#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kl5 s ILE 2 N 0.00 0.11 0.00 1.12 1.10 -1.26 -5.17 121.20 117.10 2kl5 s ILE 2 Ca 0.00 -0.88 0.00 0.00 -0.51 0.00 0.00 60.65 59.26 2kl5 s ILE 2 Cb 0.00 -0.32 0.00 0.00 0.15 0.00 0.00 42.46 42.29 2kl5 s ILE 2 CO 0.00 -0.49 0.00 0.61 -2.11 0.00 0.00 174.94 172.95 2kl5 n GLY 3 N 1.54 1.79 3.26 1.50 0.00 -1.26 -5.15 105.19 106.87 2kl5 n GLY 3 Ca -0.24 -1.89 -0.13 0.00 0.00 0.00 0.00 46.02 43.76 2kl5 n GLY 3 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 2kl5 s MET 4 N 3.45 0.50 -0.14 1.61 0.23 -1.26 -5.08 119.30 118.61 2kl5 s MET 4 Ca 0.00 0.36 -0.09 0.00 -1.03 0.00 0.00 55.69 54.93 2kl5 s MET 4 Cb 0.00 0.24 -0.05 0.00 -1.53 0.00 0.00 34.83 33.49 2kl5 s MET 4 CO 0.00 -0.09 -0.09 0.66 -2.03 0.00 0.00 175.02 173.48 2kl5 h SER 5 N 5.14 0.00 0.00 -1.18 4.64 -2.09 -3.48 113.55 116.58 2kl5 h SER 5 Ca -0.27 -0.07 0.00 0.00 -0.47 0.00 0.00 61.79 60.97 2kl5 h SER 5 Cb 1.18 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.27 2kl5 h SER 5 CO 0.30 0.79 0.00 -1.84 -0.87 0.00 0.00 176.83 175.21 2kl5 n GLU 6 N -4.63 0.00 -1.69 4.77 0.28 -1.26 -5.03 120.64 113.08 2kl5 n GLU 6 Ca -0.09 0.00 -0.18 0.00 -0.16 0.00 0.00 57.16 56.74 2kl5 n GLU 6 Cb 0.27 0.00 -0.06 0.00 1.43 0.00 0.00 31.44 33.08 2kl5 n GLU 6 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 177.13 178.14 2kl5 n LYS 7 N -2.58 -1.27 0.18 3.44 4.81 -1.26 -4.90 118.16 116.57 2kl5 n LYS 7 Ca 0.00 1.07 -0.09 0.00 -0.87 0.00 0.00 58.31 58.42 2kl5 n LYS 7 Cb 0.00 -5.37 -0.05 0.00 0.02 0.00 0.00 35.03 29.63 2kl5 n LYS 7 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2kl5 h ARG 8 N 0.00 -0.51 0.00 1.64 3.08 -2.04 -3.49 114.38 113.06 2kl5 h ARG 8 Ca -0.38 0.03 0.00 0.00 0.07 0.00 0.00 59.98 59.71 2kl5 h ARG 8 Cb 1.19 0.12 0.00 0.00 0.08 0.00 0.00 29.97 31.36 2kl5 h ARG 8 CO 0.53 -0.28 0.00 0.41 -1.07 0.00 0.00 179.97 179.56 2kl5 n GLY 9 N 0.31 0.80 2.00 0.04 0.00 -1.26 -4.81 105.19 102.28 2kl5 n GLY 9 Ca -0.07 -0.76 0.00 0.00 0.00 0.00 0.00 46.02 45.18 2kl5 n GLY 9 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2kl5 n GLU 10 N 3.36 0.00 -3.76 1.61 2.13 -1.26 -5.05 120.64 117.67 2kl5 n GLU 10 Ca 0.00 0.00 -0.30 0.00 0.66 0.00 0.00 57.16 57.52 2kl5 n GLU 10 Cb 0.00 0.00 -0.15 0.00 0.27 0.00 0.00 31.44 31.56 2kl5 n GLU 10 CO 0.00 0.00 0.00 0.42 -0.41 0.00 0.00 177.13 177.14 2kl5 s ILE 11 N -2.00 0.97 -0.30 6.31 1.01 -1.26 -5.07 121.20 120.85 2kl5 s ILE 11 Ca 0.00 -1.39 -0.09 0.00 0.00 0.00 0.00 60.65 59.18 2kl5 s ILE 11 Cb 0.00 -1.69 -0.00 0.00 0.01 0.00 0.00 42.46 40.77 2kl5 s ILE 11 CO 0.00 -0.61 0.13 0.00 0.00 0.00 0.00 174.94 174.46 2kl5 s MET 12 N 1.58 3.28 -0.41 2.79 0.23 -1.26 -1.35 119.30 124.16 2kl5 s MET 12 Ca 0.08 -0.75 -0.11 0.00 -1.03 0.00 0.00 55.69 53.88 2kl5 s MET 12 Cb -0.17 -3.49 0.05 0.00 -1.53 0.00 0.00 34.83 29.68 2kl5 s MET 12 CO -0.22 -0.41 0.26 0.42 -2.03 0.00 0.00 175.02 173.04 2kl5 s ILE 13 N 1.58 4.58 -0.32 3.16 -1.09 0.11 -4.93 121.20 124.29 2kl5 s ILE 13 Ca 0.04 -1.07 -0.15 0.00 -2.23 0.00 0.00 60.65 57.24 2kl5 s ILE 13 Cb -0.17 -3.67 -0.02 0.00 -1.58 0.00 0.00 42.46 37.02 2kl5 s ILE 13 CO 0.05 -0.39 0.38 -0.76 -1.23 0.00 0.00 174.94 172.99 2kl5 s LEU 14 N 1.53 4.29 -0.09 2.97 1.02 -1.26 -0.47 118.68 126.67 2kl5 s LEU 14 Ca 0.03 -0.04 -0.14 0.00 0.02 0.00 0.00 54.13 53.99 2kl5 s LEU 14 Cb -0.21 -2.39 0.03 0.00 0.02 0.00 0.00 46.19 43.64 2kl5 s LEU 14 CO 0.05 -0.30 0.36 -0.51 0.02 0.00 0.00 176.35 175.97 2kl5 s ILE 15 N 2.08 0.02 -1.41 -0.59 2.07 -0.21 -4.93 121.20 118.22 2kl5 s ILE 15 Ca 0.13 -0.18 -0.11 0.00 -1.41 0.00 