.48 27.61 2kym h GLN 91 CO -0.36 0.58 -0.04 2.35 -0.95 0.00 0.00 178.83 180.40 2kym h TRP 92 N 0.90 0.75 -0.38 2.96 7.01 0.16 -1.24 115.95 126.10 2kym h TRP 92 Ca 0.32 -0.11 -0.12 0.00 2.11 0.00 0.00 58.89 61.08 2kym h TRP 92 Cb 0.07 -0.20 -0.01 0.00 -2.10 0.00 0.00 29.16 26.92 2kym h TRP 92 CO -0.04 0.73 -0.27 0.87 -2.79 0.00 0.00 178.44 176.94 2kym h LYS 93 N 0.65 0.79 0.03 2.65 1.79 0.33 -1.27 116.57 121.54 2kym h LYS 93 Ca 0.13 -0.34 -0.00 0.00 -2.18 0.00 0.00 60.65 58.25 2kym h LYS 93 Cb 0.47 -0.02 0.00 0.00 -1.58 0.00 0.00 32.23 31.09 2kym h LYS 93 CO 0.02 0.96 -0.01 0.22 -1.08 0.00 0.00 179.45 179.56 2kym h ASP 94 N 0.68 -0.03 -0.98 0.86 3.58 -0.89 -0.39 116.42 119.25 2kym h ASP 94 Ca 0.08 -0.46 0.01 0.00 0.42 0.00 0.00 57.03 57.08 2kym h ASP 94 Cb 0.79 0.01 -0.05 0.00 1.72 0.00 0.00 39.33 41.80 2kym h ASP 94 CO 0.07 0.46 0.65 0.06 -2.88 0.00 0.00 179.24 177.59 2kym h GLN 95 N -0.53 1.28 -0.31 0.28 3.07 -1.25 -1.30 115.11 116.35 2kym h GLN 95 Ca -0.00 -0.08 -0.15 0.00 0.09 0.00 0.00 58.65 58.51 2kym h GLN 95 Cb 0.49 -0.29 -0.00 0.00 0.08 0.00 0.00 27.48 27.76 2kym h GLN 95 CO 0.01 0.85 -0.41 1.79 0.09 0.00 0.00 178.83 181.16 2kym h THR 96 N 1.32 1.29 -0.45 1.86 1.35 -1.23 0.65 112.91 117.69 2kym h THR 96 Ca 0.36 -1.59 -0.00 0.00 -0.55 0.00 0.00 66.41 64.63 2kym h THR 96 Cb -0.14 1.57 -0.02 0.00 -1.73 0.00 0.00 68.15 67.82 2kym h THR 96 CO -0.08 0.52 0.27 0.03 -0.25 0.00 0.00 175.52 176.01 2kym h ARG 97 N 0.60 0.61 -0.00 4.72 2.47 -0.64 0.26 114.38 122.40 2kym h ARG 97 Ca 0.04 -0.06 -0.18 0.00 -1.26 0.00 0.00 59.98 58.52 2kym h ARG 97 Cb 1.00 -0.13 -0.02 0.00 -1.65 0.00 0.00 29.97 29.17 2kym h ARG 97 CO 0.10 0.45 -0.81 0.07 0.56 0.00 0.00 179.97 180.34 2kym h ARG 98 N 0.60 0.08 -0.23 0.04 0.11 -1.25 -3.21 114.38 110.52 2kym h ARG 98 Ca 0.16 -0.08 -0.19 0.00 0.10 0.00 0.00 59.98 59.97 2kym h ARG 98 Cb -0.00 0.02 0.00 0.00 1.11 0.00 0.00 29.97 31.10 2kym h ARG 98 CO -0.03 0.84 -0.60 -0.92 0.10 0.00 0.00 179.97 179.36 2kym h TYR 99 N 0.05 0.97 0.00 4.08 3.20 -0.51 -2.85 116.97 121.90 2kym h TYR 99 Ca -0.02 -0.36 0.00 0.00 3.14 0.00 0.00 58.73 61.49 2kym h TYR 99 Cb 1.42 -0.17 0.00 0.00 1.54 0.00 0.00 36.73 39.51 2kym h TYR 99 CO 0.01 1.17 0.00 1.63 -1.64 0.00 0.00 178.16 179.33 2kym n LYS 100 N -3.97 0.17 0.00 1.82 5.02 0.90 -4.70 118.16 117.39 2kym n LYS 100 Ca -0.05 0.49 0.00 0.00 -2.02 0.00 0.00 58.31 56.73 2kym n LYS 100 Cb 0.65 -1.88 0.00 0.00 -0.02 0.00 0.00 35.03 33.78 2kym n LYS 100 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 2kym n GLU 101 N -2.21 -1.84 -1.46 1.97 -0.58 -1.08 -4.68 120.64 110.77 2kym n GLU 101 Ca 0.01 0.00 -0.46 0.00 -0.42 0.00 0.00 57.16 56.29 2kym n GLU 101 Cb 0.16 0.00 -0.09 0.00 -0.57 0.00 0.00 31.44 30.95 2kym n GLU 101 CO 0.00 0.00 0.00 -1.13 -0.48 0.00 0.00 177.13 175.52 2kym n SER 102 N -2.86 1.57 -0.93 1.62 3.41 -1.26 -4.81 113.62 110.36 2kym n SER 102 Ca 0.00 0.20 0.00 0.00 -0.26 0.00 0.00 58.87 58.81 2kym n SER 102 Cb 0.00 -1.21 0.00 0.00 -0.26 0.00 0.00 64.21 62.74 2kym n SER 102 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 2kym n SER 103 N 11.00 0.00 -4.80 4.04 7.64 -1.26 -5.10 113.62 125.14 2kym n SER 103 Ca 0.48 -0.93 -0.32 0.00 1.01 0.00 0.00 58.87 59.11 2kym n SER 103 Cb 0.22 0.00 0.03 0.00 -1.01 0.00 0.00 64.21 63.45 2kym n SER 