#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1k23 s LYS 3 N 0.00 4.70 0.15 5.31 2.20 -1.26 -4.41 119.74 126.43 1k23 s LYS 3 Ca 0.00 1.35 0.10 0.00 -0.36 0.00 0.00 55.97 57.07 1k23 s LYS 3 Cb 0.00 -3.11 -0.04 0.00 -1.51 0.00 0.00 37.83 33.17 1k23 s LYS 3 CO 0.00 0.45 -0.23 0.42 -0.36 0.00 0.00 175.35 175.63 1k23 s ILE 4 N -1.32 2.12 -0.10 5.43 1.01 -0.03 -4.51 121.20 123.79 1k23 s ILE 4 Ca 0.43 -1.85 0.03 0.00 0.00 0.00 0.00 60.65 59.26 1k23 s ILE 4 Cb -0.23 -1.94 -0.01 0.00 0.01 0.00 0.00 42.46 40.30 1k23 s ILE 4 CO 0.28 -0.08 -0.21 -0.76 0.00 0.00 0.00 174.94 174.17 1k23 s LEU 5 N -2.36 2.29 -0.12 2.97 1.02 -1.22 -2.40 118.68 118.86 1k23 s LEU 5 Ca 0.15 -0.48 0.01 0.00 0.02 0.00 0.00 54.13 53.83 1k23 s LEU 5 Cb -0.08 -1.47 -0.01 0.00 0.02 0.00 0.00 46.19 44.64 1k23 s LEU 5 CO 0.07 0.17 -0.15 -0.63 0.02 0.00 0.00 176.35 175.84 1k23 s ILE 6 N 0.27 2.92 0.16 -0.59 1.01 -0.38 -0.82 121.20 123.77 1k23 s ILE 6 Ca -0.15 -0.71 -0.22 0.00 0.00 0.00 0.00 60.65 59.57 1k23 s ILE 6 Cb -0.17 -2.21 0.06 0.00 0.01 0.00 0.00 42.46 40.16 1k23 s ILE 6 CO 0.07 0.53 0.57 0.72 0.00 0.00 0.00 174.94 176.84 1k23 s PHE 7 N 0.27 -0.49 0.00 3.97 -0.12 -0.90 -0.26 117.98 120.45 1k23 s PHE 7 Ca -0.10 0.26 0.00 0.00 -0.05 0.00 0.00 56.93 57.03 1k23 s PHE 7 Cb -0.16 0.52 0.00 0.00 -0.63 0.00 0.00 43.02 42.75 1k23 s PHE 7 CO 0.06 -0.83 0.00 0.41 -0.05 0.00 0.00 175.22 174.80 1k23 n GLY 8 N -0.36 2.06 3.25 1.99 0.00 -1.25 -2.06 105.19 108.82 1k23 n GLY 8 Ca -0.17 -2.06 -0.26 0.00 0.00 0.00 0.00 46.02 43.53 1k23 n GLY 8 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 1k23 n HIS 9 N -0.20 -3.90 -1.93 1.61 1.44 -1.26 -4.76 115.22 106.23 1k23 n HIS 9 Ca 0.00 -0.96 -0.29 0.00 -2.01 0.00 0.00 57.72 54.46 1k23 n HIS 9 Cb 0.00 -0.95 0.12 0.00 0.12 0.00 0.00 29.99 29.27 1k23 n HIS 9 CO 0.00 0.00 0.00 -0.65 -2.81 0.00 0.00 176.34 172.88 1k23 s GLN 10 N -5.38 1.59 -1.11 -1.40 -0.21 -0.34 -4.08 119.66 108.73 1k23 s GLN 10 Ca 0.65 -0.06 -0.24 0.00 0.02 0.00 0.00 55.36 55.73 1k23 s GLN 10 Cb -0.04 -1.93 0.02 0.00 1.00 0.00 0.00 33.01 32.06 1k23 s GLN 10 CO 0.47 -1.82 0.72 0.09 -2.12 0.00 0.00 175.29 172.63 1k23 n ASN 11 N -3.43 -4.83 -4.68 5.90 3.02 -1.26 -4.74 115.26 105.24 1k23 n ASN 11 Ca 0.10 -1.11 -0.48 0.00 -0.03 0.00 0.00 54.58 53.07 1k23 n ASN 11 Cb 0.61 -2.44 -0.05 0.00 -0.61 0.00 0.00 39.78 37.29 1k23 n ASN 11 CO 0.00 0.00 0.00 -0.81 -2.62 0.00 0.00 177.26 173.83 1k23 n PRO 12 N -4.28 2.11 -2.84 3.52 -0.04 -1.26 -5.04 135.00 127.17 1k23 n PRO 12 Ca -0.13 0.77 -0.19 0.00 -0.04 0.00 0.00 63.50 63.91 1k23 n PRO 12 Cb 0.59 -2.58 0.02 0.00 -0.04 0.00 0.00 33.50 31.49 1k23 n PRO 12 CO 0.00 0.00 0.00 0.16 -0.04 0.00 0.00 175.50 175.62 1k23 s ASP 13 N 2.79 5.49 0.66 3.54 3.84 -1.26 -4.53 116.67 127.20 1k23 s ASP 13 Ca 0.87 -0.17 0.43 0.00 -0.00 0.00 0.00 52.55 53.68 1k23 s ASP 13 Cb -0.71 -0.83 2.35 0.00 -1.38 0.00 0.00 42.92 42.35 1k23 s ASP 13 CO 0.47 -0.93 2.36 0.74 -0.00 0.00 0.00 175.17 177.80 1k23 h THR 14 N 0.36 0.08 -0.01 2.11 2.02 -1.96 -1.63 112.91 113.88 1k23 h THR 14 Ca -0.42 0.00 -0.05 0.00 0.77 0.00 0.00 66.41 66.71 1k23 h THR 14 Cb 1.29 1.00 0.00 0.00 -1.74 0.00 0.00 68.15 68.70 1k23 h THR 14 CO 0.50 0.00 -0.20 -0.78 0.37 0.00 0.00 175.52 175.40 1k23 h ASP 15 N 0.00 0.20 -0.27 4.18 -0.00 -1.92 -1.80 116.42 116.79 1k23 h ASP 15 Ca 0.00 -0.74 0.01 0.00 -0.00 0.00 0.00 57.03 56.30 1k23 h ASP 15 Cb 0.01 -0.06 -0.01 0.00 -0.00 0.00 0.00 39.33 39.27 1k23 h ASP 15 CO -0.00 0.91 0.18 0.74 -0.00 0.00 0.00 179.24 181.07 1k23 h THR 16 N -0.49 1.06 0.00 2.25 2.02 -1.66 0.92 112.91 117.01 1k23 