0.00 60.65 59.09 2kl5 s ILE 15 Cb -0.16 -0.57 0.08 0.00 0.13 0.00 0.00 42.46 41.93 2kl5 s ILE 15 CO 0.11 -0.10 0.64 0.00 -1.91 0.00 0.00 174.94 173.69 2kl5 n GLN 16 N 2.20 -4.01 -3.33 3.50 1.13 -1.26 -0.33 117.38 115.28 2kl5 n GLN 16 Ca -0.16 0.54 -0.21 0.00 -1.94 0.00 0.00 57.00 55.22 2kl5 n GLN 16 Cb 0.57 -5.31 0.06 0.00 0.11 0.00 0.00 30.24 25.67 2kl5 n GLN 16 CO 0.00 0.00 0.00 0.09 -1.44 0.00 0.00 177.06 175.71 2kl5 n ASN 17 N -2.47 -5.90 -3.82 1.08 3.02 -1.26 -5.02 115.26 100.89 2kl5 n ASN 17 Ca -0.00 -0.42 -0.13 0.00 -0.03 0.00 0.00 54.58 54.00 2kl5 n ASN 17 Cb 0.54 -4.58 -0.14 0.00 -0.61 0.00 0.00 39.78 35.00 2kl5 n ASN 17 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2kl5 s ALA 18 N -3.24 -0.16 -0.20 5.41 0.00 0.55 -4.13 121.76 119.98 2kl5 s ALA 18 Ca 0.46 0.29 -0.08 0.00 0.00 0.00 0.00 51.96 52.62 2kl5 s ALA 18 Cb -0.20 -0.18 -0.04 0.00 0.00 0.00 0.00 23.12 22.69 2kl5 s ALA 18 CO 0.57 -0.06 0.09 -2.00 0.00 0.00 0.00 175.76 174.35 2kl5 s GLU 19 N 0.32 3.97 0.31 0.00 2.12 -1.18 -1.04 118.70 123.20 2kl5 s GLU 19 Ca -0.02 -0.34 0.11 0.00 0.36 0.00 0.00 54.97 55.07 2kl5 s GLU 19 Cb -0.04 -3.31 -0.06 0.00 0.26 0.00 0.00 34.13 30.99 2kl5 s GLU 19 CO -0.01 0.17 -0.13 -0.06 -0.54 0.00 0.00 175.26 174.69 2kl5 s PHE 20 N 0.67 2.37 0.02 5.30 0.40 0.38 -0.81 117.98 126.31 2kl5 s PHE 20 Ca 0.05 -0.42 0.02 0.00 -0.60 0.00 0.00 56.93 55.98 2kl5 s PHE 20 Cb -0.13 -1.21 -0.02 0.00 0.51 0.00 0.00 43.02 42.17 2kl5 s PHE 20 CO 0.01 0.64 -0.07 -1.83 0.70 0.00 0.00 175.22 174.67 2kl5 s GLU 21 N -3.57 0.50 -0.37 0.44 -1.05 -0.40 0.05 118.70 114.31 2kl5 s GLU 21 Ca 0.31 -0.54 -0.29 0.00 -0.15 0.00 0.00 54.97 54.31 2kl5 s GLU 21 Cb -0.01 -0.35 0.00 0.00 -0.44 0.00 0.00 34.13 33.33 2kl5 s GLU 21 CO 0.16 0.08 1.44 -1.17 0.95 0.00 0.00 175.26 176.72 2kl5 s LEU 22 N -1.02 3.67 0.00 1.83 2.96 -0.46 -1.59 118.68 124.07 2kl5 s LEU 22 Ca -0.05 1.01 0.18 0.00 -0.22 0.00 0.00 54.13 55.05 2kl5 s LEU 22 Cb -0.07 -3.54 -0.17 0.00 0.50 0.00 0.00 46.19 42.91 2kl5 s LEU 22 CO 0.00 -1.37 0.81 1.33 -1.32 0.00 0.00 176.35 175.81 2kl5 n VAL 23 N 6.87 0.00 -3.64 1.68 0.24 -0.61 -4.79 118.33 118.08 2kl5 n VAL 23 Ca 0.17 -0.10 -0.07 0.00 -2.04 0.00 0.00 64.34 62.30 2kl5 n VAL 23 Cb 0.47 1.03 -0.07 0.00 -1.47 0.00 0.00 33.84 33.81 2kl5 n VAL 23 CO 0.00 0.00 0.00 -2.28 -2.14 0.00 0.00 176.83 172.41 2kl5 s HIS 24 N -2.67 -0.50 0.03 6.34 5.65 -1.19 -4.99 115.29 117.96 2kl5 s HIS 24 Ca 0.08 1.14 -0.06 0.00 0.25 0.00 0.00 55.06 56.47 2kl5 s HIS 24 Cb 0.14 0.37 -0.01 0.00 -1.18 0.00 0.00 32.58 31.90 2kl5 s HIS 24 CO 0.72 -0.24 0.11 1.21 -0.65 0.00 0.00 174.74 175.90 2kl5 s ASN 25 N 0.50 0.12 -0.02 9.88 3.84 -1.26 -0.27 114.94 127.72 2kl5 s ASN 25 Ca 0.00 -0.41 0.01 0.00 0.21 0.00 0.00 52.86 52.67 2kl5 s ASN 25 Cb -0.05 0.22 0.01 0.00 -0.55 0.00 0.00 41.25 40.89 2kl5 s ASN 25 CO -0.09 -0.46 -0.03 0.12 -2.79 0.00 0.00 177.10 173.85 2kl5 s PHE 26 N -2.17 0.50 -1.80 0.43 5.36 0.15 -4.85 117.98 115.60 2kl5 s PHE 26 Ca -0.09 -0.09 0.00 0.00 -0.96 0.00 0.00 56.93 55.79 2kl5 s PHE 26 Cb -0.04 -0.44 0.00 0.00 -0.34 0.00 0.00 43.02 42.20 2kl5 s PHE 26 CO -0.02 -0.10 0.00 1.63 -1.46 0.00 0.00 175.22 175.26 2kl5 n LYS 27 N 3.67 -1.65 -2.19 10.12 4.76 -1.26 -1.64 118.16 129.96 2kl5 n LYS 27 Ca -0.22 1.01 -0.20 0.00 -2.87 0.00 0.00 58.31 56.04 2kl5 n LYS 27 Cb 0.53 -5.56 -0.03 0.00 -1.84 0.00 0.00 35.03 28.14 2kl5 n LYS 27 CO 0.00 0.00 0.00 -0.25 -1.37 0.00 0.00 177.40 175.78 2kl5 n ASP 28 N -1.69 -5.56 0.00 4.39 8.00 -1.26 -4.84 116.55 115.59 2kl5 n ASP 28 Ca -0.22 0.09 0.04 0.00 0.71 0.00 0.00 54.79 55.42 