#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 2.30 -0.03 2.12 0.52 -0.22 -0.89 118.95 122.77 3ko5 s ARG 2 Ca 0.00 -0.86 0.03 0.00 -0.52 0.00 0.00 55.73 54.38 3ko5 s ARG 2 Cb 0.00 -2.02 0.00 0.00 0.52 0.00 0.00 34.95 33.45 3ko5 s ARG 2 CO 0.00 0.41 -0.10 0.54 0.02 0.00 0.00 175.30 176.17 3ko5 s VAL 3 N -0.25 0.85 -0.27 3.52 0.11 -0.00 0.50 120.40 124.86 3ko5 s VAL 3 Ca -0.00 -0.41 -0.09 0.00 -2.93 0.00 0.00 61.98 58.56 3ko5 s VAL 3 Cb -0.12 -0.75 -0.03 0.00 -1.53 0.00 0.00 36.38 33.94 3ko5 s VAL 3 CO 0.02 0.26 0.12 -0.69 -3.33 0.00 0.00 175.10 171.48 3ko5 s VAL 4 N 0.12 4.63 -0.16 2.04 1.01 -0.17 -1.25 120.40 126.62 3ko5 s VAL 4 Ca -0.02 -0.12 -0.04 0.00 0.00 0.00 0.00 61.98 61.80 3ko5 s VAL 4 Cb -0.08 -3.21 -0.03 0.00 0.00 0.00 0.00 36.38 33.06 3ko5 s VAL 4 CO 0.01 0.27 -0.03 -0.63 0.00 0.00 0.00 175.10 174.71 3ko5 s ILE 5 N 1.65 3.86 -0.06 2.22 1.01 0.55 -0.45 121.20 129.99 3ko5 s ILE 5 Ca 0.06 -0.36 0.04 0.00 0.00 0.00 0.00 60.65 60.39 3ko5 s ILE 5 Cb -0.16 -2.70 0.00 0.00 0.01 0.00 0.00 42.46 39.61 3ko5 s ILE 5 CO 0.06 0.48 -0.17 -1.10 0.00 0.00 0.00 174.94 174.21 3ko5 s GLN 6 N 0.51 2.00 -0.01 2.79 -0.21 -0.02 -0.73 119.66 123.99 3ko5 s GLN 6 Ca -0.03 -0.61 -0.27 0.00 0.02 0.00 0.00 55.36 54.46 3ko5 s GLN 6 Cb -0.14 -1.66 -0.04 0.00 1.00 0.00 0.00 33.01 32.17 3ko5 s GLN 6 CO 0.03 0.18 0.85 0.50 -2.12 0.00 0.00 175.29 174.73 3ko5 s ARG 7 N 0.24 4.52 0.09 2.91 3.52 -0.58 -1.34 118.95 128.31 3ko5 s ARG 7 Ca -0.09 1.19 0.04 0.00 -0.13 0.00 0.00 55.73 56.74 3ko5 s ARG 7 Cb -0.14 -3.44 -0.03 0.00 -1.56 0.00 0.00 34.95 29.78 3ko5 s ARG 7 CO 0.04 0.05 -0.10 0.14 -0.81 0.00 0.00 175.30 174.62 3ko5 s VAL 8 N 0.73 0.91 -0.27 7.11 -7.23 -0.13 -0.99 120.40 120.53 3ko5 s VAL 8 Ca 0.45 -1.54 0.23 0.00 -1.81 0.00 0.00 61.98 59.30 3ko5 s VAL 8 Cb -0.20 -1.24 -0.07 0.00 0.56 0.00 0.00 36.38 35.43 3ko5 s VAL 8 CO 0.24 -0.50 0.97 0.29 -0.31 0.00 0.00 175.10 175.78 3ko5 n LYS 9 N 0.74 0.56 -3.60 4.82 5.02 -0.67 -1.74 118.16 123.29 3ko5 n LYS 9 Ca -0.17 0.05 -0.05 0.00 -2.02 0.00 0.00 58.31 56.12 3ko5 n LYS 9 Cb 0.57 -1.74 -0.03 0.00 -0.02 0.00 0.00 35.03 33.81 3ko5 n LYS 9 CO 0.00 0.00 0.00 0.20 -0.52 0.00 0.00 177.40 177.08 3ko5 s GLY 10 N -4.26 -0.21 -0.20 0.72 0.00 -1.18 -2.16 107.32 100.02 3ko5 s GLY 10 Ca -0.01 1.92 -0.13 0.00 0.00 0.00 0.00 44.72 46.51 3ko5 s GLY 10 CO 0.81 0.73 0.51 0.00 0.00 0.00 0.00 173.10 175.15 3ko5 s ALA 11 N -1.92 -1.32 -0.18 3.20 0.00 -0.64 -0.43 121.76 120.47 3ko5 s ALA 11 Ca 0.07 1.76 0.01 0.00 0.00 0.00 0.00 51.96 53.80 3ko5 s ALA 11 Cb -0.01 -1.05 0.04 0.00 0.00 0.00 0.00 23.12 22.09 3ko5 s ALA 11 CO -0.05 -0.29 -0.11 0.42 0.00 0.00 0.00 175.76 175.73 3ko5 s ILE 12 N 1.27 1.60 -0.22 0.00 1.01 -0.06 -1.08 121.20 123.72 3ko5 s ILE 12 Ca -0.08 -0.86 -0.07 0.00 0.00 0.00 0.00 60.65 59.64 3ko5 s ILE 12 Cb -0.07 -1.62 -0.03 0.00 0.01 0.00 0.00 42.46 40.76 3ko5 s ILE 12 CO -0.12 0.27 0.04 -0.22 0.00 0.00 0.00 174.94 174.91 3ko5 s LEU 13 N 1.44 3.46 0.19 2.97 0.20 0.58 -1.28 118.68 126.23 3ko5 s LEU 13 Ca 0.01 -0.14 0.08 0.00 0.69 0.00 0.00 54.13 54.77 3ko5 s LEU 13 Cb -0.15 -1.90 -0.04 0.00 -0.43 0.00 0.00 46.19 43.67 3ko5 s LEU 13 CO -0.09 0.05 -0.16 -0.94 -0.29 0.00 0.00 176.35 174.91 3ko5 s SER 14 N 1.12 2.63 0.25 3.68 1.04 0.46 -1.19 113.70 121.69 3ko5 s SER 14 Ca 0.04 -0.94 0.05 0.00 0.48 0.00 0.00 55.95 55.57 3ko5 s SER 14 Cb -0.14 -0.15 -0.05 0.00 0.10 0.00 0.00 66.02 65.77 3ko5 s SER 14 CO 0.03 -0.10 -0.02 0.68 0.98 0.00 0.00 173.24 174.80 3ko5 s VAL 15 N -2.51 1.26 0.77 5.02 -7.23 -0.44 -0.55 120.40 116.72 3ko5 s VAL 15 Ca 0.19 -2.06 -0.11 0.00 -1.81 0.00 0.00 61.98 58.19 3ko5 s VAL 15 Cb -0.03 -2.40 0.05 0.00 0.56 0.00 0.00 36.38 34.56 3ko5 s VAL 15 CO 0.07 -0.31 1.09 -0.13 -0.31 0.00 0.00 175.10 175.51 3ko5 s ARG 16 N -3.81 2.33 -0.73 4.82 0.52 -1.26 0.58 118.95 121.40 3ko5 s ARG 16 Ca 0.29 0.71 -0.02 0.00 -0.52 0.00 0.00 55.73 56.19 3ko5 s ARG 16 Cb 0.05 -1.94 -0.02 0.00 0.52 0.00 0.00 34.95 33.56 3ko5 s ARG 16 CO 0.10 -1.46 0.67 1.63 0.02 0.00 0.00 175.30 176.26 3ko5 n LYS 17 N -3.34 -1.41 0.00 3.54 4.76 -1.26 -4.68 118.16 115.78 3ko5 n LYS 17 Ca 0.07 1.18 0.00 0.00 -2.87 0.00 0.00 58.31 56.69 3ko5 n LYS 17 Cb 0.56 -5.25 0.00 0.00 -1.84 0.00 0.00 35.03 28.50 3ko5 n LYS 17 CO 0.00 0.00 0.00 -1.91 -1.37 0.00 0.00 177.40 174.12 3ko5 n GLU 26 N -2.09 0.36 -4.74 1.97 2.13 -1.26 -4.56 120.64 112.45 3ko5 n GLU 26 Ca -0.02 0.00 -0.30 0.00 0.66 0.00 0.00 57.16 57.50 3ko5 n GLU 26 Cb 0.53 -1.15 -0.14 0.00 0.27 0.00 0.00 31.44 30.95 3ko5 n GLU 26 CO 0.00 0.00 0.00 -0.51 -0.41 0.00 0.00 177.13 176.21 3ko5 s LEU 27 N -0.17 2.32 -0.21 4.31 1.43 -1.26 -4.99 118.68 120.11 3ko5 s LEU 27 Ca 0.00 -0.57 0.02 0.00 -1.03 0.00 0.00 54.13 52.54 3ko5 s LEU 27 Cb 0.00 -1.34 0.04 0.00 0.03 0.00 0.00 46.19 44.92 3ko5 s LEU 27 CO 0.00 0.24 -0.14 -0.70 0.23 0.00 0.00 176.35 175.98 3ko5 s GLU 28 N -1.45 2.44 -0.07 1.70 2.12 0.20 -4.93 118.70 118.72 3ko5 s GLU 28 Ca 0.13 -1.01 -0.30 0.00 0.36 0.00 0.00 54.97 54.16 3ko5 s GLU 28 Cb -0.10 -2.63 -0.04 0.00 0.26 0.00 0.00 34.13 