h THR 16 Ca -0.02 -0.12 -0.04 0.00 0.77 0.00 0.00 66.41 67.00 1k23 h THR 16 Cb 0.93 0.68 -0.01 0.00 -1.74 0.00 0.00 68.15 68.01 1k23 h THR 16 CO 0.04 0.06 -0.28 0.40 0.37 0.00 0.00 175.52 176.11 1k23 h ILE 17 N 0.35 0.72 -0.41 3.11 1.08 -1.48 -3.27 117.51 117.60 1k23 h ILE 17 Ca 0.10 -1.62 -0.03 0.00 -0.39 0.00 0.00 64.86 62.93 1k23 h ILE 17 Cb -0.00 1.44 -0.02 0.00 -3.07 0.00 0.00 36.82 35.17 1k23 h ILE 17 CO -0.02 0.24 0.15 0.00 -0.69 0.00 0.00 178.15 177.83 1k23 h SER 19 N 0.51 0.05 -0.35 0.00 0.02 -1.00 0.32 113.55 113.10 1k23 h SER 19 Ca 0.13 -0.01 -0.09 0.00 -0.84 0.00 0.00 61.79 60.99 1k23 h SER 19 Cb 0.22 -0.01 -0.01 0.00 0.14 0.00 0.00 62.40 62.74 1k23 h SER 19 CO -0.01 0.22 -0.12 0.00 -1.14 0.00 0.00 176.83 175.79 1k23 h ALA 20 N 1.78 0.49 -0.34 3.77 0.00 -1.55 -1.15 119.26 122.27 1k23 h ALA 20 Ca 0.01 -0.32 -0.05 0.00 0.00 0.00 0.00 54.91 54.55 1k23 h ALA 20 Cb 0.33 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.99 1k23 h ALA 20 CO 0.02 0.37 -0.00 0.82 0.00 0.00 0.00 179.25 180.46 1k23 h ILE 21 N 0.49 1.26 0.42 0.00 2.04 -0.92 -2.66 117.51 118.13 1k23 h ILE 21 Ca 0.09 -0.97 -0.02 0.00 1.00 0.00 0.00 64.86 64.96 1k23 h ILE 21 Cb 0.63 1.23 0.00 0.00 -0.74 0.00 0.00 36.82 37.95 1k23 h ILE 21 CO 0.04 0.32 -0.21 0.00 0.00 0.00 0.00 178.15 178.30 1k23 h ALA 22 N 0.85 -0.58 0.00 1.87 0.00 -0.28 -2.37 119.26 118.76 1k23 h ALA 22 Ca 0.09 -0.12 -0.05 0.00 0.00 0.00 0.00 54.91 54.83 1k23 h ALA 22 Cb 0.45 0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.47 1k23 h ALA 22 CO 0.02 -0.83 -0.23 -0.92 0.00 0.00 0.00 179.25 177.30 1k23 h TYR 23 N -0.58 0.00 -0.44 0.00 3.20 -1.28 -1.11 116.97 116.76 1k23 h TYR 23 Ca -0.06 0.00 -0.12 0.00 3.14 0.00 0.00 58.73 61.69 1k23 h TYR 23 Cb 0.45 0.00 -0.01 0.00 1.54 0.00 0.00 36.73 38.70 1k23 h TYR 23 CO -0.05 0.23 -0.21 0.00 -1.64 0.00 0.00 178.16 176.48 1k23 h ALA 24 N 1.77 0.79 0.38 1.82 0.00 -1.33 0.52 119.26 123.21 1k23 h ALA 24 Ca -0.00 -0.38 -0.02 0.00 0.00 0.00 0.00 54.91 54.51 1k23 h ALA 24 Cb 0.46 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.09 1k23 h ALA 24 CO 0.03 0.65 -0.18 0.22 0.00 0.00 0.00 179.25 179.97 1k23 h ASP 25 N 0.78 -0.43 -0.51 0.00 -0.00 -0.70 0.69 116.42 116.24 1k23 h ASP 25 Ca 0.10 -0.01 0.10 0.00 -0.00 0.00 0.00 57.03 57.22 1k23 h ASP 25 Cb 0.76 0.11 -0.08 0.00 -0.00 0.00 0.00 39.33 40.12 1k23 h ASP 25 CO 0.06 -0.28 0.04 0.25 -0.00 0.00 0.00 179.24 179.31 1k23 h LEU 26 N -0.56 -0.14 -0.41 2.28 6.46 -1.12 0.16 115.31 121.98 1k23 h LEU 26 Ca -0.05 0.11 0.01 0.00 -0.12 0.00 0.00 57.88 57.83 1k23 h LEU 26 Cb 0.42 0.19 -0.02 0.00 -0.73 0.00 0.00 40.66 40.51 1k23 h LEU 26 CO 0.09 -0.04 0.25 0.11 -0.62 0.00 0.00 178.44 178.23 1k23 h LYS 27 N 0.16 0.50 -0.63 1.25 1.79 -0.67 -2.17 116.57 116.80 1k23 h LYS 27 Ca 0.26 -0.03 -0.07 0.00 -2.18 0.00 0.00 60.65 58.63 1k23 h LYS 27 Cb 0.39 -0.11 -0.03 0.00 -1.58 0.00 0.00 32.23 30.90 1k23 h LYS 27 CO -0.40 0.33 0.13 -0.91 -1.08 0.00 0.00 179.45 177.52 1k23 h ASN 28 N 0.52 0.97 0.29 0.86 2.35 0.25 -1.80 115.58 119.02 1k23 h ASN 28 Ca 0.16 -0.25 0.00 0.00 -0.55 0.00 0.00 56.30 55.66 1k23 h ASN 28 Cb -0.03 -0.26 0.00 0.00 0.05 0.00 0.00 38.32 38.09 1k23 h ASN 28 CO -0.05 0.97 0.00 0.11 -1.65 0.00 0.00 177.43 176.80 1k23 h LYS 29 N 0.94 0.00 -0.65 0.81 1.79 -0.42 -0.25 116.57 118.78 1k23 h LYS 29 Ca 0.19 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.66 1k23 h LYS 29 Cb 0.39 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.04 1k23 h LYS 29 CO 0.01 0.00 0.00 1.28 -1.08 0.00 0.00 179.45 179.66 1k23 n LEU 30 N -2.83 4.02 0.00 2.94 4.77 -0.73 -4.93 117.00 120.23 1k23 n LEU 30 Ca -0.01 -2.02 0.00 0.00 -0.03 0.00 0.00 56.01 53.95 1k23 n LEU 30 Cb 0.13 -0.51 0.00 0.00 -2.33 0.00 0.00 43.42 40.71 1k23 n LEU 30 CO 0.19 0.80 0.00 0.61 -1.33 0.00 0.00 177.39 177.66 1k23 n GLY 31 N 1.27 0.77 3.99 -0.72 0.00 -0.10 -5.06 105.19 105.33 1k23 n GLY 31 Ca 0.23 -0.25 -0.21 0.00 0.00 0.00 0.00 46.02 45.78 1k23 n GLY 31 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1k23 s PHE 32 N -2.00 1.60 -0.68 1.61 0.40 -0.88 -5.01 117.98 113.02 1k23 s PHE 32 Ca 0.00 -0.73 0.04 0.00 -0.60 0.00 0.00 56.93 55.64 1k23 s PHE 32 Cb 0.00 -2.13 0.17 0.00 0.51 0.00 0.00 43.02 41.57 1k23 s PHE 32 CO 0.00 -0.87 0.47 1.21 0.70 0.00 0.00 175.22 176.73 1k23 s ASN 33 N -4.51 4.86 0.16 1.36 2.47 -1.26 -4.36 114.94 113.66 1k23 s ASN 33 Ca 0.53 -3.63 0.10 0.00 0.42 0.00 0.00 52.86 50.28 1k23 s ASN 33 Cb -0.05 -1.68 -0.04 0.00 -1.45 0.00 0.00 41.25 38.03 1k23 s ASN 33 CO 0.33 -0.14 -0.20 0.00 -3.72 0.00 0.00 177.10 173.37 1k23 s ALA 34 N -1.15 2.64 -0.03 1.71 0.00 -1.26 -0.85 121.76 122.81 1k23 s ALA 34 Ca 0.23 -1.51 0.01 0.00 0.00 0.00 0.00 51.96 50.69 1k23 s ALA 34 Cb -0.10 -0.51 0.02 0.00 0.00 0.00 0.00 23.12 22.54 1k23 s ALA 34 CO -0.12 0.50 -0.03 -2.00 0.00 0.00 0.00 175.76 174.11 1k23 s GLU 35 N -2.47 0.58 0.24 0.00 2.12 -1.01 -4.90 118.70 113.26 1k23 s GLU 35 Ca 0.20 -0.04 -0.30 0.00 0.36 0.00 0.00 54.97 55.19 1k23 s GLU 35 Cb -0.09 -0.65 -0.09 0.00 0.26 0.00 0.00 34.13 33.56 1k23 s GLU 35 CO 0.10 -0.08 1.10 -2.14 -0.54 0.00 0.00 175.26 173.70 1k23 s PRO 36 N 0.85 4.62 0.03 4.30 0.02 -1.26 -1.25 135.00 142.32 1k23 s PRO 36 Ca -0.10 1.77 -0.03 0.00 0.02 0.00 0.00 61.00 62.66 1k23 s PRO 36 Cb -0.13 -3.22 -0.02 0.00 0.02 0.00 0.00 34.50 31.15 1k23 s PRO 36 CO -0.01 0.16 0.04 0.08 -0.33 0.00 0.00 177.00 176.95 1k23 s VAL 37 N -0.82 0.14 0.20 3.83 1.01 0.64 -3.98 120.40 121.42 1k23 s VAL 37 Ca 0.46 -1.16 0.11 0.00 0.00 0.00 0.00 61.98 61.40 1k23 s VAL 37 Cb -0.31 -0.82 -0.04 0.00 0.00 0.00 0.00 36.38 35.21 1k23 s VAL 37 CO 0.39 -0.64 -0.24 0.00 0.00 0.00 0.00 175.10 174.61 1k23 s ARG 38 N -2.48 1.53 0.00 2.72 1.70 -0.71 -4.20 118.95 117.51 1k23 s ARG 38 Ca -0.06 -1.54 0.14 0.00 -0.47 0.00 0.00 55.73 53.80 1k23 s ARG 38 Cb -0.02 -1.84 0.23 0.00 -0.57 0.00 0.00 34.95 32.74 1k23 s ARG 38 CO -0.04 0.40 1.10 1.28 -1.08 0.00 0.00 175.30 176.96 1k23 n LEU 39 N 0.22 2.60 0.00 -1.89 4.77 -1.26 -1.86 117.00 119.58 1k23 n LEU 39 Ca -0.12 -1.39 0.00 0.00 -0.03 0.00 0.00 56.01 54.47 1k23 n LEU 39 Cb 0.56 -0.12 0.00 0.00 -2.33 0.00 0.00 43.42 41.53 1k23 n LEU 39 CO 0.30 0.56 0.00 0.61 -1.33 0.00 0.00 177.39 177.53 1k23 n GLY 40 N 0.82 2.48 3.78 -0.72 0.00 -1.26 -4.77 105.19 105.52 1k23 n GLY 40 Ca 0.11 -0.85 -0.37 0.00 0.00 0.00 0.00 46.02 44.91 1k23 n GLY 40 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1k23 s GLN 41 N -0.23 4.49 -0.30 1.61 1.11 -1.26 -4.92 119.66 120.17 1k23 s GLN 41 Ca 0.00 1.35 -0.22 0.00 0.01 0.00 0.00 55.36 56.50 1k23 s GLN 41 Cb 0.00 -2.72 -0.00 0.00 -1.01 0.00 0.00 33.01 29.28 1k23 s GLN 41 CO 0.00 0.19 0.73 0.08 0.01 0.00 0.00 175.29 176.30 1k23 s VAL 42 N -1.66 4.86 0.97 1.09 1.01 -1.26 -4.50 120.40 120.91 1k23 s VAL 42 Ca 0.52 1.12 -0.13 0.00 0.00 0.00 0.00 61.98 63.49 1k23 s VAL 42 Cb -0.19 -4.08 0.17 0.00 0.00 0.00 0.00 36.38 32.28 1k23 s VAL 42 CO 0.24 -0.18 1.13 0.54 0.00 0.00 0.00 175.10 176.84 1k23 s ASN 43 N 1.59 2.95 0.29 3.32 2.20 -1.26 -4.74 114.94 119.28 1k23 s ASN 43 Ca 0.30 0.93 -0.01 0.00 -0.94 0.00 0.00 52.86 53.15 1k23 s ASN 43 Cb -0.15 -1.47 0.48 0.00 -2.00 0.00 0.00 41.25 38.12 1k23 s ASN 43 CO 0.11 -2.90 