#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kym s ALA -1 N 0.00 0.08 -1.08 -5.12 0.00 -1.26 -5.08 121.76 109.29 2kym s ALA -1 Ca 0.00 -0.75 -0.23 0.00 0.00 0.00 0.00 51.96 50.98 2kym s ALA -1 Cb 0.00 0.29 -0.07 0.00 0.00 0.00 0.00 23.12 23.34 2kym s ALA -1 CO 0.00 -0.36 1.94 -1.25 0.00 0.00 0.00 175.76 176.09 2kym s PRO 1 N -3.14 2.51 0.48 0.00 0.04 -1.26 -4.95 135.00 128.68 2kym s PRO 1 Ca -0.00 -0.85 -0.23 0.00 0.04 0.00 0.00 61.00 59.95 2kym s PRO 1 Cb 0.02 -5.18 -0.07 0.00 0.04 0.00 0.00 34.50 29.31 2kym s PRO 1 CO -0.07 -3.77 1.23 -0.48 0.04 0.00 0.00 177.00 173.94 2kym s LEU 2 N 10.71 3.99 0.02 -3.56 2.34 -1.26 -4.90 118.68 126.02 2kym s LEU 2 Ca 0.69 2.45 0.04 0.00 0.06 0.00 0.00 54.13 57.38 2kym s LEU 2 Cb -0.03 -4.22 -0.03 0.00 -0.56 0.00 0.00 46.19 41.35 2kym s LEU 2 CO 0.08 -1.08 -0.09 -0.36 -1.06 0.00 0.00 176.35 173.84 2kym s PHE 3 N -1.46 2.81 0.13 3.48 0.40 -1.25 -2.37 117.98 119.73 2kym s PHE 3 Ca 0.65 -0.09 0.07 0.00 -0.60 0.00 0.00 56.93 56.96 2kym s PHE 3 Cb -0.32 -1.56 -0.04 0.00 0.51 0.00 0.00 43.02 41.61 2kym s PHE 3 CO 0.39 0.36 -0.17 0.00 0.70 0.00 0.00 175.22 176.50 2kym s ALA 4 N -1.01 1.76 -0.15 5.36 0.00 -0.31 -2.74 121.76 124.66 2kym s ALA 4 Ca 0.17 -1.35 0.01 0.00 0.00 0.00 0.00 51.96 50.80 2kym s ALA 4 Cb -0.11 -0.16 0.02 0.00 0.00 0.00 0.00 23.12 22.87 2kym s ALA 4 CO 0.08 0.22 -0.19 0.54 0.00 0.00 0.00 175.76 176.41 2kym s VAL 5 N -1.83 1.88 0.38 0.00 0.11 0.24 -0.53 120.40 120.65 2kym s VAL 5 Ca 0.11 -0.85 -0.28 0.00 -2.93 0.00 0.00 61.98 58.03 2kym s VAL 5 Cb -0.07 -1.70 -0.11 0.00 -1.53 0.00 0.00 36.38 32.97 2kym s VAL 5 CO 0.05 0.51 1.46 0.41 -3.33 0.00 0.00 175.10 174.20 2kym n THR 6 N 4.40 2.05 0.25 5.04 -1.04 -1.01 -0.80 114.28 123.17 2kym n THR 6 Ca -0.20 -0.50 0.07 0.00 -2.04 0.00 0.00 64.05 61.39 2kym n THR 6 Cb 0.51 -1.91 -0.11 0.00 -1.82 0.00 0.00 70.33 67.00 2kym n THR 6 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 2kym n LEU 7 N 0.46 0.25 -4.15 -4.42 4.77 -1.20 -0.17 117.00 112.54 2kym n LEU 7 Ca 0.02 -0.18 -0.10 0.00 -0.03 0.00 0.00 56.01 55.72 2kym n LEU 7 Cb 0.39 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.38 2kym n LEU 7 CO 0.63 0.06 -0.31 -0.31 -1.33 0.00 0.00 177.39 176.13 2kym s TYR 8 N -2.82 0.86 -0.57 -1.77 1.51 -1.26 -4.61 117.35 108.69 2kym s TYR 8 Ca -0.02 -1.18 -0.23 0.00 -1.01 0.00 0.00 57.07 54.63 2kym s TYR 8 Cb 0.10 -0.50 0.05 0.00 -0.11 0.00 0.00 41.96 41.50 2kym s TYR 8 CO 0.63 -0.45 0.92 -2.00 -1.11 0.00 0.00 175.55 173.54 2kym s GLU 9 N -4.01 3.28 -0.37 -0.62 2.12 -1.26 -3.41 118.70 114.43 2kym s GLU 9 Ca 0.21 -0.40 -0.09 0.00 0.36 0.00 0.00 54.97 55.05 2kym s GLU 9 Cb 0.07 -4.08 0.04 0.00 0.26 0.00 0.00 34.13 30.42 2kym s GLU 9 CO 0.00 -1.52 0.17 0.12 -0.54 0.00 0.00 175.26 173.49 2kym s PHE 10 N 3.88 3.26 0.21 5.30 2.19 -0.28 -4.95 117.98 127.58 2kym s PHE 10 Ca 0.28 -1.22 -0.24 0.00 0.33 0.00 0.00 56.93 56.08 2kym s PHE 10 Cb -0.14 -2.44 -0.08 0.00 -1.31 0.00 0.00 43.02 39.05 2kym s PHE 10 CO 0.17 -0.71 0.79 0.15 1.83 0.00 0.00 175.22 177.46 2kym s LYS 11 N 1.48 4.47 0.23 10.12 1.02 -1.26 -0.66 119.74 135.14 2kym s LYS 11 Ca 0.01 1.10 -0.30 0.00 0.02 0.00 0.00 55.97 56.80 2kym s LYS 11 Cb -0.20 -3.06 -0.09 0.00 -0.52 0.00 0.00 37.83 33.96 2kym s LYS 11 CO 0.05 0.46 1.28 0.00 -0.92 0.00 0.00 175.35 176.22 2kym s ALA 12 N -1.35 3.51 -0.10 5.17 0.00 -1.25 -4.83 121.76 122.90 2kym s ALA 12 Ca 0.41 1.11 0.14 0.00 0.00 0.00 0.00 51.96 53.62 2kym s ALA 12 Cb -0.20 -3.46 -0.20 0.00 0.00 0.00 0.00 23.12 19.25 2kym s ALA 12 CO 0.24 -0.51 0.15 -0.85 0.00 0.00 0.00 175.76 174.79 2kym n GLU 13 N 2.11 1.22 -4.25 0.00 0.28 -1.26 -4.94 120.64 113.81 2kym n GLU 13 Ca 0.04 -0.05 -0.25 0.00 -0.16 0.00 0.00 57.16 56.74 2kym n GLU 13 Cb 0.43 -1.38 -0.06 0.00 1.43 0.00 0.00 31.44 31.86 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 -2.38 0.71 0.23 3.44 5.12 -1.26 -5.02 116.66 