#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ko5 s ARG 2 N 0.00 2.53 -0.01 2.12 0.52 -0.30 -1.57 118.95 122.23 3ko5 s ARG 2 Ca 0.00 -0.72 0.01 0.00 -0.52 0.00 0.00 55.73 54.50 3ko5 s ARG 2 Cb 0.00 -2.36 0.00 0.00 0.52 0.00 0.00 34.95 33.11 3ko5 s ARG 2 CO 0.00 0.59 -0.04 0.54 0.02 0.00 0.00 175.30 176.41 3ko5 s VAL 3 N -0.64 0.38 -0.26 3.52 0.11 0.04 -0.24 120.40 123.31 3ko5 s VAL 3 Ca 0.10 -0.15 -0.06 0.00 -2.93 0.00 0.00 61.98 58.94 3ko5 s VAL 3 Cb -0.11 -0.36 -0.01 0.00 -1.53 0.00 0.00 36.38 34.38 3ko5 s VAL 3 CO 0.01 0.13 0.04 -0.69 -3.33 0.00 0.00 175.10 171.26 3ko5 s VAL 4 N 0.21 3.85 -0.19 2.04 1.01 -0.60 -1.71 120.40 125.01 3ko5 s VAL 4 Ca -0.02 -0.51 -0.05 0.00 0.00 0.00 0.00 61.98 61.40 3ko5 s VAL 4 Cb -0.06 -2.87 -0.03 0.00 0.00 0.00 0.00 36.38 33.42 3ko5 s VAL 4 CO -0.00 0.25 0.01 -0.63 0.00 0.00 0.00 175.10 174.73 3ko5 s ILE 5 N 1.52 4.14 -0.08 2.22 1.01 0.81 -0.77 121.20 130.04 3ko5 s ILE 5 Ca 0.04 -0.25 0.05 0.00 0.00 0.00 0.00 60.65 60.49 3ko5 s ILE 5 Cb -0.16 -2.87 -0.00 0.00 0.01 0.00 0.00 42.46 39.44 3ko5 s ILE 5 CO 0.01 0.43 -0.24 -1.10 0.00 0.00 0.00 174.94 174.05 3ko5 s GLN 6 N 0.84 2.81 0.00 2.79 -0.21 -0.39 -0.17 119.66 125.33 3ko5 s GLN 6 Ca 0.01 -0.86 -0.30 0.00 0.02 0.00 0.00 55.36 54.23 3ko5 s GLN 6 Cb -0.14 -2.20 -0.04 0.00 1.00 0.00 0.00 33.01 31.63 3ko5 s GLN 6 CO 0.02 0.23 1.16 0.50 -2.12 0.00 0.00 175.29 175.08 3ko5 s ARG 7 N 0.20 4.42 0.13 2.91 3.52 -0.58 -1.90 118.95 127.66 3ko5 s ARG 7 Ca -0.14 1.66 0.06 0.00 -0.13 0.00 0.00 55.73 57.19 3ko5 s ARG 7 Cb -0.16 -3.45 -0.04 0.00 -1.56 0.00 0.00 34.95 29.74 3ko5 s ARG 7 CO 0.07 -0.29 -0.15 0.14 -0.81 0.00 0.00 175.30 174.26 3ko5 s VAL 8 N 1.49 1.41 -0.78 7.11 -7.23 -0.36 -0.12 120.40 121.92 3ko5 s VAL 8 Ca 0.56 -1.76 0.23 0.00 -1.81 0.00 0.00 61.98 59.20 3ko5 s VAL 8 Cb -0.26 -1.60 -0.07 0.00 0.56 0.00 0.00 36.38 35.01 3ko5 s VAL 8 CO 0.26 -0.41 1.17 0.29 -0.31 0.00 0.00 175.10 176.10 3ko5 n LYS 9 N 0.46 0.16 0.00 4.82 4.76 -0.17 -1.91 118.16 126.29 3ko5 n LYS 9 Ca -0.15 0.01 0.00 0.00 -2.87 0.00 0.00 58.31 55.30 3ko5 n LYS 9 Cb 0.57 -1.56 0.00 0.00 -1.84 0.00 0.00 35.03 32.20 3ko5 n LYS 9 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3ko5 n GLY 10 N 1.42 1.19 3.18 0.72 0.00 -1.19 -2.59 105.19 107.92 3ko5 n GLY 10 Ca 0.03 -0.70 -0.11 0.00 0.00 0.00 0.00 46.02 45.24 3ko5 n GLY 10 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ko5 s ALA 11 N -2.00 -0.85 -0.22 4.61 0.00 -0.67 -0.92 121.76 121.71 3ko5 s ALA 11 Ca 0.00 1.31 -0.00 0.00 0.00 0.00 0.00 51.96 53.27 3ko5 s ALA 11 Cb 0.00 -0.83 0.03 0.00 0.00 0.00 0.00 23.12 22.32 3ko5 s ALA 11 CO 0.00 -0.26 -0.12 0.42 0.00 0.00 0.00 175.76 175.80 3ko5 s ILE 12 N 1.41 2.50 -0.20 0.00 1.01 0.94 -1.27 121.20 125.59 3ko5 s ILE 12 Ca -0.09 -1.04 -0.05 0.00 0.00 0.00 0.00 60.65 59.47 3ko5 s ILE 12 Cb -0.09 -2.21 -0.02 0.00 0.01 0.00 0.00 42.46 40.14 3ko5 s ILE 12 CO -0.11 0.31 0.01 -0.22 0.00 0.00 0.00 174.94 174.93 3ko5 s LEU 13 N 1.29 3.28 0.15 2.97 0.20 0.21 -0.85 118.68 125.93 3ko5 s LEU 13 Ca 0.01 -0.20 0.06 0.00 0.69 0.00 0.00 54.13 54.70 3ko5 s LEU 13 Cb -0.16 -1.83 -0.04 0.00 -0.43 0.00 0.00 46.19 43.73 3ko5 s LEU 13 CO -0.08 0.06 -0.14 -0.94 -0.29 0.00 0.00 176.35 174.96 3ko5 s SER 14 N 1.04 2.19 0.39 3.68 1.04 0.17 -1.27 113.70 120.94 3ko5 s SER 14 Ca 0.02 -0.87 0.05 0.00 0.48 0.00 0.00 55.95 55.62 3ko5 s SER 14 Cb -0.14 -0.09 -0.06 0.00 0.10 0.00 0.00 66.02 65.83 3ko5 s SER 14 CO 0.02 -0.15 0.04 0.68 0.98 0.00 0.00 173.24 174.81 3ko5 s VAL 15 N -2.38 1.46 -0.04 5.02 -7.23 -0.73 -0.54 120.40 115.96 3ko5 s VAL 15 Ca 0.13 -2.00 -0.21 0.00 -1.81 0.00 0.00 61.98 58.09 3ko5 s VAL 15 Cb -0.04 -2.76 -0.05 0.00 0.56 0.00 0.00 36.38 34.10 3ko5 s VAL 15 CO 0.04 0.00 0.59 -0.13 -0.31 0.00 0.00 175.10 175.29 3ko5 s ARG 16 N -3.80 4.34 0.00 4.82 0.52 -1.26 -0.83 118.95 122.74 3ko5 s ARG 16 Ca 0.31 0.71 0.00 0.00 -0.52 0.00 0.00 55.73 56.23 3ko5 s ARG 16 Cb 0.08 -3.38 0.00 0.00 0.52 0.00 0.00 34.95 32.17 3ko5 s ARG 16 CO 0.15 0.27 0.11 1.63 0.02 0.00 0.00 175.30 177.47 3ko5 n LYS 17 N 3.11 0.00 0.00 3.54 5.02 -1.26 -4.95 118.16 123.63 3ko5 n LYS 17 Ca -0.06 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.23 3ko5 n LYS 17 Cb 0.51 -0.46 0.00 0.00 -0.02 0.00 0.00 35.03 35.06 3ko5 n LYS 17 CO 0.00 0.00 0.00 0.36 -0.52 0.00 0.00 177.40 177.24 3ko5 n LYS 25 N -0.22 0.00 0.08 1.97 0.00 -1.26 -5.14 118.16 113.59 3ko5 n LYS 25 Ca 0.00 0.00 -0.05 0.00 -0.00 0.00 0.00 58.31 58.26 3ko5 n LYS 25 Cb 0.00 0.00 0.13 0.00 -0.00 0.00 0.00 35.03 35.16 3ko5 n LYS 25 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.40 178.89 3ko5 h GLU 26 N 0.00 0.27 -6.59 -1.58 4.81 -2.01 -3.44 114.58 106.05 3ko5 h GLU 26 Ca 0.00 -0.17 -0.51 0.00 -0.13 0.00 0.00 59.36 58.54 3ko5 h GLU 26 Cb 0.00 0.02 -0.02 0.00 0.63 0.00 0.00 28.75 29.38 3ko5 h GLU 26 CO 0.00 0.76 0.36 -0.51 -0.73 0.00 0.00 179.01 178.89 3ko5 s LEU 27 N -8.02 4.52 -0.08 1.64 1.43 -1.26 -4.34 118.68 112.56 3ko5 s LEU 27 Ca -0.04 1.81 0.01 0.00 -1.03 0.00 0.00 54.13 54.88 3ko5 s LEU 27 Cb 0.12 -3.59 0.02 0.00 0.03 0.00 0.00 46.19 42.77 