#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 0.89 -1.09 3.17 0.00 -1.26 -5.07 121.76 118.40 2kym s ALA -1 Ca 0.00 -1.34 -0.23 0.00 0.00 0.00 0.00 51.96 50.39 2kym s ALA -1 Cb 0.00 0.22 -0.07 0.00 0.00 0.00 0.00 23.12 23.27 2kym s ALA -1 CO 0.00 -0.27 1.94 -1.25 0.00 0.00 0.00 175.76 176.18 2kym s PRO 1 N -3.86 2.51 0.37 0.00 0.04 -1.26 -4.95 135.00 127.85 2kym s PRO 1 Ca 0.12 -0.87 -0.22 0.00 0.04 0.00 0.00 61.00 60.07 2kym s PRO 1 Cb 0.06 -5.18 -0.10 0.00 0.04 0.00 0.00 34.50 29.32 2kym s PRO 1 CO -0.05 -3.79 0.92 -0.48 0.04 0.00 0.00 177.00 173.63 2kym s LEU 2 N 10.74 4.11 0.33 -3.56 2.34 -1.26 -4.87 118.68 126.50 2kym s LEU 2 Ca 0.69 1.69 0.09 0.00 0.06 0.00 0.00 54.13 56.66 2kym s LEU 2 Cb -0.03 -4.26 -0.05 0.00 -0.56 0.00 0.00 46.19 41.29 2kym s LEU 2 CO 0.09 -0.22 -0.03 -0.36 -1.06 0.00 0.00 176.35 174.77 2kym s PHE 3 N -1.93 2.51 0.12 3.48 0.40 -1.25 -2.97 117.98 118.35 2kym s PHE 3 Ca 0.56 -0.42 -0.04 0.00 -0.60 0.00 0.00 56.93 56.43 2kym s PHE 3 Cb -0.13 -1.39 -0.03 0.00 0.51 0.00 0.00 43.02 41.98 2kym s PHE 3 CO 0.18 0.53 0.12 0.00 0.70 0.00 0.00 175.22 176.75 2kym s ALA 4 N -2.51 0.45 -0.05 5.36 0.00 -0.33 -2.46 121.76 122.21 2kym s ALA 4 Ca 0.34 -1.18 0.02 0.00 0.00 0.00 0.00 51.96 51.14 2kym s ALA 4 Cb -0.01 0.74 0.01 0.00 0.00 0.00 0.00 23.12 23.87 2kym s ALA 4 CO 0.18 -0.52 -0.10 0.54 0.00 0.00 0.00 175.76 175.87 2kym s VAL 5 N -3.99 0.93 0.28 0.00 0.11 -0.40 -1.07 120.40 116.26 2kym s VAL 5 Ca 0.18 -0.37 -0.29 0.00 -2.93 0.00 0.00 61.98 58.56 2kym s VAL 5 Cb 0.06 -0.86 -0.10 0.00 -1.53 0.00 0.00 36.38 33.95 2kym s VAL 5 CO -0.02 0.30 1.14 0.42 -3.33 0.00 0.00 175.10 173.62 2kym s THR 6 N 0.65 3.35 -0.26 5.04 -4.23 -0.88 -0.13 115.64 119.17 2kym s THR 6 Ca -0.12 1.34 0.06 0.00 -1.18 0.00 0.00 61.69 61.80 2kym s THR 6 Cb -0.14 -3.85 -0.07 0.00 1.34 0.00 0.00 72.50 69.77 2kym s THR 6 CO 0.02 0.31 0.25 0.18 -0.54 0.00 0.00 174.62 174.85 2kym n LEU 7 N 1.22 0.26 -4.14 4.79 4.77 -1.22 -0.09 117.00 122.59 2kym n LEU 7 Ca -0.01 -0.44 -0.10 0.00 -0.03 0.00 0.00 56.01 55.44 2kym n LEU 7 Cb 0.44 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.43 2kym n LEU 7 CO 0.55 0.07 -0.38 -0.31 -1.33 0.00 0.00 177.39 175.99 2kym s TYR 8 N -1.70 0.78 -0.49 -1.77 1.51 -1.26 -4.61 117.35 109.81 2kym s TYR 8 Ca 0.02 -0.94 -0.25 0.00 -1.01 0.00 0.00 57.07 54.89 2kym s TYR 8 Cb 0.05 -0.47 0.03 0.00 -0.11 0.00 0.00 41.96 41.45 2kym s TYR 8 CO 0.26 -0.21 0.92 -2.00 -1.11 0.00 0.00 175.55 173.40 2kym s GLU 9 N -3.77 3.46 -0.01 -0.62 2.56 -1.26 -3.57 118.70 115.48 2kym s GLU 9 Ca 0.10 0.02 -0.14 0.00 0.00 0.00 0.00 54.97 54.94 2kym s GLU 9 Cb 0.05 -3.96 -0.06 0.00 2.00 0.00 0.00 34.13 32.17 2kym s GLU 9 CO -0.06 -1.29 0.40 0.12 -0.56 0.00 0.00 175.26 173.87 2kym s PHE 10 N 3.77 3.71 -0.47 5.30 5.36 0.70 -4.95 117.98 131.39 2kym s PHE 10 Ca 0.35 0.96 -0.03 0.00 -0.96 0.00 0.00 56.93 57.24 2kym s PHE 10 Cb -0.11 -2.29 0.13 0.00 -0.34 0.00 0.00 43.02 40.41 2kym s PHE 10 CO 0.24 0.62 0.28 0.15 -1.46 0.00 0.00 175.22 175.04 2kym s LYS 11 N -0.96 2.17 0.86 10.12 3.01 -1.26 -2.29 119.74 131.38 2kym s LYS 11 Ca 0.23 -2.04 -0.14 0.00 -1.01 0.00 0.00 55.97 53.01 2kym s LYS 11 Cb -0.16 -3.63 0.00 0.00 -1.01 0.00 0.00 37.83 33.03 2kym s LYS 11 CO 0.13 -1.11 0.43 0.00 0.51 0.00 0.00 175.35 175.31 2kym n ALA 12 N 4.25 -2.20 -0.02 5.17 0.00 -1.26 -4.96 120.51 121.49 2kym n ALA 12 Ca 0.01 -0.46 -0.03 0.00 0.00 0.00 0.00 53.44 52.96 2kym n ALA 12 Cb 0.40 -1.81 -0.03 0.00 0.00 0.00 0.00 19.45 18.01 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 -1.20 2.37 -4.08 0.00 0.28 -1.26 -4.94 120.64 111.80 2kym n GLU 13 Ca 0.08 0.01 -0.21 0.00 -0.16 0.00 0.00 57.16 56.88 2kym n GLU 13 Cb 0.52 -1.11 -0.06 0.00 1.43 0.00 0.00 31.44 32.22 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 -2.31 0.55 -0.25 3.44 5.12 -1.26 -5.03 116.66 116.92 2kym n ARG 14 Ca -0.08 -3.02 -0.07 0.00 -1.93 0.00 0.00 57.85 52.76 2kym n ARG 14 Cb 0.63 1.86 0.04 0.00 -1.16 0.00 0.00 32.46 33.83 2kym n ARG 14 CO 0.00 0.00 0.00 0.22 -1.93 0.00 0.00 177.63 175.92 2kym h ASP 15 N 1.53 0.96 -0.10 0.55 3.58 -2.05 -2.03 116.42 118.87 2kym h ASP 15 Ca -0.26 -0.18 0.03 0.00 0.42 0.00 0.00 57.03 57.03 2kym h ASP 15 Cb 1.07 -0.25 -0.00 0.00 1.72 0.00 0.00 39.33 41.87 2kym h ASP 15 CO 0.41 0.88 0.16 -2.24 -2.88 0.00 0.00 179.24 175.56 2kym h ASP 16 N 0.98 0.00 -2.89 2.28 3.04 -1.96 -3.41 116.42 114.46 2kym h ASP 16 Ca 0.23 0.00 -0.57 0.00 -3.24 0.00 0.00 57.03 53.44 2kym h ASP 16 Cb 0.24 0.00 -0.03 0.00 -1.04 0.00 0.00 39.33 38.50 2kym h ASP 16 CO -0.02 0.00 -0.40 -1.61 -2.04 0.00 0.00 179.24 175.17 2kym s GLU 17 N -4.46 3.51 -0.10 4.15 8.01 -0.76 -2.03 118.70 127.01 2kym s GLU 17 Ca -0.05 -0.36 -0.01 0.00 0.01 0.00 0.00 54.97 54.57 2kym s GLU 17 Cb 0.14 -2.92 0.03 0.00 -4.31 0.00 0.00 34.13 27.06 2kym s GLU 17 CO 0.48 0.50 -0.05 -1.17 0.01 0.00 0.00 175.26 175.03 2kym s LEU 18 N -2.92 0.99 0.45 1.80 0.20 -1.24 -4.72 118.68 113.23 2kym s LEU 18 Ca 0.37 -0.22 -0.25 0.00 0.69 0.00 0.00 54.13 54.73 2kym s LEU 18 Cb -0.12 -0.69 -0.08 0.00 -0.43 0.00 0.00 46.19 44.88 2kym s LEU 18 CO 0.28 -0.14 1.34 1.51 -0.29 0.00 0.00 176.35 179.04 2kym s ASP 19 N 1.75 6.00 0.05 3.68 -4.77 -1.26 -4.66 116.67 117.46 2kym s ASP 19 Ca 0.04 2.72 -0.01 0.00 -3.30 0.00 0.00 52.55 52.00 2kym s ASP 19 Cb -0.13 -2.64 -0.04 0.00 -1.09 0.00 0.00 42.92 39.03 2kym s ASP 19 CO -0.07 -1.07 -0.03 0.68 0.70 0.00 0.00 175.17 175.38 2kym s VAL 20 N -1.28 0.22 0.24 2.11 -7.23 -0.97 -4.96 120.40 108.52 2kym s VAL 20 Ca 0.61 -1.73 0.11 0.00 -1.81 0.00 0.00 61.98 59.16 2kym s VAL 20 Cb -0.39 -1.41 -0.05 0.00 0.56 0.00 0.00 36.38 35.09 2kym s VAL 20 CO 0.50 -0.95 -0.20 -0.44 -0.31 0.00 0.00 175.10 173.69 2kym s SER 21 N -2.79 3.32 -0.14 4.85 0.01 -1.26 -0.22 113.70 117.46 2kym s SER 21 Ca 0.05 -0.97 -0.29 0.00 1.31 0.00 0.00 55.95 56.05 2kym s SER 21 Cb 0.06 -0.25 -0.04 0.00 0.21 0.00 0.00 66.02 66.01 2kym s SER 21 CO -0.09 0.02 1.56 -2.16 0.41 0.00 0.00 173.24 172.98 2kym s PRO 22 N -3.25 4.04 0.00 12.44 0.04 -1.23 -2.72 135.00 144.31 2kym s PRO 22 Ca 0.25 1.87 0.00 0.00 0.04 0.00 0.00 61.00 63.16 2kym s PRO 22 Cb -0.05 -3.96 0.00 0.00 0.04 0.00 0.00 34.50 30.53 2kym s PRO 22 CO 0.12 -1.00 0.00 0.41 0.04 0.00 0.00 177.00 176.57 2kym n GLY 23 N 4.24 0.96 3.90 0.56 0.00 0.87 -4.94 105.19 110.79 2kym n GLY 23 Ca 0.17 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.91 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 3.64 -0.30 1.61 0.41 -1.10 -4.92 118.70 117.48 2kym s GLU 24 Ca 0.00 0.02 -0.09 0.00 -0.41 0.00 0.00 54.97 54.49 2kym s GLU 24 Cb 0.00 -2.64 -0.00 0.00 -1.78 0.00 0.00 34.13 29.70 2kym s GLU 24 CO 0.00 0.21 0.12 -0.80 -0.49 0.00 0.00 175.26 174.30 2kym s ASN 25 N -3.15 5.39 0.20 -0.19 -0.87 -1.26 -2.07 114.94 112.99 2kym s ASN 25 Ca 0.44 -0.55 0.10 0.00 -1.57 0.00 0.00 52.86 51.29 2kym s ASN 25 Cb -0.11 -1.96 -0.04 0.00 -0.02 0.00 0.00 41.25 39.12 2kym s ASN 25 CO 0.30 -0.18 -0.14 -0.76 -2.57 0.00 0.00 177.10 173.75 2kym s LEU 26 N 1.58 2.79 -0.32 0.60 1.02 -0.23 -3.06 118.68 121.06 2kym s LEU 26 Ca 0.04 -0.72 -0.07 0.00 0.02 0.00 0.00 54.13 53.40 2kym s LEU 26 Cb -0.17 -1.46 0.02 0.00 0.02 0.00 0.00 46.19 44.60 2kym s LEU 26 CO 0.05 0.09 0.10 -0.55 0.02 0.00 0.00 176.35 176.07 2kym s SER 27 N -2.92 5.26 0.37 2.29 0.15 -0.41 -1.19 113.70 117.26 2kym s SER 27 Ca 0.25 -0.87 -0.25 0.00 0.70 0.00 0.00 55.95 55.77 2kym s SER 27 Cb -0.08 -1.89 -0.09 0.00 -1.71 0.00 0.00 66.02 62.25 2kym s SER 27 CO 0.14 -0.26 1.04 -0.63 1.20 0.00 0.00 173.24 174.74 2kym s ILE 28 N 1.48 3.75 -0.05 6.45 1.01 -1.16 -1.28 121.20 131.40 2kym s ILE 28 Ca 0.01 1.41 -0.01 0.00 0.00 0.00 0.00 60.65 62.07 2kym s ILE 28 Cb -0.18 -3.77 -0.03 0.00 0.01 0.00 0.00 42.46 38.49 2kym s ILE 28 CO 0.03 0.08 -0.05 0.00 