117.51 2kym n ARG 14 Ca -0.17 -3.18 0.09 0.00 -1.93 0.00 0.00 57.85 52.66 2kym n ARG 14 Cb 0.79 1.43 0.55 0.00 -1.16 0.00 0.00 32.46 34.06 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 1.34 0.00 0.10 0.55 3.32 -2.05 -3.08 116.42 116.61 2kym h ASP 15 Ca -0.32 0.00 -0.17 0.00 0.02 0.00 0.00 57.03 56.56 2kym h ASP 15 Cb 1.11 0.00 0.01 0.00 0.22 0.00 0.00 39.33 40.67 2kym h ASP 15 CO 0.51 0.22 -0.82 0.44 -1.72 0.00 0.00 179.24 177.88 2kym h ASP 16 N 0.00 0.35 -3.78 6.45 5.19 -1.95 -3.47 116.42 119.20 2kym h ASP 16 Ca -0.00 -0.92 -0.53 0.00 -0.62 0.00 0.00 57.03 54.96 2kym h ASP 16 Cb 0.54 -0.11 0.20 0.00 0.18 0.00 0.00 39.33 40.14 2kym h ASP 16 CO 0.03 1.38 -0.14 -0.62 -3.12 0.00 0.00 179.24 176.76 2kym n GLU 17 N -4.18 -0.16 -4.20 3.56 -0.58 -1.17 -4.12 120.64 109.80 2kym n GLU 17 Ca -0.16 0.01 -0.16 0.00 -0.42 0.00 0.00 57.16 56.43 2kym n GLU 17 Cb 0.77 -2.12 -0.13 0.00 -0.57 0.00 0.00 31.44 29.40 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 -3.42 2.16 -0.01 -4.62 2.96 -1.26 -4.75 118.68 109.74 2kym s LEU 18 Ca 0.64 -0.40 -0.27 0.00 -0.22 0.00 0.00 54.13 53.88 2kym s LEU 18 Cb -0.25 -0.36 -0.04 0.00 0.50 0.00 0.00 46.19 46.04 2kym s LEU 18 CO 0.60 -0.04 0.86 1.51 -1.32 0.00 0.00 176.35 177.96 2kym s ASP 19 N -1.04 7.24 0.05 3.68 -4.77 -1.26 -3.77 116.67 116.80 2kym s ASP 19 Ca -0.03 1.49 -0.01 0.00 -3.30 0.00 0.00 52.55 50.71 2kym s ASP 19 Cb -0.07 -2.51 -0.04 0.00 -1.09 0.00 0.00 42.92 39.21 2kym s ASP 19 CO 0.01 -0.17 -0.03 0.68 0.70 0.00 0.00 175.17 176.35 2kym s VAL 20 N 0.77 0.21 0.21 2.11 -7.23 0.17 -4.94 120.40 111.70 2kym s VAL 20 Ca 0.46 -1.71 0.09 0.00 -1.81 0.00 0.00 61.98 59.00 2kym s VAL 20 Cb -0.20 -1.39 -0.05 0.00 0.56 0.00 0.00 36.38 35.31 2kym s VAL 20 CO 0.24 -0.95 -0.16 -0.44 -0.31 0.00 0.00 175.10 173.49 2kym s SER 21 N -2.76 2.76 -0.15 4.85 0.01 -1.26 -1.13 113.70 116.02 2kym s SER 21 Ca 0.05 -0.99 -0.29 0.00 1.31 0.00 0.00 55.95 56.02 2kym s SER 21 Cb 0.06 -0.17 -0.03 0.00 0.21 0.00 0.00 66.02 66.09 2kym s SER 21 CO -0.09 -0.11 1.56 -2.16 0.41 0.00 0.00 173.24 172.85 2kym s PRO 22 N -3.46 4.02 0.00 12.44 0.04 -1.22 -2.67 135.00 144.15 2kym s PRO 22 Ca 0.22 1.85 0.00 0.00 0.04 0.00 0.00 61.00 63.12 2kym s PRO 22 Cb -0.02 -3.96 0.00 0.00 0.04 0.00 0.00 34.50 30.55 2kym s PRO 22 CO 0.08 -1.01 0.00 0.41 0.04 0.00 0.00 177.00 176.52 2kym n GLY 23 N 4.26 1.01 3.90 0.56 0.00 0.77 -4.93 105.19 110.76 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 -0.69 3.66 -0.23 1.61 0.41 -1.09 -4.92 118.70 117.45 2kym s GLU 24 Ca 0.00 0.04 -0.16 0.00 -0.41 0.00 0.00 54.97 54.45 2kym s GLU 24 Cb 0.00 -2.66 -0.04 0.00 -1.78 0.00 0.00 34.13 29.66 2kym s GLU 24 CO 0.00 0.24 0.39 -0.80 -0.49 0.00 0.00 175.26 174.60 2kym s ASN 25 N -3.00 6.37 0.10 -0.19 -0.87 -1.26 -2.39 114.94 113.69 2kym s ASN 25 Ca 0.44 0.43 0.09 0.00 -1.57 0.00 0.00 52.86 52.25 2kym s ASN 25 Cb -0.11 -2.22 -0.03 0.00 -0.02 0.00 0.00 41.25 38.86 2kym s ASN 25 CO 0.28 -0.13 -0.22 -0.76 -2.57 0.00 0.00 177.10 173.71 2kym s LEU 26 N 1.64 2.29 -0.24 0.60 1.02 0.31 -3.10 118.68 121.19 2kym s LEU 26 Ca 0.17 -0.68 -0.09 0.00 0.02 0.00 0.00 54.13 53.55 2kym s LEU 26 Cb -0.15 -0.96 -0.04 0.00 0.02 0.00 0.00 46.19 45.06 2kym s LEU 26 CO 0.08 0.09 0.13 -0.55 0.02 0.00 0.00 176.35 176.13 2kym s SER 27 N -1.84 5.83 0.38 2.29 0.15 0.02 -1.17 113.70 119.36 2kym s SER 27 Ca 0.08 0.02 -0.25 0.00 0.70 0.00 0.00 55.95 56.50 2kym s SER 27 Cb -0.10 -2.05 -0.09 0.00 -1.71 0.00 0.00 66.02 62.07 2kym s SER 27 CO 0.04 0.04 1.07 -0.63 1.20 0.00 0.00 173.24 174.96 2kym s ILE 28 N 1.19 3.64 0.00 6.45 -1.09 -1.00 -0.81 121.20 129.58 2kym s ILE 28 Ca 0.06 1.33 0.00 0.00 -2.23 0.00 0.00 60.65 59.81 2kym s ILE 28 Cb -0.14 -3.72 0.00 0.00 -1.58 0.00 0.00 42.46 37.02 2kym s ILE 28 CO 0.05 0.08 0.00 0.00 -1.23 0.00 0.00 174.94 173.84 2kym s ALA 30 N -1.77 -2.30 0.40 0.00 0.00 -1.25 -4.67 121.76 112.17 2kym s ALA 30 