#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kl2 s ALA 2 N 0.00 1.11 -0.15 3.04 0.00 -0.13 -4.98 121.76 120.65 2kl2 s ALA 2 Ca 0.00 -1.18 -0.04 0.00 0.00 0.00 0.00 51.96 50.74 2kl2 s ALA 2 Cb 0.00 0.03 -0.03 0.00 0.00 0.00 0.00 23.12 23.12 2kl2 s ALA 2 CO 0.00 -0.03 -0.02 -1.01 0.00 0.00 0.00 175.76 174.69 2kl2 s HIS 3 N -2.40 3.06 0.29 0.00 0.09 -1.26 -1.05 115.29 114.01 2kl2 s HIS 3 Ca 0.05 -0.21 0.04 0.00 -0.00 0.00 0.00 55.06 54.95 2kl2 s HIS 3 Cb -0.03 -1.95 -0.06 0.00 -0.00 0.00 0.00 32.58 30.54 2kl2 s HIS 3 CO 0.00 0.03 0.01 0.96 -0.00 0.00 0.00 174.74 175.75 2kl2 s ILE 4 N 0.24 1.26 0.04 0.60 -4.36 -0.63 -2.23 121.20 116.11 2kl2 s ILE 4 Ca -0.02 -2.04 0.06 0.00 -0.26 0.00 0.00 60.65 58.39 2kl2 s ILE 4 Cb -0.14 -2.58 -0.02 0.00 1.25 0.00 0.00 42.46 40.97 2kl2 s ILE 4 CO 0.03 -0.17 -0.18 0.12 0.24 0.00 0.00 174.94 174.98 2kl2 s PHE 5 N -3.26 1.58 -0.23 1.37 5.36 -0.77 -1.17 117.98 120.86 2kl2 s PHE 5 Ca 0.32 -0.36 -0.08 0.00 -0.96 0.00 0.00 56.93 55.85 2kl2 s PHE 5 Cb 0.07 -0.95 -0.04 0.00 -0.34 0.00 0.00 43.02 41.76 2kl2 s PHE 5 CO 0.13 0.06 0.10 0.14 -1.46 0.00 0.00 175.22 174.19 2kl2 s VAL 6 N -0.78 4.75 -0.07 3.12 -7.23 -1.19 -4.72 120.40 114.28 2kl2 s VAL 6 Ca 0.05 -0.03 -0.25 0.00 -1.81 0.00 0.00 61.98 59.94 2kl2 s VAL 6 Cb -0.08 -3.21 -0.24 0.00 0.56 0.00 0.00 36.38 33.41 2kl2 s VAL 6 CO 0.01 0.36 0.99 1.88 -0.31 0.00 0.00 175.10 178.03 2kl2 h TYR 7 N 7.71 0.20 0.00 2.82 0.05 -1.94 -3.38 116.97 122.42 2kl2 h TYR 7 Ca -0.37 -0.11 0.00 0.00 0.05 0.00 0.00 58.73 58.30 2kl2 h TYR 7 Cb 1.18 -0.02 0.00 0.00 1.01 0.00 0.00 36.73 38.89 2kl2 h TYR 7 CO 0.65 0.94 0.00 0.41 -1.05 0.00 0.00 178.16 179.11 2kl2 n GLY 8 N 1.13 0.54 0.02 3.88 0.00 -1.26 -4.67 105.19 104.82 2kl2 n GLY 8 Ca -0.10 0.00 0.01 0.00 0.00 0.00 0.00 46.02 45.93 2kl2 n GLY 8 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2kl2 n THR 9 N 0.00 0.00 -2.71 2.61 -2.24 -1.26 -4.69 114.28 105.99 2kl2 n THR 9 Ca 0.00 -0.48 -0.06 0.00 -2.27 0.00 0.00 64.05 61.24 2kl2 n THR 9 Cb 0.12 1.01 0.06 0.00 -2.10 0.00 0.00 70.33 69.42 2kl2 n THR 9 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 2kl2 n LEU 10 N -0.69 0.57 0.00 3.22 4.32 -1.26 -3.71 117.00 119.45 2kl2 n LEU 10 Ca 0.00 -3.47 0.00 0.00 -0.02 0.00 0.00 56.01 52.52 2kl2 n LEU 10 Cb 0.03 0.33 0.00 0.00 -1.62 0.00 0.00 43.42 42.16 2kl2 n LEU 10 CO 0.02 1.53 0.00 1.17 -1.22 0.00 0.00 177.39 178.89 2kl2 n LYS 11 N -0.41 0.00 -0.24 3.23 0.00 -1.26 -4.95 118.16 114.53 2kl2 n LYS 11 Ca 0.04 0.00 0.04 0.00 0.00 0.00 0.00 58.31 58.39 2kl2 n LYS 11 Cb 0.83 0.00 0.16 0.00 0.00 0.00 0.00 35.03 36.02 2kl2 n LYS 11 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2kl2 h ARG 12 N 0.00 0.33 0.00 1.64 3.08 -1.94 -3.43 114.38 114.06 2kl2 h ARG 12 Ca 0.00 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.03 2kl2 h ARG 12 Cb 0.00 -0.07 0.00 0.00 0.08 0.00 0.00 29.97 29.98 2kl2 h ARG 12 CO 0.00 0.22 0.00 0.41 -1.07 0.00 0.00 179.97 179.53 2kl2 n GLY 13 N -1.33 -0.81 3.90 0.04 0.00 -1.26 -5.18 105.19 100.55 2kl2 n GLY 13 Ca 0.13 0.22 -0.21 0.00 0.00 0.00 0.00 46.02 46.16 2kl2 n GLY 13 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2kl2 s GLN 14 N 0.00 3.14 0.42 1.61 1.11 -1.26 -4.82 119.66 119.87 2kl2 s GLN 14 Ca 0.00 -0.94 0.09 0.00 0.01 0.00 0.00 55.36 54.52 2kl2 s GLN 14 Cb 0.00 -2.72 0.92 0.00 -1.01 0.00 0.00 33.01 30.20 2kl2 s GLN 14 CO 0.00 0.36 2.03 -1.00 0.01 0.00 0.00 175.29 176.69 2kl2 h PRO 15 N 1.28 0.34 0.00 2.91 0.13 -1.99 -1.54 132.00 133.14 2kl2 h PRO 15 Ca -0.49 -0.04 -0.05 0.00 -0.87 0.00 0.00 66.00 64.55 2kl2 h PRO 15 Cb 1.24 -0.07 -0.01 0.00 0.13 0.00 0.00 31.00 32.29 2kl2 h PRO 15 CO 0.60 0.30 -0.23 -0.91 -0.23 0.00 0.00 178.00 177.53 2kl2 h ASN 16 N 0.34 0.00 -0.90 1.44 2.35 -1.96 -3.33 115.58 113.51 2kl2 h ASN 16 Ca 0.09 0.00 0.20 0.00 -0.55 0.00 0.00 56.30 56.04 2kl2 h ASN 16 Cb 0.09 0.00 -0.07 0.00 0.05 0.00 0.00 38.32 38.39 2kl2 h ASN 16 CO -0.01 0.23 0.60 -0.74 -1.65 0.00 0.00 177.43 175.85 2kl2 h HIS 17 N 0.00 0.55 -1.15 1.19 2.76 -1.35 -0.70 115.15 116.45 2kl2 h HIS 17 Ca -0.00 0.02 0.32 0.00 -2.20 0.00 0.00 60.37 58.51 2kl2 h HIS 17 Cb 0.70 -0.17 -0.08 0.00 1.55 0.00 0.00 27.41 29.42 2kl2 h HIS 17 CO 0.00 0.15 0.78 1.57 -1.30 0.00 0.00 177.93 179.13 2kl2 h LYS 18 N 0.42 0.18 -0.58 5.26 5.09 -1.79 -2.07 116.57 123.08 2kl2 h LYS 18 Ca 0.47 -0.01 0.02 0.00 0.09 0.00 0.00 60.65 61.22 2kl2 h LYS 18 Cb 1.16 -0.04 -0.03 0.00 0.10 0.00 0.00 32.23 33.42 2kl2 h LYS 18 CO -0.18 0.12 0.38 -0.39 -2.09 0.00 0.00 179.45 177.29 2kl2 h VAL 19 N 0.19 1.12 0.00 0.07 -1.51 -1.43 -0.92 116.25 113.77 2kl2 h VAL 19 Ca 0.61 -0.25 0.00 0.00 -1.23 0.00 0.00 66.70 65.83 2kl2 h VAL 19 Cb 1.98 0.31 0.00 0.00 -2.13 0.00 0.00 31.29 31.46 2kl2 h VAL 19 CO -0.18 0.14 -0.19 1.15 -1.23 0.00 0.00 177.57 177.25 2kl2 n MET 