#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 3.11 -0.69 3.17 0.00 -1.26 -4.96 121.76 121.13 2kym s ALA -1 Ca 0.00 -0.13 -0.26 0.00 0.00 0.00 0.00 51.96 51.57 2kym s ALA -1 Cb 0.00 -3.04 -0.03 0.00 0.00 0.00 0.00 23.12 20.05 2kym s ALA -1 CO 0.00 -0.68 1.88 -1.25 0.00 0.00 0.00 175.76 175.71 2kym s PRO 1 N -5.16 2.60 -0.12 0.00 0.04 -1.26 -4.97 135.00 126.13 2kym s PRO 1 Ca 0.55 0.38 -0.07 0.00 0.04 0.00 0.00 61.00 61.89 2kym s PRO 1 Cb -0.11 -4.56 -0.04 0.00 0.04 0.00 0.00 34.50 29.83 2kym s PRO 1 CO 0.53 -2.90 0.14 -0.48 0.04 0.00 0.00 177.00 174.33 2kym s LEU 2 N 9.35 4.36 0.29 -3.56 0.05 -1.26 -4.80 118.68 123.11 2kym s LEU 2 Ca 0.68 0.44 0.09 0.00 0.05 0.00 0.00 54.13 55.39 2kym s LEU 2 Cb -0.11 -2.06 -0.06 0.00 -2.05 0.00 0.00 46.19 41.91 2kym s LEU 2 CO 0.15 0.39 -0.12 -0.36 -0.55 0.00 0.00 176.35 175.87 2kym s PHE 3 N -0.93 2.16 0.16 3.48 0.40 -1.26 -3.31 117.98 118.68 2kym s PHE 3 Ca 0.14 -0.53 0.02 0.00 -0.60 0.00 0.00 56.93 55.97 2kym s PHE 3 Cb -0.12 -1.14 -0.05 0.00 0.51 0.00 0.00 43.02 42.23 2kym s PHE 3 CO 0.04 0.50 -0.01 0.00 0.70 0.00 0.00 175.22 176.44 2kym s ALA 4 N -2.75 1.27 -0.10 5.36 0.00 -0.47 -2.70 121.76 122.38 2kym s ALA 4 Ca 0.30 -1.54 0.01 0.00 0.00 0.00 0.00 51.96 50.73 2kym s ALA 4 Cb 0.01 0.46 0.02 0.00 0.00 0.00 0.00 23.12 23.60 2kym s ALA 4 CO 0.14 -0.30 -0.12 0.54 0.00 0.00 0.00 175.76 176.02 2kym s VAL 5 N -3.65 1.26 0.45 0.00 0.11 -0.44 -1.24 120.40 116.90 2kym s VAL 5 Ca 0.21 -0.49 -0.23 0.00 -2.93 0.00 0.00 61.98 58.53 2kym s VAL 5 Cb 0.06 -1.19 -0.07 0.00 -1.53 0.00 0.00 36.38 33.65 2kym s VAL 5 CO 0.02 0.40 1.19 0.42 -3.33 0.00 0.00 175.10 173.80 2kym s THR 6 N 1.12 2.98 -0.18 5.04 -4.23 -1.04 -0.53 115.64 118.81 2kym s THR 6 Ca -0.05 0.76 0.06 0.00 -1.18 0.00 0.00 61.69 61.28 2kym s THR 6 Cb -0.14 -3.40 -0.08 0.00 1.34 0.00 0.00 72.50 70.22 2kym s THR 6 CO -0.02 0.02 0.21 0.18 -0.54 0.00 0.00 174.62 174.46 2kym n LEU 7 N -0.39 0.17 -4.24 4.79 4.77 -1.24 -0.05 117.00 120.82 2kym n LEU 7 Ca 0.07 -0.31 -0.14 0.00 -0.03 0.00 0.00 56.01 55.60 2kym n LEU 7 Cb 0.47 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.46 2kym n LEU 7 CO 0.49 0.04 -0.24 -0.31 -1.33 0.00 0.00 177.39 176.04 2kym s TYR 8 N -1.88 1.29 -0.53 -1.77 1.51 -1.26 -4.63 117.35 110.08 2kym s TYR 8 Ca 0.01 -1.33 -0.20 0.00 -1.01 0.00 0.00 57.07 54.54 2kym s TYR 8 Cb 0.04 -0.66 0.06 0.00 -0.11 0.00 0.00 41.96 41.29 2kym s TYR 8 CO 0.25 -0.55 0.70 -2.00 -1.11 0.00 0.00 175.55 172.83 2kym s GLU 9 N -4.11 3.15 -0.57 -0.62 2.56 -1.26 -3.05 118.70 114.80 2kym s GLU 9 Ca 0.39 -0.81 -0.24 0.00 0.00 0.00 0.00 54.97 54.31 2kym s GLU 9 Cb 0.07 -4.11 0.05 0.00 2.00 0.00 0.00 34.13 32.14 2kym s GLU 9 CO 0.13 -1.31 0.94 0.12 -0.56 0.00 0.00 175.26 174.57 2kym s PHE 10 N 2.91 2.77 -0.70 5.30 5.36 -0.49 -4.95 117.98 128.17 2kym s PHE 10 Ca 0.18 -0.15 -0.27 0.00 -0.96 0.00 0.00 56.93 55.73 2kym s PHE 10 Cb -0.18 -4.10 0.03 0.00 -0.34 0.00 0.00 43.02 38.43 2kym s PHE 10 CO 0.13 -1.41 1.23 0.15 -1.46 0.00 0.00 175.22 173.85 2kym s LYS 11 N 3.95 3.23 0.36 10.12 1.02 -1.26 -2.59 119.74 134.58 2kym s LYS 11 Ca 0.28 -0.23 -0.26 0.00 0.02 0.00 0.00 55.97 55.78 2kym s LYS 11 Cb -0.14 -4.16 -0.12 0.00 -0.52 0.00 0.00 37.83 32.90 2kym s LYS 11 CO 0.17 -2.03 1.05 0.00 -0.92 0.00 0.00 175.35 173.61 2kym n ALA 12 N 9.04 0.20 -0.04 5.17 0.00 -1.26 -4.92 120.51 128.71 2kym n ALA 12 Ca 0.03 0.31 -0.03 0.00 0.00 0.00 0.00 53.44 53.75 2kym n ALA 12 Cb 0.49 -2.08 -0.07 0.00 0.00 0.00 0.00 19.45 17.79 2kym n ALA 12 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 2kym n GLU 13 N 0.44 2.33 -4.12 0.00 0.28 -1.26 -4.98 120.64 113.33 2kym n GLU 13 Ca 0.09 -0.01 -0.24 0.00 -0.16 0.00 0.00 57.16 56.84 2kym n GLU 13 Cb 0.36 -1.22 -0.06 0.00 1.43 0.00 0.00 31.44 31.95 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 -2.25 0.74 -0.09 3.44 5.12 -1.26 -5.02 116.66 117.33 