#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3kl8 n ASN 12 N 0.00 1.63 -4.80 -2.24 4.13 -1.26 -4.97 115.26 107.74 3kl8 n ASN 12 Ca 0.00 -0.04 -0.37 0.00 1.68 0.00 0.00 54.58 55.85 3kl8 n ASN 12 Cb 0.00 -0.23 -0.06 0.00 -1.54 0.00 0.00 39.78 37.95 3kl8 n ASN 12 CO 0.00 0.00 0.00 -0.31 0.28 0.00 0.00 177.26 177.23 3kl8 s TYR 13 N -2.52 3.72 -0.21 3.10 1.51 -1.26 -0.96 117.35 120.72 3kl8 s TYR 13 Ca -0.28 1.45 0.01 0.00 -1.01 0.00 0.00 57.07 57.24 3kl8 s TYR 13 Cb 0.08 -2.66 0.03 0.00 -0.11 0.00 0.00 41.96 39.30 3kl8 s TYR 13 CO 0.67 0.39 -0.15 0.34 -1.11 0.00 0.00 175.55 175.69 3kl8 s ASP 14 N -1.50 3.62 0.36 2.29 2.15 -0.85 -4.91 116.67 117.83 3kl8 s ASP 14 Ca 0.41 -0.79 -0.27 0.00 0.43 0.00 0.00 52.55 52.33 3kl8 s ASP 14 Cb -0.18 -1.54 -0.09 0.00 -0.30 0.00 0.00 42.92 40.81 3kl8 s ASP 14 CO 0.22 -0.05 1.21 -0.69 -0.17 0.00 0.00 175.17 175.69 3kl8 s VAL 15 N 1.28 3.03 0.00 1.11 1.01 -1.26 -2.25 120.40 123.32 3kl8 s VAL 15 Ca 0.02 0.94 0.00 0.00 0.00 0.00 0.00 61.98 62.94 3kl8 s VAL 15 Cb -0.15 -3.56 0.00 0.00 0.00 0.00 0.00 36.38 32.67 3kl8 s VAL 15 CO -0.10 0.16 0.00 0.29 0.00 0.00 0.00 175.10 175.45 3kl8 n LYS 16 N 0.46 2.96 -0.12 2.72 4.76 -1.11 -4.92 118.16 122.91 3kl8 n LYS 16 Ca 0.02 0.00 -0.04 0.00 -2.87 0.00 0.00 58.31 55.43 3kl8 n LYS 16 Cb 0.45 0.00 0.03 0.00 -1.84 0.00 0.00 35.03 33.67 3kl8 n LYS 16 CO 0.00 0.00 0.00 -0.85 -1.37 0.00 0.00 177.40 175.18 3kl8 n GLU 17 N 0.00 -1.35 -4.57 1.97 0.00 -1.26 -4.63 120.64 110.79 3kl8 n GLU 17 Ca 0.00 -0.21 -0.27 0.00 0.00 0.00 0.00 57.16 56.68 3kl8 n GLU 17 Cb 0.00 -0.20 -0.08 0.00 0.00 0.00 0.00 31.44 31.16 3kl8 n GLU 17 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 177.13 175.30 3kl8 s GLU 18 N -3.30 1.99 0.00 3.44 -1.05 -1.26 -1.50 118.70 117.03 3kl8 s GLU 18 Ca 0.09 -2.23 0.00 0.00 -0.15 0.00 0.00 54.97 52.67 3kl8 s GLU 18 Cb -0.01 -0.82 0.00 0.00 -0.44 0.00 0.00 34.13 32.86 3kl8 s GLU 18 CO 0.07 -0.45 0.00 0.28 0.95 0.00 0.00 175.26 176.10 3kl8 n VAL 27 N -0.99 0.00 -3.59 1.83 0.31 -1.26 -4.88 118.33 109.74 3kl8 n VAL 27 Ca -0.09 0.00 -0.06 0.00 -0.01 0.00 0.00 64.34 64.18 3kl8 n VAL 27 Cb 0.65 0.00 -0.03 0.00 -0.91 0.00 0.00 33.84 33.55 3kl8 n VAL 27 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3kl8 s ARG 28 N -0.76 0.38 1.26 5.55 1.70 -1.01 -4.97 118.95 121.10 3kl8 s ARG 28 Ca 0.00 -0.05 -0.20 0.00 -0.47 0.00 0.00 55.73 55.01 3kl8 s ARG 28 Cb 0.00 0.18 0.31 0.00 -0.57 0.00 0.00 34.95 34.87 3kl8 s ARG 28 CO 0.00 -0.15 1.07 0.50 -1.08 0.00 0.00 175.30 175.64 3kl8 s ARG 29 N -1.90 -1.66 0.00 3.89 3.52 -0.56 -0.80 118.95 121.43 3kl8 s ARG 29 Ca 0.06 -0.04 0.00 0.00 -0.13 0.00 0.00 55.73 55.62 3kl8 s ARG 29 Cb -0.01 -1.54 0.00 0.00 -1.56 0.00 0.00 34.95 31.84 3kl8 s ARG 29 CO -0.04 -4.01 0.00 0.00 -0.81 0.00 0.00 175.30 170.44 3kl8 s VAL 31 N -2.00 -0.04 0.47 0.00 1.01 -0.95 -0.32 120.40 118.57 3kl8 s VAL 31 Ca 0.00 0.14 -0.25 0.00 0.00 0.00 0.00 61.98 61.87 3kl8 s VAL 31 Cb 0.00 -0.15 -0.08 0.00 0.00 0.00 0.00 36.38 36.15 3kl8 s VAL 31 CO 0.00 0.06 1.42 -2.28 0.00 0.00 0.00 175.10 174.29 3kl8 s HIS 32 N 0.79 2.41 -0.01 5.22 2.46 -1.20 -2.01 115.29 122.94 3kl8 s HIS 32 Ca -0.06 1.28 -0.22 0.00 0.47 0.00 0.00 55.06 56.52 3kl8 s HIS 32 Cb -0.08 -3.91 -0.21 0.00 -0.13 0.00 0.00 32.58 28.25 3kl8 s HIS 32 CO -0.03 -2.97 1.13 -0.22 -2.47 0.00 0.00 174.74 170.18 3kl8 h LYS 33 N 2.13 0.27 0.00 2.88 1.63 -1.43 -2.12 116.57 119.94 3kl8 h LYS 33 Ca -0.51 -0.23 0.00 0.00 -0.85 0.00 0.00 60.65 59.06 3kl8 h LYS 33 Cb 1.27 0.05 0.00 0.00 -0.60 0.00 0.00 32.23 32.96 3kl8 h LYS 33 CO 0.60 0.90 0.00 2.41 -3.45 0.00 0.00 179.45 179.91 3kl8 n THR 34 N -4.47 0.00 0.82 1.00 -1.04 -1.26 -4.26 114.28 105.07 3kl8 n THR 34 Ca -0.09 1.11 0.13 0.00 -2.04 0.00 0.00 64.05 63.16 3kl8 n THR 34 Cb 0.50 -2.06 0.37 0.00 -1.82 0.00 0.00 70.33 67.32 3kl8 n THR 34 CO 0.00 0.00 0.00 0.35 -0.64 0.00 0.00 175.07 174.78 3kl8 n THR 35 N -1.79 0.20 -1.91 12.58 -2.24 -1.26 -4.95 114.28 114.92 3kl8 n THR 35 Ca 0.00 -0.12 -0.19 0.00 -2.27 0.00 0.00 64.05 61.46 3kl8 n THR 35 Cb 0.00 -0.23 -0.05 0.00 -2.10 0.00 0.00 70.33 67.95 3kl8 n THR 35 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3kl8 n GLY 36 N 1.42 0.87 3.66 3.38 0.00 -0.79 -4.96 105.19 108.77 3kl8 n GLY 36 Ca 0.05 -0.08 -0.42 0.00 0.00 0.00 0.00 46.02 45.58 3kl8 n GLY 36 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3kl8 s LEU 37 N -4.92 4.14 0.41 0.99 1.43 -1.26 -4.68 118.68 114.79 3kl8 s LEU 37 Ca 0.00 1.12 -0.26 0.00 -1.03 0.00 0.00 54.13 53.97 3kl8 s LEU 37 Cb 0.00 -3.22 -0.10 0.00 0.03 0.00 0.00 46.19 42.90 3kl8 s LEU 37 CO 0.00 -0.44 1.22 -0.62 0.23 0.00 0.00 176.35 176.73 3kl8 n GLU 38 N 5.53 1.82 -3.86 1.70 1.02 -1.26 -3.23 120.64 122.36 3kl8 n GLU 38 Ca 0.05 0.65 -0.16 0.00 -0.02 0.00 0.00 57.16 57.68 3kl8 n GLU 38 Cb 0.48 -2.30 -0.06 0.00 -0.02 0.00 0.00 31.44 29.54 3kl8 n GLU 38 CO 0.00 0.00 0.00 1.19 1.18 0.00 0.00 177.13 179.50 3kl8 n PHE 39 N -0.19 -0.77 -4.24 -0.32 3.72 0.56 -4.60 117.46 111.61 3kl8 n PHE 39 Ca 0.07 -2.34 -0.30 0.00 -0.05 0.00 0.00 57.45 54.84 3kl8 n PHE 39 Cb 0.39 0.28 -0.17 0.00 -0.94 0.00 0.00 39.48 39.04 3kl8 n PHE 39 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3kl8 s ALA 40 N -3.08 1.83 -0.34 4.37 0.00 -0.58 -2.56 121.76 121.41 3kl8 s ALA 40 Ca 0.33 -0.86 -0.05 0.00 0.00 0.00 0.00 51.96 51.38 3kl8 s ALA 40 Cb 0.01 -0.96 0.05 0.00 0.00 0.00 0.00 23.12 22.22 3kl8 s ALA 40 CO 0.23 -0.23 0.09 0.00 0.00 0.00 0.00 175.76 175.85 3kl8 s ALA 41 N 1.24 3.00 0.12 0.00 0.00 0.02 0.70 121.76 126.83 3kl8 s ALA 41 Ca -0.00 -1.87 -0.30 0.00 0.00 0.00 0.00 51.96 49.78 3kl8 s ALA 41 Cb -0.14 -2.21 -0.07 0.00 0.00 0.00 0.00 23.12 20.71 3kl8 s ALA 41 CO -0.07 -1.39 1.23 0.21 0.00 0.00 0.00 175.76 175.74 3kl8 s LYS 42 N 1.33 4.44 -0.26 0.00 2.20 -0.11 -2.40 119.74 124.93 3kl8 s LYS 42 Ca -0.01 1.86 0.02 0.00 -0.36 0.00 0.00 55.97 57.47 3kl8 s LYS 42 Cb -0.20 -3.29 0.07 0.00 -1.51 0.00 0.00 37.83 32.90 3kl8 s LYS 42 CO 0.01 -0.22 -0.03 0.42 -0.36 0.00 0.00 175.35 175.17 3kl8 s ILE 43 N 0.64 1.70 0.49 5.43 1.01 -1.26 -0.75 121.20 128.45 3kl8 s ILE 43 Ca 0.57 -1.50 0.08 0.00 0.00 0.00 0.00 60.65 59.80 3kl8 s ILE 43 Cb -0.32 -2.01 0.04 0.00 0.01 0.00 0.00 42.46 40.18 3kl8 s ILE 43 CO 0.32 -0.23 0.67 -0.63 0.00 0.00 0.00 174.94 175.07 3kl8 s ILE 44 N 1.28 2.68 0.29 2.92 1.01 -0.06 -4.73 121.20 124.59 3kl8 s ILE 44 Ca -0.02 -0.97 0.05 0.00 0.00 0.00 0.00 60.65 59.72 3kl8 s ILE 44 Cb -0.19 -2.71 -0.06 0.00 0.01 0.00 0.00 42.46 39.51 3kl8 s ILE 44 CO -0.08 0.00 -0.02 0.21 0.00 0.00 0.00 174.94 175.05 3kl8 s ASN 45 N -4.47 2.52 -0.03 3.58 3.04 -1.24 -0.96 114.94 117.39 3kl8 s ASN 45 Ca 0.58 -1.25 0.04 0.00 0.04 0.00 0.00 52.86 52.27 3kl8 s ASN 45 Cb -0.08 -0.12 -0.00 0.00 -1.54 0.00 0.00 41.25 39.50 3kl8 s ASN 45 CO 0.36 -0.44 -0.15 -0.89 -3.04 0.00 0.00 177.10 172.94 3kl8 s THR 46 N -3.15 1.21 -1.55 -5.21 2.01 0.51 -0.34 115.64 109.12 3kl8 s THR 46 Ca 0.31 -0.62 0.27 0.00 0.31 0.00 0.00 61.69 61.97 3kl8 s THR 46 Cb 0.06 -1.03 0.29 0.00 0.01 0.00 0.00 72.50 71.82 3kl8 s THR 46 CO 0.12 0.35 1.66 0.29 -0.69 0.00 0.00 174.62 176.36 3kl8 n LYS 47 N 3.02 0.60 -2.62 4.92 5.02 -1.26 -4.90 118.16 122.95 3kl8 n LYS 47 Ca -0.17 -0.30 -0.43 0.00 -2.02 0.00 0.00 58.31 55.40 3kl8 n LYS 47 Cb 0.54 -1.49 -0.02 0.00 -0.02 0.00 0.00 35.03 34.03 3kl8 n LYS 47 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 3kl8 s LYS 48 N -2.60 4.17 0.42 1.97 -0.14 -1.26 -0.38 119.74 121.92 3kl8 s LYS 48 Ca 0.23 1.27 -0.22 0.00 -1.36 0.00 0.00 55.97 55.89 3kl8 s LYS 48 Cb 0.19 -3.70 -0.09 0.00 -1.68 0.00 0.00 37.83 32.55 3kl8 s LYS 48 CO 0.53 -0.76 1.01 -0.48 -0.76 0.00 0.00 175.35 174.89 3kl8 s LEU 49 N 3.46 4.02 0.12 3.17 2.34 0.53 -3.60 118.68 128.72 3kl8 s LEU 49 Ca 0.46 1.88 -0.36 0.00 0.06 0.00 0.00 54.13 56.18 3kl8 s LEU 49 Cb -0.15 -4.38 -0.16 0.00 -0.56 0.00 0.00 46.19 40.95 3kl8 s LEU 49 CO 0.11 -0.49 1.43 -1.20 -1.06 0.00 0.00 176.35 175.14 3kl8 n SER 50 N -0.42 2.22 0.00 1.48 7.64 0.49 -4.43 113.62 120.60 3kl8 n SER 50 Ca 0.06 1.11 0.00 0.00 1.01 0.00 0.00 58.87 61.05 3kl8 n SER 50 Cb 0.52 -1.29 0.00 0.00 -1.01 0.00 0.00 64.21 62.43 3kl8 n SER 50 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3kl8 n ALA 51 N 2.86 0.00 0.94 -0.43 0.00 -1.21 0.36 120.51 123.03 3kl8 n ALA 51 Ca 0.18 0.00 0.13 0.00 0.00 0.00 0.00 53.44 53.75 3kl8 n ALA 51 Cb 0.23 0.00 0.50 0.00 0.00 0.00 0.00 19.45 20.18 3kl8 n ALA 51 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 3kl8 n ARG 52 N 0.00 0.04 -0.33 0.00 