0.00 0.00 0.00 174.94 175.00 2kym s ALA 30 N -2.10 -1.05 0.49 0.00 0.00 -1.26 -4.70 121.76 113.15 2kym s ALA 30 Ca -0.07 -0.49 0.02 0.00 0.00 0.00 0.00 51.96 51.42 2kym s ALA 30 Cb 0.02 0.75 -0.02 0.00 0.00 0.00 0.00 23.12 23.87 2kym s ALA 30 CO 0.10 -1.02 0.02 -3.38 0.00 0.00 0.00 175.76 171.49 2kym s HIS 31 N -2.99 1.89 -0.28 0.00 -0.00 -0.98 -0.87 115.29 112.05 2kym s HIS 31 Ca 0.14 -0.98 -0.01 0.00 -0.00 0.00 0.00 55.06 54.21 2kym s HIS 31 Cb -0.05 -1.57 0.13 0.00 -0.00 0.00 0.00 32.58 31.10 2kym s HIS 31 CO 0.09 0.18 0.29 -0.47 -0.00 0.00 0.00 174.74 174.82 2kym s TYR 32 N -2.91 -0.43 -1.67 0.38 5.04 0.16 -1.34 117.35 116.57 2kym s TYR 32 Ca 0.09 -0.15 0.00 0.00 -2.44 0.00 0.00 57.07 54.57 2kym s TYR 32 Cb 0.02 -0.46 0.00 0.00 0.35 0.00 0.00 41.96 41.87 2kym s TYR 32 CO 0.05 -0.90 0.00 -3.47 -1.34 0.00 0.00 175.55 169.89 2kym n ASP 33 N 5.31 -5.64 -1.96 4.32 2.03 -1.26 -1.28 116.55 118.07 2kym n ASP 33 Ca -0.02 0.39 -0.17 0.00 0.52 0.00 0.00 54.79 55.50 2kym n ASP 33 Cb 0.46 -4.53 -0.01 0.00 -0.72 0.00 0.00 41.12 36.33 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 -2.29 -0.80 -0.46 -0.67 4.02 -1.26 -4.83 117.16 110.87 2kym n TYR 34 Ca -0.16 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.73 2kym n TYR 34 Cb 0.64 -3.46 0.00 0.00 -0.02 0.00 0.00 39.34 36.50 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 -2.66 0.18 -3.70 -0.72 0.28 -0.41 -4.96 120.64 108.65 2kym n GLU 35 Ca -0.21 -0.18 -0.12 0.00 -0.16 0.00 0.00 57.16 56.49 2kym n GLU 35 Cb 0.65 -0.63 -0.10 0.00 1.43 0.00 0.00 31.44 32.79 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 -0.08 -0.58 -0.08 -1.84 0.52 -1.15 -4.24 118.94 111.49 2kym s TRP 36 Ca 0.00 1.31 0.04 0.00 0.02 0.00 0.00 56.10 57.47 2kym s TRP 36 Cb 0.00 0.24 -0.00 0.00 -1.15 0.00 0.00 33.47 32.56 2kym s TRP 36 CO 0.00 -0.30 -0.22 -0.06 0.02 0.00 0.00 176.95 176.39 2kym s PHE 37 N 0.78 2.31 -0.82 -1.98 0.08 0.11 -0.67 117.98 117.78 2kym s PHE 37 Ca -0.04 -0.87 -0.21 0.00 0.12 0.00 0.00 56.93 55.92 2kym s PHE 37 Cb -0.05 -1.55 0.09 0.00 -0.57 0.00 0.00 43.02 40.94 2kym s PHE 37 CO -0.06 -0.34 1.12 0.42 -0.10 0.00 0.00 175.22 176.26 2kym s ILE 38 N 0.27 4.39 -0.07 0.64 -1.09 -0.05 -1.18 121.20 124.11 2kym s ILE 38 Ca -0.14 -0.86 0.01 0.00 -2.23 0.00 0.00 60.65 57.42 2kym s ILE 38 Cb -0.16 -4.79 -0.03 0.00 -1.58 0.00 0.00 42.46 35.90 2kym s ILE 38 CO 0.07 -1.57 -0.08 0.00 -1.23 0.00 0.00 174.94 172.13 2kym s ALA 39 N 3.74 2.92 0.16 9.38 0.00 -1.26 0.09 121.76 136.78 2kym s ALA 39 Ca 0.30 -0.90 0.08 0.00 0.00 0.00 0.00 51.96 51.44 2kym s ALA 39 Cb -0.09 -1.21 -0.04 0.00 0.00 0.00 0.00 23.12 21.78 2kym s ALA 39 CO -0.00 0.54 -0.06 -1.59 0.00 0.00 0.00 175.76 174.64 2kym s LYS 40 N -0.68 2.20 -0.10 0.00 -2.85 -0.40 -3.64 119.74 114.26 2kym s LYS 40 Ca 0.10 -1.16 -0.29 0.00 -1.00 0.00 0.00 55.97 53.61 2kym s LYS 40 Cb -0.11 -2.26 -0.04 0.00 -2.06 0.00 0.00 37.83 33.36 2kym s LYS 40 CO 0.02 0.46 1.53 -1.25 0.10 0.00 0.00 175.35 176.20 2kym s PRO 41 N -2.76 4.16 0.44 1.78 0.04 -1.26 -1.28 135.00 136.13 2kym s PRO 41 Ca 0.25 1.98 0.25 0.00 0.04 0.00 0.00 61.00 63.53 2kym s PRO 41 Cb -0.09 -3.92 0.57 0.00 0.04 0.00 0.00 34.50 31.09 2kym s PRO 41 CO 0.16 -0.84 1.69 0.82 0.04 0.00 0.00 177.00 178.87 2kym h ILE 42 N 5.60 0.00 0.35 0.56 2.04 -1.89 -3.32 117.51 120.85 2kym h ILE 42 Ca -0.35 -0.86 -0.02 0.00 1.00 0.00 0.00 64.86 64.63 2kym h ILE 42 Cb 1.15 1.86 0.00 0.00 -0.74 0.00 0.00 36.82 39.09 2kym h ILE 42 CO 0.96 0.00 -0.17 -1.13 0.00 0.00 0.00 178.15 177.82 2kym h ASN 43 N 0.00 -0.40 -2.62 1.72 -1.24 -1.90 -3.46 115.58 107.68 2kym h ASN 43 Ca 0.00 -0.16 -0.06 0.00 0.71 0.00 0.00 56.30 56.79 2kym h ASN 43 Cb 0.88 0.10 0.02 0.00 0.73 0.00 0.00 38.32 40.06 2kym h ASN 43 CO 0.00 0.01 0.04 -2.11 -1.29 0.00 0.00 177.43 174.08 2kym n ARG 43 N -5.13 0.03 0.00 6.67 1.85 -1.25 -5.02 116.66 113.81 2kym n ARG 43 Ca -0.09 -0.30 0.00 0.00 -1.00 0.00 0.00 57.85 56.46 2kym n ARG 43 Cb 0.27 -0.15 0.00 0.00 -1.05 0.00 0.00 32.46 31.53 2kym n ARG 43 CO 0.00 0.00 0.00 1.28 -0.01 0.00 0.00 177.63 178.90 2kym n LEU 44 N 0.00 0.00 0.00 2.89 4.77 -1.26 -4.87 117.00 118.53 2kym n LEU 44 Ca 0.02 0.74 0.00 0.00 -0.03 0.00 0.00 56.01 56.75 2kym n LEU 44 Cb 0.08 -0.24 0.00 0.00 -2.33 0.00 0.00 43.42 40.92 2kym n LEU 44 CO 0.06 -0.24 0.00 0.61 -1.33 0.00 0.00 177.39 176.48 2kym n GLY 45 N -0.85 -1.51 3.09 -0.72 0.00 -1.26 -4.92 105.19 99.02 2kym n GLY 45 Ca 0.00 0.98 -0.35 0.00 0.00 0.00 0.00 46.02 46.65 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 3.05 -0.47 -0.02 0.00 -1.26 -4.97 107.32 103.65 2kym s GLY 46 Ca 0.00 -3.83 -0.28 0.00 0.00 0.00 0.00 44.72 40.62 2kym s GLY 46 CO 0.00 1.18 1.78 2.56 0.00 0.00 0.00 173.10 178.62 2kym s PRO 47 N -1.34 3.03 0.00 2.90 0.04 -1.26 -4.15 135.00 134.22 2kym s PRO 47 Ca 0.27 0.98 0.00 0.00 0.04 0.00 0.00 61.00 62.29 2kym s PRO 47 Cb -0.07 -4.27 0.00 0.00 0.04 0.00 0.00 34.50 30.20 2kym s PRO 47 CO -0.13 -2.23 0.00 0.41 0.04 0.00 0.00 177.00 175.09 2kym n GLY 48 N 5.51 0.42 3.60 0.56 0.00 -1.24 -4.99 105.19 109.05 2kym n GLY 48 Ca 0.21 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.20 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 -0.87 -0.02 0.99 0.20 -0.86 -4.73 118.68 113.39 2kym s LEU 49 Ca 0.00 1.28 0.01 0.00 0.69 0.00 0.00 54.13 56.10 2kym s LEU 49 Cb 0.00 2.11 0.02 0.00 -0.43 0.00 0.00 46.19 47.88 2kym s LEU 49 CO 0.00 -0.19 -0.01 0.54 -0.29 0.00 0.00 176.35 176.40 2kym s VAL 50 N 2.17 0.22 0.63 1.68 0.11 -0.33 -3.72 120.40 121.16 2kym s VAL 50 Ca -0.07 -0.01 -0.16 0.00 -2.93 0.00 0.00 61.98 58.81 2kym s VAL 50 Cb -0.07 -0.26 -0.01 0.00 -1.53 0.00 0.00 36.38 34.50 2kym s VAL 50 CO -0.18 0.12 1.11 -2.16 -3.33 0.00 0.00 175.10 170.66 2kym s PRO 51 N 0.59 2.93 0.50 1.54 0.04 -1.26 0.05 135.00 139.38 2kym s PRO 51 Ca -0.06 1.44 0.29 0.00 0.04 0.00 0.00 61.00 62.71 2kym s PRO 51 Cb -0.09 -1.96 1.04 0.00 0.04 0.00 0.00 34.50 33.53 2kym s PRO 51 CO -0.01 -1.15 1.87 0.28 0.04 0.00 0.00 177.00 178.02 2kym h VAL 52 N 0.30 0.15 0.00 -0.36 2.07 -1.91 -2.65 116.25 113.86 2kym h VAL 52 Ca -0.48 -0.78 0.00 0.00 0.82 0.00 0.00 66.70 66.26 2kym h VAL 52 Cb 1.25 1.68 0.00 0.00 -1.52 0.00 0.00 31.29 32.70 2kym h VAL 52 CO 0.55 0.06 0.00 -1.20 0.02 0.00 0.00 177.57 177.00 2kym n SER 53 N -3.16 0.00 -0.42 0.57 7.64 -1.26 -2.83 113.62 114.16 2kym n SER 53 Ca 0.01 -0.50 0.06 0.00 1.01 0.00 0.00 58.87 59.45 2kym n SER 53 Cb 0.39 -0.13 0.10 0.00 -1.01 0.00 0.00 64.21 63.56 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 -1.13 0.00 -3.88 1.43 4.02 -1.00 -4.94 117.16 111.66 2kym n TYR 54 Ca 0.17 -0.78 -0.09 0.00 -0.01 0.00 0.00 57.90 57.18 2kym n TYR 54 Cb 0.14 -0.14 -0.07 0.00 -0.02 0.00 0.00 39.34 39.26 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 -1.90 0.08 -0.12 -0.72 -7.23 -1.13 -3.43 120.40 105.96 2kym s VAL 55 Ca 0.25 -1.20 -0.01 0.00 -1.81 0.00 0.00 61.98 59.21 2kym s VAL 55 Cb 0.23 -1.62 0.03 0.00 0.56 0.00 0.00 36.38 35.59 2kym s VAL 55 CO -0.02 -0.38 -0.06 -0.60 -0.31 0.00 0.00 175.10 173.73 2kym s ARG 56 N -3.91 1.34 -0.38 4.82 3.52 0.81 -4.77 118.95 120.38 2kym s ARG 56 Ca 0.12 -0.24 -0.28 0.00 -0.13 0.00 0.00 55.73 55.20 2kym s ARG 56 Cb 0.03 -1.56 -0.01 0.00 -1.56 0.00 0.00 34.95 31.85 2kym s ARG 56 CO -0.04 -0.31 1.70 0.42 -0.81 0.00 0.00 175.30 176.26 2kym s ILE 57 N 1.75 3.58 -0.03 4.11 -1.09 -1.26 -1.28 121.20 126.97 2kym s ILE 57 Ca 0.04 0.57 0.01 0.00 -2.23 0.00 0.00 60.65 59.05 2kym s ILE 57 Cb -0.13 -3.83 0.01 0.00 -1.58 0.00 0.00 42.46 36.93 2kym s ILE 57 CO -0.08 -0.57 -0.06 0.27 -1.23 0.00 0.00 174.94 173.28 2kym s ILE 58 N 6.71 0.57 0.47 2.92 -4.36 -1.03 -4.40 121.20 122.08 2kym s ILE 58 Ca 0.73 -0.19 -0.23 0.00 -0.26 0.00 0.00 60.65 60.70 2kym s ILE 58 Cb -0.19 -0.55 -0.07 0.00 1.25 0.00 0.00 42.46 