2kym n ARG 14 Ca -0.12 -3.00 -0.07 0.00 -1.93 0.00 0.00 57.85 52.73 2kym n ARG 14 Cb 0.71 1.35 0.11 0.00 -1.16 0.00 0.00 32.46 33.47 2kym n ARG 14 CO 0.00 0.00 0.00 -0.44 -1.93 0.00 0.00 177.63 175.26 2kym h ASP 15 N 1.27 0.77 0.38 0.55 3.32 -2.04 -2.74 116.42 117.93 2kym h ASP 15 Ca -0.30 -0.25 -0.08 0.00 0.02 0.00 0.00 57.03 56.42 2kym h ASP 15 Cb 1.05 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 40.38 2kym h ASP 15 CO 0.48 0.93 -0.39 -2.24 -1.72 0.00 0.00 179.24 176.30 2kym h ASP 16 N 0.69 0.02 -3.53 6.45 2.03 -1.96 -3.43 116.42 116.70 2kym h ASP 16 Ca 0.11 -0.01 -0.52 0.00 -0.73 0.00 0.00 57.03 55.88 2kym h ASP 16 Cb 0.64 -0.01 -0.03 0.00 -0.83 0.00 0.00 39.33 39.11 2kym h ASP 16 CO 0.05 0.41 0.29 -1.61 -1.03 0.00 0.00 179.24 177.35 2kym s GLU 17 N -4.15 4.64 0.09 4.15 0.41 -1.03 -3.03 118.70 119.78 2kym s GLU 17 Ca -0.03 1.32 0.05 0.00 -0.41 0.00 0.00 54.97 55.90 2kym s GLU 17 Cb 0.14 -3.36 -0.04 0.00 -1.78 0.00 0.00 34.13 29.09 2kym s GLU 17 CO 0.73 0.26 0.02 -1.17 -0.49 0.00 0.00 175.26 174.61 2kym s LEU 18 N -0.11 3.53 -0.21 1.80 2.96 -1.26 -4.62 118.68 120.77 2kym s LEU 18 Ca 0.44 -0.15 -0.18 0.00 -0.22 0.00 0.00 54.13 54.02 2kym s LEU 18 Cb -0.23 -2.25 -0.03 0.00 0.50 0.00 0.00 46.19 44.18 2kym s LEU 18 CO 0.28 0.17 0.52 -0.62 -1.32 0.00 0.00 176.35 175.38 2kym s ASP 19 N -2.34 6.54 0.11 3.68 2.15 -1.26 -4.04 116.67 121.50 2kym s ASP 19 Ca 0.27 0.65 0.04 0.00 0.43 0.00 0.00 52.55 53.93 2kym s ASP 19 Cb -0.12 -2.29 -0.04 0.00 -0.30 0.00 0.00 42.92 40.17 2kym s ASP 19 CO 0.19 -0.21 -0.10 0.54 -0.17 0.00 0.00 175.17 175.43 2kym s VAL 20 N 1.79 0.95 0.25 1.11 0.11 -1.07 -5.00 120.40 118.55 2kym s VAL 20 Ca 0.24 -1.74 0.10 0.00 -2.93 0.00 0.00 61.98 57.64 2kym s VAL 20 Cb -0.15 -1.48 -0.04 0.00 -1.53 0.00 0.00 36.38 33.18 2kym s VAL 20 CO 0.09 -0.63 -0.07 -0.94 -3.33 0.00 0.00 175.10 170.23 2kym s SER 21 N -2.63 4.25 -0.12 3.54 1.04 -1.26 -1.40 113.70 117.12 2kym s SER 21 Ca 0.08 -0.71 -0.29 0.00 0.48 0.00 0.00 55.95 55.50 2kym s SER 21 Cb -0.01 -0.69 -0.04 0.00 0.10 0.00 0.00 66.02 65.38 2kym s SER 21 CO -0.00 0.04 1.55 -2.16 0.98 0.00 0.00 173.24 173.64 2kym s PRO 22 N -3.42 4.10 0.00 4.02 0.04 -1.17 -2.56 135.00 136.01 2kym s PRO 22 Ca 0.29 1.92 0.00 0.00 0.04 0.00 0.00 61.00 63.26 2kym s PRO 22 Cb -0.07 -3.94 0.00 0.00 0.04 0.00 0.00 34.50 30.53 2kym s PRO 22 CO 0.18 -0.92 0.00 0.41 0.04 0.00 0.00 177.00 176.70 2kym n GLY 23 N 4.13 0.62 3.90 0.56 0.00 0.93 -4.90 105.19 110.43 2kym n GLY 23 Ca 0.17 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.90 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 -0.70 3.25 -0.18 1.61 0.41 -1.06 -4.88 118.70 117.16 2kym s GLU 24 Ca 0.00 0.32 -0.09 0.00 -0.41 0.00 0.00 54.97 54.80 2kym s GLU 24 Cb 0.00 -2.21 -0.05 0.00 -1.78 0.00 0.00 34.13 30.10 2kym s GLU 24 CO 0.00 -0.60 0.12 -0.80 -0.49 0.00 0.00 175.26 173.49 2kym s ASN 25 N -4.23 6.13 0.09 -0.19 -0.87 -1.26 -2.48 114.94 112.13 2kym s ASN 25 Ca 0.53 0.25 0.06 0.00 -1.57 0.00 0.00 52.86 52.13 2kym s ASN 25 Cb -0.11 -2.05 -0.03 0.00 -0.02 0.00 0.00 41.25 39.04 2kym s ASN 25 CO 0.48 0.23 -0.15 -0.76 -2.57 0.00 0.00 177.10 174.34 2kym s LEU 26 N 0.04 2.33 -0.31 0.60 1.43 -0.37 -3.74 118.68 118.66 2kym s LEU 26 Ca 0.09 -0.70 -0.06 0.00 -1.03 0.00 0.00 54.13 52.43 2kym s LEU 26 Cb -0.11 -0.58 0.02 0.00 0.03 0.00 0.00 46.19 45.55 2kym s LEU 26 CO -0.00 -0.08 0.07 -0.55 0.23 0.00 0.00 176.35 176.02 2kym s SER 27 N -2.03 5.11 0.31 2.29 0.15 -0.54 -1.37 113.70 117.62 2kym s SER 27 Ca 0.03 -0.91 -0.25 0.00 0.70 0.00 0.00 55.95 55.52 2kym s SER 27 Cb -0.08 -1.85 -0.10 0.00 -1.71 0.00 0.00 66.02 62.28 2kym s SER 27 CO 0.03 -0.24 0.92 -0.63 1.20 0.00 0.00 173.24 174.52 2kym s ILE 28 N 1.44 4.25 -0.04 6.45 1.01 -1.21 -0.80 121.20 132.30 2kym s ILE 28 Ca 0.00 1.76 0.00 0.00 0.00 0.00 0.00 60.65 62.42 2kym s ILE 28 Cb -0.18 -3.99 -0.02 0.00 0.01 