0.63 -1.26 -1.11 116.66 114.63 3kl8 n ARG 52 Ca 0.00 0.03 -0.03 0.00 -0.92 0.00 0.00 57.85 56.93 3kl8 n ARG 52 Cb 0.00 -1.54 0.09 0.00 0.45 0.00 0.00 32.46 31.46 3kl8 n ARG 52 CO 0.00 0.00 0.00 -0.44 -2.51 0.00 0.00 177.63 174.68 3kl8 h ASP 53 N 0.00 1.03 -0.39 6.15 3.32 -0.42 -2.10 116.42 124.01 3kl8 h ASP 53 Ca 0.00 -0.03 -0.06 0.00 0.02 0.00 0.00 57.03 56.96 3kl8 h ASP 53 Cb 0.54 -0.26 -0.02 0.00 0.22 0.00 0.00 39.33 39.81 3kl8 h ASP 53 CO 0.00 0.75 0.04 0.15 -1.72 0.00 0.00 179.24 178.45 3kl8 h PHE 54 N 1.22 0.79 0.00 4.55 3.04 0.10 -2.63 116.94 124.01 3kl8 h PHE 54 Ca 0.33 -0.09 0.00 0.00 3.98 0.00 0.00 57.97 62.19 3kl8 h PHE 54 Cb -0.14 -0.22 0.00 0.00 2.56 0.00 0.00 35.95 38.14 3kl8 h PHE 54 CO -0.01 0.72 0.00 0.94 -2.02 0.00 0.00 178.31 177.94 3kl8 n GLN 55 N -4.24 0.29 0.06 1.11 7.27 -0.84 -1.05 117.38 119.98 3kl8 n GLN 55 Ca 0.03 0.09 0.00 0.00 0.07 0.00 0.00 57.00 57.19 3kl8 n GLN 55 Cb 0.27 -1.50 -0.05 0.00 2.41 0.00 0.00 30.24 31.36 3kl8 n GLN 55 CO 0.00 0.00 0.00 0.87 0.07 0.00 0.00 177.06 178.00 3kl8 h LYS 56 N 0.00 0.00 0.00 3.69 1.57 -1.04 -3.31 116.57 117.48 3kl8 h LYS 56 Ca 0.00 0.00 -0.15 0.00 -1.87 0.00 0.00 60.65 58.63 3kl8 h LYS 56 Cb 0.20 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.49 3kl8 h LYS 56 CO 0.00 0.38 -1.09 -0.07 -0.57 0.00 0.00 179.45 178.09 3kl8 h LEU 57 N 0.00 0.00 -0.03 2.94 3.38 -1.10 -2.69 115.31 117.81 3kl8 h LEU 57 Ca -0.11 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.86 3kl8 h LEU 57 Cb 1.54 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.28 3kl8 h LEU 57 CO 0.06 0.59 -0.04 -0.08 0.09 0.00 0.00 178.44 179.05 3kl8 h GLU 58 N 0.00 -0.03 -0.11 1.13 4.57 -1.26 0.20 114.58 119.08 3kl8 h GLU 58 Ca -0.10 0.00 0.04 0.00 -1.18 0.00 0.00 59.36 58.12 3kl8 h GLU 58 Cb 1.54 0.01 -0.06 0.00 -0.16 0.00 0.00 28.75 30.07 3kl8 h GLU 58 CO 0.06 -0.02 -0.40 -0.09 -1.18 0.00 0.00 179.01 177.38 3kl8 h ARG 59 N -0.03 -0.47 -0.75 1.92 2.43 -1.65 -2.17 114.38 113.66 3kl8 h ARG 59 Ca 0.00 0.03 0.09 0.00 -0.81 0.00 0.00 59.98 59.30 3kl8 h ARG 59 Cb 0.05 0.11 -0.07 0.00 -0.42 0.00 0.00 29.97 29.63 3kl8 h ARG 59 CO -0.04 -0.31 0.39 1.49 -1.51 0.00 0.00 179.97 179.99 3kl8 h GLU 60 N -0.49 0.65 -0.38 0.20 4.81 -1.35 -2.43 114.58 115.59 3kl8 h GLU 60 Ca 0.07 -0.04 -0.10 0.00 -0.13 0.00 0.00 59.36 59.17 3kl8 h GLU 60 Cb 0.62 -0.15 -0.01 0.00 0.63 0.00 0.00 28.75 29.84 3kl8 h GLU 60 CO -0.37 0.43 -0.14 0.00 -0.73 0.00 0.00 179.01 178.19 3kl8 h ALA 61 N 1.44 0.53 -0.91 2.92 0.00 -0.12 -2.79 119.26 120.33 3kl8 h ALA 61 Ca 0.37 -0.34 0.24 0.00 0.00 0.00 0.00 54.91 55.18 3kl8 h ALA 61 Cb 0.37 -0.13 -0.14 0.00 0.00 0.00 0.00 17.79 17.89 3kl8 h ALA 61 CO -0.26 0.44 0.36 -0.09 0.00 0.00 0.00 179.25 179.69 3kl8 h ARG 62 N 0.57 0.30 0.67 0.00 2.43 -0.90 -2.72 114.38 114.72 3kl8 h ARG 62 Ca 0.09 -0.02 -0.03 0.00 -0.81 0.00 0.00 59.98 59.21 3kl8 h ARG 62 Cb 0.68 -0.07 0.00 0.00 -0.42 0.00 0.00 29.97 30.17 3kl8 h ARG 62 CO 0.05 0.20 -0.35 0.82 -1.51 0.00 0.00 179.97 179.18 3kl8 h ILE 63 N 0.31 0.29 0.00 1.20 2.04 -1.37 -2.56 117.51 117.42 3kl8 h ILE 63 Ca 0.58 0.00 0.00 0.00 1.00 0.00 0.00 64.86 66.44 3kl8 h ILE 63 Cb 1.18 0.29 0.00 0.00 -0.74 0.00 0.00 36.82 37.56 3kl8 h ILE 63 CO -0.59 0.00 0.09 0.00 0.00 0.00 0.00 178.15 177.64 3kl8 h ARG 65 N 0.00 0.00 0.00 0.00 2.43 -1.29 -2.94 114.38 112.58 3kl8 h ARG 65 Ca 0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 3kl8 h ARG 65 Cb 0.17 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.72 3kl8 h ARG 65 CO 0.00 0.00 -0.57 0.87 -1.51 0.00 0.00 179.97 178.76 3kl8 h LYS 66 N 0.00 0.00 -3.86 0.20 1.57 -0.27 -3.43 116.57 110.78 3kl8 h LYS 66 Ca 0.00 0.00 -0.76 0.00 -1.87 0.00 0.00 60.65 58.02 3kl8 h LYS 66 Cb 0.83 0.00 -0.28 0.00 0.08 0.00 0.00 32.23 32.86 3kl8 h LYS 66 CO 0.00 0.00 -0.11 -0.51 -0.57 0.00 0.00 179.45 178.26 3kl8 s LEU 67 N -5.59 6.22 -0.60 2.94 1.43 -1.08 -4.98 118.68 117.02 3kl8 s LEU 67 Ca 0.03 -2.53 -0.02 0.00 -1.03 0.00 0.00 54.13 50.59 3kl8 s LEU 67 Cb 0.08 -2.10 0.15 0.00 0.03 0.00 0.00 46.19 44.35 3kl8 s LEU 67 CO 0.73 -0.58 0.40 -1.10 0.23 0.00 0.00 176.35 176.04 3kl8 s GLN 68 N 0.43 2.45 -0.02 1.70 -1.52 -1.26 -4.52 119.66 116.92 3kl8 s GLN 68 Ca 0.14 -2.52 -0.07 0.00 -1.95 0.00 0.00 55.36 50.97 3kl8 s GLN 68 Cb -0.17 -3.66 0.01 0.00 -0.22 0.00 0.00 33.01 28.97 3kl8 s GLN 68 CO -0.05 -1.16 0.15 -1.58 -0.25 0.00 0.00 175.29 172.40 3kl8 s HIS 69 N -0.06 -0.03 0.39 0.91 2.46 -1.26 -5.05 115.29 112.65 3kl8 s HIS 69 Ca 0.17 0.06 0.11 0.00 0.47 0.00 0.00 55.06 55.87 3kl8 s HIS 69 Cb -0.21 -0.01 0.91 0.00 -0.13 0.00 0.00 32.58 33.14 3kl8 s HIS 69 CO -0.03 -0.22 1.92 -1.35 -2.47 0.00 0.00 174.74 172.59 3kl8 h PRO 70 N 4.82 0.55 -0.66 2.88 0.11 -1.98 0.21 132.00 137.93 3kl8 h PRO 70 Ca -0.29 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.79 3kl8 h PRO 70 Cb 1.20 -0.12 0.00 0.00 0.11 0.00 0.00 31.00 32.18 3kl8 h PRO 70 CO 0.40 0.37 0.00 0.09 -0.21 0.00 0.00 178.00 178.65 3kl8 n ASN 71 N -4.50 4.03 -4.07 -2.05 4.13 -1.26 -4.78 115.26 106.76 3kl8 n ASN 71 Ca 0.14 -2.51 -0.31 0.00 1.68 0.00 0.00 54.58 53.59 3kl8 n ASN 71 Cb 0.43 -0.57 -0.16 0.00 -1.54 0.00 0.00 39.78 37.94 3kl8 n ASN 71 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 3kl8 s ILE 72 N -2.03 1.72 -0.82 2.41 1.01 0.74 0.03 121.20 124.26 3kl8 s ILE 72 Ca 0.38 -0.75 -0.18 0.00 0.00 0.00 0.00 60.65 60.11 3kl8 s ILE 72 Cb 0.27 -1.57 -0.21 0.00 0.01 0.00 0.00 42.46 40.96 3kl8 s ILE 72 CO 0.15 0.48 2.15 0.52 0.00 0.00 0.00 174.94 178.24 3kl8 n VAL 73 N 4.48 0.00 -2.02 2.92 0.31 -0.91 -4.49 118.33 118.62 3kl8 n VAL 73 Ca -0.19 -0.44 -0.41 0.00 -0.01 0.00 0.00 64.34 63.30 3kl8 n VAL 73 Cb 0.51 -1.13 -0.02 0.00 -0.91 0.00 0.00 33.84 32.29 3kl8 n VAL 73 CO 0.00 0.00 0.00 -0.13 -1.32 0.00 0.00 176.83 175.38 3kl8 s ARG 74 N 7.85 4.28 -0.14 5.55 0.52 -1.26 -4.71 118.95 131.03 3kl8 s ARG 74 Ca 0.95 2.31 -0.20 0.00 -0.52 0.00 0.00 55.73 58.27 3kl8 s ARG 74 Cb -0.35 -3.07 -0.03 0.00 0.52 0.00 0.00 34.95 32.02 3kl8 s ARG 74 CO 0.25 -0.34 0.57 -1.17 0.02 0.00 0.00 175.30 174.63 3kl8 s LEU 75 N -1.25 4.23 -0.25 2.53 2.96 -1.25 -1.50 118.68 124.15 3kl8 s LEU 75 Ca 0.54 0.87 -0.06 0.00 -0.22 0.00 0.00 54.13 55.26 3kl8 s LEU 75 Cb -0.42 -2.83 -0.13 0.00 0.50 0.00 0.00 46.19 43.31 3kl8 s LEU 75 CO 0.51 -0.13 -0.27 1.41 -1.32 0.00 0.00 176.35 176.54 3kl8 n HIS 76 N 4.26 0.00 -3.91 5.38 8.25 0.48 -4.80 115.22 124.89 3kl8 n HIS 76 Ca -0.04 0.00 -0.11 0.00 -0.26 0.00 0.00 57.72 57.32 3kl8 n HIS 76 Cb 0.51 -0.91 -0.11 0.00 1.12 0.00 0.00 29.99 30.61 3kl8 n HIS 76 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 3kl8 s ASP 77 N -6.83 0.09 -0.12 0.41 2.15 -1.20 -5.00 116.67 106.16 3kl8 s ASP 77 Ca -0.34 -0.26 0.02 0.00 0.43 0.00 0.00 52.55 52.40 3kl8 s ASP 77 Cb 0.11 0.17 0.01 0.00 -0.30 0.00 0.00 42.92 42.91 3kl8 s ASP 77 CO 0.49 -0.30 -0.19 -0.55 -0.17 0.00 0.00 175.17 174.44 3kl8 s SER 78 N -1.23 2.79 -0.03 -0.34 0.15 -1.26 -0.92 113.70 112.85 3kl8 s SER 78 Ca -0.13 -0.52 0.00 0.00 0.70 0.00 0.00 55.95 56.00 3kl8 s SER 78 Cb -0.08 -1.27 0.03 0.00 -1.71 0.00 0.00 66.02 62.99 3kl8 s SER 78 CO 0.00 0.06 -0.01 -0.63 1.20 0.00 0.00 173.24 173.87 3kl8 s ILE 79 N 0.84 0.25 -0.28 6.45 1.01 -0.24 -5.01 121.20 124.22 3kl8 s ILE 79 Ca -0.08 0.05 -0.12 0.00 0.00 0.00 0.00 60.65 60.50 3kl8 s ILE 79 Cb -0.15 -0.34 -0.05 0.00 0.01 0.00 0.00 42.46 41.93 3kl8 s ILE 79 CO -0.01 0.16 0.22 -1.58 0.00 0.00 0.00 174.94 173.74 3kl8 s GLN 80 N 1.05 3.97 0.00 2.79 2.00 -1.26 -0.38 119.66 127.82 3kl8 s GLN 80 Ca -0.09 -0.25 0.00 0.00 -2.00 0.00 0.00 55.36 53.01 3kl8 s GLN 80 Cb -0.14 -3.66 0.00 0.00 0.80 0.00 0.00 33.01 30.02 3kl8 s GLN 80 CO -0.01 -0.19 0.00 0.39 -0.50 0.00 0.00 175.29 174.97 3kl8 n GLU 81 N 5.09 0.00 0.00 1.67 -0.58 -0.93 -5.03 120.64 120.85 3kl8 n GLU 81 Ca -0.13 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.61 3kl8 n GLU 81 Cb 0.52 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 31.39 3kl8 n GLU 81 CO 0.00 0.00 0.00 0.39 -0.48 0.00 0.00 177.13 177.04 3kl8 n GLU 82 N 0.00 0.00 -0.00 3.49 1.02 -1.26 -4.85 120.64 119.04 3kl8 n GLU 82 Ca 0.00 0.02 0.06 0.00 -0.02 0.00 0.00 57.16 57.22 3kl8 n GLU 82 Cb 0.00 -0.19 -0.08 0.00 -0.02 0.00 0.00 31.44 31.15 3kl8 n GLU 82 CO 0.00 0.00 0.00 -1.13 1.18 0.00 0.00 177.13 177.18 3kl8 n SER 83 N -1.41 1.25 -4.91 1.62 3.41 -1.26 -4.99 113.62 107.33 3kl8 n SER 83 Ca 0.00 -0.44 -0.33 0.00 -0.26 0.00 0.00 58.87 57.84 3kl8 n SER 83 Cb 0.00 1.26 -0.05 0.00 -0.26 0.00 0.00 64.21 65.16 3kl8 n SER 83 CO 0.00 0.00 0.00 -0.36 -0.16 0.00 0.00 175.04 174.52 3kl8 s PHE 84 N -2.48 3.55 -0.05 7.33 2.99 -1.26 -0.36 117.98 127.70 3kl8 s PHE 84 Ca 0.01 0.35 0.03 0.00 0.00 0.00 0.00 56.93 57.32 3kl8 s PHE 84 Cb 0.09 -1.82 -0.03 0.00 0.00 0.00 0.00 43.02 41.26 3kl8 s PHE 84 CO 0.52 0.64 -0.13 -1.58 -0.00 0.00 0.00 175.22 174.67 3kl8 s HIS 85 N -1.34 2.73 -0.11 0.36 2.46 -0.13 -2.20 115.29 117.07 3kl8 s HIS 85 Ca 0.28 -0.13 0.02 0.00 0.47 0.00 0.00 55.06 55.70 3kl8 s HIS 85 Cb -0.13 -1.63 -0.01 0.00 -0.13 0.00 0.00 32.58 30.68 3kl8 s HIS 85 CO 0.19 0.21 -0.18 0.71 -2.47 0.00 0.00 174.74 173.20 3kl8 s TYR 86 N -0.76 2.67 -0.23 3.88 1.51 0.49 -0.88 117.35 124.03 3kl8 s TYR 86 Ca 0.12 -0.77 -0.00 0.00 -1.01 0.00 0.00 57.07 55.41 3kl8 s TYR 86 Cb -0.11 -1.75 0.06 0.00 -0.11 0.00 0.00 41.96 40.05 3kl8 s TYR 86 CO 0.01 -0.26 -0.03 -0.51 -1.11 0.00 0.00 175.55 173.65 3kl8 s LEU 87 N 0.22 2.31 -0.44 -1.29 1.43 0.07 -1.08 118.68 119.90 3kl8 s LEU 87 Ca -0.12 -1.14 -0.22 0.00 -1.03 0.00 0.00 54.13 51.62 3kl8 s LEU 87 Cb -0.16 -1.05 0.02 0.00 0.03 0.00 0.00 46.19 45.03 3kl8 s LEU 87 CO 0.06 -0.26 0.74 -0.69 0.23 0.00 0.00 176.35 176.43 3kl8 s VAL 88 N 1.49 4.71 0.22 -1.59 1.01 -0.09 -0.93 120.40 125.22 3kl8 s VAL 88 Ca -0.04 0.38 0.08 0.00 0.00 0.00 0.00 61.98 62.40 3kl8 s VAL 88 Cb -0.18 -4.27 -0.04 0.00 0.00 0.00 0.00 36.38 31.88 3kl8 s VAL 88 CO -0.07 -0.65 0.02 -0.36 0.00 0.00 0.00 175.10 174.04 3kl8 s PHE 89 N 3.13 2.82 0.43 5.22 0.40 0.22 -0.39 117.98 129.81 3kl8 s PHE 89 Ca 0.28 -0.17 -0.22 0.00 -0.60 0.00 0.00 56.93 56.22 3kl8 s PHE 89 Cb -0.13 -1.31 -0.12 0.00 0.51 0.00 0.00 43.02 41.97 3kl8 s PHE 89 CO 0.21 0.56 0.50 -0.25 0.70 0.00 0.00 175.22 176.94 3kl8 n ASP 90 N -0.57 -1.09 -4.58 1.36 10.43 -0.56 -1.52 116.55 120.01 3kl8 n ASP 90 Ca -0.08 0.88 -0.37 0.00 2.57 0.00 0.00 54.79 57.79 3kl8 n ASP 90 Cb 0.57 -1.10 -0.11 0.00 1.84 0.00 0.00 41.12 42.33 3kl8 n ASP 90 CO 0.00 0.00 0.00 -0.22 -1.07 0.00 0.00 177.20 175.91 3kl8 s LEU 91 N 1.92 3.87 -0.03 0.64 2.96 -1.26 -4.34 118.68 122.44 3kl8 s LEU 91 Ca 0.63 -0.01 0.04 0.00 -0.22 0.00 0.00 54.13 54.58 3kl8 s LEU 91 Cb -0.59 -2.04 -0.01 0.00 0.50 0.00 0.00 46.19 44.05 3kl8 s LEU 91 CO 0.58 0.02 -0.16 -0.69 -1.32 0.00 0.00 176.35 174.78 3kl8 s VAL 92 N 1.31 1.31 0.00 1.68 1.01 -1.26 -5.02 120.40 119.43 3kl8 s VAL 92 Ca 0.06 -0.68 0.00 0.00 0.00 0.00 0.00 61.98 61.37 3kl8 s VAL 92 Cb -0.15 -1.12 0.00 0.00 0.00 0.00 0.00 36.38 35.12 3kl8 s VAL 92 CO 0.06 0.38 0.00 0.35 0.00 0.00 0.00 175.10 175.88 3kl8 n THR 93 N 2.96 0.00 0.04 3.92 -2.24 -1.25 -4.72 114.28 112.99 3kl8 n THR 93 Ca -0.17 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.62 3kl8 n THR 93 Cb 0.54 -0.15 0.01 0.00 -2.10 0.00 0.00 70.33 68.63 3kl8 n THR 93 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3kl8 n GLY 94 N 2.11 -0.02 7.00 3.38 0.00 -0.29 -4.92 105.19 112.45 3kl8 n GLY 94 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 3kl8 n GLY 94 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3kl8 n GLY 95 N -0.79 -1.62 3.83 -0.02 0.00 -1.26 -4.55 105.19 100.79 3kl8 n GLY 95 Ca 0.00 -1.26 -0.32 0.00 0.00 0.00 0.00 46.02 44.44 3kl8 n GLY 95 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3kl8 s GLU 96 N 0.00 3.89 0.30 1.61 2.02 -1.26 -1.43 118.70 123.83 3kl8 s GLU 96 Ca 0.00 1.01 0.09 0.00 0.02 0.00 0.00 54.97 56.09 3kl8 s GLU 96 Cb 0.00 -2.13 0.48 0.00 0.10 0.00 0.00 34.13 32.59 3kl8 s GLU 96 CO 0.00 -0.32 1.70 1.25 0.02 0.00 0.00 175.26 177.91 3kl8 h LEU 97 N 0.96 0.11 -0.28 1.80 5.85 -0.04 -2.80 115.31 120.92 3kl8 h LEU 97 Ca -0.47 -0.05 0.07 0.00 0.84 0.00 0.00 57.88 58.26 3kl8 h LEU 97 Cb 1.19 -0.03 -0.08 0.00 0.37 0.00 0.00 40.66 42.11 3kl8 h LEU 97 CO 0.61 0.57 -0.30 0.15 -0.34 0.00 0.00 178.44 179.13 3kl8 h PHE 98 N 0.08 -0.82 -0.39 1.25 3.57 -1.78 -1.75 116.94 117.11 3kl8 h PHE 98 Ca 0.00 0.05 0.04 0.00 3.53 0.00 0.00 57.97 61.59 3kl8 h PHE 98 Cb 0.88 0.40 -0.04 0.00 2.79 0.00 0.00 35.95 39.98 3kl8 h PHE 98 CO 0.01 -0.37 0.17 0.93 -2.23 0.00 0.00 178.31 176.82 3kl8 h GLU 99 N -0.29 0.34 0.00 1.11 5.08 -1.86 -0.92 114.58 118.04 3kl8 h GLU 99 Ca 0.14 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.48 3kl8 h GLU 99 Cb 0.52 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.69 3kl8 h GLU 99 CO -0.44 0.23 0.00 0.22 -1.00 0.00 0.00 179.01 178.02 3kl8 h ASP 100 N 0.35 0.00 0.19 1.42 3.58 -1.14 0.17 116.42 121.00 3kl8 h ASP 100 Ca 0.17 0.00 -0.35 0.00 0.42 0.00 0.00 57.03 57.27 3kl8 h ASP 100 Cb 0.11 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 41.15 3kl8 h ASP 100 CO -0.14 0.00 -1.89 0.40 -2.88 0.00 0.00 179.24 174.72 3kl8 h ILE 101 N 0.00 0.74 -0.01 2.25 2.04 -0.35 -2.63 117.51 119.55 3kl8 h ILE 101 Ca 0.00 -2.44 -0.09 0.00 1.00 0.00 0.00 64.86 63.33 3kl8 h ILE 101 Cb 0.06 2.57 -0.01 0.00 -0.74 0.00 0.00 36.82 38.69 3kl8 h ILE 101 CO 0.00 0.85 -0.44 -0.37 0.00 0.00 0.00 178.15 178.19 3kl8 h VAL 102 N 0.07 1.32 0.72 1.67 -1.51 -0.91 -0.64 116.25 116.97 3kl8 h VAL 102 Ca -0.38 -1.52 -0.03 0.00 -1.23 0.00 0.00 66.70 63.54 3kl8 h VAL 102 Cb 2.05 1.81 -0.01 0.00 -2.13 0.00 0.00 31.29 33.01 3kl8 h VAL 102 CO 0.11 0.44 -0.48 0.00 -1.23 0.00 0.00 177.57 176.40 3kl8 h ALA 103 N 1.54 -1.24 -0.01 5.19 0.00 -0.70 -3.22 119.26 120.82 3kl8 h ALA 103 Ca -0.00 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.67 3kl8 h ALA 103 Cb 0.79 0.63 0.00 0.00 0.00 0.00 0.00 17.79 19.20 3kl8 h ALA 103 CO 0.06 -1.22 -0.28 0.54 0.00 0.00 0.00 179.25 178.35 3kl8 n ARG 104 N -5.49 0.87 0.00 0.00 1.74 -0.99 -4.95 116.66 107.84 3kl8 n ARG 104 Ca -0.14 -0.54 0.00 0.00 -0.77 0.00 0.00 57.85 56.40 3kl8 n ARG 104 Cb 0.48 -1.49 0.00 0.00 -1.02 0.00 0.00 32.46 30.43 3kl8 n ARG 104 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 3kl8 n GLU 105 N -0.59 0.00 0.00 5.56 1.02 -0.25 -4.81 120.64 121.57 3kl8 n GLU 105 Ca 0.12 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.26 3kl8 n GLU 105 Cb 0.36 -0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.78 3kl8 n GLU 105 CO 0.00 0.00 0.00 1.97 1.18 0.00 0.00 177.13 180.28 3kl8 n PHE 106 N 0.00 0.00 -1.37 -0.32 1.16 -1.24 -4.01 117.46 111.68 3kl8 n PHE 106 Ca 0.00 0.00 -0.31 0.00 -1.87 0.00 0.00 57.45 55.27 3kl8 n PHE 106 Cb 0.00 0.00 0.08 0.00 -1.61 0.00 0.00 39.48 37.95 3kl8 n PHE 106 CO 0.00 0.00 0.00 0.71 -1.87 0.00 0.00 176.76 175.60 3kl8 s TYR 107 N -0.82 2.62 0.69 2.97 4.12 0.37 -4.98 117.35 122.31 3kl8 s TYR 107 Ca 0.00 1.55 -0.11 0.00 0.02 0.00 0.00 57.07 58.52 3kl8 s TYR 107 Cb 0.00 -3.06 0.01 0.00 -1.52 0.00 0.00 41.96 37.39 3kl8 s TYR 107 CO 0.00 -1.74 1.08 -1.54 0.02 0.00 0.00 175.55 173.37 3kl8 s SER 108 N -3.26 5.54 0.29 2.29 1.04 -1.26 -4.58 113.70 113.77 3kl8 s SER 108 Ca 0.62 1.24 -0.02 0.00 0.48 0.00 0.00 55.95 58.27 3kl8 s SER 108 Cb -0.18 -2.10 0.42 0.00 0.10 0.00 0.00 66.02 64.26 3kl8 s SER 108 CO 0.53 -1.29 1.95 -0.33 0.98 0.00 0.00 173.24 175.08 3kl8 h GLU 109 N -0.62 1.09 0.75 4.02 5.08 -1.96 0.36 114.58 123.30 3kl8 h GLU 109 Ca -0.45 -0.08 -0.04 0.00 -1.00 0.00 0.00 59.36 57.80 3kl8 h GLU 109 Cb 1.24 -0.24 0.01 0.00 0.50 0.00 0.00 28.75 30.25 3kl8 h GLU 109 CO 0.63 0.74 -0.36 0.00 -1.00 0.00 0.00 179.01 179.02 3kl8 h ALA 110 N 1.46 -1.00 -0.18 3.43 0.00 -1.97 1.20 119.26 122.18 3kl8 h ALA 110 Ca 0.30 -0.22 -0.03 0.00 0.00 0.00 0.00 54.91 54.95 3kl8 h ALA 110 Cb -0.09 0.39 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 3kl8 h ALA 110 CO -0.06 -1.05 -0.03 -0.44 0.00 0.00 0.00 179.25 177.67 3kl8 h ASP 111 N -1.02 0.25 0.05 0.00 3.45 -1.88 0.11 116.42 117.38 3kl8 h ASP 111 Ca -0.10 -0.03 -0.00 0.00 0.43 0.00 0.00 57.03 57.32 3kl8 h ASP 111 Cb 0.77 -0.06 0.00 0.00 -0.56 0.00 0.00 39.33 39.48 3kl8 h ASP 111 CO 0.17 0.32 -0.03 0.00 -1.57 0.00 0.00 179.24 178.14 3kl8 h ALA 112 N 1.71 -0.07 -0.65 3.45 0.00 0.02 0.11 119.26 123.83 3kl8 h ALA 112 Ca 0.06 -0.18 0.10 0.00 0.00 0.00 0.00 54.91 54.89 3kl8 h ALA 112 Cb 0.23 0.03 -0.08 0.00 0.00 0.00 0.00 17.79 17.97 3kl8 h ALA 112 CO 0.01 -0.36 0.26 1.03 0.00 0.00 0.00 179.25 180.19 3kl8 h SER 113 N -0.43 0.28 -0.37 0.00 0.87 0.23 0.51 113.55 114.64 3kl8 h SER 113 Ca -0.01 0.08 -0.03 0.00 -1.23 0.00 0.00 61.79 60.60 3kl8 h SER 113 Cb 0.39 0.05 -0.02 0.00 -0.44 0.00 0.00 62.40 62.38 3kl8 h SER 113 CO 0.01 0.15 0.12 -0.74 -0.53 0.00 0.00 176.83 175.85 3kl8 h HIS 114 N 0.45 0.59 -0.64 2.24 6.17 -0.70 -1.60 115.15 121.66 3kl8 h HIS 114 Ca 0.33 -0.06 -0.06 0.00 0.71 0.00 0.00 60.37 61.29 3kl8 h HIS 114 Cb 0.42 -0.17 -0.03 0.00 2.52 0.00 0.00 27.41 30.15 3kl8 h HIS 114 CO -0.16 0.56 0.15 0.00 0.71 0.00 