#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 3.64 -0.21 -5.12 0.00 -1.26 -5.03 121.76 113.78 2kym s ALA -1 Ca 0.00 -0.84 -0.29 0.00 0.00 0.00 0.00 51.96 50.83 2kym s ALA -1 Cb 0.00 -2.21 -0.03 0.00 0.00 0.00 0.00 23.12 20.88 2kym s ALA -1 CO 0.00 -0.12 1.60 -1.25 0.00 0.00 0.00 175.76 175.99 2kym s PRO 1 N -4.42 3.84 -0.06 0.00 0.04 -1.26 -5.00 135.00 128.14 2kym s PRO 1 Ca 0.42 1.69 0.05 0.00 0.04 0.00 0.00 61.00 63.21 2kym s PRO 1 Cb -0.10 -4.02 -0.01 0.00 0.04 0.00 0.00 34.50 30.42 2kym s PRO 1 CO 0.38 -1.24 -0.22 -0.48 0.04 0.00 0.00 177.00 175.48 2kym s LEU 2 N 5.05 2.01 0.32 -3.56 0.05 -1.26 -4.74 118.68 116.55 2kym s LEU 2 Ca 0.71 -0.46 0.10 0.00 0.05 0.00 0.00 54.13 54.52 2kym s LEU 2 Cb -0.25 -1.23 -0.06 0.00 -2.05 0.00 0.00 46.19 42.60 2kym s LEU 2 CO 0.29 0.20 -0.05 -0.36 -0.55 0.00 0.00 176.35 175.87 2kym s PHE 3 N -0.01 2.48 0.17 3.48 0.40 -1.21 -3.75 117.98 119.55 2kym s PHE 3 Ca -0.06 -0.42 0.02 0.00 -0.60 0.00 0.00 56.93 55.87 2kym s PHE 3 Cb -0.14 -1.35 -0.05 0.00 0.51 0.00 0.00 43.02 42.00 2kym s PHE 3 CO 0.04 0.56 -0.00 0.00 0.70 0.00 0.00 175.22 176.52 2kym s ALA 4 N -2.52 1.32 -0.05 5.36 0.00 -0.46 -2.03 121.76 123.38 2kym s ALA 4 Ca 0.33 -1.58 0.02 0.00 0.00 0.00 0.00 51.96 50.73 2kym s ALA 4 Cb -0.01 0.53 0.01 0.00 0.00 0.00 0.00 23.12 23.65 2kym s ALA 4 CO 0.18 -0.32 -0.09 0.54 0.00 0.00 0.00 175.76 176.08 2kym s VAL 5 N -3.66 0.83 0.22 0.00 0.11 -0.35 -1.34 120.40 116.21 2kym s VAL 5 Ca 0.23 -0.32 -0.30 0.00 -2.93 0.00 0.00 61.98 58.67 2kym s VAL 5 Cb 0.06 -0.79 -0.09 0.00 -1.53 0.00 0.00 36.38 34.04 2kym s VAL 5 CO 0.03 0.28 1.18 0.42 -3.33 0.00 0.00 175.10 173.68 2kym s THR 6 N 0.66 3.51 -0.24 5.04 -4.23 -1.14 -0.12 115.64 119.11 2kym s THR 6 Ca -0.11 1.34 0.13 0.00 -1.18 0.00 0.00 61.69 61.86 2kym s THR 6 Cb -0.14 -3.85 -0.17 0.00 1.34 0.00 0.00 72.50 69.67 2kym s THR 6 CO 0.02 0.25 0.38 0.18 -0.54 0.00 0.00 174.62 174.90 2kym n LEU 7 N 2.08 0.23 -4.20 4.79 4.77 -1.25 -0.09 117.00 123.33 2kym n LEU 7 Ca 0.03 -0.20 -0.12 0.00 -0.03 0.00 0.00 56.01 55.69 2kym n LEU 7 Cb 0.45 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.43 2kym n LEU 7 CO 0.55 0.06 -0.36 -0.31 -1.33 0.00 0.00 177.39 176.00 2kym s TYR 8 N -2.60 1.03 -0.58 -1.77 1.51 -1.26 -4.65 117.35 109.03 2kym s TYR 8 Ca -0.01 -0.96 -0.25 0.00 -1.01 0.00 0.00 57.07 54.84 2kym s TYR 8 Cb 0.09 -0.59 0.04 0.00 -0.11 0.00 0.00 41.96 41.39 2kym s TYR 8 CO 0.52 -0.17 1.03 -2.00 -1.11 0.00 0.00 175.55 173.82 2kym s GLU 9 N -3.87 3.35 -0.64 -0.62 2.56 -1.26 -3.77 118.70 114.46 2kym s GLU 9 Ca 0.17 -0.17 -0.22 0.00 0.00 0.00 0.00 54.97 54.75 2kym s GLU 9 Cb 0.05 -4.07 0.08 0.00 2.00 0.00 0.00 34.13 32.20 2kym s GLU 9 CO -0.01 -1.61 0.90 0.12 -0.56 0.00 0.00 175.26 174.10 2kym s PHE 10 N 4.35 2.75 -0.56 5.30 5.36 -0.34 -4.97 117.98 129.87 2kym s PHE 10 Ca 0.33 -0.63 -0.28 0.00 -0.96 0.00 0.00 56.93 55.39 2kym s PHE 10 Cb -0.11 -4.22 0.03 0.00 -0.34 0.00 0.00 43.02 38.38 2kym s PHE 10 CO 0.20 -1.56 1.17 0.15 -1.46 0.00 0.00 175.22 173.73 2kym s LYS 11 N 3.74 3.55 0.72 10.12 -0.14 -1.26 -2.86 119.74 133.60 2kym s LYS 11 Ca 0.20 0.29 -0.16 0.00 -1.36 0.00 0.00 55.97 54.94 2kym s LYS 11 Cb -0.18 -4.00 0.02 0.00 -1.68 0.00 0.00 37.83 31.99 2kym s LYS 11 CO 0.10 -1.62 1.12 0.00 -0.76 0.00 0.00 175.35 174.18 2kym n ALA 12 N 8.30 0.22 -0.03 5.17 0.00 -1.26 -4.96 120.51 127.95 2kym n ALA 12 Ca 0.09 -0.16 -0.03 0.00 0.00 0.00 0.00 53.44 53.33 2kym n ALA 12 Cb 0.49 -2.21 -0.05 0.00 0.00 0.00 0.00 19.45 17.68 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 -2.20 2.70 -4.72 0.00 0.28 -1.26 -5.00 120.64 110.44 2kym n GLU 13 Ca 0.14 0.00 -0.33 0.00 -0.16 0.00 0.00 57.16 56.82 2kym n GLU 13 Cb 0.49 -1.16 -0.07 0.00 1.43 0.00 0.00 31.44 32.13 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 -2.28 0.72 -0.23 3.44 5.12 -1.26 -5.03 116.66 117.13 2kym n ARG 14 Ca -0.11 -3.77 -0.06 