#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 0.01 0.00 3.17 1.10 -1.26 -5.13 121.20 119.09 2kl5 s ILE 2 Ca 0.00 -0.10 0.00 0.00 -0.51 0.00 0.00 60.65 60.04 2kl5 s ILE 2 Cb 0.00 -0.61 0.00 0.00 0.15 0.00 0.00 42.46 42.00 2kl5 s ILE 2 CO 0.00 -0.06 0.00 0.61 -2.11 0.00 0.00 174.94 173.38 2kl5 n GLY 3 N 2.43 3.06 0.00 1.50 0.00 -1.26 -4.80 105.19 106.12 2kl5 n GLY 3 Ca -0.15 -0.17 0.00 0.00 0.00 0.00 0.00 46.02 45.70 2kl5 n GLY 3 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2kl5 n MET 4 N 0.00 0.00 0.00 1.61 2.81 -1.26 -4.70 117.12 115.58 2kl5 n MET 4 Ca 0.00 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.89 2kl5 n MET 4 Cb 0.00 -0.66 0.00 0.00 -0.71 0.00 0.00 33.22 31.85 2kl5 n MET 4 CO 0.00 0.00 0.00 0.45 1.51 0.00 0.00 175.97 177.93 2kl5 n SER 5 N -0.49 0.00 -3.36 7.83 2.88 -1.26 -4.87 113.62 114.35 2kl5 n SER 5 Ca 0.00 0.00 -0.20 0.00 -1.33 0.00 0.00 58.87 57.34 2kl5 n SER 5 Cb 0.00 0.00 -0.06 0.00 -0.75 0.00 0.00 64.21 63.40 2kl5 n SER 5 CO 0.00 0.00 0.00 -1.84 -1.23 0.00 0.00 175.04 171.97 2kl5 n GLU 6 N -0.00 0.59 -0.48 -1.46 -0.00 -1.26 -5.06 120.64 112.96 2kl5 n GLU 6 Ca 0.00 -2.85 0.03 0.00 -0.00 0.00 0.00 57.16 54.33 2kl5 n GLU 6 Cb 0.00 1.68 0.04 0.00 -0.00 0.00 0.00 31.44 33.16 2kl5 n GLU 6 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.13 178.76 2kl5 n LYS 7 N -0.72 0.32 -4.13 3.44 5.02 -1.26 -5.09 118.16 115.73 2kl5 n LYS 7 Ca -0.03 -1.48 -0.28 0.00 -2.02 0.00 0.00 58.31 54.51 2kl5 n LYS 7 Cb 0.51 -0.71 -0.07 0.00 -0.02 0.00 0.00 35.03 34.74 2kl5 n LYS 7 CO 0.00 0.00 0.00 0.50 -0.52 0.00 0.00 177.40 177.38 2kl5 s ARG 8 N -0.71 2.66 -0.40 1.97 3.52 -1.26 -5.05 118.95 119.69 2kl5 s ARG 8 Ca 0.10 -0.92 0.10 0.00 -0.13 0.00 0.00 55.73 54.88 2kl5 s ARG 8 Cb 0.10 -2.54 0.34 0.00 -1.56 0.00 0.00 34.95 31.29 2kl5 s ARG 8 CO -0.01 0.49 0.86 0.41 -0.81 0.00 0.00 175.30 176.24 2kl5 n GLY 9 N 0.00 2.64 0.27 8.12 0.00 -1.26 -5.02 105.19 109.95 2kl5 n GLY 9 Ca -0.09 -1.14 -0.13 0.00 0.00 0.00 0.00 46.02 44.66 2kl5 n GLY 9 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2kl5 h GLU 10 N 3.00 -0.60 -2.29 1.61 4.81 -1.96 -3.39 114.58 115.75 2kl5 h GLU 10 Ca 0.04 0.04 -0.57 0.00 -0.13 0.00 0.00 59.36 58.74 2kl5 h GLU 10 Cb 1.01 0.14 -0.37 0.00 0.63 0.00 0.00 28.75 30.16 2kl5 h GLU 10 CO 0.38 -0.31 -0.96 -0.89 -0.73 0.00 0.00 179.01 176.51 2kl5 n ILE 11 N -5.22 -1.17 -2.63 2.32 5.41 -1.26 -5.04 119.36 111.78 2kl5 n ILE 11 Ca -0.10 -3.31 -0.43 0.00 1.00 0.00 0.00 62.75 59.91 2kl5 n ILE 11 Cb 0.30 -1.53 -0.02 0.00 -0.71 0.00 0.00 39.64 37.68 2kl5 n ILE 11 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2kl5 s MET 12 N 0.08 3.62 -0.54 0.38 0.23 -1.26 -2.16 119.30 119.66 2kl5 s MET 12 Ca 0.33 0.39 -0.14 0.00 -1.03 0.00 0.00 55.69 55.24 2kl5 s MET 12 Cb 0.04 -3.95 0.13 0.00 -1.53 0.00 0.00 34.83 29.52 2kl5 s MET 12 CO -0.19 -1.47 0.48 0.42 -2.03 0.00 0.00 175.02 172.23 2kl5 s ILE 13 N 4.52 5.00 -0.32 3.16 -1.09 0.19 -4.93 121.20 127.75 2kl5 s ILE 13 Ca 0.45 -1.61 -0.18 0.00 -2.23 0.00 0.00 60.65 57.08 2kl5 s ILE 13 Cb -0.08 -4.22 -0.01 0.00 -1.58 0.00 0.00 42.46 36.57 2kl5 s ILE 13 CO 0.29 -0.86 0.52 -0.76 -1.23 0.00 0.00 174.94 172.90 2kl5 s LEU 14 N 1.48 4.22 -0.08 2.97 1.02 -1.26 -0.64 118.68 126.39 2kl5 s LEU 14 Ca 0.04 0.19 -0.04 0.00 0.02 0.00 0.00 54.13 54.35 2kl5 s LEU 14 Cb -0.28 -2.62 0.04 0.00 0.02 0.00 0.00 46.19 43.34 2kl5 s LEU 14 CO 0.02 -0.41 0.18 -0.51 0.02 0.00 0.00 176.35 175.64 2kl5 s ILE 15 N 2.38 -0.04 -1.07 -0.59 2.07 -0.23 -4.96 121.20 118.76 2kl5 s ILE 15 Ca 0.20 0.14 -0.17 0.00 -1.41 0.00 0.00 60.65 59.40 2kl5 s ILE 15 Cb -0.15 -0.28 -0.01 0.00 0.13 0.00 0.00 42.46 42.15 2kl5 s ILE 15 CO 0.12 0.06 0.77 0.00 -1.91 0.00 0.00 174.94 173.97 2kl5 n GLN 16 N 3.98 -1.23 -0.86 3.50 1.13 -1.26 -1.92 117.38 120.72 2kl5 n GLN 16 Ca -0.24 0.58 0.00 0.00 -1.94 0.00 0.00 57.00 55.40 2kl5 n GLN 16 Cb 0.53 -4.04 0.00 0.00 0.11 0.00 0.00 30.24 26.84 2kl5 n GLN 16 CO 0.00 0.00 0.00 -1.71 -1.44 0.00 0.00 177.06 173.91 2kl5 n ASN 17 N -2.57 -2.80 -4.16 1.08 5.15 -1.26 -4.94 115.26 105.76 2kl5 n ASN 17 Ca -0.11 0.00 -0.28 0.00 -0.60 0.00 0.00 54.58 53.59 2kl5 n ASN 17 Cb 0.59 -2.11 -0.16 0.00 -0.53 0.00 0.00 39.78 37.56 2kl5 n ASN 17 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2kl5 s ALA 18 N -1.64 1.74 -0.21 5.20 0.00 -0.81 -4.97 121.76 121.06 2kl5 s ALA 18 Ca 0.00 -0.77 -0.15 0.00 0.00 0.00 0.00 51.96 51.04 2kl5 s ALA 18 Cb 0.00 -0.61 -0.04 0.00 0.00 0.00 0.00 23.12 22.47 2kl5 s ALA 18 CO 0.00 0.28 0.35 -2.00 0.00 0.00 0.00 175.76 174.39 2kl5 s GLU 19 N 0.17 4.15 0.33 0.00 2.12 -1.26 -1.06 118.70 123.15 2kl5 s GLU 19 Ca -0.09 0.10 0.07 0.00 0.36 0.00 0.00 54.97 55.42 2kl5 s GLU 19 Cb -0.14 -3.54 -0.06 0.00 0.26 0.00 0.00 34.13 30.65 2kl5 s GLU 19 CO 0.04 -0.02 -0.05 -0.06 -0.54 0.00 0.00 175.26 174.63 2kl5 s PHE 20 N 1.27 2.20 0.02 5.30 0.40 0.18 0.84 117.98 128.19 2kl5 s PHE 20 Ca 0.17 -0.65 -0.12 0.00 -0.60 0.00 0.00 56.93 55.73 2kl5 s PHE 20 Cb -0.14 -1.32 0.01 0.00 0.51 0.00 0.00 43.02 42.08 2kl5 s PHE 20 CO 0.07 0.39 0.24 -1.83 0.70 0.00 0.00 175.22 174.79 2kl5 s GLU 21 N -3.70 0.68 -0.62 0.44 -1.05 -1.03 0.57 118.70 113.99 2kl5 s GLU 21 Ca 0.32 -0.44 -0.27 0.00 -0.15 0.00 0.00 54.97 54.44 2kl5 s GLU 21 Cb 0.05 0.29 -0.01 0.00 -0.44 0.00 0.00 34.13 34.02 2kl5 s GLU 21 CO 0.15 -0.19 1.70 -1.17 0.95 0.00 0.00 175.26 176.70 2kl5 s LEU 22 N -1.74 3.29 0.00 1.83 2.96 -0.92 -2.22 118.68 121.87 2kl5 s LEU 22 Ca -0.09 0.23 0.24 0.00 -0.22 0.00 0.00 54.13 54.29 2kl5 s LEU 22 Cb -0.03 -2.64 0.34 0.00 0.50 0.00 0.00 46.19 44.36 2kl5 s LEU 22 CO -0.00 -2.18 1.29 1.33 -1.32 0.00 0.00 176.35 175.47 2kl5 n VAL 23 N 7.03 0.00 -3.64 1.68 0.24 -0.17 -4.77 118.33 118.70 2kl5 n VAL 23 Ca 0.16 -0.06 -0.09 0.00 -2.04 0.00 0.00 64.34 62.31 2kl5 n VAL 23 Cb 0.51 0.58 -0.07 0.00 -1.47 0.00 0.00 33.84 33.39 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 -2.81 -0.94 0.11 6.34 5.65 -1.06 -5.00 115.29 117.58 2kl5 s HIS 24 Ca 0.15 1.99 0.05 0.00 0.25 0.00 0.00 55.06 57.50 2kl5 s HIS 24 Cb 0.18 0.51 -0.04 0.00 -1.18 0.00 0.00 32.58 32.05 2kl5 s HIS 24 CO 0.68 -0.46 -0.13 1.21 -0.65 0.00 0.00 174.74 175.39 2kl5 s ASN 25 N 1.21 1.84 -0.15 9.88 3.84 -1.26 -0.79 114.94 129.50 2kl5 s ASN 25 Ca -0.07 -0.80 -0.04 0.00 0.21 0.00 0.00 52.86 52.16 2kl5 s ASN 25 Cb -0.05 -0.05 0.06 0.00 -0.55 0.00 0.00 41.25 40.66 2kl5 s ASN 25 CO -0.13 -0.17 0.10 0.12 -2.79 0.00 0.00 177.10 174.23 2kl5 s PHE 26 N -2.16 0.11 -1.69 0.43 2.19 -0.45 -4.87 117.98 111.54 2kl5 s PHE 26 Ca 0.07 -0.13 0.00 0.00 0.33 0.00 0.00 56.93 57.20 2kl5 s PHE 26 Cb -0.05 -0.61 0.00 0.00 -1.31 0.00 0.00 43.02 41.06 2kl5 s PHE 26 CO 0.02 -0.46 0.00 1.17 1.83 0.00 0.00 175.22 177.78 2kl5 n LYS 27 N 5.29 -1.11 -3.63 10.12 4.81 -1.26 -2.04 118.16 130.34 2kl5 n LYS 27 Ca -0.06 1.06 -0.22 0.00 -0.87 0.00 0.00 58.31 58.22 2kl5 n LYS 27 Cb 0.49 -5.24 0.06 0.00 0.02 0.00 0.00 35.03 30.36 2kl5 n LYS 27 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 2kl5 n ASP 28 N -0.57 -2.76 -0.35 3.14 9.92 -1.26 -4.88 116.55 119.79 2kl5 n ASP 28 Ca -0.16 -0.71 0.02 0.00 -0.53 0.00 0.00 54.79 53.42 