#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kut n ASP 2 N 0.00 4.63 -4.81 3.17 8.00 -1.26 -4.98 116.55 121.30 2kut n ASP 2 Ca 0.00 -2.91 -0.33 0.00 0.71 0.00 0.00 54.79 52.26 2kut n ASP 2 Cb 0.00 -1.69 -0.04 0.00 -0.02 0.00 0.00 41.12 39.37 2kut n ASP 2 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 2kut s LEU 3 N 3.07 3.77 0.50 0.64 1.02 -1.26 -4.96 118.68 121.46 2kut s LEU 3 Ca 0.50 1.77 0.28 0.00 0.02 0.00 0.00 54.13 56.69 2kut s LEU 3 Cb 0.07 -4.54 1.26 0.00 0.02 0.00 0.00 46.19 43.00 2kut s LEU 3 CO 0.01 -0.69 1.97 1.55 0.02 0.00 0.00 176.35 179.21 2kut h PRO 4 N 1.34 0.00 -5.08 1.29 0.13 -1.96 -3.42 132.00 124.30 2kut h PRO 4 Ca -0.48 0.00 -0.58 0.00 -0.87 0.00 0.00 66.00 64.07 2kut h PRO 4 Cb 1.20 0.00 -0.32 0.00 0.13 0.00 0.00 31.00 32.01 2kut h PRO 4 CO 0.60 0.15 -0.84 0.42 -0.23 0.00 0.00 178.00 178.09 2kut s ILE 5 N -3.88 1.51 -0.08 -3.56 1.01 -1.26 -2.45 121.20 112.49 2kut s ILE 5 Ca -0.01 -0.72 -0.01 0.00 0.00 0.00 0.00 60.65 59.91 2kut s ILE 5 Cb 0.11 -1.32 0.03 0.00 0.01 0.00 0.00 42.46 41.29 2kut s ILE 5 CO 0.59 0.43 -0.03 -0.89 0.00 0.00 0.00 174.94 175.05 2kut s THR 6 N 0.32 0.59 0.02 2.92 2.01 -1.22 -5.05 115.64 115.23 2kut s THR 6 Ca -0.11 -0.04 -0.01 0.00 0.31 0.00 0.00 61.69 61.84 2kut s THR 6 Cb -0.15 -0.68 -0.04 0.00 0.01 0.00 0.00 72.50 71.64 2kut s THR 6 CO 0.04 0.28 0.17 -0.76 -0.69 0.00 0.00 174.62 173.67 2kut s LEU 7 N 1.69 4.25 -0.16 4.42 1.02 -1.26 -3.89 118.68 124.75 2kut s LEU 7 Ca 0.02 0.26 0.00 0.00 0.02 0.00 0.00 54.13 54.43 2kut s LEU 7 Cb -0.13 -2.67 0.17 0.00 0.02 0.00 0.00 46.19 43.58 2kut s LEU 7 CO -0.05 0.23 1.61 -1.54 0.02 0.00 0.00 176.35 176.61 2kut n SER 8 N 0.73 4.50 -2.69 2.29 3.41 -1.22 -4.69 113.62 115.94 2kut n SER 8 Ca -0.09 -2.62 -0.15 0.00 -0.26 0.00 0.00 58.87 55.75 2kut n SER 8 Cb 0.52 -0.82 -0.06 0.00 -0.26 0.00 0.00 64.21 63.59 2kut n SER 8 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 175.04 176.05 2kut n LYS 9 N 0.37 1.67 -0.19 4.33 4.81 -1.26 -4.57 118.16 123.33 2kut n LYS 9 Ca 0.18 -1.04 0.22 0.00 -0.87 0.00 0.00 58.31 56.80 2kut n LYS 9 Cb 0.71 -2.13 0.61 0.00 0.02 0.00 0.00 35.03 34.24 2kut n LYS 9 CO 0.00 0.00 0.00 0.93 1.17 0.00 0.00 177.40 179.50 2kut h GLU 10 N 5.22 0.21 -4.44 1.64 5.08 -1.98 -3.40 114.58 116.91 2kut h GLU 10 Ca 0.31 -0.01 -0.35 0.00 -1.00 0.00 0.00 59.36 58.30 2kut h GLU 10 Cb 0.54 -0.05 -0.29 0.00 0.50 0.00 0.00 28.75 29.45 2kut h GLU 10 CO 0.89 0.14 -0.76 0.95 -1.00 0.00 0.00 179.01 179.23 2kut s THR 11 N -5.22 0.52 -0.33 1.13 -4.23 -1.26 -5.13 115.64 101.13 2kut s THR 11 Ca -0.07 -0.27 -0.29 0.00 -1.18 0.00 0.00 61.69 59.88 2kut s THR 11 Cb 0.22 -0.45 0.02 0.00 1.34 0.00 0.00 72.50 73.62 2kut s THR 11 CO 0.77 0.15 1.12 -2.16 -0.54 0.00 0.00 174.62 173.96 2kut s PRO 12 N -0.08 4.01 -0.30 3.99 0.04 -1.26 -4.96 135.00 136.44 2kut s PRO 12 Ca 0.02 1.06 -0.04 0.00 0.04 0.00 0.00 61.00 62.07 2kut s PRO 12 Cb -0.03 -3.78 0.19 0.00 0.04 0.00 0.00 34.50 30.92 2kut s PRO 12 CO -0.00 -0.98 0.82 0.12 0.04 0.00 0.00 177.00 176.99 2kut s PHE 13 N 3.84 -1.15 0.49 0.56 2.19 -1.26 -4.81 117.98 117.84 2kut s PHE 13 Ca 0.47 0.82 -0.22 0.00 0.33 0.00 0.00 56.93 58.34 2kut s PHE 13 Cb -0.12 0.25 -0.09 0.00 -1.31 0.00 0.00 43.02 41.75 2kut s PHE 13 CO 0.18 -0.66 0.90 -1.91 1.83 0.00 0.00 175.22 175.56 2kut n GLU 14 N 5.32 1.06 0.00 10.12 2.13 -1.26 -1.90 120.64 136.12 2kut n GLU 14 Ca 0.04 0.39 0.00 0.00 0.66 0.00 0.00 57.16 58.25 2kut n GLU 14 Cb 0.55 -2.00 0.00 0.00 0.27 0.00 0.00 31.44 30.26 2kut n GLU 14 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2kut n GLY 15 N 1.33 3.09 3.77 8.31 0.00 -1.26 -5.02 105.19 115.41 2kut n GLY 15 Ca 0.11 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.73 2kut n GLY 15 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2kut s GLU 16 N -0.35 4.25 0.18 1.61 2.12 -0.80 -4.17 118.70 121.55 2kut s GLU 16 Ca 0.00 2.12 -0.30 0.00 0.36 0.00 0.00 54.97 57.15 2kut s GLU 16 Cb 0.00 -2.96 -0.08 0.00 0.26 0.00 0.00 34.13 31.34 2kut s GLU 16 CO 0.00 -0.24 1.31 -2.00 -0.54 0.00 0.00 175.26 173.78 2kut s GLU 17 N -1.93 4.39 0.05 4.30 2.12 -1.26 -4.20 118.70 122.17 2kut s GLU 17 Ca 0.51 2.03 0.09 0.00 0.36 0.00 0.00 54.97 57.97 2kut s GLU 17 Cb -0.38 -3.21 -0.03 0.00 0.26 0.00 0.00 34.13 30.78 2kut s GLU 17 CO 0.49 -0.26 -0.26 0.96 -0.54 0.00 0.00 175.26 175.66 2kut s ILE 18 N 0.23 2.21 -0.42 -3.70 -4.36 -1.11 -4.97 121.20 109.09 2kut s ILE 18 Ca 0.57 -1.40 -0.17 0.00 -0.26 0.00 0.00 60.65 59.39 2kut s ILE 18 Cb -0.36 -1.88 0.02 0.00 1.25 0.00 0.00 42.46 41.49 2kut s ILE 18 CO 0.37 0.34 0.45 -0.89 0.24 0.00 0.00 174.94 175.45 2kut s THR 19 N -0.84 5.07 -0.30 8.37 2.01 -1.26 -2.43 115.64 126.26 2kut s THR 19 Ca 0.12 -0.27 -0.17 0.00 0.31 0.00 0.00 61.69 61.68 2kut s THR 19 Cb -0.10 -4.04 -0.02 0.00 0.01 0.00 0.00 72.50 68.35 2kut s THR 19 CO 0.03 -0.41 0.48 -0.69 -0.69 0.00 0.00 174.62 173.33 2kut s VAL 20 N 2.20 5.07 -0.02 3.82 1.01 0.22 -3.45 120.40 129.24 2kut s VAL 20 Ca 0.13 0.56 0.04 0.00 0.00 0.00 0.00 61.98 62.71 2kut s VAL 20 Cb -0.17 -3.86 -0.01 0.00 0.00 0.00 0.00 36.38 32.35 2kut s VAL 20 CO 0.14 -0.03 -0.15 -0.55 0.00 0.00 0.00 175.10 174.51 2kut s SER 21 N 1.66 1.78 -0.13 3.32 0.15 -1.25 -2.31 113.70 116.93 2kut s SER 21 Ca 0.18 -0.28 0.01 0.00 0.70 0.00 0.00 55.95 56.57 2kut s SER 21 Cb -0.16 -0.35 0.02 0.00 -1.71 0.00 0.00 66.02 63.82 2kut s SER 21 CO 0.11 0.15 -0.17 0.00 1.20 0.00 0.00 173.24 174.54 2kut s ALA 22 N -0.13 1.90 -0.30 5.45 0.00 -1.26 -3.46 121.76 123.97 2kut s ALA 22 Ca 0.01 -0.89 -0.29 0.00 0.00 0.00 0.00 51.96 50.79 2kut s ALA 22 Cb -0.08 -0.95 0.01 0.00 0.00 0.00 0.00 23.12 22.10 2kut s ALA 22 CO 0.00 -0.17 1.20 1.03 0.00 0.00 0.00 175.76 177.83 2kut s ARG 23 N 1.10 4.01 -0.25 0.00 0.52 -1.02 -4.28 118.95 119.04 2kut s ARG 23 Ca -0.03 1.20 -0.15 0.00 -0.52 0.00 0.00 55.73 56.23 2kut s ARG 23 Cb -0.14 -3.81 -0.04 0.00 0.52 0.00 0.00 34.95 31.48 2kut s ARG 23 CO -0.05 -0.99 0.38 0.08 0.02 0.00 0.00 175.30 174.74 2kut s VAL 24 N 3.98 5.18 -0.21 3.52 1.01 -1.01 -4.94 120.40 127.93 2kut s VAL 24 Ca 0.51 0.62 -0.05 0.00 0.00 0.00 0.00 61.98 63.06 2kut s VAL 24 Cb -0.15 -3.71 -0.02 0.00 0.00 0.00 0.00 36.38 32.50 2kut s VAL 24 CO 0.19 0.19 0.01 -0.89 0.00 0.00 0.00 175.10 174.60 2kut s THR 25 N 1.81 3.91 -0.13 3.92 2.01 -1.26 -0.70 115.64 125.20 2kut s THR 25 Ca 0.16 -0.32 -0.21 0.00 0.31 0.00 0.00 61.69 61.64 2kut s THR 25 Cb -0.15 -2.78 -0.03 0.00 0.01 0.00 0.00 72.50 69.54 2kut s THR 25 CO 0.09 0.41 0.59 0.20 -0.69 0.00 0.00 174.62 175.22 2kut s ASN 26 N 1.23 6.76 -0.06 3.53 -0.87 -1.21 -5.06 114.94 119.26 2kut s ASN 26 Ca 0.03 0.92 0.02 0.00 -1.57 0.00 0.00 52.86 52.26 2kut s ASN 26 Cb -0.15 -2.34 0.01 0.00 -0.02 0.00 0.00 41.25 38.76 2kut s ASN 26 CO 0.01 -0.13 -0.11 -0.13 -2.57 0.00 0.00 177.10 174.17 2kut s ARG 27 N 1.15 1.55 0.00 -0.60 0.52 -1.26 -4.40 118.95 115.91 2kut s ARG 27 Ca 0.30 -0.38 0.00 0.00 -0.52 0.00 0.00 55.73 55.13 2kut s ARG 27 Cb -0.16 -1.31 0.00 0.00 0.52 0.00 0.00 34.95 34.00 2kut s ARG 27 CO 0.12 0.03 0.00 0.41 0.02 0.00 0.00 175.30 175.88 2kut n GLY 28 N 3.78 -0.87 0.00 -3.53 0.00 -1.26 -5.01 105.19 98.30 2kut n GLY 28 Ca -0.23 0.56 0.00 0.00 0.00 0.00 0.00 46.02 46.36 2kut n GLY 28 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2kut n ALA 29 N 0.00 0.22 -2.58 4.61 0.00 -1.26 -5.12 120.51 116.38 2kut n ALA 29 Ca 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 53.44 53.35 2kut n ALA 29 Cb 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.38 2kut n ALA 29 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2kut s ALA 30 N 0.00 0.02 -0.03 0.00 0.00 -1.26 -5.12 121.76 115.37 2kut s ALA 30 Ca 0.00 -0.86 -0.30 0.00 0.00 0.00 0.00 51.96 50.80 2kut s ALA 30 Cb 0.00 0.71 -0.06 0.00 0.00 0.00 0.00 23.12 23.77 2kut s ALA 30 CO 0.00 -0.57 1.63 -1.21 0.00 0.00 0.00 175.76 175.61 2kut s GLU 31 N -3.94 4.19 0.26 0.00 2.02 -1.26 -4.75 118.70 115.23 2kut s GLU 31 Ca 0.13 2.19 -0.05 0.00 0.02 0.00 0.00 54.97 57.26 2kut s GLU 31 Cb 0.04 -3.89 -0.05 0.00 0.10 0.00 0.00 34.13 30.33 2kut s GLU 31 CO -0.04 -0.81 