#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 -0.11 -1.13 3.17 0.00 -1.26 -5.06 121.76 117.37 2kym s ALA -1 Ca 0.00 -0.72 -0.23 0.00 0.00 0.00 0.00 51.96 51.02 2kym s ALA -1 Cb 0.00 0.49 -0.10 0.00 0.00 0.00 0.00 23.12 23.51 2kym s ALA -1 CO 0.00 -0.50 1.93 -0.35 0.00 0.00 0.00 175.76 176.84 2kym n PRO 1 N -0.05 1.58 -2.97 0.00 -0.04 -1.26 -4.94 135.00 127.33 2kym n PRO 1 Ca -0.14 -2.39 -0.29 0.00 -0.04 0.00 0.00 63.50 60.64 2kym n PRO 1 Cb 0.62 -3.63 -0.02 0.00 -0.04 0.00 0.00 33.50 30.43 2kym n PRO 1 CO 0.00 0.00 0.00 -0.48 -0.04 0.00 0.00 175.50 174.98 2kym s LEU 2 N 9.80 3.86 -0.01 1.53 0.05 -1.26 -4.95 118.68 127.70 2kym s LEU 2 Ca 0.67 0.94 0.02 0.00 0.05 0.00 0.00 54.13 55.81 2kym s LEU 2 Cb 0.01 -3.81 -0.01 0.00 -2.05 0.00 0.00 46.19 40.33 2kym s LEU 2 CO 0.14 -0.38 -0.07 -0.36 -0.55 0.00 0.00 176.35 175.13 2kym s PHE 3 N -2.37 0.62 0.41 3.48 0.40 -1.26 -3.63 117.98 115.64 2kym s PHE 3 Ca 0.48 -0.12 0.07 0.00 -0.60 0.00 0.00 56.93 56.76 2kym s PHE 3 Cb -0.10 -0.40 -0.04 0.00 0.51 0.00 0.00 43.02 42.98 2kym s PHE 3 CO 0.34 -0.01 0.25 0.00 0.70 0.00 0.00 175.22 176.50 2kym s ALA 4 N -0.16 3.75 -0.05 5.36 0.00 -0.00 -2.82 121.76 127.84 2kym s ALA 4 Ca 0.03 -2.02 -0.00 0.00 0.00 0.00 0.00 51.96 49.96 2kym s ALA 4 Cb -0.03 -0.63 0.03 0.00 0.00 0.00 0.00 23.12 22.49 2kym s ALA 4 CO -0.00 -0.18 0.00 0.54 0.00 0.00 0.00 175.76 176.12 2kym s VAL 5 N -2.55 0.24 0.45 0.00 0.11 -0.12 -0.72 120.40 117.82 2kym s VAL 5 Ca 0.43 0.13 -0.22 0.00 -2.93 0.00 0.00 61.98 59.39 2kym s VAL 5 Cb 0.01 -0.38 -0.08 0.00 -1.53 0.00 0.00 36.38 34.40 2kym s VAL 5 CO 0.24 0.20 1.09 0.42 -3.33 0.00 0.00 175.10 173.72 2kym s THR 6 N 1.51 3.51 -0.08 5.04 -4.23 -0.66 -0.73 115.64 120.00 2kym s THR 6 Ca -0.03 1.07 0.02 0.00 -1.18 0.00 0.00 61.69 61.58 2kym s THR 6 Cb -0.13 -3.51 -0.02 0.00 1.34 0.00 0.00 72.50 70.17 2kym s THR 6 CO -0.03 -0.07 0.08 0.18 -0.54 0.00 0.00 174.62 174.23 2kym n LEU 7 N -0.53 0.08 -4.16 4.79 4.77 -1.21 -0.05 117.00 120.68 2kym n LEU 7 Ca 0.07 -0.41 -0.10 0.00 -0.03 0.00 0.00 56.01 55.54 2kym n LEU 7 Cb 0.50 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.49 2kym n LEU 7 CO 0.44 0.02 -0.27 -0.31 -1.33 0.00 0.00 177.39 175.94 2kym s TYR 8 N -1.36 0.95 -0.44 -1.77 1.51 -1.26 -4.67 117.35 110.31 2kym s TYR 8 Ca 0.00 -1.27 -0.22 0.00 -1.01 0.00 0.00 57.07 54.57 2kym s TYR 8 Cb 0.01 -0.50 0.02 0.00 -0.11 0.00 0.00 41.96 41.39 2kym s TYR 8 CO 0.08 -0.56 0.72 -2.00 -1.11 0.00 0.00 175.55 172.68 2kym s GLU 9 N -4.08 3.35 -0.33 -0.62 2.56 -1.26 -3.30 118.70 115.02 2kym s GLU 9 Ca 0.29 -0.22 -0.20 0.00 0.00 0.00 0.00 54.97 54.85 2kym s GLU 9 Cb 0.07 -3.94 -0.01 0.00 2.00 0.00 0.00 34.13 32.25 2kym s GLU 9 CO 0.05 -1.07 0.59 0.12 -0.56 0.00 0.00 175.26 174.40 2kym s PHE 10 N 3.09 3.19 -0.47 5.30 5.36 -0.43 -4.95 117.98 129.06 2kym s PHE 10 Ca 0.27 0.42 -0.22 0.00 -0.96 0.00 0.00 56.93 56.44 2kym s PHE 10 Cb -0.13 -3.00 0.03 0.00 -0.34 0.00 0.00 43.02 39.58 2kym s PHE 10 CO 0.21 -0.52 0.72 0.15 -1.46 0.00 0.00 175.22 174.32 2kym s LYS 11 N 2.57 3.29 0.86 10.12 3.01 -1.26 -2.21 119.74 136.11 2kym s LYS 11 Ca 0.23 -0.39 -0.11 0.00 -1.01 0.00 0.00 55.97 54.69 2kym s LYS 11 Cb -0.15 -3.99 0.11 0.00 -1.01 0.00 0.00 37.83 32.79 2kym s LYS 11 CO 0.13 -1.16 1.15 0.00 0.51 0.00 0.00 175.35 175.98 2kym s ALA 12 N 3.08 1.71 0.00 5.17 0.00 -1.26 -4.98 121.76 125.48 2kym s ALA 12 Ca 0.24 0.59 0.00 0.00 0.00 0.00 0.00 51.96 52.79 2kym s ALA 12 Cb -0.14 -3.43 0.00 0.00 0.00 0.00 0.00 23.12 19.55 2kym s ALA 12 CO 0.19 -2.45 0.00 -0.85 0.00 0.00 0.00 175.76 172.64 2kym n GLU 13 N -3.86 0.88 -4.53 0.00 0.00 -1.26 -4.99 120.64 106.87 2kym n GLU 13 Ca 0.12 0.00 -0.25 0.00 0.00 0.00 0.00 57.16 57.03 2kym n GLU 13 Cb 0.52 -0.88 -0.11 0.00 0.00 0.00 0.00 31.44 30.97 2kym n GLU 13 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.13 178.16 2kym s ARG 14 N -1.77 1.78 0.28 