#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kl5 n ILE 2 N 0.00 1.15 0.00 2.02 5.41 -1.26 -5.12 119.36 121.56 2kl5 n ILE 2 Ca 0.00 0.19 0.00 0.00 1.00 0.00 0.00 62.75 63.94 2kl5 n ILE 2 Cb 0.00 -1.82 0.00 0.00 -0.71 0.00 0.00 39.64 37.11 2kl5 n ILE 2 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 2kl5 n GLY 3 N 2.62 2.87 2.91 7.39 0.00 -1.26 -5.06 105.19 114.65 2kl5 n GLY 3 Ca -0.09 0.15 -0.30 0.00 0.00 0.00 0.00 46.02 45.78 2kl5 n GLY 3 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 2kl5 s MET 4 N 0.00 1.46 -1.34 1.61 1.75 -1.26 -4.82 119.30 116.71 2kl5 s MET 4 Ca 0.00 -0.89 0.00 0.00 -1.25 0.00 0.00 55.69 53.55 2kl5 s MET 4 Cb 0.00 -2.51 0.00 0.00 2.84 0.00 0.00 34.83 35.16 2kl5 s MET 4 CO 0.00 -0.60 0.00 0.43 -0.65 0.00 0.00 175.02 174.20 2kl5 n SER 5 N 4.73 -4.31 -0.14 1.11 7.64 -1.26 -4.80 113.62 116.59 2kl5 n SER 5 Ca -0.12 0.19 0.02 0.00 1.01 0.00 0.00 58.87 59.98 2kl5 n SER 5 Cb 0.45 -3.72 0.10 0.00 -1.01 0.00 0.00 64.21 60.03 2kl5 n SER 5 CO 0.00 0.00 0.00 -1.84 -3.01 0.00 0.00 175.04 170.19 2kl5 n GLU 6 N -2.63 1.18 -1.86 1.43 -0.00 -1.26 -4.84 120.64 112.65 2kl5 n GLU 6 Ca -0.17 -0.28 -0.29 0.00 -0.00 0.00 0.00 57.16 56.42 2kl5 n GLU 6 Cb 0.59 -1.10 0.09 0.00 -0.00 0.00 0.00 31.44 31.03 2kl5 n GLU 6 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.13 177.28 2kl5 s LYS 7 N -1.90 1.94 0.38 3.44 3.01 -1.26 -5.11 119.74 120.25 2kl5 s LYS 7 Ca 0.09 0.15 0.05 0.00 -1.01 0.00 0.00 55.97 55.25 2kl5 s LYS 7 Cb 0.04 -1.94 -0.02 0.00 -1.01 0.00 0.00 37.83 34.90 2kl5 s LYS 7 CO 0.06 -1.62 0.20 1.03 0.51 0.00 0.00 175.35 175.53 2kl5 s ARG 8 N -5.54 1.89 3.19 1.68 1.81 -1.26 -5.07 118.95 115.65 2kl5 s ARG 8 Ca 0.62 -2.14 0.00 0.00 -1.72 0.00 0.00 55.73 52.49 2kl5 s ARG 8 Cb -0.11 -0.22 0.00 0.00 -0.45 0.00 0.00 34.95 34.17 2kl5 s ARG 8 CO 0.50 -0.57 0.00 0.41 -0.68 0.00 0.00 175.30 174.95 2kl5 n GLY 9 N -0.82 0.60 1.49 -3.53 0.00 -1.26 -4.86 105.19 96.82 2kl5 n GLY 9 Ca -0.01 -1.05 0.00 0.00 0.00 0.00 0.00 46.02 44.96 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 6.90 0.00 -3.53 1.61 2.13 -1.26 -5.04 120.64 121.44 2kl5 n GLU 10 Ca 0.00 0.00 -0.41 0.00 0.66 0.00 0.00 57.16 57.41 2kl5 n GLU 10 Cb 0.00 0.00 -0.06 0.00 0.27 0.00 0.00 31.44 31.65 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 -0.74 4.62 -0.02 6.31 1.01 -1.26 -5.06 121.20 126.06 2kl5 s ILE 11 Ca 0.00 -2.71 -0.16 0.00 0.00 0.00 0.00 60.65 57.78 2kl5 s ILE 11 Cb 0.00 -3.92 -0.06 0.00 0.01 0.00 0.00 42.46 38.49 2kl5 s ILE 11 CO 0.00 -0.95 0.44 0.00 0.00 0.00 0.00 174.94 174.43 2kl5 s MET 12 N 0.07 4.04 -0.32 2.79 0.23 -1.26 -1.59 119.30 123.26 2kl5 s MET 12 Ca 0.17 0.45 0.03 0.00 -1.03 0.00 0.00 55.69 55.32 2kl5 s MET 12 Cb -0.16 -3.27 0.09 0.00 -1.53 0.00 0.00 34.83 29.97 2kl5 s MET 12 CO -0.06 0.57 0.02 0.42 -2.03 0.00 0.00 175.02 173.94 2kl5 s ILE 13 N -0.72 2.17 -0.20 3.16 -1.09 0.68 -4.95 121.20 120.25 2kl5 s ILE 13 Ca 0.25 -2.14 -0.04 0.00 -2.23 0.00 0.00 60.65 56.48 2kl5 s ILE 13 Cb -0.17 -2.54 -0.02 0.00 -1.58 0.00 0.00 42.46 38.16 2kl5 s ILE 13 CO 0.13 -0.49 -0.02 -0.76 -1.23 0.00 0.00 174.94 172.58 2kl5 s LEU 14 N 0.99 3.12 -0.13 2.97 1.02 -1.26 -0.78 118.68 124.61 2kl5 s LEU 14 Ca 0.07 -0.26 -0.10 0.00 0.02 0.00 0.00 54.13 53.85 2kl5 s LEU 14 Cb -0.19 -1.79 0.04 0.00 0.02 0.00 0.00 46.19 44.27 2kl5 s LEU 14 CO -0.08 0.05 0.34 -0.51 0.02 0.00 0.00 176.35 176.16 2kl5 s ILE 15 N 1.09 -0.01 -1.96 -0.59 2.07 -0.98 -4.87 121.20 115.94 2kl5 s ILE 15 Ca 0.02 0.04 0.00 0.00 -1.41 0.00 0.00 60.65 59.30 2kl5 s ILE 15 Cb -0.14 -0.49 0.00 0.00 0.13 0.00 0.00 42.46 41.96 2kl5 s ILE 15 CO 0.01 0.02 0.00 0.00 -1.91 0.00 0.00 174.94 173.05 2kl5 n GLN 16 N 3.35 -1.40 -2.51 3.50 1.13 -1.26 -0.05 117.38 120.14 2kl5 n GLN 16 Ca -0.17 1.12 -0.16 0.00 -1.94 0.00 0.00 57.00 55.86 2kl5 n GLN 16 Cb 0.57 -5.51 0.01 0.00 0.11 0.00 0.00 30.24 25.41 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 -1.28 -4.75 -4.70 1.08 3.02 -1.26 -5.04 115.26 102.34 2kl5 n ASN 17 Ca -0.20 -0.10 -0.30 0.00 -0.03 0.00 0.00 54.58 53.95 2kl5 n ASN 17 Cb 0.65 -3.77 -0.08 0.00 -0.61 0.00 0.00 39.78 35.97 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 -2.87 3.32 -0.28 5.41 0.00 0.92 -4.81 121.76 123.45 2kl5 s ALA 18 Ca 0.09 -1.13 -0.04 0.00 0.00 0.00 0.00 51.96 50.88 2kl5 s ALA 18 Cb -0.04 -1.20 0.02 0.00 0.00 0.00 0.00 23.12 21.90 2kl5 s ALA 18 CO 0.11 0.69 0.02 -2.00 0.00 0.00 0.00 175.76 174.58 2kl5 s GLU 19 N -2.38 2.90 0.24 0.00 2.12 -1.26 -2.33 118.70 117.99 2kl5 s GLU 19 Ca 0.26 -0.96 0.03 0.00 0.36 0.00 0.00 54.97 54.66 2kl5 s GLU 19 Cb -0.12 -3.22 -0.05 0.00 0.26 0.00 0.00 34.13 31.00 2kl5 s GLU 19 CO 0.19 -0.46 0.01 -0.06 -0.54 0.00 0.00 175.26 174.40 2kl5 s PHE 20 N 1.40 1.59 0.07 5.30 0.08 0.04 -1.21 117.98 125.26 2kl5 s PHE 20 Ca 0.01 -0.95 -0.01 0.00 0.12 0.00 0.00 56.93 56.10 2kl5 s PHE 20 Cb -0.17 -0.94 -0.04 0.00 -0.57 0.00 0.00 43.02 41.30 2kl5 s PHE 20 CO -0.00 -0.06 -0.02 -1.83 -0.10 0.00 0.00 175.22 173.21 2kl5 s GLU 21 N -3.88 0.70 -0.58 0.44 -1.05 -0.02 -0.23 118.70 114.08 2kl5 s GLU 21 Ca 0.30 -1.28 -0.22 0.00 -0.15 0.00 0.00 54.97 53.62 2kl5 s GLU 21 Cb 0.06 0.16 0.06 0.00 -0.44 0.00 0.00 34.13 33.97 2kl5 s GLU 21 CO 0.10 -0.13 0.84 -1.17 0.95 0.00 0.00 175.26 175.85 2kl5 s LEU 22 N -2.96 4.56 0.14 1.83 2.96 -0.62 -1.08 118.68 123.51 2kl5 s LEU 22 Ca 0.11 -0.82 0.23 0.00 -0.22 0.00 0.00 54.13 53.42 2kl5 s LEU 22 Cb 0.08 -2.54 0.05 0.00 0.50 0.00 0.00 46.19 44.28 2kl5 s LEU 22 CO -0.07 -1.20 1.05 1.33 -1.32 0.00 0.00 176.35 176.14 2kl5 n VAL 23 N 5.89 0.44 -3.68 1.68 0.24 -0.40 -4.86 118.33 117.63 2kl5 n VAL 23 Ca -0.03 -0.43 -0.10 0.00 -2.04 0.00 0.00 64.34 61.73 2kl5 n VAL 23 Cb 0.46 -0.17 -0.09 0.00 -1.47 0.00 0.00 33.84 32.57 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 -3.31 -0.74 -0.01 6.34 5.65 -1.09 -5.00 115.29 117.14 2kl5 s HIS 24 Ca 0.01 1.60 0.00 0.00 0.25 0.00 0.00 55.06 56.92 2kl5 s HIS 24 Cb 0.12 0.36 0.01 0.00 -1.18 0.00 0.00 32.58 31.88 2kl5 s HIS 24 CO 0.79 -0.38 0.01 1.21 -0.65 0.00 0.00 174.74 175.72 2kl5 s ASN 25 N 1.09 0.05 -0.04 9.88 2.47 -1.26 -0.41 114.94 126.71 2kl5 s ASN 25 Ca -0.06 0.01 0.02 0.00 0.42 0.00 0.00 52.86 53.25 2kl5 s ASN 25 Cb -0.06 -0.04 0.01 0.00 -1.45 0.00 0.00 41.25 39.72 2kl5 s ASN 25 CO -0.10 -0.06 -0.09 0.12 -3.72 0.00 0.00 177.10 173.25 2kl5 s PHE 26 N 0.48 1.01 -1.16 0.43 5.36 -0.67 -4.75 117.98 118.68 2kl5 s PHE 26 Ca -0.04 -0.29 0.00 0.00 -0.96 0.00 0.00 56.93 55.64 2kl5 s PHE 26 Cb -0.06 -0.76 0.00 0.00 -0.34 0.00 0.00 43.02 41.86 2kl5 s PHE 26 CO -0.01 -0.16 0.00 1.17 -1.46 0.00 0.00 175.22 174.76 2kl5 n LYS 27 N 3.56 -1.39 -3.11 10.12 3.00 -1.26 -1.16 118.16 127.91 2kl5 n LYS 27 Ca -0.21 0.85 -0.22 0.00 -0.00 0.00 0.00 58.31 58.73 2kl5 n LYS 27 Cb 0.53 -5.10 0.02 0.00 0.00 0.00 0.00 35.03 30.48 2kl5 n LYS 27 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.40 177.15 2kl5 n ASP 28 N -0.84 -5.14 0.13 3.14 8.00 -1.26 -4.86 116.55 115.72 2kl5 n ASP 28 Ca -0.11 -0.30 0.12 0.00 0.71 0.00 0.00 54.79 55.21 2kl5 n ASP 28 Cb 0.52 -4.19 0.49 0.00 -0.02 0.00 0.00 41.12 37.91 