0.52 0.00 0.02 0.00 0.00 175.26 174.96 2kut s ALA 32 N 3.69 3.65 0.22 5.21 0.00 -1.25 -5.02 121.76 128.27 2kut s ALA 32 Ca 0.73 -0.57 -0.03 0.00 0.00 0.00 0.00 51.96 52.09 2kut s ALA 32 Cb -0.34 -2.26 -0.03 0.00 0.00 0.00 0.00 23.12 20.49 2kut s ALA 32 CO 0.30 0.31 0.23 -1.01 0.00 0.00 0.00 175.76 175.58 2kut s HIS 33 N -2.01 1.04 -1.00 0.00 3.76 -1.26 -3.81 115.29 112.01 2kut s HIS 33 Ca 0.43 -1.26 -0.12 0.00 -0.15 0.00 0.00 55.06 53.96 2kut s HIS 33 Cb -0.11 -0.40 -0.01 0.00 1.11 0.00 0.00 32.58 33.17 2kut s HIS 33 CO 0.29 -0.75 0.76 -1.71 -0.85 0.00 0.00 174.74 172.47 2kut n ASN 34 N -0.43 -5.87 -4.08 1.40 2.85 -1.26 -4.84 115.26 103.04 2kut n ASN 34 Ca 0.02 -0.80 -0.35 0.00 -0.11 0.00 0.00 54.58 53.34 2kut n ASN 34 Cb 0.65 -3.63 -0.08 0.00 1.24 0.00 0.00 39.78 37.96 2kut n ASN 34 CO 0.00 0.00 0.00 -0.69 -2.11 0.00 0.00 177.26 174.46 2kut s VAL 35 N -3.28 3.92 0.61 3.44 1.01 -1.26 -4.30 120.40 120.53 2kut s VAL 35 Ca 0.30 -3.57 -0.12 0.00 0.00 0.00 0.00 61.98 58.59 2kut s VAL 35 Cb -0.10 -3.49 -0.04 0.00 0.00 0.00 0.00 36.38 32.75 2kut s VAL 35 CO 0.84 -1.00 1.03 -2.16 0.00 0.00 0.00 175.10 173.81 2kut s PRO 36 N -0.87 3.58 -0.04 2.72 0.04 -1.26 -4.10 135.00 135.06 2kut s PRO 36 Ca 0.23 0.83 0.05 0.00 0.04 0.00 0.00 61.00 62.15 2kut s PRO 36 Cb -0.12 -2.08 -0.01 0.00 0.04 0.00 0.00 34.50 32.33 2kut s PRO 36 CO -0.09 -0.58 -0.19 0.08 0.04 0.00 0.00 177.00 176.25 2kut s VAL 37 N -3.03 1.58 -0.17 -0.36 1.01 -1.26 -3.16 120.40 115.00 2kut s VAL 37 Ca 0.56 -0.81 -0.00 0.00 0.00 0.00 0.00 61.98 61.73 2kut s VAL 37 Cb -0.11 -1.35 0.04 0.00 0.00 0.00 0.00 36.38 34.96 2kut s VAL 37 CO 0.49 0.45 -0.06 0.00 0.00 0.00 0.00 175.10 175.98 2kut s ALA 38 N -0.08 1.59 -0.08 5.51 0.00 -1.16 -4.01 121.76 123.53 2kut s ALA 38 Ca -0.02 -0.91 -0.01 0.00 0.00 0.00 0.00 51.96 51.02 2kut s ALA 38 Cb -0.11 -1.16 -0.03 0.00 0.00 0.00 0.00 23.12 21.82 2kut s ALA 38 CO 0.02 -0.79 -0.02 0.14 0.00 0.00 0.00 175.76 175.11 2kut s VAL 39 N 1.58 4.16 -0.09 0.00 -7.23 -1.25 -3.17 120.40 114.40 2kut s VAL 39 Ca 0.00 -0.31 -0.05 0.00 -1.81 0.00 0.00 61.98 59.82 2kut s VAL 39 Cb -0.15 -2.74 0.04 0.00 0.56 0.00 0.00 36.38 34.09 2kut s VAL 39 CO -0.08 0.60 0.22 -0.72 -0.31 0.00 0.00 175.10 174.81 2kut s TYR 40 N -0.87 -0.28 -0.13 2.82 1.13 -1.23 -2.01 117.35 116.79 2kut s TYR 40 Ca 0.13 0.70 -0.25 0.00 -1.41 0.00 0.00 57.07 56.24 2kut s TYR 40 Cb -0.11 0.01 -0.02 0.00 -1.10 0.00 0.00 41.96 40.74 2kut s TYR 40 CO 0.02 -0.21 0.81 -1.17 -2.51 0.00 0.00 175.55 172.49 2kut s LEU 41 N 1.21 4.23 0.00 -3.49 2.96 -1.26 -4.07 118.68 118.26 2kut s LEU 41 Ca -0.09 1.22 0.00 0.00 -0.22 0.00 0.00 54.13 55.04 2kut s LEU 41 Cb -0.10 -3.22 0.00 0.00 0.50 0.00 0.00 46.19 43.37 2kut s LEU 41 CO -0.08 -0.31 0.00 0.61 -1.32 0.00 0.00 176.35 175.26 2kut n GLY 42 N 3.32 0.57 3.87 7.98 0.00 -1.26 -4.65 105.19 115.02 2kut n GLY 42 Ca 0.03 -2.21 -0.34 0.00 0.00 0.00 0.00 46.02 43.50 2kut n GLY 42 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2kut s ASN 43 N -4.00 6.63 0.12 1.61 2.20 -1.26 -4.82 114.94 115.41 2kut s ASN 43 Ca 0.00 0.79 0.20 0.00 -0.94 0.00 0.00 52.86 52.91 2kut s ASN 43 Cb 0.00 -2.18 0.82 0.00 -2.00 0.00 0.00 41.25 37.89 2kut s ASN 43 CO 0.00 0.11 1.61 -0.81 -2.94 0.00 0.00 177.10 175.07 2kut n PRO 44 N 0.60 0.09 -0.21 3.55 -0.04 -1.26 -3.18 135.00 134.55 2kut n PRO 44 Ca -0.06 0.30 -0.03 0.00 -0.04 0.00 0.00 63.50 63.68 2kut n PRO 44 Cb 0.52 -1.67 0.07 0.00 -0.04 0.00 0.00 33.50 32.38 2kut n PRO 44 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2kut h ALA 45 N 2.43 0.81 -0.05 0.55 0.00 -2.01 0.73 119.26 121.73 2kut h ALA 45 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2kut h ALA 45 Cb 0.34 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.97 2kut h ALA 45 CO 0.00 0.08 0.00 1.04 0.00 0.00 0.00 179.25 180.37 2kut n GLN 46 N -4.76 1.13 -0.06 0.00 6.02 -1.19 -4.84 117.38 113.68 2kut n GLN 46 Ca 0.06 -0.20 0.00 0.00 -0.01 0.00 0.00 57.00 56.85 2kut n GLN 46 Cb 0.12 -1.17 0.00 0.00 1.02 0.00 0.00 30.24 30.21 2kut n GLN 