#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1kl5 h GLY 16 N 0.00 0.00 0.99 0.00 0.00 -2.04 -3.27 103.07 98.75 1kl5 h GLY 16 Ca 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 47.33 47.02 1kl5 h GLY 16 CO 0.00 0.00 -1.71 -2.22 0.00 0.00 0.00 176.54 172.61 1kl5 h ILE 17 N 0.00 0.91 -2.38 2.60 2.04 -1.97 -3.46 117.51 115.24 1kl5 h ILE 17 Ca -0.00 -2.65 -0.58 0.00 1.00 0.00 0.00 64.86 62.63 1kl5 h ILE 17 Cb 0.35 2.57 0.06 0.00 -0.74 0.00 0.00 36.82 39.06 1kl5 h ILE 17 CO 0.00 0.73 0.76 0.41 0.00 0.00 0.00 178.15 180.05 1kl5 n THR 18 N -3.31 0.22 -0.28 -0.27 -1.04 -1.23 -4.75 114.28 103.62 1kl5 n THR 18 Ca -0.20 -0.06 0.00 0.00 -2.04 0.00 0.00 64.05 61.75 1kl5 n THR 18 Cb 1.04 -1.53 0.00 0.00 -1.82 0.00 0.00 70.33 68.02 1kl5 n THR 18 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1kl5 n GLY 19 N 3.12 0.77 3.51 3.41 0.00 0.39 -4.74 105.19 111.66 1kl5 n GLY 19 Ca 0.16 -1.72 -0.34 0.00 0.00 0.00 0.00 46.02 44.12 1kl5 n GLY 19 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1kl5 s THR 20 N -3.29 3.74 0.06 2.61 2.01 -1.26 -1.05 115.64 118.46 1kl5 s THR 20 Ca 0.00 -0.43 0.05 0.00 0.31 0.00 0.00 61.69 61.62 1kl5 s THR 20 Cb 0.00 -2.60 -0.03 0.00 0.01 0.00 0.00 72.50 69.89 1kl5 s THR 20 CO 0.00 0.53 -0.15 0.26 -0.69 0.00 0.00 174.62 174.57 1kl5 s TRP 21 N -0.04 1.30 0.02 4.92 0.52 0.55 -4.54 118.94 121.67 1kl5 s TRP 21 Ca 0.00 -0.42 0.04 0.00 0.02 0.00 0.00 56.10 55.75 1kl5 s TRP 21 Cb -0.13 -0.75 -0.02 0.00 -1.15 0.00 0.00 33.47 31.42 1kl5 s TRP 21 CO 0.03 0.07 -0.14 0.71 0.02 0.00 0.00 176.95 177.64 1kl5 s TYR 22 N -1.10 1.20 0.46 -1.98 1.51 0.37 -0.94 117.35 116.88 1kl5 s TYR 22 Ca 0.00 -0.30 0.07 0.00 -1.01 0.00 0.00 57.07 55.83 1kl5 s TYR 22 Cb -0.09 -0.74 0.07 0.00 -0.11 0.00 0.00 41.96 41.09 1kl5 s TYR 22 CO 0.02 0.01 0.57 0.27 -1.11 0.00 0.00 175.55 175.31 1kl5 n ASN 23 N 2.24 1.88 0.09 2.29 6.94 -0.81 -0.99 115.26 126.90 1kl5 n ASN 23 Ca -0.16 -2.31 0.13 0.00 -0.02 0.00 0.00 54.58 52.21 1kl5 n ASN 23 Cb 0.55 -0.26 0.29 0.00 -2.36 0.00 0.00 39.78 38.00 1kl5 n ASN 23 CO 0.00 0.00 0.00 0.06 -1.03 0.00 0.00 177.26 176.29 1kl5 h GLN 24 N 0.00 0.00 -0.01 -3.83 -0.00 -1.90 -3.28 115.11 106.09 1kl5 h GLN 24 Ca -0.23 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.42 1kl5 h GLN 24 Cb 1.01 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.49 1kl5 h GLN 24 CO 0.34 0.00 -0.04 1.28 -0.00 0.00 0.00 178.83 180.42 1kl5 n LEU 25 N -2.26 0.92 0.00 0.06 4.77 -1.26 -4.88 117.00 114.34 1kl5 n LEU 25 Ca 0.04 -0.28 0.00 0.00 -0.03 0.00 0.00 56.01 55.75 1kl5 n LEU 25 Cb 0.44 -0.04 0.00 0.00 -2.33 0.00 0.00 43.42 41.50 1kl5 n LEU 25 CO 0.33 0.16 0.00 0.61 -1.33 0.00 0.00 177.39 177.16 1kl5 n GLY 26 N 1.16 0.76 3.89 -0.72 0.00 -1.24 -4.87 105.19 104.17 1kl5 n GLY 26 Ca 0.19 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.92 1kl5 n GLY 26 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1kl5 s SER 27 N -1.42 6.38 0.05 1.61 0.01 -1.26 -4.06 113.70 115.00 1kl5 s SER 27 Ca 0.00 1.08 0.05 0.00 1.31 0.00 0.00 55.95 58.39 1kl5 s SER 27 Cb 0.00 -2.31 -0.02 0.00 0.21 0.00 0.00 66.02 63.90 1kl5 s SER 27 CO 0.00 -0.52 -0.14 -0.89 0.41 0.00 0.00 173.24 172.09 1kl5 s THR 28 N -2.61 1.12 -0.02 1.44 2.01 -0.21 -1.93 115.64 115.43 1kl5 s THR 28 Ca 0.50 -1.06 -0.01 0.00 0.31 0.00 0.00 61.69 61.42 1kl5 s THR 28 Cb -0.10 -1.03 0.02 0.00 0.01 0.00 0.00 72.50 71.40 1kl5 s THR 28 CO 0.39 -0.04 0.05 0.72 -0.69 0.00 0.00 174.62 175.06 1kl5 s PHE 29 N -0.93 -0.04 -0.18 4.92 -0.12 -0.11 -0.72 117.98 120.79 1kl5 s PHE 29 Ca 0.01 0.17 -0.03 0.00 -0.05 0.00 0.00 56.93 57.04 1kl5 s PHE 29 Cb -0.08 -0.07 -0.01 0.00 -0.63 0.00 0.00 43.02 42.23 1kl5 s PHE 29 CO 0.01 -0.06 -0.07 0.42 -0.05 0.00 0.00 175.22 175.47 1kl5 s ILE 30 N 0.46 3.37 0.04 -4.49 1.01 0.03 -0.33 121.20 121.30 1kl5 s ILE 30 Ca -0.04 -0.52 0.01 0.00 0.00 0.00 0.00 60.65 60.11 1kl5 s ILE 30 Cb -0.05 -2.48 -0.03 0.00 0.01 0.00 0.00 42.46 39.91 1kl5 s ILE 