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 -1.36 -1.33 3.71 0.44 0.00 -0.31 -4.76 105.19 101.60 2kl5 n GLY 29 Ca -0.08 0.08 -0.42 0.00 0.00 0.00 0.00 46.02 45.59 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 -3.30 2.81 -0.20 1.61 5.36 -1.26 -4.83 117.98 118.17 2kl5 s PHE 30 Ca 0.05 0.34 -0.10 0.00 -0.96 0.00 0.00 56.93 56.26 2kl5 s PHE 30 Cb 0.10 -4.10 0.07 0.00 -0.34 0.00 0.00 43.02 38.75 2kl5 s PHE 30 CO 0.42 -4.22 0.47 1.21 -1.46 0.00 0.00 175.22 171.64 2kl5 s ASN 31 N 1.44 -0.56 0.20 6.13 3.84 -1.26 -5.06 114.94 119.67 2kl5 s ASN 31 Ca 0.75 1.07 -0.10 0.00 0.21 0.00 0.00 52.86 54.78 2kl5 s ASN 31 Cb -0.48 1.12 0.20 0.00 -0.55 0.00 0.00 41.25 41.54 2kl5 s ASN 31 CO 0.32 -0.21 1.83 -0.08 -2.79 0.00 0.00 177.10 176.17 2kl5 h GLU 32 N 7.42 0.74 -0.84 0.43 4.81 -2.00 -2.16 114.58 122.98 2kl5 h GLU 32 Ca -0.29 -0.04 0.02 0.00 -0.13 0.00 0.00 59.36 58.92 2kl5 h GLU 32 Cb 1.17 -0.17 -0.05 0.00 0.63 0.00 0.00 28.75 30.33 2kl5 h GLU 32 CO 0.22 0.49 0.54 1.05 -0.73 0.00 0.00 179.01 180.58 2kl5 h GLU 33 N 0.76 1.05 -0.81 1.92 4.11 -1.98 -0.04 114.58 119.60 2kl5 h GLU 33 Ca 0.28 -0.06 -0.02 0.00 0.07 0.00 0.00 59.36 59.63 2kl5 h GLU 33 Cb 0.08 -0.24 -0.04 0.00 0.50 0.00 0.00 28.75 29.06 2kl5 h GLU 33 CO -0.13 0.70 0.43 0.00 0.07 0.00 0.00 179.01 180.07 2kl5 h ALA 34 N 1.33 1.04 0.52 1.06 0.00 -1.82 0.62 119.26 122.01 2kl5 h ALA 34 Ca 0.32 -0.13 -0.03 0.00 0.00 0.00 0.00 54.91 55.08 2kl5 h ALA 34 Cb -0.05 -0.32 0.01 0.00 0.00 0.00 0.00 17.79 17.42 2kl5 h ALA 34 CO -0.09 0.56 -0.25 0.35 0.00 0.00 0.00 179.25 179.82 2kl5 h PHE 35 N 1.13 -0.65 0.00 0.00 3.57 -1.01 -3.09 116.94 116.90 2kl5 h PHE 35 Ca 0.28 -0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.77 2kl5 h PHE 35 Cb 0.05 0.21 0.00 0.00 2.79 0.00 0.00 35.95 39.00 2kl5 h PHE 35 CO 0.01 -0.32 0.00 1.57 -2.23 0.00 0.00 178.31 177.34 2kl5 h LYS 36 N -1.01 0.00 0.04 1.11 2.10 -0.90 0.12 116.57 118.04 2kl5 h LYS 36 Ca -0.07 0.00 -0.23 0.00 -2.00 0.00 0.00 60.65 58.35 2kl5 h LYS 36 Cb 0.62 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 31.94 2kl5 h LYS 36 CO 0.12 0.00 -1.02 0.00 -2.00 0.00 0.00 179.45 176.54 2kl5 h ALA 37 N 2.04 0.32 0.00 0.07 0.00 -0.94 -3.30 119.26 117.47 2kl5 h ALA 37 Ca 0.00 -0.78 0.00 0.00 0.00 0.00 0.00 54.91 54.13 2kl5 h ALA 37 Cb 0.52 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.28 2kl5 h ALA 37 CO 0.00 0.93 -1.15 0.54 0.00 0.00 0.00 179.25 179.57 2kl5 n ARG 38 N -3.62 0.21 -1.75 0.00 5.12 -0.93 -4.99 116.66 110.70 2kl5 n ARG 38 Ca -0.06 -0.04 -0.42 0.00 -1.93 0.00 0.00 57.85 55.41 2kl5 n ARG 38 Cb 0.89 -1.53 -0.00 0.00 -1.16 0.00 0.00 32.46 30.66 2kl5 n ARG 38 CO 0.00 0.00 0.00 0.98 -1.93 0.00 0.00 177.63 176.68 2kl5 n TYR 39 N -1.78 2.81 -4.09 -1.55 9.36 0.37 -4.85 117.16 117.43 2kl5 n TYR 39 Ca 0.02 0.45 -0.14 0.00 3.32 0.00 0.00 57.90 61.55 2kl5 n TYR 39 Cb 0.41 -2.51 -0.12 0.00 -0.63 0.00 0.00 39.34 36.48 2kl5 n TYR 39 CO 0.00 0.00 0.00 -1.12 0.22 0.00 0.00 176.86 175.96 2kl5 s SER 40 N -0.09 0.74 0.38 2.98 0.01 -1.26 -5.01 113.70 111.44 2kl5 s SER 40 Ca 0.55 -0.38 0.05 0.00 1.31 0.00 0.00 55.95 57.48 2kl5 s SER 40 Cb -0.50 0.00 0.76 0.00 0.21 0.00 0.00 66.02 66.49 2kl5 s SER 40 CO 0.62 -0.11 2.02 -0.78 0.41 0.00 0.00 173.24 175.39 2kl5 h ASP 41 N 5.05 0.60 -0.15 2.44 3.58 -2.02 -0.87 116.42 125.05 2kl5 h ASP 41 Ca -0.33 -0.01 0.04 0.00 0.42 0.00 0.00 57.03 57.15 2kl5 h ASP 41 Cb 1.20 -0.14 -0.01 0.00 1.72 0.00 0.00 39.33 42.10 2kl5 h ASP 41 CO 0.44 0.42 0.13 -0.29 -2.88 0.00 0.00 179.24 177.06 2kl5 h ILE 42 N 0.70 0.68 0.00 2.25 6.09 -2.02 -0.38 117.51 124.84 2kl5 h ILE 42 Ca 0.22 0.00 0.00 0.00 -1.37 0.00 0.00 64.86 63.71 2kl5 h ILE 42 Cb 0.02 0.90 0.00 0.00 0.47 0.00 0.00 36.82 38.22 2kl5 h ILE 42 CO -0.06 0.00 0.00 -0.07 -3.07 0.00 0.00 178.15 174.95 2kl5 h LEU 43 N 0.00 0.00 -1.19 2.19 3.38 -1.58 -3.30 115.31 114.81 2kl5 h LEU 43 Ca 0.07 0.00 0.02 0.00 0.09 0.00 0.00 57.88 58.06 2kl5 h LEU 43 Cb 0.33 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.03 2kl5 h LEU 43 CO -0.00 0.00 0.55 -1.13 0.09 0.00 0.00 178.44 177.95 2kl5 h ASN 44 N 0.00 0.93 0.43 -0.43 -0.00 -1.11 -2.52 115.58 112.88 2kl5 h ASN 44 Ca 0.00 -0.02 -0.01 0.00 -0.00 0.00 0.00 56.30 56.27 2kl5 h ASN 44 Cb 0.90 -0.23 -0.00 0.00 -0.00 0.00 0.00 38.32 38.99 2kl5 h ASN 44 CO 0.00 0.66 -0.04 0.07 -0.00 0.00 0.00 177.43 178.12 2kl5 h LYS 45 N 1.09 0.00 0.00 6.67 2.10 -1.72 -2.24 116.57 122.47 2kl5 h LYS 45 Ca 0.32 0.00 -0.09 0.00 -2.00 0.00 0.00 60.65 58.87 2kl5 h LYS 45 Cb -0.06 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 31.25 2kl5 h LYS 45 CO -0.08 0.04 -0.44 1.88 -2.00 0.00 0.00 179.45 178.85 2kl5 h TYR 46 N 0.00 0.00 0.00 0.07 0.05 -1.69 -3.46 116.97 111.94 2kl5 h TYR 46 Ca -0.00 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.78 2kl5 h TYR 46 Cb 0.27 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.01 2kl5 h TYR 46 CO 0.00 0.44 0.00 -0.25 -1.05 0.00 0.00 178.16 177.30 2kl5 n ASP 47 N -3.82 -0.64 -3.64 3.88 8.00 -0.85 -4.23 116.55 115.25 2kl5 n ASP 47 Ca -0.01 0.00 -0.19 0.00 0.71 0.00 0.00 54.79 55.30 2kl5 n ASP 47 Cb 0.50 -1.73 -0.16 0.00 -0.02 0.00 0.00 41.12 39.70 2kl5 n ASP 47 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 2kl5 s TYR 48 N -1.96 -0.07 -0.19 1.24 1.51 -1.22 -0.53 117.35 116.13 2kl5 s TYR 48 Ca 0.00 0.34 0.01 0.00 -1.01 0.00 0.00 57.07 56.41 2kl5 s TYR 48 Cb 0.00 -0.39 0.02 0.00 -0.11 0.00 0.00 41.96 41.48 2kl5 s TYR 48 CO 0.00 -0.32 -0.18 0.42 -1.11 0.00 0.00 175.55 174.36 2kl5 s ILE 49 N 2.24 2.13 -0.24 2.71 -1.09 -0.13 -1.64 121.20 125.19 2kl5 s ILE 49 Ca 0.04 -1.01 -0.04 0.00 -2.23 0.00 0.00 60.65 57.40 2kl5 s ILE 49 Cb -0.13 -1.95 -0.00 0.00 -1.58 0.00 0.00 42.46 38.80 2kl5 s ILE 49 CO -0.06 0.46 -0.01 -0.69 -1.23 0.00 0.00 174.94 173.41 2kl5 s VAL 50 N 1.27 3.50 -0.25 2.92 1.01 -0.15 -0.43 120.40 128.27 2kl5 s VAL 50 Ca 0.03 -0.60 -0.19 0.00 0.00 0.00 0.00 61.98 61.22 2kl5 s VAL 50 Cb -0.14 -2.68 -0.02 0.00 0.00 0.00 0.00 36.38 33.54 2kl5 s VAL 50 CO -0.12 0.30 0.58 -0.83 0.00 0.00 0.00 175.10 175.03 2kl5 s GLY 51 N 1.47 1.86 -0.24 4.51 0.00 0.33 -0.41 107.32 114.83 2kl5 s GLY 51 Ca 0.04 -0.49 -0.07 0.00 0.00 0.00 0.00 44.72 44.20 2kl5 s GLY 51 CO -0.02 1.33 0.07 -0.35 0.00 0.00 0.00 173.10 174.13 2kl5 s ASP 52 N 1.46 5.21 -0.11 1.64 2.15 -0.43 -1.90 116.67 124.69 2kl5 s ASP 52 Ca 0.24 -0.16 -0.04 0.00 0.43 0.00 0.00 52.55 53.03 2kl5 s ASP 52 Cb -0.16 -1.93 -0.01 0.00 -0.30 0.00 0.00 42.92 40.52 2kl5 s ASP 52 CO 0.09 0.00 -0.07 -0.50 -0.17 0.00 0.00 175.17 174.52 2kl5 h TRP 53 N 7.97 0.00 0.00 -5.34 4.06 -1.70 -2.66 115.95 118.28 2kl5 h TRP 53 Ca -0.38 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.57 2kl5 h TRP 53 Cb 1.18 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 29.34 2kl5 h TRP 53 CO 0.65 0.00 0.00 0.41 -3.56 0.00 0.00 178.44 175.94 2kl5 n GLY 54 N 1.72 0.42 0.17 1.49 0.00 -1.25 0.26 105.19 108.01 2kl5 n GLY 54 Ca -0.03 0.63 0.08 0.00 0.00 0.00 0.00 46.02 46.71 2kl5 n GLY 54 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 2kl5 n TYR 55 N 0.00 0.08 -0.19 1.61 9.36 -1.26 -4.79 117.16 121.96 2kl5 n TYR 55 