0.00 177.93 179.20 3kl8 h ILE 116 N 0.96 1.52 0.00 0.00 6.09 -0.90 -3.01 117.51 122.17 3kl8 h ILE 116 Ca 0.20 -2.88 -0.03 0.00 -1.37 0.00 0.00 64.86 60.78 3kl8 h ILE 116 Cb 0.34 2.69 -0.00 0.00 0.47 0.00 0.00 36.82 40.32 3kl8 h ILE 116 CO 0.00 0.84 -0.15 -0.61 -3.07 0.00 0.00 178.15 175.16 3kl8 h GLN 117 N 0.09 0.00 -0.01 2.19 4.15 -1.05 0.29 115.11 120.77 3kl8 h GLN 117 Ca -0.08 0.00 -0.01 0.00 0.77 0.00 0.00 58.65 59.33 3kl8 h GLN 117 Cb 1.72 0.00 0.00 0.00 0.21 0.00 0.00 27.48 29.41 3kl8 h GLN 117 CO 0.16 0.15 -0.05 1.96 -1.93 0.00 0.00 178.83 179.13 3kl8 h GLN 118 N 0.00 0.04 -0.55 1.69 4.20 -1.41 -2.08 115.11 117.01 3kl8 h GLN 118 Ca -0.00 -0.04 0.02 0.00 0.06 0.00 0.00 58.65 58.69 3kl8 h GLN 118 Cb 0.29 0.01 -0.03 0.00 0.30 0.00 0.00 27.48 28.04 3kl8 h GLN 118 CO 0.02 0.74 0.34 0.82 -0.67 0.00 0.00 178.83 180.08 3kl8 h ILE 119 N -0.64 1.08 -0.16 2.54 2.04 -1.33 -2.17 117.51 118.87 3kl8 h ILE 119 Ca -0.00 -0.23 0.05 0.00 1.00 0.00 0.00 64.86 65.67 3kl8 h ILE 119 Cb 0.75 0.34 -0.05 0.00 -0.74 0.00 0.00 36.82 37.12 3kl8 h ILE 119 CO 0.01 0.12 -0.16 -0.07 0.00 0.00 0.00 178.15 178.05 3kl8 h LEU 120 N 0.67 -0.50 -1.33 1.44 3.38 -0.48 0.83 115.31 119.33 3kl8 h LEU 120 Ca 0.22 0.10 0.09 0.00 0.09 0.00 0.00 57.88 58.37 3kl8 h LEU 120 Cb -0.00 0.24 -0.05 0.00 0.09 0.00 0.00 40.66 40.94 3kl8 h LEU 120 CO -0.08 -0.20 0.52 -0.33 0.09 0.00 0.00 178.44 178.43 3kl8 h GLU 121 N -0.18 0.74 0.04 1.13 5.08 -1.17 0.43 114.58 120.64 3kl8 h GLU 121 Ca 0.11 -0.04 -0.00 0.00 -1.00 0.00 0.00 59.36 58.42 3kl8 h GLU 121 Cb 0.34 -0.17 0.00 0.00 0.50 0.00 0.00 28.75 29.42 3kl8 h GLU 121 CO -0.27 0.49 -0.02 0.66 -1.00 0.00 0.00 179.01 178.87 3kl8 h SER 122 N 0.76 -0.04 -0.05 1.42 4.64 -0.70 -2.24 113.55 117.34 3kl8 h SER 122 Ca 0.36 -0.50 0.03 0.00 -0.47 0.00 0.00 61.79 61.21 3kl8 h SER 122 Cb 0.40 0.01 -0.06 0.00 -0.31 0.00 0.00 62.40 62.44 3kl8 h SER 122 CO -0.14 0.50 -0.46 0.40 -0.87 0.00 0.00 176.83 176.27 3kl8 h ILE 123 N -0.60 0.10 -0.93 0.95 1.08 -0.43 -0.10 117.51 117.58 3kl8 h ILE 123 Ca -0.01 0.00 0.15 0.00 -0.39 0.00 0.00 64.86 64.62 3kl8 h ILE 123 Cb 0.54 0.10 -0.16 0.00 -3.07 0.00 0.00 36.82 34.24 3kl8 h ILE 123 CO 0.01 0.00 -0.36 0.00 -0.69 0.00 0.00 178.15 177.11 3kl8 h ALA 124 N -0.09 0.21 -0.31 1.87 0.00 -0.16 0.19 119.26 120.96 3kl8 h ALA 124 Ca 0.05 0.28 0.01 0.00 0.00 0.00 0.00 54.91 55.24 3kl8 h ALA 124 Cb 0.67 0.93 -0.02 0.00 0.00 0.00 0.00 17.79 19.36 3kl8 h ALA 124 CO -0.36 -0.59 0.18 -0.92 0.00 0.00 0.00 179.25 177.56 3kl8 h TYR 125 N -0.03 0.34 -0.47 0.00 3.20 -0.75 0.92 116.97 120.19 3kl8 h TYR 125 Ca 0.35 0.01 0.09 0.00 3.14 0.00 0.00 58.73 62.31 3kl8 h TYR 125 Cb 0.61 -0.11 -0.07 0.00 1.54 0.00 0.00 36.73 38.69 3kl8 h TYR 125 CO -0.81 0.20 0.04 0.00 -1.64 0.00 0.00 178.16 175.95 3kl8 h HIS 127 N 0.16 0.20 0.00 0.00 3.86 -0.37 0.42 115.15 119.42 3kl8 h HIS 127 Ca 0.24 -0.05 0.00 0.00 -1.16 0.00 0.00 60.37 59.39 3kl8 h HIS 127 Cb 0.34 -0.05 0.00 0.00 1.06 0.00 0.00 27.41 28.76 3kl8 h HIS 127 CO -0.26 0.56 0.00 -1.13 0.86 0.00 0.00 177.93 177.96 3kl8 n SER 128 N -4.74 0.00 -0.16 2.45 3.41 0.27 -0.03 113.62 114.82 3kl8 n SER 128 Ca -0.07 -0.15 0.05 0.00 -0.26 0.00 0.00 58.87 58.44 3kl8 n SER 128 Cb 0.27 0.00 0.06 0.00 -0.26 0.00 0.00 64.21 64.29 3kl8 n SER 128 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 3kl8 n ASN 129 N -0.81 1.44 -0.14 4.04 3.02 -0.84 -5.00 115.26 116.97 3kl8 n ASN 129 Ca 0.02 -2.39 -0.02 0.00 -0.03 0.00 0.00 54.58 52.15 3kl8 n ASN 129 Cb 0.01 -0.25 -0.01 0.00 -0.61 0.00 0.00 39.78 38.92 3kl8 n ASN 129 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3kl8 n GLY 130 N -0.75 0.51 3.57 7.41 0.00 0.95 -4.95 105.19 111.93 3kl8 n GLY 130 Ca 0.07 -0.26 -0.34 0.00 0.00 0.00 0.00 46.02 45.49 3kl8 n GLY 130 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3kl8 s ILE 131 N -1.88 4.15 -0.11 -0.61 -1.09 0.08 -0.19 121.20 121.54 3kl8 s ILE 131 Ca 0.00 -0.28 0.02 0.00 -2.23 0.00 0.00 60.65 58.16 3kl8 s ILE 131 Cb 0.00 -2.81 -0.01 0.00 -1.58 0.00 0.00 42.46 38.06 3kl8 s ILE 131 CO 0.00 0.52 -0.18 -0.69 -1.23 0.00 0.00 174.94 173.36 3kl8 s VAL 132 N 0.03 2.62 -0.13 2.92 1.01 -0.75 -3.36 120.40 122.75 3kl8 s VAL 132 Ca 0.02 -0.82 -0.24 0.00 0.00 0.00 0.00 61.98 60.94 3kl8 s VAL 132 Cb -0.13 -2.06 -0.21 0.00 0.00 0.00 0.00 36.38 33.98 3kl8 s VAL 132 CO 0.02 0.54 0.65 -0.74 0.00 0.00 0.00 175.10 175.57 3kl8 h HIS 133 N 6.64 -0.00 0.00 5.22 2.76 -1.89 -2.17 115.15 125.70 3kl8 h HIS 133 Ca -0.24 -0.00 0.00 0.00 -2.20 0.00 0.00 60.37 57.93 3kl8 h HIS 133 Cb 1.22 0.00 0.00 0.00 1.55 0.00 0.00 27.41 30.18 3kl8 h HIS 133 CO 0.49 0.80 0.00 0.54 -1.30 0.00 0.00 177.93 178.45 3kl8 n ARG 134 N -4.65 0.00 -1.02 5.26 1.74 -1.26 -3.28 116.66 113.45 3kl8 n ARG 134 Ca -0.08 0.00 -0.16 0.00 -0.77 0.00 0.00 57.85 56.83 3kl8 n ARG 134 Cb 0.39 0.00 -0.03 0.00 -1.02 0.00 0.00 32.46 31.80 3kl8 n ARG 134 CO 0.00 0.00 0.00 -1.71 -1.52 0.00 0.00 177.63 174.40 3kl8 n ASN 135 N 3.45 6.12 -4.61 0.55 5.15 -1.26 -4.63 115.26 120.04 3kl8 n ASN 135 Ca 0.00 -2.92 -0.43 0.00 -0.60 0.00 0.00 54.58 50.63 3kl8 n ASN 135 Cb 0.00 -1.17 -0.03 0.00 -0.53 0.00 0.00 39.78 38.04 3kl8 n ASN 135 CO 0.00 0.00 0.00 -0.22 1.40 0.00 0.00 177.26 178.44 3kl8 s LEU 136 N -1.38 3.96 0.23 1.20 2.96 -1.26 -4.89 118.68 119.49 3kl8 s LEU 136 Ca 0.40 0.60 -0.12 0.00 -0.22 0.00 0.00 54.13 54.78 3kl8 s LEU 136 Cb 0.26 -3.32 -0.00 0.00 0.50 0.00 0.00 46.19 43.63 3kl8 s LEU 136 CO -0.07 -0.90 0.44 -1.59 -1.32 0.00 0.00 176.35 172.92 3kl8 s LYS 137 N 3.59 1.46 0.23 1.98 -2.85 -1.26 -4.85 119.74 118.04 3kl8 s LYS 137 Ca 0.40 -1.20 -0.07 0.00 -1.00 0.00 0.00 55.97 54.09 3kl8 s LYS 137 Cb -0.11 0.46 0.29 0.00 -2.06 0.00 0.00 37.83 36.40 3kl8 s LYS 137 CO 0.20 -0.60 1.84 -1.35 0.10 0.00 0.00 175.35 175.54 3kl8 h PRO 138 N 2.30 0.86 0.00 1.78 0.11 -1.94 -1.74 132.00 133.37 3kl8 h PRO 138 Ca -0.27 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.78 3kl8 h PRO 138 Cb 1.25 -0.19 0.00 0.00 0.11 0.00 0.00 31.00 32.16 3kl8 h PRO 138 CO 0.38 0.57 0.00 0.39 -0.21 0.00 0.00 178.00 179.13 3kl8 n GLU 139 N -4.66 0.21 0.00 1.05 4.71 -1.26 -1.40 120.64 119.29 3kl8 n GLU 139 Ca 0.11 0.00 0.00 0.00 -0.01 0.00 0.00 57.16 57.26 3kl8 n GLU 139 Cb 0.16 -1.33 0.00 0.00 -1.01 0.00 0.00 31.44 29.26 3kl8 n GLU 139 CO 0.00 0.00 0.00 0.09 0.09 0.00 0.00 177.13 177.31 3kl8 n ASN 140 N -0.83 1.56 -4.42 1.62 3.02 -0.66 -4.94 115.26 110.61 3kl8 n ASN 140 Ca 0.03 -1.71 -0.35 0.00 -0.03 0.00 0.00 54.58 52.52 3kl8 n ASN 140 Cb 0.02 0.00 -0.13 0.00 -0.61 0.00 0.00 39.78 39.06 3kl8 n ASN 140 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 3kl8 s LEU 141 N -0.71 3.19 0.03 3.41 1.43 -0.49 -1.83 118.68 123.70 3kl8 s LEU 141 Ca 0.00 -0.24 0.01 0.00 -1.03 0.00 0.00 54.13 52.87 3kl8 s LEU 141 Cb 0.00 -1.81 -0.04 0.00 0.03 0.00 0.00 46.19 44.37 3kl8 s LEU 141 CO 0.00 0.04 0.07 -0.76 0.23 0.00 0.00 176.35 175.93 3kl8 s LEU 142 N 1.12 3.81 -0.08 1.79 1.43 0.33 0.51 118.68 127.60 3kl8 s LEU 142 Ca 0.02 0.07 -0.05 0.00 -1.03 0.00 0.00 54.13 53.15 3kl8 s LEU 142 Cb -0.14 -2.31 -0.04 0.00 0.03 0.00 0.00 46.19 43.72 3kl8 s LEU 142 CO 0.01 0.24 0.14 -0.76 0.23 0.00 0.00 176.35 176.21 3kl8 s LEU 143 N -1.94 4.28 0.08 1.79 1.43 -0.52 0.75 118.68 124.56 3kl8 s LEU 143 Ca 0.25 0.38 -0.24 0.00 -1.03 0.00 0.00 54.13 53.49 3kl8 s LEU 143 Cb -0.12 -2.22 -0.16 0.00 0.03 0.00 0.00 46.19 43.72 3kl8 s LEU 143 CO 0.16 0.35 1.70 0.00 0.23 0.00 0.00 176.35 178.79 3kl8 h ALA 144 N 4.58 -0.04 -3.42 4.21 0.00 -1.24 -0.77 119.26 122.58 3kl8 h ALA 144 Ca -0.52 -0.03 -0.15 0.00 0.00 0.00 0.00 54.91 54.20 3kl8 h ALA 144 Cb 1.21 0.02 -0.04 0.00 0.00 0.00 0.00 17.79 18.98 3kl8 h ALA 144 CO 0.61 -0.51 -0.11 -1.13 0.00 0.00 0.00 179.25 178.12 3kl8 n SER 145 N -5.09 -0.54 -1.87 0.00 3.41 -1.26 -3.13 113.62 105.13 3kl8 n SER 145 Ca -0.07 -1.91 -0.13 0.00 -0.26 0.00 0.00 58.87 56.50 3kl8 n SER 145 Cb 0.06 1.06 0.18 0.00 -0.26 0.00 0.00 64.21 65.25 3kl8 n SER 145 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 3kl8 n LYS 146 N -0.27 2.47 -0.62 4.33 5.02 -1.26 -4.67 118.16 123.16 3kl8 n LYS 146 Ca 0.01 -2.37 -0.31 0.00 -2.02 0.00 0.00 58.31 53.63 3kl8 n LYS 146 Cb 0.27 -1.96 0.20 0.00 -0.02 0.00 0.00 35.03 33.52 3kl8 n LYS 146 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3kl8 n ALA 147 N -0.48 -2.94 -2.22 7.82 0.00 -1.26 -4.87 120.51 116.57 3kl8 n ALA 147 Ca 0.41 -1.03 -0.41 0.00 0.00 0.00 0.00 53.44 52.41 3kl8 n ALA 147 Cb 1.32 -1.85 0.00 0.00 0.00 0.00 0.00 19.45 18.92 3kl8 n ALA 147 