42.90 2kym s ILE 58 CO 0.32 0.21 1.22 -0.62 0.24 0.00 0.00 174.94 176.31 2kym s ASP 59 N 0.57 6.02 0.18 4.36 -1.08 -1.24 -3.82 116.67 121.65 2kym s ASP 59 Ca -0.08 2.45 -0.04 0.00 -0.52 0.00 0.00 52.55 54.36 2kym s ASP 59 Cb -0.11 -2.61 0.08 0.00 -1.46 0.00 0.00 42.92 38.82 2kym s ASP 59 CO 0.00 -1.03 1.49 0.25 0.52 0.00 0.00 175.17 176.40 2kym h LEU 60 N 2.04 0.66 0.00 -1.34 6.46 -1.89 0.18 115.31 121.41 2kym h LEU 60 Ca -0.50 -0.36 -0.11 0.00 -0.12 0.00 0.00 57.88 56.80 2kym h LEU 60 Cb 1.26 -0.19 -0.02 0.00 -0.73 0.00 0.00 40.66 40.98 2kym h LEU 60 CO 0.60 1.08 -0.73 0.24 -0.62 0.00 0.00 178.44 179.01 2kym h MET 61 N 0.45 0.00 -1.39 1.25 2.86 -1.98 -3.40 114.93 112.72 2kym h MET 61 Ca 0.01 0.00 -0.41 0.00 -2.06 0.00 0.00 59.70 57.24 2kym h MET 61 Cb 1.11 0.00 -0.28 0.00 0.06 0.00 0.00 31.60 32.49 2kym h MET 61 CO 0.11 0.38 -0.81 -3.47 1.06 0.00 0.00 176.91 174.18 2kym n ASP 62 N -3.09 -1.44 0.00 1.22 -0.08 -1.18 -4.96 116.55 107.02 2kym n ASP 62 Ca -0.01 -2.82 0.07 0.00 -1.51 0.00 0.00 54.79 50.53 2kym n ASP 62 Cb 0.73 0.45 0.32 0.00 2.34 0.00 0.00 41.12 44.97 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 2.09 0.07 0.06 -0.67 -0.04 0.62 -2.09 135.00 135.04 2kym n PRO 63 Ca 0.19 0.22 0.11 0.00 -0.04 0.00 0.00 63.50 63.99 2kym n PRO 63 Cb 0.55 -1.50 -0.01 0.00 -0.04 0.00 0.00 33.50 32.50 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 2.79 -0.04 0.55 0.00 -1.26 -3.38 120.51 117.74 2kym n ALA 64 Ca 0.05 -0.32 -0.13 0.00 0.00 0.00 0.00 53.44 53.04 2kym n ALA 64 Cb 0.15 -1.02 -0.11 0.00 0.00 0.00 0.00 19.45 18.47 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 -0.01 -0.78 0.00 3.64 -1.80 -3.27 116.57 114.35 2kym h LYS 65 Ca 0.00 0.00 -0.13 0.00 -1.27 0.00 0.00 60.65 59.25 2kym h LYS 65 Cb 0.92 0.00 -0.08 0.00 -0.41 0.00 0.00 32.23 32.67 2kym h LYS 65 CO 0.00 0.70 0.16 0.66 -2.27 0.00 0.00 179.45 178.70 2kym n TYR 66 N -4.75 1.85 0.74 1.91 4.02 -1.24 -4.22 117.16 115.47 2kym n TYR 66 Ca -0.09 -0.87 0.05 0.00 -0.01 0.00 0.00 57.90 56.98 2kym n TYR 66 Cb 0.35 -0.54 0.16 0.00 -0.02 0.00 0.00 39.34 39.30 2kym n TYR 66 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2kym n ALA 67 N 0.08 2.57 -0.01 -0.72 0.00 -1.22 -3.70 120.51 117.51 2kym n ALA 67 Ca 0.29 -0.67 0.01 0.00 0.00 0.00 0.00 53.44 53.07 2kym n ALA 67 Cb 1.12 -0.99 -0.04 0.00 0.00 0.00 0.00 19.45 19.54 2kym n ALA 67 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 2kym n SER 68 N 0.50 3.72 -4.69 0.00 3.41 -1.26 -5.03 113.62 110.27 2kym n SER 68 Ca 0.12 0.00 -0.43 0.00 -0.26 0.00 0.00 58.87 58.31 2kym n SER 68 Cb 0.37 1.00 -0.01 0.00 -0.26 0.00 0.00 64.21 65.32 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 -1.90 2.04 -3.30 -3.33 3.14 -1.24 -4.93 118.33 108.81 2kym n VAL 69 Ca -0.04 -0.50 -0.46 0.00 -2.96 0.00 0.00 64.34 60.37 2kym n VAL 69 Cb 0.36 -1.51 -0.03 0.00 -1.06 0.00 0.00 33.84 31.60 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 -0.36 6.55 0.53 6.55 1.01 -1.26 -4.87 116.67 124.82 2kym s ASP 70 Ca 0.56 -2.33 0.32 0.00 0.71 0.00 0.00 52.55 51.81 2kym s ASP 70 Cb -0.58 -2.22 1.48 0.00 1.01 0.00 0.00 42.92 42.61 2kym s ASP 70 CO 0.62 -0.70 1.88 0.71 0.21 0.00 0.00 175.17 177.88 2kym h THR 71 N 5.22 0.54 -0.04 -1.27 1.35 -1.86 -0.74 112.91 116.12 2kym h THR 71 Ca -0.04 -0.00 0.02 0.00 -0.55 0.00 0.00 66.41 65.84 2kym h THR 71 Cb 1.06 0.53 -0.02 0.00 -1.73 0.00 0.00 68.15 67.99 2kym h THR 71 CO 0.87 0.00 -0.08 0.22 -0.25 0.00 0.00 175.52 176.28 2kym h TYR 72 N 0.01 -0.20 -2.33 4.73 3.20 -1.91 -3.40 116.97 117.08 2kym h TYR 72 Ca 0.44 0.01 -0.58 0.00 3.14 0.00 0.00 58.73 61.73 2kym h TYR 72 Cb 1.74 0.10 -0.01 0.00 1.54 0.00 0.00 36.73 40.09 2kym h TYR 72 CO -0.00 -0.13 1.38 0.34 -1.64 0.00 0.00 178.16 178.12 2kym s ASP 73 N -5.10 5.68 0.61 -2.11 2.15 -0.28 -4.82 116.67 112.79 2kym s ASP 73 Ca -0.14 1.61 0.30 0.00 0.43 0.00 0.00 52.55 54.76 2kym s ASP 73 