Ca 0.00 -0.04 0.00 0.00 3.32 0.00 0.00 57.90 61.18 2kl5 n TYR 55 Cb 0.00 0.00 0.00 0.00 -0.63 0.00 0.00 39.34 38.71 2kl5 n TYR 55 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 2kl5 n GLY 56 N 0.85 0.74 3.32 2.98 0.00 0.14 -5.02 105.19 108.20 2kl5 n GLY 56 Ca 0.12 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.70 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 -0.81 4.08 -0.30 1.61 -0.21 -0.71 -5.01 119.66 118.31 2kl5 s GLN 57 Ca 0.00 -3.17 -0.28 0.00 0.02 0.00 0.00 55.36 51.93 2kl5 s GLN 57 Cb 0.00 -4.49 -0.05 0.00 1.00 0.00 0.00 33.01 29.47 2kl5 s GLN 57 CO 0.00 -1.25 2.17 -1.17 -2.12 0.00 0.00 175.29 172.92 2kl5 s LEU 58 N -1.17 3.44 0.14 2.90 1.98 -1.23 -4.58 118.68 120.15 2kl5 s LEU 58 Ca 0.29 1.58 0.05 0.00 -2.89 0.00 0.00 54.13 53.16 2kl5 s LEU 58 Cb -0.10 -3.29 -0.04 0.00 0.66 0.00 0.00 46.19 43.42 2kl5 s LEU 58 CO -0.08 -2.11 -0.11 -0.13 -1.89 0.00 0.00 176.35 172.03 2kl5 s ARG 59 N 6.61 1.03 -0.27 1.98 0.52 -1.00 -4.95 118.95 122.87 2kl5 s ARG 59 Ca 0.95 -1.37 -0.08 0.00 -0.52 0.00 0.00 55.73 54.71 2kl5 s ARG 59 Cb -0.27 -0.69 -0.02 0.00 0.52 0.00 0.00 34.95 34.49 2kl5 s ARG 59 CO 0.33 0.10 0.10 -0.51 0.02 0.00 0.00 175.30 175.33 2kl5 s LEU 60 N -2.92 3.68 -0.10 2.53 1.43 -1.26 -1.31 118.68 120.73 2kl5 s LEU 60 Ca 0.14 -0.34 -0.10 0.00 -1.03 0.00 0.00 54.13 52.80 2kl5 s LEU 60 Cb 0.00 -1.95 -0.05 0.00 0.03 0.00 0.00 46.19 44.23 2kl5 s LEU 60 CO 0.01 -0.09 0.23 -0.75 0.23 0.00 0.00 176.35 175.98 2kl5 s LYS 61 N 1.61 3.71 -0.12 1.70 2.47 0.45 -4.92 119.74 124.64 2kl5 s LYS 61 Ca 0.05 0.03 -0.11 0.00 -1.56 0.00 0.00 55.97 54.39 2kl5 s LYS 61 Cb -0.16 -3.24 -0.05 0.00 -1.46 0.00 0.00 37.83 32.92 2kl5 s LYS 61 CO 0.04 0.66 0.22 0.20 0.16 0.00 0.00 175.35 176.64 2kl5 s GLY 62 N -0.77 2.21 0.33 5.54 0.00 -1.26 -0.98 107.32 112.38 2kl5 s GLY 62 Ca 0.17 -0.53 0.03 0.00 0.00 0.00 0.00 44.72 44.39 2kl5 s GLY 62 CO 0.06 0.00 0.13 -1.36 0.00 0.00 0.00 173.10 171.93 2kl5 s PHE 63 N -0.43 1.71 0.42 1.90 0.08 -0.65 -5.00 117.98 116.00 2kl5 s PHE 63 Ca 0.16 -1.25 0.06 0.00 0.12 0.00 0.00 56.93 56.01 2kl5 s PHE 63 Cb -0.13 -1.02 -0.07 0.00 -0.57 0.00 0.00 43.02 41.23 2kl5 s PHE 63 CO 0.05 -0.35 0.02 -0.06 -0.10 0.00 0.00 175.22 174.78 2kl5 s PHE 64 N -3.46 2.36 -0.32 0.36 0.08 -1.26 -3.40 117.98 112.34 2kl5 s PHE 64 Ca 0.33 -0.75 -0.29 0.00 0.12 0.00 0.00 56.93 56.34 2kl5 s PHE 64 Cb 0.05 -1.69 -0.07 0.00 -0.57 0.00 0.00 43.02 40.74 2kl5 s PHE 64 CO 0.16 0.36 2.28 -3.47 -0.10 0.00 0.00 175.22 174.45 2kl5 n ASP 65 N -0.99 2.78 -0.00 1.36 -0.08 -1.26 -4.84 116.55 113.52 2kl5 n ASP 65 Ca -0.07 0.05 -0.00 0.00 -1.51 0.00 0.00 54.79 53.26 2kl5 n ASP 65 Cb 0.67 -1.51 -0.00 0.00 2.34 0.00 0.00 41.12 42.62 2kl5 n ASP 65 CO 0.00 0.00 0.00 -0.78 0.12 0.00 0.00 177.20 176.54 2kl5 h ASP 66 N 15.77 0.00 -2.02 1.67 1.82 -1.98 -3.40 116.42 128.28 2kl5 h ASP 66 Ca -0.34 0.00 -0.75 0.00 -0.39 0.00 0.00 57.03 55.55 2kl5 h ASP 66 Cb 1.26 0.00 -0.18 0.00 0.68 0.00 0.00 39.33 41.09 2kl5 h ASP 66 CO 1.03 0.04 1.50 0.00 -1.61 0.00 0.00 179.24 180.20 2kl5 n GLN 67 N -2.34 3.50 0.10 0.28 6.02 -0.21 -4.71 117.38 120.03 2kl5 n GLN 67 Ca -0.00 -3.81 0.12 0.00 -0.01 0.00 0.00 57.00 53.30 2kl5 n GLN 67 Cb 0.01 -2.96 0.21 0.00 1.02 0.00 0.00 30.24 28.53 2kl5 n GLN 67 CO 0.00 0.00 0.00 -0.97 -1.01 0.00 0.00 177.06 175.08 2kl5 h ASN 68 N 6.61 0.00 -4.54 1.08 -0.73 -1.83 -3.36 115.58 112.80 2kl5 h ASN 68 Ca 0.33 -0.09 0.08 0.00 1.87 0.00 0.00 56.30 58.49 2kl5 h ASN 68 Cb 0.79 0.00 -0.18 0.00 0.27 0.00 0.00 38.32 39.20 2kl5 h ASN 68 CO 1.36 0.05 