0.00 0.00 42.46 38.28 2kym s ILE 28 CO 0.02 0.15 -0.03 0.00 0.00 0.00 0.00 174.94 175.07 2kym s ALA 30 N -2.08 -1.28 0.51 0.00 0.00 -1.25 -4.68 121.76 112.98 2kym s ALA 30 Ca -0.05 -0.31 0.01 0.00 0.00 0.00 0.00 51.96 51.62 2kym s ALA 30 Cb 0.01 0.73 -0.02 0.00 0.00 0.00 0.00 23.12 23.85 2kym s ALA 30 CO 0.09 -1.03 0.00 -3.38 0.00 0.00 0.00 175.76 171.44 2kym s HIS 31 N -3.03 1.90 -0.28 0.00 -0.00 -0.89 -0.19 115.29 112.79 2kym s HIS 31 Ca 0.14 -0.94 -0.00 0.00 -0.00 0.00 0.00 55.06 54.26 2kym s HIS 31 Cb -0.04 -1.62 0.14 0.00 -0.00 0.00 0.00 32.58 31.06 2kym s HIS 31 CO 0.07 0.24 0.32 -0.47 -0.00 0.00 0.00 174.74 174.89 2kym s TYR 32 N -2.87 -0.57 -1.78 0.38 6.14 0.49 -1.79 117.35 117.35 2kym s TYR 32 Ca 0.07 -0.00 0.00 0.00 0.64 0.00 0.00 57.07 57.78 2kym s TYR 32 Cb 0.02 -0.37 0.00 0.00 0.42 0.00 0.00 41.96 42.03 2kym s TYR 32 CO 0.04 -0.90 0.00 -0.25 0.64 0.00 0.00 175.55 175.07 2kym n ASP 33 N 5.32 -5.60 -1.53 4.32 9.92 -1.26 -1.29 116.55 126.44 2kym n ASP 33 Ca -0.02 0.42 -0.19 0.00 -0.53 0.00 0.00 54.79 54.46 2kym n ASP 33 Cb 0.47 -4.58 -0.08 0.00 -0.64 0.00 0.00 41.12 36.29 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 -2.32 -0.06 0.09 1.24 4.02 -1.26 -4.78 117.16 114.09 2kym n TYR 34 Ca -0.17 0.00 0.01 0.00 -0.01 0.00 0.00 57.90 57.73 2kym n TYR 34 Cb 0.65 -3.29 -0.01 0.00 -0.02 0.00 0.00 39.34 36.67 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 -2.47 5.91 -3.74 -0.72 0.28 -0.41 -4.89 120.64 114.60 2kym n GLU 35 Ca -0.20 -0.04 -0.12 0.00 -0.16 0.00 0.00 57.16 56.64 2kym n GLU 35 Cb 0.64 -0.62 -0.11 0.00 1.43 0.00 0.00 31.44 32.78 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 -1.11 -0.41 -0.12 -1.84 0.52 -1.08 -4.09 118.94 110.82 2kym s TRP 36 Ca 0.01 0.96 0.02 0.00 0.02 0.00 0.00 56.10 57.11 2kym s TRP 36 Cb 0.01 0.14 -0.01 0.00 -1.15 0.00 0.00 33.47 32.47 2kym s TRP 36 CO 0.07 -0.22 -0.17 -0.06 0.02 0.00 0.00 176.95 176.58 2kym s PHE 37 N 0.66 2.71 -0.84 -1.98 0.08 0.96 -0.38 117.98 119.19 2kym s PHE 37 Ca -0.04 -0.79 -0.23 0.00 0.12 0.00 0.00 56.93 55.98 2kym s PHE 37 Cb -0.05 -1.78 0.06 0.00 -0.57 0.00 0.00 43.02 40.68 2kym s PHE 37 CO -0.04 -0.28 1.23 0.42 -0.10 0.00 0.00 175.22 176.45 2kym s ILE 38 N 0.32 4.10 0.09 0.64 -1.09 0.74 -1.31 121.20 124.68 2kym s ILE 38 Ca -0.14 -0.48 0.06 0.00 -2.23 0.00 0.00 60.65 57.86 2kym s ILE 38 Cb -0.17 -4.89 -0.04 0.00 -1.58 0.00 0.00 42.46 35.79 2kym s ILE 38 CO 0.07 -1.73 -0.05 0.00 -1.23 0.00 0.00 174.94 172.00 2kym s ALA 39 N 4.58 3.12 0.19 9.38 0.00 -1.26 -0.01 121.76 137.75 2kym s ALA 39 Ca 0.35 -1.17 0.09 0.00 0.00 0.00 0.00 51.96 51.23 2kym s ALA 39 Cb -0.07 -1.05 -0.04 0.00 0.00 0.00 0.00 23.12 21.96 2kym s ALA 39 CO 0.02 0.67 -0.17 -1.59 0.00 0.00 0.00 175.76 174.68 2kym s LYS 40 N -2.21 1.33 0.23 0.00 -2.85 0.01 -2.34 119.74 113.91 2kym s LYS 40 Ca 0.23 -1.50 -0.30 0.00 -1.00 0.00 0.00 55.97 53.40 2kym s LYS 40 Cb -0.11 -1.31 -0.09 0.00 -2.06 0.00 0.00 37.83 34.26 2kym s LYS 40 CO 0.15 0.25 1.28 -1.25 0.10 0.00 0.00 175.35 175.88 2kym s PRO 41 N -3.14 4.41 -0.05 1.78 0.04 -1.26 -1.47 135.00 135.31 2kym s PRO 41 Ca 0.19 2.05 0.21 0.00 0.04 0.00 0.00 61.00 63.49 2kym s PRO 41 Cb -0.04 -3.17 -0.28 0.00 0.04 0.00 0.00 34.50 31.04 2kym s PRO 41 CO 0.07 -0.18 0.43 -0.89 0.04 0.00 0.00 177.00 176.47 2kym n ILE 42 N 2.16 0.48 -0.00 0.56 5.41 -1.25 -4.69 119.36 122.04 2kym n ILE 42 Ca 0.04 -0.61 -0.00 0.00 1.00 0.00 0.00 62.75 63.18 2kym n ILE 42 Cb 0.43 -0.19 -0.00 0.00 -0.71 0.00 0.00 39.64 39.17 2kym n ILE 42 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 176.55 177.33 2kym h ASN 43 N 0.00 0.00 -4.11 4.38 4.21 -1.92 -3.48 115.58 114.66 2kym h ASN 43 Ca -0.15 0.00 -0.50 0.00 1.21 0.00 0.00 56.30 56.86 2kym h ASN 43 Cb 1.36 0.00 0.16 0.00 -1.12 0.00 0.00 38.32 38.73 2kym h ASN 43 CO 0.01 0.03 0.23 0.00 -1.29 0.00 0.00 177.43 176.41 2kym s ARG 43 N -1.04 1.22 -0.08 0.81 1.70 -1.26 -4.95 118.95 115.35 2kym s ARG 43 Ca -0.00 1.13 0.16 0.00 -0.47 0.00 0.00 55.73 56.55 2kym s ARG 43 Cb 0.00 -1.78 0.56 0.00 -0.57 0.00 0.00 34.95 33.16 2kym s ARG 43 CO 0.01 -2.35 1.47 1.47 -1.08 0.00 0.00 175.30 174.82 2kym n LEU 44 N -4.00 3.99 0.00 -1.89 -0.00 -1.26 -4.80 117.00 109.04 2kym n LEU 44 Ca 0.08 -2.38 0.00 0.00 -0.00 0.00 0.00 56.01 53.71 2kym n LEU 44 Cb 0.54 -0.46 0.00 0.00 -0.00 0.00 0.00 43.42 43.49 2kym n LEU 44 CO 0.53 0.78 0.05 0.61 -0.00 0.00 0.00 177.39 179.36 2kym n GLY 45 N 0.69 -1.78 0.00 1.47 0.00 -1.26 -5.02 105.19 99.28 2kym n GLY 45 Ca 0.21 0.07 0.00 0.00 0.00 0.00 0.00 46.02 46.30 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 -0.14 0.48 3.77 -0.02 0.00 -1.26 -5.13 105.19 102.89 2kym n GLY 46 Ca 0.00 -0.89 -0.36 0.00 0.00 0.00 0.00 46.02 44.77 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 3.49 0.00 1.61 0.04 -1.26 -4.27 135.00 132.61 2kym s PRO 47 Ca 0.00 1.66 0.00 0.00 0.04 0.00 0.00 61.00 62.70 2kym s PRO 47 Cb 0.00 -2.14 0.00 0.00 0.04 0.00 0.00 34.50 32.40 2kym s PRO 47 CO 0.00 -0.75 0.00 0.41 0.04 0.00 0.00 177.00 176.70 2kym n GLY 48 N 0.25 5.53 3.05 0.56 0.00 -0.99 -4.95 105.19 108.64 2kym n GLY 48 Ca 0.10 -1.13 -0.13 0.00 0.00 0.00 0.00 46.02 44.86 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 0.53 -0.04 0.99 0.20 -1.17 -4.09 118.68 115.10 2kym s LEU 49 Ca 0.00 0.50 -0.02 0.00 0.69 0.00 0.00 54.13 55.29 2kym s LEU 49 Cb 0.00 0.71 0.03 0.00 -0.43 0.00 0.00 46.19 46.49 2kym s LEU 49 CO 0.00 -0.15 0.10 0.54 -0.29 0.00 0.00 176.35 176.55 2kym s VAL 50 N 1.11 -0.03 0.60 1.68 0.11 -0.43 -4.27 120.40 119.17 2kym s VAL 50 Ca -0.08 0.12 -0.17 0.00 -2.93 0.00 0.00 61.98 58.92 2kym s VAL 50 Cb -0.09 -0.17 -0.03 0.00 -1.53 0.00 0.00 36.38 34.56 2kym s VAL 50 CO -0.07 0.05 1.12 -2.16 -3.33 0.00 0.00 175.10 170.71 2kym s PRO 51 N 0.75 3.06 0.58 1.54 0.04 -1.26 -0.03 135.00 139.68 2kym s PRO 51 Ca -0.06 1.49 0.35 0.00 0.04 0.00 0.00 61.00 62.83 2kym s PRO 51 Cb -0.08 -1.98 1.76 0.00 0.04 0.00 0.00 34.50 34.24 2kym s PRO 51 CO -0.03 -1.06 2.15 0.28 0.04 0.00 0.00 177.00 178.38 2kym h VAL 52 N 0.57 0.21 0.00 -0.36 2.07 -1.90 -1.14 116.25 115.70 2kym h VAL 52 Ca -0.48 -0.35 0.00 0.00 0.82 0.00 0.00 66.70 66.69 2kym h VAL 52 Cb 1.25 1.28 0.00 0.00 -1.52 0.00 0.00 31.29 32.30 2kym h VAL 52 CO 0.55 0.04 0.00 -0.24 0.02 0.00 0.00 177.57 177.95 2kym n SER 53 N -3.29 0.00 -0.15 0.57 2.88 -1.26 -2.76 113.62 109.61 2kym n SER 53 Ca -0.01 -0.44 0.06 0.00 -1.33 0.00 0.00 58.87 57.15 2kym n SER 53 Cb 0.20 -0.15 0.09 0.00 -0.75 0.00 0.00 64.21 63.59 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 -1.15 0.00 -3.79 0.66 4.02 -0.44 -5.00 117.16 111.46 2kym n TYR 54 Ca 0.16 -0.68 -0.09 0.00 -0.01 0.00 0.00 57.90 57.28 2kym n TYR 54 Cb 0.15 -0.11 -0.06 0.00 -0.02 0.00 0.00 39.34 39.30 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 0.12 -0.20 -0.72 -7.23 -1.11 -3.66 120.40 105.69 2kym s VAL 55 Ca 0.20 -0.99 0.00 0.00 -1.81 0.00 0.00 61.98 59.37 2kym s VAL 55 Cb 0.17 -1.28 0.05 0.00 0.56 0.00 0.00 36.38 35.89 2kym s VAL 55 CO 0.02 -0.55 -0.05 -0.60 -0.31 0.00 0.00 175.10 173.61 2kym s ARG 56 N -3.81 1.54 -0.17 4.82 3.52 0.31 -4.80 118.95 120.36 2kym s ARG 56 Ca 0.04 -0.77 -0.29 0.00 -0.13 0.00 0.00 55.73 54.58 2kym s ARG 56 Cb 0.04 -2.35 -0.05 0.00 -1.56 0.00 0.00 34.95 31.04 2kym s ARG 56 CO -0.11 -0.52 1.89 0.42 -0.81 0.00 0.00 175.30 176.16 2kym s ILE 57 N 1.51 3.33 -0.02 4.11 -1.09 -1.26 -1.32 121.20 126.46 2kym s ILE 57 Ca -0.03 0.36 0.02 0.00 -2.23 0.00 0.00 60.65 58.78 2kym s ILE 57 Cb -0.17 -3.35 -0.00 0.00 -1.58 0.00 0.00 42.46 37.36 2kym s ILE 57 CO -0.07 -0.16 -0.08 0.27 -1.23 0.00 0.00 174.94 173.67 2kym s ILE 58 N 6.11 0.66 -0.12 2.92 -4.36 -1.10 -4.40 121.20 120.91 2kym s ILE 58 Ca 0.84 -0.32 -0.30 0.00 -0.26 0.00 0.00 60.65 60.62 2kym s ILE 58 Cb -0.31 -0.57 -0.02 0.00 1.25 