103 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 2kym s ILE 104 N -2.90 3.77 1.05 0.44 1.01 -1.26 -5.00 121.20 118.30 2kym s ILE 104 Ca 0.00 0.75 -0.18 0.00 0.00 0.00 0.00 60.65 61.21 2kym s ILE 104 Cb 0.00 -3.32 0.02 0.00 0.01 0.00 0.00 42.46 39.17 2kym s ILE 104 CO 0.00 -0.59 -0.19 0.00 0.00 0.00 0.00 174.94 174.17 2kym n GLN 105 N -2.47 -0.90 0.01 2.79 6.02 -1.26 -4.99 117.38 116.58 2kym n GLN 105 Ca 0.09 -0.24 0.00 0.00 -0.01 0.00 0.00 57.00 56.83 2kym n GLN 105 Cb 0.53 -1.58 0.00 0.00 1.02 0.00 0.00 30.24 30.21 2kym n GLN 105 CO 0.00 0.00 0.00 -0.89 -1.01 0.00 0.00 177.06 175.16 2kym n ILE 106 N -3.92 0.02 0.00 5.09 2.08 -1.26 -5.09 119.36 116.27 2kym n ILE 106 Ca 0.02 0.01 0.00 0.00 0.56 0.00 0.00 62.75 63.33 2kym n ILE 106 Cb 0.61 -0.19 0.00 0.00 -0.75 0.00 0.00 39.64 39.31 2kym n ILE 106 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 2kym n GLY 107 N 1.79 1.68 3.40 7.39 0.00 -1.26 -5.14 105.19 113.06 2kym n GLY 107 Ca 0.00 -0.15 -0.29 0.00 0.00 0.00 0.00 46.02 45.58 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 0.00 3.41 -0.09 1.61 2.47 -1.26 -5.14 114.94 115.94 2kym s ASN 108 Ca 0.00 -0.72 -0.18 0.00 0.42 0.00 0.00 52.86 52.38 2kym s ASN 108 Cb 0.00 -0.27 0.04 0.00 -1.45 0.00 0.00 41.25 39.57 2kym s ASN 108 CO 0.00 0.18 0.43 -0.83 -3.72 0.00 0.00 177.10 173.16 2kym s GLY 109 N -2.06 -0.30 0.36 1.21 0.00 -1.26 -5.17 107.32 100.09 2kym s GLY 109 Ca 0.15 0.90 -0.07 0.00 0.00 0.00 0.00 44.72 45.69 2kym s GLY 109 CO 0.07 0.68 0.60 1.42 0.00 0.00 0.00 173.10 175.87 2kym n HIS 110 N 1.90 -1.83 0.00 1.90 8.25 -1.26 -5.19 115.22 118.99 2kym n HIS 110 Ca -0.18 -2.08 0.00 0.00 -0.26 0.00 0.00 57.72 55.20 2kym n HIS 110 Cb 0.57 0.70 0.00 0.00 1.12 0.00 0.00 29.99 32.37 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 -0.54 1.90 3.46 -1.41 0.00 -1.26 -5.19 105.19 102.15 2kym n GLY 111 Ca -0.03 -0.18 -0.16 0.00 0.00 0.00 0.00 46.02 45.64 2kym n GLY 111 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2kym s GLN 112 N -1.50 1.96 0.05 1.61 -1.52 -1.26 -5.19 119.66 113.82 2kym s GLN 112 Ca 0.00 -1.86 -0.27 0.00 -1.95 0.00 0.00 55.36 51.29 2kym s GLN 112 Cb 0.00 0.43 0.08 0.00 -0.22 0.00 0.00 33.01 33.31 2kym s GLN 112 CO 0.00 -0.80 0.74 -1.12 -0.25 0.00 0.00 175.29 173.85 2kym s SER 113 N -3.29 -0.50 0.35 5.90 0.01 -1.26 -5.19 113.70 109.72 2kym s SER 113 Ca 0.33 0.12 -0.02 0.00 1.31 0.00 0.00 55.95 57.68 2kym s SER 113 Cb -0.00 0.50 0.00 0.00 0.21 0.00 0.00 66.02 66.73 2kym s SER 113 CO 0.23 -0.76 0.48 -1.10 0.41 0.00 0.00 173.24 172.50 2kym s GLN 114 N -3.01 1.93 0.00 12.44 -0.21 -1.26 -5.16 119.66 124.38 2kym s GLN 114 Ca 0.01 -1.76 0.00 0.00 0.02 0.00 0.00 55.36 53.62 2kym s GLN 114 Cb -0.01 0.45 0.00 0.00 1.00 0.00 0.00 33.01 34.45 2kym s GLN 114 CO -0.08 -0.80 0.00 0.41 -2.12 0.00 0.00 175.29 172.70 2kym n GLY 115 N -0.57 2.58 3.49 3.09 0.00 -1.26 -5.19 105.19 107.33 2kym n GLY 115 Ca 0.01 0.14 -0.10 0.00 0.00 0.00 0.00 46.02 46.07 2kym n GLY 115 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 2kym s LEU 116 N 0.00 -0.44 0.00 0.99 0.05 -1.26 -5.39 118.68 112.63 2kym s LEU 116 Ca 0.00 0.09 0.15 0.00 0.05 0.00 0.00 54.13 54.43 2kym s LEU 116 Cb 0.00 2.19 0.12 0.00 -2.05 0.00 0.00 46.19 46.45 2kym s LEU 116 CO 0.00 -0.68 0.99 -1.84 -0.55 0.00 0.00 176.35 174.27