2kl5 n ASP 28 Cb 0.66 -4.63 0.25 0.00 -0.02 0.00 0.00 41.12 37.38 2kl5 n ASP 28 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2kl5 n GLY 29 N -0.92 -0.43 3.59 0.44 0.00 -0.66 -4.67 105.19 102.55 2kl5 n GLY 29 Ca -0.22 -0.05 -0.43 0.00 0.00 0.00 0.00 46.02 45.32 2kl5 n GLY 29 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2kl5 s PHE 30 N -2.00 2.97 -0.33 1.61 5.36 -1.26 -4.67 117.98 119.66 2kl5 s PHE 30 Ca 0.13 0.66 0.00 0.00 -0.96 0.00 0.00 56.93 56.75 2kl5 s PHE 30 Cb 0.06 -3.93 0.10 0.00 -0.34 0.00 0.00 43.02 38.91 2kl5 s PHE 30 CO 0.10 -1.01 0.11 1.21 -1.46 0.00 0.00 175.22 174.17 2kl5 s ASN 31 N 2.12 4.06 0.21 6.13 3.04 -1.26 -5.02 114.94 124.21 2kl5 s ASN 31 Ca 0.40 -1.83 -0.10 0.00 0.04 0.00 0.00 52.86 51.38 2kl5 s ASN 31 Cb -0.10 -0.97 0.26 0.00 -1.54 0.00 0.00 41.25 38.90 2kl5 s ASN 31 CO 0.24 -0.39 1.76 -0.08 -3.04 0.00 0.00 177.10 175.59 2kl5 h GLU 32 N 7.86 0.47 -0.85 0.43 4.81 -1.99 -0.67 114.58 124.64 2kl5 h GLU 32 Ca -0.11 -0.03 0.12 0.00 -0.13 0.00 0.00 59.36 59.21 2kl5 h GLU 32 Cb 1.00 -0.11 -0.06 0.00 0.63 0.00 0.00 28.75 30.21 2kl5 h GLU 32 CO 0.48 0.31 0.55 1.05 -0.73 0.00 0.00 179.01 180.67 2kl5 h GLU 33 N 0.49 0.71 -0.03 1.92 4.11 -1.98 0.13 114.58 119.93 2kl5 h GLU 33 Ca 0.30 -0.04 -0.11 0.00 0.07 0.00 0.00 59.36 59.58 2kl5 h GLU 33 Cb 0.31 -0.16 0.01 0.00 0.50 0.00 0.00 28.75 29.41 2kl5 h GLU 33 CO -0.26 0.47 -0.41 0.00 0.07 0.00 0.00 179.01 178.89 2kl5 h ALA 34 N 1.59 0.09 0.08 1.06 0.00 -1.63 -2.75 119.26 117.69 2kl5 h ALA 34 Ca 0.41 -0.50 0.02 0.00 0.00 0.00 0.00 54.91 54.85 2kl5 h ALA 34 Cb 0.57 0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.32 2kl5 h ALA 34 CO -0.17 0.22 -0.33 0.35 0.00 0.00 0.00 179.25 179.31 2kl5 h PHE 35 N -0.23 -0.92 0.00 0.00 3.57 -0.09 -1.24 116.94 118.03 2kl5 h PHE 35 Ca -0.04 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.48 2kl5 h PHE 35 Cb 1.11 0.39 0.00 0.00 2.79 0.00 0.00 35.95 40.24 2kl5 h PHE 35 CO 0.15 -0.44 0.00 1.57 -2.23 0.00 0.00 178.31 177.36 2kl5 h LYS 36 N -0.54 0.00 0.08 1.11 2.10 -0.90 0.26 116.57 118.69 2kl5 h LYS 36 Ca 0.04 0.00 -0.26 0.00 -2.00 0.00 0.00 60.65 58.43 2kl5 h LYS 36 Cb 0.59 0.00 0.01 0.00 -0.90 0.00 0.00 32.23 31.92 2kl5 h LYS 36 CO -0.22 0.00 -1.12 0.00 -2.00 0.00 0.00 179.45 176.11 2kl5 h ALA 37 N 2.04 0.20 0.00 0.07 0.00 -1.05 -3.34 119.26 117.19 2kl5 h ALA 37 Ca 0.00 -0.80 0.00 0.00 0.00 0.00 0.00 54.91 54.11 2kl5 h ALA 37 Cb 0.41 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.21 2kl5 h ALA 37 CO 0.00 0.88 -1.53 0.54 0.00 0.00 0.00 179.25 179.14 2kl5 n ARG 38 N -3.65 0.60 -2.12 0.00 5.12 -0.54 -4.95 116.66 111.12 2kl5 n ARG 38 Ca -0.08 -0.06 -0.37 0.00 -1.93 0.00 0.00 57.85 55.41 2kl5 n ARG 38 Cb 0.94 -1.65 0.01 0.00 -1.16 0.00 0.00 32.46 30.60 2kl5 n ARG 38 CO 0.00 0.00 0.00 -0.47 -1.93 0.00 0.00 177.63 175.23 2kl5 s TYR 39 N -3.43 2.65 0.21 -1.55 5.04 0.86 -4.92 117.35 116.21 2kl5 s TYR 39 Ca -0.04 1.50 -0.09 0.00 -2.44 0.00 0.00 57.07 56.00 2kl5 s TYR 39 Cb 0.12 -3.47 -0.01 0.00 0.35 0.00 0.00 41.96 38.95 2kl5 s TYR 39 CO 0.86 -1.92 0.35 0.45 -1.34 0.00 0.00 175.55 173.95 2kl5 s SER 40 N -1.36 -0.00 0.49 4.32 0.15 -1.26 -4.97 113.70 111.07 2kl5 s SER 40 Ca 0.69 -1.00 0.26 0.00 0.70 0.00 0.00 55.95 56.59 2kl5 s SER 40 Cb -0.31 0.50 1.27 0.00 -1.71 0.00 0.00 66.02 65.78 2kl5 s SER 40 CO 0.36 -1.00 2.00 -2.24 1.20 0.00 0.00 173.24 173.56 2kl5 h ASP 41 N 2.42 0.00 0.10 5.45 2.03 -1.98 -1.95 116.42 122.48 2kl5 h ASP 41 Ca -0.30 0.00 -0.01 0.00 -0.73 0.00 0.00 57.03 55.99 2kl5 h ASP 41 Cb 1.24 0.00 -0.00 0.00 -0.83 0.00 0.00 39.33 