46 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2kut n GLY 47 N 0.71 2.86 1.15 1.08 0.00 0.25 -4.88 105.19 106.36 2kut n GLY 47 Ca 0.08 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.25 2kut n GLY 47 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2kut n GLY 48 N -2.00 -1.59 2.99 -0.02 0.00 -1.24 -4.91 105.19 98.43 2kut n GLY 48 Ca 0.00 -0.87 -0.20 0.00 0.00 0.00 0.00 46.02 44.95 2kut n GLY 48 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2kut s VAL 49 N -2.23 0.73 0.14 1.61 0.11 -1.26 -5.07 120.40 114.42 2kut s VAL 49 Ca 0.00 -0.33 -0.30 0.00 -2.93 0.00 0.00 61.98 58.41 2kut s VAL 49 Cb 0.00 -0.65 -0.08 0.00 -1.53 0.00 0.00 36.38 34.12 2kut s VAL 49 CO 0.00 0.23 1.28 -0.70 -3.33 0.00 0.00 175.10 172.58 2kut s GLU 50 N 0.20 4.40 -0.21 1.54 2.12 -1.26 -4.12 118.70 121.37 2kut s GLU 50 Ca -0.03 1.96 -0.02 0.00 0.36 0.00 0.00 54.97 57.24 2kut s GLU 50 Cb -0.08 -3.25 -0.12 0.00 0.26 0.00 0.00 34.13 30.93 2kut s GLU 50 CO 0.00 -0.27 -0.21 -0.89 -0.54 0.00 0.00 175.26 173.35 2kut n ILE 51 N 3.29 1.18 -3.55 -3.70 5.41 -0.85 -5.02 119.36 116.12 2kut n ILE 51 Ca 0.08 -0.41 -0.08 0.00 1.00 0.00 0.00 62.75 63.33 2kut n ILE 51 Cb 0.44 -1.38 -0.03 0.00 -0.71 0.00 0.00 39.64 37.96 2kut n ILE 51 CO 0.00 0.00 0.00 -0.83 0.00 0.00 0.00 176.55 175.72 2kut s GLY 52 N -5.83 -0.34 0.12 7.39 0.00 -1.26 -5.04 107.32 102.36 2kut s GLY 52 Ca -0.28 1.57 -0.10 0.00 0.00 0.00 0.00 44.72 45.91 2kut s GLY 52 CO 0.45 0.67 0.25 1.09 0.00 0.00 0.00 173.10 175.56 2kut s ARG 53 N -2.14 0.97 -0.30 2.90 1.70 -1.26 -3.81 118.95 117.01 2kut s ARG 53 Ca 0.03 -0.99 -0.05 0.00 -0.47 0.00 0.00 55.73 54.25 2kut s ARG 53 Cb -0.01 0.37 0.17 0.00 -0.57 0.00 0.00 34.95 34.91 2kut s ARG 53 CO -0.04 -0.34 0.65 0.34 -1.08 0.00 0.00 175.30 174.84 2kut s ASP 54 N -2.88 -1.23 0.20 -2.89 2.15 -1.26 -5.00 116.67 105.76 2kut s ASP 54 Ca 0.08 1.11 -0.27 0.00 0.43 0.00 0.00 52.55 53.91 2kut s ASP 54 Cb 0.04 2.17 -0.08 0.00 -0.30 0.00 0.00 42.92 44.74 2kut s ASP 54 CO -0.08 -0.23 0.84 -0.89 -0.17 0.00 0.00 175.17 174.64 2kut s THR 55 N 2.86 4.27 0.37 1.71 2.01 -1.26 -4.25 115.64 121.35 2kut s THR 55 Ca 0.09 1.81 -0.22 0.00 0.31 0.00 0.00 61.69 63.68 2kut s THR 55 Cb -0.13 -4.17 -0.10 0.00 0.01 0.00 0.00 72.50 68.10 2kut s THR 55 CO -0.20 0.47 0.90 -0.63 -0.69 0.00 0.00 174.62 174.48 2kut s ILE 56 N -1.21 4.38 0.10 1.82 -1.09 -1.26 -4.98 121.20 118.96 2kut s ILE 56 Ca 0.39 1.52 -0.18 0.00 -2.23 0.00 0.00 60.65 60.14 2kut s ILE 56 Cb -0.23 -3.76 -0.06 0.00 -1.58 0.00 0.00 42.46 36.83 2kut s ILE 56 CO 0.28 -0.11 1.60 -1.28 -1.23 0.00 0.00 174.94 174.19 2kut h SER 57 N 2.48 0.41 -3.15 3.58 0.87 -1.98 -3.43 113.55 112.33 2kut h SER 57 Ca -0.48 -0.23 0.05 0.00 -1.23 0.00 0.00 61.79 59.91 2kut h SER 57 Cb 1.18 -0.11 -0.25 0.00 -0.44 0.00 0.00 62.40 62.78 2kut h SER 57 CO 0.63 0.53 0.36 0.00 -0.53 0.00 0.00 176.83 177.82 2kut s ARG 58 N -5.31 0.54 -0.20 2.24 1.70 -1.26 -4.85 118.95 111.82 2kut s ARG 58 Ca -0.14 0.72 0.01 0.00 -0.47 0.00 0.00 55.73 55.85 2kut s ARG 58 Cb 0.08 0.22 0.02 0.00 -0.57 0.00 0.00 34.95 34.70 2kut s ARG 58 CO 0.73 -0.08 -0.17 0.42 -1.08 0.00 0.00 175.30 175.13 2kut s ILE 59 N 0.60 2.25 0.76 4.99 1.01 -1.25 -5.08 121.20 124.48 2kut s ILE 59 Ca -0.01 -0.96 -0.11 0.00 0.00 0.00 0.00 60.65 59.57 2kut s ILE 59 Cb -0.05 -2.00 0.05 0.00 0.01 0.00 0.00 42.46 40.47 2kut s ILE 59 CO -0.08 0.46 1.08 -2.16 0.00 0.00 0.00 174.94 174.24 2kut s PRO 60 N 1.29 2.41 0.28 2.79 0.04 -1.26 -3.82 135.00 136.72 2kut s PRO 60 Ca 0.04 0.79 -0.29 0.00 0.04 0.00 0.00 61.00 61.57 2kut s PRO 60 Cb -0.14 -1.94 -0.10 0.00 0.04 0.00 0.00 34.50 32.36 2kut s PRO 60 CO -0.11 -1.43 1.31 0.54 0.04 0.00 0.00 177.00 177.35 2kut s VAL 61 N -3.10 2.91 -0.54 -0.36 0.11 -1.26 -2.30 120.40 115.86 2kut s VAL 61 Ca 0.60 0.84 0.00 0.00 -2.93 0.00 0.00 61.98 60.49 2kut s VAL 61 Cb -0.14 -3.54 0.00 0.00 -1.53 0.00 0.00 36.38 31.17 2kut s VAL 61 CO 0.55 0.17 0.00 0.61 -3.33 0.00 0.00 175.10 173.10 2kut n GLY 62 N 1.48 0.75 0.00 6.54 0.00 -1.26 -4.99 105.19 