#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kym s ALA -1 N 0.00 -1.25 -0.97 -5.12 0.00 -1.26 -5.07 121.76 108.09 2kym s ALA -1 Ca 0.00 0.22 -0.23 0.00 0.00 0.00 0.00 51.96 51.95 2kym s ALA -1 Cb 0.00 0.78 -0.13 0.00 0.00 0.00 0.00 23.12 23.77 2kym s ALA -1 CO 0.00 -0.70 1.92 -0.35 0.00 0.00 0.00 175.76 176.63 2kym n PRO 1 N -0.28 1.51 -2.47 0.00 -0.04 -1.26 -4.93 135.00 127.53 2kym n PRO 1 Ca -0.17 -2.16 -0.40 0.00 -0.04 0.00 0.00 63.50 60.74 2kym n PRO 1 Cb 0.64 -3.34 -0.04 0.00 -0.04 0.00 0.00 33.50 30.72 2kym n PRO 1 CO 0.00 0.00 0.00 -0.48 -0.04 0.00 0.00 175.50 174.98 2kym s LEU 2 N 6.42 4.53 -0.04 1.53 0.05 -1.26 -4.94 118.68 124.97 2kym s LEU 2 Ca 0.64 2.27 0.06 0.00 0.05 0.00 0.00 54.13 57.14 2kym s LEU 2 Cb 0.06 -3.66 -0.02 0.00 -2.05 0.00 0.00 46.19 40.52 2kym s LEU 2 CO 0.14 -0.17 -0.21 -0.36 -0.55 0.00 0.00 176.35 175.20 2kym s PHE 3 N -1.19 2.51 0.42 3.48 0.08 -1.25 -1.90 117.98 120.12 2kym s PHE 3 Ca 0.45 -0.34 0.07 0.00 0.12 0.00 0.00 56.93 57.23 2kym s PHE 3 Cb -0.32 -1.57 -0.03 0.00 -0.57 0.00 0.00 43.02 40.53 2kym s PHE 3 CO 0.41 0.04 0.30 0.00 -0.10 0.00 0.00 175.22 175.87 2kym s ALA 4 N -0.61 3.88 -0.08 5.36 0.00 0.90 -3.24 121.76 127.98 2kym s ALA 4 Ca 0.09 -1.97 0.01 0.00 0.00 0.00 0.00 51.96 50.09 2kym s ALA 4 Cb -0.11 -0.76 0.02 0.00 0.00 0.00 0.00 23.12 22.28 2kym s ALA 4 CO 0.00 -0.21 -0.08 0.54 0.00 0.00 0.00 175.76 176.02 2kym s VAL 5 N -2.53 0.89 0.20 0.00 0.11 -0.36 -0.38 120.40 118.33 2kym s VAL 5 Ca 0.45 -0.28 -0.30 0.00 -2.93 0.00 0.00 61.98 58.92 2kym s VAL 5 Cb -0.00 -0.88 -0.08 0.00 -1.53 0.00 0.00 36.38 33.88 2kym s VAL 5 CO 0.26 0.32 1.22 0.42 -3.33 0.00 0.00 175.10 173.99 2kym s THR 6 N 1.17 3.44 -0.28 5.04 -4.23 -1.07 -0.70 115.64 119.01 2kym s THR 6 Ca -0.06 1.23 0.16 0.00 -1.18 0.00 0.00 61.69 61.84 2kym s THR 6 Cb -0.14 -3.78 -0.22 0.00 1.34 0.00 0.00 72.50 69.70 2kym s THR 6 CO -0.02 0.20 0.46 0.18 -0.54 0.00 0.00 174.62 174.91 2kym n LEU 7 N 2.37 0.26 -4.10 4.79 4.77 -1.23 -0.05 117.00 123.81 2kym n LEU 7 Ca 0.04 -0.18 -0.09 0.00 -0.03 0.00 0.00 56.01 55.75 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 0.56 0.07 -0.37 -0.31 -1.33 0.00 0.00 177.39 176.01 2kym s TYR 8 N -2.86 0.62 -0.59 -1.77 1.51 -1.26 -4.65 117.35 108.35 2kym s TYR 8 Ca -0.02 -0.93 -0.25 0.00 -1.01 0.00 0.00 57.07 54.86 2kym s TYR 8 Cb 0.11 -0.41 0.04 0.00 -0.11 0.00 0.00 41.96 41.59 2kym s TYR 8 CO 0.65 -0.27 1.04 -2.00 -1.11 0.00 0.00 175.55 173.86 2kym s GLU 9 N -3.48 3.34 -0.24 -0.62 2.12 -1.26 -3.86 118.70 114.70 2kym s GLU 9 Ca 0.05 -0.19 -0.13 0.00 0.36 0.00 0.00 54.97 55.06 2kym s GLU 9 Cb 0.04 -4.07 -0.04 0.00 0.26 0.00 0.00 34.13 30.31 2kym s GLU 9 CO -0.07 -1.63 0.29 0.12 -0.54 0.00 0.00 175.26 173.43 2kym s PHE 10 N 4.39 3.31 -0.27 5.30 5.36 -0.67 -4.97 117.98 130.44 2kym s PHE 10 Ca 0.33 0.38 -0.12 0.00 -0.96 0.00 0.00 56.93 56.56 2kym s PHE 10 Cb -0.11 -2.44 -0.05 0.00 -0.34 0.00 0.00 43.02 40.09 2kym s PHE 10 CO 0.19 -0.05 0.24 0.15 -1.46 0.00 0.00 175.22 174.29 2kym s LYS 11 N 1.46 4.00 1.00 10.12 3.01 -1.26 -1.71 119.74 136.36 2kym s LYS 11 Ca 0.13 -0.20 -0.11 0.00 -1.01 0.00 0.00 55.97 54.77 2kym s LYS 11 Cb -0.15 -3.63 0.19 0.00 -1.01 0.00 0.00 37.83 33.23 2kym s LYS 11 CO 0.08 -0.15 1.09 0.00 0.51 0.00 0.00 175.35 176.87 2kym s ALA 12 N 1.69 0.76 -0.03 5.17 0.00 -1.26 -4.98 121.76 123.11 2kym s ALA 12 Ca 0.10 0.13 0.03 0.00 0.00 0.00 0.00 51.96 52.22 2kym s ALA 12 Cb -0.15 -3.30 -0.05 0.00 0.00 0.00 0.00 23.12 19.62 2kym s ALA 12 CO 0.09 -3.05 0.02 -0.85 0.00 0.00 0.00 175.76 171.97 2kym n GLU 13 N -4.39 3.24 -3.48 0.00 0.28 -1.26 -5.01 120.64 110.03 2kym n GLU 13 Ca 0.07 -0.00 -0.14 0.00 -0.16 0.00 0.00 57.16 56.93 2kym n GLU 13 Cb 0.54 -1.09 -0.05 0.00 1.43 0.00 0.00 31.44 32.27 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 -2.11 0.45 -0.19 3.44 5.12 -1.26 -5.05 116.66 117.07 2kym