39.74 2kl5 h ASP 41 CO 0.43 0.16 -0.04 -0.29 -1.03 0.00 0.00 179.24 178.47 2kl5 h ILE 42 N 0.00 0.60 0.00 4.15 6.09 -2.00 -2.16 117.51 124.18 2kl5 h ILE 42 Ca -0.00 -0.16 0.00 0.00 -1.37 0.00 0.00 64.86 63.33 2kl5 h ILE 42 Cb 0.46 1.10 0.00 0.00 0.47 0.00 0.00 36.82 38.85 2kl5 h ILE 42 CO 0.02 0.04 -0.81 0.18 -3.07 0.00 0.00 178.15 174.51 2kl5 n LEU 43 N -3.87 0.65 0.30 2.19 4.77 -0.73 -4.24 117.00 116.06 2kl5 n LEU 43 Ca -0.03 -0.08 0.18 0.00 -0.03 0.00 0.00 56.01 56.05 2kl5 n LEU 43 Cb 0.13 -0.14 0.90 0.00 -2.33 0.00 0.00 43.42 41.98 2kl5 n LEU 43 CO 0.29 0.10 1.06 -1.13 -1.33 0.00 0.00 177.39 176.38 2kl5 h ASN 44 N 0.00 0.00 1.28 -1.43 -1.24 -1.43 -1.99 115.58 110.77 2kl5 h ASN 44 Ca 0.00 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.01 2kl5 h ASN 44 Cb 0.61 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.66 2kl5 h ASN 44 CO 0.00 0.04 -0.01 2.29 -1.29 0.00 0.00 177.43 178.46 2kl5 n LYS 45 N -3.29 0.16 0.09 6.67 2.85 -1.26 -3.74 118.16 119.64 2kl5 n LYS 45 Ca -0.02 0.13 -0.14 0.00 -1.05 0.00 0.00 58.31 57.23 2kl5 n LYS 45 Cb 0.19 -1.68 -0.11 0.00 -0.65 0.00 0.00 35.03 32.78 2kl5 n LYS 45 CO 0.00 0.00 0.00 1.88 -0.05 0.00 0.00 177.40 179.23 2kl5 h TYR 46 N 0.00 0.46 0.00 5.58 0.05 -1.63 -3.47 116.97 117.97 2kl5 h TYR 46 Ca 0.00 -0.31 0.00 0.00 0.05 0.00 0.00 58.73 58.47 2kl5 h TYR 46 Cb 0.64 -0.03 0.00 0.00 1.01 0.00 0.00 36.73 38.36 2kl5 h TYR 46 CO 0.00 1.21 0.00 -0.25 -1.05 0.00 0.00 178.16 178.07 2kl5 n ASP 47 N -3.57 -0.30 -3.60 3.88 9.92 -1.25 -4.25 116.55 117.39 2kl5 n ASP 47 Ca -0.07 0.00 -0.17 0.00 -0.53 0.00 0.00 54.79 54.02 2kl5 n ASP 47 Cb 0.97 -1.58 -0.14 0.00 -0.64 0.00 0.00 41.12 39.73 2kl5 n ASP 47 CO 0.00 0.00 0.00 -0.31 0.13 0.00 0.00 177.20 177.02 2kl5 s TYR 48 N -2.12 -0.25 -0.19 1.24 2.02 -1.20 -0.80 117.35 116.05 2kl5 s TYR 48 Ca 0.00 0.51 0.01 0.00 -0.37 0.00 0.00 57.07 57.21 2kl5 s TYR 48 Cb 0.00 -0.27 0.02 0.00 -0.40 0.00 0.00 41.96 41.31 2kl5 s TYR 48 CO 0.00 -0.42 -0.18 0.42 -1.57 0.00 0.00 175.55 173.80 2kl5 s ILE 49 N 2.33 2.13 -0.19 2.71 -1.09 -0.62 -1.65 121.20 124.82 2kl5 s ILE 49 Ca 0.04 -0.98 -0.03 0.00 -2.23 0.00 0.00 60.65 57.45 2kl5 s ILE 49 Cb -0.14 -1.93 -0.01 0.00 -1.58 0.00 0.00 42.46 38.80 2kl5 s ILE 49 CO -0.09 0.48 -0.06 -0.69 -1.23 0.00 0.00 174.94 173.35 2kl5 s VAL 50 N 1.28 3.36 -0.11 2.92 1.01 -0.63 -1.35 120.40 126.88 2kl5 s VAL 50 Ca 0.04 -0.52 0.03 0.00 0.00 0.00 0.00 61.98 61.53 2kl5 s VAL 50 Cb -0.14 -2.49 0.00 0.00 0.00 0.00 0.00 36.38 33.75 2kl5 s VAL 50 CO -0.12 0.46 -0.22 -0.83 0.00 0.00 0.00 175.10 174.39 2kl5 s GLY 51 N 1.05 1.37 0.05 4.51 0.00 -0.56 -0.19 107.32 113.55 2kl5 s GLY 51 Ca 0.00 -0.99 0.07 0.00 0.00 0.00 0.00 44.72 43.80 2kl5 s GLY 51 CO -0.00 -0.24 -0.19 -0.35 0.00 0.00 0.00 173.10 172.32 2kl5 s ASP 52 N 0.45 2.21 -0.02 1.64 2.15 -1.14 -0.84 116.67 121.13 2kl5 s ASP 52 Ca -0.15 -0.53 -0.03 0.00 0.43 0.00 0.00 52.55 52.26 2kl5 s ASP 52 Cb -0.17 -0.16 -0.28 0.00 -0.30 0.00 0.00 42.92 42.01 2kl5 s ASP 52 CO 0.06 0.10 0.78 -0.50 -0.17 0.00 0.00 175.17 175.44 2kl5 h TRP 53 N 4.74 0.46 0.00 -5.34 4.06 -1.68 -3.04 115.95 115.15 2kl5 h TRP 53 Ca -0.42 -0.33 0.00 0.00 2.06 0.00 0.00 58.89 60.20 2kl5 h TRP 53 Cb 1.17 -0.02 0.00 0.00 -1.00 0.00 0.00 29.16 29.31 2kl5 h TRP 53 CO 0.53 1.42 0.00 0.41 -3.56 0.00 0.00 178.44 177.25 2kl5 n GLY 54 N 1.71 0.27 0.66 1.49 0.00 -1.26 0.22 105.19 108.28 2kl5 n GLY 54 Ca -0.19 0.72 0.06 0.00 0.00 0.00 0.00 46.02 46.61 2kl5 n GLY 54 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2kl5 n TYR 55 N 0.00 0.00 0.00 1.61 4.01 -1.26 -4.61 117.16 