20 N -4.46 0.14 0.04 5.19 0.00 -0.78 -3.15 117.12 114.11 2kl2 n MET 20 Ca 0.06 0.09 0.14 0.00 0.00 0.00 0.00 57.70 57.98 2kl2 n MET 20 Cb 0.08 -1.63 0.54 0.00 0.00 0.00 0.00 33.22 32.20 2kl2 n MET 20 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 175.97 177.25 2kl2 n LEU 21 N -1.86 0.31 -4.31 3.17 4.77 -0.36 -4.43 117.00 114.29 2kl2 n LEU 21 Ca 0.06 0.53 -0.46 0.00 -0.03 0.00 0.00 56.01 56.10 2kl2 n LEU 21 Cb 0.39 -0.43 -0.05 0.00 -2.33 0.00 0.00 43.42 41.00 2kl2 n LEU 21 CO 0.31 -0.07 0.15 -1.81 -1.33 0.00 0.00 177.39 174.64 2kl2 s ASP 22 N -3.58 6.20 0.64 -1.43 1.01 -1.18 -4.93 116.67 113.39 2kl2 s ASP 22 Ca 0.13 -1.82 0.42 0.00 0.71 0.00 0.00 52.55 51.98 2kl2 s ASP 22 Cb 0.16 -2.21 2.27 0.00 1.01 0.00 0.00 42.92 44.16 2kl2 s ASP 22 CO 0.56 -0.85 2.28 -0.74 0.21 0.00 0.00 175.17 176.63 2kl2 h HIS 23 N 8.84 0.00 -0.75 4.23 -0.00 -1.82 0.13 115.15 125.79 2kl2 h HIS 23 Ca -0.28 0.00 0.01 0.00 -0.00 0.00 0.00 60.37 60.10 2kl2 h HIS 23 Cb 1.10 0.00 -0.04 0.00 -0.00 0.00 0.00 27.41 28.47 2kl2 h HIS 23 CO 0.74 0.00 0.49 0.77 -0.00 0.00 0.00 177.93 179.93 2kl2 h SER 24 N 0.00 0.85 0.24 3.26 0.02 -1.94 -1.73 113.55 114.24 2kl2 h SER 24 Ca 0.00 -0.02 -0.20 0.00 -0.84 0.00 0.00 61.79 60.73 2kl2 h SER 24 Cb 0.07 -0.21 -0.00 0.00 0.14 0.00 0.00 62.40 62.39 2kl2 h SER 24 CO 0.00 0.61 -0.78 0.45 -1.14 0.00 0.00 176.83 175.97 2kl2 h HIS 25 N 1.00 0.61 0.00 3.45 3.86 -1.03 -3.49 115.15 119.54 2kl2 h HIS 25 Ca 0.28 -0.28 0.00 0.00 -1.16 0.00 0.00 60.37 59.20 2kl2 h HIS 25 Cb -0.10 -0.09 0.00 0.00 1.06 0.00 0.00 27.41 28.29 2kl2 h HIS 25 CO -0.00 1.06 0.00 0.41 0.86 0.00 0.00 177.93 180.26 2kl2 n GLY 26 N 0.65 0.20 3.77 2.45 0.00 -0.65 -2.92 105.19 108.69 2kl2 n GLY 26 Ca -0.05 -1.77 -0.36 0.00 0.00 0.00 0.00 46.02 43.84 2kl2 n GLY 26 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2kl2 s LEU 27 N 0.00 3.78 -0.30 0.99 1.43 -1.26 -4.06 118.68 119.26 2kl2 s LEU 27 Ca 0.00 2.25 -0.03 0.00 -1.03 0.00 0.00 54.13 55.31 2kl2 s LEU 27 Cb 0.00 -4.52 0.18 0.00 0.03 0.00 0.00 46.19 41.88 2kl2 s LEU 27 CO 0.00 -1.24 0.67 0.00 0.23 0.00 0.00 176.35 176.01 2kl2 s ALA 28 N -1.69 -2.42 0.05 4.21 0.00 -1.24 -3.86 121.76 116.81 2kl2 s ALA 28 Ca 0.72 1.82 0.05 0.00 0.00 0.00 0.00 51.96 54.55 2kl2 s ALA 28 Cb -0.26 -2.19 -0.02 0.00 0.00 0.00 0.00 23.12 20.64 2kl2 s ALA 28 CO 0.30 -1.32 -0.14 0.00 0.00 0.00 0.00 175.76 174.59 2kl2 s ALA 29 N 2.87 1.18 -0.98 0.00 0.00 -0.00 -4.97 121.76 119.86 2kl2 s ALA 29 Ca 0.16 -0.87 -0.24 0.00 0.00 0.00 0.00 51.96 51.02 2kl2 s ALA 29 Cb -0.14 -0.17 -0.07 0.00 0.00 0.00 0.00 23.12 22.74 2kl2 s ALA 29 CO -0.19 0.21 1.97 0.12 0.00 0.00 0.00 175.76 177.87 2kl2 s PHE 30 N -0.94 1.80 -0.98 0.00 2.19 -1.26 -0.89 117.98 117.90 2kl2 s PHE 30 Ca 0.01 0.70 -0.01 0.00 0.33 0.00 0.00 56.93 57.96 2kl2 s PHE 30 Cb -0.08 -3.98 0.31 0.00 -1.31 0.00 0.00 43.02 37.96 2kl2 s PHE 30 CO 0.01 -1.55 1.56 -2.13 1.83 0.00 0.00 175.22 174.95 2kl2 n ARG 31 N 8.67 4.74 0.00 10.12 3.00 0.04 -4.73 116.66 138.51 2kl2 n ARG 31 Ca 0.42 -4.65 0.00 0.00 -0.00 0.00 0.00 57.85 53.62 2kl2 n ARG 31 Cb 0.47 -2.45 0.00 0.00 0.00 0.00 0.00 32.46 30.48 2kl2 n ARG 31 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 2kl2 n GLY 32 N 0.45 -2.92 3.35 5.14 0.00 -1.25 -4.57 105.19 105.40 2kl2 n GLY 32 Ca 0.37 -1.73 -0.18 0.00 0.00 0.00 0.00 46.02 44.48 2kl2 n GLY 32 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2kl2 s ARG 33 N -0.91 1.53 0.20 1.61 1.70 -0.06 -1.30 118.95 121.73 2kl2 s ARG 33 Ca 0.00 -1.86 -0.12 0.00 -0.47 0.00 0.00 55.73 53.28 2kl2 s ARG 33 Cb 0.00 -0.27 0.05 0.00 -0.57 0.00 0.00 34.95 34.15 2kl2 s ARG 33 CO 0.00 -0.36 0.62 0.41 -1.08 0.00 0.00 175.30 174.90 2kl2 n GLY 34 N -0.56 1.07 3.17 3.88 0.00 -0.25 -0.85 105.19 111.65 2kl2 n GLY 34 Ca -0.00 -1.13 -0.08 0.00 0.00 0.00 0.00 46.02 44.80 2kl2 n GLY 34 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2kl2 s THR 36 N -3.77 3.74 0.28 0.00 -4.23 0.85 -0.84 115.64 111.67 2kl2 s THR 36 Ca 0.05 0.52 0.09 0.00 -1.18 0.00 0.00 61.69 61.16 2kl2 s THR 36 Cb 0.05 -4.68 -0.01 0.00 1.34 0.00 0.00 72.50 69.20 2kl2 s THR 36 CO -0.10 -1.54 1.64 -0.37 -0.54 0.00 0.00 174.62 173.71 2kl2 h VAL 37 N 6.22 1.39 -2.74 2.29 -1.51 -1.90 -3.32 116.25 116.67 2kl2 h VAL 37 Ca -0.27 -1.89 -0.56 0.00 -1.23 0.00 0.00 66.70 62.75 2kl2 h VAL 37 Cb 1.07 1.98 -0.02 0.00 -2.13 0.00 0.00 31.29 32.19 2kl2 h VAL 37 CO 1.24 0.55 1.06 -1.61 -1.23 0.00 0.00 177.57 177.57 2kl2 s GLU 38 N -3.80 4.05 0.55 5.19 2.02 -1.26 -4.96 118.70 120.49 2kl2 s GLU 38 Ca -0.03 1.86 -0.21 0.00 0.02 0.00 0.00 54.97 56.61 2kl2 s GLU 38 Cb 0.13 -3.95 -0.05 0.00 0.10 0.00 0.00 34.13 30.35 2kl2 s GLU 38 CO 0.77 -0.98 1.22 0.43 0.02 0.00 0.00 175.26 176.72 2kl2 n SER 39 N 7.50 2.03 -4.11 -0.19 7.64 -1.25 -4.71 113.62 120.54 2kl2 n SER 39 Ca 0.17 0.94 -0.13 