30 CO -0.02 0.47 -0.06 0.54 0.00 0.00 0.00 174.94 175.88 1kl5 s VAL 31 N 0.87 0.41 -0.13 2.92 0.11 -0.22 -1.24 120.40 123.13 1kl5 s VAL 31 Ca -0.02 -1.16 0.01 0.00 -2.93 0.00 0.00 61.98 57.88 1kl5 s VAL 31 Cb -0.15 -0.67 -0.00 0.00 -1.53 0.00 0.00 36.38 34.02 1kl5 s VAL 31 CO 0.01 -0.51 -0.18 -0.89 -3.33 0.00 0.00 175.10 170.21 1kl5 s THR 32 N -1.79 2.53 -0.42 5.04 2.01 -0.10 -0.46 115.64 122.46 1kl5 s THR 32 Ca -0.08 -0.83 -0.15 0.00 0.31 0.00 0.00 61.69 60.93 1kl5 s THR 32 Cb -0.07 -2.04 0.02 0.00 0.01 0.00 0.00 72.50 70.42 1kl5 s THR 32 CO -0.01 0.53 0.31 0.00 -0.69 0.00 0.00 174.62 174.76 1kl5 s ALA 33 N 0.58 3.49 0.59 7.40 0.00 -1.26 -1.98 121.76 130.57 1kl5 s ALA 33 Ca -0.10 -1.75 -0.13 0.00 0.00 0.00 0.00 51.96 49.97 1kl5 s ALA 33 Cb -0.16 -2.90 -0.05 0.00 0.00 0.00 0.00 23.12 20.01 1kl5 s ALA 33 CO 0.04 -1.48 1.02 0.20 0.00 0.00 0.00 175.76 175.53 1kl5 s GLY 34 N 1.76 1.82 0.56 0.00 0.00 0.04 -4.45 107.32 107.05 1kl5 s GLY 34 Ca 0.05 0.05 0.34 0.00 0.00 0.00 0.00 44.72 45.15 1kl5 s GLY 34 CO 0.10 0.32 2.06 0.00 0.00 0.00 0.00 173.10 175.58 1kl5 h ALA 35 N 0.10 1.05 -0.22 3.20 0.00 -1.98 -2.03 119.26 119.38 1kl5 h ALA 35 Ca -0.45 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.42 1kl5 h ALA 35 Cb 1.19 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.97 1kl5 h ALA 35 CO 0.61 0.05 0.00 -0.40 0.00 0.00 0.00 179.25 179.52 1kl5 n ASP 36 N -3.21 1.51 0.00 0.00 5.75 -1.26 -4.90 116.55 114.44 1kl5 n ASP 36 Ca -0.01 -1.82 0.00 0.00 -0.01 0.00 0.00 54.79 52.95 1kl5 n ASP 36 Cb 0.26 -0.14 0.00 0.00 -1.03 0.00 0.00 41.12 40.21 1kl5 n ASP 36 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1kl5 n GLY 37 N 1.03 0.71 3.79 6.12 0.00 -0.76 -4.99 105.19 111.09 1kl5 n GLY 37 Ca 0.13 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.79 1kl5 n GLY 37 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1kl5 s ALA 38 N -2.37 3.15 -0.08 4.61 0.00 -1.25 -1.15 121.76 124.67 1kl5 s ALA 38 Ca 0.00 0.51 0.04 0.00 0.00 0.00 0.00 51.96 52.51 1kl5 s ALA 38 Cb 0.00 -3.19 0.00 0.00 0.00 0.00 0.00 23.12 19.94 1kl5 s ALA 38 CO 0.00 0.12 -0.21 -0.51 0.00 0.00 0.00 175.76 175.16 1kl5 s LEU 39 N -2.42 1.98 0.00 0.00 1.43 -0.30 -0.78 118.68 118.59 1kl5 s LEU 39 Ca 0.54 -0.49 -0.02 0.00 -1.03 0.00 0.00 54.13 53.13 1kl5 s LEU 39 Cb -0.16 -1.25 -0.01 0.00 0.03 0.00 0.00 46.19 44.79 1kl5 s LEU 39 CO 0.21 0.14 0.03 0.42 0.23 0.00 0.00 176.35 177.39 1kl5 s THR 40 N 0.34 0.07 -1.64 5.49 -4.23 -0.84 -1.10 115.64 113.74 1kl5 s THR 40 Ca -0.16 -0.58 0.00 0.00 -1.18 0.00 0.00 61.69 59.77 1kl5 s THR 40 Cb -0.17 -0.24 0.00 0.00 1.34 0.00 0.00 72.50 73.43 1kl5 s THR 40 CO 0.07 -0.32 0.00 0.61 -0.54 0.00 0.00 174.62 174.44 1kl5 n GLY 41 N 2.01 -0.56 3.01 3.99 0.00 -0.86 -0.93 105.19 111.86 1kl5 n GLY 41 Ca -0.20 -0.72 -0.18 0.00 0.00 0.00 0.00 46.02 44.92 1kl5 n GLY 41 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1kl5 s THR 42 N -3.14 0.65 -0.19 2.61 2.01 -0.37 -1.43 115.64 115.79 1kl5 s THR 42 Ca 0.00 -0.36 -0.01 0.00 0.31 0.00 0.00 61.69 61.62 1kl5 s THR 42 Cb 0.00 -0.54 -0.00 0.00 0.01 0.00 0.00 72.50 71.96 1kl5 s THR 42 CO 0.00 0.17 -0.11 -0.47 -0.69 0.00 0.00 174.62 173.52 1kl5 s TYR 43 N -0.21 2.86 -0.28 4.92 6.14 0.64 -0.79 117.35 130.63 1kl5 s TYR 43 Ca 0.03 -1.11 -0.03 0.00 0.64 0.00 0.00 57.07 56.61 1kl5 s TYR 43 Cb -0.03 -1.99 0.03 0.00 0.42 0.00 0.00 41.96 40.40 1kl5 s TYR 43 CO -0.00 -0.56 -0.00 0.42 0.64 0.00 0.00 175.55 176.04 1kl5 s ILE 44 N 1.17 3.16 1.08 3.14 1.01 0.10 -0.71 121.20 130.15 1kl5 s ILE 44 Ca 0.02 -1.11 -0.13 0.00 0.00 0.00 0.00 60.65 59.42 1kl5 s ILE 44 Cb -0.14 -2.70 0.19 0.00 0.01 0.00 0.00 42.46 39.82 1kl5 s ILE 44 CO -0.04 0.04 0.79 0.61 0.00 0.00 0.00 174.94 176.34 1kl5 n GLY 45 N 4.69 -1.71 0.38 6.18 0.00 -0.68 -1.04 105.19 113.01 1kl5 n GLY 45 Ca -0.15 -0.94 0.20 0.00 0.00 0.00 0.00 46.02 45.13 1kl5 n GLY 45 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1kl5 h ALA 46 N -2.26 