Ca 0.00 0.58 0.04 0.00 0.00 0.00 0.00 51.96 52.58 2kym s ALA 30 Cb 0.00 0.45 -0.05 0.00 0.00 0.00 0.00 23.12 23.52 2kym s ALA 30 CO 0.00 -1.07 0.05 -3.38 0.00 0.00 0.00 175.76 171.36 2kym s HIS 31 N -2.31 2.04 -0.31 0.00 -3.43 -0.82 -0.12 115.29 110.35 2kym s HIS 31 Ca 0.17 -0.96 -0.02 0.00 -0.80 0.00 0.00 55.06 53.45 2kym s HIS 31 Cb 0.04 -1.44 0.10 0.00 -1.43 0.00 0.00 32.58 29.85 2kym s HIS 31 CO -0.03 0.09 0.12 -0.47 -2.00 0.00 0.00 174.74 172.45 2kym s TYR 32 N -3.06 1.12 -1.35 0.38 5.04 0.89 -0.45 117.35 119.92 2kym s TYR 32 Ca 0.27 -1.40 0.00 0.00 -2.44 0.00 0.00 57.07 53.51 2kym s TYR 32 Cb 0.06 -1.37 0.00 0.00 0.35 0.00 0.00 41.96 41.01 2kym s TYR 32 CO 0.13 -0.86 0.00 -3.47 -1.34 0.00 0.00 175.55 170.02 2kym n ASP 33 N 4.97 -4.23 -1.92 4.32 2.03 -1.26 -0.04 116.55 120.42 2kym n ASP 33 Ca -0.03 0.22 -0.18 0.00 0.52 0.00 0.00 54.79 55.32 2kym n ASP 33 Cb 0.42 -3.67 -0.02 0.00 -0.72 0.00 0.00 41.12 37.12 2kym n ASP 33 CO 0.00 0.00 0.00 -1.22 -1.92 0.00 0.00 177.20 174.06 2kym n TYR 34 N -2.99 -0.67 -0.02 -0.67 4.02 -1.26 -4.85 117.16 110.72 2kym n TYR 34 Ca -0.16 0.00 -0.05 0.00 -0.01 0.00 0.00 57.90 57.68 2kym n TYR 34 Cb 0.58 -3.47 -0.02 0.00 -0.02 0.00 0.00 39.34 36.41 2kym n TYR 34 CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 176.86 176.24 2kym n GLU 35 N -2.68 0.10 -4.51 -0.72 -0.58 0.94 -4.95 120.64 108.24 2kym n GLU 35 Ca -0.21 0.04 -0.31 0.00 -0.42 0.00 0.00 57.16 56.26 2kym n GLU 35 Cb 0.65 -0.74 -0.11 0.00 -0.57 0.00 0.00 31.44 30.67 2kym n GLU 35 CO 0.00 0.00 0.00 -1.58 -0.48 0.00 0.00 177.13 175.07 2kym s TRP 36 N -2.08 2.68 -0.02 -0.32 0.52 -1.08 -2.49 118.94 116.14 2kym s TRP 36 Ca -0.06 -0.18 0.07 0.00 0.02 0.00 0.00 56.10 55.95 2kym s TRP 36 Cb 0.02 -1.50 -0.02 0.00 -1.15 0.00 0.00 33.47 30.83 2kym s TRP 36 CO 0.08 0.32 -0.24 -0.06 0.02 0.00 0.00 176.95 177.07 2kym s PHE 37 N -1.00 2.22 -0.73 -1.98 0.08 0.93 -0.08 117.98 117.41 2kym s PHE 37 Ca 0.17 -0.45 -0.18 0.00 0.12 0.00 0.00 56.93 56.59 2kym s PHE 37 Cb -0.11 -1.43 0.14 0.00 -0.57 0.00 0.00 43.02 41.05 2kym s PHE 37 CO 0.08 -0.06 0.81 0.42 -0.10 0.00 0.00 175.22 176.37 2kym s ILE 38 N -0.53 5.01 0.00 0.64 -1.09 0.83 -1.25 121.20 124.82 2kym s ILE 38 Ca 0.08 -1.52 0.01 0.00 -2.23 0.00 0.00 60.65 57.00 2kym s ILE 38 Cb -0.10 -4.55 -0.04 0.00 -1.58 0.00 0.00 42.46 36.20 2kym s ILE 38 CO -0.00 -1.18 0.01 0.00 -1.23 0.00 0.00 174.94 172.53 2kym s ALA 39 N 2.02 3.31 0.20 9.38 0.00 -1.26 -0.02 121.76 135.39 2kym s ALA 39 Ca 0.18 -0.95 0.09 0.00 0.00 0.00 0.00 51.96 51.28 2kym s ALA 39 Cb -0.16 -1.36 -0.04 0.00 0.00 0.00 0.00 23.12 21.55 2kym s ALA 39 CO -0.01 0.65 -0.19 -1.59 0.00 0.00 0.00 175.76 174.62 2kym s LYS 40 N -1.61 1.39 0.02 0.00 -2.85 0.01 -3.44 119.74 113.26 2kym s LYS 40 Ca 0.20 -1.52 -0.30 0.00 -1.00 0.00 0.00 55.97 53.35 2kym s LYS 40 Cb -0.12 -1.46 -0.06 0.00 -2.06 0.00 0.00 37.83 34.13 2kym s LYS 40 CO 0.11 0.29 1.43 -1.25 0.10 0.00 0.00 175.35 176.03 2kym s PRO 41 N -3.03 4.28 0.01 1.78 0.04 -1.26 -0.80 135.00 136.02 2kym s PRO 41 Ca 0.20 2.02 -0.03 0.00 0.04 0.00 0.00 61.00 63.23 2kym s PRO 41 Cb -0.05 -3.54 -0.28 0.00 0.04 0.00 0.00 34.50 30.67 2kym s PRO 41 CO 0.09 -0.58 0.89 0.82 0.04 0.00 0.00 177.00 178.26 2kym h ILE 42 N 4.83 1.19 -0.08 0.56 2.04 -1.92 -3.36 117.51 120.77 2kym h ILE 42 Ca -0.39 -2.83 -0.12 0.00 1.00 0.00 0.00 64.86 62.52 2kym h ILE 42 Cb 1.18 2.78 0.01 0.00 -0.74 0.00 0.00 36.82 40.05 2kym h ILE 42 CO 0.90 0.82 -0.44 0.78 0.00 0.00 0.00 178.15 180.22 2kym h ASN 43 N 0.07 0.53 -1.01 1.72 2.35 -1.92 -3.46 115.58 113.86 2kym h ASN 43 Ca -0.23 -0.65 0.00 0.00 -0.55 0.00 0.00 56.30 54.87 2kym h ASN 43 Cb 2.01 -0.16 0.00 0.00 0.05 0.00 0.00 38.32 40.22 2kym h ASN 43 CO 0.17 1.10 0.00 0.54 -1.65 0.00 0.00 177.43 177.58 2kym n ARG 43 N -4.31 -1.83 0.00 0.81 5.12 -1.26 -4.95 116.66 110.25 2kym n ARG 43 Ca -0.08 0.00 0.11 0.00 -1.93 0.00 0.00 57.85 