31.62 3ko5 s GLU 28 CO 0.04 -0.40 1.41 0.42 -0.54 0.00 0.00 175.26 176.20 3ko5 s ILE 29 N 1.26 3.89 -0.03 -3.70 1.01 -1.26 -1.33 121.20 121.04 3ko5 s ILE 29 Ca -0.02 1.16 0.02 0.00 0.00 0.00 0.00 60.65 61.81 3ko5 s ILE 29 Cb -0.16 -3.75 -0.03 0.00 0.01 0.00 0.00 42.46 38.53 3ko5 s ILE 29 CO -0.09 -0.06 -0.00 2.30 0.00 0.00 0.00 174.94 177.09 3ko5 n ILE 30 N 5.10 0.19 -4.26 2.92 -5.35 -0.33 -4.99 119.36 112.64 3ko5 n ILE 30 Ca 0.14 -0.10 -0.18 0.00 -0.27 0.00 0.00 62.75 62.34 3ko5 n ILE 30 Cb 0.44 -0.85 -0.13 0.00 -1.74 0.00 0.00 39.64 37.36 3ko5 n ILE 30 CO 0.00 0.00 0.00 -0.44 -1.76 0.00 0.00 176.55 174.35 3ko5 s SER 31 N -3.58 1.38 -0.17 7.28 0.01 -1.06 -5.03 113.70 112.52 3ko5 s SER 31 Ca -0.02 -0.44 -0.11 0.00 1.31 0.00 0.00 55.95 56.69 3ko5 s SER 31 Cb 0.01 -0.07 0.06 0.00 0.21 0.00 0.00 66.02 66.22 3ko5 s SER 31 CO 0.10 -0.02 0.43 -0.70 0.41 0.00 0.00 173.24 173.46 3ko5 s GLU 32 N -1.14 0.43 0.13 12.44 2.12 -1.26 -0.31 118.70 131.11 3ko5 s GLU 32 Ca -0.01 0.77 0.07 0.00 0.36 0.00 0.00 54.97 56.16 3ko5 s GLU 32 Cb -0.08 0.04 -0.04 0.00 0.26 0.00 0.00 34.13 34.32 3ko5 s GLU 32 CO 0.01 -0.14 -0.17 0.96 -0.54 0.00 0.00 175.26 175.38 3ko5 s ILE 33 N 1.15 1.57 0.00 -3.70 -4.36 -0.24 -5.00 121.20 110.62 3ko5 s ILE 33 Ca -0.07 -1.69 0.00 0.00 -0.26 0.00 0.00 60.65 58.62 3ko5 s ILE 33 Cb -0.07 -1.59 0.00 0.00 1.25 0.00 0.00 42.46 42.05 3ko5 s ILE 33 CO -0.10 -0.26 0.00 0.29 0.24 0.00 0.00 174.94 175.10 3ko5 n LYS 34 N 0.68 0.58 -1.77 0.37 4.01 -1.26 -1.63 118.16 119.15 3ko5 n LYS 34 Ca -0.16 0.00 -0.40 0.00 -0.51 0.00 0.00 58.31 57.23 3ko5 n LYS 34 Cb 0.56 0.00 0.01 0.00 -0.51 0.00 0.00 35.03 35.09 3ko5 n LYS 34 CO 0.00 0.00 0.00 0.09 -1.11 0.00 0.00 177.40 176.38 3ko5 n ASN 35 N 0.00 3.49 0.00 4.39 3.02 -0.92 -3.13 115.26 122.12 3ko5 n ASN 35 Ca 0.00 1.16 0.00 0.00 -0.03 0.00 0.00 54.58 55.71 3ko5 n ASN 35 Cb 0.00 -1.61 0.00 0.00 -0.61 0.00 0.00 39.78 37.56 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 0.53 -0.26 2.99 7.41 0.00 -0.71 -1.78 105.19 113.38 3ko5 n GLY 36 Ca 0.04 -0.61 -0.21 0.00 0.00 0.00 0.00 46.02 45.24 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 1.72 -0.15 0.99 1.43 -0.40 -0.95 118.68 121.31 3ko5 s LEU 37 Ca 0.00 -0.20 -0.15 0.00 -1.03 0.00 0.00 54.13 52.75 3ko5 s LEU 37 Cb 0.00 -0.58 -0.04 0.00 0.03 0.00 0.00 46.19 45.59 3ko5 s LEU 37 CO 0.00 0.05 0.35 -0.51 0.23 0.00 0.00 176.35 176.47 3ko5 s ILE 38 N 0.33 5.27 -0.28 -0.59 2.07 -0.45 -0.41 121.20 127.14 3ko5 s ILE 38 Ca -0.06 0.67 0.03 0.00 -1.41 0.00 0.00 60.65 59.89 3ko5 s ILE 38 Cb -0.10 -3.69 0.07 0.00 0.13 0.00 0.00 42.46 38.87 3ko5 s ILE 38 CO 0.01 0.36 -0.06 0.00 -1.91 0.00 0.00 174.94 173.34 3ko5 s PHE 40 N 1.06 2.96 -0.24 0.00 0.08 0.40 -0.51 117.98 121.73 3ko5 s PHE 40 Ca -0.03 0.37 -0.05 0.00 0.12 0.00 0.00 56.93 57.35 3ko5 s PHE 40 Cb -0.20 -3.84 -0.00 0.00 -0.57 0.00 0.00 43.02 38.41 3ko5 s PHE 40 CO -0.06 -1.03 -0.00 -1.17 -0.10 0.00 0.00 175.22 172.86 3ko5 s LEU 41 N 3.58 3.19 -0.20 -0.37 2.96 0.12 -1.00 118.68 126.96 3ko5 s LEU 41 Ca 0.35 -0.47 -0.08 0.00 -0.22 0.00 0.00 54.13 53.71 3ko5 s LEU 41 Cb -0.11 -1.79 -0.04 0.00 0.50 0.00 0.00 46.19 44.76 3ko5 s LEU 41 CO 0.24 -0.07 0.07 -0.83 -1.32 0.00 0.00 176.35 174.45 3ko5 s GLY 42 N 1.49 1.89 -0.25 7.98 0.00 0.18 0.11 107.32 118.71 3ko5 s GLY 42 Ca 0.05 -0.82 -0.10 0.00 0.00 0.00 0.00 44.72 43.85 3ko5 s GLY 42 CO -0.01 0.16 0.15 -0.42 0.00 0.00 0.00 173.10 172.97 3ko5 s ILE 43 N 0.62 5.09 0.45 0.90 1.01 -1.26 -1.05 121.20 126.96 3ko5 s ILE 43 Ca 0.04 0.09 -0.17 0.00 0.00 0.00 0.00 60.65 60.60 3ko5 s ILE 43 Cb -0.13 -3.39 -0.09 0.00 0.01 0.00 0.00 42.46 38.86 3ko5 s ILE 43 CO 0.01 0.31 0.92 -2.28 0.00 0.00 0.00 174.94 173.91 3ko5 s HIS 44 N 1.40 3.40 0.29 3.97 5.65 -1.26 -1.08 115.29 127.66 3ko5 s HIS 44 Ca 0.07 1.43 0.04 0.00 0.25 0.00 0.00 55.06 56.85 3ko5 s HIS 44 Cb -0.15 -2.74 0.75 0.00 -1.18 0.00 0.00 32.58 29.26 3ko5 s HIS 44 CO 0.07 -0.20 1.68 0.87 -0.65 0.00 0.00 174.74 176.50 3ko5 h LYS 45 N 1.42 0.33 -0.48 2.88 1.57 -1.23 -2.71 116.57 118.35 3ko5 h LYS 45 Ca -0.48 -0.02 -0.13 0.00 -1.87 0.00 0.00 60.65 58.16 3ko5 h LYS 45 Cb 1.18 -0.07 -0.08 0.00 0.08 0.00 0.00 32.23 33.34 3ko5 h LYS 45 CO 0.62 0.22 0.10 0.09 -0.57 0.00 0.00 179.45 179.90 3ko5 n ASN 46 N -5.09 3.98 -4.71 0.86 3.02 -1.26 -4.87 115.26 107.18 3ko5 n ASN 46 Ca 0.22 -3.27 -0.42 0.00 -0.03 0.00 0.00 54.58 51.08 3ko5 n ASN 46 Cb 0.68 -0.65 -0.03 0.00 -0.61 0.00 0.00 39.78 39.18 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 -1.70 6.88 0.59 6.41 1.01 -1.02 -5.04 116.67 123.80 3ko5 s ASP 47 Ca 0.48 2.22 0.08 0.00 0.71 0.00 0.00 52.55 56.04 3ko5 s ASP 47 Cb 0.40 -2.58 0.09 0.00 1.01 0.00 0.00 42.92 41.84 3ko5 s ASP 47 CO 0.09 -0.63 0.81 0.42 0.21 0.00 0.00 175.17 176.07 3ko5 s THR 48 N 1.33 2.20 0.35 -1.27 -4.23 -1.26 -4.99 115.64 107.77 3ko5 s THR 48 Ca 0.63 -0.93 0.16 0.00 -1.18 0.00 0.00 61.69 60.37 3ko5 s THR 48 Cb -0.34 -2.26 0.13 0.00 1.34 0.00 0.00 72.50 71.37 3ko5 s THR 48 CO 0.29 0.00 1.86 -0.25 -0.54 0.00 0.00 174.62 175.98 3ko5 h TRP 49 N 