1.90 1.23 -2.94 0.00 0.00 177.10 174.50 1k23 h GLY 44 N -1.74 1.40 0.97 0.45 0.00 -1.82 -0.83 103.07 101.51 1k23 h GLY 44 Ca -0.51 -0.44 -0.01 0.00 0.00 0.00 0.00 47.33 46.37 1k23 h GLY 44 CO 0.57 0.32 -0.07 -2.09 0.00 0.00 0.00 176.54 175.26 1k23 h GLU 45 N 1.09 -0.19 -0.56 4.80 4.81 -1.78 -1.79 114.58 120.96 1k23 h GLU 45 Ca 0.41 0.01 0.02 0.00 -0.13 0.00 0.00 59.36 59.67 1k23 h GLU 45 Cb 0.18 0.04 -0.03 0.00 0.63 0.00 0.00 28.75 29.57 1k23 h GLU 45 CO -0.16 -0.10 0.35 1.15 -0.73 0.00 0.00 179.01 179.52 1k23 h THR 46 N -0.23 1.08 0.04 0.32 2.02 -1.84 -2.97 112.91 111.33 1k23 h THR 46 Ca -0.02 -0.24 0.02 0.00 0.77 0.00 0.00 66.41 66.95 1k23 h THR 46 Cb 0.18 0.33 -0.05 0.00 -1.74 0.00 0.00 68.15 66.87 1k23 h THR 46 CO 0.03 0.13 -0.47 1.56 0.37 0.00 0.00 175.52 177.14 1k23 h GLN 47 N 0.69 -0.62 -0.89 6.66 1.08 -0.89 -0.12 115.11 121.02 1k23 h GLN 47 Ca 0.22 0.04 0.24 0.00 -1.45 0.00 0.00 58.65 57.70 1k23 h GLN 47 Cb -0.00 0.14 -0.15 0.00 -0.05 0.00 0.00 27.48 27.42 1k23 h GLN 47 CO -0.08 -0.42 0.20 -0.92 -0.95 0.00 0.00 178.83 176.66 1k23 h TYR 48 N -0.65 0.28 -0.35 2.96 3.20 -1.17 0.21 116.97 121.45 1k23 h TYR 48 Ca 0.03 0.05 -0.11 0.00 3.14 0.00 0.00 58.73 61.84 1k23 h TYR 48 Cb 0.70 0.02 -0.01 0.00 1.54 0.00 0.00 36.73 38.98 1k23 h TYR 48 CO -0.44 -0.25 -0.19 0.00 -1.64 0.00 0.00 178.16 175.63 1k23 h ALA 49 N 1.81 0.49 -0.41 1.82 0.00 -1.23 0.17 119.26 121.91 1k23 h ALA 49 Ca 0.56 -0.36 -0.00 0.00 0.00 0.00 0.00 54.91 55.10 1k23 h ALA 49 Cb 1.14 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.79 1k23 h ALA 49 CO -0.70 0.44 0.24 -0.07 0.00 0.00 0.00 179.25 179.17 1k23 h LEU 50 N 0.53 0.50 -0.05 0.00 3.38 0.11 -2.51 115.31 117.28 1k23 h LEU 50 Ca 0.07 -0.06 -0.02 0.00 0.09 0.00 0.00 57.88 57.97 1k23 h LEU 50 Cb 0.74 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 41.37 1k23 h LEU 50 CO 0.06 0.42 -0.03 0.44 0.09 0.00 0.00 178.44 179.41 1k23 h ASP 51 N 0.54 0.11 -0.86 -0.43 3.32 -0.67 0.14 116.42 118.57 1k23 h ASP 51 Ca 0.15 -0.45 0.16 0.00 0.02 0.00 0.00 57.03 56.91 1k23 h ASP 51 Cb 0.01 -0.03 -0.10 0.00 0.22 0.00 0.00 39.33 39.43 1k23 h ASP 51 CO -0.03 0.54 0.43 0.22 -1.72 0.00 0.00 179.24 178.68 1k23 h TYR 52 N -0.32 0.75 -0.72 4.55 3.20 -0.59 -0.45 116.97 123.40 1k23 h TYR 52 Ca 0.01 0.04 -0.19 0.00 3.14 0.00 0.00 58.73 61.73 1k23 h TYR 52 Cb 0.50 -0.20 -0.11 0.00 1.54 0.00 0.00 36.73 38.46 1k23 h TYR 52 CO 0.08 0.14 0.24 1.19 -1.64 0.00 0.00 178.16 178.17 1k23 n PHE 53 N -4.90 2.40 -3.90 -3.82 3.01 -0.95 -4.96 117.46 104.34 1k23 n PHE 53 Ca 0.18 -1.12 -0.39 0.00 1.01 0.00 0.00 57.45 57.13 1k23 n PHE 53 Cb 0.47 -0.67 0.03 0.00 -0.01 0.00 0.00 39.48 39.30 1k23 n PHE 53 CO 0.00 0.00 0.00 1.63 1.01 0.00 0.00 176.76 179.40 1k23 n LYS 54 N -0.02 -0.69 -5.03 -1.08 5.02 -0.18 -4.90 118.16 111.27 1k23 n LYS 54 Ca 0.39 0.29 -0.28 0.00 -2.02 0.00 0.00 58.31 56.69 1k23 n LYS 54 Cb 1.36 -3.05 -0.16 0.00 -0.02 0.00 0.00 35.03 33.15 1k23 n LYS 54 CO 0.00 0.00 0.00 -0.65 -0.52 0.00 0.00 177.40 176.23 1k23 s GLN 55 N -6.63 2.09 0.38 1.97 -1.52 0.46 -5.03 119.66 111.36 1k23 s GLN 55 Ca 0.43 -0.74 -0.26 0.00 -1.95 0.00 0.00 55.36 52.83 1k23 s GLN 55 Cb -0.21 -1.81 -0.09 0.00 -0.22 0.00 0.00 33.01 30.69 1k23 s GLN 55 CO 0.93 0.32 1.22 -2.00 -0.25 0.00 0.00 175.29 175.50 1k23 s GLU 56 N -0.09 4.15 -0.11 2.91 2.56 -1.26 -4.54 118.70 122.32 1k23 s GLU 56 Ca -0.03 1.98 -0.29 0.00 0.00 0.00 0.00 54.97 56.62 1k23 s GLU 56 Cb -0.12 -2.82 -0.03 0.00 2.00 0.00 0.00 34.13 33.16 1k23 s GLU 56 CO 0.03 -0.28 1.45 0.45 -0.56 0.00 0.00 175.26 176.35 1k23 s SER 57 N -0.90 6.81 0.34 -1.70 