107.70 2kut n GLY 62 Ca 0.03 -0.44 0.00 0.00 0.00 0.00 0.00 46.02 45.61 2kut n GLY 62 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2kut n GLY 63 N -1.82 3.60 0.19 -0.02 0.00 -0.97 -5.05 105.19 101.11 2kut n GLY 63 Ca -0.05 -2.17 -0.01 0.00 0.00 0.00 0.00 46.02 43.79 2kut n GLY 63 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2kut n THR 64 N -0.33 0.00 -3.92 2.61 -2.24 -1.26 -3.33 114.28 105.82 2kut n THR 64 Ca 0.00 -0.14 -0.10 0.00 -2.27 0.00 0.00 64.05 61.54 2kut n THR 64 Cb 0.00 0.07 -0.11 0.00 -2.10 0.00 0.00 70.33 68.19 2kut n THR 64 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 2kut s GLY 65 N -1.13 0.11 -0.20 3.38 0.00 0.13 -4.78 107.32 104.82 2kut s GLY 65 Ca 0.02 -0.27 0.01 0.00 0.00 0.00 0.00 44.72 44.48 2kut s GLY 65 CO 0.02 -0.34 -0.10 -2.27 0.00 0.00 0.00 173.10 170.41 2kut s LEU 66 N -1.03 2.24 0.15 0.66 1.98 -1.26 -2.40 118.68 119.03 2kut s LEU 66 Ca -0.11 -0.88 0.06 0.00 -2.89 0.00 0.00 54.13 50.31 2kut s LEU 66 Cb -0.07 -1.21 -0.04 0.00 0.66 0.00 0.00 46.19 45.53 2kut s LEU 66 CO -0.00 -0.15 0.07 0.00 -1.89 0.00 0.00 176.35 174.39 2kut s ALA 67 N 1.41 3.42 -0.13 5.97 0.00 -1.26 -5.05 121.76 126.12 2kut s ALA 67 Ca -0.01 -1.24 0.01 0.00 0.00 0.00 0.00 51.96 50.71 2kut s ALA 67 Cb -0.16 -1.23 0.02 0.00 0.00 0.00 0.00 23.12 21.75 2kut s ALA 67 CO -0.08 0.53 -0.13 0.50 0.00 0.00 0.00 175.76 176.59 2kut s ARG 68 N -2.92 2.05 -0.03 0.00 3.52 -1.26 -4.32 118.95 115.98 2kut s ARG 68 Ca 0.29 -0.47 0.01 0.00 -0.13 0.00 0.00 55.73 55.43 2kut s ARG 68 Cb -0.10 -1.89 0.02 0.00 -1.56 0.00 0.00 34.95 31.42 2kut s ARG 68 CO 0.21 -0.19 -0.03 0.08 -0.81 0.00 0.00 175.30 174.56 2kut s VAL 69 N 1.40 0.39 -0.08 7.11 1.01 -0.98 -4.91 120.40 124.34 2kut s VAL 69 Ca 0.02 -0.07 0.01 0.00 0.00 0.00 0.00 61.98 61.93 2kut s VAL 69 Cb -0.13 -0.42 -0.03 0.00 0.00 0.00 0.00 36.38 35.79 2kut s VAL 69 CO -0.07 0.18 -0.07 -1.10 0.00 0.00 0.00 175.10 174.03 2kut s GLN 70 N 0.76 2.84 -0.02 2.72 -0.21 -1.26 0.69 119.66 125.18 2kut s GLN 70 Ca -0.09 -0.56 0.00 0.00 0.02 0.00 0.00 55.36 54.73 2kut s GLN 70 Cb -0.12 -2.61 0.02 0.00 1.00 0.00 0.00 33.01 31.30 2kut s GLN 70 CO -0.00 0.60 0.00 -0.46 -2.12 0.00 0.00 175.29 173.31 2kut s TRP 71 N -0.65 0.17 -0.23 0.91 -0.00 -1.02 -4.95 118.94 113.18 2kut s TRP 71 Ca 0.10 0.02 -0.21 0.00 -0.00 0.00 0.00 56.10 56.01 2kut s TRP 71 Cb -0.11 -0.24 -0.02 0.00 -0.00 0.00 0.00 33.47 33.09 2kut s TRP 71 CO 0.02 -0.07 0.68 0.21 -0.00 0.00 0.00 176.95 177.78 2kut s LYS 72 N 0.64 4.16 -0.04 5.86 2.20 -1.26 -2.75 119.74 128.54 2kut s LYS 72 Ca -0.06 0.66 -0.30 0.00 -0.36 0.00 0.00 55.97 55.92 2kut s LYS 72 Cb -0.09 -3.63 -0.05 0.00 -1.51 0.00 0.00 37.83 32.56 2kut s LYS 72 CO -0.01 -0.39 1.45 0.00 -0.36 0.00 0.00 175.35 176.04 2kut s ALA 73 N 2.41 3.61 0.00 3.13 0.00 -1.26 -4.92 121.76 124.73 2kut s ALA 73 Ca 0.29 0.84 0.00 0.00 0.00 0.00 0.00 51.96 53.09 2kut s ALA 73 Cb -0.16 -3.64 0.00 0.00 0.00 0.00 0.00 23.12 19.32 2kut s ALA 73 CO 0.09 -1.09 0.00 -2.37 0.00 0.00 0.00 175.76 172.39 2kut n THR 74 N 5.00 0.00 -3.53 0.00 5.66 -1.26 -4.17 114.28 115.98 2kut n THR 74 Ca 0.14 0.00 -0.19 0.00 -3.05 0.00 0.00 64.05 60.96 2kut n THR 74 Cb 0.43 0.00 0.07 0.00 -1.55 0.00 0.00 70.33 69.28 2kut n THR 74 CO 0.00 0.00 0.00 -1.14 -3.05 0.00 0.00 175.07 170.88 2kut n ARG 75 N 0.00 -5.88 -2.95 1.09 0.63 -1.26 -4.97 116.66 103.32 2kut n ARG 75 Ca 0.00 0.76 0.01 0.00 -0.92 0.00 0.00 57.85 57.70 2kut n ARG 75 Cb 0.00 -5.61 0.00 0.00 0.45 0.00 0.00 32.46 27.30 2kut n ARG 75 CO 0.00 0.00 0.00 0.21 -2.51 0.00 0.00 177.63 175.33 2kut s LYS 76 N -5.57 0.50 0.32 -0.14 2.20 -1.26 -5.02 119.74 110.78 2kut s LYS 76 Ca 0.01 -0.20 0.07 0.00 -0.36 0.00 0.00 55.97 55.49 2kut s LYS 76 Cb -0.00 0.05 0.55 0.00 -1.51 0.00 0.00 37.83 36.92 2kut s LYS 76 CO 0.76 -0.71 1.77 -0.07 -0.36 0.00 0.00 175.35 176.74 2kut h LEU 77 N 6.00 0.24 -2.70 5.43 4.07 -2.04 -3.48 115.31 122.84 2kut h LEU 77 Ca 0.01 -0.09 -0.12 0.00 0.08 0.00 0.00 57.88 57.76 2kut h LEU 77 Cb 1.20 -0.07 0.00 0.00 1.08 0.00 0.00 40.66 