0.00 -1.93 0.00 0.00 57.85 51.98 2kym n ARG 14 Cb 0.70 1.12 0.09 0.00 -1.16 0.00 0.00 32.46 33.22 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 1.30 1.00 0.07 0.55 3.58 -2.05 -3.07 116.42 117.80 2kym h ASP 15 Ca -0.42 -0.19 -0.00 0.00 0.42 0.00 0.00 57.03 56.83 2kym h ASP 15 Cb 1.30 -0.26 0.00 0.00 1.72 0.00 0.00 39.33 42.09 2kym h ASP 15 CO 0.70 0.95 -0.03 -2.24 -2.88 0.00 0.00 179.24 175.73 2kym h ASP 16 N 1.02 -0.08 -2.80 2.28 2.03 -1.97 -3.43 116.42 113.47 2kym h ASP 16 Ca 0.22 -0.14 -0.58 0.00 -0.73 0.00 0.00 57.03 55.80 2kym h ASP 16 Cb 0.33 0.02 0.09 0.00 -0.83 0.00 0.00 39.33 38.93 2kym h ASP 16 CO -0.00 0.09 0.60 -0.62 -1.03 0.00 0.00 179.24 178.28 2kym n GLU 17 N -5.06 2.07 -4.44 4.15 -0.58 -1.16 -4.02 120.64 111.60 2kym n GLU 17 Ca -0.08 0.74 -0.34 0.00 -0.42 0.00 0.00 57.16 57.05 2kym n GLU 17 Cb 0.13 -2.38 -0.11 0.00 -0.57 0.00 0.00 31.44 28.51 2kym n GLU 17 CO 0.00 0.00 0.00 -1.17 -0.48 0.00 0.00 177.13 175.48 2kym s LEU 18 N -0.10 3.38 -0.08 -4.62 2.96 -1.26 -4.72 118.68 114.25 2kym s LEU 18 Ca 0.66 0.02 -0.25 0.00 -0.22 0.00 0.00 54.13 54.34 2kym s LEU 18 Cb -0.63 -1.78 -0.03 0.00 0.50 0.00 0.00 46.19 44.25 2kym s LEU 18 CO 0.52 0.31 0.77 -0.62 -1.32 0.00 0.00 176.35 176.00 2kym s ASP 19 N -0.48 7.04 0.00 3.68 -1.08 -1.26 -4.41 116.67 120.16 2kym s ASP 19 Ca 0.08 1.25 -0.00 0.00 -0.52 0.00 0.00 52.55 53.36 2kym s ASP 19 Cb -0.12 -2.44 -0.01 0.00 -1.46 0.00 0.00 42.92 38.89 2kym s ASP 19 CO 0.02 -0.19 -0.00 0.54 0.52 0.00 0.00 175.17 176.05 2kym s VAL 20 N 1.10 0.04 0.25 1.11 0.11 -1.14 -5.01 120.40 116.86 2kym s VAL 20 Ca 0.40 -0.30 0.06 0.00 -2.93 0.00 0.00 61.98 59.21 2kym s VAL 20 Cb -0.18 -0.10 -0.03 0.00 -1.53 0.00 0.00 36.38 34.54 2kym s VAL 20 CO 0.19 -0.16 0.32 -0.44 -3.33 0.00 0.00 175.10 171.67 2kym s SER 21 N -0.48 6.05 -0.06 3.54 0.01 -1.26 -1.19 113.70 120.31 2kym s SER 21 Ca -0.05 -0.05 -0.30 0.00 1.31 0.00 0.00 55.95 56.86 2kym s SER 21 Cb -0.03 -1.68 -0.05 0.00 0.21 0.00 0.00 66.02 64.47 2kym s SER 21 CO -0.00 -0.08 1.49 -2.16 0.41 0.00 0.00 173.24 172.90 2kym s PRO 22 N -3.95 4.22 0.00 12.44 0.04 -1.25 -2.94 135.00 143.57 2kym s PRO 22 Ca 0.34 2.02 0.00 0.00 0.04 0.00 0.00 61.00 63.40 2kym s PRO 22 Cb -0.09 -3.80 0.00 0.00 0.04 0.00 0.00 34.50 30.66 2kym s PRO 22 CO 0.28 -0.73 0.00 0.41 0.04 0.00 0.00 177.00 177.00 2kym n GLY 23 N 3.87 1.01 3.96 0.56 0.00 0.87 -4.95 105.19 110.52 2kym n GLY 23 Ca 0.15 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.95 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 -0.54 2.57 -0.19 1.61 2.02 -1.15 -4.93 118.70 118.09 2kym s GLU 24 Ca 0.00 -0.67 -0.02 0.00 0.02 0.00 0.00 54.97 54.30 2kym s GLU 24 Cb 0.00 -2.45 -0.01 0.00 0.10 0.00 0.00 34.13 31.77 2kym s GLU 24 CO 0.00 -0.72 -0.09 -0.80 0.02 0.00 0.00 175.26 173.67 2kym s ASN 25 N -4.41 4.08 0.11 -0.19 -0.87 -1.26 -2.89 114.94 109.52 2kym s ASN 25 Ca 0.56 -0.40 0.09 0.00 -1.57 0.00 0.00 52.86 51.55 2kym s ASN 25 Cb -0.10 -1.67 -0.04 0.00 -0.02 0.00 0.00 41.25 39.42 2kym s ASN 25 CO 0.39 0.04 -0.23 -0.76 -2.57 0.00 0.00 177.10 173.98 2kym s LEU 26 N 1.08 2.31 -0.33 0.60 1.02 -0.45 -3.28 118.68 119.63 2kym s LEU 26 Ca 0.00 -0.71 -0.09 0.00 0.02 0.00 0.00 54.13 53.35 2kym s LEU 26 Cb -0.15 -1.01 0.01 0.00 0.02 0.00 0.00 46.19 45.07 2kym s LEU 26 CO -0.02 0.10 0.15 -0.55 0.02 0.00 0.00 176.35 176.05 2kym s SER 27 N -1.98 5.48 0.37 2.29 0.15 -0.48 -1.36 113.70 118.18 2kym s SER 27 Ca 0.09 -0.80 -0.25 0.00 0.70 0.00 0.00 55.95 55.70 2kym s SER 27 Cb -0.10 -1.96 -0.09 0.00 -1.71 0.00 0.00 66.02 62.15 2kym s SER 27 CO 0.05 -0.27 1.02 -0.63 1.20 0.00 0.00 173.24 174.60 2kym s ILE 28 N 1.54 3.88 -0.01 6.45 1.01 -1.25 -1.16 121.20 131.67 2kym s ILE 28 Ca 0.02 1.48 0.00 0.00 0.00 0.00 0.00 60.65 62.16 2kym s ILE 28 Cb -0.18 -3.79 -0.01 0.00 0.01 0.00 0.00 42.46 38.50 2kym s ILE 28 CO 0.05 0.05 -0.00 0.00 0.00 0.00 0.00 174.94 175.04 