0.09 0.00 0.00 3.99 -0.00 -2.00 -2.15 115.95 115.89 3ko5 h TRP 49 Ca -0.31 0.00 -0.02 0.00 -0.00 0.00 0.00 58.89 58.55 3ko5 h TRP 49 Cb 1.28 0.00 -0.00 0.00 -0.00 0.00 0.00 29.16 30.44 3ko5 h TRP 49 CO 0.33 0.32 -0.10 0.93 -0.00 0.00 0.00 178.44 179.92 3ko5 h GLU 50 N 0.00 0.00 -0.14 2.65 4.39 -1.95 0.14 114.58 119.67 3ko5 h GLU 50 Ca -0.00 0.00 -0.08 0.00 0.34 0.00 0.00 59.36 59.62 3ko5 h GLU 50 Cb 0.62 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 29.27 3ko5 h GLU 50 CO 0.04 0.10 -0.22 -0.44 -1.16 0.00 0.00 179.01 177.33 3ko5 h ASP 51 N 0.00 0.43 -0.24 1.42 3.32 -1.69 -2.64 116.42 117.02 3ko5 h ASP 51 Ca -0.00 -0.53 -0.00 0.00 0.02 0.00 0.00 57.03 56.51 3ko5 h ASP 51 Cb 0.18 -0.12 -0.01 0.00 0.22 0.00 0.00 39.33 39.60 3ko5 h ASP 51 CO 0.01 0.88 0.14 0.00 -1.72 0.00 0.00 179.24 178.56 3ko5 h ALA 52 N 0.56 0.30 -0.78 3.45 0.00 -1.32 -2.79 119.26 118.67 3ko5 h ALA 52 Ca 0.01 -0.05 0.01 0.00 0.00 0.00 0.00 54.91 54.89 3ko5 h ALA 52 Cb 0.80 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 18.45 3ko5 h ALA 52 CO 0.05 -0.19 0.52 -0.07 0.00 0.00 0.00 179.25 179.56 3ko5 h LEU 53 N 0.29 0.89 -0.30 0.00 3.38 -0.79 -1.38 115.31 117.40 3ko5 h LEU 53 Ca 0.09 -0.02 -0.06 0.00 0.09 0.00 0.00 57.88 57.97 3ko5 h LEU 53 Cb 0.03 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.55 3ko5 h LEU 53 CO -0.02 0.64 -0.05 0.22 0.09 0.00 0.00 178.44 179.32 3ko5 h TYR 54 N 1.04 0.62 0.15 1.13 3.20 -1.37 -0.82 116.97 120.93 3ko5 h TYR 54 Ca 0.29 -0.13 0.01 0.00 3.14 0.00 0.00 58.73 62.05 3ko5 h TYR 54 Cb -0.09 -0.16 -0.03 0.00 1.54 0.00 0.00 36.73 38.00 3ko5 h TYR 54 CO -0.00 0.73 -0.22 0.82 -1.64 0.00 0.00 178.16 177.85 3ko5 h ILE 55 N 0.34 0.50 -0.48 1.81 1.08 -1.21 -1.27 117.51 118.28 3ko5 h ILE 55 Ca 0.08 0.00 0.07 0.00 -0.39 0.00 0.00 64.86 64.62 3ko5 h ILE 55 Cb 0.51 0.50 -0.06 0.00 -3.07 0.00 0.00 36.82 34.71 3ko5 h ILE 55 CO 0.02 0.00 0.14 0.40 -0.69 0.00 0.00 178.15 178.03 3ko5 h ILE 56 N -0.44 0.80 -0.45 -0.67 2.04 -1.23 0.18 117.51 117.73 3ko5 h ILE 56 Ca 0.02 -0.10 0.02 0.00 1.00 0.00 0.00 64.86 65.79 3ko5 h ILE 56 Cb 0.44 0.47 -0.03 0.00 -0.74 0.00 0.00 36.82 36.97 3ko5 h ILE 56 CO -0.10 0.05 0.28 -0.09 0.00 0.00 0.00 178.15 178.29 3ko5 h ARG 57 N 0.30 0.54 -0.44 2.37 2.43 -0.97 -1.35 114.38 117.26 3ko5 h ARG 57 Ca 0.23 -0.03 -0.14 0.00 -0.81 0.00 0.00 59.98 59.23 3ko5 h ARG 57 Cb 0.27 -0.12 -0.01 0.00 -0.42 0.00 0.00 29.97 29.69 3ko5 h ARG 57 CO -0.26 0.36 -0.29 0.87 -1.51 0.00 0.00 179.97 179.14 3ko5 h LYS 58 N 0.56 0.97 -0.67 0.20 1.79 -0.83 -1.12 116.57 117.46 3ko5 h LYS 58 Ca 0.18 -0.46 -0.02 0.00 -2.18 0.00 0.00 60.65 58.17 3ko5 h LYS 58 Cb -0.00 -0.01 -0.03 0.00 -1.58 0.00 0.00 32.23 30.61 3ko5 h LYS 58 CO -0.07 1.12 0.34 0.00 -1.08 0.00 0.00 179.45 179.76 3ko5 h LEU 60 N 0.93 0.00 0.00 0.00 3.38 -1.20 -3.40 115.31 115.02 3ko5 h LEU 60 Ca 0.23 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.20 3ko5 h LEU 60 Cb 0.09 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.84 3ko5 h LEU 60 CO -0.03 0.31 -0.84 0.59 0.09 0.00 0.00 178.44 178.56 3ko5 n ASN 61 N -3.15 2.63 -4.68 -0.43 3.02 -0.43 -4.01 115.26 108.21 3ko5 n ASN 61 Ca 0.02 -0.22 -0.45 0.00 -0.03 0.00 0.00 54.58 53.90 3ko5 n ASN 61 Cb 0.66 1.13 -0.04 0.00 -0.61 0.00 0.00 39.78 40.92 3ko5 n ASN 61 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 3ko5 n LEU 62 N -1.45 3.32 -4.45 3.41 4.77 -0.06 -4.63 117.00 117.91 3ko5 n LEU 62 Ca -0.00 1.07 -0.44 0.00 -0.03 0.00 0.00 56.01 56.61 3ko5 n LEU 62 Cb 0.10 -1.46 -0.01 0.00 -2.33 0.00 0.00 43.42 39.72 3ko5 n LEU 62 CO 0.09 -0.17 1.12 -0.13 -1.33 0.00 0.00 177.39 176.97 3ko5 s ARG 63 N 1.20 3.84 0.00 3.23 0.52 -1.26 -4.14 118.95 122.34 3ko5 s ARG 63 Ca 0.79 -2.22 0.22 0.00 -0.52 0.00 0.00 55.73 54.01 3ko5 s ARG 63 Cb -0.64 -4.94 0.37 0.00 0.52 0.00 0.00 34.95 30.26 3ko5 s ARG 63 CO 0.37 -1.72 1.34 1.28 0.02 0.00 0.00 175.30 176.60 3ko5 n LEU 64 N 5.86 3.31 -4.35 2.53 4.77 -0.86 -3.65 117.00 124.61 3ko5 n LEU 64 Ca 0.29 -1.42 -0.31 0.00 -0.03 0.00 0.00 56.01 54.54 3ko5 n LEU 64 Cb 0.46 -0.20 -0.15 0.00 -2.33 0.00 0.00 43.42 41.20 3ko5 n LEU 64 CO 0.54 0.69 -0.55 0.26 -1.33 0.00 0.00 177.39 177.01 3ko5 s TRP 65 N -1.51 2.40 0.27 -1.77 0.51 -0.94 -4.88 118.94 113.03 3ko5 s TRP 65 Ca 0.35 -0.38 -0.24 0.00 -2.12 0.00 0.00 56.10 53.71 3ko5 s TRP 65 Cb 0.21 -1.51 -0.09 0.00 -0.81 0.00 0.00 33.47 31.27 3ko5 s TRP 65 CO 0.30 0.04 0.86 -0.80 -0.51 0.00 0.00 176.95 176.84 3ko5 s ASN 66 N -0.76 7.28 -0.12 2.95 -0.87 -1.26 -0.59 114.94 121.58 3ko5 s ASN 66 Ca 0.11 1.70 -0.00 0.00 -1.57 0.00 0.00 52.86 53.10 3ko5 s ASN 66 Cb -0.10 -2.53 0.02 0.00 -0.02 0.00 0.00 41.25 38.63 3ko5 s ASN 66 CO -0.00 0.00 -0.09 0.21 -2.57 0.00 0.00 177.10 174.65 3ko5 s ASN 67 N -1.56 2.26 0.00 -1.22 3.84 0.72 -4.88 114.94 114.10 3ko5 s ASN 67 Ca 0.46 -0.34 0.00 0.00 0.21 0.00 0.00 52.86 53.19 3ko5 s ASN 67 Cb -0.19 -0.91 0.00 0.00 -0.55 0.00 0.00 41.25 39.60 3ko5 s ASN 67 CO 0.24 -0.09 0.00 -0.90 -2.79 0.00 0.00 177.10 173.56 3ko5 n ASP 68 N 4.80 0.00 0.00 -4.21 5.75 -1.26 -0.60 116.55 121.03 