0.15 -1.26 -4.95 113.70 112.19 1k23 s SER 57 Ca 0.54 1.96 -0.26 0.00 0.70 0.00 0.00 55.95 58.89 1k23 s SER 57 Cb -0.34 -2.54 -0.13 0.00 -1.71 0.00 0.00 66.02 61.30 1k23 s SER 57 CO 0.44 -0.84 0.85 -0.81 1.20 0.00 0.00 173.24 174.08 1k23 n PRO 58 N 6.87 1.03 -1.68 5.44 -0.04 -1.26 -4.84 135.00 140.51 1k23 n PRO 58 Ca 0.16 0.36 -0.45 0.00 -0.04 0.00 0.00 63.50 63.53 1k23 n PRO 58 Cb 0.44 -1.71 -0.03 0.00 -0.04 0.00 0.00 33.50 32.15 1k23 n PRO 58 CO 0.00 0.00 0.00 -2.13 -0.04 0.00 0.00 175.50 173.33 1k23 n ARG 59 N 0.61 2.17 -2.56 0.54 0.63 -1.26 -4.37 116.66 112.43 1k23 n ARG 59 Ca 0.11 0.78 -0.41 0.00 -0.92 0.00 0.00 57.85 57.41 1k23 n ARG 59 Cb 0.34 -2.50 -0.04 0.00 0.45 0.00 0.00 32.46 30.71 1k23 n ARG 59 CO 0.00 0.00 0.00 -1.17 -2.51 0.00 0.00 177.63 173.95 1k23 s LEU 60 N 0.35 4.54 0.03 6.15 2.96 -1.26 -1.73 118.68 129.72 1k23 s LEU 60 Ca 0.72 2.10 0.01 0.00 -0.22 0.00 0.00 54.13 56.74 1k23 s LEU 60 Cb -0.64 -3.61 -0.02 0.00 0.50 0.00 0.00 46.19 42.42 1k23 s LEU 60 CO 0.45 -0.12 -0.05 -0.69 -1.32 0.00 0.00 176.35 174.62 1k23 s VAL 61 N -0.68 0.33 -0.08 1.68 1.01 -0.78 -4.93 120.40 116.95 1k23 s VAL 61 Ca 0.46 -0.89 0.08 0.00 0.00 0.00 0.00 61.98 61.63 1k23 s VAL 61 Cb -0.29 -0.42 -0.11 0.00 0.00 0.00 0.00 36.38 35.56 1k23 s VAL 61 CO 0.36 -0.38 0.05 -0.62 0.00 0.00 0.00 175.10 174.51 1k23 n GLU 62 N 1.71 2.38 -3.90 2.72 1.02 -1.26 -4.55 120.64 118.76 1k23 n GLU 62 Ca -0.22 -0.01 -0.09 0.00 -0.02 0.00 0.00 57.16 56.82 1k23 n GLU 62 Cb 0.55 -1.22 -0.07 0.00 -0.02 0.00 0.00 31.44 30.68 1k23 n GLU 62 CO 0.00 0.00 0.00 0.95 1.18 0.00 0.00 177.13 179.26 1k23 s THR 63 N -2.25 0.12 0.00 2.62 -4.23 -1.26 -4.17 115.64 106.47 1k23 s THR 63 Ca -0.04 -1.27 0.00 0.00 -1.18 0.00 0.00 61.69 59.20 1k23 s THR 63 Cb 0.03 -1.50 0.00 0.00 1.34 0.00 0.00 72.50 72.37 1k23 s THR 63 CO 0.36 -0.55 0.00 0.00 -0.54 0.00 0.00 174.62 173.88 1k23 n ALA 64 N -0.10 1.97 -0.38 3.99 0.00 -1.26 -4.75 120.51 119.97 1k23 n ALA 64 Ca -0.13 0.00 0.30 0.00 0.00 0.00 0.00 53.44 53.61 1k23 n ALA 64 Cb 0.63 0.31 0.59 0.00 0.00 0.00 0.00 19.45 20.98 1k23 n ALA 64 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1k23 h ALA 65 N 0.00 2.51 0.00 0.00 0.00 -1.84 0.46 119.26 120.40 1k23 h ALA 65 Ca 0.00 0.08 -0.05 0.00 0.00 0.00 0.00 54.91 54.94 1k23 h ALA 65 Cb 0.95 0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.85 1k23 h ALA 65 CO 0.00 -1.02 -0.25 -2.95 0.00 0.00 0.00 179.25 175.03 1k23 h ASN 66 N 0.23 0.00 0.00 0.00 7.08 -1.96 -3.35 115.58 117.58 1k23 h ASN 66 Ca 0.70 0.00 -0.41 0.00 -3.08 0.00 0.00 56.30 53.51 1k23 h ASN 66 Cb 2.05 0.00 -0.07 0.00 -2.08 0.00 0.00 38.32 38.23 1k23 h ASN 66 CO -0.34 0.25 -2.48 -0.62 -2.08 0.00 0.00 177.43 172.16 1k23 n GLU 67 N -3.47 0.62 -4.40 4.14 1.02 0.15 -5.06 120.64 113.63 1k23 n GLU 67 Ca -0.00 0.18 -0.21 0.00 -0.02 0.00 0.00 57.16 57.11 1k23 n GLU 67 Cb 0.42 -1.50 -0.09 0.00 -0.02 0.00 0.00 31.44 30.26 1k23 n GLU 67 CO 0.00 0.00 0.00 0.14 1.18 0.00 0.00 177.13 178.45 1k23 s VAL 68 N -2.51 0.44 -0.04 2.62 -7.23 -0.38 -4.99 120.40 108.32 1k23 s VAL 68 Ca -0.36 -2.00 0.10 0.00 -1.81 0.00 0.00 61.98 57.92 1k23 s VAL 68 Cb 0.11 -2.47 -0.15 0.00 0.56 0.00 0.00 36.38 34.42 1k23 s VAL 68 CO 0.55 0.00 0.18 0.59 -0.31 0.00 0.00 175.10 176.11 1k23 n ASN 69 N -1.12 2.56 -4.11 4.85 5.03 -1.26 -4.32 115.26 116.90 1k23 n ASN 69 Ca -0.01 0.00 -0.20 0.00 0.87 0.00 0.00 54.58 55.24 1k23 n ASN 69 Cb 0.65 1.27 -0.14 0.00 -1.02 0.00 0.00 39.78 40.54 1k23 n ASN 69 CO 0.00 0.00 0.00 -0.83 -1.83 0.00 0.00 177.26 174.60 1k23 s GLY 70 N -3.52 0.69 0.18 7.41 0.00 -1.26 -1.68 107.32 