3.44 1.81 -1.26 -5.00 118.95 118.23 2kym s ARG 14 Ca 0.00 -1.96 0.01 0.00 -1.72 0.00 0.00 55.73 52.06 2kym s ARG 14 Cb 0.00 -1.46 0.56 0.00 -0.45 0.00 0.00 34.95 33.61 2kym s ARG 14 CO 0.00 0.02 1.81 -0.44 -0.68 0.00 0.00 175.30 176.00 2kym h ASP 15 N 2.01 0.80 0.37 0.23 3.32 -2.03 0.23 116.42 121.35 2kym h ASP 15 Ca -0.42 0.06 -0.03 0.00 0.02 0.00 0.00 57.03 56.67 2kym h ASP 15 Cb 1.24 -0.09 -0.00 0.00 0.22 0.00 0.00 39.33 40.70 2kym h ASP 15 CO 0.73 0.39 -0.13 0.44 -1.72 0.00 0.00 179.24 178.95 2kym h ASP 16 N 0.86 0.00 -3.35 6.45 3.32 -1.96 -3.41 116.42 118.33 2kym h ASP 16 Ca 0.49 0.00 -0.57 0.00 0.02 0.00 0.00 57.03 56.97 2kym h ASP 16 Cb 0.58 0.00 -0.08 0.00 0.22 0.00 0.00 39.33 40.05 2kym h ASP 16 CO -0.30 0.13 -0.05 -1.61 -1.72 0.00 0.00 179.24 175.69 2kym s GLU 17 N -4.21 4.34 0.01 3.56 0.41 0.82 -3.78 118.70 119.85 2kym s GLU 17 Ca -0.03 0.57 0.02 0.00 -0.41 0.00 0.00 54.97 55.12 2kym s GLU 17 Cb 0.13 -3.46 -0.04 0.00 -1.78 0.00 0.00 34.13 28.99 2kym s GLU 17 CO 0.60 0.08 -0.01 -1.17 -0.49 0.00 0.00 175.26 174.27 2kym s LEU 18 N 0.84 3.47 0.27 1.80 2.96 -1.26 -4.53 118.68 122.22 2kym s LEU 18 Ca 0.29 -0.04 -0.11 0.00 -0.22 0.00 0.00 54.13 54.05 2kym s LEU 18 Cb -0.16 -2.01 -0.08 0.00 0.50 0.00 0.00 46.19 44.45 2kym s LEU 18 CO 0.12 0.27 0.62 -0.62 -1.32 0.00 0.00 176.35 175.42 2kym s ASP 19 N -1.60 6.67 0.05 3.68 -1.08 -1.26 -4.41 116.67 118.71 2kym s ASP 19 Ca 0.20 1.04 -0.10 0.00 -0.52 0.00 0.00 52.55 53.16 2kym s ASP 19 Cb -0.11 -2.27 0.01 0.00 -1.46 0.00 0.00 42.92 39.08 2kym s ASP 19 CO 0.11 -0.13 0.22 0.54 0.52 0.00 0.00 175.17 176.42 2kym s VAL 20 N -1.90 0.11 0.17 1.11 0.11 -0.94 -4.98 120.40 114.09 2kym s VAL 20 Ca 0.50 -0.92 0.07 0.00 -2.93 0.00 0.00 61.98 58.70 2kym s VAL 20 Cb -0.11 -1.02 -0.04 0.00 -1.53 0.00 0.00 36.38 33.68 2kym s VAL 20 CO 0.20 -0.51 -0.01 -0.94 -3.33 0.00 0.00 175.10 170.52 2kym s SER 21 N -2.28 4.74 0.07 3.54 1.04 -1.26 -1.32 113.70 118.23 2kym s SER 21 Ca -0.02 -0.40 -0.31 0.00 0.48 0.00 0.00 55.95 55.70 2kym s SER 21 Cb 0.00 -1.00 -0.07 0.00 0.10 0.00 0.00 66.02 65.05 2kym s SER 21 CO -0.06 0.09 1.39 -2.16 0.98 0.00 0.00 173.24 173.49 2kym s PRO 22 N -2.92 4.31 0.00 4.02 0.04 -1.21 -2.72 135.00 136.52 2kym s PRO 22 Ca 0.27 2.03 0.00 0.00 0.04 0.00 0.00 61.00 63.34 2kym s PRO 22 Cb -0.09 -3.38 0.00 0.00 0.04 0.00 0.00 34.50 31.07 2kym s PRO 22 CO 0.18 -0.48 0.00 0.41 0.04 0.00 0.00 177.00 177.15 2kym n GLY 23 N 3.55 0.49 3.89 0.56 0.00 0.92 -4.91 105.19 109.69 2kym n GLY 23 Ca 0.12 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.85 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 -0.89 3.63 -0.18 1.61 0.41 -1.10 -4.87 118.70 117.31 2kym s GLU 24 Ca 0.00 0.38 -0.08 0.00 -0.41 0.00 0.00 54.97 54.86 2kym s GLU 24 Cb 0.00 -2.32 -0.04 0.00 -1.78 0.00 0.00 34.13 29.98 2kym s GLU 24 CO 0.00 -0.22 0.11 -0.80 -0.49 0.00 0.00 175.26 173.86 2kym s ASN 25 N -3.83 6.03 0.24 -0.19 -0.87 -1.26 -1.66 114.94 113.39 2kym s ASN 25 Ca 0.50 0.22 0.10 0.00 -1.57 0.00 0.00 52.86 52.11 2kym s ASN 25 Cb -0.10 -2.02 -0.05 0.00 -0.02 0.00 0.00 41.25 39.05 2kym s ASN 25 CO 0.42 0.22 -0.17 -0.76 -2.57 0.00 0.00 177.10 174.25 2kym s LEU 26 N 0.09 2.57 -0.31 0.60 2.01 0.10 -3.89 118.68 119.86 2kym s LEU 26 Ca 0.08 -1.02 -0.07 0.00 0.01 0.00 0.00 54.13 53.13 2kym s LEU 26 Cb -0.12 -0.86 0.02 0.00 0.01 0.00 0.00 46.19 45.24 2kym s LEU 26 CO -0.00 -0.08 0.09 -0.55 1.01 0.00 0.00 176.35 176.82 2kym s SER 27 N -3.40 5.20 0.38 2.29 0.15 -0.47 -0.82 113.70 117.03 2kym s SER 27 Ca 0.26 -0.88 -0.26 0.00 0.70 0.00 0.00 55.95 55.77 2kym s SER 27 Cb -0.03 -1.88 -0.09 0.00 -1.71 0.00 0.00 66.02 62.32 2kym s SER 27 CO 0.10 -0.25 1.17 -0.63 1.20 0.00 0.00 173.24 174.83 2kym s ILE 28 N 1.46 3.18 0.00 6.45 -1.09 -1.24 -1.03 121.20 128.94 2kym s ILE 28 Ca 0.01 1.03 0.00 0.00 -2.23 0.00 0.00 60.65 59.46 2kym s ILE 28 Cb -0.18 -3.59 0.00 0.00 -1.58 