2kl5 n ASP 28 Cb 0.52 -4.52 0.07 0.00 -0.64 0.00 0.00 41.12 36.56 2kl5 n ASP 28 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2kl5 n GLY 29 N -1.52 -0.04 3.59 0.44 0.00 -0.87 -4.81 105.19 101.99 2kl5 n GLY 29 Ca -0.20 -0.17 -0.43 0.00 0.00 0.00 0.00 46.02 45.22 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 -1.74 3.02 -0.19 1.61 5.36 -1.26 -4.70 117.98 120.07 2kl5 s PHE 30 Ca 0.11 0.61 0.01 0.00 -0.96 0.00 0.00 56.93 56.70 2kl5 s PHE 30 Cb 0.06 -3.77 0.03 0.00 -0.34 0.00 0.00 43.02 39.00 2kl5 s PHE 30 CO 0.07 -0.93 -0.16 -0.80 -1.46 0.00 0.00 175.22 171.94 2kl5 s ASN 31 N 2.03 3.25 0.14 6.13 0.02 -1.26 -5.03 114.94 120.21 2kl5 s ASN 31 Ca 0.37 -0.75 -0.19 0.00 -1.02 0.00 0.00 52.86 51.27 2kl5 s ASN 31 Cb -0.11 -1.37 0.00 0.00 0.02 0.00 0.00 41.25 39.79 2kl5 s ASN 31 CO 0.22 -0.07 1.72 -0.08 0.02 0.00 0.00 177.10 178.92 2kl5 h GLU 32 N 7.95 0.11 -0.62 -0.60 4.81 -1.99 0.16 114.58 124.40 2kl5 h GLU 32 Ca -0.37 -0.01 0.04 0.00 -0.13 0.00 0.00 59.36 58.89 2kl5 h GLU 32 Cb 1.12 -0.02 -0.04 0.00 0.63 0.00 0.00 28.75 30.43 2kl5 h GLU 32 CO 0.56 0.07 0.37 1.05 -0.73 0.00 0.00 179.01 180.33 2kl5 h GLU 33 N 0.11 0.69 -0.61 1.92 4.11 -1.99 0.80 114.58 119.60 2kl5 h GLU 33 Ca 0.12 -0.04 -0.06 0.00 0.07 0.00 0.00 59.36 59.45 2kl5 h GLU 33 Cb 0.14 -0.16 -0.03 0.00 0.50 0.00 0.00 28.75 29.20 2kl5 h GLU 33 CO -0.18 0.46 0.15 0.00 0.07 0.00 0.00 179.01 179.50 2kl5 h ALA 34 N 1.29 1.10 0.79 1.06 0.00 -1.86 -0.03 119.26 121.61 2kl5 h ALA 34 Ca 0.26 -0.23 -0.04 0.00 0.00 0.00 0.00 54.91 54.91 2kl5 h ALA 34 Cb 0.08 -0.24 0.01 0.00 0.00 0.00 0.00 17.79 17.63 2kl5 h ALA 34 CO -0.13 0.60 -0.38 0.35 0.00 0.00 0.00 179.25 179.69 2kl5 h PHE 35 N 0.92 -0.98 -0.19 0.00 3.57 0.00 -2.45 116.94 117.81 2kl5 h PHE 35 Ca 0.20 -0.02 -0.13 0.00 3.53 0.00 0.00 57.97 61.54 2kl5 h PHE 35 Cb 0.33 0.32 -0.01 0.00 2.79 0.00 0.00 35.95 39.38 2kl5 h PHE 35 CO 0.02 -0.60 -0.43 1.57 -2.23 0.00 0.00 178.31 176.65 2kl5 h LYS 36 N -1.21 0.46 0.00 1.11 2.10 -0.83 -0.35 116.57 117.86 2kl5 h LYS 36 Ca -0.11 -0.24 -0.14 0.00 -2.00 0.00 0.00 60.65 58.16 2kl5 h LYS 36 Cb 0.82 0.01 -0.02 0.00 -0.90 0.00 0.00 32.23 32.14 2kl5 h LYS 36 CO 0.18 0.81 -0.66 0.00 -2.00 0.00 0.00 179.45 177.77 2kl5 h ALA 37 N 1.16 0.71 -0.46 0.07 0.00 -1.08 -3.10 119.26 116.58 2kl5 h ALA 37 Ca 0.03 -0.60 0.00 0.00 0.00 0.00 0.00 54.91 54.34 2kl5 h ALA 37 Cb 0.91 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.59 2kl5 h ALA 37 CO 0.08 0.82 0.00 0.54 0.00 0.00 0.00 179.25 180.69 2kl5 n ARG 38 N -3.47 2.74 -2.18 0.00 5.12 -0.92 -4.98 116.66 112.97 2kl5 n ARG 38 Ca 0.00 -2.22 -0.42 0.00 -1.93 0.00 0.00 57.85 53.28 2kl5 n ARG 38 Cb 0.72 -1.37 -0.03 0.00 -1.16 0.00 0.00 32.46 30.63 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 -1.02 2.44 -0.13 -1.55 5.04 -0.15 -4.53 117.35 117.45 2kl5 s TYR 39 Ca 0.31 0.58 -0.19 0.00 -2.44 0.00 0.00 57.07 55.33 2kl5 s TYR 39 Cb 0.16 -3.74 -0.04 0.00 0.35 0.00 0.00 41.96 38.70 2kl5 s TYR 39 CO 0.22 -2.90 0.53 -1.12 -1.34 0.00 0.00 175.55 170.93 2kl5 s SER 40 N 2.59 6.70 0.32 4.32 0.01 -1.26 -4.97 113.70 121.42 2kl5 s SER 40 Ca 0.66 0.84 0.04 0.00 1.31 0.00 0.00 55.95 58.80 2kl5 s SER 40 Cb -0.29 -2.31 0.66 0.00 0.21 0.00 0.00 66.02 64.28 2kl5 s SER 40 CO 0.24 -0.07 1.87 0.44 0.41 0.00 0.00 173.24 176.14 2kl5 h ASP 41 N 6.92 0.81 -0.21 2.44 5.19 -2.00 -0.53 116.42 129.04 2kl5 h ASP 41 Ca -0.39 0.03 0.04 0.00 -0.62 0.00 0.00 57.03 56.09 2kl5 h ASP 41 Cb 1.17 -0.13 -0.01 0.00 0.18 0.00 0.00 39.33 40.54 2kl5 h ASP 41 CO 0.75 0.45 0.14 -0.29 -3.12 0.00 0.00 179.24 