109.14 1k23 s GLY 70 Ca -0.04 -0.69 0.06 0.00 0.00 0.00 0.00 44.72 44.04 1k23 s GLY 70 CO 0.43 -0.64 -0.10 -1.34 0.00 0.00 0.00 173.10 171.45 1k23 s VAL 71 N -0.62 1.36 -0.11 1.40 -7.23 -0.11 -3.41 120.40 111.68 1k23 s VAL 71 Ca 0.03 -2.11 0.03 0.00 -1.81 0.00 0.00 61.98 58.12 1k23 s VAL 71 Cb -0.06 -2.00 0.01 0.00 0.56 0.00 0.00 36.38 34.88 1k23 s VAL 71 CO 0.00 -0.62 -0.21 -0.63 -0.31 0.00 0.00 175.10 173.33 1k23 s ILE 72 N -3.21 1.86 -0.17 -0.62 1.01 -0.00 -0.98 121.20 119.08 1k23 s ILE 72 Ca 0.21 -0.88 -0.09 0.00 0.00 0.00 0.00 60.65 59.89 1k23 s ILE 72 Cb 0.02 -1.63 -0.05 0.00 0.01 0.00 0.00 42.46 40.81 1k23 s ILE 72 CO 0.04 0.51 0.13 -0.76 0.00 0.00 0.00 174.94 174.86 1k23 s LEU 73 N 0.60 4.24 0.03 2.97 1.43 -0.12 -2.12 118.68 125.71 1k23 s LEU 73 Ca -0.14 0.29 0.07 0.00 -1.03 0.00 0.00 54.13 53.33 1k23 s LEU 73 Cb -0.17 -2.07 -0.02 0.00 0.03 0.00 0.00 46.19 43.96 1k23 s LEU 73 CO 0.04 0.25 -0.21 0.68 0.23 0.00 0.00 176.35 177.35 1k23 s VAL 74 N -0.08 1.65 -1.58 -1.59 -7.23 -0.88 -0.57 120.40 110.13 1k23 s VAL 74 Ca 0.10 -1.14 0.00 0.00 -1.81 0.00 0.00 61.98 59.13 1k23 s VAL 74 Cb -0.11 -1.43 0.00 0.00 0.56 0.00 0.00 36.38 35.40 1k23 s VAL 74 CO 0.00 0.24 0.00 -0.67 -0.31 0.00 0.00 175.10 174.36 1k23 n ASP 75 N 1.97 -4.80 0.00 4.85 2.03 -0.01 -4.11 116.55 116.47 1k23 n ASP 75 Ca -0.17 0.34 0.00 0.00 0.52 0.00 0.00 54.79 55.48 1k23 n ASP 75 Cb 0.53 -3.66 0.00 0.00 -0.72 0.00 0.00 41.12 37.27 1k23 n ASP 75 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1k23 n HIS 76 N -2.69 0.00 0.00 -0.67 1.44 -1.26 -4.66 115.22 107.38 1k23 n HIS 76 Ca -0.15 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.56 1k23 n HIS 76 Cb 0.51 0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.62 1k23 n HIS 76 CO 0.00 0.00 0.00 0.27 -2.81 0.00 0.00 176.34 173.80 1k23 n ASN 77 N 0.00 0.00 -4.73 4.39 0.23 -1.26 -4.85 115.26 109.04 1k23 n ASN 77 Ca 0.00 0.00 -0.42 0.00 -0.53 0.00 0.00 54.58 53.63 1k23 n ASN 77 Cb 0.00 0.00 -0.03 0.00 -2.08 0.00 0.00 39.78 37.67 1k23 n ASN 77 CO 0.00 0.00 0.00 -1.61 -0.93 0.00 0.00 177.26 174.72 1k23 s GLU 78 N -0.56 4.26 0.19 -3.83 2.02 -1.24 -4.53 118.70 115.01 1k23 s GLU 78 Ca 0.00 2.27 -0.22 0.00 0.02 0.00 0.00 54.97 57.04 1k23 s GLU 78 Cb 0.00 -3.16 0.12 0.00 0.10 0.00 0.00 34.13 31.18 1k23 s GLU 78 CO 0.00 -0.51 1.57 0.00 0.02 0.00 0.00 175.26 176.34 1k23 h ARG 79 N 6.27 -0.12 -0.92 1.61 3.08 -1.38 -0.96 114.38 121.96 1k23 h ARG 79 Ca -0.43 0.01 0.24 0.00 0.07 0.00 0.00 59.98 59.86 1k23 h ARG 79 Cb 1.21 0.03 -0.06 0.00 0.08 0.00 0.00 29.97 31.23 1k23 h ARG 79 CO 0.86 -0.08 0.63 1.96 -1.07 0.00 0.00 179.97 182.27 1k23 h GLN 80 N -0.13 0.21 0.00 0.04 7.50 -1.91 0.15 115.11 120.97 1k23 h GLN 80 Ca 0.24 -0.01 0.00 0.00 0.50 0.00 0.00 58.65 59.38 1k23 h GLN 80 Cb 0.56 -0.05 0.00 0.00 0.05 0.00 0.00 27.48 28.04 1k23 h GLN 80 CO -0.79 0.14 -0.12 1.96 -1.50 0.00 0.00 178.83 178.52 1k23 h GLN 81 N 0.22 0.00 0.00 1.46 4.20 -1.55 -3.47 115.11 115.97 1k23 h GLN 81 Ca 0.47 0.00 -0.09 0.00 0.06 0.00 0.00 58.65 59.08 1k23 h GLN 81 Cb 1.46 0.00 0.03 0.00 0.30 0.00 0.00 27.48 29.27 1k23 h GLN 81 CO -0.11 0.00 0.05 0.45 -0.67 0.00 0.00 178.83 178.55 1k23 n SER 82 N -2.62 0.16 -4.71 1.46 2.88 0.53 -1.20 113.62 110.11 1k23 n SER 82 Ca 0.04 -1.18 -0.32 0.00 -1.33 0.00 0.00 58.87 56.08 1k23 n SER 82 Cb 0.48 -0.17 0.12 0.00 -0.75 0.00 0.00 64.21 63.89 1k23 n SER 82 CO 0.00 0.00 0.00 -0.51 -1.23 0.00 0.00 175.04 173.30 1k23 s ILE 83 N -1.00 2.41 0.09 2.46 2.07 -1.26 -4.74 121.20 121.23 1k23 s ILE 83 Ca 0.15 0.16 -0.33 0.00 -1.41 0.00 0.00 60.65 59.21 1k23 s ILE 83 