42.88 2kut h LEU 77 CO 0.00 0.56 -0.45 0.00 -1.08 0.00 0.00 178.44 177.48 2kut n ALA 78 N -2.48 -2.68 -1.75 1.53 0.00 -1.26 -4.74 120.51 109.14 2kut n ALA 78 Ca -0.01 0.32 -0.19 0.00 0.00 0.00 0.00 53.44 53.56 2kut n ALA 78 Cb 0.41 -2.08 -0.08 0.00 0.00 0.00 0.00 19.45 17.70 2kut n ALA 78 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 2kut s GLY 79 N -2.73 -0.61 -0.22 0.00 0.00 -1.26 -4.08 107.32 98.41 2kut s GLY 79 Ca 0.11 -1.39 -0.04 0.00 0.00 0.00 0.00 44.72 43.39 2kut s GLY 79 CO 0.79 4.02 0.10 0.54 0.00 0.00 0.00 173.10 178.56 2kut n ARG 80 N 8.50 -2.15 -3.15 2.90 1.74 -1.26 -5.04 116.66 118.19 2kut n ARG 80 Ca 0.43 1.93 0.05 0.00 -0.77 0.00 0.00 57.85 59.49 2kut n ARG 80 Cb 0.46 -3.63 -0.00 0.00 -1.02 0.00 0.00 32.46 28.26 2kut n ARG 80 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2kut s ALA 81 N -1.49 -3.18 1.00 7.54 0.00 -1.26 -5.17 121.76 119.21 2kut s ALA 81 Ca 0.05 1.32 0.00 0.00 0.00 0.00 0.00 51.96 53.33 2kut s ALA 81 Cb -0.01 -2.61 0.00 0.00 0.00 0.00 0.00 23.12 20.50 2kut s ALA 81 CO 0.51 -1.82 0.00 0.00 0.00 0.00 0.00 175.76 174.45 2kut n ALA 82 N 5.31 0.00 -3.71 0.00 0.00 -1.26 -4.43 120.51 116.42 2kut n ALA 82 Ca 0.04 0.00 -0.25 0.00 0.00 0.00 0.00 53.44 53.23 2kut n ALA 82 Cb 0.55 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.00 2kut n ALA 82 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 2kut n ASN 83 N -2.99 -4.63 -0.25 0.00 6.94 -1.26 -4.82 115.26 108.25 2kut n ASN 83 Ca 0.00 -0.86 0.05 0.00 -0.02 0.00 0.00 54.58 53.75 2kut n ASN 83 Cb 0.00 -1.52 0.18 0.00 -2.36 0.00 0.00 39.78 36.09 2kut n ASN 83 CO 0.00 0.00 0.00 -0.65 -1.03 0.00 0.00 177.26 175.58 2kut h PRO 84 N -0.00 0.32 -4.75 -0.53 0.11 -1.84 -3.47 132.00 121.85 2kut h PRO 84 Ca -0.61 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.48 2kut h PRO 84 Cb 1.35 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.38 2kut h PRO 84 CO 0.34 0.21 -0.40 0.41 -0.21 0.00 0.00 178.00 178.36 2kut n GLY 85 N -1.34 -1.28 2.97 -0.55 0.00 -1.26 -5.00 105.19 98.73 2kut n GLY 85 Ca 0.14 0.92 -0.31 0.00 0.00 0.00 0.00 46.02 46.78 2kut n GLY 85 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2kut s VAL 86 N -2.20 3.29 0.68 1.61 1.01 -1.08 -5.04 120.40 118.67 2kut s VAL 86 Ca 0.18 -3.96 -0.11 0.00 0.00 0.00 0.00 61.98 58.10 2kut s VAL 86 Cb -0.05 -3.13 0.00 0.00 0.00 0.00 0.00 36.38 33.19 2kut s VAL 86 CO 0.59 -0.99 1.06 -2.16 0.00 0.00 0.00 175.10 173.60 2kut s PRO 87 N -1.18 3.04 0.22 2.72 0.04 -1.26 -4.05 135.00 134.52 2kut s PRO 87 Ca 0.24 0.83 0.10 0.00 0.04 0.00 0.00 61.00 62.20 2kut s PRO 87 Cb -0.09 -2.01 -0.05 0.00 0.04 0.00 0.00 34.50 32.39 2kut s PRO 87 CO -0.12 -0.99 -0.18 0.14 0.04 0.00 0.00 177.00 175.88 2kut s VAL 88 N -3.12 2.07 0.00 -0.36 -7.23 -1.23 -4.52 120.40 106.02 2kut s VAL 88 Ca 0.57 -2.21 -0.07 0.00 -1.81 0.00 0.00 61.98 58.47 2kut s VAL 88 Cb -0.13 -2.10 0.00 0.00 0.56 0.00 0.00 36.38 34.71 2kut s VAL 88 CO 0.54 -0.43 0.13 -0.31 -0.31 0.00 0.00 175.10 174.73 2kut s TYR 89 N -2.51 0.04 -0.13 2.82 2.02 -1.26 -3.88 117.35 114.45 2kut s TYR 89 Ca 0.24 -0.12 -0.10 0.00 -0.37 0.00 0.00 57.07 56.72 2kut s TYR 89 Cb -0.04 -0.05 0.04 0.00 -0.40 0.00 0.00 41.96 41.51 2kut s TYR 89 CO 0.10 -0.27 0.33 0.00 -1.57 0.00 0.00 175.55 174.13 2kut s ALA 90 N -1.32 -0.81 0.01 3.71 0.00 -1.20 -3.47 121.76 118.68 2kut s ALA 90 Ca -0.14 1.05 0.01 0.00 0.00 0.00 0.00 51.96 52.87 2kut s ALA 90 Cb -0.07 -0.62 -0.01 0.00 0.00 0.00 0.00 23.12 22.41 2kut s ALA 90 CO 0.01 -0.18 -0.04 0.08 0.00 0.00 0.00 175.76 175.64 2kut s VAL 91 N 0.59 0.25 -0.03 0.00 1.01 -1.19 -3.71 120.40 117.32 2kut s VAL 91 Ca -0.03 -0.47 -0.13 0.00 0.00 0.00 0.00 61.98 61.34 2kut s VAL 91 Cb -0.05 -0.28 -0.05 0.00 0.00 0.00 0.00 36.38 36.00 2kut s VAL 91 CO -0.04 -0.15 0.34 0.68 0.00 0.00 0.00 175.10 175.94 2kut s VAL 92 N -0.62 5.15 -0.67 2.92 -7.23 -1.26 -2.98 120.40 115.69 2kut s VAL 92 Ca -0.05 0.69 0.05 0.00 -1.81 0.00 0.00 61.98 60.86 2kut s VAL 92 Cb -0.05 -3.64 0.16 0.00 0.56 0.00 0.00 36.38 33.42 2kut s VAL 92 CO -0.00 