0.00 0.00 42.46 42.80 2kym s ILE 58 CO 0.34 0.20 1.25 -0.62 0.24 0.00 0.00 174.94 176.35 2kym s ASP 59 N 0.04 6.98 0.47 4.36 -1.08 -1.23 -3.98 116.67 122.24 2kym s ASP 59 Ca -0.00 1.76 0.23 0.00 -0.52 0.00 0.00 52.55 54.01 2kym s ASP 59 Cb -0.06 -2.55 1.25 0.00 -1.46 0.00 0.00 42.92 40.10 2kym s ASP 59 CO -0.00 -0.69 1.88 -0.07 0.52 0.00 0.00 175.17 176.81 2kym h LEU 60 N 9.08 0.23 0.00 -1.34 3.38 -1.87 0.37 115.31 125.16 2kym h LEU 60 Ca -0.30 0.02 -0.21 0.00 0.09 0.00 0.00 57.88 57.48 2kym h LEU 60 Cb 1.13 -0.02 -0.03 0.00 0.09 0.00 0.00 40.66 41.83 2kym h LEU 60 CO 0.93 0.09 -1.14 0.24 0.09 0.00 0.00 178.44 178.66 2kym h MET 61 N 0.23 0.00 -1.94 1.13 2.86 -1.95 -3.41 114.93 111.85 2kym h MET 61 Ca 0.43 0.00 -0.47 0.00 -2.06 0.00 0.00 59.70 57.60 2kym h MET 61 Cb 1.32 0.00 -0.32 0.00 0.06 0.00 0.00 31.60 32.66 2kym h MET 61 CO -0.10 0.78 -0.86 -0.25 1.06 0.00 0.00 176.91 177.53 2kym n ASP 62 N -3.23 -1.22 0.00 1.22 9.92 0.82 -4.96 116.55 119.09 2kym n ASP 62 Ca -0.04 -2.55 0.07 0.00 -0.53 0.00 0.00 54.79 51.74 2kym n ASP 62 Cb 0.94 0.06 0.34 0.00 -0.64 0.00 0.00 41.12 41.81 2kym n ASP 62 CO 0.00 0.00 0.00 -0.81 0.13 0.00 0.00 177.20 176.52 2kym n PRO 63 N 2.72 0.11 0.00 -0.24 -0.04 0.92 -1.92 135.00 136.56 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 0.51 -1.50 0.11 0.00 -0.04 0.00 0.00 33.50 32.58 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 3.83 -0.08 0.55 0.00 -1.26 -3.42 120.51 118.74 2kym n ALA 64 Ca 0.05 -0.50 -0.14 0.00 0.00 0.00 0.00 53.44 52.85 2kym n ALA 64 Cb 0.14 -0.95 -0.10 0.00 0.00 0.00 0.00 19.45 18.54 2kym n ALA 64 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 2kym h LYS 65 N 0.75 0.00 -0.77 0.00 1.57 -1.75 -3.36 116.57 113.01 2kym h LYS 65 Ca 0.00 0.00 -0.17 0.00 -1.87 0.00 0.00 60.65 58.61 2kym h LYS 65 Cb 0.55 0.00 -0.10 0.00 0.08 0.00 0.00 32.23 32.76 2kym h LYS 65 CO 0.00 0.79 0.22 0.66 -0.57 0.00 0.00 179.45 180.55 2kym n TYR 66 N -4.57 2.18 0.41 -1.35 4.02 -1.25 -4.21 117.16 112.39 2kym n TYR 66 Ca -0.16 -1.03 0.12 0.00 -0.01 0.00 0.00 57.90 56.82 2kym n TYR 66 Cb 0.47 -0.62 0.19 0.00 -0.02 0.00 0.00 39.34 39.36 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 2.79 0.76 0.00 -0.72 0.00 -1.71 -3.29 119.26 117.10 2kym h ALA 67 Ca 0.21 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.12 2kym h ALA 67 Cb 2.13 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.92 2kym h ALA 67 CO 0.64 0.00 -1.64 0.43 0.00 0.00 0.00 179.25 178.68 2kym n SER 68 N -2.49 0.30 -4.57 0.00 7.64 -1.26 -4.98 113.62 108.27 2kym n SER 68 Ca 0.03 -0.08 -0.41 0.00 1.01 0.00 0.00 58.87 59.42 2kym n SER 68 Cb 0.48 1.53 0.01 0.00 -1.01 0.00 0.00 64.21 65.23 2kym n SER 68 CO 0.00 0.00 0.00 0.55 -3.01 0.00 0.00 175.04 172.58 2kym n VAL 69 N -2.21 2.39 -3.30 0.44 3.14 -1.24 -4.91 118.33 112.64 2kym n VAL 69 Ca -0.02 -0.50 -0.46 0.00 -2.96 0.00 0.00 64.34 60.40 2kym n VAL 69 Cb 0.53 -0.98 -0.01 0.00 -1.06 0.00 0.00 33.84 32.31 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 -0.85 6.91 0.43 6.55 1.11 -1.26 -4.89 116.67 124.67 2kym s ASP 70 Ca 0.64 -2.90 0.18 0.00 0.18 0.00 0.00 52.55 50.66 2kym s ASP 70 Cb -0.56 -2.23 1.11 0.00 1.07 0.00 0.00 42.92 42.32 2kym s ASP 70 CO 0.56 -0.53 1.86 0.71 1.18 0.00 0.00 175.17 178.95 2kym h THR 71 N 4.55 0.67 -0.55 -1.27 1.35 -1.87 -0.23 112.91 115.56 2kym h THR 71 Ca 0.14 -0.13 0.03 0.00 -0.55 0.00 0.00 66.41 65.90 2kym h THR 71 Cb 0.99 0.26 -0.04 0.00 -1.73 0.00 0.00 68.15 67.63 2kym h THR 71 CO 0.85 0.07 0.32 0.22 -0.25 0.00 0.00 175.52 176.73 2kym h TYR 72 N 0.38 0.59 -2.24 4.73 3.20 -1.90 -3.40 116.97 118.32 2kym h TYR 72 Ca 0.47 0.02 -0.58 0.00 3.14 0.00 0.00 58.73 61.78 2kym h TYR 72 Cb 1.21 -0.19 -0.01 0.00 1.54 0.00 0.00 36.73 39.28 2kym h TYR 72 CO -0.00 0.32 1.41 -0.51 -1.64 0.00 0.00 178.16 177.74 2kym s ASP 73 N -5.59 5.56 0.58 -2.11 1.01 -0.10 -4.82 116.67 111.21 2kym