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 3kl8 n LYS 148 N -3.40 4.51 0.00 0.00 3.00 -1.26 -3.62 118.16 117.38 3kl8 n LYS 148 Ca 0.04 -3.71 0.00 0.00 -0.00 0.00 0.00 58.31 54.64 3kl8 n LYS 148 Cb 0.56 -2.66 0.00 0.00 0.00 0.00 0.00 35.03 32.93 3kl8 n LYS 148 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 3kl8 n GLY 149 N 1.68 0.00 3.37 3.14 0.00 -1.26 -5.15 105.19 106.97 3kl8 n GLY 149 Ca 0.53 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 46.16 3kl8 n GLY 149 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3kl8 n ALA 150 N 0.00 -2.11 -1.77 4.61 0.00 -1.24 -4.92 120.51 115.08 3kl8 n ALA 150 Ca 0.00 0.03 -0.31 0.00 0.00 0.00 0.00 53.44 53.16 3kl8 n ALA 150 Cb 0.00 -1.63 0.02 0.00 0.00 0.00 0.00 19.45 17.84 3kl8 n ALA 150 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3kl8 s ALA 151 N -1.75 2.96 -0.06 0.00 0.00 -1.26 -4.79 121.76 116.85 3kl8 s ALA 151 Ca 0.62 0.02 0.03 0.00 0.00 0.00 0.00 51.96 52.63 3kl8 s ALA 151 Cb -0.52 -3.12 -0.02 0.00 0.00 0.00 0.00 23.12 19.45 3kl8 s ALA 151 CO 0.60 -0.79 -0.14 0.08 0.00 0.00 0.00 175.76 175.50 3kl8 s VAL 152 N -3.04 3.03 0.04 0.00 1.01 -1.26 -0.73 120.40 119.45 3kl8 s VAL 152 Ca 0.57 -0.73 0.08 0.00 0.00 0.00 0.00 61.98 61.90 3kl8 s VAL 152 Cb -0.12 -2.19 -0.03 0.00 0.00 0.00 0.00 36.38 34.04 3kl8 s VAL 152 CO 0.51 0.58 -0.23 -0.54 0.00 0.00 0.00 175.10 175.42 3kl8 s LYS 153 N -0.57 1.62 -0.05 2.72 -0.14 0.23 -4.50 119.74 119.04 3kl8 s LYS 153 Ca 0.08 -0.99 -0.15 0.00 -1.36 0.00 0.00 55.97 53.54 3kl8 s LYS 153 Cb -0.11 -1.74 -0.05 0.00 -1.68 0.00 0.00 37.83 34.25 3kl8 s LYS 153 CO 0.01 0.45 0.41 -1.17 -0.76 0.00 0.00 175.35 174.29 3kl8 s LEU 154 N -1.11 4.39 0.24 3.17 2.96 0.10 -0.51 118.68 127.93 3kl8 s LEU 154 Ca 0.09 0.86 -0.04 0.00 -0.22 0.00 0.00 54.13 54.83 3kl8 s LEU 154 Cb -0.09 -2.58 -0.02 0.00 0.50 0.00 0.00 46.19 44.00 3kl8 s LEU 154 CO 0.02 0.22 0.29 0.00 -1.32 0.00 0.00 176.35 175.55 3kl8 s ALA 155 N -0.45 0.79 -0.25 5.97 0.00 -0.76 -2.15 121.76 124.91 3kl8 s ALA 155 Ca 0.23 -1.48 -0.02 0.00 0.00 0.00 0.00 51.96 50.68 3kl8 s ALA 155 Cb -0.16 1.28 0.00 0.00 0.00 0.00 0.00 23.12 24.24 3kl8 s ALA 155 CO 0.11 -0.70 0.09 -3.47 0.00 0.00 0.00 175.76 171.80 3kl8 n ASP 156 N -0.57 -6.50 -1.84 0.00 2.03 -1.26 -4.86 116.55 103.55 3kl8 n ASP 156 Ca 0.01 0.94 -0.09 0.00 0.52 0.00 0.00 54.79 56.17 3kl8 n ASP 156 Cb 0.64 -4.26 0.25 0.00 -0.72 0.00 0.00 41.12 37.03 3kl8 n ASP 156 CO 0.00 0.00 0.00 0.49 -1.92 0.00 0.00 177.20 175.77 3kl8 n PHE 157 N 0.34 2.28 -0.33 -0.67 3.72 -1.26 -4.57 117.46 116.98 3kl8 n PHE 157 Ca 0.02 -1.40 0.14 0.00 -0.05 0.00 0.00 57.45 56.16 3kl8 n PHE 157 Cb 0.07 -0.69 0.37 0.00 -0.94 0.00 0.00 39.48 38.28 3kl8 n PHE 157 CO 0.00 0.00 0.00 0.78 -0.05 0.00 0.00 176.76 177.49 3kl8 h GLY 158 N 1.91 1.53 -1.80 1.37 0.00 -1.92 -0.45 103.07 103.71 3kl8 h GLY 158 Ca 0.33 -0.32 0.00 0.00 0.00 0.00 0.00 47.33 47.34 3kl8 h GLY 158 CO 0.74 -0.03 -0.04 1.04 0.00 0.00 0.00 176.54 178.25 3kl8 n LEU 159 N -4.68 2.86 -4.68 3.11 4.77 -1.26 -4.98 117.00 112.14 3kl8 n LEU 159 Ca 0.22 -0.98 -0.39 0.00 -0.03 0.00 0.00 56.01 54.83 3kl8 n LEU 159 Cb 0.59 0.00 0.04 0.00 -2.33 0.00 0.00 43.42 41.72 3kl8 n LEU 159 CO 0.24 0.48 0.77 0.00 -1.33 0.00 0.00 177.39 177.56 3kl8 n ALA 160 N 1.20 0.87 -3.01 -1.18 0.00 -0.18 -4.72 120.51 113.49 3kl8 n ALA 160 Ca 0.13 0.09 -0.10 0.00 0.00 0.00 0.00 53.44 53.56 3kl8 n ALA 160 Cb 0.57 -2.23 -0.10 0.00 0.00 0.00 0.00 19.45 17.69 3kl8 n ALA 160 CO 0.00 0.00 0.00 0.96 0.00 0.00 0.00 177.50 178.46 3kl8 s ILE 161 N -1.37 0.10 -0.12 0.00 -4.36 -0.82 -4.99 121.20 109.64 3kl8 s ILE 161 Ca 0.73 -0.81 -0.13 0.00 -0.26 0.00 0.00 60.65 60.18 3kl8 s ILE 161 Cb -0.43 -0.50 -0.05 0.00 1.25 0.00 0.00 42.46 42.73 3kl8 s ILE 161 CO 0.49 -0.44 0.29 -1.83 0.24 0.00 0.00 174.94 173.68 3kl8 s GLU 162 N -1.64 4.04 0.06 0.37 -1.05 -1.26 -1.81 118.70 117.41 3kl8 s GLU 162 Ca -0.13 0.12 -0.07 0.00 -0.15 0.00 0.00 54.97 54.74 3kl8 s GLU 162 Cb -0.07 -3.34 -0.01 0.00 -0.44 0.00 0.00 34.13 30.27 3kl8 s GLU 162 CO -0.00 0.43 0.14 0.14 0.95 0.00 0.00 175.26 176.92 3kl8 s VAL 163 N -0.13 0.15 0.55 1.83 -7.23 0.74 -5.01 120.40 111.29 3kl8 s VAL 163 Ca 0.18 -1.20 -0.04 0.00 -1.81 0.00 0.00 61.98 59.11 3kl8 s VAL 163 Cb -0.14 -1.19 0.12 0.00 0.56 0.00 0.00 36.38 35.73 3kl8 s VAL 163 CO 0.06 -0.66 0.75 -0.46 -0.31 0.00 0.00 175.10 174.48 3kl8 n ASN 164 N 0.29 0.60 0.00 4.85 0.23 -1.26 -4.58 115.26 115.38 3kl8 n ASN 164 Ca -0.16 -1.60 0.09 0.00 -0.53 0.00 0.00 54.58 52.37 3kl8 n ASN 164 Cb 0.61 -0.52 0.48 0.00 -2.08 0.00 0.00 39.78 38.26 3kl8 n ASN 164 CO 0.00 0.00 0.00 -0.90 -0.93 0.00 0.00 177.26 175.43 3kl8 n ASP 165 N -3.17 0.00 -4.66 0.53 5.68 -1.26 -4.77 116.55 108.91 3kl8 n ASP 165 Ca 0.11 -0.28 -0.38 0.00 -0.50 0.00 0.00 54.79 53.73 3kl8 n ASP 165 Cb 0.39 -0.13 -0.08 0.00 -1.14 0.00 0.00 41.12 40.17 3kl8 n ASP 165 CO 0.00 0.00 0.00 -0.44 -1.33 0.00 0.00 177.20 175.43 3kl8 s SER 166 N -2.26 6.43 0.26 -1.12 0.01 -1.26 -5.04 113.70 110.73 3kl8 s SER 166 Ca 0.22 0.51 -0.29 0.00 1.31 0.00 0.00 55.95 57.69 3kl8 s SER 166 Cb 0.12 -2.24 -0.09 0.00 0.21 0.00 0.00 66.02 64.02 3kl8 s SER 166 CO 0.23 -0.11 1.19 -1.61 0.41 0.00 0.00 173.24 173.35 3kl8 s GLU 167 N 1.46 4.52 0.00 12.44 2.02 -1.26 -4.95 118.70 132.93 3kl8 s GLU 167 Ca 0.19 1.94 0.00 0.00 0.02 0.00 0.00 54.97 57.12 3kl8 s GLU 167 Cb -0.15 -3.18 0.00 0.00 0.10 0.00 0.00 34.13 30.90 3kl8 s GLU 167 CO 0.08 0.01 0.00 0.00 0.02 0.00 0.00 175.26 175.37 3kl8 n ALA 168 N 1.56 0.00 -3.66 5.21 0.00 -1.16 -4.85 120.51 117.60 3kl8 n ALA 168 Ca 0.01 0.00 -0.33 0.00 0.00 0.00 0.00 53.44 53.12 3kl8 n ALA 168 Cb 0.44 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.81 3kl8 n ALA 168 CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 177.50 179.37 3kl8 n TRP 169 N 0.00 3.81 -1.15 0.00 -0.00 -1.26 0.20 117.44 119.04 3kl8 n TRP 169 Ca 0.00 -4.12 -0.33 0.00 -0.00 0.00 0.00 57.50 53.05 3kl8 n TRP 169 Cb 0.00 -0.94 -0.04 0.00 -0.00 0.00 0.00 31.31 30.33 3kl8 n TRP 169 CO 0.00 0.00 0.00 0.72 -0.00 0.00 0.00 177.69 178.41 3kl8 n HIS 170 N 2.00 1.99 -1.44 5.87 8.25 -1.26 -4.89 115.22 125.74 3kl8 n HIS 170 Ca 0.22 -2.71 0.05 0.00 -0.26 0.00 0.00 57.72 55.02 3kl8 n HIS 170 Cb 0.37 -2.24 -0.01 0.00 1.12 0.00 0.00 29.99 29.23 3kl8 n HIS 170 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3kl8 n GLY 171 N 3.53 -2.05 2.71 -1.41 0.00 -1.26 -4.84 105.19 101.87 3kl8 n GLY 171 Ca 0.68 -1.39 -0.28 0.00 0.00 0.00 0.00 46.02 45.03 3kl8 n GLY 171 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 3kl8 s PHE 172 N -1.04 1.08 0.19 1.61 5.36 -1.26 -5.09 117.98 118.83 3kl8 s PHE 172 Ca 0.00 -1.05 -0.23 0.00 -0.96 0.00 0.00 56.93 54.70 3kl8 s PHE 172 Cb 0.00 -1.16 0.05 0.00 -0.34 0.00 0.00 43.02 41.58 3kl8 s PHE 172 CO 0.00 -0.69 0.67 0.00 -1.46 0.00 0.00 175.22 173.74 3kl8 s ALA 173 N 1.84 -1.49 0.00 11.12 0.00 -1.26 -5.16 121.76 126.81 3kl8 s ALA 173 Ca 0.03 0.23 0.00 0.00 0.00 0.00 0.00 51.96 52.22 3kl8 s ALA 173 Cb -0.17 0.84 0.00 0.00 0.00 0.00 0.00 23.12 23.79 3kl8 s ALA 173 CO -0.15 -0.87 0.00 0.41 0.00 0.00 0.00 175.76 175.15 3kl8 n GLY 174 N -0.40 1.67 3.70 0.00 0.00 -1.26 -4.86 105.19 104.04 3kl8 n GLY 174 Ca -0.12 -1.97 -0.39 0.00 0.00 0.00 0.00 46.02 43.55 3kl8 n GLY 174 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3kl8 s THR 175 N -1.33 5.13 -0.24 2.61 2.01 -1.26 -4.99 115.64 117.57 3kl8 s THR 175 Ca 0.00 1.06 -0.28 0.00 0.31 0.00 0.00 61.69 62.77 3kl8 s THR 175 Cb 0.00 -3.87 -0.04 0.00 0.01 0.00 0.00 72.50 68.60 3kl8 s THR 175 CO 0.00 0.26 1.93 -2.84 -0.69 0.00 0.00 174.62 173.29 3kl8 s PRO 176 N 0.99 3.41 0.00 4.92 0.02 -1.26 -1.63 135.00 141.46 3kl8 s PRO 176 Ca 0.28 1.79 0.00 0.00 0.02 0.00 0.00 61.00 63.08 3kl8 s PRO 176 Cb -0.16 -4.23 0.00 0.00 0.02 0.00 0.00 34.50 30.13 3kl8 s PRO 176 CO 0.11 -1.78 0.00 0.41 -0.33 0.00 0.00 177.00 175.42 3kl8 n GLY 177 N 5.35 2.76 0.00 0.52 0.00 -1.26 -4.87 105.19 107.68 3kl8 n GLY 177 Ca 0.24 -0.39 0.06 0.00 0.00 0.00 0.00 46.02 45.94 3kl8 n GLY 177 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 3kl8 n TYR 178 N 0.00 0.00 -1.63 1.61 4.01 -0.64 -4.79 117.16 115.71 3kl8 n TYR 178 Ca 0.00 0.00 -0.39 0.00 -0.16 0.00 0.00 57.90 57.35 3kl8 n TYR 178 Cb 0.00 -0.01 0.04 0.00 -0.31 0.00 0.00 39.34 39.06 3kl8 n TYR 178 CO 0.00 0.00 0.00 1.28 -0.46 0.00 0.00 176.86 177.68 3kl8 n LEU 179 N -1.32 3.74 -4.88 7.72 4.77 -1.02 -4.27 117.00 121.75 3kl8 n LEU 179 Ca 0.02 0.88 -0.31 0.00 -0.03 0.00 0.00 56.01 56.57 3kl8 n LEU 179 Cb 0.20 -1.41 -0.05 0.00 -2.33 0.00 0.00 43.42 39.83 3kl8 n LEU 179 CO 0.25 -1.59 0.28 -0.94 -1.33 0.00 0.00 177.39 174.06 3kl8 s SER 180 N -1.09 6.59 0.15 -1.43 1.04 -1.26 -4.98 113.70 112.72 3kl8 s SER 180 Ca 0.72 0.96 -0.20 0.00 0.48 0.00 0.00 55.95 57.92 3kl8 s SER 180 Cb -0.44 -2.25 0.03 0.00 0.10 0.00 0.00 66.02 63.46 3kl8 s SER 180 CO 0.49 -0.17 1.66 -0.65 0.98 0.00 0.00 173.24 175.55 3kl8 h PRO 181 N 2.10 -0.13 -0.51 4.02 0.11 -1.89 -2.10 132.00 133.60 3kl8 h PRO 181 Ca -0.47 0.01 0.15 0.00 0.11 0.00 0.00 66.00 65.79 3kl8 h PRO 181 Cb 1.18 0.03 -0.02 0.00 0.11 0.00 0.00 31.00 32.30 3kl8 h PRO 181 CO 0.67 -0.08 0.45 1.05 -0.21 0.00 0.00 178.00 179.87 3kl8 h GLU 182 N -0.13 0.00 0.00 1.05 9.09 -1.95 0.90 114.58 123.54 3kl8 h GLU 182 Ca 0.14 0.00 -0.22 0.00 0.05 0.00 0.00 59.36 59.33 3kl8 h GLU 182 Cb 0.34 0.00 -0.03 0.00 -1.65 0.00 0.00 28.75 27.41 3kl8 h GLU 182 CO -0.34 0.00 -1.21 0.28 0.05 0.00 0.00 179.01 177.79 3kl8 h VAL 183 N 0.00 1.21 0.00 -1.06 2.07 -1.67 -0.72 116.25 116.08 3kl8 h VAL 183 Ca 0.24 -2.90 -0.09 0.00 0.82 0.00 0.00 66.70 64.77 3kl8 h VAL 183 Cb 1.13 2.57 -0.01 0.00 -1.52 0.00 0.00 31.29 33.46 3kl8 h VAL 183 CO -0.00 0.69 -0.44 -0.07 0.02 0.00 0.00 177.57 177.76 3kl8 h LEU 184 N 0.00 0.00 -1.20 2.57 3.38 -0.56 -2.82 115.31 116.68 3kl8 h LEU 184 Ca -0.11 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.86 3kl8 h LEU 184 Cb 1.78 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.53 3kl8 h LEU 184 CO 0.10 0.44 0.00 0.29 0.09 0.00 0.00 178.44 179.36 3kl8 n LYS 185 N -3.26 1.79 -2.29 1.13 5.02 -0.36 -4.86 118.16 115.33 3kl8 n LYS 185 Ca 0.02 -0.91 -0.06 0.00 -2.02 0.00 0.00 58.31 55.34 3kl8 n LYS 185 Cb 0.68 -1.38 -0.01 0.00 -0.02 0.00 0.00 35.03 34.30 3kl8 n LYS 185 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 3kl8 n LYS 186 N 0.20 -2.41 -1.66 1.97 4.76 -1.06 -4.93 118.16 115.03 3kl8 n LYS 186 Ca 0.08 0.30 -0.29 0.00 -2.87 0.00 0.00 58.31 55.53 3kl8 n LYS 186 Cb 0.32 -4.79 0.14 0.00 -1.84 0.00 0.00 35.03 28.86 3kl8 n LYS 186 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 3kl8 s ASP 187 N -1.94 3.58 0.27 4.39 1.01 -0.28 -5.02 116.67 118.67 3kl8 s ASP 187 Ca 0.00 0.80 -0.29 0.00 0.71 0.00 0.00 52.55 53.77 3kl8 s ASP 187 Cb 0.00 -1.26 -0.09 0.00 1.01 0.00 0.00 42.92 42.57 3kl8 s ASP 187 CO 0.00 -2.49 0.95 -2.84 0.21 0.00 0.00 175.17 171.00 3kl8 s PRO 188 N -5.45 4.76 0.26 8.23 0.02 -1.26 -4.70 135.00 136.86 3kl8 s PRO 188 Ca 0.65 1.47 0.02 0.00 0.02 0.00 0.00 61.00 63.16 3kl8 s PRO 188 Cb -0.12 -3.14 -0.05 0.00 0.02 0.00 0.00 34.50 31.21 3kl8 s PRO 188 CO 0.52 0.42 0.06 1.52 -0.33 0.00 0.00 177.00 179.20 3kl8 s TYR 189 N -1.30 1.59 0.00 6.54 -0.85 0.13 -4.76 117.35 118.70 3kl8 s TYR 189 Ca 0.44 -1.08 0.00 0.00 -0.52 0.00 0.00 57.07 55.91 3kl8 s TYR 189 Cb -0.24 -0.95 0.00 0.00 0.38 0.00 0.00 41.96 41.15 3kl8 s TYR 189 CO 0.30 -0.21 0.00 0.45 -1.52 0.00 0.00 175.55 174.57 3kl8 n SER 190 N -0.48 0.60 -0.30 -0.18 2.88 -1.26 -3.01 113.62 111.88 3kl8 n SER 190 Ca -0.02 0.00 0.11 0.00 -1.33 0.00 0.00 58.87 57.63 3kl8 n SER 190 Cb 0.66 0.00 0.25 0.00 -0.75 0.00 0.00 64.21 64.37 3kl8 n SER 190 CO 0.00 0.00 0.00 0.11 -1.23 0.00 0.00 175.04 173.92 3kl8 h LYS 191 N 0.00 0.11 0.00 -1.46 1.57 -1.96 -2.58 116.57 112.25 3kl8 h LYS 191 Ca 0.00 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.77 3kl8 h LYS 191 Cb 0.00 -0.02 0.00 0.00 0.08 0.00 0.00 32.23 32.29 3kl8 h LYS 191 CO 0.00 0.07 0.00 -2.30 -0.57 0.00 0.00 179.45 176.65 3kl8 n PRO 192 N -5.35 0.05 0.24 3.15 -0.02 -1.26 -1.37 135.00 130.44 3kl8 n PRO 192 Ca 0.20 0.29 0.15 0.00 -2.02 0.00 0.00 63.50 62.11 3kl8 n PRO 192 Cb 0.65 -1.50 0.84 0.00 -0.02 0.00 0.00 33.50 33.46 3kl8 n PRO 192 CO 0.00 0.00 0.00 -0.39 1.98 0.00 0.00 175.50 177.09 3kl8 h VAL 193 N 0.00 0.57 0.13 -1.45 -1.51 -1.88 -2.30 116.25 109.82 3kl8 h VAL 193 Ca 0.00 0.00 -0.18 0.00 -1.23 0.00 0.00 66.70 65.29 3kl8 h VAL 193 Cb 0.04 0.92 0.02 0.00 -2.13 0.00 0.00 31.29 30.15 3kl8 h VAL 193 CO 0.00 0.00 -0.77 0.44 -1.23 0.00 0.00 177.57 176.01 3kl8 h ASP 194 N 0.00 0.44 -0.42 4.19 3.45 -1.48 -2.99 116.42 119.61 3kl8 h ASP 194 Ca 0.05 -0.96 0.12 0.00 0.43 0.00 0.00 57.03 56.67 3kl8 h ASP 194 Cb 0.25 -0.14 -0.02 0.00 -0.56 0.00 0.00 39.33 38.85 3kl8 h ASP 194 CO -0.00 1.37 0.32 0.40 -1.57 0.00 0.00 179.24 179.76 3kl8 h ILE 195 N -0.40 0.72 -0.03 0.35 1.08 -1.65 -0.01 117.51 117.56 3kl8 h ILE 195 Ca -0.14 0.00 -0.00 0.00 -0.39 0.00 0.00 64.86 64.33 3kl8 h ILE 195 Cb 1.61 0.77 -0.00 0.00 -3.07 0.00 0.00 36.82 36.13 3kl8 h ILE 195 CO 0.14 0.00 0.00 -0.25 -0.69 0.00 0.00 178.15 177.36 3kl8 h TRP 196 N 0.00 0.06 -0.83 1.37 2.91 -1.36 -2.53 115.95 115.58 3kl8 h TRP 196 Ca 0.20 -0.01 0.11 0.00 1.13 0.00 0.00 58.89 60.33 3kl8 h TRP 196 Cb 0.83 -0.02 -0.08 0.00 -0.51 0.00 0.00 29.16 29.39 3kl8 h TRP 196 CO 0.00 0.30 0.45 0.00 -1.03 0.00 0.00 178.44 178.16 3kl8 h ALA 197 N 0.75 1.20 0.02 2.65 0.00 -0.92 -1.67 119.26 121.28 3kl8 h ALA 197 Ca 0.01 0.05 0.03 0.00 0.00 0.00 0.00 54.91 55.00 3kl8 h ALA 197 Cb 0.28 -0.08 -0.05 0.00 0.00 0.00 0.00 17.79 17.94 3kl8 h ALA 197 CO 0.00 0.01 -0.34 0.00 0.00 0.00 0.00 179.25 178.93 3kl8 h GLY 199 N -0.50 1.02 0.82 0.00 0.00 -0.90 0.69 103.07 104.19 3kl8 h GLY 199 Ca 0.05 -0.19 -0.01 0.00 0.00 0.00 0.00 47.33 47.18 3kl8 h GLY 199 CO -0.26 -0.07 0.03 -2.08 0.00 0.00 0.00 176.54 174.15 3kl8 h VAL 200 N 0.38 1.20 0.46 4.60 2.07 -0.70 -0.42 116.25 123.83 3kl8 h VAL 200 Ca 0.54 -0.62 -0.02 0.00 0.82 0.00 0.00 66.70 67.42 3kl8 h VAL 200 Cb 1.41 1.37 0.00 0.00 -1.52 0.00 0.00 31.29 32.56 3kl8 h VAL 200 CO -0.23 0.18 -0.22 0.40 0.02 0.00 0.00 177.57 177.72 3kl8 h ILE 201 N 0.00 0.00 -1.43 4.57 2.04 0.13 -0.23 117.51 122.60 3kl8 h ILE 201 Ca 0.04 -0.12 0.42 0.00 1.00 0.00 0.00 64.86 66.20 3kl8 h ILE 201 Cb 0.26 0.00 -0.08 0.00 -0.74 0.00 0.00 36.82 36.25 3kl8 h ILE 201 CO 0.00 0.00 0.99 0.25 0.00 0.00 0.00 178.15 179.39 3kl8 h LEU 202 N -0.73 0.12 -0.22 1.44 5.85 -0.35 0.88 115.31 122.29 3kl8 h LEU 202 Ca -0.06 0.05 -0.06 0.00 0.84 0.00 0.00 57.88 58.64 3kl8 h LEU 202 Cb 0.47 0.03 -0.01 0.00 0.37 0.00 0.00 40.66 41.53 3kl8 h LEU 202 CO 0.10 -0.04 -0.09 0.22 -0.34 0.00 0.00 178.44 178.30 3kl8 h TYR 203 N 0.07 0.52 -0.07 1.25 5.03 -0.58 -3.12 116.97 120.07 3kl8 h TYR 203 Ca 0.74 -0.12 -0.00 0.00 2.58 0.00 0.00 58.73 61.92 3kl8 h TYR 203 Cb 2.68 -0.12 -0.00 0.00 1.55 0.00 0.00 36.73 40.83 3kl8 h TYR 203 CO -0.00 0.72 0.03 0.82 -1.32 0.00 0.00 178.16 178.41 3kl8 h ILE 204 N 0.17 1.13 -0.71 1.81 2.04 0.25 -3.06 117.51 119.14 3kl8 h ILE 204 Ca 0.05 -0.37 0.14 0.00 1.00 0.00 0.00 64.86 65.68 3kl8 h ILE 204 Cb 0.57 1.24 -0.13 0.00 -0.74 0.00 0.00 36.82 37.76 3kl8 h ILE 204 CO 0.03 0.11 -0.24 -0.07 0.00 0.00 0.00 178.15 177.97 3kl8 h LEU 205 N -0.02 -0.87 -1.90 1.44 3.38 -1.11 2.76 115.31 118.98 3kl8 h LEU 205 Ca 0.02 0.23 -0.03 0.00 0.09 0.00 0.00 57.88 58.20 3kl8 h LEU 205 Cb 0.14 0.51 -0.00 0.00 0.09 0.00 0.00 40.66 41.40 3kl8 h LEU 205 CO -0.00 -0.27 -0.12 -0.07 0.09 0.00 0.00 178.44 178.07 3kl8 h LEU 206 N -0.05 0.00 -0.00 1.67 3.38 -1.47 0.11 115.31 118.94 3kl8 h LEU 206 Ca 0.32 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.29 3kl8 h LEU 206 Cb 0.55 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.30 3kl8 h LEU 206 CO -0.75 0.12 0.00 1.33 0.09 0.00 0.00 178.44 179.23 3kl8 n VAL 207 N -3.73 0.00 -0.96 1.22 0.24 0.04 -4.72 118.33 110.43 3kl8 n VAL 207 Ca -0.02 -0.06 0.00 0.00 -2.04 0.00 0.00 64.34 62.23 3kl8 n VAL 207 Cb 0.23 1.01 0.00 0.00 -1.47 0.00 0.00 33.84 33.62 3kl8 n VAL 207 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3kl8 n GLY 208 N 0.11 1.00 3.54 7.63 0.00 0.91 -4.88 105.19 113.49 3kl8 n GLY 208 Ca 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.78 3kl8 n GLY 208 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3kl8 s TYR 209 N -3.86 2.44 0.69 1.61 -0.85 -1.26 -5.01 117.35 111.11 3kl8 s TYR 209 Ca 0.00 -0.31 -0.11 0.00 -0.52 0.00 0.00 57.07 56.13 3kl8 s TYR 209 Cb 0.00 -1.11 0.00 0.00 0.38 0.00 0.00 41.96 41.23 3kl8 s TYR 209 CO 0.00 0.66 1.07 -2.14 -1.52 0.00 0.00 175.55 173.62 3kl8 s PRO 210 N -3.58 3.02 -0.09 -3.49 0.02 -1.26 -4.14 135.00 125.48 3kl8 s PRO 210 Ca 0.31 0.67 -0.25 0.00 0.02 0.00 0.00 61.00 61.75 3kl8 s PRO 210 Cb -0.05 -2.02 -0.27 0.00 0.02 0.00 0.00 34.50 32.18 3kl8 s PRO 210 CO 0.17 -0.97 0.88 -1.35 -0.33 0.00 0.00 177.00 175.40 3kl8 h PRO 211 N -0.61 0.15 -5.18 5.54 0.11 -1.93 -3.45 132.00 126.63 3kl8 h PRO 211 Ca -0.45 -0.22 -0.65 0.00 0.11 0.00 0.00 66.00 64.79 3kl8 h PRO 211 Cb 1.23 0.08 -0.26 0.00 