0.47 -1.58 -0.37 0.00 0.00 177.43 177.35 2kl5 s GLN 69 N -3.18 0.80 -1.32 6.67 0.74 -1.26 -4.93 119.66 117.18 2kl5 s GLN 69 Ca 0.07 -0.13 -0.09 0.00 0.05 0.00 0.00 55.36 55.26 2kl5 s GLN 69 Cb 0.11 0.37 0.01 0.00 1.10 0.00 0.00 33.01 34.61 2kl5 s GLN 69 CO 0.69 -0.32 1.15 1.63 -0.55 0.00 0.00 175.29 177.89 2kl5 n LYS 70 N 0.14 -7.75 -3.73 1.67 4.76 -1.26 -4.99 118.16 107.01 2kl5 n LYS 70 Ca -0.11 0.81 -0.21 0.00 -2.87 0.00 0.00 58.31 55.93 2kl5 n LYS 70 Cb 0.60 -5.79 -0.04 0.00 -1.84 0.00 0.00 35.03 27.97 2kl5 n LYS 70 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2kl5 s ALA 71 N -3.31 3.91 0.18 7.82 0.00 -1.26 -5.02 121.76 124.08 2kl5 s ALA 71 Ca 0.57 -1.77 0.12 0.00 0.00 0.00 0.00 51.96 50.88 2kl5 s ALA 71 Cb -0.25 -1.06 0.27 0.00 0.00 0.00 0.00 23.12 22.07 2kl5 s ALA 71 CO 0.71 -0.09 1.55 1.15 0.00 0.00 0.00 175.76 179.07 2kl5 h THR 72 N 1.18 1.33 -3.51 0.00 2.02 -1.94 -3.47 112.91 108.53 2kl5 h THR 72 Ca -0.43 -2.30 -0.05 0.00 0.77 0.00 0.00 66.41 64.40 2kl5 h THR 72 Cb 1.26 2.29 -0.11 0.00 -1.74 0.00 0.00 68.15 69.84 2kl5 h THR 72 CO 0.58 0.63 -0.10 0.12 0.37 0.00 0.00 175.52 177.12 2kl5 s PHE 73 N -3.34 0.04 0.44 3.16 5.36 -1.26 -5.04 117.98 117.33 2kl5 s PHE 73 Ca 0.00 -0.39 0.19 0.00 -0.96 0.00 0.00 56.93 55.78 2kl5 s PHE 73 Cb 0.11 0.23 1.15 0.00 -0.34 0.00 0.00 43.02 44.17 2kl5 s PHE 73 CO 0.76 -0.82 1.87 1.05 -1.46 0.00 0.00 175.22 176.62 2kl5 h GLU 74 N 2.34 0.33 -3.83 10.12 4.11 -1.90 -3.36 114.58 122.38 2kl5 h GLU 74 Ca -0.30 -0.02 -0.44 0.00 0.07 0.00 0.00 59.36 58.66 2kl5 h GLU 74 Cb 1.25 -0.07 -0.37 0.00 0.50 0.00 0.00 28.75 30.05 2kl5 h GLU 74 CO 0.42 0.22 -0.77 -0.08 0.07 0.00 0.00 179.01 178.87 2kl5 s THR 75 N -5.35 0.49 -0.13 -1.06 -1.32 -1.26 -4.79 115.64 102.22 2kl5 s THR 75 Ca -0.08 0.03 -0.29 0.00 -1.21 0.00 0.00 61.69 60.14 2kl5 s THR 75 Cb 0.22 -0.60 0.08 0.00 -1.51 0.00 0.00 72.50 70.69 2kl5 s THR 75 CO 0.78 0.27 0.73 -0.75 -2.21 0.00 0.00 174.62 173.43 2kl5 s LYS 76 N 1.75 0.95 -0.23 7.08 2.47 -1.26 -5.04 119.74 125.46 2kl5 s LYS 76 Ca 0.02 0.47 0.01 0.00 -1.56 0.00 0.00 55.97 54.90 2kl5 s LYS 76 Cb -0.13 0.45 0.06 0.00 -1.46 0.00 0.00 37.83 36.75 2kl5 s LYS 76 CO -0.05 -0.25 -0.05 0.42 0.16 0.00 0.00 175.35 175.58 2kl5 s ILE 77 N -0.70 1.48 0.08 5.43 1.01 -1.26 -1.04 121.20 126.19 2kl5 s ILE 77 Ca -0.07 -1.15 -0.19 0.00 0.00 0.00 0.00 60.65 59.24 2kl5 s ILE 77 Cb -0.02 -1.73 -0.09 0.00 0.01 0.00 0.00 42.46 40.63 2kl5 s ILE 77 CO 0.06 -0.07 1.52 -1.28 0.00 0.00 0.00 174.94 175.18 2kl5 h SER 78 N 7.98 0.36 0.35 3.58 0.87 -1.98 -2.57 113.55 122.14 2kl5 h SER 78 Ca -0.19 -0.29 0.00 0.00 -1.23 0.00 0.00 61.79 60.08 2kl5 h SER 78 Cb 1.08 -0.10 0.00 0.00 -0.44 0.00 0.00 62.40 62.94 2kl5 h SER 78 CO 0.41 0.56 0.00 0.00 -0.53 0.00 0.00 176.83 177.28 2kl5 h THR 79 N 0.15 0.00 -0.26 2.23 1.03 -2.00 -2.23 112.91 111.84 2kl5 h THR 79 Ca 0.06 -0.16 -0.05 0.00 -0.01 0.00 0.00 66.41 66.26 2kl5 h THR 79 Cb 0.37 1.01 -0.01 0.00 -1.07 0.00 0.00 68.15 68.45 2kl5 h THR 79 CO 0.01 0.00 -0.03 0.25 -0.01 0.00 0.00 175.52 175.74 2kl5 h LEU 80 N 0.00 0.47 -0.65 0.00 5.85 -1.88 -0.46 115.31 118.65 2kl5 h LEU 80 Ca 0.00 -0.34 0.03 0.00 0.84 0.00 0.00 57.88 58.41 2kl5 h LEU 80 Cb 0.17 -0.13 -0.04 0.00 0.37 0.00 0.00 40.66 41.03 2kl5 h LEU 80 CO 0.00 0.70 0.41 -0.78 -0.34 0.00 0.00 178.44 178.43 2kl5 h ASP 81 N 0.24 0.67 -0.10 1.25 1.82 -1.42 0.61 116.42 119.50 2kl5 h ASP 81 Ca 0.07 -0.00 -0.01 0.00 -0.39 0.00 0.00 57.03 56.69 2kl5 h ASP 81 Cb 0.47 -0.15 -0.00 0.00 0.68 0.00 0.00 39.33 40.33 2kl5 h ASP 81 CO 0.02 