2kym s ALA 30 N -2.01 -1.83 0.47 0.00 0.00 -1.24 -4.59 121.76 112.56 2kym s ALA 30 Ca -0.00 0.07 0.02 0.00 0.00 0.00 0.00 51.96 52.05 2kym s ALA 30 Cb 0.00 0.65 -0.02 0.00 0.00 0.00 0.00 23.12 23.75 2kym s ALA 30 CO 0.02 -1.06 0.05 -3.38 0.00 0.00 0.00 175.76 171.38 2kym s HIS 31 N -2.58 1.85 -0.27 0.00 -0.00 -0.67 -0.43 115.29 113.19 2kym s HIS 31 Ca 0.18 -1.07 -0.01 0.00 -0.00 0.00 0.00 55.06 54.16 2kym s HIS 31 Cb -0.00 -1.45 0.14 0.00 -0.00 0.00 0.00 32.58 31.27 2kym s HIS 31 CO 0.02 0.04 0.37 -0.47 -0.00 0.00 0.00 174.74 174.69 2kym s TYR 32 N -3.00 -0.81 -1.72 0.38 6.14 0.93 -2.29 117.35 116.97 2kym s TYR 32 Ca 0.13 0.45 0.00 0.00 0.64 0.00 0.00 57.07 58.29 2kym s TYR 32 Cb 0.02 -0.14 0.00 0.00 0.42 0.00 0.00 41.96 42.26 2kym s TYR 32 CO 0.08 -0.85 0.00 -0.25 0.64 0.00 0.00 175.55 175.17 2kym n ASP 33 N 5.35 -5.62 -1.59 4.32 9.92 -1.26 -1.31 116.55 126.36 2kym n ASP 33 Ca -0.02 0.40 -0.20 0.00 -0.53 0.00 0.00 54.79 54.44 2kym n ASP 33 Cb 0.49 -4.56 -0.08 0.00 -0.64 0.00 0.00 41.12 36.34 2kym n ASP 33 CO 0.00 0.00 0.00 -1.22 0.13 0.00 0.00 177.20 176.11 2kym n TYR 34 N -2.30 -0.08 -0.01 1.24 4.02 -1.26 -4.77 117.16 114.01 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 0.65 -3.40 -0.02 0.00 -0.02 0.00 0.00 39.34 36.55 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 -2.46 1.64 -4.39 -0.72 0.28 -0.42 -4.88 120.64 109.69 2kym n GLU 35 Ca -0.20 -0.01 -0.20 0.00 -0.16 0.00 0.00 57.16 56.58 2kym n GLU 35 Cb 0.66 -1.06 -0.15 0.00 1.43 0.00 0.00 31.44 32.31 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 -2.12 0.95 -0.09 -1.84 0.52 -0.93 -2.85 118.94 112.57 2kym s TRP 36 Ca -0.01 -0.24 0.03 0.00 0.02 0.00 0.00 56.10 55.91 2kym s TRP 36 Cb 0.01 -0.68 -0.01 0.00 -1.15 0.00 0.00 33.47 31.65 2kym s TRP 36 CO 0.10 -0.10 -0.21 -0.06 0.02 0.00 0.00 176.95 176.70 2kym s PHE 37 N 0.19 2.60 -0.80 -1.98 0.08 0.11 -0.05 117.98 118.13 2kym s PHE 37 Ca -0.03 -0.80 -0.20 0.00 0.12 0.00 0.00 56.93 56.01 2kym s PHE 37 Cb -0.09 -1.71 0.10 0.00 -0.57 0.00 0.00 43.02 40.76 2kym s PHE 37 CO 0.00 -0.27 1.04 0.42 -0.10 0.00 0.00 175.22 176.31 2kym s ILE 38 N 0.14 4.56 0.15 0.64 -1.09 0.42 -1.38 121.20 124.65 2kym s ILE 38 Ca -0.11 -1.03 0.09 0.00 -2.23 0.00 0.00 60.65 57.37 2kym s ILE 38 Cb -0.16 -4.73 -0.04 0.00 -1.58 0.00 0.00 42.46 35.95 2kym s ILE 38 CO 0.06 -1.47 -0.14 0.00 -1.23 0.00 0.00 174.94 172.16 2kym s ALA 39 N 3.28 2.81 0.21 9.38 0.00 -1.26 0.08 121.76 136.26 2kym s ALA 39 Ca 0.27 -1.42 0.10 0.00 0.00 0.00 0.00 51.96 50.91 2kym s ALA 39 Cb -0.11 -0.68 -0.05 0.00 0.00 0.00 0.00 23.12 22.29 2kym s ALA 39 CO -0.01 0.53 -0.20 -1.59 0.00 0.00 0.00 175.76 174.49 2kym s LYS 40 N -2.50 1.47 0.24 0.00 -2.85 -0.31 -3.04 119.74 112.75 2kym s LYS 40 Ca 0.22 -1.57 -0.30 0.00 -1.00 0.00 0.00 55.97 53.32 2kym s LYS 40 Cb -0.10 -1.57 -0.09 0.00 -2.06 0.00 0.00 37.83 34.02 2kym s LYS 40 CO 0.13 0.31 1.27 -1.25 0.10 0.00 0.00 175.35 175.91 2kym s PRO 41 N -3.10 4.42 -0.18 1.78 0.04 -1.26 -1.38 135.00 135.32 2kym s PRO 41 Ca 0.22 2.05 -0.03 0.00 0.04 0.00 0.00 61.00 63.28 2kym s PRO 41 Cb -0.05 -3.16 -0.10 0.00 0.04 0.00 0.00 34.50 31.22 2kym s PRO 41 CO 0.10 -0.16 -0.19 -0.89 0.04 0.00 0.00 177.00 175.89 2kym n ILE 42 N 1.94 1.03 0.00 0.56 5.41 -1.20 -4.79 119.36 122.31 2kym n ILE 42 Ca 0.03 -0.34 0.00 0.00 1.00 0.00 0.00 62.75 63.44 2kym n ILE 42 Cb 0.43 -1.39 0.00 0.00 -0.71 0.00 0.00 39.64 37.97 2kym n ILE 42 CO 0.00 0.00 0.00 -3.20 0.00 0.00 0.00 176.55 173.35 2kym n ASN 43 N -3.37 0.00 -3.41 4.38 4.05 -1.26 -4.81 115.26 110.85 2kym n ASN 43 Ca -0.34 0.76 -0.22 0.00 0.45 0.00 0.00 54.58 55.24 2kym n ASN 43 Cb 0.81 -0.26 0.15 0.00 1.23 0.00 0.00 39.78 41.71 2kym n ASN 43 CO 0.00 0.00 0.00 -2.11 -3.05 0.00 0.00 177.26 172.10 2kym n ARG 43 N -1.41 -0.99 -4.01 1.20 1.85 -1.26 -5.07 116.66 106.97 2kym n ARG 43 Ca 0.00 -1.52 -0.31 0.00 -1.00 0.00 0.00 57.85 55.02 2kym