0.11 0.00 0.00 31.00 32.16 3kl8 h PRO 211 CO 0.61 1.07 -0.72 -0.06 -0.21 0.00 0.00 178.00 178.69 3kl8 s PHE 212 N -2.51 2.94 -0.29 0.65 2.99 -1.26 -4.74 117.98 115.76 3kl8 s PHE 212 Ca -0.16 -0.65 -0.17 0.00 0.00 0.00 0.00 56.93 55.95 3kl8 s PHE 212 Cb -0.01 -1.99 0.13 0.00 0.00 0.00 0.00 43.02 41.15 3kl8 s PHE 212 CO 0.75 -0.29 0.91 -0.46 -0.00 0.00 0.00 175.22 176.13 3kl8 s TRP 213 N 0.83 -0.68 0.12 0.36 -0.00 -1.26 -4.90 118.94 113.41 3kl8 s TRP 213 Ca -0.02 1.38 -0.07 0.00 -0.00 0.00 0.00 56.10 57.39 3kl8 s TRP 213 Cb -0.15 0.41 -0.01 0.00 -0.00 0.00 0.00 33.47 33.72 3kl8 s TRP 213 CO 0.01 -0.34 0.19 0.34 -0.00 0.00 0.00 176.95 177.16 3kl8 s ASP 214 N 1.29 0.15 0.23 5.86 -1.08 -1.26 -4.96 116.67 116.89 3kl8 s ASP 214 Ca -0.08 -0.86 -0.08 0.00 -0.52 0.00 0.00 52.55 51.01 3kl8 s ASP 214 Cb -0.04 0.36 0.21 0.00 -1.46 0.00 0.00 42.92 42.00 3kl8 s ASP 214 CO -0.15 -0.79 1.89 -0.33 0.52 0.00 0.00 175.17 176.31 3kl8 h GLU 215 N 2.72 1.21 -5.38 4.34 4.39 -2.02 -3.41 114.58 116.43 3kl8 h GLU 215 Ca -0.33 -0.09 -0.61 0.00 0.34 0.00 0.00 59.36 58.66 3kl8 h GLU 215 Cb 1.21 -0.26 -0.12 0.00 -0.10 0.00 0.00 28.75 29.47 3kl8 h GLU 215 CO 0.54 0.83 -0.03 0.34 -1.16 0.00 0.00 179.01 179.53 3kl8 s ASP 216 N -6.09 6.45 0.27 1.42 2.15 -1.26 -4.97 116.67 114.64 3kl8 s ASP 216 Ca -0.13 0.54 -0.02 0.00 0.43 0.00 0.00 52.55 53.38 3kl8 s ASP 216 Cb 0.17 -2.28 0.60 0.00 -0.30 0.00 0.00 42.92 41.11 3kl8 s ASP 216 CO 0.81 -0.26 1.64 -0.61 -0.17 0.00 0.00 175.17 176.58 3kl8 h GLN 217 N 7.91 0.16 -0.07 4.34 4.15 -2.00 -1.17 115.11 128.42 3kl8 h GLN 217 Ca -0.30 -0.01 -0.25 0.00 0.77 0.00 0.00 58.65 58.86 3kl8 h GLN 217 Cb 1.14 -0.04 0.02 0.00 0.21 0.00 0.00 27.48 28.81 3kl8 h GLN 217 CO 0.72 0.11 -0.93 0.45 -1.93 0.00 0.00 178.83 177.24 3kl8 h HIS 218 N 0.16 1.07 -1.05 3.99 3.86 -1.95 -1.57 115.15 119.67 3kl8 h HIS 218 Ca 0.50 -0.53 0.27 0.00 -1.16 0.00 0.00 60.37 59.45 3kl8 h HIS 218 Cb 0.96 -0.14 -0.11 0.00 1.06 0.00 0.00 27.41 29.18 3kl8 h HIS 218 CO -0.34 1.37 0.65 0.00 0.86 0.00 0.00 177.93 180.48 3kl8 h ARG 219 N 0.46 0.42 0.07 2.45 2.47 -1.73 -1.82 114.38 116.70 3kl8 h ARG 219 Ca -0.10 -0.02 -0.00 0.00 -1.26 0.00 0.00 59.98 58.59 3kl8 h ARG 219 Cb 1.57 -0.09 0.00 0.00 -1.65 0.00 0.00 29.97 29.80 3kl8 h ARG 219 CO 0.19 0.27 -0.03 1.25 0.56 0.00 0.00 179.97 182.21 3kl8 h LEU 220 N 0.43 -0.08 -1.59 3.04 5.85 -0.45 -2.75 115.31 119.75 3kl8 h LEU 220 Ca 0.63 0.00 0.44 0.00 0.84 0.00 0.00 57.88 59.79 3kl8 h LEU 220 Cb 1.50 0.02 -0.11 0.00 0.37 0.00 0.00 40.66 42.44 3kl8 h LEU 220 CO -0.37 -0.03 0.95 1.88 -0.34 0.00 0.00 178.44 180.53 3kl8 h TYR 221 N -0.15 0.37 0.26 1.25 0.05 -1.26 1.02 116.97 118.51 3kl8 h TYR 221 Ca -0.01 0.02 -0.01 0.00 0.05 0.00 0.00 58.73 58.77 3kl8 h TYR 221 Cb 0.07 -0.09 0.00 0.00 1.01 0.00 0.00 36.73 37.72 3kl8 h TYR 221 CO 0.11 -0.12 -0.12 0.00 -1.05 0.00 0.00 178.16 176.98 3kl8 h ALA 222 N 1.46 -0.35 -0.60 3.88 0.00 -1.35 0.00 119.26 122.31 3kl8 h ALA 222 Ca 0.79 -0.08 0.02 0.00 0.00 0.00 0.00 54.91 55.64 3kl8 h ALA 222 Cb 2.68 0.13 -0.04 0.00 0.00 0.00 0.00 17.79 20.56 3kl8 h ALA 222 CO -0.28 -0.68 0.37 0.37 0.00 0.00 0.00 179.25 179.02 3kl8 h GLN 223 N -0.37 0.70 0.35 0.00 4.15 0.13 -0.42 115.11 119.67 3kl8 h GLN 223 Ca -0.04 -0.04 -0.02 0.00 0.77 0.00 0.00 58.65 59.33 3kl8 h GLN 223 Cb 0.28 -0.16 -0.00 0.00 0.21 0.00 0.00 27.48 27.81 3kl8 h GLN 223 CO 0.06 0.47 -0.22 0.82 -1.93 0.00 0.00 178.83 178.03 3kl8 h ILE 224 N 0.72 0.00 -1.06 2.39 2.04 -1.03 -0.35 117.51 120.23 3kl8 h ILE 224 Ca 0.24 0.00 0.34 0.00 1.00 0.00 0.00 64.86 66.44 3kl8 h ILE 224 Cb 0.01 0.00 -0.14 0.00 -0.74 0.00 0.00 36.82 35.95 3kl8 h ILE 224 CO -0.10 0.00 0.62 0.11 0.00 0.00 0.00 178.15 178.78 3kl8 h LYS 225 N -0.54 0.26 -0.11 2.37 1.57 -0.89 0.34 116.57 119.57 3kl8 h LYS 225 Ca -0.05 -0.02 -0.10 0.00 -1.87 0.00 0.00 60.65 58.61 3kl8 h LYS 225 Cb 0.43 -0.06 -0.01 0.00 0.08 0.00 0.00 32.23 32.67 3kl8 h LYS 225 CO 0.05 0.17 -0.39 0.00 -0.57 0.00 0.00 179.45 178.71 3kl8 h ALA 226 N 1.81 1.13 0.00 3.86 0.00 -0.92 -3.47 119.26 121.67 3kl8 h ALA 226 Ca 0.75 -0.40 0.00 0.00 0.00 0.00 0.00 54.91 55.26 3kl8 h ALA 226 Cb 1.86 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 19.56 3kl8 h ALA 226 CO -0.57 0.57 0.00 0.41 0.00 0.00 0.00 179.25 179.67 3kl8 n GLY 227 N -0.23 0.90 3.50 0.00 0.00 0.12 -5.01 105.19 104.47 3kl8 n GLY 227 Ca -0.01 -0.59 -0.43 0.00 0.00 0.00 0.00 46.02 44.98 3kl8 n GLY 227 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3kl8 s ALA 228 N -2.00 3.45 0.05 4.61 0.00 -0.21 -4.96 121.76 122.70 3kl8 s ALA 228 Ca 0.00 -2.90 -0.02 0.00 0.00 0.00 0.00 51.96 49.04 3kl8 s ALA 228 Cb 0.00 -4.26 -0.03 0.00 0.00 0.00 0.00 23.12 18.83 3kl8 s ALA 228 CO 0.00 -3.08 -0.00 1.52 0.00 0.00 0.00 175.76 174.20 3kl8 s TYR 229 N 2.98 0.45 0.33 0.00 1.13 -1.26 -4.78 117.35 116.20 3kl8 s TYR 229 Ca 0.42 -0.95 -0.01 0.00 -1.41 0.00 0.00 57.07 55.12 3kl8 s TYR 229 Cb -0.02 -0.33 -0.01 0.00 -1.10 0.00 0.00 41.96 40.50 3kl8 s TYR 229 CO -0.04 -0.38 0.41 0.16 -2.51 0.00 0.00 175.55 173.19 3kl8 s ASP 230 N -2.78 0.99 -0.81 -0.18 -4.77 -1.26 -5.10 116.67 102.77 3kl8 s ASP 230 Ca 0.05 -1.52 0.02 0.00 -3.30 0.00 0.00 52.55 47.80 3kl8 s ASP 230 Cb 0.06 0.62 0.21 0.00 -1.09 0.00 0.00 42.92 42.72 3kl8 s ASP 230 CO -0.09 -1.21 0.72 -1.22 0.70 0.00 0.00 175.17 174.07 3kl8 n TYR 231 N -0.55 3.71 -1.66 2.11 0.53 -1.26 -5.06 117.16 114.97 3kl8 n TYR 231 Ca 0.02 -4.12 -0.45 0.00 -1.02 0.00 0.00 57.90 52.34 3kl8 n TYR 231 Cb 0.62 -0.88 -0.02 0.00 -1.03 0.00 0.00 39.34 38.03 3kl8 n TYR 231 CO 0.00 0.00 0.00 -2.30 -1.02 0.00 0.00 176.86 173.54 3kl8 n PRO 232 N 1.89 1.94 -2.74 -0.72 -0.02 -1.26 -4.67 135.00 129.42 3kl8 n PRO 232 Ca 0.23 0.69 -0.30 0.00 -2.02 0.00 0.00 63.50 62.09 3kl8 n PRO 232 Cb 0.37 -2.30 -0.03 0.00 -0.02 0.00 0.00 33.50 31.52 3kl8 n PRO 232 CO 0.00 0.00 0.00 -1.12 1.98 0.00 0.00 175.50 176.36 3kl8 s SER 233 N 0.09 6.51 0.04 2.55 0.01 -1.26 -2.18 113.70 119.46 3kl8 s SER 233 Ca 0.65 1.20 0.24 0.00 1.31 0.00 0.00 55.95 59.35 3kl8 s SER 233 Cb -0.65 -2.35 0.21 0.00 0.21 0.00 0.00 66.02 63.43 3kl8 s SER 233 CO 0.53 -0.45 1.18 -0.81 0.41 0.00 0.00 173.24 174.10 3kl8 n PRO 234 N -1.44 0.17 -0.23 12.44 -0.05 -1.26 -4.89 135.00 139.74 3kl8 n PRO 234 Ca 0.03 0.01 -0.06 0.00 -0.05 0.00 0.00 63.50 63.44 3kl8 n PRO 234 Cb 0.54 -1.57 -0.00 0.00 -0.05 0.00 0.00 33.50 32.42 3kl8 n PRO 234 CO 0.00 0.00 0.00 1.05 -0.05 0.00 0.00 175.50 176.50 3kl8 h GLU 235 N 0.00 -0.16 0.00 0.54 9.09 -1.95 0.29 114.58 122.40 3kl8 h GLU 235 Ca 0.00 0.01 0.00 0.00 0.05 0.00 0.00 59.36 59.42 3kl8 h GLU 235 Cb 0.64 0.04 0.00 0.00 -1.65 0.00 0.00 28.75 27.77 3kl8 h GLU 235 CO 0.00 -0.10 0.00 0.91 0.05 0.00 0.00 179.01 179.87 3kl8 n TRP 236 N -5.43 0.00 0.33 2.06 7.02 -0.93 -3.22 117.44 117.28 3kl8 n TRP 236 Ca 0.04 0.00 0.22 0.00 -1.02 0.00 0.00 57.50 56.74 3kl8 n TRP 236 Cb 0.36 -0.50 1.16 0.00 -2.42 0.00 0.00 31.31 29.91 3kl8 n TRP 236 CO 0.00 0.00 0.00 -0.44 -2.02 0.00 0.00 177.69 175.23 3kl8 h ASP 237 N 0.00 0.00 0.00 -0.99 3.32 -0.64 -2.70 116.42 115.41 3kl8 h ASP 237 Ca 0.00 0.00 -0.05 0.00 0.02 0.00 0.00 57.03 57.00 3kl8 h ASP 237 Cb 0.36 0.00 -0.11 0.00 0.22 0.00 0.00 39.33 39.80 3kl8 h ASP 237 CO 0.00 0.00 -0.63 0.35 -1.72 0.00 0.00 179.24 177.24 3kl8 n THR 238 N -3.08 1.51 -4.11 0.35 -2.24 -1.20 -4.98 114.28 100.53 3kl8 n THR 238 Ca -0.03 -2.48 -0.34 0.00 -2.27 0.00 0.00 64.05 58.93 3kl8 n THR 238 Cb 0.10 0.13 -0.11 0.00 -2.10 0.00 0.00 70.33 68.35 3kl8 n THR 238 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 3kl8 s VAL 239 N -2.22 4.49 0.16 2.28 1.01 -1.02 -5.05 120.40 120.04 3kl8 s VAL 239 Ca 0.36 -0.14 -0.34 0.00 0.00 0.00 0.00 61.98 61.86 3kl8 s VAL 239 Cb 0.36 -3.01 -0.14 0.00 0.00 0.00 0.00 36.38 33.59 3kl8 s VAL 239 CO -0.09 0.46 1.49 0.35 0.00 0.00 0.00 175.10 177.31 3kl8 n THR 240 N 3.61 0.19 -0.33 3.92 -2.24 -1.26 -4.81 114.28 113.36 3kl8 n THR 240 Ca -0.17 -0.05 0.18 0.00 -2.27 0.00 0.00 64.05 61.75 3kl8 n THR 240 Cb 0.52 -1.37 0.42 0.00 -2.10 0.00 0.00 70.33 67.80 3kl8 n THR 240 CO 0.00 0.00 0.00 -0.65 -0.57 0.00 0.00 175.07 173.85 3kl8 h PRO 241 N 5.29 0.53 -0.52 -0.78 0.11 -1.96 0.18 132.00 134.85 3kl8 h PRO 241 Ca -0.45 -0.03 0.15 0.00 0.11 0.00 0.00 66.00 65.77 3kl8 h PRO 241 Cb 1.28 -0.12 -0.02 0.00 0.11 0.00 0.00 31.00 32.24 3kl8 h PRO 241 CO 0.84 0.35 0.42 0.93 -0.21 0.00 0.00 178.00 180.33 3kl8 h GLU 242 N 0.55 0.00 0.18 1.05 3.07 -1.99 0.32 114.58 117.76 3kl8 h GLU 242 Ca 0.60 0.00 -0.26 0.00 -0.50 0.00 0.00 59.36 59.20 3kl8 