Cb 0.08 -2.52 1.71 0.00 -0.30 0.00 0.00 42.92 41.89 2kym s ASP 73 CO 0.67 -1.83 2.08 0.08 -0.17 0.00 0.00 175.17 176.00 2kym h ARG 74 N 13.95 0.00 0.20 4.34 -0.00 -1.84 -1.88 114.38 129.14 2kym h ARG 74 Ca -0.37 0.00 -0.01 0.00 -0.00 0.00 0.00 59.98 59.60 2kym h ARG 74 Cb 1.20 0.00 0.00 0.00 -0.00 0.00 0.00 29.97 31.18 2kym h ARG 74 CO 0.99 0.00 -0.10 0.93 -0.00 0.00 0.00 179.97 181.80 2kym h GLU 75 N 0.00 -0.26 0.86 0.08 5.08 -1.92 -1.67 114.58 116.75 2kym h GLU 75 Ca 0.08 0.02 -0.04 0.00 -1.00 0.00 0.00 59.36 58.42 2kym h GLU 75 Cb 0.54 0.06 0.01 0.00 0.50 0.00 0.00 28.75 29.86 2kym h GLU 75 CO -0.00 0.07 -0.41 1.96 -1.00 0.00 0.00 179.01 179.63 2kym h GLN 76 N -0.61 -1.11 -0.88 2.33 4.20 -1.63 -1.62 115.11 115.80 2kym h GLN 76 Ca -0.03 0.08 0.23 0.00 0.06 0.00 0.00 58.65 58.99 2kym h GLN 76 Cb 0.45 0.25 -0.05 0.00 0.30 0.00 0.00 27.48 28.43 2kym h GLN 76 CO 0.04 -0.74 0.61 -0.24 -0.67 0.00 0.00 178.83 177.83 2kym h VAL 77 N -1.16 0.62 0.10 -0.54 3.04 -1.57 -0.98 116.25 115.77 2kym h VAL 77 Ca -0.12 -0.06 -0.01 0.00 -1.01 0.00 0.00 66.70 65.51 2kym h VAL 77 Cb 0.88 0.42 0.00 0.00 -2.01 0.00 0.00 31.29 30.58 2kym h VAL 77 CO 0.19 0.03 -0.05 0.24 -1.01 0.00 0.00 177.57 176.98 2kym h MET 78 N 0.18 -0.14 -0.46 4.17 2.86 -0.87 -1.43 114.93 119.24 2kym h MET 78 Ca 0.44 0.01 0.06 0.00 -2.06 0.00 0.00 59.70 58.15 2kym h MET 78 Cb 1.43 0.03 -0.05 0.00 0.06 0.00 0.00 31.60 33.07 2kym h MET 78 CO -0.09 0.25 0.15 0.87 1.06 0.00 0.00 176.91 179.15 2kym h LYS 79 N -0.55 0.30 0.36 1.72 1.57 -0.25 0.16 116.57 119.89 2kym h LYS 79 Ca -0.01 -0.02 -0.02 0.00 -1.87 0.00 0.00 60.65 58.73 2kym h LYS 79 Cb 0.44 -0.07 0.00 0.00 0.08 0.00 0.00 32.23 32.69 2kym h LYS 79 CO 0.02 0.20 -0.17 0.82 -0.57 0.00 0.00 179.45 179.75 2kym h ILE 80 N 0.31 0.65 -0.72 1.86 5.03 -1.35 0.20 117.51 123.49 2kym h ILE 80 Ca 0.22 -0.09 0.07 0.00 -0.12 0.00 0.00 64.86 64.94 2kym h ILE 80 Cb 0.23 0.70 -0.04 0.00 -3.03 0.00 0.00 36.82 34.68 2kym h ILE 80 CO -0.24 0.02 0.47 0.40 -0.68 0.00 0.00 178.15 178.12 2kym h ILE 81 N -0.53 1.00 0.09 -0.67 2.04 -0.96 0.16 117.51 118.63 2kym h ILE 81 Ca -0.05 -0.25 -0.00 0.00 1.00 0.00 0.00 64.86 65.56 2kym h ILE 81 Cb 0.40 0.22 0.00 0.00 -0.74 0.00 0.00 36.82 36.71 2kym h ILE 81 CO 0.08 0.13 -0.04 -0.78 0.00 0.00 0.00 178.15 177.54 2kym h ASP 82 N 0.72 -0.10 -0.10 1.72 3.58 -0.38 -0.71 116.42 121.15 2kym h ASP 82 Ca 0.31 -0.45 0.01 0.00 0.42 0.00 0.00 57.03 57.32 2kym h ASP 82 Cb 0.30 0.03 -0.01 0.00 1.72 0.00 0.00 39.33 41.36 2kym h ASP 82 CO -0.10 0.44 0.03 -0.33 -2.88 0.00 0.00 179.24 176.39 2kym h GLU 83 N -0.67 0.08 0.00 0.28 5.08 -0.26 -1.29 114.58 117.79 2kym h GLU 83 Ca -0.01 -0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.34 2kym h GLU 83 Cb 0.54 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.77 2kym h GLU 83 CO 0.02 0.05 0.00 0.74 -1.00 0.00 0.00 179.01 178.82 2kym h PHE 84 N 0.08 0.00 -5.42 4.33 -1.00 -0.78 -3.47 116.94 110.69 2kym h PHE 84 Ca 0.04 0.00 -0.31 0.00 2.81 0.00 0.00 57.97 60.51 2kym h PHE 84 Cb 0.03 0.00 0.16 0.00 3.61 0.00 0.00 35.95 39.74 2kym h PHE 84 CO -0.10 0.00 -0.72 1.63 -1.61 0.00 0.00 178.31 177.51 2kym n LYS 85 N -2.43 -6.26 -2.64 1.51 4.76 -0.49 -3.87 118.16 108.73 2kym n LYS 85 Ca 0.01 0.79 -0.42 0.00 -2.87 0.00 0.00 58.31 55.82 2kym n LYS 85 Cb 0.20 -5.65 -0.03 0.00 -1.84 0.00 0.00 35.03 27.72 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 -3.33 4.68 0.99 -0.18 1.01 -0.38 -4.49 121.20 119.49 2kym s ILE 86 Ca 0.03 1.96 -0.12 0.00 0.00 0.00 0.00 60.65 62.51 2kym s ILE 86 Cb -0.01 -4.26 0.18 0.00 0.01 0.00 0.00 42.46 38.38 2kym s ILE 86 CO 0.68 -0.00 1.09 -2.16 0.00 0.00 0.00 174.94 174.55 2kym s PRO 87 N 2.10 0.53 0.60 2.79 0.04 -1.26 -4.76 135.00 135.04 2kym s PRO 87 Ca 0.50 0.57 -0.04 0.00 0.04 0.00 0.00 61.00 62.06 2kym s PRO 87 Cb -0.19 -1.74 0.03 0.00 0.04 0.00 0.00 34.50 32.63 2kym s PRO 87 CO 