n ARG 43 Cb 0.00 -1.02 -0.16 0.00 -1.05 0.00 0.00 32.46 30.23 2kym n ARG 43 CO 0.00 0.00 0.00 -0.51 -0.01 0.00 0.00 177.63 177.11 2kym s LEU 44 N 0.00 2.50 0.00 2.89 2.01 -1.26 -4.89 118.68 119.93 2kym s LEU 44 Ca 0.56 -0.99 0.00 0.00 0.01 0.00 0.00 54.13 53.70 2kym s LEU 44 Cb -0.02 -1.30 0.00 0.00 0.01 0.00 0.00 46.19 44.89 2kym s LEU 44 CO 0.39 -0.15 0.00 0.61 1.01 0.00 0.00 176.35 178.21 2kym n GLY 45 N 4.64 -0.71 0.00 -3.19 0.00 -1.26 -5.18 105.19 99.48 2kym n GLY 45 Ca -0.15 0.16 0.00 0.00 0.00 0.00 0.00 46.02 46.03 2kym n GLY 45 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2kym n GLY 46 N 0.46 1.85 3.77 -0.02 0.00 -1.26 -5.13 105.19 104.86 2kym n GLY 46 Ca 0.00 -0.92 -0.40 0.00 0.00 0.00 0.00 46.02 44.70 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 -2.00 4.42 0.00 1.61 0.04 -1.26 -4.31 135.00 133.50 2kym s PRO 47 Ca 0.00 2.04 0.00 0.00 0.04 0.00 0.00 61.00 63.08 2kym s PRO 47 Cb 0.00 -3.07 0.00 0.00 0.04 0.00 0.00 34.50 31.47 2kym s PRO 47 CO 0.00 -0.07 0.00 0.41 0.04 0.00 0.00 177.00 177.38 2kym n GLY 48 N 0.92 5.12 3.12 0.56 0.00 -1.17 -5.00 105.19 108.74 2kym n GLY 48 Ca 0.00 -1.10 -0.12 0.00 0.00 0.00 0.00 46.02 44.80 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 0.02 -0.02 0.99 0.20 -1.26 -4.35 118.68 114.26 2kym s LEU 49 Ca 0.00 0.68 0.01 0.00 0.69 0.00 0.00 54.13 55.51 2kym s LEU 49 Cb 0.00 0.95 0.02 0.00 -0.43 0.00 0.00 46.19 46.72 2kym s LEU 49 CO 0.00 -0.20 -0.02 0.54 -0.29 0.00 0.00 176.35 176.38 2kym s VAL 50 N 1.68 0.30 0.74 1.68 0.11 -0.48 -4.12 120.40 120.31 2kym s VAL 50 Ca -0.06 -0.05 -0.12 0.00 -2.93 0.00 0.00 61.98 58.82 2kym s VAL 50 Cb -0.10 -0.33 0.04 0.00 -1.53 0.00 0.00 36.38 34.46 2kym s VAL 50 CO -0.10 0.14 1.10 -2.16 -3.33 0.00 0.00 175.10 170.75 2kym s PRO 51 N 0.60 2.43 0.54 1.54 0.04 -1.26 0.04 135.00 138.92 2kym s PRO 51 Ca -0.06 1.24 0.33 0.00 0.04 0.00 0.00 61.00 62.54 2kym s PRO 51 Cb -0.10 -1.91 1.34 0.00 0.04 0.00 0.00 34.50 33.87 2kym s PRO 51 CO -0.01 -1.52 1.98 0.28 0.04 0.00 0.00 177.00 177.77 2kym h VAL 52 N -0.76 0.08 -0.02 -0.36 2.07 -1.86 -2.30 116.25 113.10 2kym h VAL 52 Ca -0.45 -0.57 0.00 0.00 0.82 0.00 0.00 66.70 66.50 2kym h VAL 52 Cb 1.24 1.53 0.00 0.00 -1.52 0.00 0.00 31.29 32.53 2kym h VAL 52 CO 0.52 0.03 0.00 -1.20 0.02 0.00 0.00 177.57 176.94 2kym n SER 53 N -3.14 0.21 -0.50 0.57 7.64 -1.26 -3.13 113.62 114.02 2kym n SER 53 Ca 0.00 -1.42 0.04 0.00 1.01 0.00 0.00 58.87 58.51 2kym n SER 53 Cb 0.31 -0.01 0.06 0.00 -1.01 0.00 0.00 64.21 63.57 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 -0.67 0.00 -3.69 1.43 4.02 -0.87 -4.92 117.16 112.46 2kym n TYR 54 Ca 0.15 -0.51 -0.10 0.00 -0.01 0.00 0.00 57.90 57.43 2kym n TYR 54 Cb 0.10 -0.11 -0.05 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 -1.19 0.08 -0.12 -0.72 -7.23 -1.18 -3.85 120.40 106.19 2kym s VAL 55 Ca 0.18 -0.73 0.00 0.00 -1.81 0.00 0.00 61.98 59.61 2kym s VAL 55 Cb 0.17 -1.24 0.02 0.00 0.56 0.00 0.00 36.38 35.89 2kym s VAL 55 CO -0.02 -0.38 -0.10 -0.60 -0.31 0.00 0.00 175.10 173.69 2kym s ARG 56 N -3.82 1.82 -0.06 4.82 3.52 0.82 -4.82 118.95 121.24 2kym s ARG 56 Ca 0.04 -0.37 -0.30 0.00 -0.13 0.00 0.00 55.73 54.97 2kym s ARG 56 Cb 0.02 -1.77 -0.04 0.00 -1.56 0.00 0.00 34.95 31.60 2kym s ARG 56 CO -0.11 -0.24 1.38 0.42 -0.81 0.00 0.00 175.30 175.94 2kym s ILE 57 N 1.57 3.91 0.24 4.11 -1.09 -1.26 -1.21 121.20 127.47 2kym s ILE 57 Ca 0.04 1.21 -0.01 0.00 -2.23 0.00 0.00 60.65 59.66 2kym s ILE 57 Cb -0.13 -3.78 -0.03 0.00 -1.58 0.00 0.00 42.46 36.94 2kym s ILE 57 CO -0.08 -0.05 0.22 0.27 -1.23 0.00 0.00 174.94 174.07 2kym s ILE 58 N 2.92 0.00 -0.10 2.92 -4.36 -0.86 -4.39 121.20 117.32 2kym s ILE 58 Ca 0.62 -1.91 0.04 0.00 -0.26 0.00 0.00 60.65 59.14 2kym s ILE 58 Cb -0.28 -2.47 -0.00 0.00 1.25 0.00 0.00 42.46 40.95 2kym s ILE 58 CO 0.23 0.00 -0.23 -0.62 0.24 0.00 0.00 174.94 174.56 2kym s ASP 59 N -3.18 3.18 