n ARG 14 Ca -0.06 -2.17 -0.08 0.00 -1.93 0.00 0.00 57.85 53.61 2kym n ARG 14 Cb 0.59 1.51 0.02 0.00 -1.16 0.00 0.00 32.46 33.42 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 1.19 0.75 -0.00 0.55 2.03 -2.03 -3.09 116.42 115.81 2kym h ASP 15 Ca -0.17 -0.18 0.03 0.00 -0.73 0.00 0.00 57.03 55.97 2kym h ASP 15 Cb 0.77 -0.20 -0.04 0.00 -0.83 0.00 0.00 39.33 39.04 2kym h ASP 15 CO 0.26 0.73 -0.20 -2.24 -1.03 0.00 0.00 179.24 176.76 2kym h ASP 16 N 0.73 -0.60 -4.08 4.15 2.03 -1.97 -3.42 116.42 113.26 2kym h ASP 16 Ca 0.18 0.09 -0.52 0.00 -0.73 0.00 0.00 57.03 56.05 2kym h ASP 16 Cb 0.23 0.25 0.09 0.00 -0.83 0.00 0.00 39.33 39.07 2kym h ASP 16 CO -0.01 -0.27 0.46 -0.70 -1.03 0.00 0.00 179.24 177.69 2kym s GLU 17 N -6.10 3.23 0.18 4.15 2.56 -1.17 -4.17 118.70 117.39 2kym s GLU 17 Ca -0.15 1.75 0.11 0.00 0.00 0.00 0.00 54.97 56.68 2kym s GLU 17 Cb 0.09 -2.03 -0.04 0.00 2.00 0.00 0.00 34.13 34.15 2kym s GLU 17 CO 0.66 -0.98 -0.23 -1.17 -0.56 0.00 0.00 175.26 172.99 2kym s LEU 18 N -3.81 2.43 0.13 2.70 2.96 -1.26 -4.66 118.68 117.17 2kym s LEU 18 Ca 0.74 -0.86 -0.07 0.00 -0.22 0.00 0.00 54.13 53.72 2kym s LEU 18 Cb -0.28 -1.09 -0.06 0.00 0.50 0.00 0.00 46.19 45.26 2kym s LEU 18 CO 0.31 0.09 0.41 -0.62 -1.32 0.00 0.00 176.35 175.22 2kym s ASP 19 N -2.63 6.57 0.07 3.68 -1.08 -1.26 -4.14 116.67 117.87 2kym s ASP 19 Ca 0.19 0.71 -0.06 0.00 -0.52 0.00 0.00 52.55 52.87 2kym s ASP 19 Cb -0.08 -2.14 -0.01 0.00 -1.46 0.00 0.00 42.92 39.23 2kym s ASP 19 CO 0.09 0.08 0.11 0.68 0.52 0.00 0.00 175.17 176.65 2kym s VAL 20 N -1.58 0.16 0.19 1.11 -7.23 -0.69 -4.99 120.40 107.37 2kym s VAL 20 Ca 0.39 -1.36 0.09 0.00 -1.81 0.00 0.00 61.98 59.29 2kym s VAL 20 Cb -0.13 -1.33 -0.04 0.00 0.56 0.00 0.00 36.38 35.44 2kym s VAL 20 CO 0.22 -0.75 -0.18 -0.94 -0.31 0.00 0.00 175.10 173.14 2kym s SER 21 N -2.77 2.81 -0.15 4.85 1.04 -1.26 -1.66 113.70 116.56 2kym s SER 21 Ca 0.04 -0.92 -0.29 0.00 0.48 0.00 0.00 55.95 55.25 2kym s SER 21 Cb 0.05 -0.18 -0.03 0.00 0.10 0.00 0.00 66.02 65.96 2kym s SER 21 CO -0.10 -0.05 1.56 -2.16 0.98 0.00 0.00 173.24 173.48 2kym s PRO 22 N -3.10 4.01 0.00 4.02 0.04 -1.25 -2.68 135.00 136.04 2kym s PRO 22 Ca 0.20 1.85 0.00 0.00 0.04 0.00 0.00 61.00 63.09 2kym s PRO 22 Cb -0.04 -3.97 0.00 0.00 0.04 0.00 0.00 34.50 30.53 2kym s PRO 22 CO 0.08 -1.02 0.00 0.41 0.04 0.00 0.00 177.00 176.50 2kym n GLY 23 N 4.28 0.96 3.89 0.56 0.00 0.92 -4.95 105.19 110.84 2kym n GLY 23 Ca 0.17 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.89 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 -0.60 3.72 -0.36 1.61 0.41 -1.09 -4.92 118.70 117.46 2kym s GLU 24 Ca 0.00 0.14 -0.13 0.00 -0.41 0.00 0.00 54.97 54.57 2kym s GLU 24 Cb 0.00 -2.67 -0.00 0.00 -1.78 0.00 0.00 34.13 29.68 2kym s GLU 24 CO 0.00 0.29 0.25 -0.80 -0.49 0.00 0.00 175.26 174.51 2kym s ASN 25 N -2.66 6.01 0.39 -0.19 -0.87 -1.26 -2.59 114.94 113.76 2kym s ASN 25 Ca 0.45 -0.62 0.08 0.00 -1.57 0.00 0.00 52.86 51.20 2kym s ASN 25 Cb -0.11 -2.13 -0.04 0.00 -0.02 0.00 0.00 41.25 38.95 2kym s ASN 25 CO 0.25 -0.31 0.19 -0.76 -2.57 0.00 0.00 177.10 173.90 2kym s LEU 26 N 1.69 3.19 -0.20 0.60 1.02 0.48 -2.38 118.68 123.09 2kym s LEU 26 Ca 0.05 -0.93 0.01 0.00 0.02 0.00 0.00 54.13 53.28 2kym s LEU 26 Cb -0.18 -1.61 0.04 0.00 0.02 0.00 0.00 46.19 44.46 2kym s LEU 26 CO 0.10 -0.47 -0.15 -0.55 0.02 0.00 0.00 176.35 175.30 2kym s SER 27 N -3.91 3.48 0.50 2.29 0.15 0.36 -0.07 113.70 116.50 2kym s SER 27 Ca 0.41 -0.88 -0.22 0.00 0.70 0.00 0.00 55.95 55.96 2kym s SER 27 Cb 0.01 -1.41 -0.06 0.00 -1.71 0.00 0.00 66.02 62.85 2kym s SER 27 CO 0.23 -0.09 1.18 -0.63 1.20 0.00 0.00 173.24 175.13 2kym s ILE 28 N 1.29 2.99 0.00 6.45 -1.09 -0.80 -1.27 121.20 128.77 2kym s ILE 28 Ca -0.00 0.70 0.00 0.00 -2.23 0.00 0.00 60.65 59.12 2kym s ILE 28 Cb -0.16 -3.33 0.00 0.00 -1.58 0.00 0.00 42.46 37.39 2kym s ILE 28 CO -0.10 -0.05 0.00 0.00 -1.23 0.00 0.00 174.94 173.56 2kym s ALA 30 N -1.73 -1.87 0.41 0.00 0.00 -1.25 -4.51 121.76 112.80 2kym s ALA 30 Ca 0.00 0.23 0.03 0.00 0.00 0.00 0.00 51.96 52.23 2kym s ALA 30 Cb 0.00 0.58 -0.04 0.00 0.00 0.00 0.00 23.12 23.66 2kym s ALA 30 CO 0.00 -1.06 0.07 -3.38 0.00 0.00 0.00 175.76 171.40 2kym s HIS 31 N -2.78 1.91 -0.27 0.00 -3.43 -0.48 -0.85 115.29 109.39 2kym s HIS 31 Ca 0.15 -1.08 -0.01 0.00 -0.80 0.00 0.00 55.06 53.32 2kym s HIS 31 Cb 0.01 -1.34 0.13 0.00 -1.43 0.00 0.00 32.58 29.94 2kym s HIS 31 CO 0.01 -0.04 0.29 -0.47 -2.00 0.00 0.00 174.74 172.52 2kym s TYR 32 N -3.12 -0.45 -1.74 0.38 5.04 0.18 -0.79 117.35 116.86 2kym s TYR 32 Ca 0.24 -0.06 0.00 0.00 -2.44 0.00 0.00 57.07 54.81 2kym s TYR 32 Cb 0.04 -0.42 0.00 0.00 0.35 0.00 0.00 41.96 41.93 2kym s TYR 32 CO 0.12 -0.86 0.00 -0.25 -1.34 0.00 0.00 175.55 173.22 2kym n ASP 33 N 5.31 -5.50 -1.41 4.32 8.00 -1.26 -1.34 116.55 124.67 2kym n ASP 33 Ca -0.03 0.41 -0.18 0.00 0.71 0.00 0.00 54.79 55.69 2kym n ASP 33 Cb 0.47 -4.44 -0.08 0.00 -0.02 0.00 0.00 41.12 37.05 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 -2.35 0.00 0.05 1.24 4.02 -1.26 -4.78 117.16 114.07 2kym n TYR 34 Ca -0.16 0.00 0.01 0.00 -0.01 0.00 0.00 57.90 57.73 2kym n TYR 34 Cb 0.63 -3.16 0.00 0.00 -0.02 0.00 0.00 39.34 36.79 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 -2.40 2.34 -3.73 -0.72 0.28 -0.45 -4.89 120.64 111.07 2kym n GLU 35 Ca -0.18 -0.33 -0.12 0.00 -0.16 0.00 0.00 57.16 56.37 2kym n GLU 35 Cb 0.61 -0.82 -0.11 0.00 1.43 0.00 0.00 31.44 32.55 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 -0.52 -0.45 0.05 -1.84 0.52 -1.10 -4.10 118.94 111.51 2kym s TRP 36 Ca 0.01 1.04 0.09 0.00 0.02 0.00 0.00 56.10 57.25 2kym s TRP 36 Cb 0.01 0.16 -0.03 0.00 -1.15 0.00 0.00 33.47 32.46 2kym s TRP 36 CO 0.03 -0.24 -0.24 -0.06 0.02 0.00 0.00 176.95 176.45 2kym s PHE 37 N 0.69 2.11 -0.64 -1.98 0.08 0.97 -0.65 117.98 118.56 2kym s PHE 37 Ca -0.04 -0.40 -0.12 0.00 0.12 0.00 0.00 56.93 56.50 2kym s PHE 37 Cb -0.05 -1.26 0.17 0.00 -0.57 0.00 0.00 43.02 41.31 2kym s PHE 37 CO -0.05 0.12 0.55 0.42 -0.10 0.00 0.00 175.22 176.17 2kym s ILE 38 N -0.82 4.90 -0.07 0.64 -1.09 -0.03 -1.13 121.20 123.60 2kym s ILE 38 Ca 0.10 -2.15 0.00 0.00 -2.23 0.00 0.00 60.65 56.37 2kym s ILE 38 Cb -0.10 -4.12 -0.03 0.00 -1.58 0.00 0.00 42.46 36.64 2kym s ILE 38 CO 0.02 -0.91 -0.06 0.00 -1.23 0.00 0.00 174.94 172.76 2kym s ALA 39 N 0.76 3.00 0.23 9.38 0.00 -1.26 0.10 121.76 133.96 2kym s ALA 39 Ca 0.11 -0.88 0.10 0.00 0.00 0.00 0.00 51.96 51.29 2kym s ALA 39 Cb -0.20 -1.26 -0.04 0.00 0.00 0.00 0.00 23.12 21.62 2kym s ALA 39 CO -0.03 0.56 -0.09 -1.59 0.00 0.00 0.00 175.76 174.60 2kym s LYS 40 N -0.76 2.03 -0.39 0.00 -2.85 -0.39 -4.07 119.74 113.31 2kym s LYS 40 Ca 0.12 -1.42 -0.28 0.00 -1.00 0.00 0.00 55.97 53.38 2kym s LYS 40 Cb -0.11 -2.07 -0.01 0.00 -2.06 0.00 0.00 37.83 33.58 2kym s LYS 40 CO 0.02 0.39 1.72 -1.25 0.10 0.00 0.00 175.35 176.33 2kym s PRO 41 N -3.20 3.28 0.42 1.78 0.04 -1.26 -0.49 135.00 135.57 2kym s PRO 41 Ca 0.27 1.20 0.19 0.00 0.04 0.00 0.00 61.00 62.71 2kym s PRO 41 Cb -0.07 -4.19 0.91 0.00 0.04 0.00 0.00 34.50 31.19 2kym s PRO 41 CO 0.16 -1.93 1.86 0.82 0.04 0.00 0.00 177.00 177.95 2kym h ILE 42 N 6.74 0.90 0.00 0.56 2.04 -1.80 -3.32 117.51 122.65 2kym h ILE 42 Ca -0.31 -1.16 0.00 0.00 1.00 0.00 0.00 64.86 64.38 2kym h ILE 42 Cb 1.15 1.69 0.00 0.00 -0.74 0.00 0.00 36.82 38.92 2kym h ILE 42 CO 1.07 0.29 -0.33 0.78 0.00 0.00 0.00 178.15 179.97 2kym h ASN 43 N 0.00 0.00 -0.99 1.72 4.21 -1.89 -3.48 115.58 115.14 2kym h ASN 43 Ca -0.00 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.51 2kym h ASN 43 Cb 0.67 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.87 2kym h ASN 43 CO 0.04 0.62 0.00 0.54 -1.29 0.00 0.00 177.43 177.34 2kym n ARG 43 N -4.45 -1.81 -1.06 0.81 1.74 -1.25 -5.03 116.66 