2.03 0.00 4.61 0.00 -1.90 -0.71 119.26 121.03 1kl5 h ALA 46 Ca -0.54 0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.44 1kl5 h ALA 46 Cb 1.32 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 19.12 1kl5 h ALA 46 CO 0.43 -0.46 -0.06 -0.09 0.00 0.00 0.00 179.25 179.07 1kl5 h ARG 47 N 0.49 0.00 0.00 0.00 2.43 -1.90 -3.46 114.38 111.94 1kl5 h ARG 47 Ca 0.61 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.78 1kl5 h ARG 47 Cb 1.35 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.90 1kl5 h ARG 47 CO -0.36 0.06 0.00 0.41 -1.51 0.00 0.00 179.97 178.57 1kl5 n GLY 48 N -0.99 0.27 3.80 2.80 0.00 -0.28 -4.99 105.19 105.81 1kl5 n GLY 48 Ca -0.02 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.68 1kl5 n GLY 48 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1kl5 s ASN 49 N -2.15 5.23 0.41 1.61 3.04 -1.26 -4.95 114.94 116.88 1kl5 s ASN 49 Ca 0.00 1.72 0.11 0.00 0.04 0.00 0.00 52.86 54.73 1kl5 s ASN 49 Cb 0.00 -2.51 0.88 0.00 -1.54 0.00 0.00 41.25 38.08 1kl5 s ASN 49 CO 0.00 -1.54 1.95 0.00 -3.04 0.00 0.00 177.10 174.47 1kl5 h ALA 50 N -0.57 1.60 0.00 1.71 0.00 -1.98 -1.34 119.26 118.68 1kl5 h ALA 50 Ca -0.44 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.29 1kl5 h ALA 50 Cb 1.22 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.94 1kl5 h ALA 50 CO 0.55 0.29 0.00 0.39 0.00 0.00 0.00 179.25 180.49 1kl5 n GLU 51 N -4.31 0.78 -0.19 0.00 4.71 -1.26 -2.66 120.64 117.71 1kl5 n GLU 51 Ca -0.01 0.00 0.07 0.00 -0.01 0.00 0.00 57.16 57.21 1kl5 n GLU 51 Cb 0.25 -1.50 0.18 0.00 -1.01 0.00 0.00 31.44 29.36 1kl5 n GLU 51 CO 0.00 0.00 0.00 0.43 0.09 0.00 0.00 177.13 177.65 1kl5 n SER 52 N -1.02 3.06 -4.66 1.62 7.64 -0.51 -4.84 113.62 114.92 1kl5 n SER 52 Ca 0.19 -1.93 -0.35 0.00 1.01 0.00 0.00 58.87 57.79 1kl5 n SER 52 Cb 0.10 -0.25 -0.09 0.00 -1.01 0.00 0.00 64.21 62.95 1kl5 n SER 52 CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 1kl5 s ARG 53 N -1.04 3.80 0.02 1.43 0.52 -1.09 -1.69 118.95 120.90 1kl5 s ARG 53 Ca 0.28 -0.34 0.02 0.00 -0.52 0.00 0.00 55.73 55.18 1kl5 s ARG 53 Cb 0.15 -3.15 -0.01 0.00 0.52 0.00 0.00 34.95 32.46 1kl5 s ARG 53 CO 0.21 0.37 -0.06 0.71 0.02 0.00 0.00 175.30 176.55 1kl5 s TYR 54 N 0.08 0.51 0.29 -0.53 1.51 0.12 -4.83 117.35 114.49 1kl5 s TYR 54 Ca 0.05 -0.30 -0.29 0.00 -1.01 0.00 0.00 57.07 55.52 1kl5 s TYR 54 Cb -0.12 -0.31 -0.10 0.00 -0.11 0.00 0.00 41.96 41.32 1kl5 s TYR 54 CO 0.01 -0.06 1.13 0.08 -1.11 0.00 0.00 175.55 175.60 1kl5 s VAL 55 N -0.77 3.37 0.06 0.71 1.01 -1.26 -0.26 120.40 123.25 1kl5 s VAL 55 Ca -0.05 1.37 0.06 0.00 0.00 0.00 0.00 61.98 63.37 1kl5 s VAL 55 Cb -0.06 -3.87 -0.03 0.00 0.00 0.00 0.00 36.38 32.42 1kl5 s VAL 55 CO 0.00 0.32 -0.18 -1.48 0.00 0.00 0.00 175.10 173.77 1kl5 s LEU 56 N -1.52 2.22 -0.08 3.92 0.05 -0.51 -4.19 118.68 118.56 1kl5 s LEU 56 Ca 0.45 -0.56 -0.09 0.00 0.05 0.00 0.00 54.13 53.99 1kl5 s LEU 56 Cb -0.33 -0.76 0.02 0.00 -2.05 0.00 0.00 46.19 43.07 1kl5 s LEU 56 CO 0.43 0.05 0.24 0.28 -0.55 0.00 0.00 176.35 176.80 1kl5 s THR 57 N -0.99 0.01 0.00 5.48 -1.32 -1.00 -2.02 115.64 115.80 1kl5 s THR 57 Ca 0.04 -0.07 0.00 0.00 -1.21 0.00 0.00 61.69 60.45 1kl5 s THR 57 Cb -0.09 -0.37 0.00 0.00 -1.51 0.00 0.00 72.50 70.53 1kl5 s THR 57 CO 0.02 -0.04 0.00 0.61 -2.21 0.00 0.00 174.62 173.00 1kl5 n GLY 58 N 2.76 2.06 3.06 6.08 0.00 -0.26 -0.98 105.19 117.91 1kl5 n GLY 58 Ca -0.14 -0.81 -0.08 0.00 0.00 0.00 0.00 46.02 44.99 1kl5 n GLY 58 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1kl5 s ARG 59 N -0.17 0.51 0.13 1.61 1.81 -0.65 -1.15 118.95 121.04 1kl5 s ARG 59 Ca 0.00 -0.92 -0.09 0.00 -1.72 0.00 0.00 55.73 53.00 1kl5 s ARG 59 Cb 0.00 0.18 -0.00 0.00 -0.45 0.00 0.00 34.95 34.68 1kl5 s ARG 59 CO 0.00 -0.10 0.25 1.52 -0.68 0.00 0.00 175.30 176.29 1kl5 s TYR 60 N -2.85 0.26 -0.45 -0.53 1.13 -0.30 -1.63 117.35 112.98 1kl5 s TYR 60 Ca -0.03 -0.65 -0.29 0.00 -1.41 0.00 0.00 57.07 54.70 1kl5 s TYR 60 Cb 0.00 -0.04 0.02 0.00 -1.10 0.00 0.00 41.96 40.84 1kl5 s TYR 60 CO -0.06 -0.64 1.35 0.34 -2.51 0.00 0.00 175.55 174.02 1kl5 s ASP 61 N -2.91 6.38 0.00 -0.18 -1.08 -0.32 -4.64 116.67 113.92 1kl5 s ASP 61 Ca 0.11 0.66 0.29 0.00 -0.52 0.00 0.00 52.55 53.08 1kl5 s ASP 61 Cb 0.04 -2.54 1.47 0.00 -1.46 0.00 0.00 42.92 40.43 1kl5 s ASP 61 CO -0.06 -1.43 1.97 -1.54 0.52 0.00 0.00 175.17 174.64 1kl5 n SER 62 N 8.70 0.61 -3.21 -0.34 3.41 -1.26 -3.92 113.62 117.61 1kl5 n SER 62 Ca 0.15 -1.25 -0.23 0.00 -0.26 0.00 0.00 58.87 57.27 1kl5 n SER 62 Cb 0.48 -0.01 -0.06 0.00 -0.26 0.00 0.00 64.21 64.37 1kl5 n SER 62 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1kl5 n ALA 63 N -0.50 2.68 -1.59 7.33 0.00 -1.26 -5.02 120.51 122.15 1kl5 n ALA 63 Ca 0.21 -3.67 -0.29 0.00 0.00 0.00 0.00 53.44 49.69 1kl5 n ALA 63 Cb 0.20 -0.85 0.11 0.00 0.00 0.00 0.00 19.45 18.91 1kl5 n ALA 63 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1kl5 s PRO 64 N -1.81 1.73 0.62 0.00 0.04 -1.25 -4.99 135.00 129.34 1kl5 s PRO 64 Ca 0.38 0.44 -0.18 0.00 0.04 0.00 0.00 61.00 61.68 1kl5 s PRO 64 Cb 0.22 -1.89 -0.02 0.00 0.04 0.00 0.00 34.50 32.84 1kl5 s PRO 64 CO -0.09 -1.82 1.20 0.00 0.04 0.00 0.00 177.00 176.33 1kl5 s ALA 65 N -3.25 2.47 -0.30 8.56 0.00 -1.26 -4.93 121.76 123.04 1kl5 s ALA 65 Ca 0.62 0.96 0.10 0.00 0.00 0.00 0.00 51.96 53.64 1kl5 s ALA 65 Cb -0.14 -3.45 0.60 0.00 0.00 0.00 0.00 23.12 20.14 1kl5 s ALA 65 CO 0.53 -1.28 1.63 0.25 0.00 0.00 0.00 175.76 176.88 1kl5 n THR 66 N -1.82 2.71 -1.11 0.00 -2.24 -1.26 -4.61 114.28 105.95 1kl5 n THR 66 Ca 0.13 -2.13 0.06 0.00 -2.27 0.00 0.00 64.05 59.84 1kl5 n THR 66 Cb 0.50 -0.34 0.23 0.00 -2.10 0.00 0.00 70.33 68.62 1kl5 n THR 66 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 1kl5 n ASP 67 N -0.75 3.41 0.00 3.42 5.75 -1.26 -4.92 116.55 122.20 1kl5 n ASP 67 Ca 0.37 -3.20 0.00 0.00 -0.01 0.00 0.00 54.79 51.95 1kl5 n ASP 67 Cb 1.21 -0.56 0.00 0.00 -1.03 0.00 0.00 41.12 40.74 1kl5 n ASP 67 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1kl5 n GLY 68 N -0.75 0.94 3.77 6.12 0.00 -1.26 -5.07 105.19 108.93 1kl5 n GLY 68 Ca 0.24 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.89 1kl5 n GLY 68 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1kl5 s SER 69 N -1.76 6.04 1.03 1.61 0.01 -1.26 -5.02 113.70 114.36 1kl5 s SER 69 Ca 0.00 2.25 -0.15 0.00 1.31 0.00 0.00 55.95 59.36 1kl5 s SER 69 Cb 0.00 -2.59 0.21 0.00 0.21 0.00 0.00 66.02 63.84 1kl5 s SER 69 CO 0.00 -1.00 1.14 -0.83 0.41 0.00 0.00 173.24 172.96 1kl5 s GLY 70 N -1.52 1.60 -0.33 3.44 0.00 -1.26 -4.84 107.32 104.42 1kl5 s GLY 70 Ca 0.67 -0.72 -0.10 0.00 0.00 0.00 0.00 44.72 44.57 1kl5 s GLY 70 CO 0.31 -0.02 0.16 -1.59 0.00 0.00 0.00 173.10 171.97 1kl5 s THR 71 N -3.21 4.50 0.38 0.90 2.01 -0.38 -4.76 115.64 115.08 1kl5 s THR 71 Ca 0.68 -0.61 -0.27 0.00 0.31 0.00 0.00 61.69 61.79 1kl5 s THR 71 Cb -0.13 -3.38 -0.10 0.00 0.01 0.00 0.00 72.50 68.91 1kl5 s THR 71 CO 0.55 -0.04 1.36 0.00 -0.69 0.00 0.00 174.62 175.80 1kl5 s ALA 72 N 1.58 3.42 0.20 7.40 0.00 -1.26 -0.87 121.76 132.22 1kl5 s ALA 72 Ca 0.03 1.34 -0.21 0.00 0.00 0.00 0.00 51.96 53.12 1kl5 s ALA 72 Cb -0.18 -3.52 0.05 0.00 0.00 0.00 0.00 23.12 19.47 1kl5 s ALA 72 CO 0.06 -0.84 0.62 -0.48 0.00 0.00 0.00 175.76 175.11 1kl5 s LEU 73 N -2.15 -0.33 0.02 0.00 0.05 -0.31 -1.17 118.68 114.79 1kl5 s LEU 73 Ca 0.53 -0.28 -0.22 0.00 0.05 0.00 0.00 54.13 54.22 1kl5 s LEU 73 Cb -0.41 2.54 0.05 0.00 -2.05 0.00 0.00 46.19 46.31 1kl5 s LEU 73 CO 0.54 -1.10 0.50 -0.83 -0.55 0.00 0.00 176.35 174.92 1kl5 s GLY 74 N -2.82 -0.39 0.18 -3.48 0.00 -0.64 -1.61 107.32 98.55 1kl5 s GLY 74 Ca 0.06 0.63 -0.11 0.00 0.00 0.00 0.00 44.72 45.30 1kl5 s GLY 74 CO -0.05 0.34 0.35 0.66 0.00 0.00 0.00 173.10 174.39 1kl5 s TRP 75 N -2.10 0.32 0.00 1.90 -2.14 -0.63 -1.64 118.94 114.65 1kl5 s TRP 75 Ca -0.07 -0.68 0.04 0.00 2.66 0.00 0.00 56.10 58.05 1kl5 s TRP 75 Cb -0.01 0.04 -0.01 0.00 -3.10 0.00 0.00 33.47 30.39 1kl5 s