s ASP 73 Ca -0.13 1.57 0.28 0.00 0.71 0.00 0.00 52.55 54.98 2kym s ASP 73 Cb 0.14 -2.52 1.55 0.00 1.01 0.00 0.00 42.92 43.10 2kym s ASP 73 CO 0.74 -1.93 2.00 0.08 0.21 0.00 0.00 175.17 176.28 2kym h ARG 74 N 14.46 0.00 0.19 8.23 -0.00 -1.84 -1.57 114.38 133.86 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 1.21 0.00 0.00 0.00 -0.00 0.00 0.00 29.97 31.18 2kym h ARG 74 CO 1.01 0.00 -0.09 0.93 -0.00 0.00 0.00 179.97 181.82 2kym h GLU 75 N 0.00 -0.24 0.62 0.08 5.08 -1.91 -1.46 114.58 116.75 2kym h GLU 75 Ca 0.16 0.02 -0.03 0.00 -1.00 0.00 0.00 59.36 58.51 2kym h GLU 75 Cb 0.84 0.06 0.01 0.00 0.50 0.00 0.00 28.75 30.16 2kym h GLU 75 CO -0.00 0.09 -0.30 1.96 -1.00 0.00 0.00 179.01 179.76 2kym h GLN 76 N -0.60 -0.81 -0.69 2.33 4.20 -1.57 -1.77 115.11 116.20 2kym h GLN 76 Ca -0.03 0.05 0.18 0.00 0.06 0.00 0.00 58.65 58.92 2kym h GLN 76 Cb 0.45 0.18 -0.04 0.00 0.30 0.00 0.00 27.48 28.37 2kym h GLN 76 CO 0.04 -0.52 0.48 -0.24 -0.67 0.00 0.00 178.83 177.92 2kym h VAL 77 N -0.89 0.71 0.40 -0.54 3.04 -1.49 -1.25 116.25 116.24 2kym h VAL 77 Ca -0.09 -0.05 -0.02 0.00 -1.01 0.00 0.00 66.70 65.54 2kym h VAL 77 Cb 0.66 0.56 0.00 0.00 -2.01 0.00 0.00 31.29 30.50 2kym h VAL 77 CO 0.14 0.03 -0.19 0.24 -1.01 0.00 0.00 177.57 176.77 2kym h MET 78 N 0.14 -0.51 -0.88 4.17 2.86 -0.85 -1.44 114.93 118.42 2kym h MET 78 Ca 0.33 0.04 0.12 0.00 -2.06 0.00 0.00 59.70 58.13 2kym h MET 78 Cb 1.11 0.12 -0.07 0.00 0.06 0.00 0.00 31.60 32.82 2kym h MET 78 CO -0.05 -0.20 0.57 0.87 1.06 0.00 0.00 176.91 179.15 2kym h LYS 79 N -0.94 0.74 0.19 1.72 1.57 -0.67 0.18 116.57 119.37 2kym h LYS 79 Ca -0.05 -0.04 -0.01 0.00 -1.87 0.00 0.00 60.65 58.67 2kym h LYS 79 Cb 0.55 -0.17 0.00 0.00 0.08 0.00 0.00 32.23 32.69 2kym h LYS 79 CO 0.09 0.49 -0.09 0.82 -0.57 0.00 0.00 179.45 180.19 2kym h ILE 80 N 0.76 0.92 -0.51 1.86 2.04 -1.23 0.56 117.51 121.91 2kym h ILE 80 Ca 0.42 -0.63 -0.02 0.00 1.00 0.00 0.00 64.86 65.63 2kym h ILE 80 Cb 0.57 1.29 -0.03 0.00 -0.74 0.00 0.00 36.82 37.91 2kym h ILE 80 CO -0.19 0.14 0.23 0.40 0.00 0.00 0.00 178.15 178.73 2kym h ILE 81 N -0.57 1.18 -0.09 -0.67 2.04 -0.71 0.86 117.51 119.56 2kym h ILE 81 Ca -0.03 -0.54 -0.04 0.00 1.00 0.00 0.00 64.86 65.26 2kym h ILE 81 Cb 0.42 0.55 -0.00 0.00 -0.74 0.00 0.00 36.82 37.05 2kym h ILE 81 CO 0.04 0.22 -0.09 -0.78 0.00 0.00 0.00 178.15 177.54 2kym h ASP 82 N 0.73 0.24 -0.06 1.72 3.58 -0.59 -0.77 116.42 121.26 2kym h ASP 82 Ca 0.18 -0.49 -0.00 0.00 0.42 0.00 0.00 57.03 57.13 2kym h ASP 82 Cb 0.11 -0.07 -0.00 0.00 1.72 0.00 0.00 39.33 41.09 2kym h ASP 82 CO -0.02 0.68 0.02 -0.33 -2.88 0.00 0.00 179.24 176.70 2kym h GLU 83 N -0.20 0.09 0.00 0.28 4.39 -0.65 -2.41 114.58 116.08 2kym h GLU 83 Ca 0.01 -0.02 0.00 0.00 0.34 0.00 0.00 59.36 59.69 2kym h GLU 83 Cb 0.61 -0.01 0.00 0.00 -0.10 0.00 0.00 28.75 29.25 2kym h GLU 83 CO 0.02 0.27 0.00 1.19 -1.16 0.00 0.00 179.01 179.33 2kym n PHE 84 N -4.93 0.80 -3.29 4.33 3.01 0.28 -4.90 117.46 112.76 2kym n PHE 84 Ca -0.07 0.33 -0.15 0.00 1.01 0.00 0.00 57.45 58.57 2kym n PHE 84 Cb 0.13 -1.04 0.08 0.00 -0.01 0.00 0.00 39.48 38.64 2kym n PHE 84 CO 0.00 0.00 0.00 1.63 1.01 0.00 0.00 176.76 179.40 2kym n LYS 85 N -2.25 -3.99 -3.10 -1.08 4.76 -0.43 -4.55 118.16 107.52 2kym n LYS 85 Ca 0.01 0.84 -0.40 0.00 -2.87 0.00 0.00 58.31 55.90 2kym n LYS 85 Cb 0.19 -5.76 -0.05 0.00 -1.84 0.00 0.00 35.03 27.57 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 -3.37 5.04 0.87 -0.18 1.01 -0.43 -4.62 121.20 119.52 2kym s ILE 86 Ca 0.26 1.26 -0.11 0.00 0.00 0.00 0.00 60.65 62.06 2kym s ILE 86 Cb -0.03 -3.97 0.11 0.00 0.01 0.00 0.00 42.46 38.58 2kym s ILE 86 CO 0.72 0.17 1.09 -2.16 0.00 0.00 0.00 174.94 174.76 2kym s PRO 87 N 1.46 1.50 0.54 2.79 0.04 -1.26 -4.76 135.00 135.31 2kym s PRO 87 Ca 0.32 0.91 0.04 0.00 0.04 0.00 0.00 61.00 62.30 2kym s PRO 87 Cb -0.16 -1.83 0.05 0.00 0.04 0.00 0.00 34.50 32.59 