0.00 1.01 0.00 0.00 58.87 60.86 2kl2 n SER 39 Cb 0.44 -1.51 -0.11 0.00 -1.01 0.00 0.00 64.21 62.03 2kl2 n SER 39 CO 0.00 0.00 0.00 -0.36 -3.01 0.00 0.00 175.04 171.67 2kl2 s PHE 40 N -1.34 0.78 -0.15 1.43 0.08 -0.20 -0.28 117.98 118.30 2kl2 s PHE 40 Ca 0.72 -0.62 -0.29 0.00 0.12 0.00 0.00 56.93 56.85 2kl2 s PHE 40 Cb -0.43 -0.46 -0.01 0.00 -0.57 0.00 0.00 43.02 41.55 2kl2 s PHE 40 CO 0.49 -0.09 1.17 -1.25 -0.10 0.00 0.00 175.22 175.44 2kl2 s PRO 41 N -2.30 4.28 -0.27 0.24 0.04 -1.09 -2.00 135.00 133.90 2kl2 s PRO 41 Ca -0.02 1.56 -0.00 0.00 0.04 0.00 0.00 61.00 62.57 2kl2 s PRO 41 Cb -0.05 -3.67 0.04 0.00 0.04 0.00 0.00 34.50 30.86 2kl2 s PRO 41 CO -0.01 -0.59 -0.05 -1.17 0.04 0.00 0.00 177.00 175.21 2kl2 s LEU 42 N 3.01 3.50 0.06 -3.56 2.96 -1.26 -1.22 118.68 122.18 2kl2 s LEU 42 Ca 0.52 -1.16 0.06 0.00 -0.22 0.00 0.00 54.13 53.32 2kl2 s LEU 42 Cb -0.20 -1.65 -0.03 0.00 0.50 0.00 0.00 46.19 44.81 2kl2 s LEU 42 CO 0.14 -0.19 -0.16 0.68 -1.32 0.00 0.00 176.35 175.50 2kl2 s VAL 43 N 1.24 1.27 -0.10 1.68 -7.23 -0.51 -2.85 120.40 113.90 2kl2 s VAL 43 Ca -0.04 -1.24 -0.23 0.00 -1.81 0.00 0.00 61.98 58.66 2kl2 s VAL 43 Cb -0.19 -1.17 -0.03 0.00 0.56 0.00 0.00 36.38 35.55 2kl2 s VAL 43 CO -0.04 -0.08 0.70 -0.63 -0.31 0.00 0.00 175.10 174.74 2kl2 s ILE 44 N -1.07 5.03 0.25 -0.62 1.01 -1.26 -0.91 121.20 123.63 2kl2 s ILE 44 Ca 0.02 1.41 0.00 0.00 0.00 0.00 0.00 60.65 62.08 2kl2 s ILE 44 Cb -0.09 -4.03 -0.03 0.00 0.01 0.00 0.00 42.46 38.32 2kl2 s ILE 44 CO 0.02 0.20 0.23 0.00 0.00 0.00 0.00 174.94 175.39 2kl2 s ALA 45 N 1.15 1.24 0.01 9.38 0.00 -0.94 -4.94 121.76 127.65 2kl2 s ALA 45 Ca 0.36 -1.73 0.00 0.00 0.00 0.00 0.00 51.96 50.58 2kl2 s ALA 45 Cb -0.17 1.37 0.00 0.00 0.00 0.00 0.00 23.12 24.32 2kl2 s ALA 45 CO 0.16 -0.65 0.00 0.41 0.00 0.00 0.00 175.76 175.68 2kl2 n GLY 46 N -0.41 -2.14 0.35 0.00 0.00 -1.26 -1.25 105.19 100.47 2kl2 n GLY 46 Ca 0.03 -1.46 0.13 0.00 0.00 0.00 0.00 46.02 44.72 2kl2 n GLY 46 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2kl2 n GLU 47 N -0.61 1.13 -0.05 1.61 2.13 -1.26 -3.70 120.64 119.90 2kl2 n GLU 47 Ca 0.00 -0.70 0.03 0.00 0.66 0.00 0.00 57.16 57.16 2kl2 n GLU 47 Cb 0.02 -1.49 0.05 0.00 0.27 0.00 0.00 31.44 30.29 2kl2 n GLU 47 CO 0.00 0.00 0.00 0.72 -0.41 0.00 0.00 177.13 177.44 2kl2 n HIS 48 N -0.33 0.07 -3.27 4.31 8.25 -1.26 -5.01 115.22 117.98 2kl2 n HIS 48 Ca 0.14 -0.63 -0.09 0.00 -0.26 0.00 0.00 57.72 56.88 2kl2 n HIS 48 Cb 0.36 -0.08 0.00 0.00 1.12 0.00 0.00 29.99 31.40 2kl2 n HIS 48 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 2kl2 n ASN 49 N -0.63 -6.87 -4.26 0.41 3.02 -1.24 -1.43 115.26 104.25 2kl2 n ASN 49 Ca 0.05 -0.28 -0.44 0.00 -0.03 0.00 0.00 54.58 53.89 2kl2 n ASN 49 Cb 0.38 -4.12 -0.04 0.00 -0.61 0.00 0.00 39.78 35.38 2kl2 n ASN 49 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 2kl2 s ILE 50 N -2.90 5.01 0.12 2.41 1.01 -0.38 -3.99 121.20 122.47 2kl2 s ILE 50 Ca 0.04 -2.59 -0.31 0.00 0.00 0.00 0.00 60.65 57.79 2kl2 s ILE 50 Cb -0.01 -4.14 -0.10 0.00 0.01 0.00 0.00 42.46 38.22 2kl2 s ILE 50 CO 0.80 -0.98 1.82 -2.16 0.00 0.00 0.00 174.94 174.42 2kl2 s PRO 51 N 0.14 4.14 0.23 2.79 0.04 -1.26 -2.22 135.00 138.86 2kl2 s PRO 51 Ca 0.17 2.57 0.10 0.00 0.04 0.00 0.00 61.00 63.89 2kl2 s PRO 51 Cb -0.14 -3.61 -0.04 0.00 0.04 0.00 0.00 34.50 30.75 2kl2 s PRO 51 CO -0.07 -0.84 -0.13 -1.58 0.04 0.00 0.00 177.00 174.42 2kl2 s TRP 52 N 2.77 2.49 -0.25 0.56 0.52 -0.09 -4.98 118.94 119.97 2kl2 s TRP 52 Ca 0.80 -0.28 -0.01 0.00 0.02 0.00 0.00 56.10 56.64 2kl2 s TRP 52 Cb -0.45 -1.16 0.03 0.00 -1.15 0.00 0.00 33.47 30.73 2kl2 s TRP 52 CO 0.36 0.58 -0.06 -1.17 0.02 0.00 0.00 176.95 176.68 2kl2 s LEU 53 N -3.15 3.22 0.27 2.99 2.96 -1.26 -1.43 118.68 122.28 2kl2 s LEU 53 Ca 0.27 -0.92 -0.24 0.00 -0.22 0.00 0.00 54.13 53.02 2kl2 s LEU 53 Cb -0.07 -1.66 -0.09 0.00 0.50 0.00 0.00 46.19 44.87 2kl2 s LEU 53 CO 0.15 -0.14 0.86 -0.76 -1.32 0.00 0.00 176.35 175.14 2kl2 s LEU 54 N 1.31 4.37 -1.04 -0.68 1.43 -0.35 -2.23 118.68 121.48 2kl2 s LEU 54 Ca -0.00 1.68 -0.23 0.00 -1.03 0.00 0.00 54.13 54.55 2kl2 s LEU 54 Cb -0.17 -3.81 0.05 0.00 0.03 0.00 0.00 46.19 42.29 2kl2 s LEU 54 CO -0.05 -0.01 1.49 -0.47 0.23 0.00 0.00 176.35 177.55 2kl2 s TYR 55 N -1.54 2.54 -0.41 0.29 5.04 -0.24 -3.96 117.35 119.07 2kl2 s TYR 55 Ca 0.46 -0.88 0.02 0.00 -2.44 0.00 0.00 57.07 54.24 2kl2 s TYR 55 Cb -0.18 -4.69 0.15 0.00 0.35 0.00 0.00 41.96 37.59 2kl2 s TYR 55 CO 0.23 -1.92 0.28 -1.17 -1.34 0.00 0.00 175.55 171.63 2kl2 s LEU 56 N 5.04 1.61 0.19 6.97 0.20 -1.26 -4.94 118.68 126.49 2kl2 s LEU 56 Ca 0.47 -2.68 -0.32 0.00 0.69 0.00 0.00 54.13 52.30 2kl2 s LEU 56 Cb 0.00 -0.58 -0.12 0.00 -0.43 0.00 0.00 46.19 45.07 2kl2 s LEU 56 CO -0.08 -0.24 1.75 -2.16 -0.29 0.00 0.00 176.35 175.33 2kl2 s PRO 57 N 0.44 4.13 0.00 0.98 0.04 -1.26 -2.28 135.00 137.05 2kl2 s PRO 57 Ca 0.24 2.60 0.00 0.00 0.04 0.00 0.00 61.00 63.88 2kl2 s PRO 57 Cb -0.12 -3.19 0.00 0.00 0.04 0.00 0.00 34.50 31.23 2kl2 s PRO 57 CO -0.08 -0.77 0.00 0.41 0.04 0.00 0.00 177.00 176.60 2kl2 n GLY 58 N 4.03 0.70 3.51 0.56 0.00 0.62 -4.94 105.19 109.68 2kl2 n GLY 58 Ca 0.16 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.94 2kl2 n GLY 58 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2kl2 s LYS 59 N -0.38 1.74 6.32 1.61 2.47 -0.97 -4.83 119.74 125.70 2kl2 s LYS 59 Ca 0.00 -1.88 0.00 0.00 -1.56 0.00 0.00 55.97 52.53 2kl2 s LYS 59 Cb 0.00 -1.59 0.00 0.00 -1.46 0.00 0.00 37.83 34.78 2kl2 s LYS 59 CO 0.00 0.15 0.00 0.41 0.16 0.00 0.00 175.35 176.07 2kl2 n GLY 60 N -0.72 1.18 3.31 5.54 0.00 -1.26 -1.03 105.19 112.21 2kl2 n GLY 60 Ca -0.05 -0.56 -0.10 0.00 0.00 0.00 0.00 46.02 45.30 2kl2 n GLY 60 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2kl2 s HIS 61 N 0.00 0.67 -1.17 1.61 3.76 -0.85 -4.75 115.29 114.56 2kl2 s HIS 61 Ca 0.00 -1.00 -0.13 0.00 -0.15 0.00 0.00 55.06 53.79 2kl2 s HIS 61 Cb 0.00 -0.22 0.20 0.00 1.11 0.00 0.00 32.58 33.67 2kl2 s HIS 61 CO 0.00 -0.71 1.34 0.00 -0.85 0.00 0.00 174.74 174.52 2kl2 s VAL 63 N 0.91 3.19 0.27 0.00 0.11 -1.26 -4.42 120.40 119.21 2kl2 s VAL 63 Ca 0.39 1.04 -0.08 0.00 -2.93 0.00 0.00 61.98 60.41 2kl2 s VAL 63 Cb -0.05 -3.67 -0.06 0.00 -1.53 0.00 0.00 36.38 31.07 2kl2 s VAL 63 CO -0.02 0.19 0.57 0.42 -3.33 0.00 0.00 175.10 172.92 2kl2 s THR 64 N -0.30 4.96 0.19 5.04 -4.23 -1.19 -0.11 115.64 120.01 2kl2 s THR 64 Ca 0.53 0.30 -0.09 0.00 -1.18 0.00 0.00 61.69 61.25 2kl2 s THR 64 Cb -0.36 -3.68 0.04 0.00 1.34 0.00 0.00 72.50 69.84 2kl2 s THR 64 CO 0.41 -0.22 0.47 0.61 -0.54 0.00 0.00 174.62 175.35 2kl2 n GLY 65 N -0.59 1.31 3.80 3.99 0.00 0.00 -4.81 105.19 108.90 2kl2 n GLY 65 Ca -0.00 -1.13 -0.23 0.00 0.00 0.00 0.00 46.02 44.66 2kl2 n GLY 65 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2kl2 s GLU 66 N -2.04 2.87 -0.31 1.61 2.12 -1.26 -1.09 118.70 120.60 2kl2 s GLU 66 Ca 0.10 -1.01 -0.03 0.00 0.36 0.00 0.00 54.97 54.39 2kl2 s GLU 66 Cb -0.02 -2.57 0.05 0.00 0.26 0.00 0.00 34.13 31.85 2kl2 s GLU 66 CO 0.06 0.43 0.02 0.42 -0.54 0.00 0.00 175.26 175.65 2kl2 s ILE 67 N -2.01 3.15 -0.22 -3.70 1.01 -0.42 -3.20 121.20 115.83 2kl2 s ILE 67 Ca 0.32 -1.32 -0.17 0.00 0.00 0.00 0.00 60.65 59.48 2kl2 s ILE 67 Cb -0.09 -2.80 -0.03 0.00 0.01 0.00 0.00 42.46 39.55 2kl2 s ILE 67 CO 0.24 -0.12 0.46 -0.31 0.00 0.00 0.00 174.94 175.21 2kl2 s TYR 68 N 1.29 3.34 -0.39 3.97 2.02 -0.32 -0.78 117.35 126.49 2kl2 s TYR 68 Ca -0.04 0.66 -0.28 0.00 -0.37 0.00 0.00 57.07 57.03 2kl2 s TYR 68 Cb -0.20 -2.62 -0.02 0.00 -0.40 0.00 0.00 41.96 38.73 2kl2 s TYR 68 CO -0.00 -0.11 1.80 -2.00 -1.57 0.00 0.00 175.55 173.67 2kl2 s GLU 69 N 1.67 3.20 0.41 -0.62 2.12 -0.06 -1.60 118.70 123.81 2kl2 s GLU 69 Ca 0.21 1.26 0.08 0.00 0.36 0.00 0.00 54.97 56.88 2kl2 s GLU 69 Cb -0.15 -4.23 -0.01 0.00 0.26 0.00 0.00 34.13 30.00 2kl2 s GLU 69 CO 0.09 -2.02 0.46 0.14 -0.54 0.00 0.00 175.26 173.39 2kl2 s VAL 70 N 7.31 2.88 0.50 3.70 -7.23 -0.22 -0.82 120.40 126.52 2kl2 s VAL 70 Ca 0.77 -1.19 0.02 0.00 -1.81 0.00 0.00 61.98 59.77 2kl2 s VAL 70 Cb -0.20 -3.02 -0.01 0.00 0.56 0.00 0.00 36.38 33.70 2kl2 s VAL 70 CO 0.31 -0.01 0.03 -1.81 -0.31 0.00 0.00 175.10 173.31 2kl2 s ASP 71 N -4.22 4.15 0.27 4.85 1.11 -1.25 -0.03 116.67 121.55 2kl2 s ASP 71 Ca 0.51 -1.60 -0.02 0.00 0.18 0.00 0.00 52.55 51.61 2kl2 s ASP 71 Cb -0.06 0.44 0.58 0.00 1.07 0.00 0.00 42.92 44.95 2kl2 s ASP 71 CO 0.30 -0.84 1.63 -0.08 1.18 0.00 0.00 175.17 177.36 2kl2 h GLU 72 N 1.34 0.12 -0.51 8.23 4.81 -1.95 -0.82 114.58 125.80 2kl2 h GLU 72 Ca -0.43 -0.01 0.04 0.00 -0.13 0.00 0.00 59.36 58.83 2kl2 h GLU 72 Cb 1.31 -0.03 -0.04 0.00 0.63 0.00 0.00 28.75 30.62 2kl2 h GLU 72 CO 0.74 0.08 0.27 0.37 -0.73 0.00 0.00 179.01 179.74 2kl2 h GLN 73 N 0.12 0.52 -0.09 1.92 5.75 -1.96 0.62 115.11 121.99 2kl2 h GLN 73 Ca 0.49 -0.03 -0.09 0.00 -0.15 0.00 0.00 58.65 58.87 2kl2 h GLN 73 Cb 0.94 -0.12 0.00 0.00 1.07 0.00 0.00 27.48 29.37 2kl2 h GLN 73 CO -0.71 0.34 -0.28 1.98 -2.65 0.00 0.00 178.83 177.52 2kl2 h MET 74 N 0.54 0.35 -0.24 1.69 4.05 -1.03 -1.87 114.93 118.40 2kl2 h MET 74 Ca 0.22 -0.25 -0.03 0.00 -0.28 0.00 0.00 59.70 59.36 2kl2 h MET 74 Cb 0.10 0.04 -0.01 0.00 -0.80 0.00 0.00 31.60 30.93 2kl2 h MET 74 CO -0.14 0.88 0.03 1.25 0.23 0.00 0.00 176.91 179.16 2kl2 h LEU 75 N -0.12 0.32 -0.57 3.39 6.46 -1.22 -1.23 115.31 122.34 2kl2 h LEU 75 Ca -0.01 -0.04 -0.14 0.00 -0.12 0.00 0.00 57.88 57.57 2kl2 h LEU 75 Cb 0.90 -0.08 -0.01 0.00 -0.73 0.00 0.00 40.66 40.74 2kl2 h LEU 75 CO 0.06 0.36 -0.36 0.03 -0.62 0.00 0.00 178.44 177.91 2kl2 h ARG 76 N 0.35 0.75 -0.17 1.25 3.08 -0.74 -1.73 114.38 117.17 2kl2 h ARG 76 Ca 0.08 -0.37 0.00 0.00 0.07 0.00 0.00 59.98 