TRP 75 CO 0.01 -0.78 -0.12 0.99 -2.66 0.00 0.00 176.95 174.39 1kl5 s THR 76 N -3.96 0.93 -0.11 0.66 2.01 -0.15 -1.33 115.64 113.70 1kl5 s THR 76 Ca 0.17 -0.60 0.04 0.00 0.31 0.00 0.00 61.69 61.60 1kl5 s THR 76 Cb 0.02 -0.80 0.00 0.00 0.01 0.00 0.00 72.50 71.73 1kl5 s THR 76 CO 0.01 0.19 -0.23 -0.69 -0.69 0.00 0.00 174.62 173.21 1kl5 s VAL 77 N -0.41 2.04 -0.17 3.82 1.01 -0.33 -2.37 120.40 123.98 1kl5 s VAL 77 Ca 0.03 -1.00 -0.07 0.00 0.00 0.00 0.00 61.98 60.95 1kl5 s VAL 77 Cb -0.05 -1.77 -0.04 0.00 0.00 0.00 0.00 36.38 34.52 1kl5 s VAL 77 CO -0.00 0.55 0.07 0.00 0.00 0.00 0.00 175.10 175.72 1kl5 s ALA 78 N 0.46 3.49 -0.37 5.51 0.00 -1.26 -1.35 121.76 128.24 1kl5 s ALA 78 Ca -0.16 -0.73 -0.06 0.00 0.00 0.00 0.00 51.96 51.01 1kl5 s ALA 78 Cb -0.17 -1.91 -0.14 0.00 0.00 0.00 0.00 23.12 20.90 1kl5 s ALA 78 CO 0.06 0.27 3.26 0.91 0.00 0.00 0.00 175.76 180.26 1kl5 n TRP 79 N 3.19 0.84 -4.50 0.00 7.02 -0.41 -4.74 117.44 118.85 1kl5 n TRP 79 Ca -0.17 -1.87 -0.23 0.00 -1.02 0.00 0.00 57.50 54.22 1kl5 n TRP 79 Cb 0.53 -1.65 -0.16 0.00 -2.42 0.00 0.00 31.31 27.61 1kl5 n TRP 79 CO 0.00 0.00 0.00 0.21 -2.02 0.00 0.00 177.69 175.88 1kl5 s LYS 80 N 0.26 1.31 0.00 -0.99 2.20 -1.26 -0.91 119.74 120.35 1kl5 s LYS 80 Ca 0.64 -0.37 0.00 0.00 -0.36 0.00 0.00 55.97 55.88 1kl5 s LYS 80 Cb 0.31 -1.16 0.00 0.00 -1.51 0.00 0.00 37.83 35.48 1kl5 s LYS 80 CO -0.07 0.09 0.00 0.27 -0.36 0.00 0.00 175.35 175.28 1kl5 n ASN 81 N 3.49 0.13 0.00 1.43 0.23 -0.39 -4.77 115.26 115.38 1kl5 n ASN 81 Ca -0.20 -0.90 0.12 0.00 -0.53 0.00 0.00 54.58 53.07 1kl5 n ASN 81 Cb 0.53 0.00 0.62 0.00 -2.08 0.00 0.00 39.78 38.85 1kl5 n ASN 81 CO 0.00 0.00 0.00 0.59 -0.93 0.00 0.00 177.26 176.92 1kl5 n ASN 82 N -2.57 0.00 -0.04 0.53 3.02 -1.26 -3.73 115.26 111.20 1kl5 n ASN 82 Ca 0.00 0.03 -0.04 0.00 -0.03 0.00 0.00 54.58 54.54 1kl5 n ASN 82 Cb 0.00 -0.33 -0.06 0.00 -0.61 0.00 0.00 39.78 38.79 1kl5 n ASN 82 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 1kl5 n TYR 83 N -1.33 0.00 -4.03 3.10 4.01 -1.26 -5.08 117.16 112.57 1kl5 n TYR 83 Ca 0.11 0.00 -0.10 0.00 -0.16 0.00 0.00 57.90 57.75 1kl5 n TYR 83 Cb 0.22 -0.38 -0.06 0.00 -0.31 0.00 0.00 39.34 38.81 1kl5 n TYR 83 CO 0.00 0.00 0.00 -0.98 -0.46 0.00 0.00 176.86 175.42 1kl5 s ARG 84 N -2.19 1.42 -0.20 -0.72 1.70 -1.24 -5.14 118.95 112.58 1kl5 s ARG 84 Ca -0.06 -1.31 -0.06 0.00 -0.47 0.00 0.00 55.73 53.83 1kl5 s ARG 84 Cb 0.03 0.42 0.10 0.00 -0.57 0.00 0.00 34.95 34.92 1kl5 s ARG 84 CO 0.30 -0.56 0.41 1.21 -1.08 0.00 0.00 175.30 175.57 1kl5 s ASN 85 N -3.04 -0.18 -0.02 -2.89 3.84 -1.26 -1.27 114.94 110.12 1kl5 s ASN 85 Ca 0.25 0.88 0.20 0.00 0.21 0.00 0.00 52.86 54.41 1kl5 s ASN 85 Cb 0.01 1.30 0.62 0.00 -0.55 0.00 0.00 41.25 42.64 1kl5 s ASN 85 CO 0.08 -0.24 1.52 0.00 -2.79 0.00 0.00 177.10 175.68 1kl5 n ALA 86 N 5.39 2.49 -3.98 1.71 0.00 -0.09 -4.98 120.51 121.06 1kl5 n ALA 86 Ca -0.08 -1.36 -0.28 0.00 0.00 0.00 0.00 53.44 51.73 1kl5 n ALA 86 Cb 0.50 -0.88 -0.02 0.00 0.00 0.00 0.00 19.45 19.04 1kl5 n ALA 86 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 1kl5 n HIS 87 N 1.40 -1.61 -3.88 0.00 8.25 -1.26 -4.85 115.22 113.27 1kl5 n HIS 87 Ca 0.23 0.65 -0.09 0.00 -0.26 0.00 0.00 57.72 58.25 1kl5 n HIS 87 Cb 0.66 -3.51 -0.04 0.00 1.12 0.00 0.00 29.99 28.21 1kl5 n HIS 87 CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 1kl5 s SER 88 N -4.21 -0.20 -0.12 0.41 1.04 -1.26 -0.83 113.70 108.53 1kl5 s SER 88 Ca 0.09 -0.69 -0.10 0.00 0.48 0.00 0.00 55.95 55.73 1kl5 s SER 88 Cb -0.04 0.63 0.03 0.00 0.10 0.00 0.00 66.02 66.75 1kl5 s SER 88 CO 0.91 -1.18 0.30 0.00 0.98 0.00 0.00 173.24 174.24 1kl5 s ALA 89 N -3.94 -0.75 -0.06 5.32 0.00 -0.22 -1.29 121.76 120.83 1kl5 s ALA 89 Ca 0.15 0.89 0.03 0.00 0.00 0.00 0.00 51.96 53.03 1kl5 s ALA 89 Cb -0.03 -0.53 -0.03 0.00 0.00 0.00 0.00 23.12 22.54 1kl5 s ALA 89 CO 0.05 -0.15 -0.13 0.99 0.00 0.00 0.00 175.76 176.52 1kl5 s THR 90 N 0.30 3.17 -0.05 0.00 2.01 -0.45 -1.05 115.64 119.57 1kl5 s THR 90 Ca -0.01 -0.68 0.06 0.00 0.31 0.00 0.00 61.69 61.37 1kl5 s THR 90 Cb -0.03 -2.26 -0.02 0.00 0.01 0.00 0.00 72.50 70.20 1kl5 s THR 90 CO -0.01 0.59 -0.21 0.42 -0.69 0.00 0.00 174.62 174.71 1kl5 s THR 91 N -0.63 2.41 -0.12 -0.82 -4.23 -0.48 -1.19 115.64 110.58 1kl5 s THR 91 Ca 0.09 -0.95 -0.01 0.00 -1.18 0.00 0.00 61.69 59.64 1kl5 s THR 91 Cb -0.11 -1.90 -0.02 0.00 1.34 0.00 0.00 72.50 71.81 1kl5 s THR 91 CO 0.01 0.58 -0.09 0.26 -0.54 0.00 0.00 174.62 174.84 1kl5 s TRP 92 N -0.42 2.91 -0.05 3.99 0.51 -0.44 -1.26 118.94 124.18 1kl5 s TRP 92 Ca 0.04 -0.37 0.04 0.00 -2.12 0.00 0.00 56.10 53.69 1kl5 s TRP 92 Cb -0.12 -1.85 0.00 0.00 -0.81 0.00 0.00 33.47 30.69 1kl5 s TRP 92 CO 0.02 -0.03 -0.17 0.45 -0.51 0.00 0.00 176.95 176.71 1kl5 s SER 93 N 0.10 2.19 0.00 2.95 0.15 0.29 -1.61 113.70 117.77 1kl5 s SER 93 Ca -0.03 -0.37 0.00 0.00 0.70 0.00 0.00 55.95 56.25 1kl5 s SER 93 Cb -0.14 -0.73 0.00 0.00 -1.71 0.00 0.00 66.02 63.44 1kl5 s SER 93 CO 0.04 0.13 0.00 0.61 1.20 0.00 0.00 173.24 175.22 1kl5 n GLY 94 N 3.30 0.91 3.01 9.45 0.00 -0.63 -1.06 105.19 120.17 1kl5 n GLY 94 Ca -0.19 -0.41 -0.10 0.00 0.00 0.00 0.00 46.02 45.33 1kl5 n GLY 94 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1kl5 s GLN 95 N 1.56 0.34 -0.08 1.61 -2.07 -0.60 -1.16 119.66 119.26 1kl5 s GLN 95 Ca 0.00 -0.54 -0.13 0.00 -1.82 0.00 0.00 55.36 52.86 1kl5 s GLN 95 Cb 0.00 0.13 -0.05 0.00 -1.09 0.00 0.00 33.01 32.00 1kl5 s GLN 95 CO 0.00 -0.06 0.33 -0.47 -1.32 0.00 0.00 175.29 173.77 1kl5 s TYR 96 N -1.41 3.60 -0.13 9.60 5.04 -0.05 -1.34 117.35 132.66 1kl5 s TYR 96 Ca -0.15 0.78 -0.00 0.00 -2.44 0.00 0.00 57.07 55.26 1kl5 s TYR 96 Cb -0.09 -2.27 0.03 0.00 0.35 0.00 0.00 41.96 39.97 1kl5 s TYR 96 CO -0.00 0.49 -0.11 0.08 -1.34 0.00 0.00 175.55 174.67 1kl5 s VAL 97 N -0.42 1.30 0.50 3.14 1.01 0.29 -1.25 120.40 124.98 1kl5 s VAL 97 Ca 0.20 -0.49 -0.04 0.00 0.00 0.00 0.00 61.98 61.66 1kl5 s VAL 97 Cb -0.15 -1.28 0.11 0.00 0.00 0.00 0.00 36.38 35.07 1kl5 s VAL 97 CO 0.08 0.39 0.69 0.61 0.00 0.00 0.00 175.10 176.87 1kl5 n GLY 98 N 4.85 -0.01 0.00 4.51 0.00 -1.26 -1.51 105.19 111.77 1kl5 n GLY 98 Ca -0.15 -1.90 0.00 0.00 0.00 0.00 0.00 46.02 43.98 1kl5 n GLY 98 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1kl5 n GLY 99 N 0.05 0.53 0.27 -0.02 0.00 -1.26 -4.58 105.19 100.17 1kl5 n GLY 99 Ca 0.10 -2.29 -0.02 0.00 0.00 0.00 0.00 46.02 43.81 1kl5 n GLY 99 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1kl5 h ALA 100 N 0.00 1.26 -1.41 4.61 0.00 -2.07 -3.00 119.26 118.65 1kl5 h ALA 100 Ca 0.00 -0.24 -0.75 0.00 0.00 0.00 0.00 54.91 53.92 1kl5 h ALA 100 Cb 0.00 -0.15 -0.31 0.00 0.00 0.00 0.00 17.79 17.33 1kl5 h ALA 100 CO 0.00 0.49 0.63 0.39 0.00 0.00 0.00 179.25 180.75 1kl5 n GLU 101 N -4.23 4.43 -1.81 0.00 -0.58 -1.26 -5.04 120.64 112.14 1kl5 n GLU 101 Ca 0.01 -4.49 -0.41 0.00 -0.42 0.00 0.00 57.16 51.86 1kl5 n GLU 101 Cb 0.29 -2.38 0.00 0.00 -0.57 0.00 0.00 31.44 28.78 1kl5 n GLU 101 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1kl5 s ALA 102 N -4.08 3.52 0.08 0.62 0.00 -1.14 -4.95 121.76 115.80 1kl5 s ALA 102 Ca 0.44 1.55 -0.11 0.00 0.00 0.00 0.00 51.96 53.83 1kl5 s ALA 102 Cb 0.27 -3.60 0.01 0.00 0.00 0.00 0.00 23.12 19.79 1kl5 s ALA 102 CO -0.19 -1.06 0.26 1.03 0.00 0.00 0.00 175.76 175.80 1kl5 s ARG 103 N -2.14 0.86 -0.22 0.00 0.52 -0.57 -4.12 118.95 113.27 1kl5 s ARG 103 Ca 0.54 -0.75 0.02 0.00 -0.52 0.00 0.00 55.73 55.02 1kl5 s ARG 103 Cb -0.46 0.36 0.04 0.00 0.52 0.00 0.00 34.95 35.41 1kl5 s ARG 103 CO 0.62 -0.28 -0.15 0.42 0.02 0.00 0.00 175.30 175.93 1kl5 s ILE 104 N -3.34 2.08 -0.29 1.52 1.01 -0.25 -0.55 121.20 121.38 1kl5 s ILE 104 Ca 0.01 -1.29 -0.11 0.00 0.00 0.00 0.00 60.65 59.25 1kl5 s ILE 104 Cb 0.02 -2.05 -0.04 0.00 0.01 0.00 0.00 42.46 40.39 1kl5 s ILE 104 CO -0.08 0.23 0.21 0.20 0.00 0.00 0.00 174.94 175.49 1kl5 s ASN 105 N 1.21 6.04 0.17 3.58 0.01 -0.45 -0.94 114.94 124.55 1kl5 