177.18 2kl5 h ILE 42 N 0.88 0.95 0.00 0.35 6.09 -2.03 -1.89 117.51 121.86 2kl5 h ILE 42 Ca 0.44 -0.03 -0.02 0.00 -1.37 0.00 0.00 64.86 63.87 2kl5 h ILE 42 Cb 0.49 0.84 -0.00 0.00 0.47 0.00 0.00 36.82 38.62 2kl5 h ILE 42 CO -0.21 0.02 -0.12 -0.07 -3.07 0.00 0.00 178.15 174.71 2kl5 h LEU 43 N 0.10 0.00 -2.34 2.19 3.38 -1.49 -2.33 115.31 114.82 2kl5 h LEU 43 Ca 0.09 0.00 0.01 0.00 0.09 0.00 0.00 57.88 58.08 2kl5 h LEU 43 Cb 0.25 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.00 2kl5 h LEU 43 CO -0.01 0.12 0.05 -1.13 0.09 0.00 0.00 178.44 177.55 2kl5 h ASN 44 N 0.00 0.00 1.19 -0.43 -0.73 -1.45 -0.93 115.58 113.23 2kl5 h ASN 44 Ca -0.00 0.00 0.00 0.00 1.87 0.00 0.00 56.30 58.17 2kl5 h ASN 44 Cb 0.36 0.00 0.00 0.00 0.27 0.00 0.00 38.32 38.95 2kl5 h ASN 44 CO 0.02 0.00 0.00 1.17 -0.37 0.00 0.00 177.43 178.25 2kl5 n LYS 45 N -3.97 0.20 0.10 6.67 0.00 -0.87 -3.22 118.16 117.07 2kl5 n LYS 45 Ca -0.02 0.25 0.11 0.00 0.00 0.00 0.00 58.31 58.65 2kl5 n LYS 45 Cb 0.14 -1.77 -0.01 0.00 0.00 0.00 0.00 35.03 33.38 2kl5 n LYS 45 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.40 178.06 2kl5 n TYR 46 N -2.14 0.91 -0.85 5.64 4.02 -0.35 -4.72 117.16 119.67 2kl5 n TYR 46 Ca 0.05 0.27 0.00 0.00 -0.01 0.00 0.00 57.90 58.20 2kl5 n TYR 46 Cb 0.36 -0.94 0.00 0.00 -0.02 0.00 0.00 39.34 38.74 2kl5 n TYR 46 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 176.86 175.60 2kl5 n ASP 47 N -2.66 -0.72 -3.85 7.72 9.92 -1.20 -4.33 116.55 121.44 2kl5 n ASP 47 Ca -0.01 0.00 -0.18 0.00 -0.53 0.00 0.00 54.79 54.07 2kl5 n ASP 47 Cb 0.56 -1.05 -0.16 0.00 -0.64 0.00 0.00 41.12 39.82 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 -2.66 0.50 -0.20 1.24 2.02 -1.21 -0.66 117.35 116.37 2kl5 s TYR 48 Ca 0.00 -0.09 0.01 0.00 -0.37 0.00 0.00 57.07 56.62 2kl5 s TYR 48 Cb 0.00 -0.51 0.05 0.00 -0.40 0.00 0.00 41.96 41.10 2kl5 s TYR 48 CO 0.00 -0.15 -0.09 0.42 -1.57 0.00 0.00 175.55 174.16 2kl5 s ILE 49 N 0.93 1.54 -0.06 2.71 -1.09 -0.38 -2.98 121.20 121.87 2kl5 s ILE 49 Ca -0.11 -0.99 0.04 0.00 -2.23 0.00 0.00 60.65 57.37 2kl5 s ILE 49 Cb -0.14 -1.67 -0.00 0.00 -1.58 0.00 0.00 42.46 39.07 2kl5 s ILE 49 CO -0.01 0.12 -0.19 0.54 -1.23 0.00 0.00 174.94 174.17 2kl5 s VAL 50 N 1.43 1.63 -0.09 2.92 0.11 -0.41 -0.59 120.40 125.41 2kl5 s VAL 50 Ca -0.02 -0.81 0.03 0.00 -2.93 0.00 0.00 61.98 58.25 2kl5 s VAL 50 Cb -0.16 -1.41 0.01 0.00 -1.53 0.00 0.00 36.38 33.28 2kl5 s VAL 50 CO -0.08 0.46 -0.18 -0.83 -3.33 0.00 0.00 175.10 171.15 2kl5 s GLY 51 N 0.14 1.09 0.24 6.54 0.00 -0.70 0.14 107.32 114.76 2kl5 s GLY 51 Ca -0.08 -0.74 0.10 0.00 0.00 0.00 0.00 44.72 44.00 2kl5 s GLY 51 CO 0.04 -0.04 -0.05 0.51 0.00 0.00 0.00 173.10 173.56 2kl5 s ASP 52 N 0.62 4.36 -0.29 1.64 -4.77 -1.05 -1.57 116.67 115.60 2kl5 s ASP 52 Ca -0.14 -0.66 0.10 0.00 -3.30 0.00 0.00 52.55 48.55 2kl5 s ASP 52 Cb -0.16 -0.75 0.53 0.00 -1.09 0.00 0.00 42.92 41.45 2kl5 s ASP 52 CO 0.04 0.04 1.52 0.79 0.70 0.00 0.00 175.17 178.26 2kl5 n TRP 53 N -0.54 1.31 0.15 2.11 7.02 0.59 -3.15 117.44 124.93 2kl5 n TRP 53 Ca -0.08 -1.51 -0.12 0.00 -1.02 0.00 0.00 57.50 54.78 2kl5 n TRP 53 Cb 0.58 -0.52 -0.06 0.00 -2.42 0.00 0.00 31.31 28.88 2kl5 n TRP 53 CO 0.00 0.00 0.00 0.78 -2.02 0.00 0.00 177.69 176.45 2kl5 h GLY 54 N 1.16 -1.11 2.00 6.99 0.00 -1.89 -2.64 103.07 107.58 2kl5 h GLY 54 Ca 0.24 0.53 -0.14 0.00 0.00 0.00 0.00 47.33 47.96 2kl5 h GLY 54 CO 0.45 -0.34 -0.67 -1.82 0.00 0.00 0.00 176.54 174.16 2kl5 h TYR 55 N -0.60 0.00 0.00 5.60 3.20 -1.88 -3.48 116.97 119.81 2kl5 h TYR 55 Ca -0.03 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.84 