55.94 2kym n ARG 43 Cb 0.57 0.00 -0.11 0.00 -1.16 0.00 0.00 32.46 31.75 2kym n ARG 43 CO 0.00 0.00 0.00 1.28 -1.93 0.00 0.00 177.63 176.98 2kym n LEU 44 N 0.00 0.45 0.00 0.55 7.99 -1.26 -4.99 117.00 119.74 2kym n LEU 44 Ca 0.00 -0.15 0.00 0.00 -0.01 0.00 0.00 56.01 55.85 2kym n LEU 44 Cb 0.00 -0.02 0.00 0.00 -0.11 0.00 0.00 43.42 43.29 2kym n LEU 44 CO 0.00 0.08 0.00 0.61 -1.51 0.00 0.00 177.39 176.57 2kym n GLY 45 N 1.35 2.40 2.62 -0.72 0.00 -1.26 -5.11 105.19 104.46 2kym n GLY 45 Ca -0.00 0.09 -0.11 0.00 0.00 0.00 0.00 46.02 45.99 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 0.00 0.87 3.62 -0.02 0.00 -1.26 -5.02 105.19 103.38 2kym n GLY 46 Ca 0.00 -0.28 -0.43 0.00 0.00 0.00 0.00 46.02 45.31 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 0.07 3.72 0.00 1.61 0.04 -1.26 -4.16 135.00 135.02 2kym s PRO 47 Ca 0.31 1.60 0.00 0.00 0.04 0.00 0.00 61.00 62.94 2kym s PRO 47 Cb 0.24 -4.06 0.00 0.00 0.04 0.00 0.00 34.50 30.73 2kym s PRO 47 CO -0.17 -1.38 0.00 0.41 0.04 0.00 0.00 177.00 175.90 2kym n GLY 48 N 4.78 1.62 3.64 0.56 0.00 -1.22 -4.95 105.19 109.63 2kym n GLY 48 Ca 0.19 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 46.17 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 -1.03 -0.01 0.99 0.20 -1.26 -4.65 118.68 112.92 2kym s LEU 49 Ca 0.00 1.53 0.00 0.00 0.69 0.00 0.00 54.13 56.35 2kym s LEU 49 Cb 0.00 2.34 0.02 0.00 -0.43 0.00 0.00 46.19 48.12 2kym s LEU 49 CO 0.00 -0.23 0.02 0.54 -0.29 0.00 0.00 176.35 176.39 2kym s VAL 50 N 2.22 -0.04 0.55 1.68 0.11 -0.38 -4.55 120.40 119.99 2kym s VAL 50 Ca -0.08 0.15 -0.19 0.00 -2.93 0.00 0.00 61.98 58.92 2kym s VAL 50 Cb -0.08 -0.06 -0.06 0.00 -1.53 0.00 0.00 36.38 34.65 2kym s VAL 50 CO -0.19 0.06 1.13 -2.16 -3.33 0.00 0.00 175.10 170.60 2kym s PRO 51 N 0.72 3.32 0.64 1.54 0.04 -1.26 -0.05 135.00 139.96 2kym s PRO 51 Ca -0.06 1.60 0.36 0.00 0.04 0.00 0.00 61.00 62.94 2kym s PRO 51 Cb -0.09 -2.00 2.02 0.00 0.04 0.00 0.00 34.50 34.47 2kym s PRO 51 CO -0.02 -0.87 2.21 0.28 0.04 0.00 0.00 177.00 178.64 2kym h VAL 52 N 1.13 0.19 0.00 -0.36 2.07 -1.78 0.26 116.25 117.75 2kym h VAL 52 Ca -0.50 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.02 2kym h VAL 52 Cb 1.26 0.90 0.00 0.00 -1.52 0.00 0.00 31.29 31.93 2kym h VAL 52 CO 0.57 0.00 0.00 -1.20 0.02 0.00 0.00 177.57 176.96 2kym n SER 53 N -3.32 0.00 -0.00 0.57 7.64 -1.26 -2.81 113.62 114.44 2kym n SER 53 Ca -0.02 -0.61 0.00 0.00 1.01 0.00 0.00 58.87 59.26 2kym n SER 53 Cb 0.19 -0.10 0.00 0.00 -1.01 0.00 0.00 64.21 63.29 2kym n SER 53 CO 0.00 0.00 0.00 -1.22 -3.01 0.00 0.00 175.04 170.81 2kym n TYR 54 N -1.10 0.00 -3.78 1.43 4.02 0.90 -4.93 117.16 113.69 2kym n TYR 54 Ca 0.18 -0.35 -0.13 0.00 -0.01 0.00 0.00 57.90 57.59 2kym n TYR 54 Cb 0.14 -0.04 -0.12 0.00 -0.02 0.00 0.00 39.34 39.31 2kym n TYR 54 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 176.86 175.93 2kym s VAL 55 N -0.72 -0.00 -0.17 -0.72 1.01 -1.12 -3.21 120.40 115.47 2kym s VAL 55 Ca 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 61.98 61.93 2kym s VAL 55 Cb 0.00 -0.37 -0.04 0.00 0.00 0.00 0.00 36.38 35.98 2kym s VAL 55 CO 0.00 0.00 0.04 -0.60 0.00 0.00 0.00 175.10 174.54 2kym s ARG 56 N 0.17 3.81 -0.48 2.72 3.52 0.02 -4.75 118.95 123.96 2kym s ARG 56 Ca -0.00 -0.38 -0.24 0.00 -0.13 0.00 0.00 55.73 54.98 2kym s ARG 56 Cb -0.02 -3.11 0.03 0.00 -1.56 0.00 0.00 34.95 30.29 2kym s ARG 56 CO 0.00 0.33 0.86 0.42 -0.81 0.00 0.00 175.30 176.09 2kym s ILE 57 N 0.20 4.55 0.25 4.11 -1.09 -1.26 -0.59 121.20 127.36 2kym s ILE 57 Ca 0.03 0.46 0.10 0.00 -2.23 0.00 0.00 60.65 59.01 2kym s ILE 57 Cb -0.13 -4.40 -0.05 0.00 -1.58 0.00 0.00 42.46 36.30 2kym s ILE 57 CO 0.01 -0.84 -0.16 0.27 -1.23 0.00 0.00 174.94 172.98 2kym s ILE 58 N 3.55 2.12 -0.22 2.92 -4.36 -1.11 -4.51 121.20 119.60 2kym s ILE 58 Ca 0.32 -2.30 -0.13 0.00 -0.26 0.00 0.00 60.65 58.27 2kym s ILE 58 Cb -0.12 -2.22 -0.04 0.00 