#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1kl4 h ILE 17 N 0.00 1.47 -2.86 -0.61 2.04 -1.97 -3.46 117.51 112.11 1kl4 h ILE 17 Ca 0.00 -2.46 -0.52 0.00 1.00 0.00 0.00 64.86 62.87 1kl4 h ILE 17 Cb 0.00 2.35 0.06 0.00 -0.74 0.00 0.00 36.82 38.50 1kl4 h ILE 17 CO 0.00 0.72 0.96 -0.89 0.00 0.00 0.00 178.15 178.94 1kl4 s THR 18 N -3.34 2.11 -5.00 -0.27 2.01 -1.26 -4.79 115.64 105.10 1kl4 s THR 18 Ca -0.03 0.08 0.00 0.00 0.31 0.00 0.00 61.69 62.05 1kl4 s THR 18 Cb 0.11 -3.05 0.00 0.00 0.01 0.00 0.00 72.50 69.56 1kl4 s THR 18 CO 0.82 0.01 0.00 0.61 -0.69 0.00 0.00 174.62 175.37 1kl4 n GLY 19 N 3.47 0.92 3.61 4.40 0.00 -0.10 -5.00 105.19 112.49 1kl4 n GLY 19 Ca 0.14 -1.81 -0.34 0.00 0.00 0.00 0.00 46.02 44.00 1kl4 n GLY 19 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1kl4 s THR 20 N -3.23 4.26 0.01 2.61 2.01 -1.26 -1.34 115.64 118.70 1kl4 s THR 20 Ca 0.00 -0.25 0.04 0.00 0.31 0.00 0.00 61.69 61.80 1kl4 s THR 20 Cb 0.00 -2.84 -0.01 0.00 0.01 0.00 0.00 72.50 69.66 1kl4 s THR 20 CO 0.00 0.54 -0.13 0.26 -0.69 0.00 0.00 174.62 174.60 1kl4 s TRP 21 N -0.26 1.16 -0.01 4.92 0.52 -0.35 -4.56 118.94 120.38 1kl4 s TRP 21 Ca 0.06 -0.27 0.07 0.00 0.02 0.00 0.00 56.10 55.97 1kl4 s TRP 21 Cb -0.12 -0.72 -0.02 0.00 -1.15 0.00 0.00 33.47 31.45 1kl4 s TRP 21 CO 0.02 0.00 -0.22 0.71 0.02 0.00 0.00 176.95 177.48 1kl4 s TYR 22 N -0.54 1.99 0.22 -1.98 1.51 -0.22 -0.83 117.35 117.50 1kl4 s TYR 22 Ca 0.03 -0.38 0.03 0.00 -1.01 0.00 0.00 57.07 55.75 1kl4 s TYR 22 Cb -0.06 -1.26 0.03 0.00 -0.11 0.00 0.00 41.96 40.56 1kl4 s TYR 22 CO 0.00 -0.01 0.25 0.27 -1.11 0.00 0.00 175.55 174.95 1kl4 n ASN 23 N 2.40 1.11 0.23 2.29 6.94 -0.77 -1.54 115.26 125.92 1kl4 n ASN 23 Ca -0.16 -1.63 0.12 0.00 -0.02 0.00 0.00 54.58 52.89 1kl4 n ASN 23 Cb 0.52 -0.11 0.42 0.00 -2.36 0.00 0.00 39.78 38.25 1kl4 n ASN 23 CO 0.00 0.00 0.00 1.56 -1.03 0.00 0.00 177.26 177.79 1kl4 h GLN 24 N 0.00 0.00 -0.61 -3.83 4.20 -1.90 -3.29 115.11 109.67 1kl4 h GLN 24 Ca -0.11 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.60 1kl4 h GLN 24 Cb 0.48 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.26 1kl4 h GLN 24 CO 0.17 0.15 0.00 1.28 -0.67 0.00 0.00 178.83 179.76 1kl4 n LEU 25 N -3.23 4.10 0.00 1.46 4.77 -1.26 -4.96 117.00 117.88 1kl4 n LEU 25 Ca 0.01 -2.22 0.00 0.00 -0.03 0.00 0.00 56.01 53.77 1kl4 n LEU 25 Cb 0.45 -0.48 0.00 0.00 -2.33 0.00 0.00 43.42 41.06 1kl4 n LEU 25 CO 0.33 0.86 0.00 0.61 -1.33 0.00 0.00 177.39 177.86 1kl4 n GLY 26 N 1.15 0.43 3.88 -0.72 0.00 -1.24 -4.78 105.19 103.91 1kl4 n GLY 26 Ca 0.23 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.95 1kl4 n GLY 26 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1kl4 s SER 27 N -2.10 6.40 0.00 1.61 0.01 -1.26 -4.17 113.70 114.20 1kl4 s SER 27 Ca 0.00 1.19 0.03 0.00 1.31 0.00 0.00 55.95 58.48 1kl4 s SER 27 Cb 0.00 -2.35 -0.01 0.00 0.21 0.00 0.00 66.02 63.86 1kl4 s SER 27 CO 0.00 -0.57 -0.10 -0.89 0.41 0.00 0.00 173.24 172.09 1kl4 s THR 28 N -2.67 0.75 -0.02 1.44 2.01 -0.68 -1.84 115.64 114.63 1kl4 s THR 28 Ca 0.52 -0.54 0.01 0.00 0.31 0.00 0.00 61.69 61.99 1kl4 s THR 28 Cb -0.10 -0.66 0.01 0.00 0.01 0.00 0.00 72.50 71.76 1kl4 s THR 28 CO 0.40 0.12 -0.02 0.72 -0.69 0.00 0.00 174.62 175.15 1kl4 s PHE 29 N -0.41 0.33 -0.13 4.92 -0.12 -0.01 -0.02 117.98 122.55 1kl4 s PHE 29 Ca 0.02 -0.04 -0.03 0.00 -0.05 0.00 0.00 56.93 56.82 1kl4 s PHE 29 Cb -0.05 -0.31 -0.03 0.00 -0.63 0.00 0.00 43.02 42.00 1kl4 s PHE 29 CO -0.00 -0.07 -0.01 0.42 -0.05 0.00 0.00 175.22 175.52 1kl4 s ILE 30 N 0.44 4.20 0.02 -4.49 1.01 0.39 -1.21 121.20 121.56 1kl4 s ILE 30 Ca -0.04 -0.26 0.00 0.00 0.00 0.00 0.00 60.65 60.35 1kl4 s ILE 30 Cb -0.07 -2.82 -0.02 0.00 0.01 0.00 0.00 42.46 39.56 1kl4 s ILE 30 CO -0.01 0.54 -0.04 0.54 0.00 0.00 0.00 174.94 175.97 1kl4 s VAL 31 N -0.17 0.19 -0.11 2.92 0.11 -0.45 -1.15 120.40 121.75 1kl4 s VAL 31 Ca 0.04 -0.80 0.03 0.00 -2.93 0.00 0.00 61.98 