0.56 4.36 2.15 -1.22 -3.30 116.67 119.22 2kym s ASP 59 Ca 0.37 -0.54 0.28 0.00 0.43 0.00 0.00 52.55 53.09 2kym s ASP 59 Cb 0.05 -1.43 1.48 0.00 -0.30 0.00 0.00 42.92 42.72 2kym s ASP 59 CO 0.15 0.16 1.96 -0.07 -0.17 0.00 0.00 175.17 177.19 2kym h LEU 60 N 6.74 0.00 0.03 -1.34 3.38 -1.89 0.32 115.31 122.55 2kym h LEU 60 Ca -0.20 0.00 -0.29 0.00 0.09 0.00 0.00 57.88 57.48 2kym h LEU 60 Cb 1.23 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.95 2kym h LEU 60 CO 0.48 0.00 -1.61 0.24 0.09 0.00 0.00 178.44 177.64 2kym h MET 61 N 0.00 0.06 -2.14 1.13 2.86 -1.94 -3.41 114.93 111.48 2kym h MET 61 Ca 0.24 -0.10 -0.57 0.00 -2.06 0.00 0.00 59.70 57.21 2kym h MET 61 Cb 1.10 0.04 -0.39 0.00 0.06 0.00 0.00 31.60 32.40 2kym h MET 61 CO -0.00 0.71 -1.05 -0.25 1.06 0.00 0.00 176.91 177.38 2kym n ASP 62 N -3.18 0.02 0.00 1.22 8.00 0.35 -4.94 116.55 118.02 2kym n ASP 62 Ca -0.16 -2.59 0.07 0.00 0.71 0.00 0.00 54.79 52.82 2kym n ASP 62 Cb 1.03 -0.61 0.32 0.00 -0.02 0.00 0.00 41.12 41.85 2kym n ASP 62 CO 0.00 0.00 0.00 -0.81 -0.39 0.00 0.00 177.20 176.00 2kym n PRO 63 N 1.92 0.07 -0.00 -0.24 -0.04 0.86 -2.04 135.00 135.53 2kym n PRO 63 Ca 0.24 0.22 0.09 0.00 -0.04 0.00 0.00 63.50 64.01 2kym n PRO 63 Cb 0.51 -1.50 -0.11 0.00 -0.04 0.00 0.00 33.50 32.36 2kym n PRO 63 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2kym n ALA 64 N -1.43 3.85 -0.02 0.55 0.00 -1.26 -3.91 120.51 118.29 2kym n ALA 64 Ca 0.05 -0.48 -0.12 0.00 0.00 0.00 0.00 53.44 52.88 2kym n ALA 64 Cb 0.15 -0.64 -0.10 0.00 0.00 0.00 0.00 19.45 18.86 2kym n ALA 64 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 2kym h LYS 65 N 0.00 -0.06 -0.76 0.00 3.64 -1.79 -3.29 116.57 114.32 2kym h LYS 65 Ca 0.00 0.00 -0.14 0.00 -1.27 0.00 0.00 60.65 59.25 2kym h LYS 65 Cb 0.53 0.01 -0.08 0.00 -0.41 0.00 0.00 32.23 32.28 2kym h LYS 65 CO 0.00 0.59 0.17 0.66 -2.27 0.00 0.00 179.45 178.60 2kym n TYR 66 N -4.77 2.02 0.27 1.91 4.02 -1.23 -4.17 117.16 115.21 2kym n TYR 66 Ca -0.08 -0.93 0.12 0.00 -0.01 0.00 0.00 57.90 56.99 2kym n TYR 66 Cb 0.33 -0.57 0.12 0.00 -0.02 0.00 0.00 39.34 39.19 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 2.91 0.71 0.00 -0.72 0.00 -1.68 -3.31 119.26 117.17 2kym h ALA 67 Ca 0.17 0.00 -0.11 0.00 0.00 0.00 0.00 54.91 54.97 2kym h ALA 67 Cb 2.01 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 19.78 2kym h ALA 67 CO 0.58 0.00 -1.62 0.45 0.00 0.00 0.00 179.25 178.66 2kym n SER 68 N -2.67 0.50 -4.45 0.00 2.88 -1.26 -4.97 113.62 103.65 2kym n SER 68 Ca 0.02 0.21 -0.36 0.00 -1.33 0.00 0.00 58.87 57.42 2kym n SER 68 Cb 0.51 0.85 0.08 0.00 -0.75 0.00 0.00 64.21 64.90 2kym n SER 68 CO 0.00 0.00 0.00 0.55 -1.23 0.00 0.00 175.04 174.36 2kym n VAL 69 N -2.65 1.46 -3.70 2.46 3.14 -1.25 -4.96 118.33 112.83 2kym n VAL 69 Ca -0.09 -0.36 -0.39 0.00 -2.96 0.00 0.00 64.34 60.54 2kym n VAL 69 Cb 0.74 -0.71 -0.12 0.00 -1.06 0.00 0.00 33.84 32.69 2kym n VAL 69 CO 0.00 0.00 0.00 -0.62 -6.46 0.00 0.00 176.83 169.75 2kym s ASP 70 N -1.56 5.44 0.14 6.55 -1.08 -1.26 -4.96 116.67 119.94 2kym s ASP 70 Ca 0.64 -1.08 -0.09 0.00 -0.52 0.00 0.00 52.55 51.50 2kym s ASP 70 Cb -0.32 -1.92 -0.04 0.00 -1.46 0.00 0.00 42.92 39.17 2kym s ASP 70 CO 0.60 -0.34 1.42 0.71 0.52 0.00 0.00 175.17 178.08 2kym h THR 71 N 6.07 1.29 -0.84 1.71 1.35 -1.87 -3.18 112.91 117.43 2kym h THR 71 Ca -0.24 -1.79 0.10 0.00 -0.55 0.00 0.00 66.41 63.92 2kym h THR 71 Cb 1.09 1.72 -0.07 0.00 -1.73 0.00 0.00 68.15 69.16 2kym h THR 71 CO 0.62 0.58 0.49 0.22 -0.25 0.00 0.00 175.52 177.18 2kym h TYR 72 N 0.59 0.88 -2.08 4.73 3.20 -1.91 -3.39 116.97 118.99 2kym h TYR 72 Ca 0.00 0.03 -0.54 0.00 3.14 0.00 0.00 58.73 61.37 2kym h TYR 72 Cb 1.18 -0.27 -0.01 0.00 1.54 0.00 0.00 36.73 39.17 2kym h TYR 72 CO 0.07 0.36 1.45 0.34 -1.64 0.00 0.00 178.16 178.73 2kym s ASP 73 N -5.62 5.27 0.55 -2.11 2.15 -1.20 -4.82 116.67 110.89 2kym s ASP 73 Ca -0.12 1.25 0.30 