#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1kl3 h ILE 17 N 0.00 1.29 -3.17 -0.61 2.04 -1.97 -3.45 117.51 111.65 1kl3 h ILE 17 Ca 0.00 -1.51 -0.53 0.00 1.00 0.00 0.00 64.86 63.83 1kl3 h ILE 17 Cb 0.00 1.55 0.05 0.00 -0.74 0.00 0.00 36.82 37.68 1kl3 h ILE 17 CO 0.00 0.49 0.80 -0.89 0.00 0.00 0.00 178.15 178.55 1kl3 s THR 18 N -4.34 2.68 -5.00 -0.27 2.01 -1.26 -4.81 115.64 104.66 1kl3 s THR 18 Ca -0.12 0.53 0.00 0.00 0.31 0.00 0.00 61.69 62.41 1kl3 s THR 18 Cb 0.09 -3.34 0.00 0.00 0.01 0.00 0.00 72.50 69.26 1kl3 s THR 18 CO 0.85 0.07 0.00 0.61 -0.69 0.00 0.00 174.62 175.45 1kl3 n GLY 19 N 2.81 -0.22 3.34 4.40 0.00 -0.22 -5.01 105.19 110.29 1kl3 n GLY 19 Ca 0.09 -1.52 -0.34 0.00 0.00 0.00 0.00 46.02 44.26 1kl3 n GLY 19 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1kl3 s THR 20 N -2.66 3.18 0.17 2.61 2.01 -1.26 -1.23 115.64 118.47 1kl3 s THR 20 Ca 0.00 -0.59 0.08 0.00 0.31 0.00 0.00 61.69 61.49 1kl3 s THR 20 Cb 0.00 -2.39 -0.04 0.00 0.01 0.00 0.00 72.50 70.08 1kl3 s THR 20 CO 0.00 0.48 -0.17 0.26 -0.69 0.00 0.00 174.62 174.50 1kl3 s TRP 21 N 0.90 1.76 -0.01 4.92 0.52 0.71 -4.62 118.94 123.13 1kl3 s TRP 21 Ca -0.02 -0.50 0.02 0.00 0.02 0.00 0.00 56.10 55.62 1kl3 s TRP 21 Cb -0.15 -0.86 -0.00 0.00 -1.15 0.00 0.00 33.47 31.31 1kl3 s TRP 21 CO 0.00 0.33 -0.06 0.71 0.02 0.00 0.00 176.95 177.95 1kl3 s TYR 22 N -2.32 0.56 0.58 -1.98 1.51 -0.46 -0.04 117.35 115.20 1kl3 s TYR 22 Ca 0.17 -0.11 0.04 0.00 -1.01 0.00 0.00 57.07 56.16 1kl3 s TYR 22 Cb -0.04 -0.37 0.11 0.00 -0.11 0.00 0.00 41.96 41.54 1kl3 s TYR 22 CO 0.07 -0.02 0.80 0.27 -1.11 0.00 0.00 175.55 175.55 1kl3 n ASN 23 N 3.00 1.51 0.27 2.29 6.94 -0.89 -1.28 115.26 127.09 1kl3 n ASN 23 Ca -0.14 -2.17 0.17 0.00 -0.02 0.00 0.00 54.58 52.43 1kl3 n ASN 23 Cb 0.57 -0.48 0.71 0.00 -2.36 0.00 0.00 39.78 38.23 1kl3 n ASN 23 CO 0.00 0.00 0.00 0.06 -1.03 0.00 0.00 177.26 176.29 1kl3 h GLN 24 N 0.00 0.00 -0.02 -3.83 -0.00 -1.91 -2.97 115.11 106.38 1kl3 h GLN 24 Ca -0.27 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.38 1kl3 h GLN 24 Cb 1.09 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.57 1kl3 h GLN 24 CO 0.33 0.00 -0.17 1.28 -0.00 0.00 0.00 178.83 180.26 1kl3 n LEU 25 N -3.02 2.35 0.00 0.06 4.77 -1.26 -4.95 117.00 114.94 1kl3 n LEU 25 Ca 0.00 -0.80 0.00 0.00 -0.03 0.00 0.00 56.01 55.18 1kl3 n LEU 25 Cb 0.28 -0.01 0.00 0.00 -2.33 0.00 0.00 43.42 41.36 1kl3 n LEU 25 CO 0.26 0.41 0.00 0.61 -1.33 0.00 0.00 177.39 177.34 1kl3 n GLY 26 N 1.35 0.62 3.87 -0.72 0.00 -1.12 -4.83 105.19 104.36 1kl3 n GLY 26 Ca 0.13 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.85 1kl3 n GLY 26 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1kl3 s SER 27 N -2.50 6.36 -0.09 1.61 0.01 -1.26 -4.06 113.70 113.77 1kl3 s SER 27 Ca 0.00 1.31 0.04 0.00 1.31 0.00 0.00 55.95 58.61 1kl3 s SER 27 Cb 0.00 -2.41 -0.01 0.00 0.21 0.00 0.00 66.02 63.81 1kl3 s SER 27 CO 0.00 -0.68 -0.20 -0.89 0.41 0.00 0.00 173.24 171.87 1kl3 s THR 28 N -2.86 2.43 -0.33 1.44 2.01 0.40 -2.10 115.64 116.63 1kl3 s THR 28 Ca 0.54 -0.91 0.01 0.00 0.31 0.00 0.00 61.69 61.64 1kl3 s THR 28 Cb -0.11 -1.94 0.08 0.00 0.01 0.00 0.00 72.50 70.54 1kl3 s THR 28 CO 0.44 0.56 0.04 0.12 -0.69 0.00 0.00 174.62 175.09 1kl3 s PHE 29 N 0.06 3.50 -0.37 4.92 5.36 0.95 -0.16 117.98 132.23 1kl3 s PHE 29 Ca -0.09 -2.44 -0.11 0.00 -0.96 0.00 0.00 56.93 53.33 1kl3 s PHE 29 Cb -0.15 -2.60 0.03 0.00 -0.34 0.00 0.00 43.02 39.96 1kl3 s PHE 29 CO 0.05 -0.90 0.21 0.42 -1.46 0.00 0.00 175.22 173.54 1kl3 s ILE 30 N 1.09 4.58 0.05 3.12 1.01 -0.29 -0.21 121.20 130.55 1kl3 s ILE 30 Ca 0.02 -0.86 0.05 0.00 0.00 0.00 0.00 60.65 59.87 1kl3 s ILE 30 Cb -0.20 -3.56 -0.02 0.00 0.01 0.00 0.00 42.46 38.69 1kl3 s ILE 30 CO -0.05 -0.24 -0.16 0.54 0.00 0.00 0.00 174.94 175.04 1kl3 s VAL 31 N 1.55 1.23 -0.11 2.92 0.11 -0.36 -1.65 120.40 124.10 1kl3 s VAL 31 Ca 0.02 -1.12 0.03 0.00 -2.93 0.00 0.00 61.98 57.98 1kl3 s