3ko5 n ASP 68 Ca -0.14 0.00 0.00 0.00 -0.01 0.00 0.00 54.79 54.64 3ko5 n ASP 68 Cb 0.50 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.59 3ko5 n ASP 68 CO 0.00 0.00 0.00 0.59 -0.11 0.00 0.00 177.20 177.68 3ko5 n ASN 69 N 0.26 0.00 -4.42 -1.12 4.13 -1.26 -4.98 115.26 107.87 3ko5 n ASN 69 Ca 0.00 0.00 -0.33 0.00 1.68 0.00 0.00 54.58 55.93 3ko5 n ASN 69 Cb 0.00 0.00 -0.14 0.00 -1.54 0.00 0.00 39.78 38.10 3ko5 n ASN 69 CO 0.00 0.00 0.00 -0.54 0.28 0.00 0.00 177.26 177.00 3ko5 s LYS 70 N -0.32 3.28 0.12 3.52 1.02 0.23 -5.12 119.74 122.46 3ko5 s LYS 70 Ca 0.00 -0.65 0.03 0.00 0.02 0.00 0.00 55.97 55.37 3ko5 s LYS 70 Cb 0.00 -2.65 -0.04 0.00 -0.52 0.00 0.00 37.83 34.63 3ko5 s LYS 70 CO 0.00 0.31 0.19 0.95 -0.92 0.00 0.00 175.35 175.87 3ko5 s THR 71 N 0.12 4.96 -1.29 2.17 -4.23 -1.26 -0.20 115.64 115.92 3ko5 s THR 71 Ca -0.05 -0.74 -0.11 0.00 -1.18 0.00 0.00 61.69 59.62 3ko5 s THR 71 Cb -0.15 -3.48 -0.00 0.00 1.34 0.00 0.00 72.50 70.21 3ko5 s THR 71 CO 0.04 0.00 0.58 0.79 -0.54 0.00 0.00 174.62 175.50 3ko5 n TRP 72 N -0.09 -1.73 -0.03 3.99 7.02 -1.24 -4.90 117.44 120.44 3ko5 n TRP 72 Ca -0.07 0.58 -0.05 0.00 -1.02 0.00 0.00 57.50 56.95 3ko5 n TRP 72 Cb 0.53 -3.57 -0.03 0.00 -2.42 0.00 0.00 31.31 25.82 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 -2.81 3.48 -4.51 -0.99 2.03 0.24 -4.71 116.55 109.28 3ko5 n ASP 73 Ca -0.21 -0.04 -0.33 0.00 0.52 0.00 0.00 54.79 54.73 3ko5 n ASP 73 Cb 0.64 -0.09 -0.12 0.00 -0.72 0.00 0.00 41.12 40.83 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 -2.13 2.73 0.67 -0.67 -0.14 -0.34 -4.86 119.74 115.00 3ko5 s LYS 74 Ca -0.09 -0.62 -0.01 0.00 -1.36 0.00 0.00 55.97 53.88 3ko5 s LYS 74 Cb 0.02 -2.51 0.13 0.00 -1.68 0.00 0.00 37.83 33.80 3ko5 s LYS 74 CO 0.16 0.59 0.92 0.27 -0.76 0.00 0.00 175.35 176.52 3ko5 n ASN 75 N 2.43 1.12 -0.26 2.83 0.23 -1.26 -2.03 115.26 118.32 3ko5 n ASN 75 Ca -0.18 -1.97 -0.01 0.00 -0.53 0.00 0.00 54.58 51.90 3ko5 n ASN 75 Cb 0.53 -0.60 0.20 0.00 -2.08 0.00 0.00 39.78 37.82 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 -0.67 1.22 -0.15 3.53 -1.51 -1.76 -3.01 116.25 113.90 3ko5 h VAL 76 Ca -0.30 -0.43 -0.11 0.00 -1.23 0.00 0.00 66.70 64.63 3ko5 h VAL 76 Cb 1.09 0.04 0.00 0.00 -2.13 0.00 0.00 31.29 30.29 3ko5 h VAL 76 CO 0.31 0.22 -0.34 0.11 -1.23 0.00 0.00 177.57 176.64 3ko5 h LYS 77 N 1.11 0.49 -0.82 5.19 1.57 -1.85 0.11 116.57 122.36 3ko5 h LYS 77 Ca 0.29 -0.33 0.20 0.00 -1.87 0.00 0.00 60.65 58.94 3ko5 h LYS 77 Cb -0.09 0.05 -0.05 0.00 0.08 0.00 0.00 32.23 32.21 3ko5 h LYS 77 CO -0.06 0.95 0.56 -0.44 -0.57 0.00 0.00 179.45 179.88 3ko5 h ASP 78 N 0.11 0.28 -0.38 0.86 3.32 -1.87 -0.16 116.42 118.58 3ko5 h ASP 78 Ca -0.00 0.03 0.00 0.00 0.02 0.00 0.00 57.03 57.07 3ko5 h ASP 78 Cb 0.95 -0.03 0.00 0.00 0.22 0.00 0.00 39.33 40.47 3ko5 h ASP 78 CO 0.08 0.12 0.00 0.18 -1.72 0.00 0.00 179.24 177.90 3ko5 n LEU 79 N -4.44 3.36 -3.58 1.55 4.77 -1.18 -4.96 117.00 112.51 3ko5 n LEU 79 Ca 0.17 -1.55 -0.26 0.00 -0.03 0.00 0.00 56.01 54.34 3ko5 n LEU 79 Cb 0.70 -0.25 0.04 0.00 -2.33 0.00 0.00 43.42 41.58 3ko5 n LEU 79 CO 0.33 0.74 0.12 -3.20 -1.33 0.00 0.00 177.39 174.05 3ko5 n ASN 80 N 1.36 -5.51 -4.59 -1.43 4.05 -0.07 -4.99 115.26 104.07 3ko5 n ASN 80 Ca 0.18 -0.56 -0.25 0.00 0.45 0.00 0.00 54.58 54.40 3ko5 n ASN 80 Cb 0.57 -4.40 0.12 0.00 1.23 0.00 0.00 39.78 37.30 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 -3.24 1.73 0.33 1.20 2.02 0.34 -5.03 117.35 114.70 3ko5 s TYR 81 Ca 0.55 -0.09 0.09 0.00 -0.37 0.00 0.00 57.07 57.24 3ko5 s TYR 81 Cb -0.26 -3.23 -0.04 0.00 -0.40 0.00 0.00 41.96 38.02 3ko5 s TYR 81 CO 0.67 -1.85 0.09 -1.21 -1.57 0.00 0.00 175.55 171.68 3ko5 s GLU 82 N -5.29 2.30 -0.04 -0.62 2.02 -0.73 -4.74 118.70 111.59 3ko5 s GLU 82 Ca 0.67 -1.56 0.02 0.00 0.02 0.00 0.00 54.97 54.12 3ko5 s GLU 82 Cb -0.06 -2.12 0.01 0.00 0.10 0.00 0.00 34.13 32.06 3ko5 s GLU 82 CO 0.46 0.17 -0.09 -0.51 0.02 0.00 0.00 175.26 175.30 3ko5 s LEU 83 N -3.78 1.67 -0.30 1.80 1.02 -0.35 -1.28 118.68 117.45 3ko5 s LEU 83 Ca 0.36 -0.21 -0.07 0.00 0.02 0.00 0.00 54.13 54.22 3ko5 s LEU 83 Cb -0.03 -0.63 0.01 0.00 0.02 0.00 0.00 46.19 45.56 3ko5 s LEU 83 CO 0.21 0.04 0.10 -0.22 0.02 0.00 0.00 176.35 176.50 3ko5 s LEU 84 N 0.45 3.95 -0.26 1.79 2.96 0.45 0.02 118.68 128.04 3ko5 s LEU 84 Ca -0.08 -0.70 -0.09 0.00 -0.22 0.00 0.00 54.13 53.04 3ko5 s LEU 84 Cb -0.12 -1.91 -0.04 0.00 0.50 0.00 0.00 46.19 44.62 3ko5 s LEU 84 CO 0.01 -0.20 0.13 -0.63 -1.32 0.00 0.00 176.35 174.34 3ko5 s ILE 85 N 1.52 4.82 -0.16 6.68 -1.09 -0.27 0.21 121.20 132.91 3ko5 s ILE 85 Ca 0.03 0.00 -0.00 0.00 -2.23 0.00 0.00 60.65 58.45 3ko5 s ILE 85 Cb -0.17 -3.27 0.04 0.00 -1.58 0.00 0.00 42.46 37.47 3ko5 s ILE 85 CO 0.03 0.31 -0.06 -0.69 -1.23 0.00 0.00 174.94 173.30 3ko5 s VAL 86 N 1.59 1.17 0.14 2.92 1.01 0.33 -3.49 120.40 124.07 3ko5 s VAL 86 Ca 0.06 -0.62 -0.31 0.00 0.00 0.00 0.00 61.98 61.11 3ko5 s VAL 86 Cb -0.15 -1.30 -0.11 0.00 0.00 0.00 0.00 36.38 34.82 3ko5 s VAL 86 CO 0.07 0.18 1.78 -0.55 0.00 0.00 0.00 175.10 176.58 3ko5 s SER 87 N 1.62 6.43 -0.43 