0.00 0.00 42.46 37.11 2kym s ILE 28 CO 0.03 0.13 0.00 0.00 -1.23 0.00 0.00 174.94 173.86 2kym s ALA 30 N -1.85 -1.90 0.40 0.00 0.00 -1.25 -4.55 121.76 112.61 2kym s ALA 30 Ca 0.00 0.16 0.03 0.00 0.00 0.00 0.00 51.96 52.15 2kym s ALA 30 Cb 0.00 0.62 -0.03 0.00 0.00 0.00 0.00 23.12 23.71 2kym s ALA 30 CO 0.00 -1.07 0.10 -3.38 0.00 0.00 0.00 175.76 171.41 2kym s HIS 31 N -2.60 1.84 -0.30 0.00 -3.43 -0.84 -0.54 115.29 109.43 2kym s HIS 31 Ca 0.17 -1.16 -0.03 0.00 -0.80 0.00 0.00 55.06 53.24 2kym s HIS 31 Cb 0.00 -1.25 0.10 0.00 -1.43 0.00 0.00 32.58 30.00 2kym s HIS 31 CO 0.01 -0.15 0.12 -0.47 -2.00 0.00 0.00 174.74 172.25 2kym s TYR 32 N -3.18 0.71 -1.43 0.38 5.04 0.87 -0.55 117.35 119.19 2kym s TYR 32 Ca 0.24 -1.13 0.00 0.00 -2.44 0.00 0.00 57.07 53.75 2kym s TYR 32 Cb 0.04 -1.13 0.00 0.00 0.35 0.00 0.00 41.96 41.22 2kym s TYR 32 CO 0.13 -0.84 0.00 -3.47 -1.34 0.00 0.00 175.55 170.03 2kym n ASP 33 N 5.12 -4.32 -1.77 4.32 2.03 -1.26 -0.08 116.55 120.60 2kym n ASP 33 Ca -0.05 0.23 -0.18 0.00 0.52 0.00 0.00 54.79 55.32 2kym n ASP 33 Cb 0.42 -3.77 -0.03 0.00 -0.72 0.00 0.00 41.12 37.02 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 -2.92 -0.53 -0.03 -0.67 4.02 -1.26 -4.84 117.16 110.93 2kym n TYR 34 Ca -0.17 0.00 -0.06 0.00 -0.01 0.00 0.00 57.90 57.67 2kym n TYR 34 Cb 0.58 -3.33 -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 0.39 -1.01 0.00 0.00 176.86 176.24 2kym n GLU 35 N -2.62 0.13 -4.47 -0.72 -0.58 0.89 -4.92 120.64 108.36 2kym n GLU 35 Ca -0.20 0.05 -0.30 0.00 -0.42 0.00 0.00 57.16 56.29 2kym n GLU 35 Cb 0.63 -0.85 -0.11 0.00 -0.57 0.00 0.00 31.44 30.53 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 -2.11 2.64 0.03 -0.32 0.52 -1.07 -2.45 118.94 116.18 2kym s TRP 36 Ca -0.08 -0.20 0.07 0.00 0.02 0.00 0.00 56.10 55.91 2kym s TRP 36 Cb 0.03 -1.45 -0.02 0.00 -1.15 0.00 0.00 33.47 30.87 2kym s TRP 36 CO 0.12 0.33 -0.22 -0.06 0.02 0.00 0.00 176.95 177.14 2kym s PHE 37 N -1.04 1.90 -0.57 -1.98 0.08 0.10 -0.09 117.98 116.38 2kym s PHE 37 Ca 0.17 -0.38 -0.14 0.00 0.12 0.00 0.00 56.93 56.70 2kym s PHE 37 Cb -0.11 -1.15 0.14 0.00 -0.57 0.00 0.00 43.02 41.33 2kym s PHE 37 CO 0.08 0.07 0.51 0.42 -0.10 0.00 0.00 175.22 176.20 2kym s ILE 38 N -0.73 5.09 -0.08 0.64 -1.09 0.30 -1.25 121.20 124.08 2kym s ILE 38 Ca 0.08 -1.70 0.01 0.00 -2.23 0.00 0.00 60.65 56.81 2kym s ILE 38 Cb -0.09 -4.26 -0.03 0.00 -1.58 0.00 0.00 42.46 36.50 2kym s ILE 38 CO 0.01 -0.88 -0.08 0.00 -1.23 0.00 0.00 174.94 172.77 2kym s ALA 39 N 1.34 2.93 0.23 9.38 0.00 -1.25 -0.10 121.76 134.29 2kym s ALA 39 Ca 0.06 -0.89 0.09 0.00 0.00 0.00 0.00 51.96 51.21 2kym s ALA 39 Cb -0.27 -1.24 -0.04 0.00 0.00 0.00 0.00 23.12 21.58 2kym s ALA 39 CO 0.01 0.52 -0.02 -1.59 0.00 0.00 0.00 175.76 174.68 2kym s LYS 40 N -0.61 2.29 0.13 0.00 -2.85 -0.19 -3.48 119.74 115.03 2kym s LYS 40 Ca 0.09 -1.30 -0.31 0.00 -1.00 0.00 0.00 55.97 53.45 2kym s LYS 40 Cb -0.12 -2.22 -0.08 0.00 -2.06 0.00 0.00 37.83 33.36 2kym s LYS 40 CO 0.02 0.40 1.35 -1.25 0.10 0.00 0.00 175.35 175.97 2kym s PRO 41 N -3.33 4.35 -0.06 1.78 0.04 -1.26 -1.36 135.00 135.16 2kym s PRO 41 Ca 0.29 2.04 0.09 0.00 0.04 0.00 0.00 61.00 63.46 2kym s PRO 41 Cb -0.08 -3.24 -0.24 0.00 0.04 0.00 0.00 34.50 30.99 2kym s PRO 41 CO 0.19 -0.37 0.61 -0.89 0.04 0.00 0.00 177.00 176.58 2kym n ILE 42 N 3.57 1.65 -0.09 0.56 5.41 -1.25 -4.51 119.36 124.69 2kym n ILE 42 Ca 0.10 -0.77 -0.16 0.00 1.00 0.00 0.00 62.75 62.92 2kym n ILE 42 Cb 0.43 -1.18 -0.08 0.00 -0.71 0.00 0.00 39.64 38.10 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 -3.13 1.85 -3.00 4.38 2.85 -1.26 -4.97 115.26 111.97 2kym n ASN 43 Ca -0.20 0.49 0.00 0.00 -0.11 0.00 0.00 54.58 54.76 2kym n ASN 43 Cb 1.05 -0.92 0.00 0.00 1.24 0.00 0.00 39.78 41.15 2kym n ASN 43 CO 0.00 0.00 0.00 0.54 -2.11 0.00 0.00 177.26 175.69 2kym n ARG 43 N -4.48 -1.73 -0.60 1.20 5.12 -1.26 -5.05 116.66 