105.61 2kym n ARG 43 Ca -0.05 0.00 -0.13 0.00 -0.77 0.00 0.00 57.85 56.91 2kym n ARG 43 Cb 0.17 0.00 0.08 0.00 -1.02 0.00 0.00 32.46 31.69 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 0.00 0.00 -4.61 0.55 4.77 -1.26 -4.90 117.00 111.55 2kym n LEU 44 Ca 0.00 -0.76 -0.43 0.00 -0.03 0.00 0.00 56.01 54.80 2kym n LEU 44 Cb 0.00 -0.41 -0.03 0.00 -2.33 0.00 0.00 43.42 40.65 2kym n LEU 44 CO 0.00 -0.87 1.71 -0.83 -1.33 0.00 0.00 177.39 176.07 2kym s GLY 45 N -4.12 0.72 -0.44 -0.72 0.00 -1.26 -4.64 107.32 96.87 2kym s GLY 45 Ca 0.33 0.67 0.07 0.00 0.00 0.00 0.00 44.72 45.80 2kym s GLY 45 CO 0.23 3.57 0.82 0.61 0.00 0.00 0.00 173.10 178.33 2kym n GLY 46 N 5.48 1.37 3.69 0.20 0.00 -1.26 -5.09 105.19 109.57 2kym n GLY 46 Ca 0.26 -0.58 -0.42 0.00 0.00 0.00 0.00 46.02 45.28 2kym n GLY 46 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2kym s PRO 47 N -0.30 4.27 0.00 1.61 0.04 -1.26 -4.45 135.00 134.90 2kym s PRO 47 Ca 0.32 2.02 0.00 0.00 0.04 0.00 0.00 61.00 63.38 2kym s PRO 47 Cb 0.24 -3.59 0.00 0.00 0.04 0.00 0.00 34.50 31.19 2kym s PRO 47 CO -0.15 -0.61 0.00 0.41 0.04 0.00 0.00 177.00 176.69 2kym n GLY 48 N 3.71 4.80 2.96 0.56 0.00 -1.26 -4.83 105.19 111.13 2kym n GLY 48 Ca 0.14 -0.99 -0.14 0.00 0.00 0.00 0.00 46.02 45.03 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 0.34 -0.02 0.99 0.20 -1.26 -4.59 118.68 114.34 2kym s LEU 49 Ca 0.00 0.41 -0.00 0.00 0.69 0.00 0.00 54.13 55.23 2kym s LEU 49 Cb 0.00 0.51 0.02 0.00 -0.43 0.00 0.00 46.19 46.29 2kym s LEU 49 CO 0.00 -0.18 0.04 0.54 -0.29 0.00 0.00 176.35 176.46 2kym s VAL 50 N 1.57 -0.04 0.57 1.68 0.11 -0.28 -4.40 120.40 119.61 2kym s VAL 50 Ca -0.06 0.15 -0.19 0.00 -2.93 0.00 0.00 61.98 58.96 2kym s VAL 50 Cb -0.11 -0.09 -0.05 0.00 -1.53 0.00 0.00 36.38 34.60 2kym s VAL 50 CO -0.07 0.06 1.12 -2.16 -3.33 0.00 0.00 175.10 170.73 2kym s PRO 51 N 0.79 3.25 0.62 1.54 0.04 -1.26 -0.02 135.00 139.96 2kym s PRO 51 Ca -0.06 1.56 0.38 0.00 0.04 0.00 0.00 61.00 62.92 2kym s PRO 51 Cb -0.09 -1.99 2.06 0.00 0.04 0.00 0.00 34.50 34.51 2kym s PRO 51 CO -0.02 -0.93 2.26 0.28 0.04 0.00 0.00 177.00 178.63 2kym h VAL 52 N 0.96 0.18 0.00 -0.36 2.07 -1.88 0.09 116.25 117.31 2kym h VAL 52 Ca -0.49 -0.14 0.00 0.00 0.82 0.00 0.00 66.70 66.89 2kym h VAL 52 Cb 1.26 1.11 0.00 0.00 -1.52 0.00 0.00 31.29 32.14 2kym h VAL 52 CO 0.56 0.02 0.00 -0.24 0.02 0.00 0.00 177.57 177.93 2kym n SER 53 N -3.31 0.00 -0.06 0.57 2.88 -1.26 -2.78 113.62 109.66 2kym n SER 53 Ca -0.02 -0.31 0.05 0.00 -1.33 0.00 0.00 58.87 57.25 2kym n SER 53 Cb 0.13 -0.21 0.06 0.00 -0.75 0.00 0.00 64.21 63.44 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 -1.21 0.00 -3.71 0.66 4.02 0.01 -4.92 117.16 112.01 2kym n TYR 54 Ca 0.15 -0.67 -0.11 0.00 -0.01 0.00 0.00 57.90 57.26 2kym n TYR 54 Cb 0.18 -0.09 -0.06 0.00 -0.02 0.00 0.00 39.34 39.34 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 -1.74 0.08 -0.11 -0.72 -7.23 -1.12 -3.50 120.40 106.07 2kym s VAL 55 Ca 0.15 -0.64 0.01 0.00 -1.81 0.00 0.00 61.98 59.70 2kym s VAL 55 Cb 0.13 -1.02 0.02 0.00 0.56 0.00 0.00 36.38 36.06 2kym s VAL 55 CO 0.01 -0.35 -0.15 -0.60 -0.31 0.00 0.00 175.10 173.71 2kym s ARG 56 N -2.90 2.17 -0.44 4.82 3.52 0.12 -4.82 118.95 121.42 2kym s ARG 56 Ca -0.03 -0.54 -0.29 0.00 -0.13 0.00 0.00 55.73 54.75 2kym s ARG 56 Cb 0.00 -1.88 0.01 0.00 -1.56 0.00 0.00 34.95 31.52 2kym s ARG 56 CO -0.05 -0.09 1.44 0.42 -0.81 0.00 0.00 175.30 176.20 2kym s ILE 57 N 1.08 3.85 0.31 4.11 -1.09 -1.26 -1.22 121.20 126.98 2kym s ILE 57 Ca -0.05 0.84 0.05 0.00 -2.23 0.00 0.00 60.65 59.26 2kym s ILE 57 Cb -0.15 -4.21 -0.06 0.00 -1.58 0.00 0.00 42.46 36.46 2kym s ILE 57 CO -0.03 -0.81 0.01 0.27 -1.23 0.00 0.00 174.94 173.15 2kym s ILE 58 N 5.71 1.44 -0.24 2.92 -4.36 -1.20 -4.63 121.20 120.83 2kym s ILE 58 Ca 0.61 -2.04 -0.06 0.00 -0.26 0.00 0.00 60.65 58.89 2kym s ILE 58 Cb -0.14 -2.68 -0.02 