0.18 -2.67 0.89 0.95 0.04 0.00 0.00 177.00 176.39 2kym s THR 88 N -2.95 3.14 0.11 1.26 -4.23 -1.26 -2.33 115.64 109.38 2kym s THR 88 Ca 0.65 -0.23 -0.33 0.00 -1.18 0.00 0.00 61.69 60.60 2kym s THR 88 Cb -0.19 -3.26 -0.12 0.00 1.34 0.00 0.00 72.50 70.28 2kym s THR 88 CO 0.58 -0.25 1.57 0.58 -0.54 0.00 0.00 174.62 176.56 2kym h VAL 89 N -0.20 0.06 -0.55 2.29 2.07 -1.53 -0.52 116.25 117.86 2kym h VAL 89 Ca -0.45 0.00 0.11 0.00 0.82 0.00 0.00 66.70 67.18 2kym h VAL 89 Cb 1.28 0.06 -0.09 0.00 -1.52 0.00 0.00 31.29 31.02 2kym h VAL 89 CO 0.59 0.00 0.03 -0.33 0.02 0.00 0.00 177.57 177.88 2kym h GLU 90 N -0.67 0.15 -0.56 1.57 5.08 -1.95 0.12 114.58 118.32 2kym h GLU 90 Ca 0.02 -0.01 0.09 0.00 -1.00 0.00 0.00 59.36 58.46 2kym h GLU 90 Cb 0.71 -0.03 -0.03 0.00 0.50 0.00 0.00 28.75 29.90 2kym h GLU 90 CO -0.31 0.10 0.38 1.96 -1.00 0.00 0.00 179.01 180.13 2kym h GLN 91 N 0.15 0.39 -0.52 2.33 7.50 -1.77 -1.04 115.11 122.15 2kym h GLN 91 Ca 0.28 -0.02 -0.10 0.00 0.50 0.00 0.00 58.65 59.31 2kym h GLN 91 Cb 0.43 -0.09 -0.02 0.00 0.05 0.00 0.00 27.48 27.86 2kym h GLN 91 CO -0.44 0.26 -0.06 2.35 -1.50 0.00 0.00 178.83 179.45 2kym h TRP 92 N 0.40 1.06 -0.04 2.96 7.01 0.83 -0.41 115.95 127.76 2kym h TRP 92 Ca 0.25 -0.20 -0.01 0.00 2.11 0.00 0.00 58.89 61.04 2kym h TRP 92 Cb 0.48 -0.27 -0.00 0.00 -2.10 0.00 0.00 29.16 27.27 2kym h TRP 92 CO -0.00 0.99 -0.01 0.87 -2.79 0.00 0.00 178.44 177.50 2kym h LYS 93 N 0.83 0.07 -0.88 2.65 1.57 -0.69 -1.09 116.57 119.02 2kym h LYS 93 Ca 0.14 -0.03 -0.02 0.00 -1.87 0.00 0.00 60.65 58.88 2kym h LYS 93 Cb 0.60 -0.00 -0.04 0.00 0.08 0.00 0.00 32.23 32.87 2kym h LYS 93 CO 0.04 0.42 0.48 0.22 -0.57 0.00 0.00 179.45 180.04 2kym h ASP 94 N -0.28 1.10 -0.08 0.86 3.58 -1.27 -0.36 116.42 119.97 2kym h ASP 94 Ca 0.01 -0.10 -0.01 0.00 0.42 0.00 0.00 57.03 57.35 2kym h ASP 94 Cb 0.39 -0.28 -0.00 0.00 1.72 0.00 0.00 39.33 41.16 2kym h ASP 94 CO 0.00 0.88 0.01 1.56 -2.88 0.00 0.00 179.24 178.82 2kym h GLN 95 N 1.23 0.13 -0.31 0.28 1.08 -1.02 -1.34 115.11 115.17 2kym h GLN 95 Ca 0.31 -0.04 -0.04 0.00 -1.45 0.00 0.00 58.65 57.44 2kym h GLN 95 Cb 0.03 -0.01 -0.02 0.00 -0.05 0.00 0.00 27.48 27.43 2kym h GLN 95 CO -0.05 0.35 0.02 1.79 -0.95 0.00 0.00 178.83 180.00 2kym h THR 96 N -0.11 1.17 0.50 -0.54 1.35 -0.99 0.70 112.91 114.98 2kym h THR 96 Ca 0.02 -0.65 -0.02 0.00 -0.55 0.00 0.00 66.41 65.21 2kym h THR 96 Cb 0.29 0.92 0.00 0.00 -1.73 0.00 0.00 68.15 67.63 2kym h THR 96 CO 0.00 0.23 -0.24 0.03 -0.25 0.00 0.00 175.52 175.29 2kym h ARG 97 N 0.44 -0.65 0.00 4.72 3.08 -0.90 0.23 114.38 121.31 2kym h ARG 97 Ca 0.10 0.04 -0.02 0.00 0.07 0.00 0.00 59.98 60.18 2kym h ARG 97 Cb 0.26 0.15 -0.00 0.00 0.08 0.00 0.00 29.97 30.45 2kym h ARG 97 CO 0.00 -0.36 -0.08 0.07 -1.07 0.00 0.00 179.97 178.53 2kym h ARG 98 N -1.08 0.00 0.00 0.04 -0.00 -1.20 -0.42 114.38 111.73 2kym h ARG 98 Ca -0.07 0.00 -0.24 0.00 -0.00 0.00 0.00 59.98 59.67 2kym h ARG 98 Cb 0.58 0.00 -0.04 0.00 -0.00 0.00 0.00 29.97 30.52 2kym h ARG 98 CO 0.11 0.08 -1.24 -0.92 -0.00 0.00 0.00 179.97 178.01 2kym h TYR 99 N 0.00 0.01 0.00 4.08 3.20 -0.81 -3.27 116.97 120.18 2kym h TYR 99 Ca -0.00 -0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.86 2kym h TYR 99 Cb 0.22 -0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.49 2kym h TYR 99 CO 0.00 1.01 -0.31 0.87 -1.64 0.00 0.00 178.16 178.09 2kym h LYS 100 N 0.00 0.00 -6.67 1.82 1.57 0.27 -3.47 116.57 110.09 2kym h LYS 100 Ca -0.10 0.00 -0.49 0.00 -1.87 0.00 0.00 60.65 58.19 2kym h LYS 100 Cb 1.85 0.00 0.23 0.00 0.08 0.00 0.00 32.23 34.39 2kym h LYS 100 CO 0.12 0.00 -1.00 -0.85 -0.57 0.00 0.00 179.45 177.15 2kym n GLU 101 N -2.53 -1.03 -2.40 3.15 0.28 -0.24 -4.80 120.64 113.06 2kym n GLU 101 Ca 0.04 -0.28 -0.37 0.00 -0.16 0.00 0.00 57.16 56.39 2kym n GLU 101 Cb 0.48 -1.70 -0.03 0.00 1.43 0.00 0.00 31.44 31.61 2kym n GLU 101 