2kl5 h TYR 55 Cb 0.55 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.82 2kl5 h TYR 55 CO -0.26 0.67 0.00 0.41 -1.64 0.00 0.00 178.16 177.34 2kl5 n GLY 56 N 0.50 3.81 3.59 1.82 0.00 -0.99 -5.07 105.19 108.85 2kl5 n GLY 56 Ca -0.01 -0.82 -0.42 0.00 0.00 0.00 0.00 46.02 44.77 2kl5 n GLY 56 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2kl5 s GLN 57 N 0.00 3.40 -0.01 1.61 -0.21 -1.26 -4.84 119.66 118.35 2kl5 s GLN 57 Ca 0.00 0.90 -0.33 0.00 0.02 0.00 0.00 55.36 55.95 2kl5 s GLN 57 Cb 0.00 -4.11 -0.11 0.00 1.00 0.00 0.00 33.01 29.79 2kl5 s GLN 57 CO 0.00 -1.79 1.88 -0.11 -2.12 0.00 0.00 175.29 173.15 2kl5 n LEU 58 N 9.54 3.68 -3.91 2.90 -0.00 -1.26 -4.82 117.00 123.14 2kl5 n LEU 58 Ca 0.17 0.96 -0.16 0.00 -0.00 0.00 0.00 56.01 56.98 2kl5 n LEU 58 Cb 0.48 -1.44 -0.15 0.00 -0.00 0.00 0.00 43.42 42.32 2kl5 n LEU 58 CO 0.70 0.02 -0.39 -0.60 -0.00 0.00 0.00 177.39 177.12 2kl5 s ARG 59 N 3.80 0.38 0.21 1.96 6.06 -1.19 -4.99 118.95 125.18 2kl5 s ARG 59 Ca 0.90 -0.09 -0.07 0.00 -2.50 0.00 0.00 55.73 53.97 2kl5 s ARG 59 Cb -0.60 -0.42 -0.06 0.00 0.06 0.00 0.00 34.95 33.93 2kl5 s ARG 59 CO 0.47 0.02 0.48 -0.51 -2.50 0.00 0.00 175.30 173.26 2kl5 s LEU 60 N 0.27 4.18 0.04 -0.88 1.02 -1.26 -2.53 118.68 119.52 2kl5 s LEU 60 Ca -0.03 0.74 -0.06 0.00 0.02 0.00 0.00 54.13 54.80 2kl5 s LEU 60 Cb -0.06 -3.50 -0.01 0.00 0.02 0.00 0.00 46.19 42.64 2kl5 s LEU 60 CO -0.00 -0.06 0.11 -0.75 0.02 0.00 0.00 176.35 175.67 2kl5 s LYS 61 N -2.94 0.62 -0.00 1.70 2.20 0.12 -4.95 119.74 116.48 2kl5 s LYS 61 Ca 0.44 -0.76 0.04 0.00 -0.36 0.00 0.00 55.97 55.33 2kl5 s LYS 61 Cb -0.11 0.24 -0.03 0.00 -1.51 0.00 0.00 37.83 36.42 2kl5 s LYS 61 CO 0.25 -0.16 -0.10 0.20 -0.36 0.00 0.00 175.35 175.18 2kl5 s GLY 62 N -2.18 1.69 0.32 5.54 0.00 -1.26 -1.28 107.32 110.14 2kl5 s GLY 62 Ca -0.04 -1.04 0.01 0.00 0.00 0.00 0.00 44.72 43.65 2kl5 s GLY 62 CO -0.05 -0.89 0.37 -1.36 0.00 0.00 0.00 173.10 171.17 2kl5 s PHE 63 N -0.94 1.28 0.19 1.90 0.08 -1.16 -5.02 117.98 114.32 2kl5 s PHE 63 Ca 0.16 -1.40 0.09 0.00 0.12 0.00 0.00 56.93 55.89 2kl5 s PHE 63 Cb -0.11 -0.34 -0.04 0.00 -0.57 0.00 0.00 43.02 41.95 2kl5 s PHE 63 CO 0.06 -0.98 -0.18 -0.06 -0.10 0.00 0.00 175.22 173.96 2kl5 s PHE 64 N -3.36 1.87 -0.50 0.36 0.08 -1.26 -3.34 117.98 111.82 2kl5 s PHE 64 Ca 0.35 -0.47 -0.29 0.00 0.12 0.00 0.00 56.93 56.64 2kl5 s PHE 64 Cb 0.01 -0.90 0.02 0.00 -0.57 0.00 0.00 43.02 41.58 2kl5 s PHE 64 CO 0.21 0.39 1.27 0.16 -0.10 0.00 0.00 175.22 177.15 2kl5 s ASP 65 N -2.92 6.43 0.14 1.36 1.47 -1.26 -4.77 116.67 117.12 2kl5 s ASP 65 Ca 0.19 0.43 -0.16 0.00 1.18 0.00 0.00 52.55 54.19 2kl5 s ASP 65 Cb -0.05 -2.55 0.01 0.00 -0.34 0.00 0.00 42.92 40.00 2kl5 s ASP 65 CO 0.08 -1.44 1.74 0.44 0.68 0.00 0.00 175.17 176.68 2kl5 h ASP 66 N 9.98 0.53 0.00 2.11 3.32 -1.89 -3.46 116.42 127.01 2kl5 h ASP 66 Ca -0.25 -0.10 0.00 0.00 0.02 0.00 0.00 57.03 56.70 2kl5 h ASP 66 Cb 1.08 -0.13 0.00 0.00 0.22 0.00 0.00 39.33 40.49 2kl5 h ASP 66 CO 1.14 0.47 0.00 0.00 -1.72 0.00 0.00 179.24 179.14 2kl5 n GLN 67 N -4.71 -0.42 -2.72 3.56 6.02 -0.10 -4.86 117.38 114.15 2kl5 n GLN 67 Ca 0.00 0.10 -0.42 0.00 -0.01 0.00 0.00 57.00 56.68 2kl5 n GLN 67 Cb 0.09 -4.17 0.01 0.00 1.02 0.00 0.00 30.24 27.19 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 -0.21 6.60 0.00 1.08 5.15 -1.26 -4.63 115.26 122.00 2kl5 n ASN 68 Ca 0.00 -3.41 0.00 0.00 -0.60 0.00 0.00 54.58 50.57 2kl5 n ASN 68 Cb 0.10 -1.29 0.00 0.00 -0.53 0.00 0.00 39.78 38.07 2kl5 n ASN 68 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2kl5 