0.59 0.46 -0.62 -0.31 0.00 0.00 175.10 175.22 2kut s ASP 93 N -1.06 4.71 0.66 4.85 2.15 -1.19 -5.02 116.67 121.77 2kut s ASP 93 Ca 0.22 -3.73 -0.11 0.00 0.43 0.00 0.00 52.55 49.36 2kut s ASP 93 Cb -0.16 -1.62 -0.01 0.00 -0.30 0.00 0.00 42.92 40.84 2kut s ASP 93 CO 0.11 -0.11 1.06 -2.16 -0.17 0.00 0.00 175.17 173.91 2kut s PRO 94 N -1.27 3.20 0.00 4.34 0.04 -1.26 -4.24 135.00 135.80 2kut s PRO 94 Ca 0.24 0.58 0.00 0.00 0.04 0.00 0.00 61.00 61.86 2kut s PRO 94 Cb -0.07 -2.05 0.00 0.00 0.04 0.00 0.00 34.50 32.41 2kut s PRO 94 CO -0.14 -0.81 0.54 -3.47 0.04 0.00 0.00 177.00 173.15 2kut n ASP 95 N -2.88 1.18 -2.79 6.66 2.03 -1.26 -3.28 116.55 116.21 2kut n ASP 95 Ca 0.06 -1.94 -0.01 0.00 0.52 0.00 0.00 54.79 53.42 2kut n ASP 95 Cb 0.56 -0.48 0.06 0.00 -0.72 0.00 0.00 41.12 40.54 2kut n ASP 95 CO 0.00 0.00 0.00 -3.20 -1.92 0.00 0.00 177.20 172.08 2kut n ASN 96 N 0.07 0.93 -4.54 1.67 2.85 -1.26 -5.07 115.26 109.91 2kut n ASN 96 Ca 0.00 -2.11 -0.29 0.00 -0.11 0.00 0.00 54.58 52.06 2kut n ASN 96 Cb 0.27 -0.24 -0.07 0.00 1.24 0.00 0.00 39.78 40.98 2kut n ASN 96 CO 0.00 0.00 0.00 -2.11 -2.11 0.00 0.00 177.26 173.04 2kut n ARG 97 N -0.74 0.69 0.30 1.20 1.85 -1.21 -4.81 116.66 113.94 2kut n ARG 97 Ca 0.02 -0.25 -0.16 0.00 -1.00 0.00 0.00 57.85 56.46 2kut n ARG 97 Cb 0.82 -3.09 -0.08 0.00 -1.05 0.00 0.00 32.46 29.05 2kut n ARG 97 CO 0.00 0.00 0.00 0.28 -0.01 0.00 0.00 177.63 177.90 2kut h VAL 98 N 7.69 0.46 -2.17 8.89 2.07 -1.97 -3.48 116.25 127.74 2kut h VAL 98 Ca -0.13 -0.10 0.11 0.00 0.82 0.00 0.00 66.70 67.41 2kut h VAL 98 Cb 1.19 0.51 -0.02 0.00 -1.52 0.00 0.00 31.29 31.45 2kut h VAL 98 CO 1.18 0.02 0.40 0.00 0.02 0.00 0.00 177.57 179.18 2kut n ALA 99 N -2.44 -1.78 0.17 1.67 0.00 -1.26 -5.03 120.51 111.85 2kut n ALA 99 Ca -0.12 -0.65 -0.07 0.00 0.00 0.00 0.00 53.44 52.60 2kut n ALA 99 Cb 0.31 0.34 -0.03 0.00 0.00 0.00 0.00 19.45 20.07 2kut n ALA 99 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 2kut h GLU 100 N 0.00 -0.46 -0.83 0.00 5.08 -1.98 -0.99 114.58 115.40 2kut h GLU 100 Ca -0.17 0.03 0.20 0.00 -1.00 0.00 0.00 59.36 58.42 2kut h GLU 100 Cb 0.77 0.10 -0.13 0.00 0.50 0.00 0.00 28.75 29.99 2kut h GLU 100 CO 0.23 -0.30 0.25 1.03 -1.00 0.00 0.00 179.01 179.22 2kut h SER 101 N -0.71 0.08 0.00 1.42 0.87 -1.98 0.36 113.55 113.59 2kut h SER 101 Ca -0.05 0.17 0.00 0.00 -1.23 0.00 0.00 61.79 60.68 2kut h SER 101 Cb 0.36 0.21 0.00 0.00 -0.44 0.00 0.00 62.40 62.53 2kut h SER 101 CO 0.08 -0.08 0.00 0.47 -0.53 0.00 0.00 176.83 176.77 2kut n ASP 102 N -5.16 0.00 -0.33 6.23 9.92 -1.23 -3.17 116.55 122.81 2kut n ASP 102 Ca 0.19 0.92 0.22 0.00 -0.53 0.00 0.00 54.79 55.60 2kut n ASP 102 Cb 0.59 -0.48 0.45 0.00 -0.64 0.00 0.00 41.12 41.04 2kut n ASP 102 CO 0.00 0.00 0.00 0.50 0.13 0.00 0.00 177.20 177.83 2kut h LYS 103 N 0.00 0.29 0.00 -1.24 3.64 -0.84 0.88 116.57 119.30 2kut h LYS 103 Ca 0.00 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.36 2kut h LYS 103 Cb 0.00 -0.07 0.00 0.00 -0.41 0.00 0.00 32.23 31.75 2kut h LYS 103 CO 0.00 0.19 0.00 0.00 -2.27 0.00 0.00 179.45 177.37 2kut n ALA 104 N -2.36 1.33 -0.78 5.00 0.00 0.12 -2.22 120.51 121.60 2kut n ALA 104 Ca 0.30 0.00 -0.20 0.00 0.00 0.00 0.00 53.44 53.54 2kut n ALA 104 Cb 0.94 -0.88 0.11 0.00 0.00 0.00 0.00 19.45 19.62 2kut n ALA 104 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 2kut n ASN 105 N -0.78 4.48 -2.61 0.00 3.02 0.31 -4.09 115.26 115.59 2kut n ASN 105 Ca 0.00 -3.26 -0.03 0.00 -0.03 0.00 0.00 54.58 51.26 2kut n ASN 105 Cb 0.00 -0.82 0.12 0.00 -0.61 0.00 0.00 39.78 38.47 2kut n ASN 105 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 2kut n ASN 106 N -0.62 -1.48 -4.58 6.41 3.02 -0.94 -5.14 115.26 111.93 2kut n ASN 106 Ca 0.45 -2.19 -0.31 0.00 -0.03 0.00 0.00 54.58 52.50 2kut n ASN 106 Cb 1.18 0.73 -0.10 0.00 -0.61 0.00 0.00 39.78 40.98 2kut n ASN 106 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 2kut s VAL 107 N 0.14 3.50 0.03 2.41 0.11 -1.26 -4.38 120.40 120.95 2kut s VAL 107 Ca 0.11 -0.98 -0.11 0.00 -2.93 0.00 0.00 