VAL 31 Cb -0.19 -1.12 0.01 0.00 -1.53 0.00 0.00 36.38 33.54 1kl3 s VAL 31 CO 0.07 -0.01 -0.20 -0.89 -3.33 0.00 0.00 175.10 170.73 1kl3 s THR 32 N -0.94 1.81 -0.39 5.04 2.01 0.37 -1.06 115.64 122.48 1kl3 s THR 32 Ca 0.02 -0.86 -0.10 0.00 0.31 0.00 0.00 61.69 61.07 1kl3 s THR 32 Cb -0.09 -1.60 0.05 0.00 0.01 0.00 0.00 72.50 70.88 1kl3 s THR 32 CO 0.02 0.50 0.22 0.00 -0.69 0.00 0.00 174.62 174.67 1kl3 s ALA 33 N 0.62 3.25 0.54 7.40 0.00 -1.26 -1.83 121.76 130.48 1kl3 s ALA 33 Ca -0.13 -1.92 -0.04 0.00 0.00 0.00 0.00 51.96 49.86 1kl3 s ALA 33 Cb -0.17 -2.58 -0.00 0.00 0.00 0.00 0.00 23.12 20.38 1kl3 s ALA 33 CO 0.04 -1.50 0.83 0.20 0.00 0.00 0.00 175.76 175.32 1kl3 s GLY 34 N 1.79 1.58 0.56 0.00 0.00 0.08 -4.90 107.32 106.43 1kl3 s GLY 34 Ca 0.02 -0.77 0.23 0.00 0.00 0.00 0.00 44.72 44.20 1kl3 s GLY 34 CO 0.04 -0.53 2.19 0.00 0.00 0.00 0.00 173.10 174.81 1kl3 h ALA 35 N 0.02 1.79 -0.01 3.20 0.00 -1.98 -2.23 119.26 120.06 1kl3 h ALA 35 Ca -0.46 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.45 1kl3 h ALA 35 Cb 1.25 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.04 1kl3 h ALA 35 CO 0.60 -0.02 0.00 -0.40 0.00 0.00 0.00 179.25 179.42 1kl3 n ASP 36 N -4.20 0.05 0.00 0.00 5.75 -1.26 -4.86 116.55 112.03 1kl3 n ASP 36 Ca -0.03 -1.46 0.00 0.00 -0.01 0.00 0.00 54.79 53.29 1kl3 n ASP 36 Cb 0.11 -0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.19 1kl3 n ASP 36 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1kl3 n GLY 37 N 0.78 0.75 3.84 6.12 0.00 -0.84 -5.02 105.19 110.82 1kl3 n GLY 37 Ca 0.13 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.79 1kl3 n GLY 37 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1kl3 s ALA 38 N -2.30 3.61 -0.17 4.61 0.00 -1.25 -1.45 121.76 124.81 1kl3 s ALA 38 Ca 0.00 -0.13 -0.04 0.00 0.00 0.00 0.00 51.96 51.79 1kl3 s ALA 38 Cb 0.00 -2.51 -0.02 0.00 0.00 0.00 0.00 23.12 20.59 1kl3 s ALA 38 CO 0.00 0.46 -0.04 -0.51 0.00 0.00 0.00 175.76 175.67 1kl3 s LEU 39 N -1.68 3.17 0.07 0.00 1.43 0.33 -0.74 118.68 121.26 1kl3 s LEU 39 Ca 0.34 -0.18 0.02 0.00 -1.03 0.00 0.00 54.13 53.27 1kl3 s LEU 39 Cb -0.16 -1.77 -0.03 0.00 0.03 0.00 0.00 46.19 44.26 1kl3 s LEU 39 CO 0.18 0.13 -0.07 0.42 0.23 0.00 0.00 176.35 177.25 1kl3 s THR 40 N 0.57 0.63 -4.85 5.49 -4.23 -0.76 -1.25 115.64 111.24 1kl3 s THR 40 Ca -0.03 -1.57 0.00 0.00 -1.18 0.00 0.00 61.69 58.91 1kl3 s THR 40 Cb -0.14 -1.23 0.00 0.00 1.34 0.00 0.00 72.50 72.47 1kl3 s THR 40 CO 0.03 -0.66 0.00 0.61 -0.54 0.00 0.00 174.62 174.05 1kl3 n GLY 41 N 0.60 -0.49 3.01 3.99 0.00 -1.11 -0.48 105.19 110.71 1kl3 n GLY 41 Ca -0.17 -1.10 -0.19 0.00 0.00 0.00 0.00 46.02 44.56 1kl3 n GLY 41 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1kl3 s THR 42 N -3.01 0.72 -0.16 2.61 2.01 -0.66 -1.65 115.64 115.50 1kl3 s THR 42 Ca 0.00 -0.37 -0.02 0.00 0.31 0.00 0.00 61.69 61.61 1kl3 s THR 42 Cb 0.00 -0.62 -0.02 0.00 0.01 0.00 0.00 72.50 71.87 1kl3 s THR 42 CO 0.00 0.21 -0.07 -0.47 -0.69 0.00 0.00 174.62 173.60 1kl3 s TYR 43 N -0.05 2.93 -0.19 4.92 6.14 0.61 -1.13 117.35 130.57 1kl3 s TYR 43 Ca 0.01 -0.56 -0.01 0.00 0.64 0.00 0.00 57.07 57.16 1kl3 s TYR 43 Cb -0.05 -1.95 0.01 0.00 0.42 0.00 0.00 41.96 40.39 1kl3 s TYR 43 CO -0.00 -0.21 -0.15 0.08 0.64 0.00 0.00 175.55 175.91 1kl3 s VAL 44 N 0.60 2.48 1.08 3.14 1.01 0.77 -0.84 120.40 128.64 1kl3 s VAL 44 Ca -0.05 -0.80 -0.16 0.00 0.00 0.00 0.00 61.98 60.97 1kl3 s VAL 44 Cb -0.15 -2.08 0.23 0.00 0.00 0.00 0.00 36.38 34.38 1kl3 s VAL 44 CO 0.03 0.50 1.16 0.42 0.00 0.00 0.00 175.10 177.20 1kl3 s THR 45 N 1.35 1.81 0.43 3.92 -4.23 -0.64 -0.45 115.64 117.82 1kl3 s THR 45 Ca 0.05 0.00 0.10 0.00 -1.18 0.00 0.00 61.69 60.66 1kl3 s THR 45 Cb -0.13 -2.65 0.29 0.00 1.34 0.00 0.00 72.50 71.34 1kl3 s THR 45 CO -0.10 0.00 2.04 0.00 -0.54 0.00 0.00 174.62 176.02 1kl3 h ALA 46 N -2.11 1.84 -0.34 3.99 0.00 -1.88 -2.66 119.26 118.10 1kl3 h ALA 46 Ca -0.47 -0.02 0.06 0.00 0.00 0.00 