0.00 1.25 0.00 0.00 42.46 40.88 2kym s ILE 58 CO 0.31 -0.12 0.04 -0.62 0.24 0.00 0.00 174.94 174.79 2kym s ASP 59 N -3.49 4.90 0.52 4.36 2.15 -1.25 -3.95 116.67 119.91 2kym s ASP 59 Ca 0.33 -0.29 0.30 0.00 0.43 0.00 0.00 52.55 53.33 2kym s ASP 59 Cb 0.07 -1.87 1.43 0.00 -0.30 0.00 0.00 42.92 42.25 2kym s ASP 59 CO 0.14 -0.04 1.87 0.17 -0.17 0.00 0.00 175.17 177.15 2kym h LEU 60 N 8.20 0.06 0.11 -1.34 -0.00 -1.92 0.39 115.31 120.82 2kym h LEU 60 Ca -0.39 0.01 -0.28 0.00 -0.00 0.00 0.00 57.88 57.22 2kym h LEU 60 Cb 1.17 -0.00 -0.00 0.00 -0.00 0.00 0.00 40.66 41.82 2kym h LEU 60 CO 0.59 0.02 -1.34 0.24 -0.00 0.00 0.00 178.44 177.95 2kym h MET 61 N 0.06 0.24 -2.15 0.17 2.86 -1.99 -3.41 114.93 110.72 2kym h MET 61 Ca 0.45 -0.41 -0.56 0.00 -2.06 0.00 0.00 59.70 57.12 2kym h MET 61 Cb 1.69 0.15 -0.37 0.00 0.06 0.00 0.00 31.60 33.13 2kym h MET 61 CO -0.04 1.15 -1.00 -3.47 1.06 0.00 0.00 176.91 174.61 2kym n ASP 62 N -3.48 -0.41 0.00 1.22 -0.08 0.91 -4.95 116.55 109.76 2kym n ASP 62 Ca -0.11 -2.52 0.07 0.00 -1.51 0.00 0.00 54.79 50.73 2kym n ASP 62 Cb 1.03 -0.46 0.34 0.00 2.34 0.00 0.00 41.12 44.36 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 2.32 0.11 0.01 -0.67 -0.04 0.99 -1.96 135.00 135.75 2kym n PRO 63 Ca 0.26 0.20 0.11 0.00 -0.04 0.00 0.00 63.50 64.03 2kym n PRO 63 Cb 0.50 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.47 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 -1.39 3.88 -0.08 0.55 0.00 -1.26 -3.48 120.51 118.73 2kym n ALA 64 Ca 0.05 -0.47 -0.16 0.00 0.00 0.00 0.00 53.44 52.86 2kym n ALA 64 Cb 0.14 -0.91 -0.11 0.00 0.00 0.00 0.00 19.45 18.57 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 0.00 -0.79 0.00 3.64 -1.77 -3.35 116.57 114.30 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 0.62 0.00 -0.08 0.00 -0.41 0.00 0.00 32.23 32.36 2kym h LYS 65 CO 0.00 0.89 0.16 0.66 -2.27 0.00 0.00 179.45 178.89 2kym n TYR 66 N -4.55 1.82 0.30 1.91 4.02 -1.23 -4.11 117.16 115.33 2kym n TYR 66 Ca -0.18 -0.86 0.12 0.00 -0.01 0.00 0.00 57.90 56.97 2kym n TYR 66 Cb 0.52 -0.53 0.12 0.00 -0.02 0.00 0.00 39.34 39.43 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 2.78 0.67 0.00 -0.72 0.00 -1.70 -3.30 119.26 117.00 2kym h ALA 67 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.07 2kym h ALA 67 Cb 1.88 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.67 2kym h ALA 67 CO 0.52 0.00 -1.06 -1.13 0.00 0.00 0.00 179.25 177.58 2kym n SER 68 N -2.58 0.61 -4.57 0.00 3.41 -1.26 -4.96 113.62 104.28 2kym n SER 68 Ca 0.02 -0.06 -0.41 0.00 -0.26 0.00 0.00 58.87 58.16 2kym n SER 68 Cb 0.51 0.76 0.01 0.00 -0.26 0.00 0.00 64.21 65.23 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 -2.13 2.34 -3.45 -3.33 3.14 -1.24 -4.92 118.33 108.73 2kym n VAL 69 Ca 0.01 -0.50 -0.43 0.00 -2.96 0.00 0.00 64.34 60.46 2kym n VAL 69 Cb 0.47 -0.99 -0.04 0.00 -1.06 0.00 0.00 33.84 32.23 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 -0.82 6.50 0.54 6.55 1.01 -1.26 -4.89 116.67 124.30 2kym s ASP 70 Ca 0.64 -3.08 0.30 0.00 0.71 0.00 0.00 52.55 51.12 2kym s ASP 70 Cb -0.57 -2.10 1.47 0.00 1.01 0.00 0.00 42.92 42.73 2kym s ASP 70 CO 0.57 -0.41 1.91 0.71 0.21 0.00 0.00 175.17 178.15 2kym h THR 71 N 4.51 0.58 -0.23 -1.27 1.35 -1.88 -0.45 112.91 115.52 2kym h THR 71 Ca 0.11 0.00 0.01 0.00 -0.55 0.00 0.00 66.41 65.98 2kym h THR 71 Cb 0.95 0.59 -0.02 0.00 -1.73 0.00 0.00 68.15 67.94 2kym h THR 71 CO 0.82 0.00 0.13 0.22 -0.25 0.00 0.00 175.52 176.44 2kym h TYR 72 N 0.00 0.24 -2.37 4.73 3.20 -1.90 -3.41 116.97 117.46 2kym h TYR 72 Ca 0.39 0.01 -0.57 0.00 3.14 0.00 0.00 58.73 61.70 2kym h TYR 72 Cb 1.58 -0.08 -0.01 0.00 1.54 0.00 0.00 36.73 39.76 2kym h TYR 72 CO 0.00 0.14 1.33 -0.51 -1.64 0.00 0.00 178.16 177.49 2kym s ASP 73 N -5.37 5.87 0.58 -2.11 1.01 -0.18 -4.83 116.67 111.64 2kym s ASP 73 Ca -0.13 1.78 0.28 0.00 0.71 0.00 0.00 52.55 55.19 