Cb -0.01 -2.49 -0.15 0.00 0.13 0.00 0.00 42.46 39.94 1k23 s ILE 83 CO 0.10 -0.15 1.59 0.50 -1.91 0.00 0.00 174.94 175.08 1k23 h LYS 84 N -1.07 -0.86 -1.30 3.50 3.64 -1.93 -3.01 116.57 115.54 1k23 h LYS 84 Ca -0.45 0.06 -0.38 0.00 -1.27 0.00 0.00 60.65 58.60 1k23 h LYS 84 Cb 1.27 0.19 -0.18 0.00 -0.41 0.00 0.00 32.23 33.11 1k23 h LYS 84 CO 0.47 -0.57 0.49 -0.40 -2.27 0.00 0.00 179.45 177.17 1k23 n ASP 85 N -5.52 5.96 0.06 4.20 5.75 -1.26 -4.57 116.55 121.17 1k23 n ASP 85 Ca -0.11 -3.17 0.10 0.00 -0.01 0.00 0.00 54.79 51.60 1k23 n ASP 85 Cb 0.41 -0.96 0.56 0.00 -1.03 0.00 0.00 41.12 40.10 1k23 n ASP 85 CO 0.00 0.00 0.00 -0.29 -0.11 0.00 0.00 177.20 176.80 1k23 h ILE 86 N 0.90 0.96 0.00 2.12 6.09 -1.90 -0.54 117.51 125.14 1k23 h ILE 86 Ca 0.37 -0.09 -0.02 0.00 -1.37 0.00 0.00 64.86 63.76 1k23 h ILE 86 Cb 1.19 0.68 -0.00 0.00 0.47 0.00 0.00 36.82 39.16 1k23 h ILE 86 CO 0.89 0.05 -0.08 -0.08 -3.07 0.00 0.00 178.15 175.85 1k23 h GLU 87 N 0.25 0.00 -0.27 2.19 4.57 -1.87 -2.86 114.58 116.59 1k23 h GLU 87 Ca 0.15 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.33 1k23 h GLU 87 Cb 0.29 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.88 1k23 h GLU 87 CO -0.03 0.08 0.00 0.39 -1.18 0.00 0.00 179.01 178.27 1k23 n GLU 88 N -3.75 1.83 -4.33 1.92 1.02 -0.21 -4.91 120.64 112.21 1k23 n GLU 88 Ca -0.02 -1.27 -0.17 0.00 -0.02 0.00 0.00 57.16 55.68 1k23 n GLU 88 Cb 0.18 -1.36 -0.10 0.00 -0.02 0.00 0.00 31.44 30.14 1k23 n GLU 88 CO 0.00 0.00 0.00 0.14 1.18 0.00 0.00 177.13 178.45 1k23 s VAL 89 N -1.65 0.90 -0.22 2.62 -7.23 -1.08 -4.78 120.40 108.96 1k23 s VAL 89 Ca 0.30 -2.02 -0.12 0.00 -1.81 0.00 0.00 61.98 58.33 1k23 s VAL 89 Cb 0.16 -2.44 -0.05 0.00 0.56 0.00 0.00 36.38 34.61 1k23 s VAL 89 CO 0.23 -0.23 0.23 -1.58 -0.31 0.00 0.00 175.10 173.45 1k23 s GLN 90 N -3.91 4.13 -0.67 4.82 0.74 -0.68 -4.96 119.66 119.13 1k23 s GLN 90 Ca 0.31 -0.10 -0.26 0.00 0.05 0.00 0.00 55.36 55.36 1k23 s GLN 90 Cb 0.07 -3.51 0.04 0.00 1.10 0.00 0.00 33.01 30.70 1k23 s GLN 90 CO 0.10 0.08 1.18 0.08 -0.55 0.00 0.00 175.29 176.18 1k23 s VAL 91 N 0.98 3.95 0.16 1.34 1.01 -1.26 -0.93 120.40 125.65 1k23 s VAL 91 Ca 0.12 0.44 -0.11 0.00 0.00 0.00 0.00 61.98 62.43 1k23 s VAL 91 Cb -0.13 -4.80 0.03 0.00 0.00 0.00 0.00 36.38 31.48 1k23 s VAL 91 CO 0.05 -1.59 1.60 -0.07 0.00 0.00 0.00 175.10 175.09 1k23 h LEU 92 N 12.30 0.98 -7.19 3.92 4.07 -1.43 -3.46 115.31 124.51 1k23 h LEU 92 Ca -0.27 -0.33 0.05 0.00 0.08 0.00 0.00 57.88 57.41 1k23 h LEU 92 Cb 1.06 -0.26 -0.12 0.00 1.08 0.00 0.00 40.66 42.41 1k23 h LEU 92 CO 1.22 1.07 0.33 -1.83 -1.08 0.00 0.00 178.44 178.15 1k23 s GLU 93 N -4.93 1.19 -0.06 1.13 -1.05 -1.25 -2.21 118.70 111.52 1k23 s GLU 93 Ca -0.12 -0.50 -0.01 0.00 -0.15 0.00 0.00 54.97 54.19 1k23 s GLU 93 Cb 0.13 0.51 0.03 0.00 -0.44 0.00 0.00 34.13 34.35 1k23 s GLU 93 CO 0.85 -0.53 0.01 0.08 0.95 0.00 0.00 175.26 176.62 1k23 s VAL 94 N -3.53 0.25 -0.27 1.83 1.01 -0.67 -0.94 120.40 118.07 1k23 s VAL 94 Ca 0.05 0.17 -0.03 0.00 0.00 0.00 0.00 61.98 62.16 1k23 s VAL 94 Cb -0.02 -0.41 0.02 0.00 0.00 0.00 0.00 36.38 35.98 1k23 s VAL 94 CO -0.08 0.22 -0.02 -0.63 0.00 0.00 0.00 175.10 174.60 1k23 s ILE 95 N 1.79 3.17 0.32 2.22 -1.09 0.27 -0.57 121.20 127.32 1k23 s ILE 95 Ca 0.02 -0.98 -0.07 0.00 -2.23 0.00 0.00 60.65 57.39 1k23 s ILE 95 Cb -0.13 -2.65 0.01 0.00 -1.58 0.00 0.00 42.46 38.12 1k23 s ILE 95 CO -0.04 0.13 0.51 -0.62 -1.23 0.00 0.00 174.94 173.69 1k23 s ASP 96 N 1.36 0.52 0.00 3.58 2.15 -0.87 -0.83 116.67 122.58 1k23 s ASP 96 Ca 0.00 -1.30 0.10 0.00 0.43 0.00 0.00 52.55 51.78 1k23 s ASP 96 Cb -0.17 