0.00 54.91 54.48 1kl3 h ALA 46 Cb 1.29 -0.12 -0.06 0.00 0.00 0.00 0.00 17.79 18.90 1kl3 h ALA 46 CO 0.43 0.11 -0.04 -0.09 0.00 0.00 0.00 179.25 179.66 1kl3 h ARG 47 N 0.46 0.05 0.00 0.00 2.43 -1.91 -3.48 114.38 111.94 1kl3 h ARG 47 Ca 0.18 -0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.35 1kl3 h ARG 47 Cb 0.15 -0.01 0.00 0.00 -0.42 0.00 0.00 29.97 29.69 1kl3 h ARG 47 CO -0.04 0.03 0.00 0.41 -1.51 0.00 0.00 179.97 178.86 1kl3 n GLY 48 N -1.26 0.77 2.06 2.80 0.00 -1.00 -5.07 105.19 103.49 1kl3 n GLY 48 Ca 0.01 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.89 1kl3 n GLY 48 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1kl3 n ASN 49 N 0.00 0.35 0.15 1.61 5.15 -1.26 -4.96 115.26 116.29 1kl3 n ASN 49 Ca 0.00 -1.41 0.02 0.00 -0.60 0.00 0.00 54.58 52.58 1kl3 n ASN 49 Cb 0.00 -0.45 0.15 0.00 -0.53 0.00 0.00 39.78 38.95 1kl3 n ASN 49 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1kl3 h ALA 50 N -1.29 0.80 0.00 5.20 0.00 -1.99 -2.65 119.26 119.34 1kl3 h ALA 50 Ca -0.21 -0.50 0.00 0.00 0.00 0.00 0.00 54.91 54.20 1kl3 h ALA 50 Cb 0.64 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.34 1kl3 h ALA 50 CO 0.17 0.69 0.00 0.39 0.00 0.00 0.00 179.25 180.51 1kl3 n GLU 51 N -3.47 0.54 -0.27 0.00 4.71 -1.26 -3.21 120.64 117.68 1kl3 n GLU 51 Ca 0.00 0.03 0.08 0.00 -0.01 0.00 0.00 57.16 57.26 1kl3 n GLU 51 Cb 0.66 -1.50 0.19 0.00 -1.01 0.00 0.00 31.44 29.78 1kl3 n GLU 51 CO 0.00 0.00 0.00 -1.13 0.09 0.00 0.00 177.13 176.09 1kl3 n SER 52 N -1.11 3.19 -4.64 1.62 3.41 -1.00 -4.83 113.62 110.26 1kl3 n SER 52 Ca 0.14 -2.79 -0.35 0.00 -0.26 0.00 0.00 58.87 55.62 1kl3 n SER 52 Cb 0.11 -0.42 -0.10 0.00 -0.26 0.00 0.00 64.21 63.54 1kl3 n SER 52 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 1kl3 s ARG 53 N -2.39 3.49 0.02 4.33 0.52 -1.20 -1.63 118.95 122.09 1kl3 s ARG 53 Ca 0.33 -0.39 0.02 0.00 -0.52 0.00 0.00 55.73 55.17 1kl3 s ARG 53 Cb 0.26 -2.98 -0.01 0.00 0.52 0.00 0.00 34.95 32.74 1kl3 s ARG 53 CO 0.08 0.47 -0.07 0.71 0.02 0.00 0.00 175.30 176.51 1kl3 s TYR 54 N -0.21 0.58 0.18 -0.53 1.51 -0.02 -4.80 117.35 114.06 1kl3 s TYR 54 Ca 0.06 -0.28 -0.30 0.00 -1.01 0.00 0.00 57.07 55.54 1kl3 s TYR 54 Cb -0.12 -0.36 -0.08 0.00 -0.11 0.00 0.00 41.96 41.29 1kl3 s TYR 54 CO 0.02 -0.04 1.15 0.08 -1.11 0.00 0.00 175.55 175.65 1kl3 s VAL 55 N -0.70 3.71 0.14 0.71 1.01 -1.26 -0.28 120.40 123.73 1kl3 s VAL 55 Ca -0.03 1.46 0.10 0.00 0.00 0.00 0.00 61.98 63.50 1kl3 s VAL 55 Cb -0.06 -3.93 -0.04 0.00 0.00 0.00 0.00 36.38 32.35 1kl3 s VAL 55 CO 0.00 0.24 -0.22 -1.48 0.00 0.00 0.00 175.10 173.64 1kl3 s LEU 56 N -0.32 2.37 0.02 3.92 0.05 -0.66 -4.41 118.68 119.65 1kl3 s LEU 56 Ca 0.51 -0.78 -0.03 0.00 0.05 0.00 0.00 54.13 53.88 1kl3 s LEU 56 Cb -0.31 -1.02 -0.01 0.00 -2.05 0.00 0.00 46.19 42.80 1kl3 s LEU 56 CO 0.36 0.08 0.04 0.28 -0.55 0.00 0.00 176.35 176.56 1kl3 s THR 57 N -1.46 0.11 0.00 5.48 -1.32 -1.08 -2.76 115.64 114.62 1kl3 s THR 57 Ca 0.14 -0.94 0.00 0.00 -1.21 0.00 0.00 61.69 59.68 1kl3 s THR 57 Cb -0.09 -0.51 0.00 0.00 -1.51 0.00 0.00 72.50 70.40 1kl3 s THR 57 CO 0.07 -0.52 0.00 0.61 -2.21 0.00 0.00 174.62 172.57 1kl3 n GLY 58 N 1.31 1.69 3.04 6.08 0.00 -0.38 -0.94 105.19 115.98 1kl3 n GLY 58 Ca -0.22 -0.91 -0.09 0.00 0.00 0.00 0.00 46.02 44.80 1kl3 n GLY 58 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1kl3 s ARG 59 N -1.45 0.41 0.08 1.61 1.81 -0.59 -0.51 118.95 120.31 1kl3 s ARG 59 Ca 0.00 -0.64 -0.06 0.00 -1.72 0.00 0.00 55.73 53.31 1kl3 s ARG 59 Cb 0.00 0.16 -0.02 0.00 -0.45 0.00 0.00 34.95 34.64 1kl3 s ARG 59 CO 0.00 -0.08 0.11 1.52 -0.68 0.00 0.00 175.30 176.17 1kl3 s TYR 60 N -1.82 0.31 -0.43 -0.53 1.13 -0.53 -1.70 117.35 113.78 1kl3 s TYR 60 Ca -0.12 -0.78 -0.29 0.00 -1.41 0.00 0.00 57.07 54.47 1kl3 s TYR 60 Cb -0.07 -0.19 0.02 0.00 -1.10 0.00 0.00 41.96 40.63 1kl3 s TYR 60 CO -0.02 -0.49 1.19 0.34 -2.51 0.00 0.00 175.55 174.06 1kl3 s ASP 61 N -2.89 6.62 0.00 -0.18 -1.08 -0.41 -4.65 116.67 114.07 1kl3 s ASP 61 Ca 0.07 0.66 0.31 0.00 -0.52 0.00 0.00 52.55 53.06 1kl3 s ASP 61 Cb 0.06 -2.55 1.61 0.00 -1.46 0.00 0.00 42.92 40.58 1kl3 s ASP 61 CO -0.10 -1.23 2.08 -1.54 0.52 0.00 0.00 175.17 174.90 1kl3 n SER 62 N 7.89 0.11 -3.22 -0.34 3.41 -1.26 -4.08 113.62 116.13 1kl3 n SER 62 Ca 0.13 -0.54 -0.24 0.00 -0.26 0.00 0.00 58.87 57.96 1kl3 n SER 62 Cb 0.48 -0.15 -0.06 0.00 -0.26 0.00 0.00 64.21 64.22 1kl3 n SER 62 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1kl3 n ALA 63 N -1.10 2.77 -1.19 7.33 0.00 -1.26 -5.06 120.51 122.00 1kl3 n ALA 63 Ca 0.18 -3.71 -0.30 0.00 0.00 0.00 0.00 53.44 49.61 1kl3 n ALA 63 Cb 0.20 -0.84 0.13 0.00 0.00 0.00 0.00 19.45 18.95 1kl3 n ALA 63 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1kl3 s PRO 64 N -1.70 1.38 0.59 0.00 0.04 -1.26 -4.99 135.00 129.05 1kl3 s PRO 64 Ca 0.37 0.90 -0.20 0.00 0.04 0.00 0.00 61.00 62.11 1kl3 s PRO 64 Cb 0.20 -1.82 -0.03 0.00 0.04 0.00 0.00 34.50 32.89 1kl3 s PRO 64 CO -0.09 -2.18 1.28 0.00 0.04 0.00 0.00 177.00 176.05 1kl3 s ALA 65 N -2.91 2.61 -0.38 8.56 0.00 -1.26 -4.93 121.76 123.44 1kl3 s ALA 65 Ca 0.63 1.17 0.07 0.00 0.00 0.00 0.00 51.96 53.83 1kl3 s ALA 65 Cb -0.18 -3.51 0.70 0.00 0.00 0.00 0.00 23.12 20.12 1kl3 s ALA 65 CO 0.57 -1.32 1.84 0.25 0.00 0.00 0.00 175.76 177.10 1kl3 n THR 66 N -1.43 3.04 -0.52 0.00 -2.24 -1.26 -4.52 114.28 107.35 1kl3 n THR 66 Ca 0.13 -1.84 0.09 0.00 -2.27 0.00 0.00 64.05 60.16 1kl3 n THR 66 Cb 0.48 -0.41 0.35 0.00 -2.10 0.00 0.00 70.33 68.65 1kl3 n THR 66 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 1kl3 n ASP 67 N -0.67 4.67 0.00 3.42 5.68 -1.26 -4.88 116.55 123.50 1kl3 n ASP 67 Ca 0.49 -2.48 0.00 0.00 -0.50 0.00 0.00 54.79 52.31 1kl3 n ASP 67 Cb 1.50 -0.58 0.00 0.00 -1.14 0.00 0.00 41.12 40.90 1kl3 n ASP 67 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1kl3 n GLY 68 N 1.05 0.65 3.79 6.12 0.00 -1.26 -5.07 105.19 110.47 1kl3 n GLY 68 Ca 0.25 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.94 1kl3 n GLY 68 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1kl3 s SER 69 N -2.78 5.50 0.95 1.61 0.01 -1.26 -5.06 113.70 112.68 1kl3 s SER 69 Ca 0.00 1.88 -0.14 0.00 1.31 0.00 0.00 55.95 59.00 1kl3 s SER 69 Cb 0.00 -2.54 0.17 0.00 0.21 0.00 0.00 66.02 63.86 1kl3 s SER 69 CO 0.00 -1.36 1.19 -0.83 0.41 0.00 0.00 173.24 172.65 1kl3 s GLY 70 N -2.74 1.63 -0.29 3.44 0.00 -1.26 -4.79 107.32 103.31 1kl3 s GLY 70 Ca 0.65 -0.79 -0.08 0.00 0.00 0.00 0.00 44.72 44.49 1kl3 s GLY 70 CO 0.39 -0.14 0.12 -1.59 0.00 0.00 0.00 173.10 171.88 1kl3 s THR 71 N -3.45 4.41 0.51 0.90 2.01 -0.50 -4.77 115.64 114.75 1kl3 s THR 71 Ca 0.67 -0.41 -0.21 0.00 0.31 0.00 0.00 61.69 62.05 1kl3 s THR 71 Cb -0.10 -3.21 -0.06 0.00 0.01 0.00 0.00 72.50 69.13 1kl3 s THR 71 CO 0.53 0.13 1.14 0.00 -0.69 0.00 0.00 174.62 175.74 1kl3 s ALA 72 N 1.59 2.80 0.08 7.40 0.00 -1.26 -0.38 121.76 131.99 1kl3 s ALA 72 Ca 0.05 0.87 -0.26 0.00 0.00 0.00 0.00 51.96 52.61 1kl3 s ALA 72 Cb -0.17 -3.37 0.08 0.00 0.00 0.00 0.00 23.12 19.67 1kl3 s ALA 72 CO 0.05 -0.73 0.80 -0.48 0.00 0.00 0.00 175.76 175.40 1kl3 s LEU 73 N -3.51 -0.40 0.17 0.00 0.05 -0.42 -1.29 118.68 113.28 1kl3 s LEU 73 Ca 0.69 -0.08 -0.20 0.00 0.05 0.00 0.00 54.13 54.60 1kl3 s LEU 73 Cb -0.26 2.25 0.05 0.00 -2.05 0.00 0.00 46.19 46.18 1kl3 s LEU 73 CO 0.30 -0.79 0.55 -0.83 -0.55 0.00 0.00 176.35 175.03 1kl3 s GLY 74 N -2.63 -0.39 0.20 -3.48 0.00 -0.69 -1.81 107.32 98.53 1kl3 s GLY 74 Ca 0.05 0.15 -0.19 0.00 0.00 0.00 0.00 44.72 44.73 1kl3 s GLY 74 CO -0.08 -0.05 0.57 0.66 0.00 0.00 0.00 173.10 174.20 1kl3 s TRP 75 N -3.80 -0.21 -0.03 1.90 -2.14 -0.71 -1.54 118.94 112.42 1kl3 s TRP 75 Ca 0.04 -0.13 0.04 0.00 2.66 0.00 0.00 56.10 58.72 1kl3 s TRP 75 Cb -0.01 0.47 -0.01 0.00 -3.10 0.00 0.00 33.47 30.83 1kl3 s TRP 75 CO -0.09 -0.96 -0.16 0.99 -2.66 0.00 0.00 176.95 174.08 1kl3 s THR 76 N -3.86 1.28 -0.16 0.66 2.01 -0.12 -0.95 115.64 114.50 1kl3 s THR 76 Ca 0.08 -0.66 0.00 0.00 0.31 0.00 0.00 61.69 61.42 1kl3 s THR 76 Cb -0.02 -1.09 -0.00 0.00 0.01 0.00 0.00 72.50 71.40 1kl3 s THR 76 CO -0.03 0.37 -0.15 -0.69 -0.69 0.00 0.00 174.62 173.43 1kl3 s VAL 77 N -0.15 2.71 -0.13 3.82 1.01 -0.24 -2.62 120.40 124.81 1kl3 s VAL 77 Ca 0.01 -0.75 -0.16 0.00 0.00 0.00 0.00 61.98 61.08 1kl3 s VAL 77 Cb -0.09 -2.15 -0.05 0.00 0.00 0.00 0.00 36.38 34.10 1kl3 s VAL 77 CO 0.01 0.51 0.39 0.00 0.00 0.00 0.00 175.10 176.00 1kl3 s ALA 78 N 0.82 3.55 -0.18 5.51 0.00 -1.26 -0.37 121.76 129.82 1kl3 s ALA 78 Ca -0.05 -0.31 -0.05 0.00 0.00 0.00 0.00 51.96 51.55 1kl3 s ALA 78 Cb -0.15 -2.50 -0.12 0.00 0.00 0.00 0.00 23.12 20.35 1kl3 s ALA 78 CO -0.00 0.09 3.20 0.91 0.00 0.00 0.00 175.76 179.96 1kl3 n TRP 79 N 3.44 0.66 -4.39 0.00 7.02 -0.49 -4.76 117.44 118.91 1kl3 n TRP 79 Ca -0.10 -1.67 -0.23 0.00 -1.02 0.00 0.00 57.50 54.49 1kl3 n TRP 79 Cb 0.52 -1.46 -0.16 0.00 -2.42 0.00 0.00 31.31 27.78 1kl3 n TRP 79 CO 0.00 0.00 0.00 0.21 -2.02 0.00 0.00 177.69 175.88 1kl3 s LYS 80 N -0.16 1.35 0.00 -0.99 2.20 -1.26 -0.61 119.74 120.26 1kl3 s LYS 80 Ca 0.61 -0.28 0.00 0.00 -0.36 0.00 0.00 55.97 55.93 1kl3 s LYS 80 Cb 0.33 -1.19 0.00 0.00 -1.51 0.00 0.00 37.83 35.47 1kl3 s LYS 80 CO -0.09 -0.03 0.00 0.27 -0.36 0.00 0.00 175.35 175.15 1kl3 n ASN 81 N 3.95 0.81 -0.15 1.43 0.23 -0.65 -4.80 115.26 116.07 1kl3 n ASN 81 Ca -0.23 -0.18 0.14 0.00 -0.53 0.00 0.00 54.58 53.77 1kl3 n ASN 81 Cb 0.51 0.00 0.53 0.00 -2.08 0.00 0.00 39.78 38.75 1kl3 n ASN 81 CO 0.00 0.00 0.00 0.59 -0.93 0.00 0.00 177.26 176.92 1kl3 n ASN 82 N -0.40 0.64 -0.06 0.53 3.02 -1.26 -3.65 115.26 114.07 1kl3 n ASN 82 Ca 0.00 -0.65 -0.06 0.00 -0.03 0.00 0.00 54.58 53.83 1kl3 n ASN 82 Cb 0.00 -0.01 -0.11 0.00 -0.61 0.00 0.00 39.78 39.05 1kl3 n ASN 82 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 1kl3 n TYR 83 N -0.87 0.00 -3.76 3.10 4.01 -1.26 -5.08 117.16 113.30 1kl3 n TYR 83 Ca 0.13 0.00 -0.09 0.00 -0.16 0.00 0.00 57.90 57.78 1kl3 n TYR 83 Cb 0.30 -0.66 -0.03 0.00 -0.31 0.00 0.00 39.34 38.64 1kl3 n TYR 83 CO 0.00 0.00 0.00 -0.98 -0.46 0.00 0.00 176.86 175.42 1kl3 s ARG 84 N -2.34 1.47 -0.16 -0.72 1.70 -1.24 -5.15 118.95 112.51 1kl3 s ARG 84 Ca -0.07 -0.89 -0.05 0.00 -0.47 0.00 0.00 55.73 54.26 1kl3 s ARG 84 Cb 0.04 0.54 0.08 0.00 -0.57 0.00 0.00 34.95 35.04 1kl3 s ARG 84 CO 0.55 -0.63 0.29 1.21 -1.08 0.00 0.00 175.30 175.64 1kl3 s ASN 85 N -2.88 0.38 -0.09 -2.89 3.84 -1.26 -1.63 114.94 110.40 1kl3 s ASN 85 Ca 0.10 0.52 0.18 0.00 0.21 0.00 0.00 52.86 53.87 1kl3 s ASN 85 Cb -0.02 0.80 0.66 0.00 -0.55 0.00 0.00 41.25 42.15 1kl3 s ASN 85 CO -0.01 -0.26 1.57 0.00 -2.79 0.00 0.00 177.10 175.62 1kl3 n ALA 86 N 5.35 2.89 -4.10 1.71 0.00 0.22 -4.98 120.51 121.60 1kl3 n ALA 86 Ca -0.06 -1.56 -0.34 0.00 0.00 0.00 0.00 53.44 51.47 1kl3 n ALA 86 Cb 0.50 -0.93 -0.03 0.00 0.00 0.00 0.00 19.45 18.99 1kl3 n ALA 86 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 1kl3 n HIS 87 N 1.06 -1.46 -3.77 0.00 8.25 -1.26 -4.87 115.22 113.17 1kl3 n HIS 87 Ca 0.24 0.47 -0.09 0.00 -0.26 0.00 0.00 57.72 58.08 1kl3 n HIS 87 Cb 0.81 -3.08 -0.03 0.00 1.12 0.00 0.00 29.99 28.81 1kl3 n HIS 87 CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 1kl3 s SER 88 N -4.04 -0.30 -0.02 0.41 1.04 -1.26 -1.44 113.70 108.09 1kl3 s SER 88 Ca 0.19 -0.50 -0.07 0.00 0.48 0.00 0.00 55.95 56.05 1kl3 s SER 88 Cb -0.10 0.66 0.01 0.00 0.10 0.00 0.00 66.02 66.69 1kl3 s SER 88 CO 0.95 -1.19 0.14 0.00 0.98 0.00 0.00 173.24 174.12 1kl3 s ALA 89 N -3.89 -0.34 -0.04 5.32 0.00 -0.23 -1.39 121.76 121.19 1kl3 s ALA 89 Ca 0.10 0.03 0.06 0.00 0.00 0.00 0.00 51.96 52.15 1kl3 s ALA 89 Cb -0.03 0.00 -0.01 0.00 0.00 0.00 0.00 23.12 23.08 1kl3 s ALA 89 CO 0.01 -0.17 -0.21 0.99 0.00 0.00 0.00 175.76 176.38 1kl3 s THR 90 N -0.96 1.73 -0.08 0.00 2.01 0.49 -0.51 115.64 118.33 1kl3 s THR 90 Ca -0.10 -0.90 0.01 0.00 0.31 0.00 0.00 61.69 