s ASN 105 Ca -0.02 -0.05 0.06 0.00 -0.71 0.00 0.00 52.86 52.14 1kl5 s ASN 105 Cb -0.17 -2.13 -0.05 0.00 0.41 0.00 0.00 41.25 39.32 1kl5 s ASN 105 CO -0.09 -0.08 -0.12 0.42 -1.51 0.00 0.00 177.10 175.72 1kl5 s THR 106 N 1.77 1.45 0.06 1.60 -4.23 0.40 -1.55 115.64 115.15 1kl5 s THR 106 Ca 0.07 -2.13 0.08 0.00 -1.18 0.00 0.00 61.69 58.54 1kl5 s THR 106 Cb -0.16 -1.94 -0.03 0.00 1.34 0.00 0.00 72.50 71.71 1kl5 s THR 106 CO 0.11 -0.66 -0.19 -1.10 -0.54 0.00 0.00 174.62 172.23 1kl5 s GLN 107 N -3.67 1.94 0.13 3.99 -0.21 -0.22 -1.86 119.66 119.76 1kl5 s GLN 107 Ca 0.19 -1.06 0.05 0.00 0.02 0.00 0.00 55.36 54.56 1kl5 s GLN 107 Cb 0.01 -2.14 -0.04 0.00 1.00 0.00 0.00 33.01 31.84 1kl5 s GLN 107 CO 0.04 0.52 -0.12 1.67 -2.12 0.00 0.00 175.29 175.27 1kl5 s TRP 108 N -0.97 1.31 -0.13 0.91 1.48 0.08 -0.55 118.94 121.07 1kl5 s TRP 108 Ca 0.15 -0.62 0.01 0.00 -1.06 0.00 0.00 56.10 54.58 1kl5 s TRP 108 Cb -0.10 -0.68 0.02 0.00 -1.16 0.00 0.00 33.47 31.54 1kl5 s TRP 108 CO 0.06 0.11 -0.15 -0.51 -4.06 0.00 0.00 176.95 172.40 1kl5 s LEU 109 N -2.65 1.71 -0.28 -4.66 1.43 -0.39 -1.78 118.68 112.07 1kl5 s LEU 109 Ca 0.10 -0.46 -0.06 0.00 -1.03 0.00 0.00 54.13 52.69 1kl5 s LEU 109 Cb -0.03 -1.14 0.01 0.00 0.03 0.00 0.00 46.19 45.06 1kl5 s LEU 109 CO 0.02 -0.01 0.04 -0.22 0.23 0.00 0.00 176.35 176.41 1kl5 s LEU 110 N 1.20 3.62 -0.15 1.79 0.20 -0.25 -1.39 118.68 123.71 1kl5 s LEU 110 Ca -0.01 -0.69 -0.01 0.00 0.69 0.00 0.00 54.13 54.10 1kl5 s LEU 110 Cb -0.14 -1.83 -0.02 0.00 -0.43 0.00 0.00 46.19 43.78 1kl5 s LEU 110 CO -0.06 -0.16 -0.10 -0.89 -0.29 0.00 0.00 176.35 174.86 1kl5 s THR 111 N 1.47 3.24 -0.00 3.68 2.01 -0.21 -1.23 115.64 124.59 1kl5 s THR 111 Ca 0.02 -0.58 -0.01 0.00 0.31 0.00 0.00 61.69 61.43 1kl5 s THR 111 Cb -0.17 -2.39 -0.04 0.00 0.01 0.00 0.00 72.50 69.91 1kl5 s THR 111 CO 0.01 0.50 0.14 -0.44 -0.69 0.00 0.00 174.62 174.13 1kl5 s SER 112 N 0.56 6.04 0.04 3.53 0.01 0.17 -1.05 113.70 123.00 1kl5 s SER 112 Ca -0.07 0.24 -0.30 0.00 1.31 0.00 0.00 55.95 57.13 1kl5 s SER 112 Cb -0.15 -1.82 -0.07 0.00 0.21 0.00 0.00 66.02 64.19 1kl5 s SER 112 CO 0.03 0.26 1.54 -0.83 0.41 0.00 0.00 173.24 174.65 1kl5 s GLY 113 N -1.88 1.69 0.20 3.44 0.00 -0.01 -4.76 107.32 106.00 1kl5 s GLY 113 Ca 0.26 1.06 0.02 0.00 0.00 0.00 0.00 44.72 46.06 1kl5 s GLY 113 CO 0.17 2.71 0.01 -0.51 0.00 0.00 0.00 173.10 175.48 1kl5 s THR 114 N 2.49 0.79 0.79 0.90 -4.23 -1.26 -5.03 115.64 110.09 1kl5 s THR 114 Ca 0.69 -2.00 -0.11 0.00 -1.18 0.00 0.00 61.69 59.09 1kl5 s THR 114 Cb -0.36 -2.25 0.07 0.00 1.34 0.00 0.00 72.50 71.29 1kl5 s THR 114 CO 0.30 -0.37 1.09 0.42 -0.54 0.00 0.00 174.62 175.51 1kl5 s THR 115 N -3.58 3.22 0.29 3.99 -4.23 -1.26 -4.89 115.64 109.18 1kl5 s THR 115 Ca 0.27 0.40 0.01 0.00 -1.18 0.00 0.00 61.69 61.19 1kl5 s THR 115 Cb 0.06 -3.05 0.28 0.00 1.34 0.00 0.00 72.50 71.14 1kl5 s THR 115 CO 0.07 -0.52 1.87 -0.33 -0.54 0.00 0.00 174.62 175.17 1kl5 h GLU 116 N -1.12 1.00 -0.20 3.99 5.08 -2.01 0.09 114.58 121.42 1kl5 h GLU 116 Ca -0.46 -0.06 -0.09 0.00 -1.00 0.00 0.00 59.36 57.75 1kl5 h GLU 116 Cb 1.25 -0.23 -0.01 0.00 0.50 0.00 0.00 28.75 30.26 1kl5 h GLU 116 CO 0.57 0.66 -0.27 0.00 -1.00 0.00 0.00 179.01 178.97 1kl5 h ALA 117 N 1.51 1.18 -0.64 3.43 0.00 -2.06 -3.04 119.26 119.63 1kl5 h ALA 117 Ca 0.45 -0.33 0.00 0.00 0.00 0.00 0.00 54.91 55.02 1kl5 h ALA 117 Cb 0.35 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.03 1kl5 h ALA 117 CO -0.21 0.53 0.00 0.09 0.00 0.00 0.00 179.25 179.66 1kl5 n ASN 118 N -4.13 4.62 0.29 0.00 5.03 -0.04 -4.47 115.26 116.57 1kl5 n ASN 118 Ca -0.01 -2.41 0.14 0.00 0.87 0.00 0.00 54.58 53.17 1kl5 n ASN 118 Cb 0.40 -0.57 0.86 0.00 -1.02 0.00 0.00 39.78 39.45 1kl5 n ASN 118 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1kl5 h ALA 119 N 4.14 1.51 -0.01 5.41 0.00 -1.30 -2.36 119.26 126.65 1kl5 h ALA 119 Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1kl5 h ALA 119 Cb 1.40 