59.77 2kl2 h ARG 76 Cb 0.19 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.23 2kl2 h ARG 76 CO 0.00 0.99 0.11 0.35 -1.07 0.00 0.00 179.97 180.35 2kl2 h PHE 77 N 0.62 0.22 -0.89 3.04 3.57 -0.58 -2.73 116.94 120.19 2kl2 h PHE 77 Ca 0.06 0.00 0.06 0.00 3.53 0.00 0.00 57.97 61.62 2kl2 h PHE 77 Cb 0.90 -0.07 -0.06 0.00 2.79 0.00 0.00 35.95 39.50 2kl2 h PHE 77 CO 0.05 0.15 0.56 -0.07 -2.23 0.00 0.00 178.31 176.76 2kl2 h LEU 78 N 0.22 0.90 0.00 0.59 4.07 -1.16 0.18 115.31 120.10 2kl2 h LEU 78 Ca 0.06 0.01 0.00 0.00 0.08 0.00 0.00 57.88 58.03 2kl2 h LEU 78 Cb -0.02 -0.18 0.00 0.00 1.08 0.00 0.00 40.66 41.54 2kl2 h LEU 78 CO -0.01 0.58 0.00 -0.67 -1.08 0.00 0.00 178.44 177.26 2kl2 n ASP 79 N -4.58 0.00 0.00 -0.43 2.03 -0.66 -1.15 116.55 111.77 2kl2 n ASP 79 Ca 0.13 -0.43 0.00 0.00 0.52 0.00 0.00 54.79 55.00 2kl2 n ASP 79 Cb 0.15 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.55 2kl2 n ASP 79 CO 0.00 0.00 0.00 -0.67 -1.92 0.00 0.00 177.20 174.61 2kl2 n ASP 80 N -0.77 0.42 -0.21 1.67 -0.08 -0.88 -4.49 116.55 112.21 2kl2 n ASP 80 Ca 0.04 0.00 -0.07 0.00 -1.51 0.00 0.00 54.79 53.24 2kl2 n ASP 80 Cb 0.02 0.00 0.03 0.00 2.34 0.00 0.00 41.12 43.50 2kl2 n ASP 80 CO 0.00 0.00 0.00 0.15 0.12 0.00 0.00 177.20 177.47 2kl2 h PHE 81 N 0.00 0.89 0.00 -0.67 3.57 -0.80 -1.37 116.94 118.57 2kl2 h PHE 81 Ca 0.00 -0.06 0.00 0.00 3.53 0.00 0.00 57.97 61.44 2kl2 h PHE 81 Cb 0.51 -0.27 0.00 0.00 2.79 0.00 0.00 35.95 38.98 2kl2 h PHE 81 CO 0.00 0.71 0.00 0.39 -2.23 0.00 0.00 178.31 177.18 2kl2 n GLU 82 N -4.48 0.90 -1.21 1.11 -0.58 -0.30 -4.87 120.64 111.21 2kl2 n GLU 82 Ca 0.03 0.00 -0.10 0.00 -0.42 0.00 0.00 57.16 56.67 2kl2 n GLU 82 Cb 0.16 -1.06 -0.04 0.00 -0.57 0.00 0.00 31.44 29.93 2kl2 n GLU 82 CO 0.00 0.00 0.00 -3.47 -0.48 0.00 0.00 177.13 173.18 2kl2 n ASP 83 N -0.43 -4.10 -4.71 1.62 2.03 -0.52 -3.31 116.55 107.13 2kl2 n ASP 83 Ca 0.00 0.26 -0.33 0.00 0.52 0.00 0.00 54.79 55.23 2kl2 n ASP 83 Cb 0.03 -3.34 0.11 0.00 -0.72 0.00 0.00 41.12 37.19 2kl2 n ASP 83 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2kl2 n PRO 85 N -3.10 0.40 0.27 0.00 -0.04 -1.26 -4.80 135.00 126.47 2kl2 n PRO 85 Ca 0.13 0.07 -0.11 0.00 -0.04 0.00 0.00 63.50 63.55 2kl2 n PRO 85 Cb 0.51 -1.50 -0.05 0.00 -0.04 0.00 0.00 33.50 32.42 2kl2 n PRO 85 CO 0.00 0.00 0.00 0.77 -0.04 0.00 0.00 175.50 176.23 2kl2 h SER 86 N 0.00 -0.59 0.00 3.54 0.02 -1.77 -3.40 113.55 111.35 2kl2 h SER 86 Ca 0.00 0.02 0.00 0.00 -0.84 0.00 0.00 61.79 60.97 2kl2 h SER 86 Cb 0.15 0.15 0.00 0.00 0.14 0.00 0.00 62.40 62.84 2kl2 h SER 86 CO 0.00 -0.36 0.00 0.23 -1.14 0.00 0.00 176.83 175.56 2kl2 n MET 87 N -4.21 0.00 -2.34 3.45 2.81 -1.14 -4.97 117.12 110.72 2kl2 n MET 87 Ca -0.09 0.17 -0.13 0.00 -1.81 0.00 0.00 57.70 55.84 2kl2 n MET 87 Cb 0.27 -0.81 0.05 0.00 -0.71 0.00 0.00 33.22 32.02 2kl2 n MET 87 CO 0.00 0.00 0.00 0.66 1.51 0.00 0.00 175.97 178.14 2kl2 n TYR 88 N -1.00 -2.52 -3.68 2.03 4.01 -1.21 -4.82 117.16 109.98 2kl2 n TYR 88 Ca 0.00 -1.43 -0.14 0.00 -0.16 0.00 0.00 57.90 56.16 2kl2 n TYR 88 Cb 0.00 -0.37 -0.07 0.00 -0.31 0.00 0.00 39.34 38.58 2kl2 n TYR 88 CO 0.00 0.00 0.00 1.14 -0.46 0.00 0.00 176.86 177.54 2kl2 s GLN 89 N -3.78 0.83 0.09 -0.72 0.00 0.10 -4.03 119.66 112.16 2kl2 s GLN 89 Ca 0.41 -0.15 -0.31 0.00 -0.00 0.00 0.00 55.36 55.31 2kl2 s GLN 89 Cb -0.03 0.38 -0.09 0.00 0.00 0.00 0.00 33.01 33.26 2kl2 s GLN 89 CO 0.26 -0.26 1.67 0.50 0.00 0.00 0.00 175.29 177.47 2kl2 s ARG 90 N -1.68 4.19 0.34 9.60 3.00 -1.26 -3.19 118.95 129.96 2kl2 s ARG 90 Ca -0.10 2.38 0.03 0.00 -1.00 0.00 0.00 55.73 57.04 2kl2 s ARG 90 Cb -0.03 -3.53 -0.04 0.00 0.00 0.00 0.00 34.95 31.36 2kl2 s ARG 90 CO 0.03 -0.73 0.13 0.99 0.00 0.00 0.00 175.30 175.72 2kl2 s THR 91 N 2.43 0.58 -0.06 4.11 2.01 -0.88 -5.00 115.64 118.83 2kl2 s THR 91 Ca 0.74 -2.00 0.04 0.00 0.31 0.00 0.00 61.69 60.78 2kl2 s THR 91 Cb -0.41 -2.51 0.00 0.00 0.01 0.00 0.00 72.50 69.59 2kl2 s THR 91 CO 0.33 0.00 -0.18 0.00 -0.69 0.00 0.00 174.62 174.08 2kl2 s ALA 92 N -3.42 1.62 0.46 7.40 0.00 -1.26 -2.38 121.76 124.17 2kl2 s ALA 92 Ca 0.32 -0.69 0.03 0.00 0.00 0.00 0.00 51.96 51.62 2kl2 s ALA 92 Cb 0.05 -0.59 -0.02 0.00 0.00 0.00 0.00 23.12 22.55 2kl2 s ALA 92 CO 0.16 0.24 0.05 -0.48 0.00 0.00 0.00 175.76 175.73 2kl2 s LEU 93 N 0.27 2.23 -0.32 0.00 -0.00 -1.13 -4.97 118.68 114.76 2kl2 s LEU 93 Ca -0.10 -1.63 -0.09 0.00 -0.00 0.00 0.00 54.13 52.31 2kl2 s LEU 93 Cb -0.14 -0.51 0.01 0.00 -0.00 0.00 0.00 46.19 45.54 2kl2 s LEU 93 CO 0.04 -0.84 0.14 -1.58 -0.00 0.00 0.00 176.35 174.10 2kl2 s GLN 94 N -3.81 3.14 -0.05 1.48 2.00 -1.26 -2.74 119.66 118.42 2kl2 s GLN 94 Ca 0.15 -0.84 0.01 0.00 -2.00 0.00 0.00 55.36 52.68 2kl2 s GLN 94 Cb 0.03 -3.52 -0.03 0.00 0.80 0.00 0.00 33.01 30.28 2kl2 s GLN 94 CO 0.09 -0.48 -0.04 0.08 -0.50 0.00 0.00 175.29 174.43 2kl2 s VAL 