61.01 1kl3 s THR 90 Cb -0.06 -1.46 -0.02 0.00 0.01 0.00 0.00 72.50 70.96 1kl3 s THR 90 CO 0.01 0.49 -0.11 0.42 -0.69 0.00 0.00 174.62 174.74 1kl3 s THR 91 N -0.21 3.30 -0.13 -0.82 -4.23 -0.23 -1.08 115.64 112.24 1kl3 s THR 91 Ca 0.00 -0.61 -0.01 0.00 -1.18 0.00 0.00 61.69 59.89 1kl3 s THR 91 Cb -0.11 -2.34 -0.02 0.00 1.34 0.00 0.00 72.50 71.37 1kl3 s THR 91 CO 0.02 0.57 -0.11 0.26 -0.54 0.00 0.00 174.62 174.82 1kl3 s TRP 92 N -0.41 2.86 -0.11 3.99 0.51 -0.13 -1.38 118.94 124.27 1kl3 s TRP 92 Ca 0.05 -0.51 0.03 0.00 -2.12 0.00 0.00 56.10 53.55 1kl3 s TRP 92 Cb -0.12 -1.85 0.01 0.00 -0.81 0.00 0.00 33.47 30.69 1kl3 s TRP 92 CO 0.02 -0.13 -0.20 0.45 -0.51 0.00 0.00 176.95 176.58 1kl3 s SER 93 N 0.26 2.82 0.00 2.95 0.15 -0.23 -1.74 113.70 117.90 1kl3 s SER 93 Ca -0.08 -0.52 0.00 0.00 0.70 0.00 0.00 55.95 56.06 1kl3 s SER 93 Cb -0.15 -1.29 0.00 0.00 -1.71 0.00 0.00 66.02 62.87 1kl3 s SER 93 CO 0.05 0.09 0.00 0.61 1.20 0.00 0.00 173.24 175.19 1kl3 n GLY 94 N 3.86 1.31 3.22 9.45 0.00 -0.75 -1.27 105.19 121.01 1kl3 n GLY 94 Ca -0.20 -0.38 -0.13 0.00 0.00 0.00 0.00 46.02 45.31 1kl3 n GLY 94 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1kl3 s GLN 95 N 1.72 0.58 -0.11 1.61 -2.07 -0.85 -1.31 119.66 119.23 1kl3 s GLN 95 Ca 0.00 -0.05 -0.15 0.00 -1.82 0.00 0.00 55.36 53.34 1kl3 s GLN 95 Cb 0.00 0.26 -0.05 0.00 -1.09 0.00 0.00 33.01 32.13 1kl3 s GLN 95 CO 0.00 -0.14 0.38 -0.47 -1.32 0.00 0.00 175.29 173.74 1kl3 s TYR 96 N -0.95 3.54 -0.23 9.60 5.04 0.49 -1.62 117.35 133.23 1kl3 s TYR 96 Ca -0.10 0.79 0.02 0.00 -2.44 0.00 0.00 57.07 55.33 1kl3 s TYR 96 Cb -0.05 -2.39 0.04 0.00 0.35 0.00 0.00 41.96 39.91 1kl3 s TYR 96 CO 0.03 0.32 -0.14 0.08 -1.34 0.00 0.00 175.55 174.50 1kl3 s VAL 97 N 0.13 2.22 0.19 3.14 1.01 -0.05 -1.41 120.40 125.63 1kl3 s VAL 97 Ca 0.21 -1.29 -0.01 0.00 0.00 0.00 0.00 61.98 60.90 1kl3 s VAL 97 Cb -0.15 -2.14 0.04 0.00 0.00 0.00 0.00 36.38 34.14 1kl3 s VAL 97 CO 0.08 0.22 0.26 0.61 0.00 0.00 0.00 175.10 176.27 1kl3 n GLY 98 N 4.54 0.40 0.00 4.51 0.00 -1.26 -1.73 105.19 111.64 1kl3 n GLY 98 Ca -0.17 -1.92 0.00 0.00 0.00 0.00 0.00 46.02 43.93 1kl3 n GLY 98 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1kl3 n GLY 99 N 3.09 -1.24 3.62 -0.02 0.00 -1.26 -4.70 105.19 104.68 1kl3 n GLY 99 Ca 0.04 -1.94 -0.43 0.00 0.00 0.00 0.00 46.02 43.69 1kl3 n GLY 99 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1kl3 s ALA 100 N -2.00 3.07 -0.02 4.61 0.00 -1.26 -2.64 121.76 123.52 1kl3 s ALA 100 Ca 0.00 0.60 -0.00 0.00 0.00 0.00 0.00 51.96 52.56 1kl3 s ALA 100 Cb 0.00 -3.95 -0.00 0.00 0.00 0.00 0.00 23.12 19.17 1kl3 s ALA 100 CO 0.00 -2.29 0.02 0.39 0.00 0.00 0.00 175.76 173.88 1kl3 n GLU 101 N 8.12 -0.05 -1.94 0.00 -0.58 -1.26 -4.99 120.64 119.94 1kl3 n GLU 101 Ca 0.23 0.12 -0.40 0.00 -0.42 0.00 0.00 57.16 56.69 1kl3 n GLU 101 Cb 0.45 -1.60 0.00 0.00 -0.57 0.00 0.00 31.44 29.72 1kl3 n GLU 101 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1kl3 s ALA 102 N -3.01 3.31 0.03 0.62 0.00 -1.08 -4.92 121.76 116.71 1kl3 s ALA 102 Ca 0.01 1.36 -0.00 0.00 0.00 0.00 0.00 51.96 53.32 1kl3 s ALA 102 Cb -0.00 -3.54 -0.03 0.00 0.00 0.00 0.00 23.12 19.55 1kl3 s ALA 102 CO 0.02 -0.97 -0.03 -0.98 0.00 0.00 0.00 175.76 173.80 1kl3 s ARG 103 N -2.27 0.43 -0.21 0.00 1.70 -0.71 -4.19 118.95 113.71 1kl3 s ARG 103 Ca 0.57 -0.85 0.02 0.00 -0.47 0.00 0.00 55.73 55.00 1kl3 s ARG 103 Cb -0.41 0.14 0.04 0.00 -0.57 0.00 0.00 34.95 34.14 1kl3 s ARG 103 CO 0.53 -0.07 -0.15 0.42 -1.08 0.00 0.00 175.30 174.95 1kl3 s ILE 104 N -2.40 2.00 -0.22 4.99 1.01 -0.42 -0.87 121.20 125.29 1kl3 s ILE 104 Ca -0.07 -1.14 -0.10 0.00 0.00 0.00 0.00 60.65 59.34 1kl3 s ILE 104 Cb -0.03 -1.94 -0.05 0.00 0.01 0.00 0.00 42.46 40.45 1kl3 s ILE 104 CO -0.04 0.31 0.13 0.20 0.00 0.00 0.00 174.94 175.54 1kl3 s ASN 105 N 1.26 6.01 0.08 3.58 0.02 -0.64 -0.81 114.94 124.44 1kl3 s ASN 105 Ca -0.00 0.12 0.01 0.00 -1.02 0.00 0.00 52.86 