2kym s ASP 73 Cb 0.09 -2.52 1.53 0.00 1.01 0.00 0.00 42.92 43.03 2kym s ASP 73 CO 0.69 -1.65 2.00 0.08 0.21 0.00 0.00 175.17 176.51 2kym h ARG 74 N 13.09 0.00 -0.02 8.23 -0.00 -1.84 -1.25 114.38 132.58 2kym h ARG 74 Ca -0.39 0.00 -0.00 0.00 -0.00 0.00 0.00 59.98 59.59 2kym h ARG 74 Cb 1.20 0.00 -0.00 0.00 -0.00 0.00 0.00 29.97 31.17 2kym h ARG 74 CO 0.98 0.00 -0.00 0.93 -0.00 0.00 0.00 179.97 181.88 2kym h GLU 75 N 0.00 0.04 0.56 0.08 5.08 -1.91 -1.08 114.58 117.35 2kym h GLU 75 Ca 0.17 -0.01 -0.03 0.00 -1.00 0.00 0.00 59.36 58.49 2kym h GLU 75 Cb 0.86 -0.00 0.01 0.00 0.50 0.00 0.00 28.75 30.11 2kym h GLU 75 CO -0.00 0.35 -0.27 1.96 -1.00 0.00 0.00 179.01 180.04 2kym h GLN 76 N -0.26 -0.73 -0.48 2.33 1.08 -1.50 -1.74 115.11 113.80 2kym h GLN 76 Ca 0.01 0.05 0.12 0.00 -1.45 0.00 0.00 58.65 57.38 2kym h GLN 76 Cb 0.33 0.17 -0.02 0.00 -0.05 0.00 0.00 27.48 27.90 2kym h GLN 76 CO 0.00 -0.45 0.34 -0.24 -0.95 0.00 0.00 178.83 177.53 2kym h VAL 77 N -0.85 0.80 0.43 -0.54 3.04 -1.51 -0.97 116.25 116.64 2kym h VAL 77 Ca -0.08 -0.03 -0.02 0.00 -1.01 0.00 0.00 66.70 65.56 2kym h VAL 77 Cb 0.62 0.70 0.00 0.00 -2.01 0.00 0.00 31.29 30.60 2kym h VAL 77 CO 0.13 0.02 -0.21 0.24 -1.01 0.00 0.00 177.57 176.74 2kym h MET 78 N 0.09 -0.55 -0.73 4.17 2.86 -0.84 -1.39 114.93 118.54 2kym h MET 78 Ca 0.23 0.04 0.07 0.00 -2.06 0.00 0.00 59.70 57.97 2kym h MET 78 Cb 0.78 0.13 -0.05 0.00 0.06 0.00 0.00 31.60 32.52 2kym h MET 78 CO -0.02 -0.25 0.48 0.87 1.06 0.00 0.00 176.91 179.05 2kym h LYS 79 N -0.97 0.73 0.10 1.72 1.57 -0.85 -0.49 116.57 118.39 2kym h LYS 79 Ca -0.06 -0.04 -0.00 0.00 -1.87 0.00 0.00 60.65 58.67 2kym h LYS 79 Cb 0.56 -0.16 0.00 0.00 0.08 0.00 0.00 32.23 32.71 2kym h LYS 79 CO 0.10 0.48 -0.05 0.82 -0.57 0.00 0.00 179.45 180.23 2kym h ILE 80 N 0.75 1.06 -0.45 1.86 2.04 -1.18 0.22 117.51 121.81 2kym h ILE 80 Ca 0.32 -0.62 -0.01 0.00 1.00 0.00 0.00 64.86 65.55 2kym h ILE 80 Cb 0.29 1.45 -0.02 0.00 -0.74 0.00 0.00 36.82 37.80 2kym h ILE 80 CO -0.11 0.15 0.24 0.40 0.00 0.00 0.00 178.15 178.83 2kym h ILE 81 N -0.42 1.14 -0.08 -0.67 2.04 -0.80 0.24 117.51 118.96 2kym h ILE 81 Ca -0.01 -0.37 -0.05 0.00 1.00 0.00 0.00 64.86 65.42 2kym h ILE 81 Cb 0.35 0.54 0.00 0.00 -0.74 0.00 0.00 36.82 36.97 2kym h ILE 81 CO 0.02 0.16 -0.15 -0.78 0.00 0.00 0.00 178.15 177.41 2kym h ASP 82 N 0.63 0.27 -0.26 1.72 1.82 -0.98 0.68 116.42 120.29 2kym h ASP 82 Ca 0.16 -0.55 -0.04 0.00 -0.39 0.00 0.00 57.03 56.21 2kym h ASP 82 Cb 0.03 -0.08 -0.01 0.00 0.68 0.00 0.00 39.33 39.95 2kym h ASP 82 CO -0.03 0.77 -0.01 -0.33 -1.61 0.00 0.00 179.24 178.03 2kym h GLU 83 N -0.22 0.47 0.00 0.28 5.08 -0.66 -2.57 114.58 116.95 2kym h GLU 83 Ca 0.00 -0.15 0.00 0.00 -1.00 0.00 0.00 59.36 58.21 2kym h GLU 83 Cb 0.72 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.93 2kym h GLU 83 CO 0.03 0.64 0.00 1.19 -1.00 0.00 0.00 179.01 179.88 2kym n PHE 84 N -4.60 0.06 -3.60 4.33 3.01 0.82 -4.88 117.46 112.59 2kym n PHE 84 Ca -0.03 0.02 -0.22 0.00 1.01 0.00 0.00 57.45 58.22 2kym n PHE 84 Cb 0.26 -0.53 0.07 0.00 -0.01 0.00 0.00 39.48 39.26 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 -1.55 -6.87 -2.52 -1.08 4.01 -0.24 -4.14 118.16 105.77 2kym n LYS 85 Ca 0.05 0.78 -0.43 0.00 -0.51 0.00 0.00 58.31 58.20 2kym n LYS 85 Cb 0.24 -5.75 -0.02 0.00 -0.51 0.00 0.00 35.03 29.00 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 -3.37 4.45 0.93 -0.18 1.01 0.07 -4.81 121.20 119.30 2kym s ILE 86 Ca 0.34 1.75 -0.12 0.00 0.00 0.00 0.00 60.65 62.63 2kym s ILE 86 Cb -0.16 -4.13 0.15 0.00 0.01 0.00 0.00 42.46 38.33 2kym s ILE 86 CO 0.75 -0.15 1.09 -2.16 0.00 0.00 0.00 174.94 174.48 2kym s PRO 87 N 3.31 0.96 0.60 2.79 0.04 -1.26 -4.73 135.00 136.71 2kym s PRO 87 Ca 0.50 0.71 -0.01 0.00 0.04 0.00 0.00 61.00 62.24 2kym s PRO 87 Cb -0.19 -1.78 0.04 0.00 0.04 0.00 0.00 34.50 32.61 2kym s PRO 87 CO 0.11 -2.41 0.85 