3ko5 s LEU 27 CO 0.80 -0.04 -0.11 -1.83 0.23 0.00 0.00 176.35 175.40 3ko5 s GLU 28 N -0.15 1.62 0.23 1.70 -1.05 -0.01 -4.92 118.70 116.13 3ko5 s GLU 28 Ca 0.46 -0.36 -0.31 0.00 -0.15 0.00 0.00 54.97 54.61 3ko5 s GLU 28 Cb -0.24 -1.43 -0.11 0.00 -0.44 0.00 0.00 34.13 31.92 3ko5 s GLU 28 CO 0.30 -0.06 1.58 0.42 0.95 0.00 0.00 175.26 178.46 3ko5 s ILE 29 N 0.95 2.32 0.00 1.83 1.01 -1.26 -1.76 121.20 124.28 3ko5 s ILE 29 Ca -0.09 0.25 0.00 0.00 0.00 0.00 0.00 60.65 60.81 3ko5 s ILE 29 Cb -0.15 -3.16 0.00 0.00 0.01 0.00 0.00 42.46 39.16 3ko5 s ILE 29 CO 0.00 0.03 0.00 2.30 0.00 0.00 0.00 174.94 177.27 3ko5 n ILE 30 N 3.03 0.00 -3.65 2.92 -5.35 -0.39 -4.94 119.36 110.99 3ko5 n ILE 30 Ca 0.11 -0.25 -0.12 0.00 -0.27 0.00 0.00 62.75 62.22 3ko5 n ILE 30 Cb 0.38 0.78 -0.08 0.00 -1.74 0.00 0.00 39.64 38.98 3ko5 n ILE 30 CO 0.00 0.00 0.00 -0.55 -1.76 0.00 0.00 176.55 174.24 3ko5 s SER 31 N -1.09 -0.76 -0.01 7.28 0.15 -1.00 -5.04 113.70 113.23 3ko5 s SER 31 Ca 0.00 1.37 -0.24 0.00 0.70 0.00 0.00 55.95 57.78 3ko5 s SER 31 Cb 0.00 1.34 0.05 0.00 -1.71 0.00 0.00 66.02 65.70 3ko5 s SER 31 CO 0.00 -0.23 0.52 -1.83 1.20 0.00 0.00 173.24 172.90 3ko5 s GLU 32 N 0.78 0.93 0.11 5.44 -1.05 -1.26 0.66 118.70 124.31 3ko5 s GLU 32 Ca -0.03 -0.02 0.03 0.00 -0.15 0.00 0.00 54.97 54.80 3ko5 s GLU 32 Cb -0.05 0.43 -0.04 0.00 -0.44 0.00 0.00 34.13 34.03 3ko5 s GLU 32 CO -0.06 -0.30 -0.09 0.96 0.95 0.00 0.00 175.26 176.72 3ko5 s ILE 33 N -1.60 0.94 0.00 1.83 -4.36 -0.39 -4.99 121.20 112.62 3ko5 s ILE 33 Ca -0.10 -1.77 0.00 0.00 -0.26 0.00 0.00 60.65 58.52 3ko5 s ILE 33 Cb -0.02 -1.50 0.00 0.00 1.25 0.00 0.00 42.46 42.19 3ko5 s ILE 33 CO 0.05 -0.65 0.00 0.29 0.24 0.00 0.00 174.94 174.87 3ko5 n LYS 34 N 0.32 1.83 -1.71 0.37 5.02 -1.26 -1.67 118.16 121.05 3ko5 n LYS 34 Ca -0.14 0.00 -0.42 0.00 -2.02 0.00 0.00 58.31 55.73 3ko5 n LYS 34 Cb 0.59 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.60 3ko5 n LYS 34 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 3ko5 n ASN 35 N 0.00 2.82 0.00 4.39 3.02 -1.07 -3.20 115.26 121.23 3ko5 n ASN 35 Ca 0.00 1.17 0.00 0.00 -0.03 0.00 0.00 54.58 55.72 3ko5 n ASN 35 Cb 0.00 -1.51 0.00 0.00 -0.61 0.00 0.00 39.78 37.66 3ko5 n ASN 35 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3ko5 n GLY 36 N 0.74 -0.12 3.04 7.41 0.00 -0.80 -2.00 105.19 113.46 3ko5 n GLY 36 Ca 0.05 -0.77 -0.21 0.00 0.00 0.00 0.00 46.02 45.09 3ko5 n GLY 36 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3ko5 s LEU 37 N 0.00 1.91 -0.20 0.99 1.43 -0.18 -1.23 118.68 121.40 3ko5 s LEU 37 Ca 0.00 -0.21 -0.10 0.00 -1.03 0.00 0.00 54.13 52.79 3ko5 s LEU 37 Cb 0.00 -0.59 -0.05 0.00 0.03 0.00 0.00 46.19 45.58 3ko5 s LEU 37 CO 0.00 0.11 0.13 -0.51 0.23 0.00 0.00 176.35 176.31 3ko5 s ILE 38 N -0.04 5.37 -0.26 -0.59 2.07 -0.80 -0.44 121.20 126.52 3ko5 s ILE 38 Ca 0.00 0.18 0.03 0.00 -1.41 0.00 0.00 60.65 59.45 3ko5 s ILE 38 Cb -0.07 -3.46 0.06 0.00 0.13 0.00 0.00 42.46 39.13 3ko5 s ILE 38 CO 0.00 0.43 -0.11 0.00 -1.91 0.00 0.00 174.94 173.35 3ko5 s PHE 40 N 1.13 2.96 -0.31 0.00 0.08 0.05 -1.09 117.98 120.79 3ko5 s PHE 40 Ca -0.08 0.07 -0.08 0.00 0.12 0.00 0.00 56.93 56.96 3ko5 s PHE 40 Cb -0.20 -3.71 0.00 0.00 -0.57 0.00 0.00 43.02 38.54 3ko5 s PHE 40 CO -0.05 -1.05 0.12 -1.17 -0.10 0.00 0.00 175.22 172.97 3ko5 s LEU 41 N 3.34 4.06 -0.25 -0.37 0.20 0.13 -1.56 118.68 124.22 3ko5 s LEU 41 Ca 0.29 -0.66 -0.11 0.00 0.69 0.00 0.00 54.13 54.33 3ko5 s LEU 41 Cb -0.13 -1.95 -0.05 0.00 -0.43 0.00 0.00 46.19 43.63 3ko5 s LEU 41 CO 0.21 -0.21 0.17 -0.83 -0.29 0.00 0.00 176.35 175.40 3ko5 s GLY 42 N 1.55 1.97 -0.27 7.98 0.00 0.67 0.33 107.32 119.54 3ko5 s GLY 42 Ca 0.03 -0.96 -0.10 0.00 0.00 0.00 0.00 44.72 43.70 3ko5 s GLY 42 CO 0.05 0.49 0.15 -0.42 0.00 0.00 0.00 173.10 173.37 3ko5 s ILE 43 N 1.32 5.00 0.50 0.90 1.01 -1.26 -1.15 121.20 127.52 3ko5 s ILE 43 Ca 0.08 0.06 -0.13 0.00 0.00 0.00 0.00 60.65 60.65 3ko5 s ILE 43 Cb -0.14 -3.37 -0.07 0.00 0.01 0.00 0.00 42.46 38.89 3ko5 s ILE 43 CO 0.07 0.28 0.93 -2.28 0.00 0.00 0.00 174.94 173.94 3ko5 s HIS 44 N 1.71 3.49 0.22 3.97 5.65 -1.26 -0.50 115.29 128.57 3ko5 s HIS 44 Ca 0.07 1.30 -0.11 0.00 0.25 0.00 0.00 55.06 56.56 3ko5 s HIS 44 Cb -0.16 -2.67 0.29 0.00 -1.18 0.00 0.00 32.58 28.87 3ko5 s HIS 44 CO 0.09 -0.35 1.65 -0.22 -0.65 0.00 0.00 174.74 175.25 3ko5 h LYS 45 N 0.75 0.08 -0.60 2.88 3.64 -1.21 -2.51 116.57 119.59 3ko5 h LYS 45 Ca -0.46 -0.00 -0.13 0.00 -1.27 0.00 0.00 60.65 58.78 3ko5 h LYS 45 Cb 1.19 -0.02 -0.08 0.00 -0.41 0.00 0.00 32.23 32.91 3ko5 h LYS 45 CO 0.62 0.05 0.14 0.09 -2.27 0.00 0.00 179.45 178.09 3ko5 n ASN 46 N -5.33 4.78 -4.70 4.20 3.02 -1.26 -4.85 115.26 111.12 3ko5 n ASN 46 Ca 0.09 -3.16 -0.42 0.00 -0.03 0.00 0.00 54.58 51.06 3ko5 n ASN 46 Cb 0.36 -0.70 -0.03 0.00 -0.61 0.00 0.00 39.78 38.81 3ko5 n ASN 46 CO 0.00 0.00 0.00 -1.81 -2.62 0.00 0.00 177.26 172.83 3ko5 s ASP 47 N -1.22 6.64 0.58 6.41 1.01 -0.95 -5.02 116.67 124.13 3ko5 s ASP 47 Ca 0.53 2.46 0.09 0.00 0.71 0.00 0.00 52.55 56.34 3ko5 s ASP 47 Cb 0.42 -2.57 0.09 0.00 1.01 0.00 0.00 42.92 41.87 3ko5 s ASP 47 CO 