58.33 1kl4 s VAL 31 Cb -0.13 -0.30 -0.00 0.00 -1.53 0.00 0.00 36.38 34.43 1kl4 s VAL 31 CO 0.02 -0.39 -0.22 -0.89 -3.33 0.00 0.00 175.10 170.29 1kl4 s THR 32 N -1.20 2.18 -0.45 5.04 2.01 0.55 -0.93 115.64 122.85 1kl4 s THR 32 Ca -0.12 -0.97 -0.16 0.00 0.31 0.00 0.00 61.69 60.75 1kl4 s THR 32 Cb -0.08 -1.85 0.05 0.00 0.01 0.00 0.00 72.50 70.63 1kl4 s THR 32 CO -0.01 0.55 0.40 0.00 -0.69 0.00 0.00 174.62 174.87 1kl4 s ALA 33 N 0.41 3.50 0.56 7.40 0.00 -1.26 -1.96 121.76 130.40 1kl4 s ALA 33 Ca -0.16 -1.87 -0.11 0.00 0.00 0.00 0.00 51.96 49.81 1kl4 s ALA 33 Cb -0.17 -3.04 -0.05 0.00 0.00 0.00 0.00 23.12 19.85 1kl4 s ALA 33 CO 0.07 -1.66 0.97 0.20 0.00 0.00 0.00 175.76 175.34 1kl4 s GLY 34 N 2.21 1.75 0.54 0.00 0.00 0.29 -4.89 107.32 107.23 1kl4 s GLY 34 Ca 0.07 -0.09 0.36 0.00 0.00 0.00 0.00 44.72 45.05 1kl4 s GLY 34 CO 0.09 0.16 2.10 0.00 0.00 0.00 0.00 173.10 175.45 1kl4 h ALA 35 N 0.15 1.00 -0.39 3.20 0.00 -1.98 -2.43 119.26 118.82 1kl4 h ALA 35 Ca -0.45 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.46 1kl4 h ALA 35 Cb 1.19 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.98 1kl4 h ALA 35 CO 0.62 0.00 0.00 -0.40 0.00 0.00 0.00 179.25 179.47 1kl4 n ASP 36 N -2.85 2.08 0.00 0.00 5.75 -1.26 -4.91 116.55 115.35 1kl4 n ASP 36 Ca -0.01 -1.99 0.00 0.00 -0.01 0.00 0.00 54.79 52.77 1kl4 n ASP 36 Cb 0.13 -0.26 0.00 0.00 -1.03 0.00 0.00 41.12 39.96 1kl4 n ASP 36 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1kl4 n GLY 37 N 1.12 0.69 3.75 6.12 0.00 -0.91 -5.02 105.19 110.94 1kl4 n GLY 37 Ca 0.13 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.75 1kl4 n GLY 37 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1kl4 s ALA 38 N -2.43 3.34 -0.13 4.61 0.00 -1.25 -1.38 121.76 124.52 1kl4 s ALA 38 Ca 0.00 0.67 0.00 0.00 0.00 0.00 0.00 51.96 52.64 1kl4 s ALA 38 Cb 0.00 -3.23 -0.01 0.00 0.00 0.00 0.00 23.12 19.87 1kl4 s ALA 38 CO 0.00 0.12 -0.14 -0.51 0.00 0.00 0.00 175.76 175.23 1kl4 s LEU 39 N -1.32 2.63 0.01 0.00 1.43 -0.25 -0.55 118.68 120.64 1kl4 s LEU 39 Ca 0.43 -0.36 0.00 0.00 -1.03 0.00 0.00 54.13 53.17 1kl4 s LEU 39 Cb -0.27 -1.58 -0.01 0.00 0.03 0.00 0.00 46.19 44.36 1kl4 s LEU 39 CO 0.33 0.16 -0.02 0.42 0.23 0.00 0.00 176.35 177.47 1kl4 s THR 40 N 0.36 0.09 -2.42 5.49 -4.23 -0.83 -1.15 115.64 112.95 1kl4 s THR 40 Ca -0.12 -0.50 0.00 0.00 -1.18 0.00 0.00 61.69 59.89 1kl4 s THR 40 Cb -0.16 -0.17 0.00 0.00 1.34 0.00 0.00 72.50 73.51 1kl4 s THR 40 CO 0.06 -0.26 0.00 0.61 -0.54 0.00 0.00 174.62 174.49 1kl4 n GLY 41 N 2.28 -0.61 2.96 3.99 0.00 -0.96 -0.33 105.19 112.51 1kl4 n GLY 41 Ca -0.18 -0.62 -0.13 0.00 0.00 0.00 0.00 46.02 45.09 1kl4 n GLY 41 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1kl4 s THR 42 N -3.66 0.27 -0.15 2.61 -4.23 -0.30 -1.75 115.64 108.44 1kl4 s THR 42 Ca 0.00 -0.51 -0.03 0.00 -1.18 0.00 0.00 61.69 59.97 1kl4 s THR 42 Cb 0.00 -0.30 -0.02 0.00 1.34 0.00 0.00 72.50 73.51 1kl4 s THR 42 CO 0.00 -0.16 -0.06 -0.47 -0.54 0.00 0.00 174.62 173.39 1kl4 s TYR 43 N -0.67 2.97 -0.18 3.99 6.14 0.01 -0.46 117.35 129.15 1kl4 s TYR 43 Ca -0.05 -0.38 0.01 0.00 0.64 0.00 0.00 57.07 57.28 1kl4 s TYR 43 Cb -0.05 -1.93 0.02 0.00 0.42 0.00 0.00 41.96 40.42 1kl4 s TYR 43 CO -0.00 -0.08 -0.19 0.42 0.64 0.00 0.00 175.55 176.33 1kl4 s ILE 44 N 0.37 2.08 0.80 3.14 1.09 0.97 -0.73 121.20 128.92 1kl4 s ILE 44 Ca -0.06 -0.97 -0.10 0.00 -1.10 0.00 0.00 60.65 58.42 1kl4 s ILE 44 Cb -0.15 -1.89 0.07 0.00 -1.06 0.00 0.00 42.46 39.43 1kl4 s ILE 44 CO 0.04 0.51 1.10 -0.83 -0.10 0.00 0.00 174.94 175.65 1kl4 s GLY 45 N 1.28 1.68 0.34 6.18 0.00 -0.63 -1.69 107.32 114.48 1kl4 s GLY 45 Ca 0.04 0.32 0.21 0.00 0.00 0.00 0.00 44.72 45.29 1kl4 s GLY 45 CO -0.12 0.68 1.38 0.00 0.00 0.00 0.00 173.10 175.03 1kl4 n ALA 46 N -3.64 0.98 0.31 3.20 0.00 -1.26 -0.57 120.51 119.53 1kl4 n ALA 46 Ca 0.09 0.85 0.18 0.00 0.00 0.00 0.00 53.44 54.57 1kl4 n ALA 46 Cb 0.53 -0.90 1.00 0.00 0.00 0.00 