109.86 2kym n ARG 43 Ca -0.25 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.67 2kym n ARG 43 Cb 0.55 0.00 0.00 0.00 -1.16 0.00 0.00 32.46 31.85 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 0.00 -4.57 0.55 4.77 -1.26 -4.94 117.00 111.55 2kym n LEU 44 Ca 0.00 0.00 -0.43 0.00 -0.03 0.00 0.00 56.01 55.55 2kym n LEU 44 Cb 0.00 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.05 2kym n LEU 44 CO 0.00 -0.47 1.88 0.61 -1.33 0.00 0.00 177.39 178.08 2kym n GLY 45 N 5.00 0.83 2.69 -0.72 0.00 -1.26 -4.68 105.19 107.05 2kym n GLY 45 Ca 0.00 0.78 -0.10 0.00 0.00 0.00 0.00 46.02 46.71 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 5.91 0.50 3.64 -0.02 0.00 -1.26 -5.10 105.19 108.86 2kym n GLY 46 Ca 0.33 -0.06 -0.43 0.00 0.00 0.00 0.00 46.02 45.86 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 0.35 3.99 0.00 1.61 0.04 -1.26 -4.34 135.00 135.39 2kym s PRO 47 Ca 0.29 1.82 0.00 0.00 0.04 0.00 0.00 61.00 63.16 2kym s PRO 47 Cb 0.25 -3.97 0.00 0.00 0.04 0.00 0.00 34.50 30.82 2kym s PRO 47 CO -0.17 -1.05 0.00 0.41 0.04 0.00 0.00 177.00 176.23 2kym n GLY 48 N 4.31 4.95 3.15 0.56 0.00 -1.23 -4.81 105.19 112.12 2kym n GLY 48 Ca 0.17 -2.15 -0.32 0.00 0.00 0.00 0.00 46.02 43.73 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 2.04 -0.03 0.99 0.20 -1.25 -3.91 118.68 116.72 2kym s LEU 49 Ca 0.00 -0.58 0.01 0.00 0.69 0.00 0.00 54.13 54.26 2kym s LEU 49 Cb 0.00 -1.39 0.01 0.00 -0.43 0.00 0.00 46.19 44.39 2kym s LEU 49 CO 0.00 0.07 -0.05 0.54 -0.29 0.00 0.00 176.35 176.62 2kym s VAL 50 N 0.87 0.49 0.63 1.68 0.11 -0.38 -4.67 120.40 119.14 2kym s VAL 50 Ca -0.06 -0.15 -0.16 0.00 -2.93 0.00 0.00 61.98 58.67 2kym s VAL 50 Cb -0.15 -0.49 -0.01 0.00 -1.53 0.00 0.00 36.38 34.20 2kym s VAL 50 CO -0.02 0.19 1.11 -2.16 -3.33 0.00 0.00 175.10 170.89 2kym s PRO 51 N 0.57 2.93 0.57 1.54 0.04 -1.26 0.00 135.00 139.39 2kym s PRO 51 Ca -0.07 1.44 0.35 0.00 0.04 0.00 0.00 61.00 62.76 2kym s PRO 51 Cb -0.11 -1.96 1.70 0.00 0.04 0.00 0.00 34.50 34.17 2kym s PRO 51 CO -0.00 -1.16 2.12 0.28 0.04 0.00 0.00 177.00 178.29 2kym h VAL 52 N 0.30 0.20 0.00 -0.36 2.07 -1.79 -1.27 116.25 115.39 2kym h VAL 52 Ca -0.47 -0.39 0.00 0.00 0.82 0.00 0.00 66.70 66.66 2kym h VAL 52 Cb 1.25 1.32 0.00 0.00 -1.52 0.00 0.00 31.29 32.34 2kym h VAL 52 CO 0.55 0.04 0.00 -1.20 0.02 0.00 0.00 177.57 176.98 2kym n SER 53 N -3.27 0.00 0.00 0.57 7.64 -1.26 -2.80 113.62 114.49 2kym n SER 53 Ca -0.01 -0.66 0.00 0.00 1.01 0.00 0.00 58.87 59.20 2kym n SER 53 Cb 0.22 -0.09 0.00 0.00 -1.01 0.00 0.00 64.21 63.33 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 -1.09 0.00 -4.10 1.43 4.02 -0.49 -5.01 117.16 111.91 2kym n TYR 54 Ca 0.19 -0.10 -0.08 0.00 -0.01 0.00 0.00 57.90 57.91 2kym n TYR 54 Cb 0.14 -0.01 -0.10 0.00 -0.02 0.00 0.00 39.34 39.35 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 -0.20 0.28 -0.11 -0.72 -7.23 -1.12 -3.31 120.40 107.99 2kym s VAL 55 Ca 0.00 -1.83 0.01 0.00 -1.81 0.00 0.00 61.98 58.35 2kym s VAL 55 Cb 0.00 -1.56 0.02 0.00 0.56 0.00 0.00 36.38 35.40 2kym s VAL 55 CO 0.00 -0.97 -0.12 -0.60 -0.31 0.00 0.00 175.10 173.10 2kym s ARG 56 N -3.91 1.89 -0.40 4.82 3.52 0.09 -4.81 118.95 120.16 2kym s ARG 56 Ca 0.08 -0.43 -0.29 0.00 -0.13 0.00 0.00 55.73 54.97 2kym s ARG 56 Cb 0.08 -1.72 0.01 0.00 -1.56 0.00 0.00 34.95 31.75 2kym s ARG 56 CO -0.09 -0.14 1.44 0.42 -0.81 0.00 0.00 175.30 176.12 2kym s ILE 57 N 1.25 3.87 0.38 4.11 -1.09 -1.26 -0.94 121.20 127.52 2kym s ILE 57 Ca -0.02 0.89 0.01 0.00 -2.23 0.00 0.00 60.65 59.30 2kym s ILE 57 Cb -0.14 -4.15 -0.01 0.00 -1.58 0.00 0.00 42.46 36.58 2kym s ILE 57 CO -0.04 -0.72 0.05 2.30 -1.23 0.00 0.00 174.94 175.30 2kym n ILE 58 N 7.07 0.00 -4.41 2.92 -5.35 -1.13 -4.49 119.36 113.98 2kym n ILE 58 Ca 0.17 -1.97 -0.21 0.00 -0.27 0.00 0.00 62.75 60.47 2kym n ILE 58 Cb 0.48 0.52 -0.13 0.00 -1.74 0.00 0.00 39.64 38.76 2kym n ILE 58 CO 0.00 