0.13 -0.84 0.78 0.42 0.21 0.00 0.00 175.17 175.86 3ko5 s THR 48 N 2.19 2.04 0.08 -1.27 -4.23 -1.26 -5.00 115.64 108.19 3ko5 s THR 48 Ca 0.71 -1.04 0.28 0.00 -1.18 0.00 0.00 61.69 60.47 3ko5 s THR 48 Cb -0.39 -2.08 0.31 0.00 1.34 0.00 0.00 72.50 71.68 3ko5 s THR 48 CO 0.31 0.00 1.88 -0.25 -0.54 0.00 0.00 174.62 176.02 3ko5 h TRP 49 N 0.19 0.00 -0.05 3.99 2.91 -2.00 -2.69 115.95 118.31 3ko5 h TRP 49 Ca -0.30 0.00 -0.14 0.00 1.13 0.00 0.00 58.89 59.59 3ko5 h TRP 49 Cb 1.29 0.00 -0.01 0.00 -0.51 0.00 0.00 29.16 29.93 3ko5 h TRP 49 CO 0.48 0.11 -0.60 0.93 -1.03 0.00 0.00 178.44 178.33 3ko5 h GLU 50 N 0.00 0.16 -0.34 2.65 3.07 -1.98 -0.54 114.58 117.60 3ko5 h GLU 50 Ca -0.00 -0.11 -0.06 0.00 -0.50 0.00 0.00 59.36 58.69 3ko5 h GLU 50 Cb 0.66 0.02 -0.01 0.00 -0.84 0.00 0.00 28.75 28.57 3ko5 h GLU 50 CO 0.01 0.71 -0.02 -0.44 -1.40 0.00 0.00 179.01 177.87 3ko5 h ASP 51 N 0.12 0.61 -0.65 1.42 3.32 -1.88 -2.43 116.42 116.93 3ko5 h ASP 51 Ca -0.01 -0.32 -0.04 0.00 0.02 0.00 0.00 57.03 56.68 3ko5 h ASP 51 Cb 1.09 -0.16 -0.03 0.00 0.22 0.00 0.00 39.33 40.45 3ko5 h ASP 51 CO 0.09 0.79 0.24 0.00 -1.72 0.00 0.00 179.24 178.63 3ko5 h ALA 52 N 0.84 0.84 -0.57 3.45 0.00 -1.42 -2.58 119.26 119.83 3ko5 h ALA 52 Ca 0.09 -0.19 -0.03 0.00 0.00 0.00 0.00 54.91 54.79 3ko5 h ALA 52 Cb 0.49 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 18.00 3ko5 h ALA 52 CO 0.02 0.48 0.22 -0.07 0.00 0.00 0.00 179.25 179.90 3ko5 h LEU 53 N 0.92 0.75 -0.29 0.00 4.07 -1.07 -1.42 115.31 118.26 3ko5 h LEU 53 Ca 0.21 -0.09 -0.10 0.00 0.08 0.00 0.00 57.88 57.98 3ko5 h LEU 53 Cb 0.24 -0.19 -0.01 0.00 1.08 0.00 0.00 40.66 41.78 3ko5 h LEU 53 CO -0.01 0.68 -0.20 0.22 -1.08 0.00 0.00 178.44 178.04 3ko5 h TYR 54 N 0.81 0.77 -0.10 1.13 3.20 -1.24 -1.41 116.97 120.13 3ko5 h TYR 54 Ca 0.19 -0.21 0.01 0.00 3.14 0.00 0.00 58.73 61.87 3ko5 h TYR 54 Cb 0.16 -0.17 -0.01 0.00 1.54 0.00 0.00 36.73 38.25 3ko5 h TYR 54 CO 0.01 0.92 0.01 0.82 -1.64 0.00 0.00 178.16 178.28 3ko5 h ILE 55 N 0.40 0.95 -0.64 1.81 1.08 -1.30 -1.43 117.51 118.38 3ko5 h ILE 55 Ca 0.06 -0.02 0.03 0.00 -0.39 0.00 0.00 64.86 64.54 3ko5 h ILE 55 Cb 0.75 0.89 -0.04 0.00 -3.07 0.00 0.00 36.82 35.35 3ko5 h ILE 55 CO 0.05 0.01 0.39 0.40 -0.69 0.00 0.00 178.15 178.32 3ko5 h ILE 56 N 0.05 1.07 -0.08 -0.67 2.04 -1.24 -0.05 117.51 118.63 3ko5 h ILE 56 Ca 0.04 -0.26 0.00 0.00 1.00 0.00 0.00 64.86 65.64 3ko5 h ILE 56 Cb 0.04 0.24 -0.01 0.00 -0.74 0.00 0.00 36.82 36.35 3ko5 h ILE 56 CO -0.06 0.14 0.04 -0.09 0.00 0.00 0.00 178.15 178.17 3ko5 h ARG 57 N 0.77 0.09 -0.24 2.37 2.43 -1.08 -2.36 114.38 116.35 3ko5 h ARG 57 Ca 0.26 -0.01 -0.12 0.00 -0.81 0.00 0.00 59.98 59.30 3ko5 h ARG 57 Cb 0.03 -0.02 -0.00 0.00 -0.42 0.00 0.00 29.97 29.56 3ko5 h ARG 57 CO -0.11 0.06 -0.31 0.87 -1.51 0.00 0.00 179.97 178.97 3ko5 h LYS 58 N 0.09 0.64 -0.67 0.20 1.79 -0.96 -1.03 116.57 116.64 3ko5 h LYS 58 Ca 0.03 -0.36 0.06 0.00 -2.18 0.00 0.00 60.65 58.20 3ko5 h LYS 58 Cb 0.00 0.03 -0.06 0.00 -1.58 0.00 0.00 32.23 30.62 3ko5 h LYS 58 CO -0.02 0.97 0.36 0.00 -1.08 0.00 0.00 179.45 179.68 3ko5 h LEU 60 N 0.67 0.00 0.00 0.00 3.38 -1.37 -3.38 115.31 114.61 3ko5 h LEU 60 Ca 0.30 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.27 3ko5 h LEU 60 Cb 0.21 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.96 3ko5 h LEU 60 CO -0.19 0.44 -0.44 0.59 0.09 0.00 0.00 178.44 178.93 3ko5 n ASN 61 N -3.21 0.79 -4.71 -0.43 3.02 -0.40 -3.96 115.26 106.36 3ko5 n ASN 61 Ca 0.02 -0.54 -0.42 0.00 -0.03 0.00 0.00 54.58 53.61 3ko5 n ASN 61 Cb 0.71 1.04 -0.03 0.00 -0.61 0.00 0.00 39.78 40.89 3ko5 n ASN 61 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 3ko5 s LEU 62 N -2.46 4.37 -0.90 3.41 1.43 0.49 -4.70 118.68 120.32 3ko5 s LEU 62 Ca 0.02 2.78 -0.17 0.00 -1.03 0.00 0.00 54.13 55.73 3ko5 s LEU 62 Cb 0.04 -3.59 0.17 0.00 0.03 0.00 0.00 46.19 42.84 3ko5 s LEU 62 CO 0.25 -0.94 0.98 -0.13 0.23 0.00 0.00 176.35 176.74 3ko5 s ARG 63 N 1.44 3.62 0.00 1.70 0.52 -1.26 -4.07 118.95 120.91 3ko5 s ARG 63 Ca 0.75 -2.10 0.15 0.00 -0.52 0.00 0.00 55.73 54.01 3ko5 s ARG 63 Cb -0.47 -4.71 0.02 0.00 0.52 0.00 0.00 34.95 30.31 3ko5 s ARG 63 CO 0.32 -1.56 0.85 1.28 0.02 0.00 0.00 175.30 176.22 3ko5 n LEU 64 N 5.39 1.72 -4.62 2.53 4.77 -0.72 -3.92 117.00 122.15 3ko5 n LEU 64 Ca 0.20 -0.82 -0.33 0.00 -0.03 0.00 0.00 56.01 55.03 3ko5 n LEU 64 Cb 0.48 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.47 3ko5 n LEU 64 CO 0.43 0.32 -0.36 0.26 -1.33 0.00 0.00 177.39 176.71 3ko5 s TRP 65 N -1.69 2.96 0.27 -1.77 0.51 -0.78 -4.81 118.94 113.63 3ko5 s TRP 65 Ca 0.14 0.02 -0.29 0.00 -2.12 0.00 0.00 56.10 53.84 3ko5 s TRP 65 Cb 0.12 -1.66 -0.09 0.00 -0.81 0.00 0.00 33.47 31.03 3ko5 s TRP 65 CO 0.34 0.39 1.04 -0.80 -0.51 0.00 0.00 176.95 177.41 3ko5 s ASN 66 N -1.26 7.37 -1.01 2.95 0.01 -1.26 0.27 114.94 122.02 3ko5 s ASN 66 Ca 0.16 2.16 -0.04 0.00 -0.71 0.00 0.00 52.86 54.43 3ko5 s ASN 66 Cb -0.11 -2.62 0.27 0.00 0.41 0.00 0.00 41.25 39.20 3ko5 s ASN 66 CO 0.06 -0.06 1.12 -3.20 -1.51 0.00 0.00 177.10 173.51 3ko5 n ASN 67 N 1.23 5.32 0.00 -1.22 2.85 0.97 -4.84 115.26 119.57 