116.91 2kl5 n TYR 55 Ca 0.00 -0.92 0.00 0.00 -0.16 0.00 0.00 57.90 56.82 2kl5 n TYR 55 Cb 0.00 -0.17 0.00 0.00 -0.31 0.00 0.00 39.34 38.86 2kl5 n TYR 55 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2kl5 n GLY 56 N -0.66 0.70 3.23 2.72 0.00 0.97 -5.02 105.19 107.11 2kl5 n GLY 56 Ca 0.12 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.71 2kl5 n GLY 56 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2kl5 n GLN 57 N -1.62 3.58 -1.93 1.61 6.02 0.13 -4.97 117.38 120.21 2kl5 n GLN 57 Ca 0.00 -3.91 -0.34 0.00 -0.01 0.00 0.00 57.00 52.74 2kl5 n GLN 57 Cb 0.00 -2.89 -0.04 0.00 1.02 0.00 0.00 30.24 28.34 2kl5 n GLN 57 CO 0.00 0.00 0.00 -1.17 -1.01 0.00 0.00 177.06 174.88 2kl5 s LEU 58 N 0.24 3.26 0.08 1.08 1.98 -1.26 -4.48 118.68 119.58 2kl5 s LEU 58 Ca 0.39 0.25 0.08 0.00 -2.89 0.00 0.00 54.13 51.96 2kl5 s LEU 58 Cb 0.01 -2.53 -0.04 0.00 0.66 0.00 0.00 46.19 44.29 2kl5 s LEU 58 CO 0.00 -2.63 -0.19 -0.13 -1.89 0.00 0.00 176.35 171.51 2kl5 s ARG 59 N 7.36 1.89 -0.15 1.98 0.52 -1.15 -4.98 118.95 124.42 2kl5 s ARG 59 Ca 0.75 -1.10 -0.07 0.00 -0.52 0.00 0.00 55.73 54.79 2kl5 s ARG 59 Cb -0.12 -2.12 -0.04 0.00 0.52 0.00 0.00 34.95 33.18 2kl5 s ARG 59 CO 0.17 0.51 0.10 -0.51 0.02 0.00 0.00 175.30 175.58 2kl5 s LEU 60 N -1.76 4.10 -0.13 2.53 1.43 -1.26 -2.87 118.68 120.71 2kl5 s LEU 60 Ca 0.16 0.28 0.02 0.00 -1.03 0.00 0.00 54.13 53.55 2kl5 s LEU 60 Cb -0.10 -2.02 0.01 0.00 0.03 0.00 0.00 46.19 44.11 2kl5 s LEU 60 CO 0.07 0.29 -0.19 -0.75 0.23 0.00 0.00 176.35 176.01 2kl5 s LYS 61 N -0.34 2.65 0.13 1.70 2.47 0.74 -4.96 119.74 122.14 2kl5 s LYS 61 Ca 0.10 -0.72 -0.22 0.00 -1.56 0.00 0.00 55.97 53.58 2kl5 s LYS 61 Cb -0.12 -2.22 -0.07 0.00 -1.46 0.00 0.00 37.83 33.96 2kl5 s LYS 61 CO 0.01 -0.08 0.67 0.20 0.16 0.00 0.00 175.35 176.31 2kl5 s GLY 62 N 1.01 2.76 0.10 5.54 0.00 -1.26 -1.61 107.32 113.87 2kl5 s GLY 62 Ca -0.04 0.18 -0.01 0.00 0.00 0.00 0.00 44.72 44.85 2kl5 s GLY 62 CO -0.04 0.62 0.02 -1.36 0.00 0.00 0.00 173.10 172.34 2kl5 s PHE 63 N -1.18 0.77 0.26 1.90 0.08 -0.66 -5.00 117.98 114.16 2kl5 s PHE 63 Ca 0.33 -1.16 0.09 0.00 0.12 0.00 0.00 56.93 56.32 2kl5 s PHE 63 Cb -0.21 -0.47 -0.04 0.00 -0.57 0.00 0.00 43.02 41.74 2kl5 s PHE 63 CO 0.22 -0.44 0.02 -0.06 -0.10 0.00 0.00 175.22 174.86 2kl5 s PHE 64 N -3.97 2.76 -0.32 0.36 0.08 -1.26 -3.27 117.98 112.36 2kl5 s PHE 64 Ca 0.18 -0.20 -0.28 0.00 0.12 0.00 0.00 56.93 56.75 2kl5 s PHE 64 Cb 0.07 -1.23 -0.04 0.00 -0.57 0.00 0.00 43.02 41.26 2kl5 s PHE 64 CO -0.02 0.60 2.05 0.16 -0.10 0.00 0.00 175.22 177.91 2kl5 s ASP 65 N -3.64 5.50 -0.02 1.36 -4.77 -1.26 -4.87 116.67 108.98 2kl5 s ASP 65 Ca 0.31 1.48 -0.22 0.00 -3.30 0.00 0.00 52.55 50.82 2kl5 s ASP 65 Cb -0.07 -2.52 -0.14 0.00 -1.09 0.00 0.00 42.92 39.10 2kl5 s ASP 65 CO 0.20 -1.99 0.98 -0.78 0.70 0.00 0.00 175.17 174.29 2kl5 h ASP 66 N 14.69 -0.40 -0.09 2.11 3.58 -1.90 -3.36 116.42 131.04 2kl5 h ASP 66 Ca -0.35 -0.15 -0.64 0.00 0.42 0.00 0.00 57.03 56.31 2kl5 h ASP 66 Cb 1.21 0.10 0.01 0.00 1.72 0.00 0.00 39.33 42.37 2kl5 h ASP 66 CO 1.03 0.03 2.40 0.00 -2.88 0.00 0.00 179.24 179.82 2kl5 n GLN 67 N -5.12 1.97 -1.87 0.28 6.02 -1.26 -4.80 117.38 112.59 2kl5 n GLN 67 Ca -0.09 -2.19 -0.42 0.00 -0.01 0.00 0.00 57.00 54.30 2kl5 n GLN 67 Cb 0.27 -3.13 0.00 0.00 1.02 0.00 0.00 30.24 28.40 2kl5 n GLN 67 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 177.06 174.34 2kl5 n ASN 68 N 7.83 4.37 -3.68 1.08 2.85 -1.26 -4.81 115.26 121.64 2kl5 n ASN 68 Ca 0.50 -2.91 -0.03 0.00 -0.11 0.00 0.00 54.58 52.03 2kl5 n ASN 68 Cb 0.41 -1.61 -0.01 0.00 1.24 0.00 0.00 39.78 