3.32 0.15 -1.26 0.12 113.70 123.64 3ko5 s SER 87 Ca 0.01 2.76 0.04 0.00 0.70 0.00 0.00 55.95 59.47 3ko5 s SER 87 Cb -0.15 -2.57 0.17 0.00 -1.71 0.00 0.00 66.02 61.76 3ko5 s SER 87 CO -0.08 -0.98 0.36 1.67 1.20 0.00 0.00 173.24 175.41 3ko5 n GLN 88 N 5.21 0.32 0.31 5.44 -0.06 0.12 -4.80 117.38 123.92 3ko5 n GLN 88 Ca 0.17 -3.26 0.19 0.00 -2.00 0.00 0.00 57.00 52.10 3ko5 n GLN 88 Cb 0.38 -1.69 1.03 0.00 -4.06 0.00 0.00 30.24 25.89 3ko5 n GLN 88 CO 0.00 0.00 0.00 0.27 -0.20 0.00 0.00 177.06 177.13 3ko5 h PHE 89 N 5.53 0.00 0.00 3.69 -5.15 -1.93 -2.43 116.94 116.65 3ko5 h PHE 89 Ca 0.25 0.00 0.00 0.00 -0.20 0.00 0.00 57.97 58.02 3ko5 h PHE 89 Cb 0.90 0.00 0.00 0.00 0.22 0.00 0.00 35.95 37.07 3ko5 h PHE 89 CO 0.29 0.02 0.00 0.25 -2.00 0.00 0.00 178.31 176.87 3ko5 n THR 90 N -3.31 0.97 0.30 0.88 -2.24 -1.26 -1.83 114.28 107.78 3ko5 n THR 90 Ca -0.02 0.39 0.18 0.00 -2.27 0.00 0.00 64.05 62.33 3ko5 n THR 90 Cb 0.13 -1.32 0.94 0.00 -2.10 0.00 0.00 70.33 67.97 3ko5 n THR 90 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 3ko5 h LEU 91 N 0.00 0.00 -2.74 3.22 3.38 -1.84 0.13 115.31 117.46 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 0.23 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.98 3ko5 h LEU 91 CO 0.00 0.03 0.00 0.49 0.09 0.00 0.00 178.44 179.05 3ko5 n PHE 92 N -3.27 1.33 -1.65 1.13 3.72 -0.76 -4.90 117.46 113.06 3ko5 n PHE 92 Ca -0.02 -0.52 -0.40 0.00 -0.05 0.00 0.00 57.45 56.47 3ko5 n PHE 92 Cb 0.18 -0.25 -0.03 0.00 -0.94 0.00 0.00 39.48 38.43 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 -0.79 0.16 -0.19 1.37 0.00 0.03 -4.36 107.32 103.53 3ko5 s GLY 93 Ca 0.43 0.36 -0.22 0.00 0.00 0.00 0.00 44.72 45.29 3ko5 s GLY 93 CO 0.19 3.86 0.68 0.21 0.00 0.00 0.00 173.10 178.05 3ko5 s ASN 94 N 9.56 6.76 -0.05 1.64 3.84 0.22 -4.78 114.94 132.14 3ko5 s ASN 94 Ca 0.96 0.93 0.08 0.00 0.21 0.00 0.00 52.86 55.03 3ko5 s ASN 94 Cb -0.25 -2.38 0.12 0.00 -0.55 0.00 0.00 41.25 38.19 3ko5 s ASN 94 CO 0.31 -0.30 1.00 0.35 -2.79 0.00 0.00 177.10 175.66 3ko5 n THR 95 N 4.68 1.09 -0.11 -5.21 -2.24 -1.26 -0.86 114.28 110.37 3ko5 n THR 95 Ca 0.00 -1.24 -0.07 0.00 -2.27 0.00 0.00 64.05 60.46 3ko5 n THR 95 Cb 0.49 0.26 0.09 0.00 -2.10 0.00 0.00 70.33 69.08 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 0.00 0.82 0.02 -0.78 1.57 -1.96 -3.33 116.57 112.92 3ko5 h LYS 96 Ca 0.00 -0.30 -0.00 0.00 -1.87 0.00 0.00 60.65 58.48 3ko5 h LYS 96 Cb 0.89 -0.05 0.00 0.00 0.08 0.00 0.00 32.23 33.15 3ko5 h LYS 96 CO 0.00 0.93 -0.01 0.87 -0.57 0.00 0.00 179.45 180.66 3ko5 h LYS 97 N 0.73 -0.03 0.00 3.15 6.56 -1.95 -3.50 116.57 121.53 3ko5 h LYS 97 Ca 0.11 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.71 3ko5 h LYS 97 Cb 0.66 0.01 0.00 0.00 -0.57 0.00 0.00 32.23 32.33 3ko5 h LYS 97 CO 0.05 0.61 0.00 0.41 -2.06 0.00 0.00 179.45 178.46 3ko5 n GLY 98 N 1.44 3.92 0.10 3.86 0.00 -1.25 -5.07 105.19 108.19 3ko5 n GLY 98 Ca -0.07 -1.29 0.00 0.00 0.00 0.00 0.00 46.02 44.66 3ko5 n GLY 98 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 3ko5 h ASN 99 N 0.00 0.00 -3.37 1.61 2.35 -1.96 -3.43 115.58 110.77 3ko5 h ASN 99 Ca 0.00 0.00 -0.58 0.00 -0.55 0.00 0.00 56.30 55.17 3ko5 h ASN 99 Cb 0.00 0.00 -0.07 0.00 0.05 0.00 0.00 38.32 38.30 3ko5 h ASN 99 CO 0.00 0.58 0.78 -0.75 -1.65 0.00 0.00 177.43 176.39 3ko5 s LYS 100 N -2.92 4.00 0.49 0.81 2.20 -1.26 -5.02 119.74 118.04 3ko5 s LYS 100 Ca -0.02 0.93 -0.21 0.00 -0.36 0.00 0.00 55.97 56.30 3ko5 s LYS 100 Cb 0.09 -3.76 -0.07 0.00 -1.51 0.00 0.00 37.83 32.58 3ko5 s LYS 100 CO 0.80 -0.92 1.13 -2.14 -0.36 0.00 0.00 175.35 173.86 3ko5 s PRO 101 N 3.63 3.63 -0.19 4.03 0.02 -1.26 -4.91 135.00 139.95 3ko5 s PRO 101 Ca 0.43 1.66 -0.03 0.00 0.02 0.00 0.00 61.00 63.09 3ko5 s PRO 101 Cb -0.12 -2.24 -0.01 0.00 0.02 0.00 0.00 34.50 32.15 3ko5 s PRO 101 CO 0.17 -0.63 -0.06 0.34 -0.33 0.00 0.00 177.00 176.49 3ko5 s ASP 102 N -1.58 4.33 -0.43 2.53 2.15 -0.04 -4.86 116.67 118.77 3ko5 s ASP 102 Ca 0.67 -0.33 0.04 0.00 0.43 0.00 0.00 52.55 53.37 3ko5 s ASP 102 Cb -0.25 -1.72 0.44 0.00 -0.30 0.00 0.00 42.92 41.09 3ko5 s ASP 102 CO 0.30 0.06 1.40 0.49 -0.17 0.00 0.00 175.17 177.25 3ko5 n PHE 103 N 4.26 2.97 0.10 -5.34 3.72 -1.26 0.73 117.46 122.65 3ko5 n PHE 103 Ca -0.18 -2.54 -0.02 0.00 -0.05 0.00 0.00 57.45 54.66 3ko5 n PHE 103 Cb 0.52 -0.58 -0.04 0.00 -0.94 0.00 0.00 39.48 38.44 3ko5 n PHE 103 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 3ko5 h HIS 104 N 2.26 0.00 0.00 1.38 3.86 -1.96 -3.25 115.15 117.43 3ko5 h HIS 104 Ca 0.42 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.63 3ko5 h HIS 104 Cb 1.20 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.67 3ko5 h HIS 104 CO 0.99 0.74 0.00 1.28 0.86 0.00 0.00 177.93 181.80 3ko5 n LEU 105 N -3.29 0.46 -4.73 2.43 4.77 -1.26 -4.80 117.00 110.57 3ko5 n LEU 105 Ca 0.01 0.58 -0.41 0.00 -0.03 0.00 0.00 56.01 56.16 3ko5 n LEU 105 Cb 0.83 -0.47 -0.04 0.00 -2.33 0.00 0.00 43.42 41.41 3ko5 n LEU 105 CO 0.44 -0.29 0.79 0.00 -1.33 0.00 0.00 177.39 177.00 3ko5 s ALA 106 N -3.14 3.35 0.21 -1.18 0.00 -1.23 -0.83 