0.47 0.01 -0.33 -1.61 0.00 0.00 179.24 177.80 2kl5 h GLU 82 N 0.81 0.16 0.23 0.28 4.39 -1.57 -2.44 114.58 116.44 2kl5 h GLU 82 Ca 0.26 -0.05 0.01 0.00 0.34 0.00 0.00 59.36 59.92 2kl5 h GLU 82 Cb 0.00 -0.02 -0.03 0.00 -0.10 0.00 0.00 28.75 28.60 2kl5 h GLU 82 CO -0.10 0.40 -0.36 -0.92 -1.16 0.00 0.00 179.01 176.87 2kl5 h TYR 83 N -0.09 -0.98 -0.75 4.33 3.20 -0.44 -2.36 116.97 119.88 2kl5 h TYR 83 Ca 0.03 0.02 0.04 0.00 3.14 0.00 0.00 58.73 61.95 2kl5 h TYR 83 Cb 0.32 0.40 -0.05 0.00 1.54 0.00 0.00 36.73 38.94 2kl5 h TYR 83 CO 0.03 -0.48 0.47 0.82 -1.64 0.00 0.00 178.16 177.35 2kl5 h ILE 84 N -0.66 1.09 -0.42 1.81 1.08 -0.97 -0.94 117.51 118.49 2kl5 h ILE 84 Ca 0.00 -0.31 0.12 0.00 -0.39 0.00 0.00 64.86 64.28 2kl5 h ILE 84 Cb 0.64 0.10 -0.02 0.00 -3.07 0.00 0.00 36.82 34.48 2kl5 h ILE 84 CO -0.14 0.17 0.30 0.22 -0.69 0.00 0.00 178.15 178.01 2kl5 h TYR 85 N 0.91 0.01 0.05 1.37 3.20 -1.00 0.10 116.97 121.61 2kl5 h TYR 85 Ca 0.31 0.00 -0.07 0.00 3.14 0.00 0.00 58.73 62.11 2kl5 h TYR 85 Cb 0.05 -0.00 0.01 0.00 1.54 0.00 0.00 36.73 38.33 2kl5 h TYR 85 CO -0.04 0.01 -0.30 0.93 -1.64 0.00 0.00 178.16 177.11 2kl5 h GLU 86 N 0.01 0.11 0.00 1.82 5.08 -0.70 -3.40 114.58 117.51 2kl5 h GLU 86 Ca 0.20 -0.19 0.00 0.00 -1.00 0.00 0.00 59.36 58.37 2kl5 h GLU 86 Cb 0.79 0.07 0.00 0.00 0.50 0.00 0.00 28.75 30.12 2kl5 h GLU 86 CO -0.00 1.09 0.00 0.66 -1.00 0.00 0.00 179.01 179.75 2kl5 n TYR 87 N -4.43 0.00 -2.62 4.33 4.02 -0.58 -4.65 117.16 113.22 2kl5 n TYR 87 Ca -0.11 0.00 -0.43 0.00 -0.01 0.00 0.00 57.90 57.35 2kl5 n TYR 87 Cb 0.61 0.00 -0.01 0.00 -0.02 0.00 0.00 39.34 39.92 2kl5 n TYR 87 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2kl5 s ASN 89 N 4.22 0.20 -0.91 0.00 4.22 -1.23 -4.38 114.94 117.06 2kl5 s ASN 89 Ca 0.51 0.71 -0.26 0.00 -2.14 0.00 0.00 52.86 51.68 2kl5 s ASN 89 Cb 0.02 -0.98 -0.14 0.00 1.28 0.00 0.00 41.25 41.43 2kl5 s ASN 89 CO 0.03 -4.57 2.22 0.12 -2.04 0.00 0.00 177.10 172.86 2kl5 s PHE 90 N -2.76 1.34 0.00 1.54 5.36 -1.26 -3.40 117.98 118.81 2kl5 s PHE 90 Ca 0.70 1.71 0.00 0.00 -0.96 0.00 0.00 56.93 58.38 2kl5 s PHE 90 Cb -0.11 -3.56 0.00 0.00 -0.34 0.00 0.00 43.02 39.01 2kl5 s PHE 90 CO 0.57 -1.36 0.00 0.41 -1.46 0.00 0.00 175.22 173.38 2kl5 n GLY 91 N 6.59 0.00 0.00 13.12 0.00 -1.26 -5.16 105.19 118.48 2kl5 n GLY 91 Ca 0.44 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.46 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 -1.00 1.54 0.04 0.00 0.00 -1.26 -4.80 121.76 116.28 2kl5 s ALA 93 Ca 0.00 -1.70 -0.27 0.00 0.00 0.00 0.00 51.96 49.99 2kl5 s ALA 93 Cb 0.00 0.66 0.09 0.00 0.00 0.00 0.00 23.12 23.87 2kl5 s ALA 93 CO 0.00 -0.34 0.82 1.52 0.00 0.00 0.00 175.76 177.76 2kl5 s TYR 94 N -3.63 -0.39 0.03 0.00 1.13 -1.22 -2.27 117.35 111.01 2kl5 s TYR 94 Ca 0.28 0.23 -0.06 0.00 -1.41 0.00 0.00 57.07 56.11 2kl5 s TYR 94 Cb 0.06 0.55 -0.01 0.00 -1.10 0.00 0.00 41.96 41.46 2kl5 s TYR 94 CO 0.07 -0.63 0.11 -0.59 -2.51 0.00 0.00 175.55 172.01 2kl5 s PHE 95 N -3.28 0.16 -0.10 -3.49 -0.71 -0.80 -1.67 117.98 108.08 2kl5 s PHE 95 Ca 0.04 -0.42 -0.01 0.00 -1.04 0.00 0.00 56.93 55.51 2kl5 s PHE 95 Cb -0.01 -0.11 0.03 0.00 -1.21 0.00 0.00 43.02 41.71 2kl5 s PHE 95 CO -0.10 -0.36 -0.06 0.08 -1.34 0.00 0.00 175.22 173.45 2kl5 s VAL 96 N -2.38 0.84 0.06 -2.49 1.01 0.45 -0.51 120.40 117.37 2kl5 s VAL 96 Ca -0.07 -0.18 0.04 0.00 0.00 0.00 0.00 61.98 61.78 2kl5 s VAL 96 Cb -0.02 -0.89 -0.04 0.00 0.00 0.00 0.00 36.38 35.43 2kl5 s VAL 96 CO -0.03 0.33 -0.01 -0.76 0.00 0.00 0.00 175.10 174.63 2kl5 s LEU 97 N 1.72 3.44 -0.02 3.92 