39.81 2kl5 n ASN 68 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 2kl5 s GLN 69 N 2.40 1.13 -0.90 1.20 1.03 -1.26 -5.10 119.66 118.16 2kl5 s GLN 69 Ca 0.46 -0.64 -0.24 0.00 0.04 0.00 0.00 55.36 54.97 2kl5 s GLN 69 Cb 0.13 0.37 0.01 0.00 0.03 0.00 0.00 33.01 33.55 2kl5 s GLN 69 CO -0.06 -0.52 1.64 0.15 -2.54 0.00 0.00 175.29 173.95 2kl5 s LYS 70 N -3.03 3.09 0.04 9.60 3.01 -1.26 -4.90 119.74 126.28 2kl5 s LYS 70 Ca 0.14 -0.55 0.06 0.00 -1.01 0.00 0.00 55.97 54.61 2kl5 s LYS 70 Cb -0.01 -5.01 -0.02 0.00 -1.01 0.00 0.00 37.83 31.78 2kl5 s LYS 70 CO 0.02 -2.65 -0.16 0.00 0.51 0.00 0.00 175.35 173.07 2kl5 s ALA 71 N 7.23 1.37 -0.50 5.17 0.00 -1.26 -5.02 121.76 128.75 2kl5 s ALA 71 Ca 0.55 -0.88 0.16 0.00 0.00 0.00 0.00 51.96 51.79 2kl5 s ALA 71 Cb -0.05 -0.25 0.83 0.00 0.00 0.00 0.00 23.12 23.65 2kl5 s ALA 71 CO -0.00 0.28 1.50 2.41 0.00 0.00 0.00 175.76 179.95 2kl5 n THR 72 N 1.96 1.22 -3.39 0.00 -1.04 -1.26 -3.74 114.28 108.03 2kl5 n THR 72 Ca -0.17 0.55 -0.25 0.00 -2.04 0.00 0.00 64.05 62.14 2kl5 n THR 72 Cb 0.54 -1.52 -0.10 0.00 -1.82 0.00 0.00 70.33 67.44 2kl5 n THR 72 CO 0.00 0.00 0.00 0.72 -0.64 0.00 0.00 175.07 175.15 2kl5 s PHE 73 N -3.34 0.48 0.29 -1.42 -0.71 -1.26 -4.99 117.98 107.03 2kl5 s PHE 73 Ca 0.00 -1.58 -0.01 0.00 -1.04 0.00 0.00 56.93 54.30 2kl5 s PHE 73 Cb 0.06 -0.74 0.42 0.00 -1.21 0.00 0.00 43.02 41.55 2kl5 s PHE 73 CO 0.19 -0.88 1.87 1.49 -1.34 0.00 0.00 175.22 176.55 2kl5 h GLU 74 N 6.58 0.89 0.00 1.99 4.81 -1.88 -3.14 114.58 123.83 2kl5 h GLU 74 Ca 0.11 -0.14 0.00 0.00 -0.13 0.00 0.00 59.36 59.20 2kl5 h GLU 74 Cb 0.98 -0.15 0.00 0.00 0.63 0.00 0.00 28.75 30.21 2kl5 h GLU 74 CO 0.26 0.73 0.00 0.25 -0.73 0.00 0.00 179.01 179.53 2kl5 n THR 75 N -4.31 0.43 -1.68 0.32 -2.24 -1.26 -4.11 114.28 101.42 2kl5 n THR 75 Ca 0.05 0.11 -0.42 0.00 -2.27 0.00 0.00 64.05 61.52 2kl5 n THR 75 Cb 0.17 -0.99 -0.01 0.00 -2.10 0.00 0.00 70.33 67.40 2kl5 n THR 75 CO 0.00 0.00 0.00 1.17 -0.57 0.00 0.00 175.07 175.67 2kl5 n LYS 76 N -1.14 2.70 -2.20 -0.78 3.00 -1.19 -4.93 118.16 113.62 2kl5 n LYS 76 Ca 0.04 -2.52 -0.43 0.00 -0.00 0.00 0.00 58.31 55.40 2kl5 n LYS 76 Cb 0.04 -3.25 -0.02 0.00 0.00 0.00 0.00 35.03 31.79 2kl5 n LYS 76 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.40 177.82 2kl5 s ILE 77 N 3.42 3.79 0.11 3.15 1.01 -1.26 -4.59 121.20 126.84 2kl5 s ILE 77 Ca 0.48 0.86 -0.30 0.00 0.00 0.00 0.00 60.65 61.70 2kl5 s ILE 77 Cb 0.14 -3.88 -0.10 0.00 0.01 0.00 0.00 42.46 38.63 2kl5 s ILE 77 CO -0.06 -0.44 1.60 -1.28 0.00 0.00 0.00 174.94 174.76 2kl5 h SER 78 N 10.77 -1.07 -0.20 3.58 0.87 -1.94 0.26 113.55 125.82 2kl5 h SER 78 Ca -0.31 0.12 0.06 0.00 -1.23 0.00 0.00 61.79 60.43 2kl5 h SER 78 Cb 1.13 0.40 -0.01 0.00 -0.44 0.00 0.00 62.40 63.48 2kl5 h SER 78 CO 1.03 -0.46 0.21 0.00 -0.53 0.00 0.00 176.83 177.08 2kl5 h THR 79 N -0.63 0.49 0.06 2.23 1.03 -1.95 0.12 112.91 114.26 2kl5 h THR 79 Ca 0.02 0.00 -0.23 0.00 -0.01 0.00 0.00 66.41 66.19 2kl5 h THR 79 Cb 0.64 0.83 0.02 0.00 -1.07 0.00 0.00 68.15 68.57 2kl5 h THR 79 CO -0.19 0.00 -0.92 0.25 -0.01 0.00 0.00 175.52 174.64 2kl5 h LEU 80 N 0.00 0.71 -0.82 0.00 5.85 -1.67 -2.83 115.31 116.55 2kl5 h LEU 80 Ca 0.10 -0.81 0.04 0.00 0.84 0.00 0.00 57.88 58.05 2kl5 h LEU 80 Cb 0.52 -0.22 -0.05 0.00 0.37 0.00 0.00 40.66 41.28 2kl5 h LEU 80 CO -0.00 1.43 0.52 -0.78 -0.34 0.00 0.00 178.44 179.27 2kl5 h ASP 81 N 0.07 0.85 -0.71 1.25 3.58 0.12 0.20 116.42 121.78 2kl5 h ASP 81 Ca -0.13 0.00 -0.02 0.00 0.42 0.00 0.00 57.03 57.30 2kl5 h ASP 81 Cb 1.63 -0.18 -0.03 0.00 1.72 0.00 0.00 39.33 42.47 2kl5 h ASP 81 