3ko5 n ASN 67 Ca -0.01 -3.22 0.00 0.00 -0.11 0.00 0.00 54.58 51.23 3ko5 n ASN 67 Cb 0.46 -1.19 0.00 0.00 1.24 0.00 0.00 39.78 40.28 3ko5 n ASN 67 CO 0.00 0.00 0.00 -0.67 -2.11 0.00 0.00 177.26 174.48 3ko5 n ASP 68 N 1.96 0.00 0.11 1.20 4.64 -1.26 -1.88 116.55 121.32 3ko5 n ASP 68 Ca 0.25 0.00 -0.02 0.00 -1.38 0.00 0.00 54.79 53.64 3ko5 n ASP 68 Cb 0.37 0.00 0.04 0.00 -1.04 0.00 0.00 41.12 40.48 3ko5 n ASP 68 CO 0.00 0.00 0.00 -0.55 -0.82 0.00 0.00 177.20 175.83 3ko5 h ASN 69 N 0.00 0.00 -3.24 1.67 -0.00 -2.03 -3.43 115.58 108.54 3ko5 h ASN 69 Ca 0.00 0.00 -0.57 0.00 -0.00 0.00 0.00 56.30 55.73 3ko5 h ASN 69 Cb 0.00 0.00 -0.05 0.00 -0.00 0.00 0.00 38.32 38.27 3ko5 h ASN 69 CO 0.00 0.71 0.55 -0.54 -0.00 0.00 0.00 177.43 178.15 3ko5 s LYS 70 N -3.07 4.35 0.21 4.14 -0.14 -0.79 -5.05 119.74 119.39 3ko5 s LYS 70 Ca 0.01 1.26 -0.08 0.00 -1.36 0.00 0.00 55.97 55.80 3ko5 s LYS 70 Cb 0.10 -3.57 -0.07 0.00 -1.68 0.00 0.00 37.83 32.61 3ko5 s LYS 70 CO 0.77 -0.37 0.51 0.95 -0.76 0.00 0.00 175.35 176.45 3ko5 s THR 71 N 2.25 4.99 -1.30 2.17 -4.23 -1.26 -0.02 115.64 118.23 3ko5 s THR 71 Ca 0.44 0.36 -0.13 0.00 -1.18 0.00 0.00 61.69 61.19 3ko5 s THR 71 Cb -0.17 -3.62 0.01 0.00 1.34 0.00 0.00 72.50 70.05 3ko5 s THR 71 CO 0.14 -0.05 0.54 0.79 -0.54 0.00 0.00 174.62 175.50 3ko5 n TRP 72 N -0.10 -1.64 -0.09 3.99 7.02 -1.25 -4.88 117.44 120.48 3ko5 n TRP 72 Ca -0.00 0.52 -0.14 0.00 -1.02 0.00 0.00 57.50 56.87 3ko5 n TRP 72 Cb 0.52 -3.39 -0.09 0.00 -2.42 0.00 0.00 31.31 25.94 3ko5 n TRP 72 CO 0.00 0.00 0.00 -3.47 -2.02 0.00 0.00 177.69 172.20 3ko5 n ASP 73 N -2.74 2.48 -4.38 -0.99 2.03 0.14 -4.70 116.55 108.40 3ko5 n ASP 73 Ca -0.21 -0.09 -0.31 0.00 0.52 0.00 0.00 54.79 54.70 3ko5 n ASP 73 Cb 0.64 -0.31 -0.15 0.00 -0.72 0.00 0.00 41.12 40.58 3ko5 n ASP 73 CO 0.00 0.00 0.00 -0.54 -1.92 0.00 0.00 177.20 174.74 3ko5 s LYS 74 N -2.38 2.17 0.69 -0.67 -0.14 -0.37 -4.88 119.74 114.15 3ko5 s LYS 74 Ca -0.26 -0.90 -0.01 0.00 -1.36 0.00 0.00 55.97 53.45 3ko5 s LYS 74 Cb 0.07 -2.14 0.14 0.00 -1.68 0.00 0.00 37.83 34.22 3ko5 s LYS 74 CO 0.43 0.57 0.95 0.27 -0.76 0.00 0.00 175.35 176.81 3ko5 n ASN 75 N 2.20 1.23 -0.10 2.83 0.23 -1.26 -1.75 115.26 118.64 3ko5 n ASN 75 Ca -0.16 -2.05 -0.09 0.00 -0.53 0.00 0.00 54.58 51.75 3ko5 n ASN 75 Cb 0.52 -0.62 -0.01 0.00 -2.08 0.00 0.00 39.78 37.58 3ko5 n ASN 75 CO 0.00 0.00 0.00 -0.37 -0.93 0.00 0.00 177.26 175.96 3ko5 h VAL 76 N -0.64 1.11 -0.67 3.53 -1.51 -1.75 -3.00 116.25 113.31 3ko5 h VAL 76 Ca -0.31 -0.26 -0.03 0.00 -1.23 0.00 0.00 66.70 64.86 3ko5 h VAL 76 Cb 1.15 0.70 -0.03 0.00 -2.13 0.00 0.00 31.29 30.97 3ko5 h VAL 76 CO 0.33 0.11 0.29 0.11 -1.23 0.00 0.00 177.57 177.18 3ko5 h LYS 77 N 0.42 0.98 -0.77 5.19 1.57 -1.84 -0.17 116.57 121.95 3ko5 h LYS 77 Ca 0.12 -0.15 0.03 0.00 -1.87 0.00 0.00 60.65 58.78 3ko5 h LYS 77 Cb 0.01 -0.17 -0.04 0.00 0.08 0.00 0.00 32.23 32.10 3ko5 h LYS 77 CO -0.02 0.79 0.51 -0.44 -0.57 0.00 0.00 179.45 179.71 3ko5 h ASP 78 N 0.97 0.83 -0.44 0.86 3.32 -1.87 -2.44 116.42 117.64 3ko5 h ASP 78 Ca 0.23 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.27 3ko5 h ASP 78 Cb 0.16 -0.19 0.00 0.00 0.22 0.00 0.00 39.33 39.52 3ko5 h ASP 78 CO -0.02 0.57 0.00 0.18 -1.72 0.00 0.00 179.24 178.25 3ko5 n LEU 79 N -4.45 3.49 -1.98 1.55 4.77 -1.04 -4.95 117.00 114.39 3ko5 n LEU 79 Ca 0.10 -1.61 -0.19 0.00 -0.03 0.00 0.00 56.01 54.28 3ko5 n LEU 79 Cb 0.11 -0.29 -0.03 0.00 -2.33 0.00 0.00 43.42 40.88 3ko5 n LEU 79 CO 0.35 0.78 -0.23 -3.20 -1.33 0.00 0.00 177.39 173.76 3ko5 n ASN 80 N 1.45 -5.39 -4.69 -1.43 4.05 -0.65 -4.99 115.26 103.61 3ko5 n ASN 80 Ca 0.19 0.09 -0.27 0.00 0.45 0.00 0.00 54.58 55.05 3ko5 n ASN 80 Cb 0.59 -4.47 0.11 0.00 1.23 0.00 0.00 39.78 37.24 3ko5 n ASN 80 CO 0.00 0.00 0.00 -0.31 -3.05 0.00 0.00 177.26 173.90 3ko5 s TYR 81 N -2.88 2.38 0.26 1.20 2.02 -0.17 -5.01 117.35 115.16 3ko5 s TYR 81 Ca 0.00 0.33 0.08 0.00 -0.37 0.00 0.00 57.07 57.10 3ko5 s TYR 81 Cb 0.00 -3.42 -0.04 0.00 -0.40 0.00 0.00 41.96 38.10 3ko5 s TYR 81 CO 0.00 -1.80 0.15 -1.21 -1.57 0.00 0.00 175.55 171.12 3ko5 s GLU 82 N -5.42 2.74 -0.06 -0.62 2.02 -0.85 -4.69 118.70 111.83 3ko5 s GLU 82 Ca 0.65 -1.17 0.04 0.00 0.02 0.00 0.00 54.97 54.51 3ko5 s GLU 82 Cb -0.08 -2.45 -0.00 0.00 0.10 0.00 0.00 34.13 31.70 3ko5 s GLU 82 CO 0.47 0.37 -0.18 -0.51 0.02 0.00 0.00 175.26 175.43 3ko5 s LEU 83 N -3.81 1.91 -0.28 1.80 1.02 0.18 -1.01 118.68 118.49 3ko5 s LEU 83 Ca 0.33 -0.39 -0.04 0.00 0.02 0.00 0.00 54.13 54.06 3ko5 s LEU 83 Cb -0.07 -1.04 0.02 0.00 0.02 0.00 0.00 46.19 45.12 3ko5 s LEU 83 CO 0.24 0.14 0.01 -0.22 0.02 0.00 0.00 176.35 176.54 3ko5 s LEU 84 N 0.16 3.57 -0.32 1.79 2.96 0.42 -0.19 118.68 127.06 3ko5 s LEU 84 Ca -0.07 -0.85 -0.10 0.00 -0.22 0.00 0.00 54.13 52.89 3ko5 s LEU 84 Cb -0.13 -1.77 -0.00 0.00 0.50 0.00 0.00 46.19 44.79 3ko5 s LEU 84 CO 0.03 -0.17 0.17 -0.63 -1.32 0.00 0.00 176.35 174.43 3ko5 s ILE 85 N 1.39 4.67 -0.13 6.68 -1.09 -0.39 -0.55 121.20 131.78 3ko5 s ILE 85 Ca 0.01 -0.45 0.01 0.00 -2.23 0.00 0.00 60.65 57.99 3ko5 s ILE 85 Cb -0.17 -3.41 -0.00 0.00 -1.58 0.00 0.00 42.46 