1.25 0.00 0.00 42.46 41.33 2kym s ILE 58 CO 0.23 -0.47 0.27 -0.62 0.24 0.00 0.00 174.94 174.59 2kym s ASP 59 N -3.43 6.27 0.36 4.36 -1.08 -1.20 -3.94 116.67 118.01 2kym s ASP 59 Ca 0.27 0.30 0.11 0.00 -0.52 0.00 0.00 52.55 52.72 2kym s ASP 59 Cb -0.02 -2.16 0.90 0.00 -1.46 0.00 0.00 42.92 40.17 2kym s ASP 59 CO 0.12 0.01 1.81 -0.07 0.52 0.00 0.00 175.17 177.55 2kym h LEU 60 N 7.53 0.61 0.03 -1.34 3.38 -1.95 0.33 115.31 123.91 2kym h LEU 60 Ca -0.37 0.07 -0.23 0.00 0.09 0.00 0.00 57.88 57.43 2kym h LEU 60 Cb 1.17 -0.04 -0.02 0.00 0.09 0.00 0.00 40.66 41.85 2kym h LEU 60 CO 0.69 0.23 -1.11 0.24 0.09 0.00 0.00 178.44 178.57 2kym h MET 61 N 0.60 0.07 -2.37 1.13 2.86 -2.01 -3.40 114.93 111.80 2kym h MET 61 Ca 0.53 -0.11 -0.59 0.00 -2.06 0.00 0.00 59.70 57.46 2kym h MET 61 Cb 1.03 0.04 -0.39 0.00 0.06 0.00 0.00 31.60 32.35 2kym h MET 61 CO -0.28 1.02 -0.95 -0.40 1.06 0.00 0.00 176.91 177.36 2kym n ASP 62 N -3.37 0.02 0.00 1.22 5.75 0.30 -4.95 116.55 115.52 2kym n ASP 62 Ca -0.03 -2.52 0.07 0.00 -0.01 0.00 0.00 54.79 52.30 2kym n ASP 62 Cb 0.97 -0.59 0.33 0.00 -1.03 0.00 0.00 41.12 40.81 2kym n ASP 62 CO 0.00 0.00 0.00 -0.81 -0.11 0.00 0.00 177.20 176.28 2kym n PRO 63 N 2.50 0.09 -0.08 0.11 -0.04 0.92 -2.61 135.00 135.89 2kym n PRO 63 Ca 0.28 0.21 -0.13 0.00 -0.04 0.00 0.00 63.50 63.81 2kym n PRO 63 Cb 0.47 -1.50 -0.14 0.00 -0.04 0.00 0.00 33.50 32.29 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 -1.41 1.41 0.08 0.55 0.00 -1.26 -3.53 120.51 116.35 2kym n ALA 64 Ca 0.05 -1.08 -0.13 0.00 0.00 0.00 0.00 53.44 52.28 2kym n ALA 64 Cb 0.15 -0.36 -0.08 0.00 0.00 0.00 0.00 19.45 19.15 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 0.01 -0.18 -0.73 0.00 3.11 -1.88 -2.89 116.57 114.02 2kym h LYS 65 Ca -0.49 0.01 0.00 0.00 -2.81 0.00 0.00 60.65 57.36 2kym h LYS 65 Cb 2.09 0.04 0.00 0.00 -1.00 0.00 0.00 32.23 33.36 2kym h LYS 65 CO 0.02 0.09 0.00 0.66 -2.81 0.00 0.00 179.45 177.41 2kym n TYR 66 N -5.05 1.07 0.13 1.91 4.02 -1.18 -3.94 117.16 114.12 2kym n TYR 66 Ca -0.09 -0.38 0.06 0.00 -0.01 0.00 0.00 57.90 57.48 2kym n TYR 66 Cb 0.19 -0.29 0.03 0.00 -0.02 0.00 0.00 39.34 39.25 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 3.16 0.71 -0.01 -0.72 0.00 -1.55 -3.26 119.26 117.59 2kym h ALA 67 Ca 0.00 -0.35 0.00 0.00 0.00 0.00 0.00 54.91 54.56 2kym h ALA 67 Cb 1.23 0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.05 2kym h ALA 67 CO 0.24 0.43 -0.41 0.45 0.00 0.00 0.00 179.25 179.95 2kym n SER 68 N -3.02 1.36 -4.69 0.00 2.88 -1.25 -4.94 113.62 103.96 2kym n SER 68 Ca -0.00 -1.09 -0.53 0.00 -1.33 0.00 0.00 58.87 55.92 2kym n SER 68 Cb 0.68 0.34 -0.06 0.00 -0.75 0.00 0.00 64.21 64.41 2kym n SER 68 CO 0.00 0.00 0.00 0.52 -1.23 0.00 0.00 175.04 174.33 2kym n VAL 69 N -0.54 0.36 -2.08 2.46 0.31 -1.23 -4.82 118.33 112.78 2kym n VAL 69 Ca 0.10 -0.06 -0.41 0.00 -0.01 0.00 0.00 64.34 63.96 2kym n VAL 69 Cb 0.39 -1.46 -0.01 0.00 -0.91 0.00 0.00 33.84 31.85 2kym n VAL 69 CO 0.00 0.00 0.00 0.47 -1.32 0.00 0.00 176.83 175.98 2kym n ASP 70 N 5.45 4.07 -0.35 4.52 8.00 -1.26 -4.76 116.55 132.22 2kym n ASP 70 Ca 0.24 -2.84 0.30 0.00 0.71 0.00 0.00 54.79 53.19 2kym n ASP 70 Cb 0.21 -1.65 0.61 0.00 -0.02 0.00 0.00 41.12 40.27 2kym n ASP 70 CO 0.00 0.00 0.00 0.71 -0.39 0.00 0.00 177.20 177.52 2kym h THR 71 N 5.03 0.41 -0.59 -3.53 1.35 -1.89 0.26 112.91 113.95 2kym h THR 71 Ca 0.45 -0.07 0.03 0.00 -0.55 0.00 0.00 66.41 66.27 2kym h THR 71 Cb 0.78 0.18 -0.04 0.00 -1.73 0.00 0.00 68.15 67.35 2kym h THR 71 CO 1.62 0.04 0.36 0.22 -0.25 0.00 0.00 175.52 177.51 2kym h TYR 72 N 0.21 0.67 -2.74 4.73 3.20 -1.86 -3.40 116.97 117.79 2kym h TYR 72 Ca 0.63 0.02 -0.57 0.00 3.14 0.00 0.00 58.73 61.95 2kym h TYR 72 Cb 1.97 -0.22 -0.03 0.00 1.54 0.00 0.00 36.73 39.99 2kym h TYR 72 CO -0.00 0.38 1.16 0.34 -1.64 0.00 0.00 178.16 178.40 2kym s ASP 73 N -5.65 6.28 0.62 -2.11 -1.08 0.90 -4.85 116.67 