0.00 0.43 0.00 0.00 52.55 54.41 2kym s ASP 73 Cb 0.20 -2.52 1.46 0.00 -0.30 0.00 0.00 42.92 41.76 2kym s ASP 73 CO 0.78 -2.21 1.91 0.08 -0.17 0.00 0.00 175.17 175.57 2kym h ARG 74 N 15.66 0.00 0.41 4.34 -0.00 -1.87 -1.09 114.38 131.83 2kym h ARG 74 Ca -0.32 0.00 -0.02 0.00 -0.00 0.00 0.00 59.98 59.64 2kym h ARG 74 Cb 1.21 0.00 0.00 0.00 -0.00 0.00 0.00 29.97 31.19 2kym h ARG 74 CO 1.08 0.00 -0.20 0.93 -0.00 0.00 0.00 179.97 181.78 2kym h GLU 75 N 0.00 -0.53 0.45 0.08 5.08 -1.92 -1.31 114.58 116.43 2kym h GLU 75 Ca 0.35 0.04 -0.02 0.00 -1.00 0.00 0.00 59.36 58.73 2kym h GLU 75 Cb 1.47 0.12 -0.00 0.00 0.50 0.00 0.00 28.75 30.84 2kym h GLU 75 CO -0.00 -0.22 -0.26 1.96 -1.00 0.00 0.00 179.01 179.49 2kym h GLN 76 N -0.90 -0.64 -0.69 2.33 4.20 -1.54 -1.63 115.11 116.24 2kym h GLN 76 Ca -0.06 0.04 0.16 0.00 0.06 0.00 0.00 58.65 58.85 2kym h GLN 76 Cb 0.56 0.15 -0.04 0.00 0.30 0.00 0.00 27.48 28.44 2kym h GLN 76 CO 0.09 -0.43 0.47 -0.24 -0.67 0.00 0.00 178.83 178.06 2kym h VAL 77 N -0.66 0.76 0.37 -0.54 3.04 -1.34 -1.34 116.25 116.55 2kym h VAL 77 Ca -0.05 -0.09 -0.02 0.00 -1.01 0.00 0.00 66.70 65.53 2kym h VAL 77 Cb 0.53 0.48 0.00 0.00 -2.01 0.00 0.00 31.29 30.29 2kym h VAL 77 CO 0.07 0.05 -0.18 0.24 -1.01 0.00 0.00 177.57 176.74 2kym h MET 78 N 0.26 -0.48 -0.92 4.17 2.86 -0.66 -1.45 114.93 118.72 2kym h MET 78 Ca 0.34 0.03 0.12 0.00 -2.06 0.00 0.00 59.70 58.13 2kym h MET 78 Cb 0.95 0.11 -0.07 0.00 0.06 0.00 0.00 31.60 32.64 2kym h MET 78 CO -0.08 -0.16 0.59 0.87 1.06 0.00 0.00 176.91 179.19 2kym h LYS 79 N -0.86 0.82 0.36 1.72 1.57 -0.70 0.25 116.57 119.74 2kym h LYS 79 Ca -0.05 -0.05 -0.02 0.00 -1.87 0.00 0.00 60.65 58.66 2kym h LYS 79 Cb 0.54 -0.19 0.00 0.00 0.08 0.00 0.00 32.23 32.66 2kym h LYS 79 CO 0.08 0.55 -0.17 0.82 -0.57 0.00 0.00 179.45 180.15 2kym h ILE 80 N 0.85 0.62 -0.58 1.86 2.04 -1.23 0.25 117.51 121.32 2kym h ILE 80 Ca 0.45 -0.46 -0.01 0.00 1.00 0.00 0.00 64.86 65.83 2kym h ILE 80 Cb 0.53 0.85 -0.03 0.00 -0.74 0.00 0.00 36.82 37.43 2kym h ILE 80 CO -0.21 0.09 0.32 0.40 0.00 0.00 0.00 178.15 178.75 2kym h ILE 81 N -0.76 1.17 -0.07 -0.67 2.04 -0.82 0.10 117.51 118.51 2kym h ILE 81 Ca -0.05 -0.42 -0.04 0.00 1.00 0.00 0.00 64.86 65.35 2kym h ILE 81 Cb 0.51 0.39 -0.00 0.00 -0.74 0.00 0.00 36.82 36.98 2kym h ILE 81 CO 0.08 0.19 -0.12 -0.78 0.00 0.00 0.00 178.15 177.52 2kym h ASP 82 N 0.80 0.23 0.20 1.72 1.82 -0.46 -0.37 116.42 120.37 2kym h ASP 82 Ca 0.21 -0.54 -0.01 0.00 -0.39 0.00 0.00 57.03 56.29 2kym h ASP 82 Cb 0.01 -0.07 0.00 0.00 0.68 0.00 0.00 39.33 39.95 2kym h ASP 82 CO -0.04 0.73 -0.10 -0.33 -1.61 0.00 0.00 179.24 177.90 2kym h GLU 83 N -0.26 -0.26 0.00 0.28 5.08 -0.25 -2.45 114.58 116.72 2kym h GLU 83 Ca 0.01 0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.38 2kym h GLU 83 Cb 0.69 0.06 0.00 0.00 0.50 0.00 0.00 28.75 30.00 2kym h GLU 83 CO 0.03 -0.06 0.00 0.74 -1.00 0.00 0.00 179.01 178.72 2kym h PHE 84 N -0.43 0.00 -5.32 4.33 -1.00 -0.90 -3.47 116.94 110.16 2kym h PHE 84 Ca -0.03 0.00 -0.19 0.00 2.81 0.00 0.00 57.97 60.56 2kym h PHE 84 Cb 0.33 0.00 0.15 0.00 3.61 0.00 0.00 35.95 40.04 2kym h PHE 84 CO -0.02 0.00 -0.65 1.63 -1.61 0.00 0.00 178.31 177.66 2kym n LYS 85 N -2.42 -1.96 -3.35 1.51 4.76 -0.30 -4.57 118.16 111.83 2kym n LYS 85 Ca 0.01 0.96 -0.38 0.00 -2.87 0.00 0.00 58.31 56.03 2kym n LYS 85 Cb 0.20 -5.62 -0.06 0.00 -1.84 0.00 0.00 35.03 27.71 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 -3.29 5.13 1.01 -0.18 1.01 -0.32 -4.73 121.20 119.83 2kym s ILE 86 Ca 0.35 0.94 -0.12 0.00 0.00 0.00 0.00 60.65 61.81 2kym s ILE 86 Cb -0.05 -3.80 0.20 0.00 0.01 0.00 0.00 42.46 38.82 2kym s ILE 86 CO 0.71 0.39 1.09 -2.16 0.00 0.00 0.00 174.94 174.97 2kym s PRO 87 N 0.20 0.32 0.54 2.79 0.04 -1.26 -4.78 135.00 132.85 2kym s PRO 87 Ca 0.25 0.48 0.07 0.00 0.04 0.00 0.00 61.00 61.85 2kym s PRO 87 Cb -0.16 -1.73 0.05 0.00 0.04 0.00 0.00 