37.29 3ko5 s ILE 85 CO -0.01 0.02 -0.17 -0.69 -1.23 0.00 0.00 174.94 172.86 3ko5 s VAL 86 N 1.62 2.60 0.08 2.92 1.01 -0.25 -4.05 120.40 124.32 3ko5 s VAL 86 Ca 0.04 -0.81 -0.31 0.00 0.00 0.00 0.00 61.98 60.90 3ko5 s VAL 86 Cb -0.17 -2.07 -0.06 0.00 0.00 0.00 0.00 36.38 34.08 3ko5 s VAL 86 CO 0.07 0.53 1.24 -0.55 0.00 0.00 0.00 175.10 176.39 3ko5 s SER 87 N 0.54 7.02 -0.38 3.32 0.15 -1.26 0.18 113.70 123.27 3ko5 s SER 87 Ca -0.11 2.11 0.01 0.00 0.70 0.00 0.00 55.95 58.66 3ko5 s SER 87 Cb -0.16 -2.58 0.14 0.00 -1.71 0.00 0.00 66.02 61.71 3ko5 s SER 87 CO 0.04 -0.50 0.23 -1.10 1.20 0.00 0.00 173.24 173.10 3ko5 s GLN 88 N 0.96 0.74 0.55 5.44 -1.52 0.15 -4.81 119.66 121.17 3ko5 s GLN 88 Ca 0.60 -1.54 0.31 0.00 -1.95 0.00 0.00 55.36 52.77 3ko5 s GLN 88 Cb -0.31 -1.54 1.58 0.00 -0.22 0.00 0.00 33.01 32.51 3ko5 s GLN 88 CO 0.30 -1.21 2.10 0.27 -0.25 0.00 0.00 175.29 176.50 3ko5 h PHE 89 N 6.84 0.00 0.00 0.91 -5.15 -1.95 -2.83 116.94 114.76 3ko5 h PHE 89 Ca 0.06 0.00 0.00 0.00 -0.20 0.00 0.00 57.97 57.83 3ko5 h PHE 89 Cb 0.95 0.00 0.00 0.00 0.22 0.00 0.00 35.95 37.12 3ko5 h PHE 89 CO 0.44 0.09 0.00 1.79 -2.00 0.00 0.00 178.31 178.62 3ko5 h THR 90 N 0.00 0.00 0.00 0.88 1.35 -1.95 -0.25 112.91 112.95 3ko5 h THR 90 Ca -0.00 -0.09 -0.01 0.00 -0.55 0.00 0.00 66.41 65.76 3ko5 h THR 90 Cb 0.31 0.70 -0.00 0.00 -1.73 0.00 0.00 68.15 67.42 3ko5 h THR 90 CO 0.01 0.00 -0.05 -0.07 -0.25 0.00 0.00 175.52 175.16 3ko5 h LEU 91 N 0.00 0.00 -3.11 3.87 3.38 -1.90 -0.71 115.31 116.84 3ko5 h LEU 91 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3ko5 h LEU 91 Cb 0.13 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.88 3ko5 h LEU 91 CO 0.00 0.05 0.00 0.49 0.09 0.00 0.00 178.44 179.07 3ko5 n PHE 92 N -3.30 1.67 -1.93 1.13 3.72 -0.10 -4.93 117.46 113.72 3ko5 n PHE 92 Ca -0.01 -0.61 -0.42 0.00 -0.05 0.00 0.00 57.45 56.36 3ko5 n PHE 92 Cb 0.23 -0.38 -0.03 0.00 -0.94 0.00 0.00 39.48 38.36 3ko5 n PHE 92 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 176.76 176.91 3ko5 s GLY 93 N -0.75 0.67 -0.25 1.37 0.00 -0.28 -4.49 107.32 103.60 3ko5 s GLY 93 Ca 0.48 0.26 -0.29 0.00 0.00 0.00 0.00 44.72 45.16 3ko5 s GLY 93 CO 0.17 3.38 1.31 0.21 0.00 0.00 0.00 173.10 178.18 3ko5 s ASN 94 N 6.74 6.74 -0.09 1.64 2.47 0.78 -4.86 114.94 128.36 3ko5 s ASN 94 Ca 0.82 1.41 0.13 0.00 0.42 0.00 0.00 52.86 55.65 3ko5 s ASN 94 Cb -0.23 -2.54 0.40 0.00 -1.45 0.00 0.00 41.25 37.43 3ko5 s ASN 94 CO 0.33 -0.98 1.32 0.35 -3.72 0.00 0.00 177.10 174.39 3ko5 n THR 95 N 5.93 1.68 0.11 -5.21 -2.24 -1.26 -2.79 114.28 110.50 3ko5 n THR 95 Ca 0.15 -1.49 -0.23 0.00 -2.27 0.00 0.00 64.05 60.21 3ko5 n THR 95 Cb 0.46 0.09 -0.15 0.00 -2.10 0.00 0.00 70.33 68.64 3ko5 n THR 95 CO 0.00 0.00 0.00 0.11 -0.57 0.00 0.00 175.07 174.61 3ko5 h LYS 96 N 1.73 0.52 0.17 -0.78 1.57 -1.95 -3.39 116.57 114.43 3ko5 h LYS 96 Ca 0.00 -0.80 -0.01 0.00 -1.87 0.00 0.00 60.65 57.97 3ko5 h LYS 96 Cb 1.09 0.29 0.00 0.00 0.08 0.00 0.00 32.23 33.68 3ko5 h LYS 96 CO 0.11 1.37 -0.08 -0.22 -0.57 0.00 0.00 179.45 180.06 3ko5 h LYS 97 N 0.07 -0.22 0.00 3.15 1.63 -1.93 -3.49 116.57 115.78 3ko5 h LYS 97 Ca -0.21 0.02 0.00 0.00 -0.85 0.00 0.00 60.65 59.61 3ko5 h LYS 97 Cb 1.96 0.05 0.00 0.00 -0.60 0.00 0.00 32.23 33.64 3ko5 h LYS 97 CO 0.24 0.20 0.00 0.41 -3.45 0.00 0.00 179.45 176.84 3ko5 n GLY 98 N 0.40 4.86 0.64 5.01 0.00 -1.26 -5.05 105.19 109.79 3ko5 n GLY 98 Ca -0.08 -0.86 0.06 0.00 0.00 0.00 0.00 46.02 45.14 3ko5 n GLY 98 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3ko5 n ASN 99 N 0.00 2.72 -4.38 1.61 3.02 -1.26 -4.81 115.26 112.15 3ko5 n ASN 99 Ca 0.00 -1.85 -0.40 0.00 -0.03 0.00 0.00 54.58 52.30 3ko5 n ASN 99 Cb 0.00 -0.18 -0.11 0.00 -0.61 0.00 0.00 39.78 38.88 3ko5 n ASN 99 CO 0.00 0.00 0.00 -0.75 -2.62 0.00 0.00 177.26 173.89 3ko5 s LYS 100 N -1.01 2.93 0.19 3.52 2.20 -1.26 -5.08 119.74 121.23 3ko5 s LYS 100 Ca 0.22 -1.00 -0.30 0.00 -0.36 0.00 0.00 55.97 54.53 3ko5 s LYS 100 Cb 0.12 -3.66 -0.08 0.00 -1.51 0.00 0.00 37.83 32.70 3ko5 s LYS 100 CO 0.17 -0.63 1.16 -2.14 -0.36 0.00 0.00 175.35 173.55 3ko5 s PRO 101 N 1.55 4.53 0.07 4.03 0.02 -1.26 -4.91 135.00 139.03 3ko5 s PRO 101 Ca 0.02 1.82 0.03 0.00 0.02 0.00 0.00 61.00 62.89 3ko5 s PRO 101 Cb -0.19 -3.25 -0.04 0.00 0.02 0.00 0.00 34.50 31.05 3ko5 s PRO 101 CO 0.06 -0.01 0.07 0.16 -0.33 0.00 0.00 177.00 176.95 3ko5 s ASP 102 N -0.04 5.49 -0.33 2.53 1.47 -1.12 -4.86 116.67 119.81 3ko5 s ASP 102 Ca 0.51 -0.01 0.09 0.00 1.18 0.00 0.00 52.55 54.32 3ko5 s ASP 102 Cb -0.32 -1.47 0.45 0.00 -0.34 0.00 0.00 42.92 41.25 3ko5 s ASP 102 CO 0.37 0.19 1.14 0.49 0.68 0.00 0.00 175.17 178.04 3ko5 n PHE 103 N 0.59 2.70 1.12 2.11 3.72 -1.26 -0.16 117.46 126.29 3ko5 n PHE 103 Ca -0.09 -2.52 0.12 0.00 -0.05 0.00 0.00 57.45 54.91 3ko5 n PHE 103 Cb 0.52 -0.25 0.61 0.00 -0.94 0.00 0.00 39.48 39.41 3ko5 n PHE 103 CO 0.00 0.00 0.00 0.72 -0.05 0.00 0.00 176.76 177.43 3ko5 n HIS 104 N -0.59 0.00 0.32 1.38 8.25 -1.26 -3.24 115.22 120.07 3ko5 n HIS 104 Ca 0.37 0.00 0.11 0.00 -0.26 0.00 0.00 57.72 57.93 3ko5 n HIS 104 Cb 0.85 -0.31 -0.15 0.00 1.12 0.00 0.00 29.99 