0.00 0.00 -0.62 -1.76 0.00 0.00 176.55 174.17 2kym s ASP 59 N -3.20 1.88 0.13 7.28 2.15 -1.25 -3.98 116.67 119.68 2kym s ASP 59 Ca 0.07 -0.49 -0.09 0.00 0.43 0.00 0.00 52.55 52.47 2kym s ASP 59 Cb 0.00 -0.13 -0.08 0.00 -0.30 0.00 0.00 42.92 42.42 2kym s ASP 59 CO 0.05 0.06 1.36 -0.07 -0.17 0.00 0.00 175.17 176.39 2kym h LEU 60 N 4.85 0.80 -0.41 -1.34 4.07 -1.92 0.25 115.31 121.61 2kym h LEU 60 Ca -0.40 -0.52 -0.07 0.00 0.08 0.00 0.00 57.88 56.98 2kym h LEU 60 Cb 1.18 -0.24 -0.01 0.00 1.08 0.00 0.00 40.66 42.67 2kym h LEU 60 CO 0.43 1.30 -0.35 0.24 -1.08 0.00 0.00 178.44 178.98 2kym h MET 61 N 0.46 0.00 -0.98 1.13 2.86 -1.99 -3.39 114.93 113.03 2kym h MET 61 Ca -0.04 0.00 -0.27 0.00 -2.06 0.00 0.00 59.70 57.33 2kym h MET 61 Cb 1.36 0.00 -0.21 0.00 0.06 0.00 0.00 31.60 32.81 2kym h MET 61 CO 0.15 0.35 -0.62 -3.47 1.06 0.00 0.00 176.91 174.38 2kym n ASP 62 N -3.28 -2.54 0.00 1.22 -0.08 -1.19 -4.98 116.55 105.71 2kym n ASP 62 Ca 0.02 -2.94 0.07 0.00 -1.51 0.00 0.00 54.79 50.42 2kym n ASP 62 Cb 0.60 1.23 0.33 0.00 2.34 0.00 0.00 41.12 45.62 2kym n ASP 62 CO 0.00 0.00 0.00 -0.81 0.12 0.00 0.00 177.20 176.51 2kym n PRO 63 N 2.38 0.08 0.03 -0.67 -0.04 0.88 -2.02 135.00 135.64 2kym n PRO 63 Ca 0.17 0.21 0.11 0.00 -0.04 0.00 0.00 63.50 63.96 2kym n PRO 63 Cb 0.57 -1.50 -0.01 0.00 -0.04 0.00 0.00 33.50 32.52 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 -1.42 3.35 -0.05 0.55 0.00 -1.26 -3.46 120.51 118.23 2kym n ALA 64 Ca 0.05 -0.42 -0.12 0.00 0.00 0.00 0.00 53.44 52.95 2kym n ALA 64 Cb 0.15 -0.94 -0.10 0.00 0.00 0.00 0.00 19.45 18.55 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 -0.02 -0.78 0.00 3.64 -1.79 -3.31 116.57 114.31 2kym h LYS 65 Ca 0.00 0.00 -0.13 0.00 -1.27 0.00 0.00 60.65 59.26 2kym h LYS 65 Cb 0.77 0.01 -0.07 0.00 -0.41 0.00 0.00 32.23 32.52 2kym h LYS 65 CO 0.00 0.72 0.16 0.66 -2.27 0.00 0.00 179.45 178.72 2kym n TYR 66 N -4.70 1.85 0.08 1.91 4.02 -1.24 -4.11 117.16 114.97 2kym n TYR 66 Ca -0.08 -0.87 0.04 0.00 -0.01 0.00 0.00 57.90 56.98 2kym n TYR 66 Cb 0.37 -0.54 -0.03 0.00 -0.02 0.00 0.00 39.34 39.12 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 2.83 0.63 -0.00 -0.72 0.00 -1.65 -3.32 119.26 117.03 2kym h ALA 67 Ca 0.15 -0.51 0.00 0.00 0.00 0.00 0.00 54.91 54.55 2kym h ALA 67 Cb 1.90 0.13 0.00 0.00 0.00 0.00 0.00 17.79 19.83 2kym h ALA 67 CO 0.53 0.58 -0.57 -1.13 0.00 0.00 0.00 179.25 178.66 2kym n SER 68 N -2.89 0.62 -4.62 0.00 3.41 -1.26 -4.95 113.62 103.93 2kym n SER 68 Ca -0.05 -0.41 -0.44 0.00 -0.26 0.00 0.00 58.87 57.71 2kym n SER 68 Cb 0.73 0.37 -0.01 0.00 -0.26 0.00 0.00 64.21 65.03 2kym n SER 68 CO 0.00 0.00 0.00 0.52 -0.16 0.00 0.00 175.04 175.40 2kym n VAL 69 N -1.45 1.99 -2.92 -3.33 0.31 -1.25 -4.89 118.33 106.79 2kym n VAL 69 Ca 0.06 -0.50 -0.44 0.00 -0.01 0.00 0.00 64.34 63.45 2kym n VAL 69 Cb 0.34 -1.15 0.00 0.00 -0.91 0.00 0.00 33.84 32.12 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 1.11 5.56 -0.36 4.52 8.00 -1.26 -4.84 116.55 129.28 2kym n ASP 70 Ca 0.08 -3.13 0.30 0.00 0.71 0.00 0.00 54.79 52.75 2kym n ASP 70 Cb 0.33 -1.43 0.61 0.00 -0.02 0.00 0.00 41.12 40.61 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 3.88 0.39 -0.54 -3.53 1.35 -1.90 0.26 112.91 112.82 2kym h THR 71 Ca 0.27 -0.07 0.04 0.00 -0.55 0.00 0.00 66.41 66.09 2kym h THR 71 Cb 0.75 0.15 -0.04 0.00 -1.73 0.00 0.00 68.15 67.29 2kym h THR 71 CO 1.29 0.04 0.30 0.22 -0.25 0.00 0.00 175.52 177.13 2kym h TYR 72 N 0.22 0.56 -2.77 4.73 3.20 -1.88 -3.40 116.97 117.63 2kym h TYR 72 Ca 0.65 0.02 -0.57 0.00 3.14 0.00 0.00 58.73 61.97 2kym h TYR 72 Cb 2.00 -0.17 -0.03 0.00 1.54 0.00 0.00 36.73 40.07 2kym h TYR 72 CO -0.00 0.30 1.13 0.34 -1.64 0.00 0.00 178.16 178.28 2kym s ASP 73 N -5.56 6.37 0.61 -2.11 2.15 0.90 -4.86 116.67 114.17 2kym s ASP 73 Ca -0.13 1.61 0.31 0.00 0.43 0.00 0.00 52.55 54.77 2kym s ASP 73 Cb 0.14 -2.53 1.73 0.00 -0.30 