110.78 2kym s ASP 73 Ca -0.13 1.58 0.31 0.00 -0.52 0.00 0.00 52.55 53.79 2kym s ASP 73 Cb 0.14 -2.53 1.75 0.00 -1.46 0.00 0.00 42.92 40.82 2kym s ASP 73 CO 0.75 -1.35 2.09 0.08 0.52 0.00 0.00 175.17 177.26 2kym h ARG 74 N 11.17 0.00 0.36 4.34 -0.00 -1.83 -2.10 114.38 126.32 2kym h ARG 74 Ca -0.34 0.00 -0.02 0.00 -0.00 0.00 0.00 59.98 59.62 2kym h ARG 74 Cb 1.16 0.00 0.00 0.00 -0.00 0.00 0.00 29.97 31.13 2kym h ARG 74 CO 1.01 0.00 -0.17 0.93 -0.00 0.00 0.00 179.97 181.73 2kym h GLU 75 N 0.00 -0.47 0.72 0.08 5.08 -1.90 -1.49 114.58 116.60 2kym h GLU 75 Ca 0.07 0.03 -0.03 0.00 -1.00 0.00 0.00 59.36 58.43 2kym h GLU 75 Cb 0.51 0.11 -0.00 0.00 0.50 0.00 0.00 28.75 29.86 2kym h GLU 75 CO -0.00 -0.17 -0.41 1.96 -1.00 0.00 0.00 179.01 179.39 2kym h GLN 76 N -0.77 -1.01 -0.87 2.33 1.08 -1.64 -1.54 115.11 112.68 2kym h GLN 76 Ca -0.05 0.07 0.23 0.00 -1.45 0.00 0.00 58.65 57.45 2kym h GLN 76 Cb 0.52 0.23 -0.05 0.00 -0.05 0.00 0.00 27.48 28.13 2kym h GLN 76 CO 0.08 -0.68 0.61 -0.24 -0.95 0.00 0.00 178.83 177.65 2kym h VAL 77 N -1.05 0.61 0.06 -0.54 3.04 -1.58 -0.84 116.25 115.95 2kym h VAL 77 Ca -0.09 -0.05 -0.00 0.00 -1.01 0.00 0.00 66.70 65.55 2kym h VAL 77 Cb 0.84 0.46 0.00 0.00 -2.01 0.00 0.00 31.29 30.58 2kym h VAL 77 CO 0.11 0.02 -0.03 0.24 -1.01 0.00 0.00 177.57 176.91 2kym h MET 78 N 0.13 -0.08 -0.72 4.17 2.86 -0.68 -1.21 114.93 119.40 2kym h MET 78 Ca 0.43 0.01 0.06 0.00 -2.06 0.00 0.00 59.70 58.13 2kym h MET 78 Cb 1.48 0.02 -0.06 0.00 0.06 0.00 0.00 31.60 33.10 2kym h MET 78 CO -0.07 0.33 0.42 0.87 1.06 0.00 0.00 176.91 179.53 2kym h LYS 79 N -0.52 0.75 0.27 1.72 1.57 -0.20 0.27 116.57 120.42 2kym h LYS 79 Ca -0.01 -0.05 -0.01 0.00 -1.87 0.00 0.00 60.65 58.71 2kym h LYS 79 Cb 0.45 -0.17 0.00 0.00 0.08 0.00 0.00 32.23 32.60 2kym h LYS 79 CO 0.01 0.50 -0.13 0.82 -0.57 0.00 0.00 179.45 180.08 2kym h ILE 80 N 0.77 0.78 -0.68 1.86 5.03 -1.31 0.22 117.51 124.18 2kym h ILE 80 Ca 0.32 -0.42 0.01 0.00 -0.12 0.00 0.00 64.86 64.65 2kym h ILE 80 Cb 0.17 1.02 -0.04 0.00 -3.03 0.00 0.00 36.82 34.95 2kym h ILE 80 CO -0.18 0.09 0.45 0.40 -0.68 0.00 0.00 178.15 178.24 2kym h ILE 81 N -0.58 1.15 0.10 -0.67 2.04 -0.96 0.26 117.51 118.85 2kym h ILE 81 Ca -0.04 -0.31 -0.00 0.00 1.00 0.00 0.00 64.86 65.51 2kym h ILE 81 Cb 0.42 0.18 0.00 0.00 -0.74 0.00 0.00 36.82 36.68 2kym h ILE 81 CO 0.06 0.16 -0.05 -0.78 0.00 0.00 0.00 178.15 177.54 2kym h ASP 82 N 0.89 -0.12 0.08 1.72 1.82 -0.35 -0.71 116.42 119.77 2kym h ASP 82 Ca 0.26 -0.43 -0.00 0.00 -0.39 0.00 0.00 57.03 56.46 2kym h ASP 82 Cb -0.06 0.03 0.00 0.00 0.68 0.00 0.00 39.33 39.99 2kym h ASP 82 CO -0.06 0.41 -0.04 -0.33 -1.61 0.00 0.00 179.24 177.61 2kym h GLU 83 N -0.69 -0.11 0.00 0.28 4.39 -0.35 -1.86 114.58 116.24 2kym h GLU 83 Ca -0.01 0.01 0.00 0.00 0.34 0.00 0.00 59.36 59.69 2kym h GLU 83 Cb 0.54 0.02 0.00 0.00 -0.10 0.00 0.00 28.75 29.21 2kym h GLU 83 CO 0.02 -0.04 0.00 0.74 -1.16 0.00 0.00 179.01 178.58 2kym h PHE 84 N -0.15 0.00 -5.77 4.33 -1.00 -0.59 -3.46 116.94 110.30 2kym h PHE 84 Ca -0.01 0.00 -0.35 0.00 2.81 0.00 0.00 57.97 60.42 2kym h PHE 84 Cb 0.12 0.00 0.14 0.00 3.61 0.00 0.00 35.95 39.82 2kym h PHE 84 CO -0.06 0.00 -0.81 1.63 -1.61 0.00 0.00 178.31 177.46 2kym n LYS 85 N -2.31 -5.30 -2.61 1.51 4.76 -0.40 -3.99 118.16 109.82 2kym n LYS 85 Ca 0.01 0.77 -0.42 0.00 -2.87 0.00 0.00 58.31 55.81 2kym n LYS 85 Cb 0.19 -5.60 -0.03 0.00 -1.84 0.00 0.00 35.03 27.75 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 -3.46 4.47 0.59 -0.18 1.01 -0.45 -4.83 121.20 118.34 2kym s ILE 86 Ca 0.08 1.85 -0.18 0.00 0.00 0.00 0.00 60.65 62.41 2kym s ILE 86 Cb -0.02 -4.19 -0.04 0.00 0.01 0.00 0.00 42.46 38.23 2kym s ILE 86 CO 0.76 0.19 1.12 -2.16 0.00 0.00 0.00 174.94 174.85 2kym s PRO 87 N 0.68 3.14 0.76 2.79 0.04 -1.26 -4.80 135.00 136.35 2kym s PRO 87 Ca 0.53 1.52 -0.09 0.00 0.04 0.00 0.00 61.00 63.00 2kym s PRO 87 Cb -0.25 -1.98 0.07 