31.51 3ko5 n HIS 104 CO 0.00 0.00 0.00 -0.11 0.64 0.00 0.00 176.34 176.87 3ko5 n LEU 105 N -1.31 0.33 -4.80 2.41 7.94 -1.26 -4.94 117.00 115.37 3ko5 n LEU 105 Ca 0.11 -0.15 -0.34 0.00 -1.11 0.00 0.00 56.01 54.52 3ko5 n LEU 105 Cb 0.20 -0.00 -0.05 0.00 0.53 0.00 0.00 43.42 44.10 3ko5 n LEU 105 CO 0.19 0.08 0.69 0.00 -1.11 0.00 0.00 177.39 177.24 3ko5 s ALA 106 N -3.35 2.95 0.48 1.96 0.00 -1.20 -0.90 121.76 121.71 3ko5 s ALA 106 Ca -0.03 0.54 -0.22 0.00 0.00 0.00 0.00 51.96 52.25 3ko5 s ALA 106 Cb 0.15 -3.22 -0.07 0.00 0.00 0.00 0.00 23.12 19.98 3ko5 s ALA 106 CO 0.89 -0.14 1.21 0.21 0.00 0.00 0.00 175.76 177.93 3ko5 s LYS 107 N -3.15 3.59 0.24 0.00 2.20 0.34 -4.32 119.74 118.64 3ko5 s LYS 107 Ca 0.65 1.87 -0.31 0.00 -0.36 0.00 0.00 55.97 57.82 3ko5 s LYS 107 Cb -0.14 -2.35 -0.11 0.00 -1.51 0.00 0.00 37.83 33.72 3ko5 s LYS 107 CO 0.18 -0.72 1.57 -2.00 -0.36 0.00 0.00 175.35 174.01 3ko5 s GLU 108 N -2.78 4.18 0.10 4.03 -6.30 -1.26 -4.72 118.70 111.96 3ko5 s GLU 108 Ca 0.66 2.46 -0.13 0.00 -2.50 0.00 0.00 54.97 55.46 3ko5 s GLU 108 Cb -0.31 -3.08 0.05 0.00 0.00 0.00 0.00 34.13 30.78 3ko5 s GLU 108 CO 0.37 -0.59 0.80 -2.30 0.02 0.00 0.00 175.26 173.57 3ko5 n PRO 109 N 2.91 -0.17 -0.01 4.30 -0.02 -1.26 -0.77 135.00 139.97 3ko5 n PRO 109 Ca 0.10 0.79 -0.07 0.00 -2.02 0.00 0.00 63.50 62.30 3ko5 n PRO 109 Cb 0.38 -1.17 0.10 0.00 -0.02 0.00 0.00 33.50 32.80 3ko5 n PRO 109 CO 0.00 0.00 0.00 -0.91 1.98 0.00 0.00 175.50 176.57 3ko5 h ASN 110 N 0.00 0.61 1.06 2.55 4.21 -2.00 -1.25 115.58 120.75 3ko5 h ASN 110 Ca 0.13 -0.27 -0.18 0.00 1.21 0.00 0.00 56.30 57.20 3ko5 h ASN 110 Cb 0.26 -0.17 -0.03 0.00 -1.12 0.00 0.00 38.32 37.26 3ko5 h ASN 110 CO -0.50 0.94 -0.98 -0.08 -1.29 0.00 0.00 177.43 175.51 3ko5 h GLU 111 N 0.48 0.00 -0.53 0.81 4.81 -1.76 -3.25 114.58 115.14 3ko5 h GLU 111 Ca 0.04 0.00 -0.08 0.00 -0.13 0.00 0.00 59.36 59.19 3ko5 h GLU 111 Cb 0.89 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 30.25 3ko5 h GLU 111 CO 0.08 0.63 0.01 0.00 -0.73 0.00 0.00 179.01 179.00 3ko5 h ALA 112 N 1.25 1.02 -0.12 2.92 0.00 -0.76 -2.10 119.26 121.48 3ko5 h ALA 112 Ca -0.07 -0.28 -0.00 0.00 0.00 0.00 0.00 54.91 54.56 3ko5 h ALA 112 Cb 1.63 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 19.21 3ko5 h ALA 112 CO 0.09 0.61 0.06 1.25 0.00 0.00 0.00 179.25 181.25 3ko5 h LEU 113 N 0.82 0.15 -0.27 0.00 5.85 -1.27 0.19 115.31 120.78 3ko5 h LEU 113 Ca 0.16 -0.11 0.05 0.00 0.84 0.00 0.00 57.88 58.81 3ko5 h LEU 113 Cb 0.48 -0.04 -0.05 0.00 0.37 0.00 0.00 40.66 41.42 3ko5 h LEU 113 CO 0.02 0.22 -0.04 0.40 -0.34 0.00 0.00 178.44 178.70 3ko5 h ILE 114 N 0.07 0.75 -0.53 4.05 1.08 -1.58 -0.32 117.51 121.03 3ko5 h ILE 114 Ca 0.04 -0.01 -0.06 0.00 -0.39 0.00 0.00 64.86 64.44 3ko5 h ILE 114 Cb 0.11 0.72 -0.02 0.00 -3.07 0.00 0.00 36.82 34.56 3ko5 h ILE 114 CO -0.01 0.01 0.07 0.15 -0.69 0.00 0.00 178.15 177.68 3ko5 h PHE 115 N 0.03 0.89 -0.41 1.37 3.04 -1.21 -2.00 116.94 118.65 3ko5 h PHE 115 Ca 0.13 -0.11 -0.04 0.00 3.98 0.00 0.00 57.97 61.93 3ko5 h PHE 115 Cb 0.19 -0.25 -0.02 0.00 2.56 0.00 0.00 35.95 38.43 3ko5 h PHE 115 CO -0.25 0.78 0.09 -0.92 -2.02 0.00 0.00 178.31 176.00 3ko5 h TYR 116 N 0.81 0.69 -0.39 0.41 5.03 -0.18 -2.43 116.97 120.91 3ko5 h TYR 116 Ca 0.17 -0.08 -0.08 0.00 2.58 0.00 0.00 58.73 61.31 3ko5 h TYR 116 Cb 0.39 -0.19 -0.02 0.00 1.55 0.00 0.00 36.73 38.45 3ko5 h TYR 116 CO 0.02 0.66 -0.11 -0.91 -1.32 0.00 0.00 178.16 176.50 3ko5 h ASN 117 N 0.52 0.66 -0.72 -2.11 2.35 -0.83 -1.50 115.58 113.95 3ko5 h ASN 117 Ca 0.13 -0.19 0.01 0.00 -0.55 0.00 0.00 56.30 55.70 3ko5 h ASN 117 Cb 0.32 -0.18 -0.04 0.00 0.05 0.00 0.00 38.32 38.48 3ko5 h ASN 117 CO 0.00 0.80 0.47 0.11 -1.65 0.00 0.00 177.43 177.17 3ko5 h LYS 118 N 0.62 0.92 -0.62 0.81 1.57 -1.31 -1.22 116.57 117.34 3ko5 h LYS 118 Ca 0.11 -0.06 -0.02 0.00 -1.87 0.00 0.00 60.65 58.81 3ko5 h LYS 118 Cb 0.55 -0.21 -0.03 0.00 0.08 0.00 0.00 32.23 32.62 3ko5 h LYS 118 CO 0.03 0.61 0.31 0.82 -0.57 0.00 0.00 179.45 180.65 3ko5 h ILE 119 N 0.95 1.21 -0.54 1.86 2.04 -0.92 -1.89 117.51 120.21 3ko5 h ILE 119 Ca 0.27 -0.58 -0.07 0.00 1.00 0.00 0.00 64.86 65.48 3ko5 h ILE 119 Cb -0.08 0.46 -0.02 0.00 -0.74 0.00 0.00 36.82 36.44 3ko5 h ILE 119 CO -0.07 0.24 0.08 0.40 0.00 0.00 0.00 178.15 178.80 3ko5 h ILE 120 N 0.85 1.25 -0.73 -0.67 1.08 -0.98 0.03 117.51 118.34 3ko5 h ILE 120 Ca 0.21 -0.97 0.02 0.00 -0.39 0.00 0.00 64.86 63.74 3ko5 h ILE 120 Cb 0.10 0.83 -0.04 0.00 -3.07 0.00 0.00 36.82 34.64 3ko5 h ILE 120 CO -0.03 0.35 0.47 0.44 -0.69 0.00 0.00 178.15 178.69 3ko5 h ASP 121 N 0.79 0.78 0.16 1.72 3.32 -1.12 -2.30 116.42 119.78 3ko5 h ASP 121 Ca 0.16 -0.01 -0.16 0.00 0.02 0.00 0.00 57.03 57.05 3ko5 h ASP 121 Cb 0.42 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 39.78 3ko5 h ASP 121 CO 0.01 0.55 -0.58 -0.08 -1.72 0.00 0.00 179.24 177.42 3ko5 h GLU 122 N 0.93 0.43 -0.70 3.56 4.57 -1.05 -1.02 114.58 121.30 3ko5 h GLU 122 Ca 0.28 -0.28 0.04 0.00 -1.18 0.00 0.00 59.36 58.21 3ko5 h GLU 122 Cb -0.03 0.04 -0.05 0.00 -0.16 0.00 0.00 28.75 28.55 3ko5 h GLU 122 CO -0.09 0.89 0.43 0.74 -1.18 