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 177.13 175.43 2kym s SER 102 N -1.84 6.05 0.07 -1.84 1.04 -1.26 -4.89 113.70 111.02 2kym s SER 102 Ca 0.55 -1.01 -0.00 0.00 0.48 0.00 0.00 55.95 55.97 2kym s SER 102 Cb -0.14 -2.56 0.00 0.00 0.10 0.00 0.00 66.02 63.42 2kym s SER 102 CO 0.67 -1.91 0.09 -1.20 0.98 0.00 0.00 173.24 171.88 2kym n SER 103 N 10.42 -0.26 -4.76 7.02 7.64 -1.26 -5.14 113.62 127.28 2kym n SER 103 Ca 0.30 -1.35 -0.41 0.00 1.01 0.00 0.00 58.87 58.41 2kym n SER 103 Cb 0.50 0.49 -0.02 0.00 -1.01 0.00 0.00 64.21 64.17 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 -2.52 2.50 -0.06 0.44 -1.09 -1.26 -4.98 121.20 114.22 2kym s ILE 104 Ca 0.05 0.47 -0.31 0.00 -2.23 0.00 0.00 60.65 58.63 2kym s ILE 104 Cb -0.00 -3.30 0.13 0.00 -1.58 0.00 0.00 42.46 37.71 2kym s ILE 104 CO 0.04 0.10 1.37 0.00 -1.23 0.00 0.00 174.94 175.22 2kym s GLN 105 N -1.37 0.18 0.27 2.79 -2.07 -1.26 -5.15 119.66 113.05 2kym s GLN 105 Ca 0.54 -0.10 0.00 0.00 -1.82 0.00 0.00 55.36 53.98 2kym s GLN 105 Cb -0.42 0.06 -0.03 0.00 -1.09 0.00 0.00 33.01 31.53 2kym s GLN 105 CO 0.52 -0.08 0.27 0.96 -1.32 0.00 0.00 175.29 175.64 2kym s ILE 106 N -2.15 0.00 0.00 3.63 -0.00 -1.26 -5.08 121.20 116.34 2kym s ILE 106 Ca 0.18 -1.88 0.00 0.00 -0.00 0.00 0.00 60.65 58.95 2kym s ILE 106 Cb 0.05 -2.49 0.00 0.00 -0.00 0.00 0.00 42.46 40.02 2kym s ILE 106 CO -0.05 0.00 0.00 0.61 -0.00 0.00 0.00 174.94 175.50 2kym n GLY 107 N -0.44 0.64 3.68 6.27 0.00 -1.26 -5.06 105.19 109.02 2kym n GLY 107 Ca 0.03 -0.65 -0.42 0.00 0.00 0.00 0.00 46.02 44.97 2kym n GLY 107 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2kym s ASN 108 N 0.00 6.93 0.00 1.61 0.02 -1.26 -4.91 114.94 117.33 2kym s ASN 108 Ca 0.00 1.91 0.00 0.00 -1.02 0.00 0.00 52.86 53.75 2kym s ASN 108 Cb 0.00 -2.55 0.00 0.00 0.02 0.00 0.00 41.25 38.72 2kym s ASN 108 CO 0.00 -0.69 0.00 0.61 0.02 0.00 0.00 177.10 177.04 2kym n GLY 109 N 3.57 -0.37 3.40 0.66 0.00 -1.26 -5.18 105.19 106.00 2kym n GLY 109 Ca 0.13 0.73 -0.20 0.00 0.00 0.00 0.00 46.02 46.67 2kym n GLY 109 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 2kym s HIS 110 N 0.00 1.87 0.21 1.61 2.46 -1.26 -5.16 115.29 115.03 2kym s HIS 110 Ca 0.00 -0.63 -0.21 0.00 0.47 0.00 0.00 55.06 54.69 2kym s HIS 110 Cb 0.00 -0.97 0.07 0.00 -0.13 0.00 0.00 32.58 31.55 2kym s HIS 110 CO 0.00 0.34 1.00 0.20 -2.47 0.00 0.00 174.74 173.81 2kym s GLY 111 N -3.39 0.15 0.19 1.59 0.00 -1.26 -5.19 107.32 99.41 2kym s GLY 111 Ca 0.27 -0.40 -0.13 0.00 0.00 0.00 0.00 44.72 44.45 2kym s GLY 111 CO 0.10 2.10 0.42 -0.86 0.00 0.00 0.00 173.10 174.86 2kym s GLN 112 N -2.18 1.32 -0.13 2.90 -2.07 -1.26 -5.18 119.66 113.07 2kym s GLN 112 Ca 0.21 -1.07 -0.21 0.00 -1.82 0.00 0.00 55.36 52.47 2kym s GLN 112 Cb -0.03 0.45 0.05 0.00 -1.09 0.00 0.00 33.01 32.39 2kym s GLN 112 CO 0.06 -0.53 0.53 -1.54 -1.32 0.00 0.00 175.29 172.49 2kym s SER 113 N -2.94 -0.51 0.29 12.60 1.04 -1.26 -5.15 113.70 117.77 2kym s SER 113 Ca 0.15 0.81 -0.29 0.00 0.48 0.00 0.00 55.95 57.10 2kym s SER 113 Cb 0.01 0.82 -0.10 0.00 0.10 0.00 0.00 66.02 66.85 2kym s SER 113 CO 0.01 -0.33 1.28 -1.10 0.98 0.00 0.00 173.24 174.07 2kym s GLN 114 N -0.37 4.41 -0.42 4.02 1.11 -1.26 -5.01 119.66 122.14 2kym s GLN 114 Ca -0.05 2.12 0.02 0.00 0.01 0.00 0.00 55.36 57.45 2kym s GLN 114 Cb -0.03 -3.12 0.13 0.00 -1.01 0.00 0.00 33.01 28.98 2kym s GLN 114 CO 0.04 -0.14 0.22 0.20 0.01 0.00 0.00 175.29 175.61 2kym s GLY 115 N -0.35 1.62 0.00 3.09 0.00 -1.26 -4.88 107.32 105.54 2kym s GLY 115 Ca 0.50 -2.49 0.00 0.00 0.00 0.00 0.00 44.72 42.73 2kym s GLY 115 CO 0.47 1.53 0.00 1.47 0.00 0.00 0.00 173.10 176.57 2kym n LEU 116 N 3.72 1.67 0.00 0.66 -0.00 -1.26 -5.38 117.00 116.41 2kym n LEU 116 Ca 0.07 0.00 0.12 0.00 -0.00 0.00 0.00 56.01 56.21 2kym n LEU 116 Cb 0.35 0.00 0.74 0.00 -0.00 0.00 0.00 43.42 44.52 2kym n LEU 116 CO 0.23 0.28 0.92 -0.62 -0.00 0.00 0.00 177.39 178.20