0.00 0.04 0.00 0.00 34.50 32.38 2kym s PRO 87 CO 0.29 -1.01 1.10 0.95 0.04 0.00 0.00 177.00 178.38 2kym s THR 88 N -2.00 2.13 0.13 1.26 -4.23 -1.26 -1.94 115.64 109.74 2kym s THR 88 Ca 0.70 -0.14 -0.26 0.00 -1.18 0.00 0.00 61.69 60.81 2kym s THR 88 Cb -0.23 -3.00 -0.04 0.00 1.34 0.00 0.00 72.50 70.58 2kym s THR 88 CO 0.33 0.00 1.61 0.58 -0.54 0.00 0.00 174.62 176.60 2kym h VAL 89 N -0.84 0.29 -0.62 2.29 2.07 -1.08 -0.10 116.25 118.26 2kym h VAL 89 Ca -0.45 0.00 0.11 0.00 0.82 0.00 0.00 66.70 67.18 2kym h VAL 89 Cb 1.32 0.29 -0.09 0.00 -1.52 0.00 0.00 31.29 31.29 2kym h VAL 89 CO 0.62 0.00 0.16 -0.33 0.02 0.00 0.00 177.57 178.04 2kym h GLU 90 N -0.43 0.28 -0.74 1.57 5.08 -1.94 0.40 114.58 118.80 2kym h GLU 90 Ca 0.08 -0.02 0.01 0.00 -1.00 0.00 0.00 59.36 58.44 2kym h GLU 90 Cb 0.55 -0.06 -0.04 0.00 0.50 0.00 0.00 28.75 29.70 2kym h GLU 90 CO -0.32 0.19 0.49 1.96 -1.00 0.00 0.00 179.01 180.32 2kym h GLN 91 N 0.29 0.96 -0.58 2.33 1.08 -1.72 -1.11 115.11 116.36 2kym h GLN 91 Ca 0.33 -0.06 -0.07 0.00 -1.45 0.00 0.00 58.65 57.40 2kym h GLN 91 Cb 0.48 -0.22 -0.02 0.00 -0.05 0.00 0.00 27.48 27.67 2kym h GLN 91 CO -0.39 0.63 0.07 2.35 -0.95 0.00 0.00 178.83 180.54 2kym h TRP 92 N 0.98 0.99 -0.03 2.96 7.01 0.39 -0.97 115.95 127.29 2kym h TRP 92 Ca 0.28 -0.13 -0.00 0.00 2.11 0.00 0.00 58.89 61.14 2kym h TRP 92 Cb -0.09 -0.28 -0.00 0.00 -2.10 0.00 0.00 29.16 26.70 2kym h TRP 92 CO -0.02 0.86 0.01 0.87 -2.79 0.00 0.00 178.44 177.36 2kym h LYS 93 N 0.88 0.05 -0.41 2.65 1.79 -0.41 -1.05 116.57 120.07 2kym h LYS 93 Ca 0.18 -0.01 -0.01 0.00 -2.18 0.00 0.00 60.65 58.62 2kym h LYS 93 Cb 0.42 -0.01 -0.02 0.00 -1.58 0.00 0.00 32.23 31.05 2kym h LYS 93 CO 0.01 0.28 0.22 -0.44 -1.08 0.00 0.00 179.45 178.45 2kym h ASP 94 N -0.18 0.52 0.10 0.86 3.32 -1.13 -0.42 116.42 119.48 2kym h ASP 94 Ca 0.01 -0.09 0.00 0.00 0.02 0.00 0.00 57.03 56.97 2kym h ASP 94 Cb 0.25 -0.13 -0.01 0.00 0.22 0.00 0.00 39.33 39.66 2kym h ASP 94 CO 0.00 0.46 -0.10 1.56 -1.72 0.00 0.00 179.24 179.45 2kym h GLN 95 N 0.53 -0.21 -0.42 3.56 1.08 -1.13 -0.81 115.11 117.72 2kym h GLN 95 Ca 0.15 0.01 0.01 0.00 -1.45 0.00 0.00 58.65 57.37 2kym h GLN 95 Cb 0.06 0.05 -0.02 0.00 -0.05 0.00 0.00 27.48 27.51 2kym h GLN 95 CO -0.02 -0.14 0.26 1.79 -0.95 0.00 0.00 178.83 179.77 2kym h THR 96 N -0.22 1.08 -0.54 -0.54 1.35 -1.07 0.80 112.91 113.78 2kym h THR 96 Ca 0.00 -0.18 0.05 0.00 -0.55 0.00 0.00 66.41 65.73 2kym h THR 96 Cb 0.21 0.50 -0.05 0.00 -1.73 0.00 0.00 68.15 67.08 2kym h THR 96 CO -0.03 0.10 0.28 0.03 -0.25 0.00 0.00 175.52 175.65 2kym h ARG 97 N 0.53 0.52 -0.09 4.72 2.47 -0.86 -0.10 114.38 121.58 2kym h ARG 97 Ca 0.16 -0.03 -0.11 0.00 -1.26 0.00 0.00 59.98 58.74 2kym h ARG 97 Cb -0.03 -0.12 -0.01 0.00 -1.65 0.00 0.00 29.97 28.16 2kym h ARG 97 CO -0.05 0.35 -0.44 0.00 0.56 0.00 0.00 179.97 180.38 2kym h ARG 98 N 0.54 0.22 -0.36 0.04 3.08 -0.79 -0.66 114.38 116.45 2kym h ARG 98 Ca 0.24 -0.11 -0.13 0.00 0.07 0.00 0.00 59.98 60.05 2kym h ARG 98 Cb 0.14 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.18 2kym h ARG 98 CO -0.16 0.63 -0.29 -0.92 -1.07 0.00 0.00 179.97 178.15 2kym h TYR 99 N 0.18 0.87 0.00 3.04 3.20 0.06 -2.96 116.97 121.36 2kym h TYR 99 Ca 0.01 -0.22 -0.08 0.00 3.14 0.00 0.00 58.73 61.58 2kym h TYR 99 Cb 0.86 -0.20 -0.01 0.00 1.54 0.00 0.00 36.73 38.92 2kym h TYR 99 CO 0.01 0.96 -0.55 0.87 -1.64 0.00 0.00 178.16 177.81 2kym h LYS 100 N 0.64 0.00 -5.86 1.82 1.79 -0.90 -3.42 116.57 110.64 2kym h LYS 100 Ca 0.08 0.00 -0.60 0.00 -2.18 0.00 0.00 60.65 57.95 2kym h LYS 100 Cb 0.82 0.00 -0.07 0.00 -1.58 0.00 0.00 32.23 31.40 2kym h LYS 100 CO 0.07 0.34 -0.21 -2.00 -1.08 0.00 0.00 179.45 176.57 2kym s GLU 101 N -3.03 4.05 -1.03 3.15 2.12 -0.27 -4.25 118.70 119.44 2kym s GLU 101 Ca 0.03 0.36 -0.03 0.00 0.36 0.00 0.00 54.97 55.70 2kym s GLU 101 Cb 0.07 -3.30 0.00 0.00 0.26 0.00 0.00 34.13 31.17 2kym s GLU 101 CO 