121.76 118.94 3ko5 s ALA 106 Ca 0.08 0.78 -0.32 0.00 0.00 0.00 0.00 51.96 52.50 3ko5 s ALA 106 Cb 0.12 -3.36 -0.12 0.00 0.00 0.00 0.00 23.12 19.75 3ko5 s ALA 106 CO 0.45 -0.24 1.71 1.17 0.00 0.00 0.00 175.76 178.85 3ko5 n LYS 107 N 2.83 2.73 -1.69 0.00 4.81 -0.24 -4.58 118.16 122.02 3ko5 n LYS 107 Ca 0.04 0.98 -0.39 0.00 -0.87 0.00 0.00 58.31 58.08 3ko5 n LYS 107 Cb 0.47 -2.82 0.04 0.00 0.02 0.00 0.00 35.03 32.74 3ko5 n LYS 107 CO 0.00 0.00 0.00 -0.85 1.17 0.00 0.00 177.40 177.72 3ko5 n GLU 108 N 3.84 1.42 -0.30 1.64 -0.00 -1.26 -4.58 120.64 121.41 3ko5 n GLU 108 Ca 0.16 0.53 0.13 0.00 -0.00 0.00 0.00 57.16 57.98 3ko5 n GLU 108 Cb 0.34 -2.38 0.30 0.00 -0.00 0.00 0.00 31.44 29.71 3ko5 n GLU 108 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.13 175.78 3ko5 h PRO 109 N 1.20 0.26 -0.04 3.44 0.11 -1.97 -1.04 132.00 133.96 3ko5 h PRO 109 Ca -0.49 -0.02 -0.00 0.00 0.11 0.00 0.00 66.00 65.60 3ko5 h PRO 109 Cb 1.33 -0.06 -0.00 0.00 0.11 0.00 0.00 31.00 32.38 3ko5 h PRO 109 CO 0.55 0.17 0.01 -0.91 -0.21 0.00 0.00 178.00 177.62 3ko5 h ASN 110 N 0.27 0.05 0.75 -2.05 2.35 -2.01 0.29 115.58 115.23 3ko5 h ASN 110 Ca 0.56 -0.18 -0.13 0.00 -0.55 0.00 0.00 56.30 55.99 3ko5 h ASN 110 Cb 1.11 -0.01 -0.02 0.00 0.05 0.00 0.00 38.32 39.45 3ko5 h ASN 110 CO -0.61 0.22 -0.63 -0.33 -1.65 0.00 0.00 177.43 174.44 3ko5 h GLU 111 N -0.12 0.00 -0.59 0.81 5.08 -1.87 -3.22 114.58 114.67 3ko5 h GLU 111 Ca 0.01 0.00 -0.10 0.00 -1.00 0.00 0.00 59.36 58.27 3ko5 h GLU 111 Cb 0.19 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.42 3ko5 h GLU 111 CO -0.00 0.63 -0.04 0.00 -1.00 0.00 0.00 179.01 178.59 3ko5 h ALA 112 N 1.37 0.81 -0.30 3.43 0.00 -0.91 -2.00 119.26 121.66 3ko5 h ALA 112 Ca -0.01 -0.33 -0.01 0.00 0.00 0.00 0.00 54.91 54.57 3ko5 h ALA 112 Cb 1.17 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.73 3ko5 h ALA 112 CO 0.08 0.67 0.16 1.25 0.00 0.00 0.00 179.25 181.42 3ko5 h LEU 113 N 0.96 0.38 -0.60 0.00 5.85 -0.96 0.24 115.31 121.18 3ko5 h LEU 113 Ca 0.16 -0.09 -0.09 0.00 0.84 0.00 0.00 57.88 58.70 3ko5 h LEU 113 Cb 0.61 -0.10 -0.02 0.00 0.37 0.00 0.00 40.66 41.52 3ko5 h LEU 113 CO 0.04 0.36 0.04 0.40 -0.34 0.00 0.00 178.44 178.94 3ko5 h ILE 114 N 0.36 1.26 -0.45 4.05 5.03 -1.58 -0.11 117.51 126.08 3ko5 h ILE 114 Ca 0.10 -1.09 -0.04 0.00 -0.12 0.00 0.00 64.86 63.71 3ko5 h ILE 114 Cb 0.07 0.78 -0.02 0.00 -3.03 0.00 0.00 36.82 34.63 3ko5 h ILE 114 CO -0.02 0.40 0.11 0.15 -0.68 0.00 0.00 178.15 178.11 3ko5 h PHE 115 N 0.93 0.75 0.04 1.37 3.57 -1.21 -1.71 116.94 120.69 3ko5 h PHE 115 Ca 0.18 -0.09 0.01 0.00 3.53 0.00 0.00 57.97 61.59 3ko5 h PHE 115 Cb 0.51 -0.21 -0.01 0.00 2.79 0.00 0.00 35.95 39.02 3ko5 h PHE 115 CO 0.04 0.69 -0.08 -0.92 -2.23 0.00 0.00 178.31 175.81 3ko5 h TYR 116 N 0.59 -0.19 -0.85 0.41 3.20 -0.33 -1.10 116.97 118.71 3ko5 h TYR 116 Ca 0.14 0.00 0.03 0.00 3.14 0.00 0.00 58.73 62.05 3ko5 h TYR 116 Cb 0.31 0.08 -0.05 0.00 1.54 0.00 0.00 36.73 38.62 3ko5 h TYR 116 CO 0.02 -0.12 0.56 -0.91 -1.64 0.00 0.00 178.16 176.07 3ko5 h ASN 117 N -0.15 0.91 -0.58 -2.11 2.35 -0.91 -0.20 115.58 114.89 3ko5 h ASN 117 Ca 0.02 -0.01 -0.09 0.00 -0.55 0.00 0.00 56.30 55.67 3ko5 h ASN 117 Cb 0.17 -0.21 -0.02 0.00 0.05 0.00 0.00 38.32 38.30 3ko5 h ASN 117 CO -0.05 0.63 0.02 0.50 -1.65 0.00 0.00 177.43 176.89 3ko5 h LYS 118 N 1.06 1.03 -0.51 0.81 3.64 -1.13 -1.85 116.57 119.62 3ko5 h LYS 118 Ca 0.34 -0.31 -0.02 0.00 -1.27 0.00 0.00 60.65 59.40 3ko5 h LYS 118 Cb 0.03 -0.10 -0.02 0.00 -0.41 0.00 0.00 32.23 31.72 3ko5 h LYS 118 CO -0.10 0.99 0.26 0.82 -2.27 0.00 0.00 179.45 179.15 3ko5 h ILE 119 N 0.95 1.19 -0.84 2.00 2.04 -0.30 -2.04 117.51 120.51 3ko5 h ILE 119 Ca 0.18 -0.52 -0.01 0.00 1.00 0.00 0.00 64.86 65.51 3ko5 h ILE 119 Cb 0.52 0.59 -0.04 0.00 -0.74 0.00 0.00 36.82 37.15 3ko5 h ILE 119 CO 0.02 0.21 0.51 0.40 0.00 0.00 0.00 178.15 179.29 3ko5 h ILE 120 N 0.68 1.23 -0.26 -0.67 1.08 -0.81 -1.29 117.51 117.47 3ko5 h ILE 120 Ca 0.18 -0.52 -0.12 0.00 -0.39 0.00 0.00 64.86 64.01 3ko5 h ILE 120 Cb 0.10 0.06 -0.01 0.00 -3.07 0.00 0.00 36.82 33.89 3ko5 h ILE 120 CO -0.02 0.25 -0.33 0.44 -0.69 0.00 0.00 178.15 177.79 3ko5 h ASP 121 N 1.16 0.58 -0.53 1.72 3.32 -1.20 -2.42 116.42 119.05 3ko5 h ASP 121 Ca 0.30 -0.23 -0.12 0.00 0.02 0.00 0.00 57.03 57.01 3ko5 h ASP 121 Cb -0.04 -0.16 -0.02 0.00 0.22 0.00 0.00 39.33 39.33 3ko5 h ASP 121 CO -0.06 0.87 -0.13 -0.08 -1.72 0.00 0.00 179.24 178.13 3ko5 h GLU 122 N 0.48 1.02 -0.19 3.56 4.57 -1.04 -0.37 114.58 122.61 3ko5 h GLU 122 Ca 0.05 -0.39 0.05 0.00 -1.18 0.00 0.00 59.36 57.89 3ko5 h GLU 122 Cb 0.80 -0.06 -0.05 0.00 -0.16 0.00 0.00 28.75 29.28 3ko5 h GLU 122 CO 0.07 1.07 -0.11 0.74 -1.18 0.00 0.00 179.01 179.59 3ko5 h PHE 123 N 0.90 -0.28 -0.44 0.92 0.04 -1.11 0.27 116.94 117.25 3ko5 h PHE 123 Ca 0.14 0.02 -0.10 0.00 2.80 0.00 0.00 57.97 60.83 3ko5 h PHE 123 Cb 0.69 0.15 -0.02 0.00 2.20 0.00 0.00 35.95 38.98 3ko5 h PHE 123 CO 0.05 -0.17 -0.11 0.87 -0.60 0.00 0.00 178.31 178.34 3ko5 h LYS 124 N -0.11 0.80 -0.40 1.51 1.57 -1.34 -0.51 116.57 118.10 3ko5 h LYS 124 