n GLN 69 N 1.40 0.00 -1.95 1.20 1.13 -1.26 -4.86 117.38 113.04 2kl5 n GLN 69 Ca 0.37 0.00 -0.25 0.00 -1.94 0.00 0.00 57.00 55.18 2kl5 n GLN 69 Cb 0.31 0.00 -0.07 0.00 0.11 0.00 0.00 30.24 30.59 2kl5 n GLN 69 CO 0.00 0.00 0.00 0.15 -1.44 0.00 0.00 177.06 175.77 2kl5 s LYS 70 N 2.99 2.17 0.00 -1.09 3.01 -1.26 -4.91 119.74 120.65 2kl5 s LYS 70 Ca 0.00 -0.91 0.00 0.00 -1.01 0.00 0.00 55.97 54.05 2kl5 s LYS 70 Cb 0.00 -5.16 0.00 0.00 -1.01 0.00 0.00 37.83 31.66 2kl5 s LYS 70 CO 0.00 -4.32 0.00 0.00 0.51 0.00 0.00 175.35 171.54 2kl5 n ALA 71 N 15.71 0.00 -0.97 5.17 0.00 -1.26 -4.54 120.51 134.62 2kl5 n ALA 71 Ca 0.44 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.88 2kl5 n ALA 71 Cb 0.47 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.92 2kl5 n ALA 71 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 2kl5 n THR 72 N -0.31 0.00 -3.96 0.00 -1.04 -1.26 -4.99 114.28 102.73 2kl5 n THR 72 Ca 0.00 0.00 -0.17 0.00 -2.04 0.00 0.00 64.05 61.84 2kl5 n THR 72 Cb 0.00 -0.04 -0.16 0.00 -1.82 0.00 0.00 70.33 68.31 2kl5 n THR 72 CO 0.00 0.00 0.00 -0.36 -0.64 0.00 0.00 175.07 174.07 2kl5 s PHE 73 N -3.37 0.35 -0.56 -1.42 0.08 -1.26 -5.03 117.98 106.77 2kl5 s PHE 73 Ca 0.00 -0.02 0.25 0.00 0.12 0.00 0.00 56.93 57.28 2kl5 s PHE 73 Cb 0.00 -0.43 0.92 0.00 -0.57 0.00 0.00 43.02 42.94 2kl5 s PHE 73 CO 0.00 -0.13 1.74 -1.91 -0.10 0.00 0.00 175.22 174.82 2kl5 n GLU 74 N 4.09 0.23 -0.64 0.44 2.13 -1.26 -2.71 120.64 122.93 2kl5 n GLU 74 Ca -0.27 0.35 0.06 0.00 0.66 0.00 0.00 57.16 57.96 2kl5 n GLU 74 Cb 0.51 -1.86 0.31 0.00 0.27 0.00 0.00 31.44 30.66 2kl5 n GLU 74 CO 0.00 0.00 0.00 0.25 -0.41 0.00 0.00 177.13 176.97 2kl5 n THR 75 N -2.28 1.93 -2.80 6.31 -2.24 -1.26 -4.81 114.28 109.13 2kl5 n THR 75 Ca 0.03 -1.04 -0.43 0.00 -2.27 0.00 0.00 64.05 60.34 2kl5 n THR 75 Cb 0.31 -0.20 -0.04 0.00 -2.10 0.00 0.00 70.33 68.30 2kl5 n THR 75 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 2kl5 s LYS 76 N -2.18 3.30 -0.20 -0.78 -0.14 -1.10 -5.01 119.74 113.64 2kl5 s LYS 76 Ca 0.42 -0.30 -0.04 0.00 -1.36 0.00 0.00 55.97 54.69 2kl5 s LYS 76 Cb 0.31 -4.08 -0.01 0.00 -1.68 0.00 0.00 37.83 32.36 2kl5 s LYS 76 CO 0.15 -1.59 -0.04 0.42 -0.76 0.00 0.00 175.35 173.52 2kl5 s ILE 77 N 4.16 3.48 -0.04 2.17 1.01 -1.26 -0.92 121.20 129.81 2kl5 s ILE 77 Ca 0.30 -0.47 -0.22 0.00 0.00 0.00 0.00 60.65 60.27 2kl5 s ILE 77 Cb -0.12 -2.56 -0.28 0.00 0.01 0.00 0.00 42.46 39.50 2kl5 s ILE 77 CO 0.18 0.44 0.97 -1.28 0.00 0.00 0.00 174.94 175.25 2kl5 h SER 78 N 7.71 0.44 0.40 3.58 0.87 -1.89 -3.12 113.55 121.54 2kl5 h SER 78 Ca -0.38 -0.88 -0.00 0.00 -1.23 0.00 0.00 61.79 59.31 2kl5 h SER 78 Cb 1.17 -0.14 -0.00 0.00 -0.44 0.00 0.00 62.40 62.99 2kl5 h SER 78 CO 0.60 1.28 -0.00 0.00 -0.53 0.00 0.00 176.83 178.18 2kl5 h THR 79 N -0.33 0.01 0.04 2.23 1.03 -1.95 -1.25 112.91 112.69 2kl5 h THR 79 Ca -0.10 -0.21 -0.25 0.00 -0.01 0.00 0.00 66.41 65.84 2kl5 h THR 79 Cb 1.45 1.20 0.01 0.00 -1.07 0.00 0.00 68.15 69.74 2kl5 h THR 79 CO 0.12 0.00 -1.05 0.25 -0.01 0.00 0.00 175.52 174.83 2kl5 h LEU 80 N 0.00 0.65 -0.73 0.00 5.85 -1.92 -1.74 115.31 117.42 2kl5 h LEU 80 Ca -0.00 -0.56 0.02 0.00 0.84 0.00 0.00 57.88 58.19 2kl5 h LEU 80 Cb 0.20 -0.20 -0.04 0.00 0.37 0.00 0.00 40.66 40.99 2kl5 h LEU 80 CO 0.00 1.37 0.47 -0.78 -0.34 0.00 0.00 178.44 179.16 2kl5 h ASP 81 N 0.25 0.79 -0.09 1.25 3.58 -1.17 0.47 116.42 121.49 2kl5 h ASP 81 Ca -0.12 -0.01 -0.01 0.00 0.42 0.00 0.00 57.03 57.32 2kl5 h ASP 81 Cb 1.71 -0.18 -0.00 0.00 1.72 0.00 0.00 39.33 42.58 2kl5 h ASP 81 CO 0.19 0.55 0.03 -0.33 -2.88 0.00 0.00 179.24 176.80 2kl5 h GLU 82 N 0.93 0.15 -0.61 0.28 4.39 -1.54 -2.68 114.58 115.49 2kl5 h GLU 82 Ca 0.29 -0.03 0.12 0.00 0.34 0.00 0.00 59.36 60.07 2kl5 h GLU 82 Cb -0.02 -0.02 -0.09 0.00 -0.10 0.00 0.00 28.75 28.52 2kl5 h GLU 82 CO -0.09 0.30 0.13 -0.92 -1.16 0.00 0.00 179.01 177.27 2kl5 h TYR 83 N -0.04 0.21 -0.62 4.33 3.20 -0.46 0.71 116.97 124.30 2kl5 h TYR 83 Ca 0.03 0.04 -0.03 0.00 3.14 0.00 0.00 58.73 61.90 2kl5 h TYR 83 Cb 0.22 0.00 -0.03 0.00 1.54 0.00 0.00 36.73 38.46 2kl5 h TYR 83 CO -0.00 -0.03 0.26 0.82 -1.64 0.00 0.00 178.16 177.56 2kl5 h ILE 84 N 0.26 1.23 -0.08 1.81 1.08 -0.93 -0.62 117.51 120.26 2kl5 h ILE 84 Ca 0.32 -0.70 -0.04 0.00 -0.39 0.00 0.00 64.86 64.05 2kl5 h ILE 84 Cb 0.48 0.54 -0.01 0.00 -3.07 0.00 0.00 36.82 34.76 2kl5 h ILE 84 CO -0.41 0.28 -0.15 0.22 -0.69 0.00 0.00 178.15 177.40 2kl5 h TYR 85 N 0.86 0.12 0.01 1.37 3.20 -0.73 -2.21 116.97 119.59 2kl5 h TYR 85 Ca 0.21 -0.01 -0.02 0.00 3.14 0.00 0.00 58.73 62.05 2kl5 h TYR 85 Cb 0.19 -0.04 0.00 0.00 1.54 0.00 0.00 36.73 38.42 2kl5 h TYR 85 CO 0.01 0.27 -0.07 0.93 -1.64 0.00 0.00 178.16 177.66 2kl5 h GLU 86 N 0.11 0.03 0.00 1.82 5.08 -0.44 -3.42 114.58 117.77 2kl5 h GLU 86 Ca 0.02 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.34 2kl5 h GLU 86 Cb 0.34 0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.61 2kl5 h GLU 86 CO 0.02 0.96 0.00 0.66 -1.00 0.00 0.00 179.01 179.65 2kl5 n TYR 87 N -4.60 0.00 -1.81 4.33 4.02 -0.29 -4.74 117.16 114.08 2kl5 n TYR 87 Ca -0.10 0.00 -0.41 0.00 -0.01 0.00 0.00 57.90 57.38 2kl5 n TYR 87 Cb 0.48 -0.00 -0.01 0.00 -0.02 0.00 0.00 39.34 39.79 2kl5 n TYR 87 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2kl5 n ASN 89 N 3.89 3.56 -0.48 0.00 5.15 -1.08 -4.69 115.26 121.61 2kl5 n ASN 89 Ca 0.59 -2.11 0.00 0.00 -0.60 0.00 0.00 54.58 52.46 2kl5 n ASN 89 Cb 0.31 -0.38 0.00 0.00 -0.53 0.00 0.00 39.78 39.17 2kl5 n ASN 89 CO 0.00 0.00 0.00 0.49 1.40 0.00 0.00 177.26 179.15 2kl5 n PHE 90 N 0.93 -0.25 -0.83 1.20 3.72 -1.26 -4.98 117.46 115.99 2kl5 n PHE 90 Ca 0.18 0.00 -0.08 0.00 -0.05 0.00 0.00 57.45 57.50 2kl5 n PHE 90 Cb 0.58 0.00 -0.11 0.00 -0.94 0.00 0.00 39.48 39.00 2kl5 n PHE 90 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2kl5 n GLY 91 N 5.00 2.81 0.00 1.37 0.00 -1.26 -4.85 105.19 108.26 2kl5 n GLY 91 Ca 0.00 -0.81 0.00 0.00 0.00 0.00 0.00 46.02 45.21 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 -2.33 0.23 0.13 0.00 0.00 -1.26 -4.88 121.76 113.65 2kl5 s ALA 93 Ca 0.00 -1.02 -0.26 0.00 0.00 0.00 0.00 51.96 50.69 2kl5 s ALA 93 Cb 0.00 0.75 0.07 0.00 0.00 0.00 0.00 23.12 23.94 2kl5 s ALA 93 CO 0.00 -0.56 0.95 1.52 0.00 0.00 0.00 175.76 177.67 2kl5 s TYR 94 N -3.97 -0.16 0.00 0.00 1.13 -1.21 -0.30 117.35 112.84 2kl5 s TYR 94 Ca 0.16 -0.12 -0.03 0.00 -1.41 0.00 0.00 57.07 55.68 2kl5 s TYR 94 Cb 0.05 0.62 -0.01 0.00 -1.10 0.00 0.00 41.96 41.53 2kl5 s TYR 94 CO -0.02 -0.79 0.04 -0.59 -2.51 0.00 0.00 175.55 171.69 2kl5 s PHE 95 N -3.27 0.09 -0.13 -3.49 -0.12 -0.61 -1.34 117.98 109.12 2kl5 s PHE 95 Ca 0.11 -0.19 -0.00 0.00 -0.05 0.00 0.00 56.93 56.80 2kl5 s PHE 95 Cb -0.01 -0.08 0.03 0.00 -0.63 0.00 0.00 43.02 42.32 2kl5 s PHE 95 CO 0.01 -0.16 -0.09 0.08 -0.05 0.00 0.00 175.22 175.01 2kl5 s VAL 96 N -0.92 1.16 -0.11 -2.49 1.01 0.03 -1.72 120.40 117.36 2kl5 s VAL 96 Ca -0.10 -0.43 -0.02 0.00 0.00 0.00 0.00 61.98 61.43 2kl5 s VAL 96 Cb -0.06 -1.18 -0.03 0.00 0.00 0.00 0.00 36.38 35.10 2kl5 s VAL 96 CO 0.00 0.35 -0.01 -0.76 0.00 0.00 0.00 175.10 174.67 2kl5 s LEU 97 N 1.65 3.46 -0.08 3.92 1.02 