34.50 32.71 2kym s PRO 87 CO 0.11 -2.80 0.54 0.95 0.04 0.00 0.00 177.00 175.84 2kym s THR 88 N -2.97 1.92 0.08 1.26 -4.23 -1.26 -1.67 115.64 108.78 2kym s THR 88 Ca 0.66 -1.30 -0.27 0.00 -1.18 0.00 0.00 61.69 59.59 2kym s THR 88 Cb -0.19 -2.23 -0.16 0.00 1.34 0.00 0.00 72.50 71.26 2kym s THR 88 CO 0.58 0.00 1.69 0.58 -0.54 0.00 0.00 174.62 176.93 2kym h VAL 89 N 0.58 0.71 -0.10 2.29 2.07 -1.79 0.16 116.25 120.17 2kym h VAL 89 Ca -0.35 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.21 2kym h VAL 89 Cb 1.29 0.71 -0.05 0.00 -1.52 0.00 0.00 31.29 31.73 2kym h VAL 89 CO 0.51 0.00 -0.19 -0.33 0.02 0.00 0.00 177.57 177.58 2kym h GLU 90 N -0.38 -0.25 -0.85 1.57 5.08 -1.96 0.24 114.58 118.03 2kym h GLU 90 Ca -0.04 0.02 -0.00 0.00 -1.00 0.00 0.00 59.36 58.34 2kym h GLU 90 Cb 0.30 0.06 -0.04 0.00 0.50 0.00 0.00 28.75 29.56 2kym h GLU 90 CO 0.05 -0.17 0.52 1.96 -1.00 0.00 0.00 179.01 180.38 2kym h GLN 91 N -0.26 1.15 -0.47 2.33 4.20 -1.94 -1.31 115.11 118.80 2kym h GLN 91 Ca 0.09 -0.09 -0.10 0.00 0.06 0.00 0.00 58.65 58.61 2kym h GLN 91 Cb 0.39 -0.24 -0.02 0.00 0.30 0.00 0.00 27.48 27.90 2kym h GLN 91 CO -0.25 0.79 -0.09 2.35 -0.67 0.00 0.00 178.83 180.96 2kym h TRP 92 N 1.17 0.94 -0.04 2.96 7.01 0.18 -0.91 115.95 127.26 2kym h TRP 92 Ca 0.31 -0.17 -0.01 0.00 2.11 0.00 0.00 58.89 61.13 2kym h TRP 92 Cb -0.07 -0.24 -0.00 0.00 -2.10 0.00 0.00 29.16 26.75 2kym h TRP 92 CO 0.00 0.90 -0.00 0.87 -2.79 0.00 0.00 178.44 177.42 2kym h LYS 93 N 0.77 0.07 -0.58 2.65 1.79 0.05 -1.24 116.57 120.08 2kym h LYS 93 Ca 0.13 -0.02 -0.01 0.00 -2.18 0.00 0.00 60.65 58.56 2kym h LYS 93 Cb 0.59 -0.00 -0.03 0.00 -1.58 0.00 0.00 32.23 31.21 2kym h LYS 93 CO 0.04 0.39 0.31 0.22 -1.08 0.00 0.00 179.45 179.33 2kym h ASP 94 N -0.27 0.73 0.28 0.86 3.58 -1.22 -0.37 116.42 120.02 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 0.37 -0.19 0.00 0.00 1.72 0.00 0.00 39.33 41.23 2kym h ASP 94 CO 0.00 0.62 -0.14 1.56 -2.88 0.00 0.00 179.24 178.41 2kym h GLN 95 N 0.78 -0.36 -0.59 0.28 1.08 -1.14 -0.64 115.11 114.52 2kym h GLN 95 Ca 0.20 0.02 0.01 0.00 -1.45 0.00 0.00 58.65 57.43 2kym h GLN 95 Cb 0.06 0.08 -0.03 0.00 -0.05 0.00 0.00 27.48 27.54 2kym h GLN 95 CO -0.03 -0.21 0.39 1.79 -0.95 0.00 0.00 178.83 179.82 2kym h THR 96 N -0.43 1.15 0.37 -0.54 1.35 -1.12 0.25 112.91 113.94 2kym h THR 96 Ca -0.04 -0.27 -0.02 0.00 -0.55 0.00 0.00 66.41 65.53 2kym h THR 96 Cb 0.33 0.28 0.00 0.00 -1.73 0.00 0.00 68.15 67.03 2kym h THR 96 CO 0.06 0.15 -0.18 0.03 -0.25 0.00 0.00 175.52 175.33 2kym h ARG 97 N 0.80 -0.48 0.00 4.72 2.47 -0.77 0.27 114.38 121.40 2kym h ARG 97 Ca 0.22 0.03 0.00 0.00 -1.26 0.00 0.00 59.98 58.97 2kym h ARG 97 Cb -0.09 0.11 0.00 0.00 -1.65 0.00 0.00 29.97 28.34 2kym h ARG 97 CO -0.05 -0.18 0.00 0.07 0.56 0.00 0.00 179.97 180.37 2kym h ARG 98 N -0.77 0.00 0.00 0.04 0.11 -0.92 -0.91 114.38 111.93 2kym h ARG 98 Ca -0.05 0.00 -0.18 0.00 0.10 0.00 0.00 59.98 59.85 2kym h ARG 98 Cb 0.52 0.00 -0.03 0.00 1.11 0.00 0.00 29.97 31.57 2kym h ARG 98 CO 0.08 0.00 -1.26 -0.92 0.10 0.00 0.00 179.97 177.97 2kym h TYR 99 N 0.00 0.00 0.00 4.08 3.20 -0.31 -3.33 116.97 120.61 2kym h TYR 99 Ca 0.00 0.00 -0.15 0.00 3.14 0.00 0.00 58.73 61.72 2kym h TYR 99 Cb 0.44 0.00 -0.02 0.00 1.54 0.00 0.00 36.73 38.68 2kym h TYR 99 CO 0.00 0.69 -1.17 0.87 -1.64 0.00 0.00 178.16 176.90 2kym h LYS 100 N 0.00 0.00 -6.66 1.82 1.57 -0.03 -3.47 116.57 109.79 2kym h LYS 100 Ca -0.14 0.00 -0.47 0.00 -1.87 0.00 0.00 60.65 58.17 2kym h LYS 100 Cb 1.65 0.00 0.23 0.00 0.08 0.00 0.00 32.23 34.19 2kym h LYS 100 CO 0.06 0.33 -1.08 -0.85 -0.57 0.00 0.00 179.45 177.35 2kym n GLU 101 N -2.96 -1.41 -1.63 3.15 0.28 -0.38 -4.74 120.64 112.94 2kym n GLU 101 Ca -0.06 -0.39 -0.49 0.00 -0.16 0.00 0.00 57.16 56.06 2kym n GLU 101 Cb 0.80 -1.69 -0.05 0.00 1.43 0.00 0.00 31.44 31.93 2kym n GLU 101 CO 0.00 0.00 0.00 0.45 -0.16 0.00 0.00 177.13 177.42 