0.00 0.00 179.01 179.80 3ko5 h PHE 123 N 0.32 0.80 -0.12 0.92 0.04 -0.81 0.17 116.94 118.26 3ko5 h PHE 123 Ca -0.00 0.02 -0.19 0.00 2.80 0.00 0.00 57.97 60.60 3ko5 h PHE 123 Cb 1.11 -0.26 -0.00 0.00 2.20 0.00 0.00 35.95 39.00 3ko5 h PHE 123 CO 0.04 0.44 -0.72 0.87 -0.60 0.00 0.00 178.31 178.34 3ko5 h LYS 124 N 0.83 0.56 -0.15 1.51 1.57 -1.26 -1.99 116.57 117.64 3ko5 h LYS 124 Ca 0.29 -0.44 -0.01 0.00 -1.87 0.00 0.00 60.65 58.62 3ko5 h LYS 124 Cb 0.06 0.09 -0.01 0.00 0.08 0.00 0.00 32.23 32.45 3ko5 h LYS 124 CO -0.12 1.07 0.07 -0.22 -0.57 0.00 0.00 179.45 179.67 3ko5 h LYS 125 N 0.39 0.21 0.00 3.15 3.64 -0.96 -2.73 116.57 120.28 3ko5 h LYS 125 Ca -0.03 -0.03 -0.04 0.00 -1.27 0.00 0.00 60.65 59.28 3ko5 h LYS 125 Cb 1.30 -0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 33.08 3ko5 h LYS 125 CO 0.13 0.26 -0.19 1.96 -2.27 0.00 0.00 179.45 179.34 3ko5 h GLN 126 N 0.12 0.00 0.00 1.90 4.20 -0.97 -3.44 115.11 116.91 3ko5 h GLN 126 Ca 0.05 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.76 3ko5 h GLN 126 Cb 0.11 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.89 3ko5 h GLN 126 CO -0.01 0.19 0.00 0.98 -0.67 0.00 0.00 178.83 179.32 3ko5 n TYR 127 N -3.28 0.00 -3.70 2.96 9.36 -0.75 -5.09 117.16 116.66 3ko5 n TYR 127 Ca 0.01 0.00 -0.12 0.00 3.32 0.00 0.00 57.90 61.11 3ko5 n TYR 127 Cb 0.45 0.00 -0.10 0.00 -0.63 0.00 0.00 39.34 39.07 3ko5 n TYR 127 CO 0.00 0.00 0.00 1.21 0.22 0.00 0.00 176.86 178.29 3ko5 s ASN 128 N 1.00 -0.54 0.43 2.98 2.47 -1.04 -4.96 114.94 115.27 3ko5 s ASN 128 Ca 0.00 1.00 0.15 0.00 0.42 0.00 0.00 52.86 54.43 3ko5 s ASN 128 Cb 0.00 0.96 0.94 0.00 -1.45 0.00 0.00 41.25 41.70 3ko5 s ASN 128 CO 0.00 -0.18 1.94 -2.24 -3.72 0.00 0.00 177.10 172.90 3ko5 h ASP 129 N 5.98 0.00 0.93 -4.21 3.04 -1.92 -2.37 116.42 117.87 3ko5 h ASP 129 Ca -0.30 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.49 3ko5 h ASP 129 Cb 1.18 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 39.47 3ko5 h ASP 129 CO 0.22 0.25 -0.47 -0.90 -2.04 0.00 0.00 179.24 176.31 3ko5 n ASP 130 N -4.16 0.65 -0.06 4.15 5.75 -1.26 -3.87 116.55 117.75 3ko5 n ASP 130 Ca -0.02 0.17 0.12 0.00 -0.01 0.00 0.00 54.79 55.05 3ko5 n ASP 130 Cb 0.31 -0.03 0.27 0.00 -1.03 0.00 0.00 41.12 40.64 3ko5 n ASP 130 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 3ko5 n LYS 131 N -2.02 0.20 -4.04 0.11 4.76 -0.90 -4.81 118.16 111.46 3ko5 n LYS 131 Ca 0.04 -0.12 -0.35 0.00 -2.87 0.00 0.00 58.31 55.01 3ko5 n LYS 131 Cb 0.42 -1.50 -0.13 0.00 -1.84 0.00 0.00 35.03 31.98 3ko5 n LYS 131 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 3ko5 s ILE 132 N -2.88 3.89 0.18 -0.18 -1.09 -1.20 -0.65 121.20 119.27 3ko5 s ILE 132 Ca 0.14 -0.33 0.11 0.00 -2.23 0.00 0.00 60.65 58.34 3ko5 s ILE 132 Cb 0.18 -2.76 -0.04 0.00 -1.58 0.00 0.00 42.46 38.25 3ko5 s ILE 132 CO 0.66 0.42 -0.24 -0.54 -1.23 0.00 0.00 174.94 174.01 3ko5 s LYS 133 N 1.09 1.51 0.34 2.79 -0.14 0.73 -4.99 119.74 121.08 3ko5 s LYS 133 Ca 0.02 -1.47 0.03 0.00 -1.36 0.00 0.00 55.97 53.20 3ko5 s LYS 133 Cb -0.14 -1.87 -0.05 0.00 -1.68 0.00 0.00 37.83 34.08 3ko5 s LYS 133 CO 0.01 0.42 0.09 0.96 -0.76 0.00 0.00 175.35 176.07 3ko5 s ILE 134 N -1.51 0.87 0.00 2.17 -4.36 -1.26 -1.26 121.20 115.85 3ko5 s ILE 134 Ca 0.19 -2.00 0.00 0.00 -0.26 0.00 0.00 60.65 58.58 3ko5 s ILE 134 Cb -0.09 -2.61 0.00 0.00 1.25 0.00 0.00 42.46 41.02 3ko5 s ILE 134 CO 0.09 0.00 0.00 0.61 0.24 0.00 0.00 174.94 175.88 3ko5 n GLY 135 N -0.73 3.05 3.05 6.27 0.00 -1.26 -4.72 105.19 110.86 3ko5 n GLY 135 Ca -0.03 -1.71 -0.32 0.00 0.00 0.00 0.00 46.02 43.96 3ko5 n GLY 135 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3ko5 s LYS 136 N 4.88 1.81 0.25 1.61 -0.14 -1.26 -5.10 119.74 121.79 3ko5 s LYS 136 Ca 0.00 -1.68 -0.30 0.00 -1.36 0.00 0.00 55.97 52.63 3ko5 s LYS 136 Cb 0.00 -3.15 -0.14 0.00 -1.68 0.00 0.00 37.83 32.86 3ko5 s LYS 136 CO 0.00 -0.82 1.19 0.34 -0.76 0.00 0.00 175.35 175.29 3ko5 n PHE 137 N 4.36 1.61 0.00 3.18 7.35 -1.26 -1.55 117.46 131.15 3ko5 n PHE 137 Ca -0.03 0.61 0.00 0.00 -0.76 0.00 0.00 57.45 57.27 3ko5 n PHE 137 Cb 0.42 -2.33 0.00 0.00 0.35 0.00 0.00 39.48 37.92 3ko5 n PHE 137 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 3ko5 n GLY 138 N 1.65 2.94 3.92 7.13 0.00 -1.26 -4.99 105.19 114.58 3ko5 n GLY 138 Ca 0.11 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.87 3ko5 n GLY 138 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3ko5 s ASN 139 N -2.53 6.23 0.30 1.61 0.01 -0.60 -5.08 114.94 114.89 3ko5 s ASN 139 Ca 0.00 0.13 -0.30 0.00 -0.71 0.00 0.00 52.86 51.99 3ko5 s ASN 139 Cb 0.00 -1.85 -0.11 0.00 0.41 0.00 0.00 41.25 39.70 3ko5 s ASN 139 CO 0.00 0.06 1.53 -0.47 -1.51 0.00 0.00 177.10 176.71 3ko5 s TYR 140 N -1.73 2.79 0.01 2.20 5.04 -1.26 -4.86 117.35 119.53 3ko5 s TYR 140 Ca 0.34 0.93 0.04 0.00 -2.44 0.00 0.00 57.07 55.94 3ko5 s TYR 140 Cb -0.11 -3.99 -0.01 0.00 0.35 0.00 0.00 41.96 38.20 3ko5 s TYR 140 CO 0.28 -3.20 -0.11 -1.64 -1.34 0.00 0.00 175.55 169.53 3ko5 s MET 141 N -0.83 0.84 -0.29 4.97 -1.94 -1.26 -4.43 119.30 116.36 3ko5 s MET 141 Ca 0.60 -0.49 -0.10 0.00 -1.71 0.00 