61.98 58.07 2kut s VAL 107 Cb 0.41 -2.56 0.01 0.00 -1.53 0.00 0.00 36.38 32.70 2kut s VAL 107 CO -0.11 0.29 0.23 -0.36 -3.33 0.00 0.00 175.10 171.82 2kut s PHE 108 N -1.08 -0.01 -0.14 1.54 0.08 -1.24 -5.06 117.98 112.07 2kut s PHE 108 Ca 0.19 -0.15 -0.29 0.00 0.12 0.00 0.00 56.93 56.80 2kut s PHE 108 Cb -0.11 0.02 0.07 0.00 -0.57 0.00 0.00 43.02 42.43 2kut s PHE 108 CO 0.10 -0.44 0.72 0.45 -0.10 0.00 0.00 175.22 175.95 2kut s SER 109 N -1.98 -0.68 -0.03 1.36 0.15 -1.26 -3.26 113.70 107.99 2kut s SER 109 Ca -0.06 0.99 0.01 0.00 0.70 0.00 0.00 55.95 57.59 2kut s SER 109 Cb -0.02 0.89 0.02 0.00 -1.71 0.00 0.00 66.02 65.21 2kut s SER 109 CO -0.03 -0.45 -0.03 -0.60 1.20 0.00 0.00 173.24 173.33 2kut s ARG 110 N -0.55 0.59 -0.04 5.44 3.52 -1.25 -4.99 118.95 121.66 2kut s ARG 110 Ca -0.06 -0.04 -0.29 0.00 -0.13 0.00 0.00 55.73 55.21 2kut s ARG 110 Cb -0.02 -0.65 -0.02 0.00 -1.56 0.00 0.00 34.95 32.69 2kut s ARG 110 CO 0.06 -0.08 0.95 0.42 -0.81 0.00 0.00 175.30 175.83 2kut s ILE 111 N 0.85 4.87 -0.01 4.11 1.09 -1.26 -3.48 121.20 127.36 2kut s ILE 111 Ca -0.10 1.97 0.03 0.00 -1.10 0.00 0.00 60.65 61.44 2kut s ILE 111 Cb -0.13 -4.28 -0.00 0.00 -1.06 0.00 0.00 42.46 36.98 2kut s ILE 111 CO -0.01 0.12 -0.10 -0.69 -0.10 0.00 0.00 174.94 174.17 2kut s VAL 112 N 1.32 0.79 -0.21 2.92 1.01 -1.26 -5.04 120.40 119.94 2kut s VAL 112 Ca 0.49 -0.41 -0.01 0.00 0.00 0.00 0.00 61.98 62.04 2kut s VAL 112 Cb -0.20 -0.68 0.06 0.00 0.00 0.00 0.00 36.38 35.57 2kut s VAL 112 CO 0.23 0.23 -0.01 -0.54 0.00 0.00 0.00 175.10 175.02 2kut s LYS 113 N -0.12 1.09 0.02 2.72 1.02 -1.26 -2.64 119.74 120.57 2kut s LYS 113 Ca 0.02 -0.66 -0.19 0.00 0.02 0.00 0.00 55.97 55.15 2kut s LYS 113 Cb -0.05 -2.31 -0.06 0.00 -0.52 0.00 0.00 37.83 34.89 2kut s LYS 113 CO -0.00 -0.62 0.55 0.54 -0.92 0.00 0.00 175.35 174.90 2kut s VAL 114 N 1.65 4.88 0.05 3.17 0.11 -1.26 -5.02 120.40 123.98 2kut s VAL 114 Ca -0.03 1.16 -0.27 0.00 -2.93 0.00 0.00 61.98 59.91 2kut s VAL 114 Cb -0.18 -3.88 -0.05 0.00 -1.53 0.00 0.00 36.38 30.74 2kut s VAL 114 CO -0.07 0.49 0.84 -0.76 -3.33 0.00 0.00 175.10 172.27 2kut s LEU 115 N -0.61 4.45 0.28 2.54 2.01 -1.26 -4.69 118.68 121.40 2kut s LEU 115 Ca 0.29 1.56 0.01 0.00 0.01 0.00 0.00 54.13 56.00 2kut s LEU 115 Cb -0.18 -3.36 0.42 0.00 0.01 0.00 0.00 46.19 43.07 2kut s LEU 115 CO 0.17 -0.04 1.77 -0.33 1.01 0.00 0.00 176.35 178.92 2kut h GLU 116 N 5.80 0.63 -3.31 1.70 5.08 -1.97 -3.36 114.58 119.15 2kut h GLU 116 Ca -0.43 -0.18 -0.09 0.00 -1.00 0.00 0.00 59.36 57.66 2kut h GLU 116 Cb 1.21 -0.06 -0.16 0.00 0.50 0.00 0.00 28.75 30.23 2kut h GLU 116 CO 0.72 0.71 -0.21 -1.01 -1.00 0.00 0.00 179.01 178.22 2kut s HIS 117 N -4.80 -0.12 0.00 4.33 3.76 -1.26 -4.81 115.29 112.38 2kut s HIS 117 Ca -0.08 -0.04 0.00 0.00 -0.15 0.00 0.00 55.06 54.79 2kut s HIS 117 Cb 0.14 0.12 0.00 0.00 1.11 0.00 0.00 32.58 33.96 2kut s HIS 117 CO 0.79 -0.54 0.00 1.58 -0.85 0.00 0.00 174.74 175.72 2kut n HIS 118 N 0.42 0.00 0.92 1.40 -0.00 -1.26 -4.93 115.22 111.77 2kut n HIS 118 Ca -0.18 0.00 -0.00 0.00 0.46 0.00 0.00 57.72 58.00 2kut n HIS 118 Cb 0.60 0.00 0.01 0.00 -0.12 0.00 0.00 29.99 30.48 2kut n HIS 118 CO 0.00 0.00 0.00 0.72 0.46 0.00 0.00 176.34 177.52 2kut n HIS 119 N 0.00 0.09 -0.07 1.57 8.25 -1.26 -4.17 115.22 119.64 2kut n HIS 119 Ca 0.00 -0.28 -0.10 0.00 -0.26 0.00 0.00 57.72 57.08 2kut n HIS 119 Cb 0.00 -0.19 -0.03 0.00 1.12 0.00 0.00 29.99 30.88 2kut n HIS 119 CO 0.00 0.00 0.00 1.25 0.64 0.00 0.00 176.34 178.23 2kut h HIS 120 N 0.09 0.34 -0.10 4.41 6.17 -2.03 -3.28 115.15 120.75 2kut h HIS 120 Ca 0.01 -0.01 -0.66 0.00 0.71 0.00 0.00 60.37 60.42 2kut h HIS 120 Cb 0.80 -0.11 -0.00 0.00 2.52 0.00 0.00 27.41 30.62 2kut h HIS 120 CO 0.05 0.32 2.56 0.72 0.71 0.00 0.00 177.93 182.28 2kut n HIS 121 N -4.84 2.85 0.45 5.26 8.25 -1.26 -5.31 115.22 120.61 2kut n HIS 121 Ca -0.03 -2.35 0.04 0.00 -0.26 0.00 0.00 57.72 55.11 2kut n HIS 121 Cb 0.09 -2.20 0.21 0.00 1.12 0.00 0.00 29.99 29.21 2kut n HIS 121 CO 0.00 0.00 0.00 1.58 0.64 0.00 0.00 176.34 178.56