0.00 19.45 20.08 1kl4 n ALA 46 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.50 177.41 1kl4 h ARG 47 N 0.00 0.00 0.00 0.00 2.43 -1.90 -3.46 114.38 111.45 1kl4 h ARG 47 Ca 0.75 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.92 1kl4 h ARG 47 Cb 2.11 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 31.66 1kl4 h ARG 47 CO -0.60 0.02 0.00 0.41 -1.51 0.00 0.00 179.97 178.29 1kl4 n GLY 48 N -1.05 0.25 3.77 2.80 0.00 0.27 -4.98 105.19 106.25 1kl4 n GLY 48 Ca -0.03 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.65 1kl4 n GLY 48 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1kl4 s ASN 49 N -2.18 5.51 0.50 1.61 2.47 -1.26 -4.94 114.94 116.64 1kl4 s ASN 49 Ca 0.00 2.11 0.17 0.00 0.42 0.00 0.00 52.86 55.56 1kl4 s ASN 49 Cb 0.00 -2.57 1.22 0.00 -1.45 0.00 0.00 41.25 38.45 1kl4 s ASN 49 CO 0.00 -1.36 2.10 0.00 -3.72 0.00 0.00 177.10 174.11 1kl4 h ALA 50 N 0.78 1.83 0.00 1.71 0.00 -1.98 -0.58 119.26 121.02 1kl4 h ALA 50 Ca -0.49 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.36 1kl4 h ALA 50 Cb 1.26 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.03 1kl4 h ALA 50 CO 0.56 0.09 0.00 0.39 0.00 0.00 0.00 179.25 180.29 1kl4 n GLU 51 N -4.38 0.08 -0.50 0.00 1.02 -1.26 -2.62 120.64 112.99 1kl4 n GLU 51 Ca -0.03 0.26 0.10 0.00 -0.02 0.00 0.00 57.16 57.48 1kl4 n GLU 51 Cb 0.15 -1.64 0.33 0.00 -0.02 0.00 0.00 31.44 30.26 1kl4 n GLU 51 CO 0.00 0.00 0.00 0.43 1.18 0.00 0.00 177.13 178.74 1kl4 n SER 52 N -1.79 4.34 -4.65 1.62 7.64 -0.23 -4.82 113.62 115.74 1kl4 n SER 52 Ca 0.04 -2.28 -0.35 0.00 1.01 0.00 0.00 58.87 57.29 1kl4 n SER 52 Cb 0.23 -0.52 -0.10 0.00 -1.01 0.00 0.00 64.21 62.82 1kl4 n SER 52 CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 1kl4 s ARG 53 N -1.52 3.85 0.08 1.43 0.52 -1.08 -1.60 118.95 120.63 1kl4 s ARG 53 Ca 0.48 -0.34 0.03 0.00 -0.52 0.00 0.00 55.73 55.38 1kl4 s ARG 53 Cb 0.29 -3.16 -0.03 0.00 0.52 0.00 0.00 34.95 32.56 1kl4 s ARG 53 CO 0.27 0.34 -0.09 0.71 0.02 0.00 0.00 175.30 176.55 1kl4 s TYR 54 N 0.16 0.92 0.20 -0.53 1.51 0.09 -4.81 117.35 114.89 1kl4 s TYR 54 Ca 0.04 -0.67 -0.29 0.00 -1.01 0.00 0.00 57.07 55.14 1kl4 s TYR 54 Cb -0.12 -0.52 -0.08 0.00 -0.11 0.00 0.00 41.96 41.13 1kl4 s TYR 54 CO 0.01 -0.06 0.91 0.08 -1.11 0.00 0.00 175.55 175.38 1kl4 s VAL 55 N -2.40 4.22 0.03 0.71 1.01 -1.26 -0.81 120.40 121.89 1kl4 s VAL 55 Ca 0.03 2.01 0.09 0.00 0.00 0.00 0.00 61.98 64.10 1kl4 s VAL 55 Cb -0.03 -4.29 -0.03 0.00 0.00 0.00 0.00 36.38 32.03 1kl4 s VAL 55 CO -0.01 0.47 -0.26 -1.48 0.00 0.00 0.00 175.10 173.82 1kl4 s LEU 56 N -0.93 2.13 -0.04 3.92 0.05 -0.71 -4.13 118.68 118.97 1kl4 s LEU 56 Ca 0.41 -0.55 -0.06 0.00 0.05 0.00 0.00 54.13 53.98 1kl4 s LEU 56 Cb -0.25 -1.26 0.01 0.00 -2.05 0.00 0.00 46.19 42.64 1kl4 s LEU 56 CO 0.30 0.27 0.15 0.28 -0.55 0.00 0.00 176.35 176.80 1kl4 s THR 57 N -0.74 0.03 0.00 5.48 -1.32 -0.97 -2.27 115.64 115.84 1kl4 s THR 57 Ca 0.11 -0.28 0.00 0.00 -1.21 0.00 0.00 61.69 60.31 1kl4 s THR 57 Cb -0.10 -0.31 0.00 0.00 -1.51 0.00 0.00 72.50 70.58 1kl4 s THR 57 CO 0.01 -0.15 0.00 0.61 -2.21 0.00 0.00 174.62 172.88 1kl4 n GLY 58 N 2.38 2.24 3.05 6.08 0.00 -0.30 -0.77 105.19 117.87 1kl4 n GLY 58 Ca -0.17 -0.85 -0.10 0.00 0.00 0.00 0.00 46.02 44.91 1kl4 n GLY 58 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1kl4 s ARG 59 N -0.41 0.42 0.06 1.61 1.81 -0.43 -1.09 118.95 120.93 1kl4 s ARG 59 Ca 0.00 -0.58 -0.06 0.00 -1.72 0.00 0.00 55.73 53.37 1kl4 s ARG 59 Cb 0.00 0.16 -0.01 0.00 -0.45 0.00 0.00 34.95 34.65 1kl4 s ARG 59 CO 0.00 -0.09 0.11 1.52 -0.68 0.00 0.00 175.30 176.16 1kl4 s TYR 60 N -1.68 0.25 -0.62 -0.53 1.13 -0.48 -1.61 117.35 113.81 1kl4 s TYR 60 Ca -0.13 -0.66 -0.27 0.00 -1.41 0.00 0.00 57.07 54.60 1kl4 s TYR 60 Cb -0.07 -0.16 0.01 0.00 -1.10 0.00 0.00 41.96 40.64 1kl4 s TYR 60 CO -0.01 -0.45 1.49 0.34 -2.51 0.00 0.00 175.55 174.41 1kl4 s ASP 61 N -2.63 5.94 0.00 -0.18 2.15 -0.45 -4.62 116.67 