CO 0.18 0.57 0.37 -0.33 -2.88 0.00 0.00 179.24 177.15 2kl5 h GLU 82 N 0.99 1.00 -0.05 0.28 5.08 -1.34 -0.29 114.58 120.25 2kl5 h GLU 82 Ca 0.34 -0.13 0.00 0.00 -1.00 0.00 0.00 59.36 58.57 2kl5 h GLU 82 Cb 0.05 -0.19 -0.00 0.00 0.50 0.00 0.00 28.75 29.11 2kl5 h GLU 82 CO -0.13 0.76 0.03 -0.92 -1.00 0.00 0.00 179.01 177.76 2kl5 h TYR 83 N 0.98 0.07 -0.85 4.33 5.03 -0.96 -2.46 116.97 123.10 2kl5 h TYR 83 Ca 0.25 0.00 0.05 0.00 2.58 0.00 0.00 58.73 61.60 2kl5 h TYR 83 Cb 0.07 -0.02 -0.05 0.00 1.55 0.00 0.00 36.73 38.28 2kl5 h TYR 83 CO 0.00 0.04 0.56 0.82 -1.32 0.00 0.00 178.16 178.26 2kl5 h ILE 84 N 0.07 1.11 -0.22 1.81 1.08 -0.33 -1.22 117.51 119.80 2kl5 h ILE 84 Ca 0.02 -0.35 -0.04 0.00 -0.39 0.00 0.00 64.86 64.10 2kl5 h ILE 84 Cb -0.00 0.00 -0.01 0.00 -3.07 0.00 0.00 36.82 33.73 2kl5 h ILE 84 CO -0.00 0.19 -0.02 0.22 -0.69 0.00 0.00 178.15 177.84 2kl5 h TYR 85 N 1.02 0.34 0.31 1.37 3.20 -0.66 0.21 116.97 122.76 2kl5 h TYR 85 Ca 0.35 -0.02 -0.02 0.00 3.14 0.00 0.00 58.73 62.18 2kl5 h TYR 85 Cb 0.09 -0.10 0.00 0.00 1.54 0.00 0.00 36.73 38.27 2kl5 h TYR 85 CO -0.00 0.37 -0.15 0.93 -1.64 0.00 0.00 178.16 177.67 2kl5 h GLU 86 N 0.32 -0.40 0.00 1.82 5.08 -0.79 -3.42 114.58 117.19 2kl5 h GLU 86 Ca 0.07 0.03 -0.18 0.00 -1.00 0.00 0.00 59.36 58.29 2kl5 h GLU 86 Cb 0.26 0.09 -0.02 0.00 0.50 0.00 0.00 28.75 29.57 2kl5 h GLU 86 CO 0.01 -0.25 -0.95 1.88 -1.00 0.00 0.00 179.01 178.69 2kl5 h TYR 87 N -1.11 0.02 -0.37 4.33 -1.99 -1.45 -3.40 116.97 113.00 2kl5 h TYR 87 Ca -0.04 -0.01 -0.70 0.00 2.00 0.00 0.00 58.73 59.98 2kl5 h TYR 87 Cb 0.34 -0.00 -0.06 0.00 2.00 0.00 0.00 36.73 39.01 2kl5 h TYR 87 CO 0.00 1.37 2.74 0.00 -0.00 0.00 0.00 178.16 182.28 2kl5 h ASN 89 N 6.66 0.00 -4.39 0.00 -1.24 -1.79 -3.42 115.58 111.39 2kl5 h ASN 89 Ca 0.52 -0.53 0.01 0.00 0.71 0.00 0.00 56.30 57.01 2kl5 h ASN 89 Cb 0.74 0.00 -0.21 0.00 0.73 0.00 0.00 38.32 39.57 2kl5 h ASN 89 CO 1.71 0.94 0.35 0.12 -1.29 0.00 0.00 177.43 179.26 2kl5 s PHE 90 N -2.08 -0.54 -0.58 0.67 5.36 -1.26 -4.93 117.98 114.62 2kl5 s PHE 90 Ca -0.16 1.01 0.00 0.00 -0.96 0.00 0.00 56.93 56.82 2kl5 s PHE 90 Cb 0.00 0.41 0.00 0.00 -0.34 0.00 0.00 43.02 43.09 2kl5 s PHE 90 CO 0.44 -0.45 0.00 0.41 -1.46 0.00 0.00 175.22 174.16 2kl5 n GLY 91 N 1.12 0.74 3.94 13.12 0.00 -1.26 -5.00 105.19 117.85 2kl5 n GLY 91 Ca -0.14 -0.28 -0.24 0.00 0.00 0.00 0.00 46.02 45.35 2kl5 n GLY 91 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2kl5 s ALA 93 N -2.60 -1.63 0.32 0.00 0.00 -1.26 -4.65 121.76 111.94 2kl5 s ALA 93 Ca 0.48 0.44 0.10 0.00 0.00 0.00 0.00 51.96 52.99 2kl5 s ALA 93 Cb -0.10 -2.27 -0.06 0.00 0.00 0.00 0.00 23.12 20.70 2kl5 s ALA 93 CO 0.39 -1.82 -0.10 1.52 0.00 0.00 0.00 175.76 175.75 2kl5 s TYR 94 N 2.56 2.41 -0.00 0.00 1.13 -1.18 -2.25 117.35 120.02 2kl5 s TYR 94 Ca 0.10 -0.42 -0.03 0.00 -1.41 0.00 0.00 57.07 55.32 2kl5 s TYR 94 Cb -0.11 -1.27 -0.00 0.00 -1.10 0.00 0.00 41.96 39.47 2kl5 s TYR 94 CO -0.27 0.61 0.05 -0.59 -2.51 0.00 0.00 175.55 172.84 2kl5 s PHE 95 N -2.54 0.07 -0.20 -3.49 -0.12 -0.02 -0.67 117.98 111.01 2kl5 s PHE 95 Ca 0.32 -0.15 0.01 0.00 -0.05 0.00 0.00 56.93 57.07 2kl5 s PHE 95 Cb -0.01 -0.07 0.03 0.00 -0.63 0.00 0.00 43.02 42.34 2kl5 s PHE 95 CO 0.17 -0.16 -0.18 0.08 -0.05 0.00 0.00 175.22 175.08 2kl5 s VAL 96 N -0.87 2.07 -0.16 -2.49 1.01 0.62 -1.50 120.40 119.08 2kl5 s VAL 96 Ca -0.10 -1.08 -0.07 0.00 0.00 0.00 0.00 61.98 60.74 2kl5 s VAL 96 Cb -0.06 -1.94 -0.04 0.00 0.00 0.00 0.00 36.38 34.35 2kl5 s VAL 96 CO 0.00 0.42 0.06 -0.76 0.00 0.00 0.00 175.10 174.82 2kl5 s LEU 97 N 1.26 3.83 -0.17 3.92 