0.95 0.04 0.00 0.00 177.00 176.55 2kym s THR 88 N -2.95 2.54 0.12 1.26 -4.23 -1.26 -1.38 115.64 109.74 2kym s THR 88 Ca 0.64 -0.53 -0.31 0.00 -1.18 0.00 0.00 61.69 60.31 2kym s THR 88 Cb -0.18 -3.00 -0.09 0.00 1.34 0.00 0.00 72.50 70.57 2kym s THR 88 CO 0.57 -0.00 1.58 0.58 -0.54 0.00 0.00 174.62 176.81 2kym h VAL 89 N -0.15 0.13 -0.76 2.29 2.07 -1.27 0.15 116.25 118.71 2kym h VAL 89 Ca -0.43 0.00 0.14 0.00 0.82 0.00 0.00 66.70 67.24 2kym h VAL 89 Cb 1.30 0.13 -0.10 0.00 -1.52 0.00 0.00 31.29 31.11 2kym h VAL 89 CO 0.55 0.00 0.31 -0.33 0.02 0.00 0.00 177.57 178.11 2kym h GLU 90 N -0.60 0.43 -0.33 1.57 5.08 -1.95 0.58 114.58 119.36 2kym h GLU 90 Ca 0.04 -0.03 -0.01 0.00 -1.00 0.00 0.00 59.36 58.36 2kym h GLU 90 Cb 0.67 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.81 2kym h GLU 90 CO -0.31 0.29 0.16 1.96 -1.00 0.00 0.00 179.01 180.11 2kym h GLN 91 N 0.45 0.47 -0.93 2.33 1.08 -1.70 -1.18 115.11 115.62 2kym h GLN 91 Ca 0.42 -0.07 -0.01 0.00 -1.45 0.00 0.00 58.65 57.54 2kym h GLN 91 Cb 0.64 -0.09 -0.04 0.00 -0.05 0.00 0.00 27.48 27.94 2kym h GLN 91 CO -0.41 0.42 0.54 2.35 -0.95 0.00 0.00 178.83 180.79 2kym h TRP 92 N 0.39 1.24 0.14 2.96 7.01 0.55 -0.64 115.95 127.59 2kym h TRP 92 Ca 0.11 -0.01 -0.01 0.00 2.11 0.00 0.00 58.89 61.09 2kym h TRP 92 Cb 0.10 -0.40 0.00 0.00 -2.10 0.00 0.00 29.16 26.76 2kym h TRP 92 CO -0.02 0.83 -0.07 0.87 -2.79 0.00 0.00 178.44 177.27 2kym h LYS 93 N 1.28 -0.18 -0.96 2.65 1.79 -0.66 -1.38 116.57 119.11 2kym h LYS 93 Ca 0.33 0.01 0.03 0.00 -2.18 0.00 0.00 60.65 58.85 2kym h LYS 93 Cb -0.03 0.04 -0.05 0.00 -1.58 0.00 0.00 32.23 30.61 2kym h LYS 93 CO -0.06 0.06 0.63 0.22 -1.08 0.00 0.00 179.45 179.22 2kym h ASP 94 N -0.39 1.06 0.32 0.86 1.82 -1.05 0.13 116.42 119.16 2kym h ASP 94 Ca -0.02 -0.01 -0.02 0.00 -0.39 0.00 0.00 57.03 56.59 2kym h ASP 94 Cb 0.31 -0.24 0.00 0.00 0.68 0.00 0.00 39.33 40.08 2kym h ASP 94 CO 0.03 0.73 -0.15 1.56 -1.61 0.00 0.00 179.24 179.80 2kym h GLN 95 N 1.23 -0.41 -0.74 0.28 4.20 -0.98 -0.41 115.11 118.28 2kym h GLN 95 Ca 0.38 0.03 -0.03 0.00 0.06 0.00 0.00 58.65 59.08 2kym h GLN 95 Cb -0.01 0.09 -0.03 0.00 0.30 0.00 0.00 27.48 27.83 2kym h GLN 95 CO -0.11 -0.19 0.33 1.79 -0.67 0.00 0.00 178.83 179.98 2kym h THR 96 N -0.56 1.24 0.84 -0.54 1.35 -1.00 0.44 112.91 114.68 2kym h THR 96 Ca -0.04 -0.72 -0.04 0.00 -0.55 0.00 0.00 66.41 65.06 2kym h THR 96 Cb 0.41 0.33 0.01 0.00 -1.73 0.00 0.00 68.15 67.17 2kym h THR 96 CO 0.07 0.30 -0.40 0.03 -0.25 0.00 0.00 175.52 175.27 2kym h ARG 97 N 1.06 -1.08 -0.24 4.72 2.47 -0.63 -0.84 114.38 119.84 2kym h ARG 97 Ca 0.25 0.07 -0.00 0.00 -1.26 0.00 0.00 59.98 59.04 2kym h ARG 97 Cb 0.15 0.25 -0.01 0.00 -1.65 0.00 0.00 29.97 28.71 2kym h ARG 97 CO -0.03 -0.71 0.14 0.07 0.56 0.00 0.00 179.97 180.00 2kym h ARG 98 N -1.25 0.32 -0.20 0.04 0.11 -1.03 -2.40 114.38 109.97 2kym h ARG 98 Ca -0.11 -0.02 -0.02 0.00 0.10 0.00 0.00 59.98 59.92 2kym h ARG 98 Cb 0.87 -0.07 -0.01 0.00 1.11 0.00 0.00 29.97 31.87 2kym h ARG 98 CO 0.19 0.22 0.03 -0.92 0.10 0.00 0.00 179.97 179.59 2kym h TYR 99 N 0.32 0.36 0.00 4.08 3.20 -0.75 -2.66 116.97 121.52 2kym h TYR 99 Ca 0.09 -0.05 -0.02 0.00 3.14 0.00 0.00 58.73 61.89 2kym h TYR 99 Cb -0.01 -0.10 -0.00 0.00 1.54 0.00 0.00 36.73 38.16 2kym h TYR 99 CO 0.00 0.48 -0.09 0.87 -1.64 0.00 0.00 178.16 177.78 2kym h LYS 100 N 0.13 0.00 0.00 1.82 1.79 -0.67 -3.43 116.57 116.20 2kym h LYS 100 Ca 0.06 0.00 -0.35 0.00 -2.18 0.00 0.00 60.65 58.18 2kym h LYS 100 Cb 0.31 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 30.96 2kym h LYS 100 CO 0.00 0.09 -0.11 0.39 -1.08 0.00 0.00 179.45 178.74 2kym n GLU 101 N -3.79 0.84 -4.20 3.15 -0.58 -0.97 -5.11 120.64 109.98 2kym n GLU 101 Ca -0.02 -2.17 -0.19 0.00 -0.42 0.00 0.00 57.16 54.35 2kym n GLU 101 Cb 0.19 0.03 -0.12 0.00 -0.57 0.00 0.00 31.44 30.97 2kym n GLU 101 CO 0.00 0.00 0.00 0.45 -0.48 