116.88 1kl4 s ASP 61 Ca 0.02 0.11 0.20 0.00 0.43 0.00 0.00 52.55 53.31 1kl4 s ASP 61 Cb 0.04 -2.55 1.00 0.00 -0.30 0.00 0.00 42.92 41.11 1kl4 s ASP 61 CO -0.09 -1.90 1.63 -1.54 -0.17 0.00 0.00 175.17 173.10 1kl4 n SER 62 N 10.26 0.00 -3.19 -0.34 3.41 -1.26 -3.68 113.62 118.81 1kl4 n SER 62 Ca 0.12 0.02 -0.23 0.00 -0.26 0.00 0.00 58.87 58.52 1kl4 n SER 62 Cb 0.50 -0.29 -0.06 0.00 -0.26 0.00 0.00 64.21 64.10 1kl4 n SER 62 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1kl4 n ALA 63 N -1.29 2.38 -1.19 7.33 0.00 -1.26 -5.03 120.51 121.45 1kl4 n ALA 63 Ca 0.09 -3.45 -0.30 0.00 0.00 0.00 0.00 53.44 49.78 1kl4 n ALA 63 Cb 0.16 -0.84 0.12 0.00 0.00 0.00 0.00 19.45 18.89 1kl4 n ALA 63 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1kl4 s PRO 64 N -1.57 1.69 0.54 0.00 0.04 -1.24 -4.99 135.00 129.46 1kl4 s PRO 64 Ca 0.37 1.03 -0.21 0.00 0.04 0.00 0.00 61.00 62.22 1kl4 s PRO 64 Cb 0.22 -1.84 -0.05 0.00 0.04 0.00 0.00 34.50 32.87 1kl4 s PRO 64 CO -0.10 -2.00 1.29 0.00 0.04 0.00 0.00 177.00 176.22 1kl4 s ALA 65 N -2.89 2.79 -0.48 8.56 0.00 -1.26 -4.94 121.76 123.53 1kl4 s ALA 65 Ca 0.63 1.18 0.03 0.00 0.00 0.00 0.00 51.96 53.80 1kl4 s ALA 65 Cb -0.18 -3.51 0.49 0.00 0.00 0.00 0.00 23.12 19.92 1kl4 s ALA 65 CO 0.57 -1.18 1.71 0.25 0.00 0.00 0.00 175.76 177.10 1kl4 n THR 66 N -1.03 3.13 -1.14 0.00 -2.24 -1.26 -4.60 114.28 107.14 1kl4 n THR 66 Ca 0.10 -3.14 0.05 0.00 -2.27 0.00 0.00 64.05 58.79 1kl4 n THR 66 Cb 0.47 -0.95 0.23 0.00 -2.10 0.00 0.00 70.33 67.98 1kl4 n THR 66 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 1kl4 n ASP 67 N -0.92 3.29 0.00 3.42 5.75 -1.26 -4.92 116.55 121.91 1kl4 n ASP 67 Ca 0.53 -3.25 0.00 0.00 -0.01 0.00 0.00 54.79 52.06 1kl4 n ASP 67 Cb 0.92 -0.56 0.00 0.00 -1.03 0.00 0.00 41.12 40.45 1kl4 n ASP 67 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1kl4 n GLY 68 N -0.80 0.98 3.78 6.12 0.00 -1.26 -5.06 105.19 108.94 1kl4 n GLY 68 Ca 0.24 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.92 1kl4 n GLY 68 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1kl4 s SER 69 N -2.80 5.67 0.95 1.61 0.01 -1.26 -5.04 113.70 112.84 1kl4 s SER 69 Ca 0.00 2.10 -0.14 0.00 1.31 0.00 0.00 55.95 59.22 1kl4 s SER 69 Cb 0.00 -2.57 0.17 0.00 0.21 0.00 0.00 66.02 63.83 1kl4 s SER 69 CO 0.00 -1.25 1.18 -0.83 0.41 0.00 0.00 173.24 172.75 1kl4 s GLY 70 N -2.00 1.63 -0.34 3.44 0.00 -1.26 -4.83 107.32 103.96 1kl4 s GLY 70 Ca 0.71 -0.77 -0.12 0.00 0.00 0.00 0.00 44.72 44.53 1kl4 s GLY 70 CO 0.29 -0.12 0.23 -1.59 0.00 0.00 0.00 173.10 171.91 1kl4 s THR 71 N -3.43 5.17 0.36 0.90 2.01 -0.75 -4.76 115.64 115.14 1kl4 s THR 71 Ca 0.67 -0.26 -0.27 0.00 0.31 0.00 0.00 61.69 62.14 1kl4 s THR 71 Cb -0.11 -3.66 -0.09 0.00 0.01 0.00 0.00 72.50 68.65 1kl4 s THR 71 CO 0.53 -0.01 1.18 0.00 -0.69 0.00 0.00 174.62 175.63 1kl4 s ALA 72 N 1.70 3.27 0.15 7.40 0.00 -1.26 -0.16 121.76 132.85 1kl4 s ALA 72 Ca 0.06 1.00 -0.24 0.00 0.00 0.00 0.00 51.96 52.78 1kl4 s ALA 72 Cb -0.17 -3.38 0.07 0.00 0.00 0.00 0.00 23.12 19.63 1kl4 s ALA 72 CO 0.10 -0.46 0.68 -0.48 0.00 0.00 0.00 175.76 175.59 1kl4 s LEU 73 N -2.16 -0.49 0.09 0.00 0.05 -0.62 -1.34 118.68 114.22 1kl4 s LEU 73 Ca 0.53 -0.09 -0.22 0.00 0.05 0.00 0.00 54.13 54.41 1kl4 s LEU 73 Cb -0.32 2.50 0.05 0.00 -2.05 0.00 0.00 46.19 46.37 1kl4 s LEU 73 CO 0.41 -0.95 0.53 -0.83 -0.55 0.00 0.00 176.35 174.96 1kl4 s GLY 74 N -2.73 -0.46 0.11 -3.48 0.00 -0.63 -1.58 107.32 98.55 1kl4 s GLY 74 Ca 0.03 0.48 -0.13 0.00 0.00 0.00 0.00 44.72 45.10 1kl4 s GLY 74 CO -0.09 0.18 0.30 0.66 0.00 0.00 0.00 173.10 174.15 1kl4 s TRP 75 N -2.99 -0.04 -0.02 1.90 -2.14 -0.51 -1.32 118.94 113.82 1kl4 s TRP 75 Ca -0.02 -0.33 0.06 0.00 2.66 0.00 0.00 56.10 58.47 1kl4 s TRP 75 Cb -0.00 0.11 -0.02 0.00 -3.10 0.00 0.00 33.47 30.47 1kl4 s TRP 75 CO -0.06 -0.63 -0.20 0.99 -2.66 0.00 0.00 176.95 174.39 1kl4 s THR 76 N -3.83 1.57 -0.09 0.66 2.01 0.05 -0.88 115.64 115.13 