95 N 1.56 3.91 0.20 1.34 1.01 -0.09 -3.55 120.40 124.78 2kl2 s VAL 95 Ca 0.03 -0.48 -0.30 0.00 0.00 0.00 0.00 61.98 61.24 2kl2 s VAL 95 Cb -0.18 -2.64 -0.08 0.00 0.00 0.00 0.00 36.38 33.48 2kl2 s VAL 95 CO 0.05 0.54 1.06 -1.58 0.00 0.00 0.00 175.10 175.18 2kl2 s GLN 96 N -1.01 4.65 -1.03 2.72 0.74 -0.02 -0.56 119.66 125.15 2kl2 s GLN 96 Ca 0.14 1.68 -0.12 0.00 0.05 0.00 0.00 55.36 57.12 2kl2 s GLN 96 Cb -0.11 -3.27 0.24 0.00 1.10 0.00 0.00 33.01 30.97 2kl2 s GLN 96 CO 0.04 0.18 1.05 0.54 -0.55 0.00 0.00 175.29 176.55 2kl2 s VAL 97 N -0.57 5.69 0.55 1.34 0.11 -0.97 -1.91 120.40 124.65 2kl2 s VAL 97 Ca 0.47 -2.93 0.36 0.00 -2.93 0.00 0.00 61.98 56.95 2kl2 s VAL 97 Cb -0.29 -4.61 0.39 0.00 -1.53 0.00 0.00 36.38 30.33 2kl2 s VAL 97 CO 0.35 -1.21 2.25 -0.07 -3.33 0.00 0.00 175.10 173.10 2kl2 h LEU 98 N 7.61 0.00 -7.30 2.54 -0.00 -1.32 -3.43 115.31 113.41 2kl2 h LEU 98 Ca 0.17 0.00 -0.07 0.00 -0.00 0.00 0.00 57.88 57.98 2kl2 h LEU 98 Cb 0.93 0.00 -0.17 0.00 -0.00 0.00 0.00 40.66 41.43 2kl2 h LEU 98 CO 0.97 0.02 -0.05 -0.70 -0.00 0.00 0.00 178.44 178.68 2kl2 s GLU 99 N -4.28 0.96 -0.07 1.13 2.56 -1.11 -4.90 118.70 112.99 2kl2 s GLU 99 Ca -0.04 -0.30 0.00 0.00 0.00 0.00 0.00 54.97 54.64 2kl2 s GLU 99 Cb 0.13 0.43 0.02 0.00 2.00 0.00 0.00 34.13 36.72 2kl2 s GLU 99 CO 0.50 -0.34 -0.05 -0.46 -0.56 0.00 0.00 175.26 174.35 2kl2 s TRP 100 N -2.41 1.00 -0.34 5.30 -0.11 -1.26 -0.88 118.94 120.24 2kl2 s TRP 100 Ca -0.06 -0.37 -0.20 0.00 1.22 0.00 0.00 56.10 56.70 2kl2 s TRP 100 Cb -0.01 -0.89 -0.00 0.00 -1.50 0.00 0.00 33.47 31.07 2kl2 s TRP 100 CO -0.02 -0.31 0.60 -1.21 -4.62 0.00 0.00 176.95 171.39 2kl2 s GLU 101 N 1.33 3.74 0.44 5.86 0.41 -1.26 -4.83 118.70 124.38 2kl2 s GLU 101 Ca -0.04 0.08 0.00 0.00 -0.41 0.00 0.00 54.97 54.60 2kl2 s GLU 101 Cb -0.14 -3.78 0.00 0.00 -1.78 0.00 0.00 34.13 28.43 2kl2 s GLU 101 CO -0.03 -0.66 0.00 0.41 -0.49 0.00 0.00 175.26 174.49 2kl2 n GLY 102 N 4.63 -1.84 3.62 -1.39 0.00 -1.26 -4.70 105.19 104.25 2kl2 n GLY 102 Ca -0.02 -1.80 -0.29 0.00 0.00 0.00 0.00 46.02 43.91 2kl2 n GLY 102 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2kl2 s ASP 103 N -4.00 1.88 -0.26 1.61 2.15 -1.26 -4.74 116.67 112.05 2kl2 s ASP 103 Ca 0.00 1.06 -0.00 0.00 0.43 0.00 0.00 52.55 54.03 2kl2 s ASP 103 Cb 0.00 -1.63 -0.01 0.00 -0.30 0.00 0.00 42.92 40.98 2kl2 s ASP 103 CO 0.00 -3.58 0.24 0.61 -0.17 0.00 0.00 175.17 172.28 2kl2 n GLY 104 N -0.80 -0.39 3.30 2.66 0.00 -1.26 -4.99 105.19 103.72 2kl2 n GLY 104 Ca 0.07 0.01 -0.46 0.00 0.00 0.00 0.00 46.02 45.64 2kl2 n GLY 104 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2kl2 s ASP 105 N -2.52 6.59 0.63 1.61 2.15 -1.26 -4.95 116.67 118.92 2kl2 s ASP 105 Ca 0.04 -2.75 0.31 0.00 0.43 0.00 0.00 52.55 50.58 2kl2 s ASP 105 Cb -0.00 -2.17 1.72 0.00 -0.30 0.00 0.00 42.92 42.17 2kl2 s ASP 105 CO 0.24 -0.54 2.03 1.55 -0.17 0.00 0.00 175.17 178.28 2kl2 h PRO 106 N 7.64 0.00 0.00 4.34 0.13 -1.94 -3.48 132.00 138.69 2kl2 h PRO 106 Ca 0.10 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.23 2kl2 h PRO 106 Cb 1.02 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.15 2kl2 h PRO 106 CO 0.75 0.00 0.00 0.41 -0.23 0.00 0.00 178.00 178.93 2kl2 n GLY 107 N -1.30 2.37 0.00 1.56 0.00 -1.26 -4.89 105.19 101.67 2kl2 n GLY 107 Ca 0.01 -1.86 0.02 0.00 0.00 0.00 0.00 46.02 44.18 2kl2 n GLY 107 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2kl2 n ASP 108 N 0.00 0.00 -4.12 1.61 2.03 -1.26 -4.22 116.55 110.59 2kl2 n ASP 108 Ca 0.00 -0.29 -0.14 0.00 0.52 0.00 0.00 54.79 54.88 2kl2 n ASP 108 Cb 0.00 0.00 -0.11 0.00 -0.72 0.00 0.00 41.12 40.29 2kl2 n ASP 108 CO 0.00 0.00 0.00 -0.94 -1.92 0.00 0.00 177.20 174.34 2kl2 s SER 109 N -1.90 1.19 0.05 1.67 1.04 -1.26 -2.29 113.70 112.20 2kl2 s SER 109 Ca 0.05 -0.67 0.02 0.00 0.48 0.00 0.00 55.95 55.82 2kl2 s SER 109 Cb 0.02 0.02 -0.03 0.00 0.10 0.00 0.00 66.02 66.13 2kl2 s SER 109 CO 0.04 -0.22 -0.06 0.68 0.98 0.00 0.00 173.24 174.66 2kl2 s VAL 110 N -1.81 0.46 -0.09 5.02 -7.23 0.27 -4.91 120.40 112.12 2kl2 s VAL 110 Ca -0.03 -1.22 -0.21 0.00 -1.81 0.00 0.00 61.98 58.72 2kl2 s VAL 110 Cb -0.07 -0.75 -0.04 0.00 0.56 0.00 0.00 36.38 36.08 2kl2 s VAL 110 CO 0.00 -0.51 0.58 -1.58 -0.31 0.00 0.00 175.10 173.28 2kl2 s GLN 111 N -2.03 4.38 0.44 4.82 -0.44 -1.26 -0.91 119.66 124.66 2kl2 s GLN 111 Ca -0.07 0.66 0.04 0.00 -2.50 0.00 0.00 55.36 53.49 2kl2 s GLN 111 Cb -0.07 -3.44 -0.01 0.00 -1.64 0.00 0.00 33.01 27.85 2kl2 s GLN 111 CO -0.01 0.12 0.14 0.00 0.50 0.00 0.00 175.29 176.04 2kl2 s PHE 113 N -3.13 3.36 -0.30 0.00 0.08 -0.95 -2.83 117.98 114.22 2kl2 s PHE 113 Ca 0.19 -0.04 -0.10 0.00 0.12 0.00 0.00 56.93 57.11 2kl2 s PHE 113 Cb 0.01 -1.53 0.15 0.00 -0.57 0.00 0.00 43.02 41.08 2kl2 s PHE 113 CO 0.14 0.46 0.74 0.14 -0.10 0.00 0.00 175.22 176.60 2kl2 s VAL 114 N -2.01 -0.85 -1.10 -0.44 -7.23 -1.00 -1.84 120.40 105.93 2kl2 s VAL 114 Ca 0.34 0.00 -0.20 0.00 -1.81 0.00 0.00 61.98 60.31 2kl2 s VAL 114 Cb -0.09 -1.00 0.09 0.00 0.56 0.00 0.00 36.38 35.94 2kl2 s VAL 114 CO 0.28 0.00 1.46 -0.31 -0.31 0.00 0.00 175.10 176.21 2kl2 s TYR 115 N 2.79 2.84 0.70 2.82 2.02 -1.26 -2.07 117.35 125.19 2kl2 s TYR 115 Ca -0.01 -1.32 0.02 0.00 -0.37 0.00 0.00 57.07 55.39 2kl2 s TYR 115 Cb -0.11 -4.58 0.13 0.00 -0.40 0.00 0.00 41.96 37.00 2kl2 s TYR 115 CO -0.19 -1.74 0.96 0.25 -1.57 0.00 0.00 175.55 173.26 2kl2 n THR 116 N 6.19 0.00 -4.33 -0.71 -2.24 -1.19 -4.76 114.28 107.23 2kl2 n THR 116 Ca 0.36 -1.70 -0.18 0.00 -2.27 0.00 0.00 64.05 60.26 2kl2 n THR 116 Cb 0.48 -0.78 -0.14 0.00 -2.10 0.00 0.00 70.33 67.78 2kl2 n THR 116 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 2kl2 s THR 117 N -3.02 0.69 -0.86 4.28 -1.32 -0.95 -0.72 115.64 113.76 2kl2 s THR 117 Ca 0.66 -0.44 0.17 0.00 -1.21 0.00 0.00 61.69 60.88 2kl2 s THR 117 Cb -0.04 -0.59 -0.18 0.00 -1.51 0.00 0.00 72.50 70.17 2kl2 s THR 117 CO 0.43 0.15 0.75 0.00 -2.21 0.00 0.00 174.62 173.74 2kl2 n ALA 118 N 2.75 4.23 -1.37 11.08 0.00 -1.26 -1.08 120.51 134.85 2kl2 n ALA 118 Ca -0.14 -0.50 -0.26 0.00 0.00 0.00 0.00 53.44 52.55 2kl2 n ALA 118 Cb 0.57 -0.63 0.13 0.00 0.00 0.00 0.00 19.45 19.51 2kl2 n ALA 118 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.50 175.13 2kl2 n THR 119 N -1.35 3.23 -0.94 0.00 5.66 -1.26 -5.00 114.28 114.62 2kl2 n THR 119 Ca 0.03 -2.65 -0.30 0.00 -3.05 0.00 0.00 64.05 58.08 2kl2 n THR 119 Cb 0.28 -0.79 0.17 0.00 -1.55 0.00 0.00 70.33 68.43 2kl2 n THR 119 CO 0.00 0.00 0.00 -0.72 -3.05 0.00 0.00 175.07 171.30 2kl2 s TYR 120 N -3.54 1.96 0.22 1.09 -0.85 -1.26 -5.07 117.35 109.90 2kl2 s TYR 120 Ca 0.58 1.40 -0.10 0.00 -0.52 0.00 0.00 57.07 58.43 2kl2 s TYR 120 Cb 0.48 -3.18 -0.07 0.00 0.38 0.00 0.00 41.96 39.56 2kl2 s TYR 120 CO 0.04 -2.77 0.54 0.00 -1.52 0.00 0.00 175.55 171.84 2kl2 s ALA 121 N -2.76 3.58 0.45 9.51 0.00 -1.26 -5.02 121.76 126.26 2kl2 s ALA 121 Ca 0.65 -0.28 0.14 0.00 0.00 0.00 0.00 51.96 52.47 2kl2 s ALA 121 Cb -0.21 -2.42 1.00 0.00 0.00 0.00 0.00 23.12 21.49 2kl2 s ALA 121 CO 0.59 0.52 1.99 -1.00 0.00 0.00 0.00 175.76 177.86 2kl2 h PRO 122 N 2.66 0.02 -0.19 0.00 0.13 -2.03 -1.91 132.00 130.68 2kl2 h PRO 122 Ca -0.47 -0.00 0.05 0.00 -0.87 0.00 0.00 66.00 64.71 2kl2 h PRO 122 Cb 1.17 -0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.29 2kl2 h PRO 122 CO 0.69 0.19 0.14 1.05 -0.23 0.00 0.00 178.00 179.83 2kl2 h GLU 123 N 0.02 0.00 0.00 0.86 9.09 -2.02 -2.63 114.58 119.90 2kl2 h GLU 123 Ca 0.00 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.41 2kl2 h GLU 123 Cb 0.31 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.41 2kl2 h GLU 123 CO 0.02 0.00 0.00 0.91 0.05 0.00 0.00 179.01 179.99 2kl2 n TRP 124 N -4.46 0.00 0.10 2.06 7.02 -0.72 -1.13 117.44 120.32 2kl2 n TRP 124 Ca 0.02 0.00 0.11 0.00 -1.02 0.00 0.00 57.50 56.60 2kl2 n TRP 124 Cb 0.27 -0.42 -0.00 0.00 -2.42 0.00 0.00 31.31 28.74 2kl2 n TRP 124 CO 0.00 0.00 0.00 -0.07 -2.02 0.00 0.00 177.69 175.60 2kl2 h LEU 125 N 0.00 0.00 -0.71 -0.99 -0.00 -1.65 -3.34 115.31 108.62 2kl2 h LEU 125 Ca 0.00 0.00 -0.12 0.00 -0.00 0.00 0.00 57.88 57.76 2kl2 h LEU 125 Cb 0.24 0.00 -0.01 0.00 -0.00 0.00 0.00 40.66 40.89 2kl2 h LEU 125 CO 0.00 0.03 -0.35 -0.26 -0.00 0.00 0.00 178.44 177.85 2kl2 h PHE 126 N 0.00 0.69 -3.92 1.13 0.04 -1.27 -3.46 116.94 110.15 2kl2 h PHE 126 Ca -0.01 -0.18 -0.56 0.00 2.80 0.00 0.00 57.97 60.02 2kl2 h PHE 126 Cb 1.03 -0.15 0.16 0.00 2.20 0.00 0.00 35.95 39.18 2kl2 h PHE 126 CO 0.00 0.86 0.37 1.28 -0.60 0.00 0.00 178.31 180.23 2kl2 n LEU 127 N -4.06 5.22 -4.78 1.54 4.77 -1.22 -5.01 117.00 113.46 2kl2 n LEU 127 Ca -0.01 0.82 -0.29 0.00 -0.03 0.00 0.00 56.01 56.49 2kl2 n LEU 127 Cb 0.49 -1.50 0.12 0.00 -2.33 0.00 0.00 43.42 40.19 2kl2 n LEU 127 CO 0.45 -1.31 0.70 -2.16 -1.33 0.00 0.00 177.39 173.74 2kl2 s PRO 128 N -3.16 1.60 0.28 3.23 0.04 -1.26 -5.05 135.00 130.67 2kl2 s PRO 128 Ca 0.80 0.55 0.11 0.00 0.04 0.00 0.00 61.00 62.51 2kl2 s PRO 128 Cb -0.39 -1.87 -0.05 0.00 0.04 0.00 0.00 34.50 32.23 2kl2 s PRO 128 CO 0.42 -1.94 -0.16 0.71 0.04 0.00 0.00 177.00 176.07 2kl2 s TYR 129 N -3.15 2.36 0.15 0.56 2.02 -1.26 -4.64 117.35 113.39 2kl2 s TYR 129 Ca 0.62 -0.32 -0.01 0.00 -0.37 0.00 0.00 57.07 57.00 2kl2 s TYR 129 Cb -0.15 -1.04 -0.04 0.00 -0.40 0.00 0.00 41.96 40.33 2kl2 s TYR 129 CO 0.55 0.70 0.08 -1.01 -1.57 0.00 0.00 175.55 174.29 2kl2 s HIS 130 N -2.48 0.96 0.00 2.71 3.76 -1.13 -4.97 115.29 114.13 2kl2 s HIS 130 Ca 0.30 -1.27 0.00 0.00 -0.15 0.00 0.00 55.06 53.94 2kl2 s HIS 130 Cb -0.05 -0.51 0.00 0.00 1.11 0.00 0.00 32.58 33.13 2kl2 s HIS 130 CO 0.16 -0.54 0.16 -1.91 -0.85 0.00 0.00 174.74 171.76 2kl2 n GLU 131 N -0.15 1.86 -4.04 1.40 2.13 -1.26 -4.42 