1.02 0.43 -1.28 118.68 127.90 2kl5 s LEU 97 Ca 0.04 -0.14 0.04 0.00 0.02 0.00 0.00 54.13 54.09 2kl5 s LEU 97 Cb -0.13 -2.12 -0.01 0.00 0.02 0.00 0.00 46.19 43.96 2kl5 s LEU 97 CO -0.07 0.21 -0.14 -0.75 0.02 0.00 0.00 176.35 175.62 2kl5 s LYS 98 N -2.07 1.31 0.03 1.70 2.20 -0.24 -0.95 119.74 121.72 2kl5 s LYS 98 Ca 0.24 -0.50 -0.30 0.00 -0.36 0.00 0.00 55.97 55.04 2kl5 s LYS 98 Cb -0.12 -1.21 -0.06 0.00 -1.51 0.00 0.00 37.83 34.93 2kl5 s LYS 98 CO 0.16 0.25 1.42 0.50 -0.36 0.00 0.00 175.35 177.32 2kl5 s ARG 99 N -0.13 4.28 0.00 4.03 6.06 0.31 -0.84 118.95 132.67 2kl5 s ARG 99 Ca 0.01 2.02 0.00 0.00 -2.50 0.00 0.00 55.73 55.27 2kl5 s ARG 99 Cb -0.08 -3.51 0.00 0.00 0.06 0.00 0.00 34.95 31.42 2kl5 s ARG 99 CO 0.00 -0.56 0.00 -0.89 -2.50 0.00 0.00 175.30 171.36 2kl5 n ILE 100 N 4.51 0.00 0.00 4.11 2.08 -0.35 -4.95 119.36 124.76 2kl5 n ILE 100 Ca 0.13 0.06 0.00 0.00 0.56 0.00 0.00 62.75 63.50 2kl5 n ILE 100 Cb 0.43 -0.20 0.00 0.00 -0.75 0.00 0.00 39.64 39.12 2kl5 n ILE 100 CO 0.00 0.00 0.00 0.54 0.56 0.00 0.00 176.55 177.65 2kl5 n ARG 101 N 0.00 0.00 -3.62 0.38 1.74 -1.26 -5.10 116.66 108.80 2kl5 n ARG 101 Ca 0.00 0.00 -0.16 0.00 -0.77 0.00 0.00 57.85 56.92 2kl5 n ARG 101 Cb 0.00 0.00 -0.07 0.00 -1.02 0.00 0.00 32.46 31.37 2kl5 n ARG 101 CO 0.00 0.00 0.00 -1.59 -1.52 0.00 0.00 177.63 174.52 2kl5 s LYS 102 N 0.00 0.87 -0.62 5.56 0.00 -1.26 -4.94 119.74 119.35 2kl5 s LYS 102 Ca 0.00 0.28 -0.27 0.00 0.00 0.00 0.00 55.97 55.97 2kl5 s LYS 102 Cb 0.00 0.41 0.01 0.00 0.00 0.00 0.00 37.83 38.25 2kl5 s LYS 102 CO 0.00 -0.23 1.47 -0.51 0.00 0.00 0.00 175.35 176.08 2kl5 s LEU 103 N -0.87 3.31 -0.76 2.77 2.01 -1.26 -4.93 118.68 118.95 2kl5 s LEU 103 Ca -0.09 0.10 -0.26 0.00 0.01 0.00 0.00 54.13 53.89 2kl5 s LEU 103 Cb -0.02 -2.81 -0.01 0.00 0.01 0.00 0.00 46.19 43.36 2kl5 s LEU 103 CO 0.06 -1.88 1.70 -0.70 1.01 0.00 0.00 176.35 176.54 2kl5 s GLU 104 N 5.89 2.86 0.00 1.70 2.12 -1.26 -4.80 118.70 125.20 2kl5 s GLU 104 Ca 0.51 -0.01 0.00 0.00 0.36 0.00 0.00 54.97 55.83 2kl5 s GLU 104 Cb -0.10 -4.62 0.00 0.00 0.26 0.00 0.00 34.13 29.67 2kl5 s GLU 104 CO 0.21 -2.69 0.00 0.72 -0.54 0.00 0.00 175.26 172.97 2kl5 n HIS 105 N 11.80 0.00 0.00 5.30 8.25 -1.26 -4.93 115.22 134.38 2kl5 n HIS 105 Ca 0.23 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.69 2kl5 n HIS 105 Cb 0.50 -0.09 0.00 0.00 1.12 0.00 0.00 29.99 31.52 2kl5 n HIS 105 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 2kl5 n HIS 106 N -1.65 0.00 -1.45 4.41 8.25 -1.26 -4.88 115.22 118.64 2kl5 n HIS 106 Ca 0.00 0.00 -0.46 0.00 -0.26 0.00 0.00 57.72 57.00 2kl5 n HIS 106 Cb 0.00 0.00 -0.10 0.00 1.12 0.00 0.00 29.99 31.01 2kl5 n HIS 106 CO 0.00 0.00 0.00 1.58 0.64 0.00 0.00 176.34 178.56 2kl5 n HIS 107 N 0.00 1.09 -0.02 4.41 -0.00 -1.26 -4.78 115.22 114.67 2kl5 n HIS 107 Ca 0.00 0.38 0.00 0.00 -0.00 0.00 0.00 57.72 58.10 2kl5 n HIS 107 Cb 0.00 -2.45 0.00 0.00 -0.00 0.00 0.00 29.99 27.54 2kl5 n HIS 107 CO 0.00 0.00 0.00 0.72 -0.00 0.00 0.00 176.34 177.06 2kl5 n HIS 108 N 10.79 0.00 -3.42 1.57 8.25 -1.26 -4.48 115.22 126.67 2kl5 n HIS 108 Ca 0.52 -0.80 -0.22 0.00 -0.26 0.00 0.00 57.72 56.96 2kl5 n HIS 108 Cb 0.16 -0.41 -0.10 0.00 1.12 0.00 0.00 29.99 30.76 2kl5 n HIS 108 CO 0.00 0.00 0.00 -1.58 0.64 0.00 0.00 176.34 175.40 2kl5 s HIS 109 N 0.09 0.08 -0.49 4.41 5.65 -1.26 -5.31 115.29 118.46 2kl5 s HIS 109 Ca 0.00 -0.99 0.04 0.00 0.25 0.00 0.00 55.06 54.35 2kl5 s HIS 109 Cb 0.00 -0.64 0.03 0.00 -1.18 0.00 0.00 32.58 30.79 2kl5 s HIS 109 CO 0.00 -0.90 0.62 1.58 -0.65 0.00 0.00 174.74 175.39