0.24 -1.00 118.68 127.88 2kl5 s LEU 97 Ca 0.04 0.05 -0.01 0.00 0.02 0.00 0.00 54.13 54.23 2kl5 s LEU 97 Cb -0.13 -1.80 -0.03 0.00 0.02 0.00 0.00 46.19 44.24 2kl5 s LEU 97 CO -0.09 0.31 -0.02 -0.75 0.02 0.00 0.00 176.35 175.82 2kl5 s LYS 98 N -0.45 2.96 -0.64 1.70 2.20 -0.94 -1.25 119.74 123.31 2kl5 s LYS 98 Ca 0.08 -0.44 -0.27 0.00 -0.36 0.00 0.00 55.97 54.97 2kl5 s LYS 98 Cb -0.12 -2.75 0.01 0.00 -1.51 0.00 0.00 37.83 33.46 2kl5 s LYS 98 CO 0.02 0.67 1.46 0.50 -0.36 0.00 0.00 175.35 177.64 2kl5 s ARG 99 N -0.81 3.12 0.53 4.03 3.00 0.17 -2.47 118.95 126.51 2kl5 s ARG 99 Ca 0.12 0.22 -0.21 0.00 -1.00 0.00 0.00 55.73 54.86 2kl5 s ARG 99 Cb -0.11 -4.20 -0.05 0.00 0.00 0.00 0.00 34.95 30.58 2kl5 s ARG 99 CO 0.02 -2.19 1.25 0.42 0.00 0.00 0.00 175.30 174.80 2kl5 s ILE 100 N 6.57 2.58 -1.62 4.11 -1.09 0.25 -4.80 121.20 127.20 2kl5 s ILE 100 Ca 0.49 0.42 0.28 0.00 -2.23 0.00 0.00 60.65 59.60 2kl5 s ILE 100 Cb -0.10 -3.20 0.59 0.00 -1.58 0.00 0.00 42.46 38.17 2kl5 s ILE 100 CO 0.20 -0.02 1.97 -1.14 -1.23 0.00 0.00 174.94 174.72 2kl5 n ARG 101 N -0.97 0.56 -2.75 2.79 0.00 -1.26 -4.38 116.66 110.64 2kl5 n ARG 101 Ca 0.10 0.02 -0.20 0.00 -0.00 0.00 0.00 57.85 57.77 2kl5 n ARG 101 Cb 0.47 -1.50 0.03 0.00 0.00 0.00 0.00 32.46 31.46 2kl5 n ARG 101 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.63 177.78 2kl5 s LYS 102 N -2.38 2.63 -0.30 -0.14 1.02 -1.26 -5.08 119.74 114.23 2kl5 s LYS 102 Ca 0.32 -0.91 -0.14 0.00 0.02 0.00 0.00 55.97 55.25 2kl5 s LYS 102 Cb 0.19 -2.57 0.18 0.00 -0.52 0.00 0.00 37.83 35.11 2kl5 s LYS 102 CO 0.39 -0.58 1.07 -1.17 -0.92 0.00 0.00 175.35 174.13 2kl5 s LEU 103 N -4.64 -0.42 0.15 3.17 1.98 -1.26 -4.06 118.68 113.60 2kl5 s LEU 103 Ca 0.57 0.28 0.06 0.00 -2.89 0.00 0.00 54.13 52.15 2kl5 s LEU 103 Cb -0.10 1.36 -0.04 0.00 0.66 0.00 0.00 46.19 48.06 2kl5 s LEU 103 CO 0.37 -0.08 0.02 -0.70 -1.89 0.00 0.00 176.35 174.07 2kl5 s GLU 104 N 2.93 2.51 0.81 1.98 2.12 -1.26 -5.10 118.70 122.68 2kl5 s GLU 104 Ca -0.02 -1.00 -0.12 0.00 0.36 0.00 0.00 54.97 54.19 2kl5 s GLU 104 Cb -0.10 -2.44 0.08 0.00 0.26 0.00 0.00 34.13 31.93 2kl5 s GLU 104 CO -0.11 0.48 1.18 -1.01 -0.54 0.00 0.00 175.26 175.26 2kl5 s HIS 105 N -1.61 2.95 -1.13 5.30 3.76 -1.26 -4.96 115.29 118.33 2kl5 s HIS 105 Ca 0.27 0.74 0.24 0.00 -0.15 0.00 0.00 55.06 56.17 2kl5 s HIS 105 Cb -0.10 -3.49 1.11 0.00 1.11 0.00 0.00 32.58 31.20 2kl5 s HIS 105 CO 0.19 -1.77 1.80 0.72 -0.85 0.00 0.00 174.74 174.83 2kl5 n HIS 106 N -3.31 0.00 -1.59 1.40 -0.00 -1.26 -4.87 115.22 105.59 2kl5 n HIS 106 Ca 0.08 0.00 -0.20 0.00 -0.00 0.00 0.00 57.72 57.60 2kl5 n HIS 106 Cb 0.61 -0.43 -0.08 0.00 -0.00 0.00 0.00 29.99 30.08 2kl5 n HIS 106 CO 0.00 0.00 0.00 0.72 -0.00 0.00 0.00 176.34 177.06 2kl5 n HIS 107 N -1.43 -0.09 -2.29 4.41 8.25 -1.26 -4.87 115.22 117.94 2kl5 n HIS 107 Ca 0.08 0.00 -0.38 0.00 -0.26 0.00 0.00 57.72 57.15 2kl5 n HIS 107 Cb 0.26 -3.34 -0.03 0.00 1.12 0.00 0.00 29.99 28.00 2kl5 n HIS 107 CO 0.00 0.00 0.00 -1.01 0.64 0.00 0.00 176.34 175.97 2kl5 s HIS 108 N -2.67 2.00 0.00 4.41 3.76 -1.26 -4.55 115.29 116.98 2kl5 s HIS 108 Ca 0.00 0.29 0.00 0.00 -0.15 0.00 0.00 55.06 55.20 2kl5 s HIS 108 Cb 0.00 -4.35 0.00 0.00 1.11 0.00 0.00 32.58 29.34 2kl5 s HIS 108 CO 0.00 -2.13 0.12 1.58 -0.85 0.00 0.00 174.74 173.46 2kl5 n HIS 109 N 11.22 0.00 0.41 1.40 -0.00 -1.26 -5.28 115.22 121.72 2kl5 n HIS 109 Ca 0.17 0.00 0.05 0.00 -0.00 0.00 0.00 57.72 57.94 2kl5 n HIS 109 Cb 0.50 0.00 0.04 0.00 -0.00 0.00 0.00 29.99 30.53 2kl5 n HIS 109 CO 0.00 0.00 0.00 0.72 -0.00 0.00 0.00 176.34 177.06