51.97 1kl3 s ASN 105 Cb -0.16 -2.07 -0.04 0.00 0.02 0.00 0.00 41.25 39.00 1kl3 s ASN 105 CO -0.10 0.10 -0.06 0.42 0.02 0.00 0.00 177.10 177.48 1kl3 s THR 106 N 0.84 0.56 0.09 1.60 -4.23 -0.04 -2.00 115.64 112.46 1kl3 s THR 106 Ca 0.07 -1.75 0.08 0.00 -1.18 0.00 0.00 61.69 58.91 1kl3 s THR 106 Cb -0.13 -1.44 -0.04 0.00 1.34 0.00 0.00 72.50 72.23 1kl3 s THR 106 CO 0.02 -0.81 -0.18 -1.10 -0.54 0.00 0.00 174.62 172.01 1kl3 s GLN 107 N -3.44 1.87 0.10 3.99 -0.21 -0.40 -2.12 119.66 119.46 1kl3 s GLN 107 Ca 0.07 -1.12 0.04 0.00 0.02 0.00 0.00 55.36 54.37 1kl3 s GLN 107 Cb 0.03 -2.13 -0.04 0.00 1.00 0.00 0.00 33.01 31.87 1kl3 s GLN 107 CO -0.05 0.50 -0.10 1.67 -2.12 0.00 0.00 175.29 175.19 1kl3 s TRP 108 N -1.07 1.07 -0.08 0.91 1.48 -0.42 -1.07 118.94 119.77 1kl3 s TRP 108 Ca 0.17 -0.68 0.01 0.00 -1.06 0.00 0.00 56.10 54.54 1kl3 s TRP 108 Cb -0.11 -0.58 0.02 0.00 -1.16 0.00 0.00 33.47 31.64 1kl3 s TRP 108 CO 0.08 -0.00 -0.07 -0.51 -4.06 0.00 0.00 176.95 172.39 1kl3 s LEU 109 N -2.53 1.27 -0.26 -4.66 1.43 -0.48 -1.99 118.68 111.47 1kl3 s LEU 109 Ca 0.07 -0.23 -0.04 0.00 -1.03 0.00 0.00 54.13 52.89 1kl3 s LEU 109 Cb -0.02 -0.70 0.01 0.00 0.03 0.00 0.00 46.19 45.51 1kl3 s LEU 109 CO -0.00 -0.07 -0.00 -0.22 0.23 0.00 0.00 176.35 176.28 1kl3 s LEU 110 N 1.27 3.33 -0.06 1.79 0.20 -0.39 -1.07 118.68 123.75 1kl3 s LEU 110 Ca -0.04 -0.66 0.05 0.00 0.69 0.00 0.00 54.13 54.17 1kl3 s LEU 110 Cb -0.14 -1.77 -0.02 0.00 -0.43 0.00 0.00 46.19 43.84 1kl3 s LEU 110 CO -0.03 -0.11 -0.19 -0.89 -0.29 0.00 0.00 176.35 174.84 1kl3 s THR 111 N 1.44 2.60 0.11 3.68 2.01 0.33 -1.12 115.64 124.68 1kl3 s THR 111 Ca 0.03 -0.88 0.07 0.00 0.31 0.00 0.00 61.69 61.21 1kl3 s THR 111 Cb -0.16 -1.99 -0.04 0.00 0.01 0.00 0.00 72.50 70.32 1kl3 s THR 111 CO -0.02 0.57 -0.08 -0.44 -0.69 0.00 0.00 174.62 173.97 1kl3 s SER 112 N -0.40 4.50 0.05 3.53 0.01 -0.48 -1.06 113.70 119.85 1kl3 s SER 112 Ca 0.04 -0.36 -0.30 0.00 1.31 0.00 0.00 55.95 56.63 1kl3 s SER 112 Cb -0.12 -0.89 -0.05 0.00 0.21 0.00 0.00 66.02 65.16 1kl3 s SER 112 CO 0.02 0.17 1.14 -0.83 0.41 0.00 0.00 173.24 174.15 1kl3 s GLY 113 N -2.26 2.56 0.19 3.44 0.00 -0.52 -4.86 107.32 105.87 1kl3 s GLY 113 Ca 0.22 0.77 0.01 0.00 0.00 0.00 0.00 44.72 45.72 1kl3 s GLY 113 CO 0.15 1.93 0.05 -0.51 0.00 0.00 0.00 173.10 174.72 1kl3 s THR 114 N 0.96 0.44 0.90 0.90 -4.23 -1.26 -5.01 115.64 108.34 1kl3 s THR 114 Ca 0.56 -1.97 -0.12 0.00 -1.18 0.00 0.00 61.69 58.98 1kl3 s THR 114 Cb -0.27 -2.29 0.13 0.00 1.34 0.00 0.00 72.50 71.41 1kl3 s THR 114 CO 0.29 -0.29 1.10 0.42 -0.54 0.00 0.00 174.62 175.60 1kl3 s THR 115 N -3.83 2.49 0.36 3.99 -4.23 -1.26 -4.87 115.64 108.29 1kl3 s THR 115 Ca 0.29 0.16 0.04 0.00 -1.18 0.00 0.00 61.69 61.01 1kl3 s THR 115 Cb 0.07 -2.76 0.28 0.00 1.34 0.00 0.00 72.50 71.43 1kl3 s THR 115 CO 0.07 -0.21 2.00 -0.33 -0.54 0.00 0.00 174.62 175.61 1kl3 h GLU 116 N -1.52 0.75 0.00 3.99 5.08 -2.01 -0.89 114.58 119.99 1kl3 h GLU 116 Ca -0.50 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 57.81 1kl3 h GLU 116 Cb 1.30 -0.17 0.00 0.00 0.50 0.00 0.00 28.75 30.38 1kl3 h GLU 116 CO 0.58 0.50 0.00 0.00 -1.00 0.00 0.00 179.01 179.09 1kl3 n ALA 117 N -2.45 1.50 -0.15 3.43 0.00 -1.26 -2.24 120.51 119.35 1kl3 n ALA 117 Ca 0.08 0.11 0.03 0.00 0.00 0.00 0.00 53.44 53.66 1kl3 n ALA 117 Cb 0.12 -1.37 0.06 0.00 0.00 0.00 0.00 19.45 18.26 1kl3 n ALA 117 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1kl3 n ASN 118 N -2.25 2.37 -0.08 0.00 3.02 -0.37 -4.68 115.26 113.28 1kl3 n ASN 118 Ca 0.01 -2.10 -0.09 0.00 -0.03 0.00 0.00 54.58 52.37 1kl3 n ASN 118 Cb 0.18 -0.11 -0.02 0.00 -0.61 0.00 0.00 39.78 39.21 1kl3 n ASN 118 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1kl3 h ALA 119 N 0.69 0.35 0.00 5.41 0.00 -1.08 -2.57 119.26 122.07 1kl3 h ALA 119 Ca 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1kl3 h ALA 119 Cb 0.63 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.31 