0.00 0.00 42.92 41.95 2kym s ASP 73 CO 0.74 -1.27 2.08 0.08 -0.17 0.00 0.00 175.17 176.64 2kym h ARG 74 N 10.76 0.00 0.52 4.34 -0.00 -1.83 -2.24 114.38 125.93 2kym h ARG 74 Ca -0.34 0.00 -0.03 0.00 -0.00 0.00 0.00 59.98 59.62 2kym h ARG 74 Cb 1.15 0.00 0.01 0.00 -0.00 0.00 0.00 29.97 31.13 2kym h ARG 74 CO 1.00 0.00 -0.25 0.93 -0.00 0.00 0.00 179.97 181.65 2kym h GLU 75 N 0.00 -0.67 0.56 0.08 5.08 -1.90 -1.70 114.58 116.04 2kym h GLU 75 Ca 0.07 0.05 -0.02 0.00 -1.00 0.00 0.00 59.36 58.46 2kym h GLU 75 Cb 0.53 0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.93 2kym h GLU 75 CO -0.00 -0.37 -0.39 1.96 -1.00 0.00 0.00 179.01 179.22 2kym h GLN 76 N -1.03 -0.88 -0.89 2.33 1.08 -1.67 -1.60 115.11 112.44 2kym h GLN 76 Ca -0.07 0.06 0.24 0.00 -1.45 0.00 0.00 58.65 57.42 2kym h GLN 76 Cb 0.61 0.20 -0.05 0.00 -0.05 0.00 0.00 27.48 28.19 2kym h GLN 76 CO 0.12 -0.59 0.62 -0.24 -0.95 0.00 0.00 178.83 177.78 2kym h VAL 77 N -0.92 0.60 0.10 -0.54 3.04 -1.55 -0.89 116.25 116.09 2kym h VAL 77 Ca -0.07 -0.06 -0.00 0.00 -1.01 0.00 0.00 66.70 65.56 2kym h VAL 77 Cb 0.76 0.42 0.00 0.00 -2.01 0.00 0.00 31.29 30.46 2kym h VAL 77 CO 0.04 0.03 -0.05 0.24 -1.01 0.00 0.00 177.57 176.82 2kym h MET 78 N 0.17 -0.13 -0.79 4.17 2.86 -0.59 -1.29 114.93 119.32 2kym h MET 78 Ca 0.44 0.01 0.08 0.00 -2.06 0.00 0.00 59.70 58.17 2kym h MET 78 Cb 1.48 0.03 -0.07 0.00 0.06 0.00 0.00 31.60 33.10 2kym h MET 78 CO -0.08 0.26 0.46 0.87 1.06 0.00 0.00 176.91 179.47 2kym h LYS 79 N -0.54 0.77 0.39 1.72 1.57 -0.26 0.24 116.57 120.45 2kym h LYS 79 Ca -0.01 -0.05 -0.02 0.00 -1.87 0.00 0.00 60.65 58.70 2kym h LYS 79 Cb 0.44 -0.17 0.00 0.00 0.08 0.00 0.00 32.23 32.58 2kym h LYS 79 CO 0.02 0.51 -0.19 0.82 -0.57 0.00 0.00 179.45 180.04 2kym h ILE 80 N 0.79 0.59 -0.82 1.86 5.03 -1.32 0.24 117.51 123.89 2kym h ILE 80 Ca 0.37 -0.40 0.06 0.00 -0.12 0.00 0.00 64.86 64.77 2kym h ILE 80 Cb 0.29 0.78 -0.05 0.00 -3.03 0.00 0.00 36.82 34.81 2kym h ILE 80 CO -0.22 0.07 0.53 0.40 -0.68 0.00 0.00 178.15 178.26 2kym h ILE 81 N -0.76 1.06 0.09 -0.67 2.04 -0.95 0.22 117.51 118.54 2kym h ILE 81 Ca -0.05 -0.31 -0.00 0.00 1.00 0.00 0.00 64.86 65.49 2kym h ILE 81 Cb 0.52 0.07 0.00 0.00 -0.74 0.00 0.00 36.82 36.67 2kym h ILE 81 CO 0.09 0.17 -0.04 -0.78 0.00 0.00 0.00 178.15 177.58 2kym h ASP 82 N 0.91 -0.10 0.08 1.72 3.58 -0.44 -0.12 116.42 122.04 2kym h ASP 82 Ca 0.35 -0.44 0.00 0.00 0.42 0.00 0.00 57.03 57.36 2kym h ASP 82 Cb 0.20 0.03 -0.01 0.00 1.72 0.00 0.00 39.33 41.27 2kym h ASP 82 CO -0.12 0.42 -0.08 -0.33 -2.88 0.00 0.00 179.24 176.25 2kym h GLU 83 N -0.68 -0.17 0.00 0.28 4.39 -0.21 -1.38 114.58 116.81 2kym h GLU 83 Ca -0.01 0.01 0.00 0.00 0.34 0.00 0.00 59.36 59.70 2kym h GLU 83 Cb 0.54 0.04 0.00 0.00 -0.10 0.00 0.00 28.75 29.23 2kym h GLU 83 CO 0.02 -0.11 0.00 1.19 -1.16 0.00 0.00 179.01 178.95 2kym n PHE 84 N -5.19 0.70 -3.41 4.33 3.01 0.76 -4.90 117.46 112.76 2kym n PHE 84 Ca -0.07 0.29 -0.18 0.00 1.01 0.00 0.00 57.45 58.50 2kym n PHE 84 Cb 0.12 -0.96 0.07 0.00 -0.01 0.00 0.00 39.48 38.70 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 -2.15 -4.52 -2.80 -1.08 4.01 -0.42 -4.10 118.16 107.09 2kym n LYS 85 Ca 0.02 0.81 -0.41 0.00 -0.51 0.00 0.00 58.31 58.22 2kym n LYS 85 Cb 0.20 -5.69 -0.04 0.00 -0.51 0.00 0.00 35.03 28.99 2kym n LYS 85 CO 0.00 0.00 0.00 0.42 -1.11 0.00 0.00 177.40 176.71 2kym s ILE 86 N -3.41 4.83 0.73 -0.18 1.01 -0.19 -3.86 121.20 120.13 2kym s ILE 86 Ca 0.20 1.90 -0.12 0.00 0.00 0.00 0.00 60.65 62.63 2kym s ILE 86 Cb -0.03 -4.25 0.04 0.00 0.01 0.00 0.00 42.46 38.23 2kym s ILE 86 CO 0.75 0.22 1.10 -2.16 0.00 0.00 0.00 174.94 174.85 2kym s PRO 87 N 0.70 2.45 0.70 2.79 0.04 -1.26 -4.81 135.00 135.61 2kym s PRO 87 Ca 0.47 1.25 -0.07 0.00 0.04 0.00 0.00 61.00 62.69 2kym s PRO 87 Cb -0.21 -1.92 0.06 0.00 0.04 0.00 0.00 34.50 32.48 2kym s PRO 87 CO 0.26 -1.51 1.02 0.99 0.04 0.00 0.00 177.00 