Ca 0.11 -0.27 -0.04 0.00 -1.87 0.00 0.00 60.65 58.58 3ko5 h LYS 124 Cb 0.27 -0.06 -0.02 0.00 0.08 0.00 0.00 32.23 32.50 3ko5 h LYS 124 CO -0.25 0.88 0.09 -0.22 -0.57 0.00 0.00 179.45 179.38 3ko5 h LYS 125 N 0.72 0.64 0.00 3.15 3.64 -0.86 -3.04 116.57 120.82 3ko5 h LYS 125 Ca 0.12 -0.16 -0.04 0.00 -1.27 0.00 0.00 60.65 59.31 3ko5 h LYS 125 Cb 0.60 -0.08 -0.01 0.00 -0.41 0.00 0.00 32.23 32.34 3ko5 h LYS 125 CO 0.04 0.67 -0.18 1.96 -2.27 0.00 0.00 179.45 179.67 3ko5 h GLN 126 N 0.50 0.00 0.00 1.90 4.20 -0.77 -3.45 115.11 117.49 3ko5 h GLN 126 Ca 0.12 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.83 3ko5 h GLN 126 Cb 0.32 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.10 3ko5 h GLN 126 CO 0.00 0.18 0.00 0.98 -0.67 0.00 0.00 178.83 179.32 3ko5 n TYR 127 N -3.17 0.00 -3.95 2.96 9.36 -0.22 -5.09 117.16 117.06 3ko5 n TYR 127 Ca 0.03 0.00 -0.11 0.00 3.32 0.00 0.00 57.90 61.14 3ko5 n TYR 127 Cb 0.56 0.00 -0.12 0.00 -0.63 0.00 0.00 39.34 39.14 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 0.19 0.23 2.98 3.04 -1.16 -4.93 114.94 116.29 3ko5 s ASN 128 Ca 0.00 -0.28 -0.07 0.00 0.04 0.00 0.00 52.86 52.55 3ko5 s ASN 128 Cb 0.00 0.05 0.20 0.00 -1.54 0.00 0.00 41.25 39.96 3ko5 s ASN 128 CO 0.00 -0.16 1.79 -0.78 -3.04 0.00 0.00 177.10 174.92 3ko5 h ASP 129 N 5.32 1.07 1.54 -4.21 3.58 -1.93 -2.94 116.42 118.85 3ko5 h ASP 129 Ca -0.29 -0.16 -0.01 0.00 0.42 0.00 0.00 57.03 56.99 3ko5 h ASP 129 Cb 1.21 -0.28 -0.00 0.00 1.72 0.00 0.00 39.33 41.98 3ko5 h ASP 129 CO 0.45 0.94 -0.04 0.44 -2.88 0.00 0.00 179.24 178.16 3ko5 h ASP 130 N 1.14 0.00 0.24 2.28 3.32 -1.96 -3.30 116.42 118.13 3ko5 h ASP 130 Ca 0.26 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.31 3ko5 h ASP 130 Cb 0.21 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.76 3ko5 h ASP 130 CO -0.02 0.04 -0.43 0.29 -1.72 0.00 0.00 179.24 177.40 3ko5 n LYS 131 N -3.12 0.59 -3.78 3.56 4.76 -1.11 -4.79 118.16 114.27 3ko5 n LYS 131 Ca 0.02 -0.39 -0.37 0.00 -2.87 0.00 0.00 58.31 54.70 3ko5 n LYS 131 Cb 0.45 -1.49 -0.13 0.00 -1.84 0.00 0.00 35.03 32.02 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 -2.68 3.68 0.12 -0.18 -1.09 -1.22 -1.21 121.20 118.62 3ko5 s ILE 132 Ca 0.18 -1.07 0.04 0.00 -2.23 0.00 0.00 60.65 57.58 3ko5 s ILE 132 Cb 0.18 -3.04 -0.04 0.00 -1.58 0.00 0.00 42.46 37.99 3ko5 s ILE 132 CO 0.61 -0.10 0.09 -0.54 -1.23 0.00 0.00 174.94 173.77 3ko5 s LYS 133 N 1.40 2.82 0.19 2.79 -0.14 0.10 -4.99 119.74 121.91 3ko5 s LYS 133 Ca -0.01 -0.81 0.03 0.00 -1.36 0.00 0.00 55.97 53.82 3ko5 s LYS 133 Cb -0.19 -2.65 -0.05 0.00 -1.68 0.00 0.00 37.83 33.26 3ko5 s LYS 133 CO 0.02 0.52 -0.04 0.96 -0.76 0.00 0.00 175.35 176.05 3ko5 s ILE 134 N -1.56 0.98 0.00 2.17 -4.36 -1.26 -1.11 121.20 116.06 3ko5 s ILE 134 Ca 0.29 -2.03 0.00 0.00 -0.26 0.00 0.00 60.65 58.66 3ko5 s ILE 134 Cb -0.11 -2.11 0.00 0.00 1.25 0.00 0.00 42.46 41.49 3ko5 s ILE 134 CO 0.22 -0.51 0.00 0.61 0.24 0.00 0.00 174.94 175.50 3ko5 n GLY 135 N -0.30 1.58 2.96 6.27 0.00 -1.23 -4.73 105.19 109.74 3ko5 n GLY 135 Ca -0.07 -1.65 -0.31 0.00 0.00 0.00 0.00 46.02 43.99 3ko5 n GLY 135 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3ko5 s LYS 136 N 3.22 1.76 0.08 1.61 2.20 -1.26 -5.08 119.74 122.27 3ko5 s LYS 136 Ca 0.00 -1.00 -0.33 0.00 -0.36 0.00 0.00 55.97 54.28 3ko5 s LYS 136 Cb 0.00 -2.59 -0.12 0.00 -1.51 0.00 0.00 37.83 33.61 3ko5 s LYS 136 CO 0.00 -0.57 1.77 0.34 -0.36 0.00 0.00 175.35 176.54 3ko5 n PHE 137 N 4.65 2.44 -1.30 4.03 7.35 -1.26 -2.28 117.46 131.09 3ko5 n PHE 137 Ca -0.13 0.01 -0.10 0.00 -0.76 0.00 0.00 57.45 56.47 3ko5 n PHE 137 Cb 0.44 -2.66 -0.04 0.00 0.35 0.00 0.00 39.48 37.57 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 4.03 1.19 3.35 7.13 0.00 -1.26 -5.01 105.19 114.61 3ko5 n GLY 138 Ca 0.19 -0.54 -0.27 0.00 0.00 0.00 0.00 46.02 45.39 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 -2.88 3.03 0.28 1.61 0.01 -0.96 -5.11 114.94 110.92 3ko5 s ASN 139 Ca 0.00 -0.71 -0.30 0.00 -0.71 0.00 0.00 52.86 51.13 3ko5 s ASN 139 Cb 0.00 -0.20 -0.11 0.00 0.41 0.00 0.00 41.25 41.35 3ko5 s ASN 139 CO 0.00 0.14 1.60 -0.47 -1.51 0.00 0.00 177.10 176.87 3ko5 s TYR 140 N -1.07 2.78 0.03 2.20 5.04 -1.26 -4.83 117.35 120.24 3ko5 s TYR 140 Ca 0.11 0.75 0.04 0.00 -2.44 0.00 0.00 57.07 55.53 3ko5 s TYR 140 Cb -0.10 -4.07 -0.02 0.00 0.35 0.00 0.00 41.96 38.13 3ko5 s TYR 140 CO 0.05 -3.63 -0.13 -1.64 -1.34 0.00 0.00 175.55 168.86 3ko5 s MET 141 N -0.32 0.89 -0.20 4.97 -1.94 -1.26 -4.32 119.30 117.11 3ko5 s MET 141 Ca 0.64 -0.68 -0.04 0.00 -1.71 0.00 0.00 55.69 53.90 3ko5 s MET 141 Cb -0.48 -0.87 -0.02 0.00 2.01 0.00 0.00 34.83 35.48 3ko5 s MET 141 CO 0.46 0.22 -0.03 1.21 -0.01 0.00 0.00 175.02 176.87 3ko5 s ASN 142 N -0.99 4.55 -0.28 3.03 2.47 0.29 -4.98 114.94 119.04 3ko5 s ASN 142 Ca 0.01 -0.28 0.00 0.00 0.42 0.00 0.00 52.86 53.01 3ko5 s ASN 142 Cb -0.07 -1.77 0.08 0.00 -1.45 0.00 0.00 41.25 38.04 3ko5 s ASN 142 CO 0.01 0.05 0.04 -0.63 -3.72 0.00 0.00 177.10 172.85 3ko5 s ILE 143 N 1.07 1.24 -0.62 -5.21 1.01 -1.26 -0.40 121.20 117.02 3ko5 s