0.74 0.51 0.88 0.45 -0.54 0.00 0.00 175.26 177.30 2kym n SER 102 N 2.49 -3.27 -2.91 -1.70 2.88 -1.26 -4.79 113.62 105.06 2kym n SER 102 Ca -0.12 -0.49 -0.02 0.00 -1.33 0.00 0.00 58.87 56.91 2kym n SER 102 Cb 0.52 -4.29 0.02 0.00 -0.75 0.00 0.00 64.21 59.71 2kym n SER 102 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 2kym n SER 103 N -2.58 -1.88 -4.57 -3.46 7.64 -1.26 -4.89 113.62 102.62 2kym n SER 103 Ca -0.15 -0.17 -0.40 0.00 1.01 0.00 0.00 58.87 59.15 2kym n SER 103 Cb 0.61 -0.06 0.02 0.00 -1.01 0.00 0.00 64.21 63.77 2kym n SER 103 CO 0.00 0.00 0.00 -0.38 -3.01 0.00 0.00 175.04 171.65 2kym n ILE 104 N -3.05 2.52 -3.70 0.44 2.08 -1.26 -4.97 119.36 111.42 2kym n ILE 104 Ca 0.01 -0.50 -0.00 0.00 0.56 0.00 0.00 62.75 62.82 2kym n ILE 104 Cb 0.04 -0.99 0.01 0.00 -0.75 0.00 0.00 39.64 37.94 2kym n ILE 104 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 2kym n GLN 105 N -0.00 0.16 -4.38 0.38 10.64 -1.26 -5.17 117.38 117.75 2kym n GLN 105 Ca 0.11 -0.42 -0.31 0.00 -1.83 0.00 0.00 57.00 54.55 2kym n GLN 105 Cb 0.42 0.59 -0.10 0.00 -0.86 0.00 0.00 30.24 30.29 2kym n GLN 105 CO 0.00 0.00 0.00 0.42 -1.83 0.00 0.00 177.06 175.65 2kym s ILE 106 N -2.29 3.57 0.27 -0.39 1.01 -1.26 -5.08 121.20 117.02 2kym s ILE 106 Ca 0.09 -0.94 -0.30 0.00 0.00 0.00 0.00 60.65 59.50 2kym s ILE 106 Cb -0.01 -2.59 -0.14 0.00 0.01 0.00 0.00 42.46 39.73 2kym s ILE 106 CO 0.01 0.29 1.22 0.61 0.00 0.00 0.00 174.94 177.07 2kym n GLY 107 N 1.24 0.29 3.88 6.18 0.00 -1.26 -4.97 105.19 110.55 2kym n GLY 107 Ca -0.14 0.41 -0.32 0.00 0.00 0.00 0.00 46.02 45.97 2kym n GLY 107 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2kym s ASN 108 N -0.16 6.61 1.13 1.61 -0.87 -1.26 -5.07 114.94 116.93 2kym s ASN 108 Ca 0.63 0.87 -0.18 0.00 -1.57 0.00 0.00 52.86 52.61 2kym s ASN 108 Cb -0.68 -2.21 0.14 0.00 -0.02 0.00 0.00 41.25 38.48 2kym s ASN 108 CO 0.56 -0.04 0.13 0.61 -2.57 0.00 0.00 177.10 175.78 2kym n GLY 109 N -0.06 -2.57 0.42 0.66 0.00 -1.26 -4.79 105.19 97.60 2kym n GLY 109 Ca -0.00 -0.85 0.24 0.00 0.00 0.00 0.00 46.02 45.40 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 -2.29 0.00 -0.37 1.61 2.76 -2.06 -2.71 115.15 112.09 2kym h HIS 110 Ca -0.49 0.00 -0.46 0.00 -2.20 0.00 0.00 60.37 57.22 2kym h HIS 110 Cb 1.26 0.00 -0.07 0.00 1.55 0.00 0.00 27.41 30.15 2kym h HIS 110 CO -0.57 0.00 1.33 0.41 -1.30 0.00 0.00 177.93 177.80 2kym n GLY 111 N -1.65 3.92 3.35 5.26 0.00 -1.26 -4.72 105.19 110.09 2kym n GLY 111 Ca 0.13 -1.54 0.03 0.00 0.00 0.00 0.00 46.02 44.64 2kym n GLY 111 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2kym s GLN 112 N 0.48 0.10 0.01 1.61 -0.44 -1.02 -5.14 119.66 115.26 2kym s GLN 112 Ca 0.64 0.23 -0.09 0.00 -2.50 0.00 0.00 55.36 53.64 2kym s GLN 112 Cb 0.27 0.11 -0.05 0.00 -1.64 0.00 0.00 33.01 31.70 2kym s GLN 112 CO -0.07 -0.03 0.32 -1.12 0.50 0.00 0.00 175.29 174.88 2kym s SER 113 N 1.86 6.59 0.00 6.67 0.01 -1.26 -4.81 113.70 122.75 2kym s SER 113 Ca -0.02 0.70 0.00 0.00 1.31 0.00 0.00 55.95 57.93 2kym s SER 113 Cb -0.02 -2.15 0.00 0.00 0.21 0.00 0.00 66.02 64.06 2kym s SER 113 CO -0.15 0.27 0.00 0.00 0.41 0.00 0.00 173.24 173.77 2kym n GLN 114 N 1.34 0.00 -1.23 12.44 3.00 -1.26 -5.06 117.38 126.61 2kym n GLN 114 Ca -0.12 0.15 0.00 0.00 -0.01 0.00 0.00 57.00 57.02 2kym n GLN 114 Cb 0.53 -0.55 0.00 0.00 0.00 0.00 0.00 30.24 30.22 2kym n GLN 114 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 2kym n GLY 115 N 2.10 0.63 3.36 1.08 0.00 -1.26 -5.11 105.19 106.00 2kym n GLY 115 Ca 0.00 -0.38 -0.20 0.00 0.00 0.00 0.00 46.02 45.45 2kym n GLY 115 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 2kym s LEU 116 N -1.62 1.74 0.00 0.99 0.05 -1.26 -5.25 118.68 113.33 2kym s LEU 116 Ca 0.00 -1.59 0.07 0.00 0.05 0.00 0.00 54.13 52.66 2kym s LEU 116 Cb 0.00 0.16 0.05 0.00 -2.05 0.00 0.00 46.19 44.36 2kym s LEU 116 CO 0.00 -0.90 0.71 -0.62 -0.55 0.00 0.00 176.35 174.99