h GLU 242 Cb 1.25 0.00 0.02 0.00 -0.84 0.00 0.00 28.75 29.18 3kl8 h GLU 242 CO -0.37 0.00 -1.20 0.00 -1.40 0.00 0.00 179.01 176.04 3kl8 h ALA 243 N 1.65 -0.06 0.51 3.43 0.00 -0.97 -2.95 119.26 120.88 3kl8 h ALA 243 Ca 0.25 -0.85 -0.02 0.00 0.00 0.00 0.00 54.91 54.28 3kl8 h ALA 243 Cb 1.07 0.21 0.00 0.00 0.00 0.00 0.00 17.79 19.08 3kl8 h ALA 243 CO -0.00 0.60 -0.24 0.87 0.00 0.00 0.00 179.25 180.47 3kl8 h LYS 244 N -0.16 -0.66 -0.99 0.00 1.57 -0.96 -2.48 116.57 112.90 3kl8 h LYS 244 Ca -0.22 0.04 0.31 0.00 -1.87 0.00 0.00 60.65 58.91 3kl8 h LYS 244 Cb 1.87 0.15 -0.15 0.00 0.08 0.00 0.00 32.23 34.18 3kl8 h LYS 244 CO 0.18 -0.43 0.52 1.03 -0.57 0.00 0.00 179.45 180.17 3kl8 h SER 245 N -0.69 0.44 -0.13 0.86 0.87 -0.55 0.54 113.55 114.88 3kl8 h SER 245 Ca -0.07 0.19 -0.12 0.00 -1.23 0.00 0.00 61.79 60.56 3kl8 h SER 245 Cb 0.53 0.16 -0.01 0.00 -0.44 0.00 0.00 62.40 62.63 3kl8 h SER 245 CO 0.11 -0.14 -0.32 0.25 -0.53 0.00 0.00 176.83 176.21 3kl8 h LEU 246 N 0.31 0.65 0.20 2.23 5.85 -1.31 -2.12 115.31 121.12 3kl8 h LEU 246 Ca 0.71 -0.26 -0.01 0.00 0.84 0.00 0.00 57.88 59.16 3kl8 h LEU 246 Cb 1.59 -0.18 0.00 0.00 0.37 0.00 0.00 40.66 42.44 3kl8 h LEU 246 CO -0.62 0.92 -0.10 0.40 -0.34 0.00 0.00 178.44 178.71 3kl8 h ILE 247 N 0.53 0.89 -1.13 4.05 2.04 0.31 -2.85 117.51 121.34 3kl8 h ILE 247 Ca 0.06 -0.60 0.36 0.00 1.00 0.00 0.00 64.86 65.69 3kl8 h ILE 247 Cb 0.81 1.24 -0.13 0.00 -0.74 0.00 0.00 36.82 37.99 3kl8 h ILE 247 CO 0.07 0.13 0.69 0.44 0.00 0.00 0.00 178.15 179.48 3kl8 h ASP 248 N -0.58 0.38 0.84 1.72 3.32 -0.27 0.68 116.42 122.51 3kl8 h ASP 248 Ca -0.03 0.16 0.00 0.00 0.02 0.00 0.00 57.03 57.18 3kl8 h ASP 248 Cb 0.43 0.12 0.00 0.00 0.22 0.00 0.00 39.33 40.10 3kl8 h ASP 248 CO 0.05 -0.14 -0.40 -1.54 -1.72 0.00 0.00 179.24 175.49 3kl8 n SER 249 N -4.85 0.52 -0.03 6.45 3.41 -0.81 -2.19 113.62 116.12 3kl8 n SER 249 Ca 0.33 0.12 -0.13 0.00 -0.26 0.00 0.00 58.87 58.93 3kl8 n SER 249 Cb 1.16 -0.04 -0.14 0.00 -0.26 0.00 0.00 64.21 64.93 3kl8 n SER 249 CO 0.00 0.00 0.00 0.23 -0.16 0.00 0.00 175.04 175.11 3kl8 n MET 250 N -1.82 0.68 -0.86 4.33 2.81 0.20 -2.08 117.12 120.38 3kl8 n MET 250 Ca 0.05 0.23 -0.16 0.00 -1.81 0.00 0.00 57.70 56.01 3kl8 n MET 250 Cb 0.39 -1.71 0.13 0.00 -0.71 0.00 0.00 33.22 31.31 3kl8 n MET 250 CO 0.00 0.00 0.00 1.28 1.51 0.00 0.00 175.97 178.76 3kl8 n LEU 251 N -3.14 5.60 -4.68 4.03 4.77 0.10 -4.15 117.00 119.52 3kl8 n LEU 251 Ca -0.26 -2.96 -0.42 0.00 -0.03 0.00 0.00 56.01 52.34 3kl8 n LEU 251 Cb 1.06 -0.74 -0.03 0.00 -2.33 0.00 0.00 43.42 41.39 3kl8 n LEU 251 CO 0.43 0.88 1.17 -0.89 -1.33 0.00 0.00 177.39 177.64 3kl8 s THR 252 N -2.30 3.70 0.18 -5.08 2.01 -0.93 -4.94 115.64 108.28 3kl8 s THR 252 Ca 0.40 1.04 0.01 0.00 0.31 0.00 0.00 61.69 63.45 3kl8 s THR 252 Cb 0.33 -3.67 -0.12 0.00 0.01 0.00 0.00 72.50 69.06 3kl8 s THR 252 CO 0.08 -0.03 1.42 0.58 -0.69 0.00 0.00 174.62 175.98 3kl8 h VAL 253 N 5.07 1.43 -2.98 3.82 2.07 -1.89 -3.41 116.25 120.36 3kl8 h VAL 253 Ca -0.37 -2.34 -0.55 0.00 0.82 0.00 0.00 66.70 64.26 3kl8 h VAL 253 Cb 1.17 2.27 -0.07 0.00 -1.52 0.00 0.00 31.29 33.14 3kl8 h VAL 253 CO 0.92 0.69 1.03 0.21 0.02 0.00 0.00 177.57 180.44 3kl8 s ASN 254 N -6.95 6.31 0.22 0.57 2.47 -1.26 -4.72 114.94 111.58 3kl8 s ASN 254 Ca -0.04 0.10 -0.15 0.00 0.42 0.00 0.00 52.86 53.18 3kl8 s ASN 254 Cb 0.10 -2.55 0.24 0.00 -1.45 0.00 0.00 41.25 37.59 3kl8 s ASN 254 CO 0.83 -1.60 1.59 -0.65 -3.72 0.00 0.00 177.10 173.56 3kl8 h PRO 255 N 10.08 -0.06 -0.73 0.43 0.11 -1.95 -0.32 132.00 139.56 3kl8 h PRO 255 Ca -0.26 0.00 0.21 0.00 0.11 0.00 0.00 66.00 66.07 3kl8 h PRO 255 Cb 1.07 0.01 -0.03 0.00 0.11 0.00 0.00 31.00 32.16 3kl8 h PRO 255 CO 1.20 -0.04 0.70 0.87 -0.21 0.00 0.00 178.00 180.51 3kl8 h LYS 256 N -0.06 0.00 -0.06 1.05 1.79 -1.96 -1.35 116.57 115.99 3kl8 h LYS 256 Ca 0.31 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.78 3kl8 h LYS 256 Cb 0.55 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.20 3kl8 h LYS 256 CO -0.75 0.00 0.00 1.63 -1.08 0.00 0.00 179.45 179.25 3kl8 n LYS 257 N -3.75 2.14 -2.74 3.15 5.02 -0.17 -4.97 118.16 116.83 3kl8 n LYS 257 Ca 0.15 -1.40 -0.42 0.00 -2.02 0.00 0.00 58.31 54.62 3kl8 n LYS 257 Cb 0.95 -1.06 -0.03 0.00 -0.02 0.00 0.00 35.03 34.88 3kl8 n LYS 257 CO 0.00 0.00 0.00 0.50 -0.52 0.00 0.00 177.40 177.38 3kl8 s ARG 258 N -0.82 4.42 0.27 1.97 3.52 -0.51 -4.97 118.95 122.82 3kl8 s ARG 258 Ca 0.04 1.30 -0.26 0.00 -0.13 0.00 0.00 55.73 56.68 3kl8 s ARG 258 Cb 0.02 -3.53 -0.16 0.00 -1.56 0.00 0.00 34.95 29.72 3kl8 s ARG 258 CO 0.03 -0.27 0.54 1.51 -0.81 0.00 0.00 175.30 176.30 3kl8 n ILE 259 N 4.47 1.78 -2.64 4.11 3.06 -0.88 -4.99 119.36 124.26 3kl8 n ILE 259 Ca 0.07 -0.50 -0.21 0.00 -2.50 0.00 0.00 62.75 59.61 3kl8 n ILE 259 Cb 0.49 -0.22 0.05 0.00 0.54 0.00 0.00 39.64 40.50 3kl8 n ILE 259 CO 0.00 0.00 0.00 0.42 -2.50 0.00 0.00 176.55 174.47 3kl8 s THR 260 N -1.16 2.54 0.05 9.51 -4.23 -1.26 -4.88 115.64 116.21 3kl8 s THR 260 Ca 0.62 -0.66 -0.33 0.00 -1.18 0.00 0.00 61.69 60.14 3kl8 s THR 260 Cb -0.82 -2.88 -0.19 0.00 1.34 0.00 0.00 72.50 69.96 3kl8 s THR 260 CO 0.58 0.00 1.50 0.00 -0.54 0.00 0.00 174.62 176.16 3kl8 h ALA 261 N -0.04 -1.02 0.00 3.99 0.00 -1.94 -1.56 119.26 118.69 3kl8 h ALA 261 Ca -0.40 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.28 3kl8 h ALA 261 Cb 1.29 0.40 0.00 0.00 0.00 0.00 0.00 17.79 19.48 3kl8 h ALA 261 CO 0.49 -1.04 0.08 -0.25 0.00 0.00 0.00 179.25 178.53 3kl8 n ASP 262 N -5.50 0.41 -0.02 0.00 8.00 -1.26 -0.97 116.55 117.21 3kl8 n ASP 262 Ca -0.14 0.66 -0.20 0.00 0.71 0.00 0.00 54.79 55.82 3kl8 n ASP 262 Cb 0.41 -0.69 -0.14 0.00 -0.02 0.00 0.00 41.12 40.69 3kl8 n ASP 262 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3kl8 n GLN 263 N -2.07 0.74 0.19 -1.24 6.02 -1.04 -4.05 117.38 115.93 3kl8 n GLN 263 Ca -0.01 0.24 0.05 0.00 -0.01 0.00 0.00 57.00 57.27 3kl8 n GLN 263 Cb 0.10 -1.67 0.48 0.00 1.02 0.00 0.00 30.24 30.17 3kl8 n GLN 263 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3kl8 h ALA 264 N 0.09 1.68 0.00 -1.58 0.00 -0.02 -1.86 119.26 117.56 3kl8 h ALA 264 Ca -0.45 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.31 3kl8 h ALA 264 Cb 2.01 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.75 3kl8 h ALA 264 CO 0.05 0.24 0.00 1.28 0.00 0.00 0.00 179.25 180.82 3kl8 n LEU 265 N -4.34 0.03 -1.21 0.00 4.77 -0.85 -2.64 117.00 112.76 3kl8 n LEU 265 Ca -0.02 0.51 0.09 0.00 -0.03 0.00 0.00 56.01 56.56 3kl8 n LEU 265 Cb 0.22 -0.50 0.29 0.00 -2.33 0.00 0.00 43.42 41.10 3kl8 n LEU 265 CO 0.36 -0.18 0.75 0.29 -1.33 0.00 0.00 177.39 177.28 3kl8 n LYS 266 N -1.54 3.09 -3.11 3.23 5.02 -0.70 -4.59 118.16 119.57 3kl8 n LYS 266 Ca 0.05 -2.59 -0.39 0.00 -2.02 0.00 0.00 58.31 53.35 3kl8 n LYS 266 Cb 0.23 -1.61 -0.06 0.00 -0.02 0.00 0.00 35.03 33.57 3kl8 n LYS 266 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 3kl8 s VAL 267 N -1.38 4.56 0.14 -0.18 1.01 -1.08 -4.87 120.40 118.61 3kl8 s VAL 267 Ca 0.43 1.49 -0.25 0.00 0.00 0.00 0.00 61.98 63.64 3kl8 s VAL 267 Cb 0.25 -4.03 -0.03 0.00 0.00 0.00 0.00 36.38 32.57 3kl8 s VAL 267 CO 0.25 0.52 1.30 -2.65 0.00 0.00 0.00 175.10 174.52 3kl8 n PRO 268 N 1.79 -0.35 0.00 2.72 -0.02 -1.26 0.30 135.00 138.17 3kl8 n PRO 268 Ca -0.07 1.28 0.00 0.00 -2.02 0.00 0.00 63.50 62.69 3kl8 n PRO 268 Cb 0.50 -1.88 0.00 0.00 -0.02 0.00 0.00 33.50 32.09 3kl8 n PRO 268 CO 0.00 0.00 0.00 1.87 1.98 0.00 0.00 175.50 179.35 3kl8 n TRP 269 N -5.08 0.00 0.00 6.00 -0.00 -1.26 -0.96 117.44 116.14 3kl8 n TRP 269 Ca 0.02 0.00 0.00 0.00 -0.00 0.00 0.00 57.50 57.52 3kl8 n TRP 269 Cb 0.23 -0.13 0.00 0.00 -0.00 0.00 0.00 31.31 31.41 3kl8 n TRP 269 CO 0.00 0.00 0.00 -0.89 -0.00 0.00 0.00 177.69 176.80 3kl8 n ILE 270 N -1.12 0.00 0.58 5.87 2.08 0.77 -4.69 119.36 122.86 3kl8 n ILE 270 Ca 0.00 0.00 -0.02 0.00 0.56 0.00 0.00 62.75 63.29 3kl8 n ILE 270 Cb 0.00 -0.94 0.05 0.00 -0.75 0.00 0.00 39.64 38.01 3kl8 n ILE 270 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 3kl8 n ASN 272 N 0.15 3.34 -4.63 0.00 3.02 -1.00 -4.91 115.26 111.23 3kl8 n ASN 272 Ca 0.09 -3.28 -0.41 0.00 -0.03 0.00 0.00 54.58 50.96 3kl8 n ASN 272 Cb 0.62 -0.76 -0.05 0.00 -0.61 0.00 0.00 39.78 38.98 3kl8 n ASN 272 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3kl8 s ARG 273 N -1.75 4.11 0.00 3.52 1.70 -1.26 -5.07 118.95 120.20 3kl8 s ARG 273 Ca 0.29 0.75 0.00 0.00 -0.47 0.00 0.00 55.73 56.30 3kl8 s ARG 273 Cb 0.01 -3.66 0.00 0.00 -0.57 0.00 0.00 34.95 30.72 3kl8 s ARG 273 CO -0.12 -0.52 0.00 0.39 -1.08 0.00 0.00 175.30 173.97