1kl3 h ALA 119 CO 0.01 -0.15 0.37 -1.49 0.00 0.00 0.00 179.25 177.98 1kl3 h TRP 120 N 0.36 0.00 -0.53 0.00 6.55 -1.83 1.25 115.95 121.75 1kl3 h TRP 120 Ca 0.10 0.00 -0.31 0.00 0.95 0.00 0.00 58.89 59.63 1kl3 h TRP 120 Cb -0.00 0.00 -0.19 0.00 -0.86 0.00 0.00 29.16 28.11 1kl3 h TRP 120 CO -0.05 0.00 -0.01 0.36 -1.05 0.00 0.00 178.44 177.70 1kl3 n LYS 121 N -2.40 2.17 0.16 0.49 2.85 -0.97 -4.79 118.16 115.67 1kl3 n LYS 121 Ca -0.01 -3.31 0.11 0.00 -1.05 0.00 0.00 58.31 54.05 1kl3 n LYS 121 Cb 0.40 -1.96 0.07 0.00 -0.65 0.00 0.00 35.03 32.89 1kl3 n LYS 121 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 177.40 178.01 1kl3 h SER 122 N 1.24 0.00 -3.22 -5.58 4.64 0.15 -3.46 113.55 107.32 1kl3 h SER 122 Ca 0.32 0.00 -0.56 0.00 -0.47 0.00 0.00 61.79 61.09 1kl3 h SER 122 Cb 1.70 0.00 -0.37 0.00 -0.31 0.00 0.00 62.40 63.42 1kl3 h SER 122 CO 0.63 0.03 -0.81 -0.89 -0.87 0.00 0.00 176.83 174.92 1kl3 s THR 123 N -3.27 1.23 0.24 2.95 2.01 -1.26 -1.39 115.64 116.16 1kl3 s THR 123 Ca 0.03 -0.51 -0.11 0.00 0.31 0.00 0.00 61.69 61.42 1kl3 s THR 123 Cb 0.07 -1.26 -0.07 0.00 0.01 0.00 0.00 72.50 71.25 1kl3 s THR 123 CO 0.74 0.32 0.58 -0.76 -0.69 0.00 0.00 174.62 174.81 1kl3 s LEU 124 N 1.61 4.16 0.07 4.42 1.43 -0.28 -4.91 118.68 125.17 1kl3 s LEU 124 Ca 0.04 0.98 0.06 0.00 -1.03 0.00 0.00 54.13 54.17 1kl3 s LEU 124 Cb -0.13 -3.74 -0.03 0.00 0.03 0.00 0.00 46.19 42.32 1kl3 s LEU 124 CO -0.09 -0.09 -0.15 0.54 0.23 0.00 0.00 176.35 176.79 1kl3 s VAL 125 N -1.83 1.21 0.00 -1.59 0.11 -1.26 -1.26 120.40 115.77 1kl3 s VAL 125 Ca 0.48 -1.27 0.00 0.00 -2.93 0.00 0.00 61.98 58.26 1kl3 s VAL 125 Cb -0.11 -1.14 0.00 0.00 -1.53 0.00 0.00 36.38 33.60 1kl3 s VAL 125 CO 0.20 -0.14 0.00 0.61 -3.33 0.00 0.00 175.10 172.44 1kl3 n GLY 126 N 1.39 1.42 2.97 6.54 0.00 -0.84 -5.00 105.19 111.66 1kl3 n GLY 126 Ca -0.20 -0.89 -0.10 0.00 0.00 0.00 0.00 46.02 44.83 1kl3 n GLY 126 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 1kl3 s HIS 127 N -5.55 0.21 0.03 1.61 -3.43 -1.26 -1.30 115.29 105.59 1kl3 s HIS 127 Ca 0.00 -0.42 0.02 0.00 -0.80 0.00 0.00 55.06 53.86 1kl3 s HIS 127 Cb 0.00 -0.15 -0.02 0.00 -1.43 0.00 0.00 32.58 30.98 1kl3 s HIS 127 CO 0.00 -0.17 -0.06 -0.51 -2.00 0.00 0.00 174.74 172.00 1kl3 s ASP 128 N -1.22 0.71 -0.10 7.38 1.01 -0.90 -4.96 116.67 118.59 1kl3 s ASP 128 Ca -0.13 -0.40 0.04 0.00 0.71 0.00 0.00 52.55 52.76 1kl3 s ASP 128 Cb -0.08 0.01 -0.00 0.00 1.01 0.00 0.00 42.92 43.86 1kl3 s ASP 128 CO -0.01 -0.13 -0.23 -0.89 0.21 0.00 0.00 175.17 174.12 1kl3 s THR 129 N -0.99 2.12 -0.09 -1.27 2.01 -1.26 -0.86 115.64 115.30 1kl3 s THR 129 Ca -0.07 -1.00 -0.01 0.00 0.31 0.00 0.00 61.69 60.92 1kl3 s THR 129 Cb -0.07 -1.81 -0.03 0.00 0.01 0.00 0.00 72.50 70.60 1kl3 s THR 129 CO 0.00 0.56 -0.04 -0.36 -0.69 0.00 0.00 174.62 174.09 1kl3 s PHE 130 N 0.31 3.01 0.28 4.92 0.40 0.01 -3.58 117.98 123.32 1kl3 s PHE 130 Ca -0.18 -0.02 0.04 0.00 -0.60 0.00 0.00 56.93 56.18 1kl3 s PHE 130 Cb -0.18 -1.79 -0.06 0.00 0.51 0.00 0.00 43.02 41.51 1kl3 s PHE 130 CO 0.09 0.27 0.02 0.95 0.70 0.00 0.00 175.22 177.25 1kl3 s THR 131 N -0.54 1.15 -1.25 0.64 -4.23 -0.41 -1.30 115.64 109.69 1kl3 s THR 131 Ca 0.08 -2.03 0.29 0.00 -1.18 0.00 0.00 61.69 58.85 1kl3 s THR 131 Cb -0.12 -2.57 0.33 0.00 1.34 0.00 0.00 72.50 71.49 1kl3 s THR 131 CO 0.02 -0.16 1.89 0.29 -0.54 0.00 0.00 174.62 176.11 1kl3 n LYS 132 N -0.55 0.26 -4.16 3.99 5.02 -1.26 -1.36 118.16 120.10 1kl3 n LYS 132 Ca -0.04 -0.05 -0.34 0.00 -2.02 0.00 0.00 58.31 55.86 1kl3 n LYS 132 Cb 0.65 -1.50 -0.10 0.00 -0.02 0.00 0.00 35.03 34.06 1kl3 n LYS 132 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1kl3 s VAL 133 N -2.77 4.51 -2.00 -0.18 1.01 -1.26 -4.86 120.40 114.84 1kl3 s VAL 133 Ca 0.21 -0.14 0.18 0.00 0.00 0.00 0.00 61.98 62.23 1kl3 s VAL 133 Cb 0.19 -3.00 0.51 0.00 0.00 0.00 0.00 36.38 34.09 1kl3 s VAL 133 CO 0.52 0.50 1.47 1.17 0.00 0.00 0.00 175.10 178.76