0.00 55.69 53.99 3ko5 s MET 141 Cb -0.46 -0.81 -0.04 0.00 2.01 0.00 0.00 34.83 35.53 3ko5 s MET 141 CO 0.50 0.21 0.17 1.21 -0.01 0.00 0.00 175.02 177.10 3ko5 s ASN 142 N -0.55 5.78 -0.27 3.03 2.47 0.29 -4.97 114.94 120.72 3ko5 s ASN 142 Ca 0.03 -0.17 0.03 0.00 0.42 0.00 0.00 52.86 53.16 3ko5 s ASN 142 Cb -0.05 -2.07 0.07 0.00 -1.45 0.00 0.00 41.25 37.75 3ko5 s ASN 142 CO 0.00 -0.09 -0.06 -0.63 -3.72 0.00 0.00 177.10 172.60 3ko5 s ILE 143 N 1.71 2.00 -0.52 -5.21 1.01 -1.26 -0.66 121.20 118.27 3ko5 s ILE 143 Ca 0.06 -1.67 -0.29 0.00 0.00 0.00 0.00 60.65 58.75 3ko5 s ILE 143 Cb -0.16 -2.23 0.03 0.00 0.01 0.00 0.00 42.46 40.11 3ko5 s ILE 143 CO 0.09 -0.18 1.18 -1.81 0.00 0.00 0.00 174.94 174.22 3ko5 s ASP 144 N 1.15 6.52 -0.20 3.58 1.11 -0.03 -4.89 116.67 123.91 3ko5 s ASP 144 Ca -0.04 0.32 -0.03 0.00 0.18 0.00 0.00 52.55 52.98 3ko5 s ASP 144 Cb -0.19 -2.55 -0.01 0.00 1.07 0.00 0.00 42.92 41.24 3ko5 s ASP 144 CO -0.06 -1.38 -0.07 -0.69 1.18 0.00 0.00 175.17 174.15 3ko5 s VAL 145 N 4.78 3.25 -0.87 -1.27 1.01 -1.26 -0.04 120.40 125.99 3ko5 s VAL 145 Ca 0.47 -0.55 -0.18 0.00 0.00 0.00 0.00 61.98 61.71 3ko5 s VAL 145 Cb -0.08 -2.45 0.14 0.00 0.00 0.00 0.00 36.38 33.99 3ko5 s VAL 145 CO 0.29 0.46 1.04 -0.89 0.00 0.00 0.00 175.10 176.00 3ko5 s THR 146 N 1.17 4.81 0.14 3.92 2.01 -0.09 -5.01 115.64 122.59 3ko5 s THR 146 Ca 0.02 -1.56 -0.31 0.00 0.31 0.00 0.00 61.69 60.15 3ko5 s THR 146 Cb -0.14 -4.71 -0.09 0.00 0.01 0.00 0.00 72.50 67.56 3ko5 s THR 146 CO -0.02 -1.42 1.46 0.20 -0.69 0.00 0.00 174.62 174.15 3ko5 s ASN 147 N 3.45 6.73 -0.61 3.53 0.01 -1.26 -1.00 114.94 125.79 3ko5 s ASN 147 Ca 0.29 2.45 -0.09 0.00 -0.71 0.00 0.00 52.86 54.79 3ko5 s ASN 147 Cb -0.08 -2.59 0.16 0.00 0.41 0.00 0.00 41.25 39.15 3ko5 s ASN 147 CO -0.07 -0.72 0.49 -0.62 -1.51 0.00 0.00 177.10 174.67 3ko5 s ASP 148 N 1.11 5.89 0.00 -1.22 2.15 0.83 -4.67 116.67 120.75 3ko5 s ASP 148 Ca 0.67 -2.35 0.00 0.00 0.43 0.00 0.00 52.55 51.30 3ko5 s ASP 148 Cb -0.40 -2.03 0.00 0.00 -0.30 0.00 0.00 42.92 40.19 3ko5 s ASP 148 CO 0.31 -0.59 0.00 0.61 -0.17 0.00 0.00 175.17 175.33 3ko5 n GLY 149 N 4.33 2.53 3.81 2.66 0.00 -1.26 -3.13 105.19 114.14 3ko5 n GLY 149 Ca 0.01 -0.59 -0.30 0.00 0.00 0.00 0.00 46.02 45.14 3ko5 n GLY 149 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3ko5 s PRO 150 N 0.00 2.27 -0.15 1.61 0.04 -1.26 -5.16 135.00 132.35 3ko5 s PRO 150 Ca 0.00 0.65 -0.00 0.00 0.04 0.00 0.00 61.00 61.69 3ko5 s PRO 150 Cb 0.00 -1.94 0.03 0.00 0.04 0.00 0.00 34.50 32.63 3ko5 s PRO 150 CO 0.00 -1.50 -0.10 0.08 0.04 0.00 0.00 177.00 175.53 3ko5 s VAL 151 N -3.17 1.30 -0.14 -0.36 1.01 -1.18 -5.03 120.40 112.83 3ko5 s VAL 151 Ca 0.60 -0.56 0.01 0.00 0.00 0.00 0.00 61.98 62.02 3ko5 s VAL 151 Cb -0.14 -1.32 0.02 0.00 0.00 0.00 0.00 36.38 34.94 3ko5 s VAL 151 CO 0.54 0.32 -0.14 -0.89 0.00 0.00 0.00 175.10 174.93 3ko5 s THR 152 N 1.58 1.54 -0.07 3.92 2.01 -1.26 -1.53 115.64 121.84 3ko5 s THR 152 Ca 0.03 -0.63 0.02 0.00 0.31 0.00 0.00 61.69 61.43 3ko5 s THR 152 Cb -0.14 -1.44 -0.02 0.00 0.01 0.00 0.00 72.50 70.91 3ko5 s THR 152 CO -0.09 0.45 -0.12 -0.63 -0.69 0.00 0.00 174.62 173.54 3ko5 s ILE 153 N 1.38 3.20 -0.07 1.82 -1.09 0.76 -4.95 121.20 122.25 3ko5 s ILE 153 Ca 0.02 -0.66 0.05 0.00 -2.23 0.00 0.00 60.65 57.84 3ko5 s ILE 153 Cb -0.13 -2.28 -0.01 0.00 -1.58 0.00 0.00 42.46 38.46 3ko5 s ILE 153 CO -0.09 0.58 -0.25 -0.47 -1.23 0.00 0.00 174.94 173.49 3ko5 s TYR 154 N -0.53 2.48 -0.03 3.97 6.14 -1.26 -0.13 117.35 127.98 3ko5 s TYR 154 Ca 0.07 -0.83 0.02 0.00 0.64 0.00 0.00 57.07 56.97 3ko5 s TYR 154 Cb -0.12 -1.63 0.01 0.00 0.42 0.00 0.00 41.96 40.64 3ko5 s TYR 154 CO 0.02 -0.28 -0.06 0.42 0.64 0.00 0.00 175.55 176.28 3ko5 s ILE 155 N -0.00 0.58 -0.26 3.14 1.01 -0.69 -5.01 121.20 119.97 3ko5 s ILE 155 Ca -0.08 -0.21 0.00 0.00 0.00 0.00 0.00 60.65 60.36 3ko5 s ILE 155 Cb -0.15 -0.56 0.07 0.00 0.01 0.00 0.00 42.46 41.83 3ko5 s ILE 155 CO 0.05 0.21 0.00 -0.62 0.00 0.00 0.00 174.94 174.59 3ko5 s ASP 156 N 0.51 3.85 0.60 3.58 -1.08 -1.26 -0.78 116.67 122.09 3ko5 s ASP 156 Ca -0.07 -1.33 0.29 0.00 -0.52 0.00 0.00 52.55 50.92 3ko5 s ASP 156 Cb -0.11 -1.08 1.67 0.00 -1.46 0.00 0.00 42.92 41.95 3ko5 s ASP 156 CO 0.00 -0.30 2.09 0.71 0.52 0.00 0.00 175.17 178.19 3ko5 h THR 157 N 6.60 0.42 0.00 1.71 1.35 -1.67 0.15 112.91 121.47 3ko5 h THR 157 Ca -0.15 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.71 3ko5 h THR 157 Cb 1.06 0.82 0.00 0.00 -1.73 0.00 0.00 68.15 68.30 3ko5 h THR 157 CO 0.42 0.00 0.00 1.41 -0.25 0.00 0.00 175.52 177.10 3ko5 n HIS 158 N -3.73 0.00 1.35 4.73 8.25 -1.26 -0.90 115.22 123.67 3ko5 n HIS 158 Ca 0.02 0.00 0.13 0.00 -0.26 0.00 0.00 57.72 57.61 3ko5 n HIS 158 Cb 0.34 -0.46 0.43 0.00 1.12 0.00 0.00 29.99 31.42 3ko5 n HIS 158 CO 0.00 0.00 0.00 -0.25 0.64 0.00 0.00 176.34 176.73 3ko5 n ASP 159 N -1.46 1.31 -0.37 0.41 8.00 0.51 -5.16 116.55 119.78 3ko5 n ASP 159 Ca 0.05 -1.21 0.05 0.00 0.71 0.00 0.00 54.79 54.39 3ko5 n ASP 159 Cb 0.19 0.07 0.04 0.00 -0.02 0.00 0.00 41.12 41.41 3ko5 n ASP 159 CO 0.00 0.00 0.00 -0.38 -0.39 0.00 0.00 177.20 176.43