177.80 2kym s THR 88 N -2.70 2.28 0.16 1.26 2.01 -1.26 -1.99 115.64 115.40 2kym s THR 88 Ca 0.63 -0.26 -0.20 0.00 0.31 0.00 0.00 61.69 62.16 2kym s THR 88 Cb -0.18 -3.00 0.06 0.00 0.01 0.00 0.00 72.50 69.38 2kym s THR 88 CO 0.51 -0.01 1.64 0.58 -0.69 0.00 0.00 174.62 176.66 2kym h VAL 89 N -0.60 0.46 -0.26 3.82 2.07 -1.13 -0.21 116.25 120.40 2kym h VAL 89 Ca -0.44 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.08 2kym h VAL 89 Cb 1.32 0.46 -0.01 0.00 -1.52 0.00 0.00 31.29 31.53 2kym h VAL 89 CO 0.60 0.00 0.17 -0.33 0.02 0.00 0.00 177.57 178.03 2kym h GLU 90 N -0.16 0.33 -0.20 1.57 5.08 -1.94 -1.65 114.58 117.62 2kym h GLU 90 Ca 0.16 -0.02 0.06 0.00 -1.00 0.00 0.00 59.36 58.56 2kym h GLU 90 Cb 0.41 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.57 2kym h GLU 90 CO -0.40 0.22 0.17 1.96 -1.00 0.00 0.00 179.01 179.96 2kym h GLN 91 N 0.34 0.00 -0.03 2.33 1.08 -1.75 -0.25 115.11 116.84 2kym h GLN 91 Ca 0.10 0.00 -0.04 0.00 -1.45 0.00 0.00 58.65 57.25 2kym h GLN 91 Cb -0.03 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.40 2kym h GLN 91 CO -0.03 0.00 -0.15 2.35 -0.95 0.00 0.00 178.83 180.05 2kym h TRP 92 N 0.00 0.22 -0.70 2.96 7.01 -0.13 -0.47 115.95 124.84 2kym h TRP 92 Ca 0.09 -0.09 -0.08 0.00 2.11 0.00 0.00 58.89 60.92 2kym h TRP 92 Cb 0.43 -0.03 -0.03 0.00 -2.10 0.00 0.00 29.16 27.43 2kym h TRP 92 CO 0.00 0.79 0.14 0.87 -2.79 0.00 0.00 178.44 177.46 2kym h LYS 93 N -0.42 1.14 -0.23 2.65 1.57 -0.83 -1.10 116.57 119.34 2kym h LYS 93 Ca -0.01 -0.29 -0.11 0.00 -1.87 0.00 0.00 60.65 58.37 2kym h LYS 93 Cb 0.81 -0.14 -0.00 0.00 0.08 0.00 0.00 32.23 32.97 2kym h LYS 93 CO 0.03 1.02 -0.28 0.22 -0.57 0.00 0.00 179.45 179.87 2kym h ASP 94 N 1.07 0.65 -0.37 0.86 3.58 -1.13 -0.54 116.42 120.54 2kym h ASP 94 Ca 0.22 -0.49 -0.01 0.00 0.42 0.00 0.00 57.03 57.17 2kym h ASP 94 Cb 0.41 -0.18 -0.02 0.00 1.72 0.00 0.00 39.33 41.26 2kym h ASP 94 CO 0.01 1.02 0.21 1.56 -2.88 0.00 0.00 179.24 179.16 2kym h GLN 95 N 0.30 0.52 -0.42 0.28 1.08 -0.96 -0.23 115.11 115.68 2kym h GLN 95 Ca 0.03 -0.06 -0.13 0.00 -1.45 0.00 0.00 58.65 57.05 2kym h GLN 95 Cb 0.85 -0.10 -0.01 0.00 -0.05 0.00 0.00 27.48 28.17 2kym h GLN 95 CO 0.07 0.41 -0.24 1.79 -0.95 0.00 0.00 178.83 179.91 2kym h THR 96 N 0.48 1.28 -0.61 -0.54 1.35 -1.22 0.25 112.91 113.89 2kym h THR 96 Ca 0.13 -1.40 -0.04 0.00 -0.55 0.00 0.00 66.41 64.55 2kym h THR 96 Cb 0.04 1.27 -0.03 0.00 -1.73 0.00 0.00 68.15 67.70 2kym h THR 96 CO -0.02 0.47 0.22 0.03 -0.25 0.00 0.00 175.52 175.97 2kym h ARG 97 N 0.72 0.91 0.00 4.72 2.47 -0.89 0.21 114.38 122.52 2kym h ARG 97 Ca 0.09 -0.15 -0.10 0.00 -1.26 0.00 0.00 59.98 58.56 2kym h ARG 97 Cb 0.82 -0.15 -0.02 0.00 -1.65 0.00 0.00 29.97 28.97 2kym h ARG 97 CO 0.07 0.76 -0.80 0.07 0.56 0.00 0.00 179.97 180.62 2kym h ARG 98 N 0.89 0.00 0.00 0.04 0.11 -0.93 -2.35 114.38 112.13 2kym h ARG 98 Ca 0.21 0.00 -0.08 0.00 0.10 0.00 0.00 59.98 60.21 2kym h ARG 98 Cb 0.21 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 31.27 2kym h ARG 98 CO -0.02 0.30 -0.60 -0.92 0.10 0.00 0.00 179.97 178.84 2kym h TYR 99 N 0.00 0.00 0.00 4.08 3.20 -0.05 -3.28 116.97 120.92 2kym h TYR 99 Ca -0.05 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.82 2kym h TYR 99 Cb 1.35 0.00 0.00 0.00 1.54 0.00 0.00 36.73 39.62 2kym h TYR 99 CO 0.00 0.34 -1.61 1.63 -1.64 0.00 0.00 178.16 176.89 2kym n LYS 100 N -3.08 0.57 -0.50 1.82 4.01 0.70 -4.98 118.16 116.71 2kym n LYS 100 Ca 0.00 -0.09 -0.27 0.00 -0.51 0.00 0.00 58.31 57.45 2kym n LYS 100 Cb 0.69 -1.60 0.20 0.00 -0.51 0.00 0.00 35.03 33.81 2kym n LYS 100 CO 0.00 0.00 0.00 -0.85 -1.11 0.00 0.00 177.40 175.44 2kym n GLU 101 N -2.29 -2.66 -3.36 1.97 0.28 -0.89 -4.00 120.64 109.70 2kym n GLU 101 Ca -0.02 -0.77 -0.19 0.00 -0.16 0.00 0.00 57.16 56.02 2kym n GLU 101 Cb 0.54 -1.72 0.07 0.00 1.43 0.00 0.00 31.44 31.75 2kym n GLU 101 CO 0.00 0.00 0.00 0.43 -0.16 