120.64 116.16 2kl2 n GLU 131 Ca -0.03 -0.16 -0.18 0.00 0.66 0.00 0.00 57.16 57.44 2kl2 n GLU 131 Cb 0.64 -0.57 -0.07 0.00 0.27 0.00 0.00 31.44 31.71 2kl2 n GLU 131 CO 0.00 0.00 0.00 -1.13 -0.41 0.00 0.00 177.13 175.59 2kl2 n SER 132 N -0.31 -0.39 -4.39 4.31 3.41 -1.26 -3.18 113.62 111.81 2kl2 n SER 132 Ca 0.00 -2.98 -0.26 0.00 -0.26 0.00 0.00 58.87 55.37 2kl2 n SER 132 Cb 0.05 1.44 -0.09 0.00 -0.26 0.00 0.00 64.21 65.34 2kl2 n SER 132 CO 0.00 0.00 0.00 -0.31 -0.16 0.00 0.00 175.04 174.57 2kl2 s TYR 133 N -3.19 1.92 -0.38 7.33 2.02 -1.26 -5.08 117.35 118.72 2kl2 s TYR 133 Ca 0.34 -1.06 0.03 0.00 -0.37 0.00 0.00 57.07 56.01 2kl2 s TYR 133 Cb 0.02 -1.34 0.16 0.00 -0.40 0.00 0.00 41.96 40.39 2kl2 s TYR 133 CO 0.24 -0.03 0.38 -0.51 -1.57 0.00 0.00 175.55 174.05 2kl2 s ASP 134 N -3.63 1.20 0.60 2.29 1.01 -1.26 -4.97 116.67 111.91 2kl2 s ASP 134 Ca 0.25 -1.77 0.35 0.00 0.71 0.00 0.00 52.55 52.10 2kl2 s ASP 134 Cb 0.05 0.47 1.94 0.00 1.01 0.00 0.00 42.92 46.39 2kl2 s ASP 134 CO 0.13 -0.24 2.24 -1.28 0.21 0.00 0.00 175.17 176.22 2kl2 h SER 135 N 6.83 0.00 -2.94 0.27 0.87 -1.92 -2.87 113.55 113.80 2kl2 h SER 135 Ca 0.07 0.00 -0.76 0.00 -1.23 0.00 0.00 61.79 59.88 2kl2 h SER 135 Cb 1.04 0.00 -0.32 0.00 -0.44 0.00 0.00 62.40 62.68 2kl2 h SER 135 CO 0.21 0.03 0.36 -0.62 -0.53 0.00 0.00 176.83 176.27 2kl2 n GLU 136 N -3.43 3.73 -3.92 2.24 -0.58 -1.26 -4.74 120.64 112.66 2kl2 n GLU 136 Ca -0.02 -4.55 -0.09 0.00 -0.42 0.00 0.00 57.16 52.07 2kl2 n GLU 136 Cb 0.13 -2.46 -0.09 0.00 -0.57 0.00 0.00 31.44 28.45 2kl2 n GLU 136 CO 0.00 0.00 0.00 0.20 -0.48 0.00 0.00 177.13 176.85 2kl2 s GLY 137 N -1.22 0.17 0.00 0.62 0.00 -1.08 -5.06 107.32 100.74 2kl2 s GLY 137 Ca 0.32 -0.55 0.21 0.00 0.00 0.00 0.00 44.72 44.70 2kl2 s GLY 137 CO 0.02 -0.69 1.65 -1.55 0.00 0.00 0.00 173.10 172.54 2kl2 n PRO 138 N 0.74 0.24 -0.22 2.90 -0.04 -1.26 -4.06 135.00 133.29 2kl2 n PRO 138 Ca -0.19 0.10 0.21 0.00 -0.04 0.00 0.00 63.50 63.59 2kl2 n PRO 138 Cb 0.59 -1.50 0.56 0.00 -0.04 0.00 0.00 33.50 33.11 2kl2 n PRO 138 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2kl2 h HIS 139 N 0.00 0.42 0.00 0.54 3.86 -1.97 -3.45 115.15 114.54 2kl2 h HIS 139 Ca 0.00 0.01 0.00 0.00 -1.16 0.00 0.00 60.37 59.22 2kl2 h HIS 139 Cb 0.22 -0.13 0.00 0.00 1.06 0.00 0.00 27.41 28.57 2kl2 h HIS 139 CO 0.00 0.11 0.00 0.41 0.86 0.00 0.00 177.93 179.31 2kl2 n GLY 140 N -1.56 3.19 2.67 2.45 0.00 -1.26 -4.92 105.19 105.77 2kl2 n GLY 140 Ca 0.19 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.80 2kl2 n GLY 140 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 2kl2 n LEU 141 N 0.00 7.44 -4.92 0.99 -0.00 -1.26 -5.03 117.00 114.22 2kl2 n LEU 141 Ca 0.00 -5.21 -0.26 0.00 -0.00 0.00 0.00 56.01 50.53 2kl2 n LEU 141 Cb 0.00 -1.17 0.07 0.00 -0.00 0.00 0.00 43.42 42.32 2kl2 n LEU 141 CO 0.00 1.99 0.64 -0.13 -0.00 0.00 0.00 177.39 179.89 2kl2 s ARG 142 N -3.94 2.22 0.65 1.47 1.81 -1.26 -4.88 118.95 115.01 2kl2 s ARG 142 Ca 0.43 -0.17 -0.18 0.00 -1.72 0.00 0.00 55.73 54.10 2kl2 s ARG 142 Cb 0.24 -2.14 -0.01 0.00 -0.45 0.00 0.00 34.95 32.59 2kl2 s ARG 142 CO -0.18 -1.26 1.26 -0.47 -0.68 0.00 0.00 175.30 173.97 2kl2 s TYR 143 N -3.28 2.14 -0.82 -0.53 5.04 -1.26 -4.61 117.35 114.03 2kl2 s TYR 143 Ca 0.60 1.51 0.01 0.00 -2.44 0.00 0.00 57.07 56.75 2kl2 s TYR 143 Cb -0.11 -3.61 0.21 0.00 0.35 0.00 0.00 41.96 38.80 2kl2 s TYR 143 CO 0.45 -2.71 0.69 0.09 -1.34 0.00 0.00 175.55 172.74 2kl2 n ASN 144 N -1.99 3.80 -0.19 4.32 5.03 -0.52 -4.93 115.26 120.79 2kl2 n ASN 144 Ca 0.15 -3.19 -0.09 0.00 0.87 0.00 0.00 54.58 52.32 2kl2 n ASN 144 Cb 0.49 -0.93 0.01 0.00 -1.02 0.00 0.00 39.78 38.33 2kl2 n ASN 144 CO 0.00 0.00 0.00 1.55 -1.83 0.00 0.00 177.26 176.98 2kl2 h PRO 145 N 5.65 0.96 0.00 3.52 0.13 -1.86 -3.40 132.00 137.00 2kl2 h PRO 145 Ca 0.16 -0.30 0.00 0.00 -0.87 0.00 0.00 66.00 64.99 2kl2 h PRO 145 Cb 0.77 -0.09 0.00 0.00 0.13 0.00 0.00 31.00 31.82 2kl2 h PRO 145 CO 0.82 0.97 0.00 -2.13 -0.23 0.00 0.00 178.00 177.42 2kl2 n ARG 146 N -4.27 0.00 -0.29 0.86 0.63 -1.26 -4.93 116.66 107.40 2kl2 n ARG 146 Ca 0.02 -0.12 -0.01 0.00 -0.92 0.00 0.00 57.85 56.82 2kl2 n ARG 146 Cb 0.33 -0.22 0.12 0.00 0.45 0.00 0.00 32.46 33.13 2kl2 n ARG 146 CO 0.00 0.00 0.00 0.93 -2.51 0.00 0.00 177.63 176.05 2kl2 h GLU 147 N 0.00 0.92 -0.03 -0.14 4.39 -1.93 -0.32 114.58 117.48 2kl2 h GLU 147 Ca 0.00 -0.06 -0.04 0.00 0.34 0.00 0.00 59.36 59.61 2kl2 h GLU 147 Cb 0.78 -0.21 -0.05 0.00 -0.10 0.00 0.00 28.75 29.17 2kl2 h GLU 147 CO 0.00 0.61 -0.56 0.27 -1.16 0.00 0.00 179.01 178.17 2kl2 n ASN 148 N -4.63 1.77 0.00 1.42 0.23 -1.26 -5.18 115.26 107.61 2kl2 n ASN 148 Ca 0.11 -3.74 0.00 0.00 -0.53 0.00 0.00 54.58 50.42 2kl2 n ASN 148 Cb 0.14 -0.50 0.00 0.00 -2.08 0.00 0.00 39.78 37.33 2kl2 n ASN 148 CO 0.00 0.00 0.00 -1.14 -0.93 0.00 0.00 177.26 175.19