1.02 -0.45 -1.58 118.68 126.50 2kl5 s LEU 97 Ca 0.02 0.13 -0.05 0.00 0.02 0.00 0.00 54.13 54.25 2kl5 s LEU 97 Cb -0.14 -1.95 -0.03 0.00 0.02 0.00 0.00 46.19 44.08 2kl5 s LEU 97 CO -0.11 0.23 -0.00 -0.75 0.02 0.00 0.00 176.35 175.73 2kl5 s LYS 98 N 0.06 3.74 -0.06 1.70 2.20 -0.62 -1.59 119.74 125.17 2kl5 s LYS 98 Ca 0.05 -0.47 -0.30 0.00 -0.36 0.00 0.00 55.97 54.90 2kl5 s LYS 98 Cb -0.12 -3.04 -0.02 0.00 -1.51 0.00 0.00 37.83 33.14 2kl5 s LYS 98 CO 0.01 0.20 1.05 0.50 -0.36 0.00 0.00 175.35 176.75 2kl5 s ARG 99 N 0.51 4.44 0.08 4.03 3.52 0.02 -1.27 118.95 130.28 2kl5 s ARG 99 Ca -0.01 1.48 -0.34 0.00 -0.13 0.00 0.00 55.73 56.74 2kl5 s ARG 99 Cb -0.14 -3.51 -0.17 0.00 -1.56 0.00 0.00 34.95 29.57 2kl5 s ARG 99 CO 0.02 -0.28 1.60 0.82 -0.81 0.00 0.00 175.30 176.66 2kl5 h ILE 100 N 4.97 0.21 0.00 4.11 1.08 -1.32 -3.48 117.51 123.09 2kl5 h ILE 100 Ca -0.35 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.12 2kl5 h ILE 100 Cb 1.17 0.21 0.00 0.00 -3.07 0.00 0.00 36.82 35.13 2kl5 h ILE 100 CO 0.83 0.00 0.00 -1.14 -0.69 0.00 0.00 178.15 177.15 2kl5 n ARG 101 N -5.52 0.00 -1.41 2.37 0.63 -1.26 -5.13 116.66 106.34 2kl5 n ARG 101 Ca -0.13 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.80 2kl5 n ARG 101 Cb 0.41 0.00 0.00 0.00 0.45 0.00 0.00 32.46 33.32 2kl5 n ARG 101 CO 0.00 0.00 0.00 1.63 -2.51 0.00 0.00 177.63 176.75 2kl5 n LYS 102 N 0.00 0.00 -3.92 -0.14 5.02 -1.26 -4.98 118.16 112.88 2kl5 n LYS 102 Ca 0.00 0.00 -0.28 0.00 -2.02 0.00 0.00 58.31 56.01 2kl5 n LYS 102 Cb 0.00 0.00 -0.16 0.00 -0.02 0.00 0.00 35.03 34.85 2kl5 n LYS 102 CO 0.00 0.00 0.00 -1.17 -0.52 0.00 0.00 177.40 175.71 2kl5 s LEU 103 N 0.00 1.64 -0.97 -0.35 1.98 -1.26 -3.13 118.68 116.59 2kl5 s LEU 103 Ca 0.00 -0.62 -0.25 0.00 -2.89 0.00 0.00 54.13 50.38 2kl5 s LEU 103 Cb 0.00 -0.97 -0.09 0.00 0.66 0.00 0.00 46.19 45.80 2kl5 s LEU 103 CO 0.00 -0.16 2.04 -0.70 -1.89 0.00 0.00 176.35 175.64 2kl5 s GLU 104 N 1.60 2.26 -0.47 1.98 2.12 -1.26 -4.77 118.70 120.17 2kl5 s GLU 104 Ca 0.02 -0.39 -0.04 0.00 0.36 0.00 0.00 54.97 54.92 2kl5 s GLU 104 Cb -0.15 -5.05 0.01 0.00 0.26 0.00 0.00 34.13 29.20 2kl5 s GLU 104 CO -0.08 -3.89 2.87 -2.39 -0.54 0.00 0.00 175.26 171.23 2kl5 n HIS 105 N 15.36 1.44 0.00 5.30 1.44 -1.26 -4.78 115.22 132.72 2kl5 n HIS 105 Ca 0.43 -1.95 0.00 0.00 -2.01 0.00 0.00 57.72 54.18 2kl5 n HIS 105 Cb 0.46 -1.46 0.00 0.00 0.12 0.00 0.00 29.99 29.11 2kl5 n HIS 105 CO 0.00 0.00 0.00 1.58 -2.81 0.00 0.00 176.34 175.11 2kl5 n HIS 106 N 1.21 0.00 -3.21 -1.40 -0.00 -1.26 -4.82 115.22 105.75 2kl5 n HIS 106 Ca 0.49 0.00 -0.00 0.00 -0.00 0.00 0.00 57.72 58.21 2kl5 n HIS 106 Cb 0.58 -0.19 -0.02 0.00 -0.00 0.00 0.00 29.99 30.36 2kl5 n HIS 106 CO 0.00 0.00 0.00 -1.01 -0.00 0.00 0.00 176.34 175.33 2kl5 s HIS 107 N -1.75 -1.49 -1.03 1.57 3.76 -1.26 -5.09 115.29 109.99 2kl5 s HIS 107 Ca 0.00 1.06 -0.15 0.00 -0.15 0.00 0.00 55.06 55.82 2kl5 s HIS 107 Cb 0.00 0.25 0.17 0.00 1.11 0.00 0.00 32.58 34.11 2kl5 s HIS 107 CO 0.00 -0.97 1.18 -1.58 -0.85 0.00 0.00 174.74 172.52 2kl5 s HIS 108 N 2.74 3.48 0.00 1.40 2.46 -1.26 -4.55 115.29 119.56 2kl5 s HIS 108 Ca 0.13 -1.88 0.00 0.00 0.47 0.00 0.00 55.06 53.78 2kl5 s HIS 108 Cb -0.12 -4.18 0.00 0.00 -0.13 0.00 0.00 32.58 28.15 2kl5 s HIS 108 CO -0.24 -1.33 0.00 1.58 -2.47 0.00 0.00 174.74 172.28 2kl5 n HIS 109 N 5.43 0.00 0.63 3.88 -0.00 -1.26 -5.27 115.22 118.63 2kl5 n HIS 109 Ca 0.27 0.00 0.08 0.00 0.46 0.00 0.00 57.72 58.53 2kl5 n HIS 109 Cb 0.45 0.00 0.06 0.00 -0.12 0.00 0.00 29.99 30.39 2kl5 n HIS 109 CO 0.00 0.00 0.00 1.58 0.46 0.00 0.00 176.34 178.38