1kl4 s THR 76 Ca 0.04 -0.85 0.04 0.00 0.31 0.00 0.00 61.69 61.23 1kl4 s THR 76 Cb 0.03 -1.31 -0.00 0.00 0.01 0.00 0.00 72.50 71.23 1kl4 s THR 76 CO -0.11 0.44 -0.24 -0.69 -0.69 0.00 0.00 174.62 173.33 1kl4 s VAL 77 N -0.46 2.03 -0.14 3.82 1.01 -0.52 -2.30 120.40 123.84 1kl4 s VAL 77 Ca 0.07 -1.01 -0.07 0.00 0.00 0.00 0.00 61.98 60.98 1kl4 s VAL 77 Cb -0.08 -1.75 -0.04 0.00 0.00 0.00 0.00 36.38 34.51 1kl4 s VAL 77 CO -0.01 0.55 0.11 0.00 0.00 0.00 0.00 175.10 175.76 1kl4 s ALA 78 N 0.27 3.71 -0.75 5.51 0.00 -1.26 -1.68 121.76 127.57 1kl4 s ALA 78 Ca -0.16 -0.68 -0.06 0.00 0.00 0.00 0.00 51.96 51.05 1kl4 s ALA 78 Cb -0.17 -1.94 -0.07 0.00 0.00 0.00 0.00 23.12 20.93 1kl4 s ALA 78 CO 0.08 0.47 3.03 0.91 0.00 0.00 0.00 175.76 180.25 1kl4 n TRP 79 N 2.48 1.45 -4.52 0.00 7.02 -0.05 -4.72 117.44 119.10 1kl4 n TRP 79 Ca -0.19 -2.24 -0.22 0.00 -1.02 0.00 0.00 57.50 53.83 1kl4 n TRP 79 Cb 0.54 -1.80 -0.16 0.00 -2.42 0.00 0.00 31.31 27.47 1kl4 n TRP 79 CO 0.00 0.00 0.00 0.21 -2.02 0.00 0.00 177.69 175.88 1kl4 s LYS 80 N 0.21 1.27 0.00 -0.99 2.20 -1.26 -1.22 119.74 119.95 1kl4 s LYS 80 Ca 0.63 -0.39 0.00 0.00 -0.36 0.00 0.00 55.97 55.85 1kl4 s LYS 80 Cb 0.28 -1.14 0.00 0.00 -1.51 0.00 0.00 37.83 35.46 1kl4 s LYS 80 CO -0.09 0.13 0.00 0.27 -0.36 0.00 0.00 175.35 175.30 1kl4 n ASN 81 N 3.36 0.57 0.11 1.43 0.23 -0.43 -4.77 115.26 115.75 1kl4 n ASN 81 Ca -0.19 -0.01 0.12 0.00 -0.53 0.00 0.00 54.58 53.96 1kl4 n ASN 81 Cb 0.53 0.00 0.46 0.00 -2.08 0.00 0.00 39.78 38.70 1kl4 n ASN 81 CO 0.00 0.00 0.00 0.59 -0.93 0.00 0.00 177.26 176.92 1kl4 n ASN 82 N -0.03 0.62 -0.03 0.53 4.13 -1.26 -3.81 115.26 115.41 1kl4 n ASN 82 Ca 0.00 0.63 0.00 0.00 1.68 0.00 0.00 54.58 56.89 1kl4 n ASN 82 Cb 0.00 -0.77 -0.09 0.00 -1.54 0.00 0.00 39.78 37.38 1kl4 n ASN 82 CO 0.00 0.00 0.00 -1.22 0.28 0.00 0.00 177.26 176.32 1kl4 n TYR 83 N -2.16 0.00 -3.59 3.10 4.01 -1.26 -5.08 117.16 112.18 1kl4 n TYR 83 Ca 0.03 0.00 -0.11 0.00 -0.16 0.00 0.00 57.90 57.66 1kl4 n TYR 83 Cb 0.27 -0.41 -0.04 0.00 -0.31 0.00 0.00 39.34 38.86 1kl4 n TYR 83 CO 0.00 0.00 0.00 -0.98 -0.46 0.00 0.00 176.86 175.42 1kl4 s ARG 84 N -2.54 1.14 -0.20 -0.72 1.70 -1.25 -5.14 118.95 111.93 1kl4 s ARG 84 Ca -0.05 -0.67 -0.06 0.00 -0.47 0.00 0.00 55.73 54.49 1kl4 s ARG 84 Cb 0.05 0.50 0.10 0.00 -0.57 0.00 0.00 34.95 35.03 1kl4 s ARG 84 CO 0.47 -0.46 0.39 1.21 -1.08 0.00 0.00 175.30 175.83 1kl4 s ASN 85 N -2.80 -0.05 0.00 -2.89 3.84 -1.26 -1.32 114.94 110.46 1kl4 s ASN 85 Ca 0.03 0.75 0.20 0.00 0.21 0.00 0.00 52.86 54.05 1kl4 s ASN 85 Cb 0.01 1.21 0.53 0.00 -0.55 0.00 0.00 41.25 42.45 1kl4 s ASN 85 CO -0.11 -0.25 1.44 0.00 -2.79 0.00 0.00 177.10 175.38 1kl4 n ALA 86 N 5.38 2.43 -4.12 1.71 0.00 -0.36 -5.00 120.51 120.55 1kl4 n ALA 86 Ca -0.07 -0.92 -0.38 0.00 0.00 0.00 0.00 53.44 52.07 1kl4 n ALA 86 Cb 0.50 -0.96 -0.02 0.00 0.00 0.00 0.00 19.45 18.96 1kl4 n ALA 86 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 1kl4 n HIS 87 N 1.11 -1.40 -3.56 0.00 8.25 -1.26 -4.86 115.22 113.50 1kl4 n HIS 87 Ca 0.19 0.34 -0.11 0.00 -0.26 0.00 0.00 57.72 57.88 1kl4 n HIS 87 Cb 0.49 -2.92 -0.03 0.00 1.12 0.00 0.00 29.99 28.64 1kl4 n HIS 87 CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 1kl4 s SER 88 N -3.90 -0.41 -0.03 0.41 1.04 -1.26 -1.16 113.70 108.39 1kl4 s SER 88 Ca 0.28 -0.20 -0.02 0.00 0.48 0.00 0.00 55.95 56.48 1kl4 s SER 88 Cb -0.15 0.57 0.01 0.00 0.10 0.00 0.00 66.02 66.55 1kl4 s SER 88 CO 0.97 -0.97 0.07 0.00 0.98 0.00 0.00 173.24 174.28 1kl4 s ALA 89 N -3.80 -0.16 -0.03 5.32 0.00 -0.46 -0.87 121.76 121.77 1kl4 s ALA 89 Ca 0.03 0.23 0.03 0.00 0.00 0.00 0.00 51.96 52.26 1kl4 s ALA 89 Cb -0.01 -0.14 -0.03 0.00 0.00 0.00 0.00 23.12 22.94 1kl4 s ALA 89 CO -0.10 -0.05 -0.11 0.99 0.00 0.00 0.00 175.76 176.50 1kl4 s THR 90 N 0.19 3.36 -0.08 0.00 2.01 -0.67 -1.30 115.64 119.15 1kl4 s THR 90 Ca -0.01 -0.72 0.05 0.00 0.31 0.00 0.00 61.69 61.32 1kl4 s THR 90 Cb -0.02 -2.38 -0.01 0.00 0.01 0.00 0.00 72.50 70.10 1kl4 s THR 90 CO -0.01 0.52 -0.24 0.42 -0.69 0.00 0.00 174.62 174.62 1kl4 s THR 91 N -0.84 2.13 -0.13 -0.82 -4.23 -0.14 -1.43 115.64 110.16 1kl4 s THR 91 Ca 0.14 -1.02 -0.03 0.00 -1.18 0.00 0.00 61.69 59.59 1kl4 s THR 91 Cb -0.11 -1.79 -0.03 0.00 1.34 0.00 0.00 72.50 71.91 1kl4 s THR 91 CO 0.03 0.56 -0.02 0.26 -0.54 0.00 0.00 174.62 174.92 1kl4 s TRP 92 N 0.07 3.07 -0.11 3.99 0.51 -0.06 -1.06 118.94 125.35 1kl4 s TRP 92 Ca -0.10 -0.10 0.02 0.00 -2.12 0.00 0.00 56.10 53.79 1kl4 s TRP 92 Cb -0.16 -1.91 0.01 0.00 -0.81 0.00 0.00 33.47 30.61 1kl4 s TRP 92 CO 0.06 0.14 -0.16 0.45 -0.51 0.00 0.00 176.95 176.93 1kl4 s SER 93 N -0.05 2.49 0.00 2.95 0.15 -0.17 -1.43 113.70 117.65 1kl4 s SER 93 Ca 0.02 -0.44 0.00 0.00 0.70 0.00 0.00 55.95 56.23 1kl4 s SER 93 Cb -0.13 -1.12 0.00 0.00 -1.71 0.00 0.00 66.02 63.06 1kl4 s SER 93 CO 0.02 0.03 0.00 0.61 1.20 0.00 0.00 173.24 175.10 1kl4 n GLY 94 N 4.14 1.44 3.07 9.45 0.00 -0.62 -1.02 105.19 121.65 1kl4 n GLY 94 Ca -0.19 -0.49 -0.12 0.00 0.00 0.00 0.00 46.02 45.22 1kl4 n GLY 94 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1kl4 s GLN 95 N 1.43 0.32 -0.00 1.61 -2.07 -0.25 -1.59 119.66 119.10 1kl4 s GLN 95 Ca 0.00 -0.07 -0.21 0.00 -1.82 0.00 0.00 55.36 53.26 1kl4 s GLN 95 Cb 0.00 0.14 -0.05 0.00 -1.09 0.00 0.00 33.01 32.01 1kl4 s GLN 95 CO 0.00 -0.06 0.61 -0.47 -1.32 0.00 0.00 175.29 174.05 1kl4 s TYR 96 N -0.60 3.68 -0.11 9.60 5.04 0.78 -1.47 117.35 134.27 1kl4 s TYR 96 Ca -0.07 1.22 0.02 0.00 -2.44 0.00 0.00 57.07 55.80 1kl4 s TYR 96 Cb -0.04 -2.63 0.01 0.00 0.35 0.00 0.00 41.96 39.65 1kl4 s TYR 96 CO 0.01 0.33 -0.16 0.08 -1.34 0.00 0.00 175.55 174.47 1kl4 s VAL 97 N -0.12 1.53 0.67 3.14 1.01 0.77 -1.82 120.40 125.59 1kl4 s VAL 97 Ca 0.32 -0.67 -0.03 0.00 0.00 0.00 0.00 61.98 61.60 1kl4 s VAL 97 Cb -0.18 -1.39 0.14 0.00 0.00 0.00 0.00 36.38 34.94 1kl4 s VAL 97 CO 0.18 0.45 0.91 0.61 0.00 0.00 0.00 175.10 177.24 1kl4 n GLY 98 N 4.14 0.24 0.00 4.51 0.00 -1.26 -1.64 105.19 111.18 1kl4 n GLY 98 Ca -0.19 -1.96 0.00 0.00 0.00 0.00 0.00 46.02 43.87 1kl4 n GLY 98 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1kl4 n GLY 99 N -1.74 -0.16 0.21 -0.02 0.00 -1.26 -4.55 105.19 97.68 1kl4 n GLY 99 Ca 0.14 -2.27 0.02 0.00 0.00 0.00 0.00 46.02 43.91 1kl4 n GLY 99 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1kl4 h ALA 100 N 0.00 1.38 -0.95 4.61 0.00 -2.06 -3.01 119.26 119.23 1kl4 h ALA 100 Ca 0.00 -0.30 -0.74 0.00 0.00 0.00 0.00 54.91 53.88 1kl4 h ALA 100 Cb 0.00 -0.07 -0.26 0.00 0.00 0.00 0.00 17.79 17.46 1kl4 h ALA 100 CO 0.00 0.44 0.99 0.39 0.00 0.00 0.00 179.25 181.07 1kl4 n GLU 101 N -4.16 2.71 -2.11 0.00 -0.58 -1.26 -5.03 120.64 110.21 1kl4 n GLU 101 Ca -0.01 -3.38 -0.40 0.00 -0.42 0.00 0.00 57.16 52.94 1kl4 n GLU 101 Cb 0.36 -2.25 -0.02 0.00 -0.57 0.00 0.00 31.44 28.96 1kl4 n GLU 101 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1kl4 s ALA 102 N -3.81 3.42 0.06 0.62 0.00 -1.14 -4.94 121.76 115.96 1kl4 s ALA 102 Ca 0.53 1.24 -0.20 0.00 0.00 0.00 0.00 51.96 53.54 1kl4 s ALA 102 Cb 0.44 -3.48 0.04 0.00 0.00 0.00 0.00 23.12 20.12 1kl4 s ALA 102 CO -0.38 -0.69 0.46 1.03 0.00 0.00 0.00 175.76 176.18 1kl4 s ARG 103 N -1.93 0.99 -0.20 0.00 0.52 -0.65 -4.21 118.95 113.47 1kl4 s ARG 103 Ca 0.51 -0.36 -0.01 0.00 -0.52 0.00 0.00 55.73 55.36 1kl4 s ARG 103 Cb -0.39 0.45 0.01 0.00 0.52 0.00 0.00 34.95 35.54 1kl4 s ARG 103 CO 0.51 -0.35 -0.14 0.42 0.02 0.00 0.00 175.30 175.76 1kl4 s ILE 104 N -2.64 2.54 -0.21 1.52 1.01 0.29 -0.16 121.20 123.54 1kl4 s ILE 104 Ca -0.04 -0.80 -0.09 0.00 0.00 0.00 0.00 60.65 59.72 1kl4 s ILE 104 Cb -0.00 -2.11 -0.05 0.00 0.01 0.00 0.00 42.46 40.30 1kl4 s ILE 104 CO -0.03 0.48 0.12 0.20 0.00 0.00 0.00 174.94 175.71 1kl4 s ASN 105 N 1.35 6.00 0.12 3.58 0.01 -0.54 -0.71 114.94 124.76 1kl4 s ASN 105 Ca 0.05 0.14 0.02 0.00 -0.71 0.00 0.00 52.86 52.36 1kl4 s ASN 105 Cb -0.14 -2.06 -0.04 0.00 0.41 0.00 0.00 41.25 39.42 1kl4 s ASN 105 CO -0.09 0.14 -0.06 0.42 -1.51 0.00 0.00 177.10 176.00 1kl4 s THR 106 N 0.62 0.74 0.16 1.60 -4.23 0.13 -1.09 115.64 113.57 1kl4 s THR 106 Ca 0.07 -1.96 0.11 0.00 -1.18 0.00 0.00 61.69 58.73 1kl4 s THR 106 Cb -0.12 -1.78 -0.04 0.00 1.34 0.00 0.00 72.50 71.89 1kl4 s THR 106 CO 0.01 -0.79 -0.25 -1.10 -0.54 0.00 0.00 174.62 171.95 1kl4 s GLN 107 N -3.84 1.45 0.07 3.99 -0.21 -0.19 -1.82 119.66 119.11 1kl4 s GLN 107 Ca 0.15 -1.44 0.03 0.00 0.02 0.00 0.00 55.36 54.12 1kl4 s GLN 107 Cb 0.05 -1.83 -0.03 0.00 1.00 0.00 0.00 33.01 32.20 1kl4 s GLN 107 CO -0.03 0.41 -0.09 1.67 -2.12 0.00 0.00 175.29 175.14 1kl4 s TRP 108 N -1.42 0.88 -0.08 0.91 1.48 0.42 -0.99 118.94 120.13 1kl4 s TRP 108 Ca 0.17 -0.63 0.03 0.00 -1.06 0.00 0.00 56.10 54.62 1kl4 s TRP 108 Cb -0.09 -0.50 0.01 0.00 -1.16 0.00 0.00 33.47 31.72 1kl4 s TRP 108 CO 0.08 -0.06 -0.18 -0.51 -4.06 0.00 0.00 176.95 172.22 1kl4 s LEU 109 N -2.15 1.86 -0.25 -4.66 1.43 -0.23 -1.76 118.68 112.93 1kl4 s LEU 109 Ca -0.00 -0.41 0.02 0.00 -1.03 0.00 0.00 54.13 52.71 1kl4 s LEU 109 Cb -0.05 -1.08 0.05 0.00 0.03 0.00 0.00 46.19 45.14 1kl4 s LEU 109 CO -0.01 0.10 -0.11 -0.22 0.23 0.00 0.00 176.35 176.34 1kl4 s LEU 110 N 0.43 3.24 -0.17 1.79 0.20 -0.21 -0.97 118.68 123.00 1kl4 s LEU 110 Ca -0.15 -1.23 -0.05 0.00 0.69 0.00 0.00 54.13 53.39 1kl4 s LEU 110 Cb -0.16 -1.56 -0.03 0.00 -0.43 0.00 0.00 46.19 44.01 1kl4 s LEU 110 CO 0.06 -0.16 0.00 -0.89 -0.29 0.00 0.00 176.35 175.07 1kl4 s THR 111 N 1.16 4.20 -0.05 3.68 2.01 -0.42 -0.61 115.64 125.61 1kl4 s THR 111 Ca -0.06 -0.24 -0.01 0.00 0.31 0.00 0.00 61.69 61.69 1kl4 s THR 111 Cb -0.19 -2.87 -0.03 0.00 0.01 0.00 0.00 72.50 69.42 1kl4 s THR 111 CO -0.06 0.47 0.02 -0.44 -0.69 0.00 0.00 174.62 173.91 1kl4 s SER 112 N 0.52 5.28 0.12 3.53 0.01 -0.14 -1.35 113.70 121.67 1kl4 s SER 112 Ca -0.01 0.10 -0.31 0.00 1.31 0.00 0.00 55.95 57.04 1kl4 s SER 112 Cb -0.14 -1.46 -0.11 0.00 0.21 0.00 0.00 66.02 64.53 1kl4 s SER 112 CO 0.02 0.33 1.84 0.61 0.41 0.00 0.00 173.24 176.45 1kl4 n GLY 113 N 1.74 1.68 3.29 3.44 0.00 -0.31 -4.81 105.19 110.22 1kl4 n GLY 113 Ca -0.16 0.72 -0.16 0.00 0.00 0.00 0.00 46.02 46.42 1kl4 n GLY 113 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1kl4 s THR 114 N 2.77 0.39 0.86 2.61 -4.23 -1.26 -5.02 115.64 111.75 1kl4 s THR 114 Ca 0.82 -2.00 -0.12 0.00 -1.18 0.00 0.00 61.69 59.21 1kl4 s THR 114 Cb -0.48 -2.59 0.10 0.00 1.34 0.00 0.00 72.50 70.88 1kl4 s THR 114 CO 0.37 0.00 1.13 0.42 -0.54 0.00 0.00 174.62 176.00 1kl4 s THR 115 N -3.83 2.37 0.37 3.99 -4.23 -1.26 -4.88 115.64 108.17 1kl4 s THR 115 Ca 0.38 0.12 0.06 0.00 -1.18 0.00 0.00 61.69 61.07 1kl4 s THR 115 Cb 0.07 -2.92 0.21 0.00 1.34 0.00 0.00 72.50 71.20 1kl4 s THR 115 CO 0.14 -0.16 1.96 -0.33 -0.54 0.00 0.00 174.62 175.69 1kl4 h GLU 116 N -1.28 0.52 0.00 3.99 5.08 -2.01 -2.41 114.58 118.47 1kl4 h GLU 116 Ca -0.49 -0.07 -0.10 0.00 -1.00 0.00 0.00 59.36 57.70 1kl4 h GLU 116 Cb 1.31 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 30.45 1kl4 h GLU 116 CO 0.62 0.46 -0.48 0.00 -1.00 0.00 0.00 179.01 178.61 1kl4 h ALA 117 N 1.62 1.18 -0.70 3.43 0.00 -2.07 -2.75 119.26 119.97 1kl4 h ALA 117 Ca 0.13 -0.43 0.00 0.00 0.00 0.00 0.00 54.91 54.60 1kl4 h ALA 117 Cb 0.15 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.87 1kl4 h ALA 117 CO -0.01 0.59 0.00 0.09 0.00 0.00 0.00 179.25 179.93 1kl4 n ASN 118 N -3.92 3.88 0.26 0.00 3.02 -0.94 -4.56 115.26 113.00 1kl4 n ASN 118 Ca -0.01 -2.05 0.17 0.00 -0.03 0.00 0.00 54.58 52.66 1kl4 n ASN 118 Cb 0.50 -0.48 0.77 0.00 -0.61 0.00 0.00 39.78 39.96 1kl4 n ASN 118 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1kl4 h ALA 119 N 4.27 1.00 0.00 5.41 0.00 -1.16 -2.21 119.26 126.56 1kl4 h ALA 119 Ca 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.88 1kl4 h ALA 119 Cb 1.00 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.79 