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 19.19 1kl5 h ALA 119 CO 0.22 0.03 0.01 0.11 0.00 0.00 0.00 179.25 179.62 1kl5 h TRP 120 N 0.00 0.00 -0.57 0.00 5.08 -1.85 -0.09 115.95 118.52 1kl5 h TRP 120 Ca -0.00 0.00 -0.05 0.00 1.08 0.00 0.00 58.89 59.92 1kl5 h TRP 120 Cb 0.06 0.00 -0.03 0.00 -3.00 0.00 0.00 29.16 26.19 1kl5 h TRP 120 CO 0.00 0.00 0.06 0.36 -1.28 0.00 0.00 178.44 177.58 1kl5 n LYS 121 N -4.23 4.35 0.13 0.12 2.85 -0.89 -4.56 118.16 115.92 1kl5 n LYS 121 Ca -0.03 -3.12 -0.01 0.00 -1.05 0.00 0.00 58.31 54.11 1kl5 n LYS 121 Cb 0.10 -2.20 0.13 0.00 -0.65 0.00 0.00 35.03 32.42 1kl5 n LYS 121 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 177.40 178.01 1kl5 h SER 122 N 3.37 0.00 -3.24 -5.58 4.64 -1.10 -3.45 113.55 108.18 1kl5 h SER 122 Ca 0.06 0.00 -0.59 0.00 -0.47 0.00 0.00 61.79 60.79 1kl5 h SER 122 Cb 2.00 0.00 -0.37 0.00 -0.31 0.00 0.00 62.40 63.72 1kl5 h SER 122 CO 0.51 0.65 -0.82 -0.89 -0.87 0.00 0.00 176.83 175.41 1kl5 s THR 123 N -3.40 1.47 0.12 2.95 2.01 -1.26 -0.66 115.64 116.88 1kl5 s THR 123 Ca -0.00 -0.70 -0.08 0.00 0.31 0.00 0.00 61.69 61.22 1kl5 s THR 123 Cb 0.12 -1.47 -0.06 0.00 0.01 0.00 0.00 72.50 71.10 1kl5 s THR 123 CO 0.76 0.32 0.42 -0.76 -0.69 0.00 0.00 174.62 174.67 1kl5 s LEU 124 N 1.51 4.29 0.03 4.42 1.43 -0.37 -4.93 118.68 125.06 1kl5 s LEU 124 Ca 0.03 0.74 0.06 0.00 -1.03 0.00 0.00 54.13 53.93 1kl5 s LEU 124 Cb -0.14 -3.21 -0.02 0.00 0.03 0.00 0.00 46.19 42.85 1kl5 s LEU 124 CO -0.09 0.09 -0.17 0.54 0.23 0.00 0.00 176.35 176.95 1kl5 s VAL 125 N -1.55 1.39 0.00 -1.59 0.11 -1.26 -1.09 120.40 116.41 1kl5 s VAL 125 Ca 0.38 -0.99 0.00 0.00 -2.93 0.00 0.00 61.98 58.44 1kl5 s VAL 125 Cb -0.13 -1.21 0.00 0.00 -1.53 0.00 0.00 36.38 33.52 1kl5 s VAL 125 CO 0.21 0.19 0.00 0.61 -3.33 0.00 0.00 175.10 172.78 1kl5 n GLY 126 N 2.11 2.18 3.10 6.54 0.00 -0.74 -5.00 105.19 113.38 1kl5 n GLY 126 Ca -0.17 -0.95 -0.09 0.00 0.00 0.00 0.00 46.02 44.82 1kl5 n GLY 126 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 1kl5 s HIS 127 N -7.49 0.27 -0.05 1.61 -3.43 -1.26 -0.74 115.29 104.20 1kl5 s HIS 127 Ca 0.00 -0.62 -0.05 0.00 -0.80 0.00 0.00 55.06 53.59 1kl5 s HIS 127 Cb 0.00 -0.19 0.01 0.00 -1.43 0.00 0.00 32.58 30.97 1kl5 s HIS 127 CO 0.00 -0.36 0.14 -0.51 -2.00 0.00 0.00 174.74 172.01 1kl5 s ASP 128 N -2.23 -0.13 -0.18 7.38 1.01 -0.77 -4.92 116.67 116.82 1kl5 s ASP 128 Ca -0.04 0.24 -0.01 0.00 0.71 0.00 0.00 52.55 53.45 1kl5 s ASP 128 Cb -0.00 0.28 -0.00 0.00 1.01 0.00 0.00 42.92 44.21 1kl5 s ASP 128 CO -0.05 -0.08 -0.12 -0.89 0.21 0.00 0.00 175.17 174.24 1kl5 s THR 129 N -0.07 2.85 -0.08 -1.27 2.01 -1.26 -0.45 115.64 117.37 1kl5 s THR 129 Ca -0.02 -0.69 -0.02 0.00 0.31 0.00 0.00 61.69 61.28 1kl5 s THR 129 Cb -0.02 -2.24 -0.03 0.00 0.01 0.00 0.00 72.50 70.22 1kl5 s THR 129 CO 0.00 0.49 0.01 -0.36 -0.69 0.00 0.00 174.62 174.07 1kl5 s PHE 130 N 1.10 3.18 0.20 4.92 0.40 -0.12 -4.15 117.98 123.50 1kl5 s PHE 130 Ca 0.00 0.20 0.06 0.00 -0.60 0.00 0.00 56.93 56.59 1kl5 s PHE 130 Cb -0.14 -1.78 -0.05 0.00 0.51 0.00 0.00 43.02 41.55 1kl5 s PHE 130 CO -0.03 0.48 -0.11 0.95 0.70 0.00 0.00 175.22 177.22 1kl5 s THR 131 N -0.92 1.46 -0.51 0.64 -4.23 -0.17 -1.09 115.64 110.82 1kl5 s THR 131 Ca 0.14 -2.13 0.24 0.00 -1.18 0.00 0.00 61.69 58.76 1kl5 s THR 131 Cb -0.11 -2.05 0.33 0.00 1.34 0.00 0.00 72.50 72.00 1kl5 s THR 131 CO 0.03 -0.59 1.67 0.11 -0.54 0.00 0.00 174.62 175.30 1kl5 h LYS 132 N 2.60 0.00 -6.70 3.99 1.57 -1.80 0.11 116.57 116.33 1kl5 h LYS 132 Ca -0.38 0.00 -0.69 0.00 -1.87 0.00 0.00 60.65 57.71 1kl5 h LYS 132 Cb 1.21 0.00 -0.23 0.00 0.08 0.00 0.00 32.23 33.29 1kl5 h LYS 132 CO 0.63 0.00 -0.84 0.08 -0.57 0.00 0.00 179.45 178.75 1kl5 s VAL 133 N -3.19 2.48 -2.05 0.50 1.01 -1.26 -4.87 120.40 113.01 1kl5 s VAL 133 Ca 0.08 -1.38 0.32 0.00 0.00 0.00 0.00 61.98 60.99 1kl5 s VAL 133 Cb 0.07 -2.03 0.87 0.00 0.00 0.00 0.00 36.38 35.29 1kl5 s VAL 133 CO 0.64 0.29 2.18 1.17 0.00 0.00 0.00 175.10 179.38