2kym n SER 102 N -1.47 3.11 -1.25 -1.84 2.88 -1.26 -4.92 113.62 108.87 2kym n SER 102 Ca 0.01 0.78 -0.02 0.00 -1.33 0.00 0.00 58.87 58.31 2kym n SER 102 Cb 0.62 -1.36 -0.01 0.00 -0.75 0.00 0.00 64.21 62.71 2kym n SER 102 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 2kym n SER 103 N 7.79 -0.11 -4.65 -3.46 3.41 -1.26 -5.13 113.62 110.21 2kym n SER 103 Ca 0.27 -1.25 -0.43 0.00 -0.26 0.00 0.00 58.87 57.21 2kym n SER 103 Cb 0.29 0.24 -0.00 0.00 -0.26 0.00 0.00 64.21 64.48 2kym n SER 103 CO 0.00 0.00 0.00 -0.38 -0.16 0.00 0.00 175.04 174.50 2kym n ILE 104 N -0.07 2.15 -3.60 -1.33 2.08 -1.26 -4.98 119.36 112.35 2kym n ILE 104 Ca 0.01 -0.50 -0.05 0.00 0.56 0.00 0.00 62.75 62.77 2kym n ILE 104 Cb 0.07 -1.31 -0.03 0.00 -0.75 0.00 0.00 39.64 37.63 2kym n ILE 104 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 2kym s GLN 105 N -1.85 0.31 -0.28 0.38 1.03 -1.26 -5.14 119.66 112.85 2kym s GLN 105 Ca 0.59 -0.07 -0.01 0.00 0.04 0.00 0.00 55.36 55.91 2kym s GLN 105 Cb -0.60 0.14 0.13 0.00 0.03 0.00 0.00 33.01 32.72 2kym s GLN 105 CO 0.60 -0.13 0.29 0.96 -2.54 0.00 0.00 175.29 174.47 2kym s ILE 106 N -2.07 -0.40 -1.88 3.63 -0.00 -1.26 -5.11 121.20 114.12 2kym s ILE 106 Ca 0.08 -0.45 0.00 0.00 -0.00 0.00 0.00 60.65 60.28 2kym s ILE 106 Cb -0.01 -0.96 0.00 0.00 -0.00 0.00 0.00 42.46 41.49 2kym s ILE 106 CO -0.05 -0.44 0.00 0.61 -0.00 0.00 0.00 174.94 175.06 2kym n GLY 107 N 5.31 -0.59 3.47 6.27 0.00 -1.26 -5.13 105.19 113.27 2kym n GLY 107 Ca -0.02 -0.49 -0.33 0.00 0.00 0.00 0.00 46.02 45.18 2kym n GLY 107 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2kym s ASN 108 N -4.00 4.11 0.00 1.61 4.22 -1.26 -5.07 114.94 114.54 2kym s ASN 108 Ca 0.00 -0.19 0.00 0.00 -2.14 0.00 0.00 52.86 50.53 2kym s ASN 108 Cb 0.00 -1.01 0.00 0.00 1.28 0.00 0.00 41.25 41.52 2kym s ASN 108 CO 0.00 0.32 0.00 0.61 -2.04 0.00 0.00 177.10 175.99 2kym n GLY 109 N 2.50 -0.61 3.34 0.45 0.00 -1.26 -5.18 105.19 104.42 2kym n GLY 109 Ca -0.17 -0.61 -0.18 0.00 0.00 0.00 0.00 46.02 45.06 2kym n GLY 109 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2kym s HIS 110 N -3.39 1.56 0.00 1.61 3.76 -1.26 -5.18 115.29 112.39 2kym s HIS 110 Ca 0.00 -1.56 0.00 0.00 -0.15 0.00 0.00 55.06 53.35 2kym s HIS 110 Cb 0.00 -0.54 0.00 0.00 1.11 0.00 0.00 32.58 33.15 2kym s HIS 110 CO 0.00 -0.94 0.00 0.41 -0.85 0.00 0.00 174.74 173.36 2kym n GLY 111 N -0.60 2.55 1.67 -2.22 0.00 -1.26 -5.10 105.19 100.23 2kym n GLY 111 Ca 0.06 -2.11 -0.13 0.00 0.00 0.00 0.00 46.02 43.84 2kym n GLY 111 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2kym n GLN 112 N -0.55 0.77 -4.30 1.61 3.00 -1.26 -5.13 117.38 111.53 2kym n GLN 112 Ca 0.00 -1.72 -0.18 0.00 -0.01 0.00 0.00 57.00 55.09 2kym n GLN 112 Cb 0.00 0.93 -0.09 0.00 0.00 0.00 0.00 30.24 31.08 2kym n GLN 112 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.06 175.94 2kym s SER 113 N -2.25 1.32 0.29 1.08 0.01 -1.26 -5.09 113.70 107.80 2kym s SER 113 Ca 0.10 -1.57 0.04 0.00 1.31 0.00 0.00 55.95 55.83 2kym s SER 113 Cb 0.00 0.42 0.04 0.00 0.21 0.00 0.00 66.02 66.69 2kym s SER 113 CO 0.07 -0.91 0.33 0.00 0.41 0.00 0.00 173.24 173.14 2kym n GLN 114 N -0.54 0.91 0.00 12.44 1.13 -1.26 -5.12 117.38 124.95 2kym n GLN 114 Ca 0.02 -1.67 0.00 0.00 -1.94 0.00 0.00 57.00 53.41 2kym n GLN 114 Cb 0.65 0.01 0.00 0.00 0.11 0.00 0.00 30.24 31.00 2kym n GLN 114 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2kym n GLY 115 N 1.46 0.59 3.69 1.08 0.00 -1.26 -4.98 105.19 105.77 2kym n GLY 115 Ca 0.04 -0.01 -0.22 0.00 0.00 0.00 0.00 46.02 45.83 2kym n GLY 115 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 2kym n LEU 116 N 0.00 -0.63 0.00 0.99 -0.00 -1.26 -5.39 117.00 110.71 2kym n LEU 116 Ca 0.00 -0.85 0.00 0.00 -0.00 0.00 0.00 56.01 55.16 2kym n LEU 116 Cb 0.00 -1.07 0.00 0.00 -0.00 0.00 0.00 43.42 42.35 2kym n LEU 116 CO 0.00 0.27 0.20 1.21 -0.00 0.00 0.00 177.39 179.07