1kl4 h ALA 119 CO 0.03 0.00 -0.15 0.11 0.00 0.00 0.00 179.25 179.24 1kl4 h TRP 120 N 0.00 0.00 -0.49 0.00 5.08 -1.82 -2.98 115.95 115.74 1kl4 h TRP 120 Ca 0.00 0.00 -0.32 0.00 1.08 0.00 0.00 58.89 59.65 1kl4 h TRP 120 Cb 0.35 0.00 -0.22 0.00 -3.00 0.00 0.00 29.16 26.29 1kl4 h TRP 120 CO 0.00 0.15 -0.33 0.36 -1.28 0.00 0.00 178.44 177.34 1kl4 n LYS 121 N -3.38 2.49 0.19 0.12 2.85 -0.83 -4.70 118.16 114.90 1kl4 n LYS 121 Ca -0.00 -3.57 0.10 0.00 -1.05 0.00 0.00 58.31 53.78 1kl4 n LYS 121 Cb 0.35 -1.99 0.13 0.00 -0.65 0.00 0.00 35.03 32.87 1kl4 n LYS 121 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 177.40 178.01 1kl4 h SER 122 N 1.51 0.00 -3.33 -5.58 4.64 -1.60 -3.46 113.55 105.74 1kl4 h SER 122 Ca 0.27 0.00 -0.53 0.00 -0.47 0.00 0.00 61.79 61.06 1kl4 h SER 122 Cb 1.40 0.00 -0.39 0.00 -0.31 0.00 0.00 62.40 63.11 1kl4 h SER 122 CO 0.56 0.11 -0.78 -0.89 -0.87 0.00 0.00 176.83 174.96 1kl4 s THR 123 N -3.17 0.86 0.25 2.95 2.01 -1.26 -0.97 115.64 116.31 1kl4 s THR 123 Ca 0.06 -0.56 -0.13 0.00 0.31 0.00 0.00 61.69 61.37 1kl4 s THR 123 Cb 0.06 -1.15 -0.08 0.00 0.01 0.00 0.00 72.50 71.34 1kl4 s THR 123 CO 0.70 0.02 0.62 -0.76 -0.69 0.00 0.00 174.62 174.50 1kl4 s LEU 124 N 1.73 4.17 0.01 4.42 1.43 0.22 -4.91 118.68 125.74 1kl4 s LEU 124 Ca 0.00 1.09 0.06 0.00 -1.03 0.00 0.00 54.13 54.25 1kl4 s LEU 124 Cb -0.16 -3.75 -0.02 0.00 0.03 0.00 0.00 46.19 42.29 1kl4 s LEU 124 CO -0.07 -0.09 -0.18 0.54 0.23 0.00 0.00 176.35 176.78 1kl4 s VAL 125 N -1.81 1.41 0.00 -1.59 0.11 -1.26 -1.04 120.40 116.22 1kl4 s VAL 125 Ca 0.48 -0.91 0.00 0.00 -2.93 0.00 0.00 61.98 58.62 1kl4 s VAL 125 Cb -0.12 -1.20 0.00 0.00 -1.53 0.00 0.00 36.38 33.53 1kl4 s VAL 125 CO 0.20 0.28 0.00 0.61 -3.33 0.00 0.00 175.10 172.85 1kl4 n GLY 126 N 2.31 2.05 3.12 6.54 0.00 -0.72 -5.00 105.19 113.49 1kl4 n GLY 126 Ca -0.16 -0.92 -0.08 0.00 0.00 0.00 0.00 46.02 44.86 1kl4 n GLY 126 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 1kl4 s HIS 127 N -6.77 0.34 -0.07 1.61 -3.43 -1.26 -0.44 115.29 105.27 1kl4 s HIS 127 Ca 0.00 -0.80 -0.28 0.00 -0.80 0.00 0.00 55.06 53.18 1kl4 s HIS 127 Cb 0.00 -0.24 0.06 0.00 -1.43 0.00 0.00 32.58 30.97 1kl4 s HIS 127 CO 0.00 -0.42 0.62 0.34 -2.00 0.00 0.00 174.74 173.28 1kl4 s ASP 128 N -2.70 -0.59 -0.06 7.38 -1.08 -0.75 -4.93 116.67 113.93 1kl4 s ASP 128 Ca 0.03 0.69 0.06 0.00 -0.52 0.00 0.00 52.55 52.81 1kl4 s ASP 128 Cb 0.05 0.60 -0.01 0.00 -1.46 0.00 0.00 42.92 42.10 1kl4 s ASP 128 CO -0.09 -0.54 -0.24 -0.89 0.52 0.00 0.00 175.17 173.93 1kl4 s THR 129 N -1.03 2.00 0.08 1.71 2.01 -1.26 -0.70 115.64 118.45 1kl4 s THR 129 Ca -0.10 -1.03 0.09 0.00 0.31 0.00 0.00 61.69 60.96 1kl4 s THR 129 Cb -0.01 -1.70 -0.03 0.00 0.01 0.00 0.00 72.50 70.76 1kl4 s THR 129 CO 0.08 0.55 -0.22 -0.36 -0.69 0.00 0.00 174.62 173.98 1kl4 s PHE 130 N -0.06 2.43 0.22 4.92 0.40 0.11 -4.13 117.98 121.88 1kl4 s PHE 130 Ca -0.06 -0.33 0.04 0.00 -0.60 0.00 0.00 56.93 55.98 1kl4 s PHE 130 Cb -0.14 -1.37 -0.05 0.00 0.51 0.00 0.00 43.02 41.97 1kl4 s PHE 130 CO 0.04 0.27 -0.04 0.95 0.70 0.00 0.00 175.22 177.15 1kl4 s THR 131 N -0.97 1.19 -0.99 0.64 -4.23 -0.59 -0.55 115.64 110.13 1kl4 s THR 131 Ca 0.14 -2.06 0.27 0.00 -1.18 0.00 0.00 61.69 58.86 1kl4 s THR 131 Cb -0.10 -2.26 0.12 0.00 1.34 0.00 0.00 72.50 71.60 1kl4 s THR 131 CO 0.06 -0.40 1.67 0.29 -0.54 0.00 0.00 174.62 175.69 1kl4 n LYS 132 N -0.41 0.01 -4.27 3.99 5.02 -1.26 -1.06 118.16 120.18 1kl4 n LYS 132 Ca -0.06 0.00 -0.15 0.00 -2.02 0.00 0.00 58.31 56.08 1kl4 n LYS 132 Cb 0.63 -1.51 -0.10 0.00 -0.02 0.00 0.00 35.03 34.04 1kl4 n LYS 132 CO 0.00 0.00 0.00 0.14 -0.52 0.00 0.00 177.40 177.02 1kl4 s VAL 133 N -3.00 1.32 -2.36 -0.18 -7.23 -1.26 -4.87 120.40 102.81 1kl4 s VAL 133 Ca 0.12 -2.10 0.19 0.00 -1.81 0.00 0.00 61.98 58.39 1kl4 s VAL 133 Cb 0.18 -1.90 0.15 0.00 0.56 0.00 0.00 36.38 35.38 1kl4 s VAL 133 CO 0.62 -0.71 1.10 1.17 -0.31 0.00 0.00 175.10 176.97