ILE 143 Ca 0.01 -1.38 -0.28 0.00 0.00 0.00 0.00 60.65 59.01 3ko5 s ILE 143 Cb -0.15 -1.77 0.03 0.00 0.01 0.00 0.00 42.46 40.58 3ko5 s ILE 143 CO 0.01 -0.43 1.28 -1.81 0.00 0.00 0.00 174.94 173.99 3ko5 s ASP 144 N 1.47 6.28 -0.17 3.58 1.01 -0.40 -4.90 116.67 123.54 3ko5 s ASP 144 Ca 0.04 0.01 -0.03 0.00 0.71 0.00 0.00 52.55 53.27 3ko5 s ASP 144 Cb -0.18 -2.55 -0.02 0.00 1.01 0.00 0.00 42.92 41.17 3ko5 s ASP 144 CO -0.14 -1.65 -0.04 -0.69 0.21 0.00 0.00 175.17 172.86 3ko5 s VAL 145 N 5.49 3.74 -0.68 -1.27 1.01 -1.26 -0.88 120.40 126.55 3ko5 s VAL 145 Ca 0.44 -0.40 -0.17 0.00 0.00 0.00 0.00 61.98 61.84 3ko5 s VAL 145 Cb -0.08 -2.65 0.14 0.00 0.00 0.00 0.00 36.38 33.79 3ko5 s VAL 145 CO 0.23 0.48 0.72 -0.89 0.00 0.00 0.00 175.10 175.64 3ko5 s THR 146 N 0.59 5.11 -0.05 3.92 2.01 0.43 -5.00 115.64 122.65 3ko5 s THR 146 Ca -0.03 -1.58 -0.30 0.00 0.31 0.00 0.00 61.69 60.09 3ko5 s THR 146 Cb -0.14 -4.48 -0.04 0.00 0.01 0.00 0.00 72.50 67.84 3ko5 s THR 146 CO 0.03 -1.09 1.34 0.20 -0.69 0.00 0.00 174.62 174.41 3ko5 s ASN 147 N 3.23 6.91 -0.70 3.53 0.01 -1.26 -1.66 114.94 124.99 3ko5 s ASN 147 Ca 0.14 1.96 -0.14 0.00 -0.71 0.00 0.00 52.86 54.11 3ko5 s ASN 147 Cb -0.19 -2.55 0.18 0.00 0.41 0.00 0.00 41.25 39.09 3ko5 s ASN 147 CO -0.01 -0.71 0.65 -0.62 -1.51 0.00 0.00 177.10 174.90 3ko5 s ASP 148 N 1.92 6.48 0.00 -1.22 2.15 -0.16 -4.63 116.67 121.21 3ko5 s ASP 148 Ca 0.61 -2.33 0.00 0.00 0.43 0.00 0.00 52.55 51.26 3ko5 s ASP 148 Cb -0.28 -2.20 0.00 0.00 -0.30 0.00 0.00 42.92 40.14 3ko5 s ASP 148 CO 0.23 -0.68 0.00 0.61 -0.17 0.00 0.00 175.17 175.16 3ko5 n GLY 149 N 4.47 2.31 3.83 2.66 0.00 -1.26 -3.42 105.19 113.79 3ko5 n GLY 149 Ca 0.02 -0.45 -0.29 0.00 0.00 0.00 0.00 46.02 45.30 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 1.92 -0.13 1.61 0.04 -1.26 -5.16 135.00 132.01 3ko5 s PRO 150 Ca 0.00 0.42 -0.02 0.00 0.04 0.00 0.00 61.00 61.44 3ko5 s PRO 150 Cb 0.00 -1.92 0.04 0.00 0.04 0.00 0.00 34.50 32.66 3ko5 s PRO 150 CO 0.00 -1.69 -0.00 0.08 0.04 0.00 0.00 177.00 175.43 3ko5 s VAL 151 N -3.30 0.61 -0.12 -0.36 1.01 -1.22 -5.05 120.40 111.98 3ko5 s VAL 151 Ca 0.61 -0.27 0.00 0.00 0.00 0.00 0.00 61.98 62.33 3ko5 s VAL 151 Cb -0.13 -0.88 0.02 0.00 0.00 0.00 0.00 36.38 35.39 3ko5 s VAL 151 CO 0.53 0.09 -0.12 -0.89 0.00 0.00 0.00 175.10 174.71 3ko5 s THR 152 N 1.85 1.31 -0.05 3.92 2.01 -1.26 -1.52 115.64 121.89 3ko5 s THR 152 Ca 0.02 -0.48 0.05 0.00 0.31 0.00 0.00 61.69 61.59 3ko5 s THR 152 Cb -0.14 -1.25 -0.02 0.00 0.01 0.00 0.00 72.50 71.10 3ko5 s THR 152 CO -0.07 0.41 -0.21 -0.63 -0.69 0.00 0.00 174.62 173.44 3ko5 s ILE 153 N 1.43 2.48 -0.06 1.82 -1.09 0.09 -4.98 121.20 120.89 3ko5 s ILE 153 Ca 0.02 -0.92 0.06 0.00 -2.23 0.00 0.00 60.65 57.57 3ko5 s ILE 153 Cb -0.13 -1.93 -0.01 0.00 -1.58 0.00 0.00 42.46 38.80 3ko5 s ILE 153 CO -0.07 0.57 -0.24 -0.47 -1.23 0.00 0.00 174.94 173.50 3ko5 s TYR 154 N -0.40 2.47 -0.03 3.97 5.04 -1.26 -0.33 117.35 126.81 3ko5 s TYR 154 Ca 0.04 -0.74 0.02 0.00 -2.44 0.00 0.00 57.07 53.95 3ko5 s TYR 154 Cb -0.12 -1.62 0.01 0.00 0.35 0.00 0.00 41.96 40.58 3ko5 s TYR 154 CO 0.02 -0.23 -0.07 0.42 -1.34 0.00 0.00 175.55 174.35 3ko5 s ILE 155 N -0.11 0.64 -0.20 3.14 1.01 -0.38 -5.00 121.20 120.30 3ko5 s ILE 155 Ca -0.05 -0.25 0.01 0.00 0.00 0.00 0.00 60.65 60.36 3ko5 s ILE 155 Cb -0.14 -0.61 0.04 0.00 0.01 0.00 0.00 42.46 41.76 3ko5 s ILE 155 CO 0.04 0.22 -0.11 -0.62 0.00 0.00 0.00 174.94 174.48 3ko5 s ASP 156 N 0.44 3.36 0.54 3.58 -1.08 -1.26 -0.82 116.67 121.43 3ko5 s ASP 156 Ca -0.06 -0.87 0.29 0.00 -0.52 0.00 0.00 52.55 51.39 3ko5 s ASP 156 Cb -0.10 -1.23 1.54 0.00 -1.46 0.00 0.00 42.92 41.67 3ko5 s ASP 156 CO 0.00 -0.14 2.10 0.71 0.52 0.00 0.00 175.17 178.36 3ko5 h THR 157 N 6.37 0.48 0.00 1.71 1.35 -1.39 -2.16 112.91 119.27 3ko5 h THR 157 Ca -0.28 -0.46 0.00 0.00 -0.55 0.00 0.00 66.41 65.12 3ko5 h THR 157 Cb 1.10 1.31 0.00 0.00 -1.73 0.00 0.00 68.15 68.83 3ko5 h THR 157 CO 0.48 0.09 0.00 1.41 -0.25 0.00 0.00 175.52 177.25 3ko5 n HIS 158 N -3.57 0.01 0.98 4.73 8.25 -1.26 -1.05 115.22 123.32 3ko5 n HIS 158 Ca -0.02 0.01 0.12 0.00 -0.26 0.00 0.00 57.72 57.57 3ko5 n HIS 158 Cb 0.22 -0.51 0.21 0.00 1.12 0.00 0.00 29.99 31.03 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 -1.51 0.55 -4.70 0.41 8.00 -0.81 -4.93 116.55 113.55 3ko5 n ASP 159 Ca 0.03 -0.30 -0.34 0.00 0.71 0.00 0.00 54.79 54.90 3ko5 n ASP 159 Cb 0.15 0.32 -0.09 0.00 -0.02 0.00 0.00 41.12 41.49 3ko5 n ASP 159 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 3ko5 s ILE 160 N -3.01 4.32 -0.07 0.53 -1.09 -0.21 -5.08 121.20 116.59 3ko5 s ILE 160 Ca 0.10 -0.43 -0.30 0.00 -2.23 0.00 0.00 60.65 57.80 3ko5 s ILE 160 Cb 0.17 -2.89 -0.03 0.00 -1.58 0.00 0.00 42.46 38.13 3ko5 s ILE 160 CO 0.72 0.46 1.26 0.21 -1.23 0.00 0.00 174.94 176.37 3ko5 s ASN 161 N -1.32 6.98 0.00 3.58 2.47 -1.26 -4.99 114.94 120.40 3ko5 s ASN 161 Ca 0.18 1.86 0.00 0.00 0.42 0.00 0.00 52.86 55.32 3ko5 s ASN 161 Cb -0.12 -2.55 0.00 0.00 -1.45 0.00 0.00 41.25 37.13 3ko5 s ASN 161 CO 0.08 -0.65 0.00 0.18 -3.72 0.00 0.00 177.10 172.98