2kym s PRO 87 CO 0.13 -2.10 0.74 0.99 0.04 0.00 0.00 177.00 176.81 2kym s THR 88 N -2.93 2.63 0.14 1.26 2.01 -1.26 -2.10 115.64 115.39 2kym s THR 88 Ca 0.63 -0.80 -0.24 0.00 0.31 0.00 0.00 61.69 61.59 2kym s THR 88 Cb -0.18 -2.83 0.00 0.00 0.01 0.00 0.00 72.50 69.50 2kym s THR 88 CO 0.57 0.00 1.62 0.58 -0.69 0.00 0.00 174.62 176.69 2kym h VAL 89 N 0.17 0.32 -0.61 3.82 2.07 -1.70 0.11 116.25 120.43 2kym h VAL 89 Ca -0.39 0.00 0.12 0.00 0.82 0.00 0.00 66.70 67.25 2kym h VAL 89 Cb 1.29 0.32 -0.10 0.00 -1.52 0.00 0.00 31.29 31.28 2kym h VAL 89 CO 0.47 0.00 0.06 -0.33 0.02 0.00 0.00 177.57 177.79 2kym h GLU 90 N -0.34 0.17 -0.67 1.57 5.08 -1.95 0.30 114.58 118.76 2kym h GLU 90 Ca 0.11 -0.01 -0.03 0.00 -1.00 0.00 0.00 59.36 58.43 2kym h GLU 90 Cb 0.51 -0.04 -0.03 0.00 0.50 0.00 0.00 28.75 29.69 2kym h GLU 90 CO -0.37 0.12 0.28 1.96 -1.00 0.00 0.00 179.01 180.00 2kym h GLN 91 N 0.18 0.98 -0.68 2.33 1.08 -1.70 -1.21 115.11 116.09 2kym h GLN 91 Ca 0.32 -0.17 -0.08 0.00 -1.45 0.00 0.00 58.65 57.27 2kym h GLN 91 Cb 0.51 -0.17 -0.03 0.00 -0.05 0.00 0.00 27.48 27.74 2kym h GLN 91 CO -0.47 0.81 0.11 2.35 -0.95 0.00 0.00 178.83 180.68 2kym h TRP 92 N 0.94 1.20 -0.03 2.96 7.01 0.77 -0.36 115.95 128.43 2kym h TRP 92 Ca 0.22 -0.17 -0.00 0.00 2.11 0.00 0.00 58.89 61.05 2kym h TRP 92 Cb 0.18 -0.33 -0.00 0.00 -2.10 0.00 0.00 29.16 26.91 2kym h TRP 92 CO 0.01 1.00 0.01 0.87 -2.79 0.00 0.00 178.44 177.54 2kym h LYS 93 N 1.05 0.05 -0.63 2.65 1.79 -0.19 -1.28 116.57 120.02 2kym h LYS 93 Ca 0.21 -0.01 -0.04 0.00 -2.18 0.00 0.00 60.65 58.62 2kym h LYS 93 Cb 0.45 -0.01 -0.03 0.00 -1.58 0.00 0.00 32.23 31.06 2kym h LYS 93 CO 0.01 0.28 0.22 0.22 -1.08 0.00 0.00 179.45 179.10 2kym h ASP 94 N -0.18 0.86 0.17 0.86 1.82 -1.16 -0.98 116.42 117.81 2kym h ASP 94 Ca 0.01 -0.13 -0.01 0.00 -0.39 0.00 0.00 57.03 56.51 2kym h ASP 94 Cb 0.25 -0.22 0.00 0.00 0.68 0.00 0.00 39.33 40.04 2kym h ASP 94 CO 0.00 0.79 -0.08 1.56 -1.61 0.00 0.00 179.24 179.90 2kym h GLN 95 N 0.91 -0.22 -0.58 0.28 4.20 -0.93 -1.20 115.11 117.56 2kym h GLN 95 Ca 0.21 0.02 -0.00 0.00 0.06 0.00 0.00 58.65 58.93 2kym h GLN 95 Cb 0.23 0.05 -0.03 0.00 0.30 0.00 0.00 27.48 28.03 2kym h GLN 95 CO -0.01 -0.01 0.34 1.79 -0.67 0.00 0.00 178.83 180.27 2kym h THR 96 N -0.40 1.17 0.64 -0.54 1.35 -1.11 0.15 112.91 114.16 2kym h THR 96 Ca -0.02 -0.40 -0.03 0.00 -0.55 0.00 0.00 66.41 65.41 2kym h THR 96 Cb 0.32 0.39 -0.00 0.00 -1.73 0.00 0.00 68.15 67.12 2kym h THR 96 CO 0.04 0.18 -0.39 0.03 -0.25 0.00 0.00 175.52 175.13 2kym h ARG 97 N 0.78 -0.93 0.00 4.72 2.47 -1.12 -0.71 114.38 119.60 2kym h ARG 97 Ca 0.21 0.06 -0.02 0.00 -1.26 0.00 0.00 59.98 58.97 2kym h ARG 97 Cb -0.01 0.21 -0.00 0.00 -1.65 0.00 0.00 29.97 28.52 2kym h ARG 97 CO -0.04 -0.62 -0.11 0.07 0.56 0.00 0.00 179.97 179.83 2kym h ARG 98 N -0.97 0.00 -0.24 0.04 0.11 -1.15 -2.62 114.38 109.56 2kym h ARG 98 Ca -0.08 0.00 -0.04 0.00 0.10 0.00 0.00 59.98 59.96 2kym h ARG 98 Cb 0.78 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 31.85 2kym h ARG 98 CO 0.08 0.11 -0.02 -0.92 0.10 0.00 0.00 179.97 179.33 2kym h TYR 99 N 0.00 0.48 -0.16 4.08 3.20 -0.20 -2.69 116.97 121.67 2kym h TYR 99 Ca -0.00 -0.09 0.05 0.00 3.14 0.00 0.00 58.73 61.83 2kym h TYR 99 Cb 0.22 -0.12 -0.01 0.00 1.54 0.00 0.00 36.73 38.37 2kym h TYR 99 CO 0.00 0.62 0.17 0.87 -1.64 0.00 0.00 178.16 178.19 2kym h LYS 100 N 0.19 0.00 0.00 1.82 1.57 -0.75 -3.42 116.57 115.98 2kym h LYS 100 Ca 0.07 0.00 -0.10 0.00 -1.87 0.00 0.00 60.65 58.75 2kym h LYS 100 Cb 0.44 0.00 0.05 0.00 0.08 0.00 0.00 32.23 32.81 2kym h LYS 100 CO 0.02 0.00 -0.00 0.39 -0.57 0.00 0.00 179.45 179.28 2kym n GLU 101 N -3.84 -2.05 -3.25 3.15 -0.58 -1.02 -4.16 120.64 108.89 2kym n GLU 101 Ca 0.01 -0.42 -0.23 0.00 -0.42 0.00 0.00 57.16 56.10 2kym n GLU 101 Cb 0.29 -0.45 0.02 0.00 -0.57 0.00 0.00 31.44 30.74 2kym n GLU 101 CO 0.00 0.00 0.00 0.45 -0.48 0.00 0.00 177.13 177.10 2kym n SER 102 N -3.58 -5.24 -4.72 1.62 2.88 -1.26 -4.88 113.62 98.44 2kym n SER 102 Ca 0.04 -0.38 -0.42 0.00 -1.33 0.00 0.00 58.87 56.78 2kym n SER 102 Cb 0.15 -4.24 -0.03 0.00 -0.75 0.00 0.00 64.21 59.34 2kym n SER 102 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 2kym s SER 103 N -2.80 6.43 -1.13 -3.46 0.01 -1.26 -1.36 113.70 110.12 2kym s SER 103 Ca 0.39 2.80 0.00 0.00 1.31 0.00 0.00 55.95 60.45 2kym s SER 103 Cb -0.19 -2.60 0.00 0.00 0.21 0.00 0.00 66.02 63.45 2kym s SER 103 CO 0.48 -0.94 0.00 -0.38 0.41 0.00 0.00 173.24 172.81 2kym n ILE 104 N 4.05 -0.06 -3.96 1.44 5.41 -1.26 -4.99 119.36 119.99 2kym n ILE 104 Ca 0.16 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.91 2kym n ILE 104 Cb 0.36 -1.34 0.00 0.00 -0.71 0.00 0.00 39.64 37.95 2kym n ILE 104 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2kym n GLN 105 N -2.61 1.18 0.06 0.38 1.13 -0.47 -5.12 117.38 111.95 2kym n GLN 105 Ca -0.11 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 54.95 2kym n GLN 105 Cb 0.39 0.00 0.00 0.00 0.11 0.00 0.00 30.24 30.74 2kym n GLN 105 CO 0.00 0.00 0.00 -0.89 -1.44 0.00 0.00 177.06 174.73 2kym n ILE 106 N 0.00 0.37 -3.77 5.09 -0.00 -1.26 -5.06 119.36 114.73 2kym n ILE 106 Ca 0.00 0.12 0.00 0.00 -0.00 0.00 0.00 62.75 62.87 2kym n ILE 106 Cb 0.00 -0.82 0.00 0.00 -0.00 0.00 0.00 39.64 38.82 2kym n ILE 106 CO 0.00 0.00 0.00 0.61 -0.00 0.00 0.00 176.55 177.16 2kym n GLY 107 N 2.48 0.59 3.60 7.39 0.00 -1.26 -4.82 105.19 113.16 2kym n GLY 107 Ca 0.00 -0.87 -0.31 0.00 0.00 0.00 0.00 46.02 44.84 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 4.59 0.00 1.61 4.22 -1.26 -4.81 114.94 115.29 2kym s ASN 108 Ca 0.00 -0.22 0.00 0.00 -2.14 0.00 0.00 52.86 50.50 2kym s ASN 108 Cb 0.00 -1.02 0.00 0.00 1.28 0.00 0.00 41.25 41.51 2kym s ASN 108 CO 0.00 0.24 0.00 0.61 -2.04 0.00 0.00 177.10 175.91 2kym n GLY 109 N 1.22 0.93 0.12 0.45 0.00 -1.26 -4.99 105.19 101.65 2kym n GLY 109 Ca -0.14 -0.03 -0.21 0.00 0.00 0.00 0.00 46.02 45.64 2kym n GLY 109 CO 0.00 0.00 0.00 0.84 0.00 0.00 0.00 173.32 174.16 2kym h HIS 110 N 0.00 0.59 0.00 1.61 2.76 -1.95 -3.49 115.15 114.67 2kym h HIS 110 Ca 0.00 -0.43 0.00 0.00 -2.20 0.00 0.00 60.37 57.74 2kym h HIS 110 Cb 0.00 -0.02 0.00 0.00 1.55 0.00 0.00 27.41 28.94 2kym h HIS 110 CO 0.00 1.41 0.00 0.41 -1.30 0.00 0.00 177.93 178.45 2kym n GLY 111 N 1.69 2.08 3.30 5.26 0.00 -1.26 -4.87 105.19 111.39 2kym n GLY 111 Ca -0.17 -0.54 -0.16 0.00 0.00 0.00 0.00 46.02 45.15 2kym n GLY 111 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2kym s GLN 112 N 0.00 1.35 0.39 1.61 -2.07 -1.26 -5.18 119.66 114.51 2kym s GLN 112 Ca 0.00 -1.72 0.03 0.00 -1.82 0.00 0.00 55.36 51.85 2kym s GLN 112 Cb 0.00 -0.22 0.03 0.00 -1.09 0.00 0.00 33.01 31.73 2kym s GLN 112 CO 0.00 -0.28 0.28 0.43 -1.32 0.00 0.00 175.29 174.40 2kym n SER 113 N -0.42 2.30 -0.03 12.60 7.64 -1.26 -5.10 113.62 129.35 2kym n SER 113 Ca -0.01 -2.37 -0.01 0.00 1.01 0.00 0.00 58.87 57.49 2kym n SER 113 Cb 0.66 -0.01 -0.00 0.00 -1.01 0.00 0.00 64.21 63.84 2kym n SER 113 CO 0.00 0.00 0.00 1.56 -3.01 0.00 0.00 175.04 173.59 2kym h GLN 114 N 0.00 0.00 -3.69 1.43 1.08 -2.03 -3.51 115.11 108.39 2kym h GLN 114 Ca -0.25 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 56.95 2kym h GLN 114 Cb 0.91 0.00 -0.05 0.00 -0.05 0.00 0.00 27.48 28.29 2kym h GLN 114 CO 0.40 0.00 -0.59 0.41 -0.95 0.00 0.00 178.83 178.10 2kym n GLY 115 N 1.74 -3.83 2.71 3.46 0.00 -1.26 -5.08 105.19 102.93 2kym n GLY 115 Ca -0.02 0.40 -0.15 0.00 0.00 0.00 0.00 46.02 46.25 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 0.64 0.00 0.00 0.99 4.77 -1.26 -5.35 117.00 116.79 2kym n LEU 116 Ca -0.15 -1.56 0.13 0.00 -0.03 0.00 0.00 56.01 54.40 2kym n LEU 116 Cb 0.24 -0.40 0.78 0.00 -2.33 0.00 0.00 43.42 41.70 2kym n LEU 116 CO 0.14 -0.78 0.95 -1.84 -1.33 0.00 0.00 177.39 174.54