0.00 0.00 177.13 177.10 2kym s SER 102 N -3.27 1.86 0.21 1.62 0.15 -1.26 -4.89 113.70 108.11 2kym s SER 102 Ca 0.31 -0.67 0.01 0.00 0.70 0.00 0.00 55.95 56.29 2kym s SER 102 Cb -0.02 -0.06 -0.00 0.00 -1.71 0.00 0.00 66.02 64.22 2kym s SER 102 CO 0.20 -0.08 0.03 -1.54 1.20 0.00 0.00 173.24 173.05 2kym n SER 103 N 1.07 1.93 0.27 5.45 3.41 -1.26 -5.02 113.62 119.46 2kym n SER 103 Ca -0.20 -1.98 0.16 0.00 -0.26 0.00 0.00 58.87 56.59 2kym n SER 103 Cb 0.55 0.29 0.73 0.00 -0.26 0.00 0.00 64.21 65.52 2kym n SER 103 CO 0.00 0.00 0.00 0.40 -0.16 0.00 0.00 175.04 175.28 2kym h ILE 104 N 1.20 0.24 -2.33 -1.33 1.08 -2.04 -3.44 117.51 110.89 2kym h ILE 104 Ca -0.17 -0.57 -0.45 0.00 -0.39 0.00 0.00 64.86 63.28 2kym h ILE 104 Cb 0.55 1.45 0.07 0.00 -3.07 0.00 0.00 36.82 35.82 2kym h ILE 104 CO 0.27 0.07 0.05 -1.10 -0.69 0.00 0.00 178.15 176.75 2kym s GLN 105 N -3.85 2.09 0.10 2.37 -0.21 -1.26 -5.13 119.66 113.77 2kym s GLN 105 Ca -0.01 -0.95 -0.09 0.00 0.02 0.00 0.00 55.36 54.33 2kym s GLN 105 Cb 0.11 -2.40 0.00 0.00 1.00 0.00 0.00 33.01 31.72 2kym s GLN 105 CO 0.55 -1.11 0.22 0.96 -2.12 0.00 0.00 175.29 173.79 2kym s ILE 106 N -2.97 0.13 0.00 1.08 -0.00 -1.26 -5.09 121.20 113.08 2kym s ILE 106 Ca 0.62 -1.16 0.00 0.00 -0.00 0.00 0.00 60.65 60.11 2kym s ILE 106 Cb -0.08 -1.39 0.00 0.00 -0.00 0.00 0.00 42.46 40.99 2kym s ILE 106 CO 0.42 -0.58 0.00 0.61 -0.00 0.00 0.00 174.94 175.39 2kym n GLY 107 N -0.09 -1.66 3.49 6.27 0.00 -1.26 -4.98 105.19 106.96 2kym n GLY 107 Ca -0.14 -1.55 -0.32 0.00 0.00 0.00 0.00 46.02 44.01 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 -4.10 4.09 -0.68 1.61 0.01 -1.26 -5.07 114.94 109.53 2kym s ASN 108 Ca 0.00 -0.22 -0.27 0.00 -0.71 0.00 0.00 52.86 51.66 2kym s ASN 108 Cb 0.00 -0.85 0.02 0.00 0.41 0.00 0.00 41.25 40.82 2kym s ASN 108 CO 0.00 0.33 1.44 -0.83 -1.51 0.00 0.00 177.10 176.52 2kym s GLY 109 N -0.92 0.72 -0.16 0.66 0.00 -1.26 -4.95 107.32 101.41 2kym s GLY 109 Ca 0.13 -1.10 -0.12 0.00 0.00 0.00 0.00 44.72 43.63 2kym s GLY 109 CO 0.02 2.85 0.41 -1.58 0.00 0.00 0.00 173.10 174.80 2kym s HIS 110 N 6.57 -0.50 0.26 1.90 5.04 -1.26 -5.17 115.29 122.13 2kym s HIS 110 Ca 0.45 1.16 0.02 0.00 -1.54 0.00 0.00 55.06 55.15 2kym s HIS 110 Cb -0.09 0.19 -0.04 0.00 0.04 0.00 0.00 32.58 32.67 2kym s HIS 110 CO 0.18 -0.26 0.12 0.20 -2.34 0.00 0.00 174.74 172.64 2kym s GLY 111 N 0.66 1.79 0.54 1.59 0.00 -1.26 -5.18 107.32 105.47 2kym s GLY 111 Ca -0.04 -1.80 0.05 0.00 0.00 0.00 0.00 44.72 42.93 2kym s GLY 111 CO -0.04 -1.56 0.38 0.61 0.00 0.00 0.00 173.10 172.49 2kym n GLN 112 N -0.47 0.69 -4.25 2.90 10.64 -1.26 -5.16 117.38 120.47 2kym n GLN 112 Ca 0.01 -3.41 -0.14 0.00 -1.83 0.00 0.00 57.00 51.62 2kym n GLN 112 Cb 0.66 0.40 -0.10 0.00 -0.86 0.00 0.00 30.24 30.34 2kym n GLN 112 CO 0.00 0.00 0.00 -1.54 -1.83 0.00 0.00 177.06 173.69 2kym s SER 113 N -4.16 0.97 -0.28 2.61 1.04 -1.26 -5.17 113.70 107.45 2kym s SER 113 Ca 0.29 -1.28 -0.24 0.00 0.48 0.00 0.00 55.95 55.19 2kym s SER 113 Cb -0.02 0.19 0.11 0.00 0.10 0.00 0.00 66.02 66.39 2kym s SER 113 CO 0.18 -0.68 0.93 0.00 0.98 0.00 0.00 173.24 174.65 2kym s GLN 114 N -4.01 0.60 -0.05 4.02 -2.07 -1.26 -5.05 119.66 111.85 2kym s GLN 114 Ca 0.31 0.74 0.09 0.00 -1.82 0.00 0.00 55.36 54.68 2kym s GLN 114 Cb 0.07 0.28 0.15 0.00 -1.09 0.00 0.00 33.01 32.42 2kym s GLN 114 CO 0.08 -0.08 1.07 0.41 -1.32 0.00 0.00 175.29 175.46 2kym n GLY 115 N 2.51 2.01 3.55 2.60 0.00 -1.26 -4.99 105.19 109.61 2kym n GLY 115 Ca -0.13 -0.48 -0.26 0.00 0.00 0.00 0.00 46.02 45.15 2kym n GLY 115 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2kym n LEU 116 N -0.40 -2.07 0.00 0.99 4.32 -1.26 -5.42 117.00 113.17 2kym n LEU 116 Ca 0.06 -0.54 0.00 0.00 -0.02 0.00 0.00 56.01 55.51 2kym n LEU 116 Cb 0.73 -2.40 0.00 0.00 -1.62 0.00 0.00 43.42 40.14 2kym n LEU 116 CO -0.00 0.28 0.00 -0.62 -1.22 0.00 0.00 177.39 175.83