0.00 0.00 177.13 177.40 2kym n SER 102 N -2.80 -4.81 -2.37 -1.84 7.64 -1.26 -5.01 113.62 103.16 2kym n SER 102 Ca 0.05 -0.46 0.00 0.00 1.01 0.00 0.00 58.87 59.47 2kym n SER 102 Cb 0.52 -4.29 0.00 0.00 -1.01 0.00 0.00 64.21 59.43 2kym n SER 102 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 2kym n SER 103 N -2.38 -0.48 -4.86 6.43 7.64 -1.26 -5.04 113.62 113.68 2kym n SER 103 Ca -0.05 -0.65 -0.31 0.00 1.01 0.00 0.00 58.87 58.86 2kym n SER 103 Cb 0.57 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.77 2kym n SER 103 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 2kym s ILE 104 N -0.89 4.65 0.87 0.44 1.01 -1.26 -5.01 121.20 121.00 2kym s ILE 104 Ca 0.00 0.95 -0.15 0.00 0.00 0.00 0.00 60.65 61.46 2kym s ILE 104 Cb 0.00 -3.82 -0.03 0.00 0.01 0.00 0.00 42.46 38.61 2kym s ILE 104 CO 0.00 -1.03 0.17 0.00 0.00 0.00 0.00 174.94 174.08 2kym n GLN 105 N -2.48 -0.03 -4.11 2.79 10.64 -1.26 -5.02 117.38 117.90 2kym n GLN 105 Ca 0.06 0.02 -0.16 0.00 -1.83 0.00 0.00 57.00 55.10 2kym n GLN 105 Cb 0.54 -1.63 -0.04 0.00 -0.86 0.00 0.00 30.24 28.25 2kym n GLN 105 CO 0.00 0.00 0.00 0.96 -1.83 0.00 0.00 177.06 176.19 2kym s ILE 106 N -2.15 0.00 0.00 -0.39 -0.00 -1.26 -5.11 121.20 112.30 2kym s ILE 106 Ca 0.56 -1.64 0.00 0.00 -0.00 0.00 0.00 60.65 59.57 2kym s ILE 106 Cb -0.26 -2.68 0.00 0.00 -0.00 0.00 0.00 42.46 39.52 2kym s ILE 106 CO 0.68 0.00 0.61 0.61 -0.00 0.00 0.00 174.94 176.84 2kym n GLY 107 N -0.61 -3.04 3.55 6.27 0.00 -1.26 -4.80 105.19 105.30 2kym n GLY 107 Ca 0.02 0.20 -0.30 0.00 0.00 0.00 0.00 46.02 45.95 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 -2.27 4.25 0.00 1.61 4.22 -1.26 -5.08 114.94 116.41 2kym s ASN 108 Ca 0.00 -0.44 0.00 0.00 -2.14 0.00 0.00 52.86 50.28 2kym s ASN 108 Cb 0.00 -0.75 0.00 0.00 1.28 0.00 0.00 41.25 41.78 2kym s ASN 108 CO 0.00 0.18 0.00 0.61 -2.04 0.00 0.00 177.10 175.85 2kym n GLY 109 N 0.71 2.63 3.30 0.45 0.00 -1.26 -5.15 105.19 105.87 2kym n GLY 109 Ca -0.14 0.11 -0.30 0.00 0.00 0.00 0.00 46.02 45.69 2kym n GLY 109 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2kym n HIS 110 N 0.00 -1.61 -3.75 1.61 8.25 -1.26 -5.05 115.22 113.42 2kym n HIS 110 Ca 0.00 -0.01 -0.08 0.00 -0.26 0.00 0.00 57.72 57.36 2kym n HIS 110 Cb 0.00 -1.56 -0.02 0.00 1.12 0.00 0.00 29.99 29.53 2kym n HIS 110 CO 0.00 0.00 0.00 0.20 0.64 0.00 0.00 176.34 177.18 2kym s GLY 111 N -2.05 -0.22 0.20 -1.41 0.00 -1.26 -5.13 107.32 97.45 2kym s GLY 111 Ca 0.59 -0.11 -0.32 0.00 0.00 0.00 0.00 44.72 44.88 2kym s GLY 111 CO 0.63 -0.03 1.28 -0.18 0.00 0.00 0.00 173.10 174.81 2kym n GLN 112 N -0.44 1.57 -2.59 2.90 7.27 -1.26 -4.99 117.38 119.84 2kym n GLN 112 Ca -0.07 0.56 -0.16 0.00 0.07 0.00 0.00 57.00 57.39 2kym n GLN 112 Cb 0.60 -2.13 0.06 0.00 2.41 0.00 0.00 30.24 31.18 2kym n GLN 112 CO 0.00 0.00 0.00 -1.13 0.07 0.00 0.00 177.06 176.00 2kym n SER 113 N 2.11 1.68 -3.80 1.69 3.41 -1.26 -5.14 113.62 112.31 2kym n SER 113 Ca 0.14 -2.24 -0.13 0.00 -0.26 0.00 0.00 58.87 56.38 2kym n SER 113 Cb 0.28 -0.36 -0.09 0.00 -0.26 0.00 0.00 64.21 63.77 2kym n SER 113 CO 0.00 0.00 0.00 -1.58 -0.16 0.00 0.00 175.04 173.30 2kym s GLN 114 N -4.19 0.59 -0.12 4.33 0.74 -1.26 -5.16 119.66 114.59 2kym s GLN 114 Ca 0.50 -0.23 -0.01 0.00 0.05 0.00 0.00 55.36 55.66 2kym s GLN 114 Cb -0.04 0.26 -0.02 0.00 1.10 0.00 0.00 33.01 34.30 2kym s GLN 114 CO 0.32 -0.15 -0.08 0.20 -0.55 0.00 0.00 175.29 175.03 2kym s GLY 115 N -1.27 1.65 -0.07 2.59 0.00 -1.26 -5.02 107.32 103.94 2kym s GLY 115 Ca -0.13 -0.86 -0.08 0.00 0.00 0.00 0.00 44.72 43.65 2kym s GLY 115 CO 0.03 -0.26 -0.15 1.04 0.00 0.00 0.00 173.10 173.76 2kym n LEU 116 N 3.19 0.91 0.00 0.66 4.32 -1.26 -5.39 117.00 119.43 2kym n LEU 116 Ca -0.18 0.15 0.10 0.00 -0.02 0.00 0.00 56.01 56.06 2kym n LEU 116 Cb 0.53 -0.56 0.58 0.00 -1.62 0.00 0.00 43.42 42.34 2kym n LEU 116 CO 0.31 -0.42 0.77 1.21 -1.22 0.00 0.00 177.39 178.04