0.66 0.16 0.00 -0.30 0.00 0.00 42.92 43.27 1k23 s ASP 96 CO -0.02 -1.30 1.01 0.00 -0.17 0.00 0.00 175.17 174.69 1k23 n HIS 97 N -0.51 0.00 -4.22 -5.34 1.44 -1.26 -2.55 115.22 102.78 1k23 n HIS 97 Ca -0.01 -0.24 -0.14 0.00 -2.01 0.00 0.00 57.72 55.32 1k23 n HIS 97 Cb 0.62 0.00 -0.02 0.00 0.12 0.00 0.00 29.99 30.70 1k23 n HIS 97 CO 0.00 0.00 0.00 0.72 -2.81 0.00 0.00 176.34 174.25 1k23 n HIS 98 N 0.19 0.25 -1.18 -1.40 8.25 -1.26 -4.71 115.22 115.36 1k23 n HIS 98 Ca -0.01 -1.06 -0.31 0.00 -0.26 0.00 0.00 57.72 56.09 1k23 n HIS 98 Cb 0.85 -0.15 0.12 0.00 1.12 0.00 0.00 29.99 31.92 1k23 n HIS 98 CO 0.00 0.00 0.00 -0.98 0.64 0.00 0.00 176.34 176.00 1k23 s ARG 99 N -2.81 1.78 -0.21 -0.41 1.70 -1.26 -4.98 118.95 112.76 1k23 s ARG 99 Ca 0.02 1.08 -0.06 0.00 -0.47 0.00 0.00 55.73 56.30 1k23 s ARG 99 Cb -0.00 -1.85 -0.03 0.00 -0.57 0.00 0.00 34.95 32.50 1k23 s ARG 99 CO 0.01 -1.95 0.03 0.42 -1.08 0.00 0.00 175.30 172.73 1k23 s ILE 100 N -2.89 4.23 -0.06 4.99 1.01 -1.26 -4.87 121.20 122.36 1k23 s ILE 100 Ca 0.62 -0.22 -0.30 0.00 0.00 0.00 0.00 60.65 60.76 1k23 s ILE 100 Cb -0.18 -2.93 0.11 0.00 0.01 0.00 0.00 42.46 39.47 1k23 s ILE 100 CO 0.57 0.41 0.94 0.00 0.00 0.00 0.00 174.94 176.86 1k23 s ALA 101 N 1.00 -1.87 -1.65 9.38 0.00 -1.26 -4.94 121.76 122.42 1k23 s ALA 101 Ca 0.03 1.19 -0.18 0.00 0.00 0.00 0.00 51.96 53.00 1k23 s ALA 101 Cb -0.14 0.14 0.15 0.00 0.00 0.00 0.00 23.12 23.26 1k23 s ALA 101 CO 0.02 -0.60 0.78 0.09 0.00 0.00 0.00 175.76 176.05 1k23 n ASN 102 N -0.03 -3.48 -3.92 0.00 3.02 -1.26 -3.74 115.26 105.85 1k23 n ASN 102 Ca -0.08 -0.93 -0.11 0.00 -0.03 0.00 0.00 54.58 53.44 1k23 n ASN 102 Cb 0.61 -2.84 -0.13 0.00 -0.61 0.00 0.00 39.78 36.81 1k23 n ASN 102 CO 0.00 0.00 0.00 0.12 -2.62 0.00 0.00 177.26 174.76 1k23 s PHE 103 N -3.23 0.13 -0.25 3.10 5.36 -1.26 -1.20 117.98 120.62 1k23 s PHE 103 Ca 0.71 -0.26 -0.26 0.00 -0.96 0.00 0.00 56.93 56.16 1k23 s PHE 103 Cb -0.39 -0.09 0.13 0.00 -0.34 0.00 0.00 43.02 42.33 1k23 s PHE 103 CO 0.88 -0.09 1.08 -2.00 -1.46 0.00 0.00 175.22 173.62 1k23 s GLU 104 N -0.70 0.46 0.07 10.12 2.12 -1.26 -5.09 118.70 124.42 1k23 s GLU 104 Ca -0.08 0.41 0.06 0.00 0.36 0.00 0.00 54.97 55.73 1k23 s GLU 104 Cb -0.05 0.22 -0.03 0.00 0.26 0.00 0.00 34.13 34.54 1k23 s GLU 104 CO -0.00 -0.08 -0.17 0.95 -0.54 0.00 0.00 175.26 175.41 1k23 s THR 105 N -0.15 1.38 -0.11 -1.70 -4.23 -1.26 -5.03 115.64 104.54 1k23 s THR 105 Ca 0.03 -1.33 0.15 0.00 -1.18 0.00 0.00 61.69 59.35 1k23 s THR 105 Cb -0.04 -1.27 -0.06 0.00 1.34 0.00 0.00 72.50 72.47 1k23 s THR 105 CO -0.05 -0.09 1.14 0.00 -0.54 0.00 0.00 174.62 175.08 1k23 h ALA 106 N 4.38 0.63 -1.44 3.99 0.00 -2.00 -3.47 119.26 121.34 1k23 h ALA 106 Ca -0.42 -0.70 -0.61 0.00 0.00 0.00 0.00 54.91 53.18 1k23 h ALA 106 Cb 1.18 0.08 -0.13 0.00 0.00 0.00 0.00 17.79 18.92 1k23 h ALA 106 CO 0.41 0.84 -0.58 -2.00 0.00 0.00 0.00 179.25 177.92 1k23 s GLU 107 N -2.91 1.96 0.96 0.00 2.56 -1.26 -5.14 118.70 114.87 1k23 s GLU 107 Ca 0.01 -2.14 -0.13 0.00 0.00 0.00 0.00 54.97 52.70 1k23 s GLU 107 Cb 0.08 -1.43 0.17 0.00 2.00 0.00 0.00 34.13 34.95 1k23 s GLU 107 CO 0.78 -0.16 1.13 -2.14 -0.56 0.00 0.00 175.26 174.31 1k23 s PRO 108 N -3.78 0.71 0.18 4.30 0.02 -1.26 -5.06 135.00 130.11 1k23 s PRO 108 Ca 0.28 0.28 -0.23 0.00 0.02 0.00 0.00 61.00 61.35 1k23 s PRO 108 Cb 0.08 -1.79 0.07 0.00 0.02 0.00 0.00 34.50 32.88 1k23 s PRO 108 CO 0.14 -2.49 1.03 -0.48 -0.33 0.00 0.00 177.00 174.87 1k23 s LEU 109 N -6.22 -0.04 -0.77 -5.54 -0.00 -1.26 -5.00 118.68 99.86 1k23 s LEU 109 Ca 0.65 -0.61 -0.15 0.00 -0.00 0.00 0.00 54.13 54.02 1k23 s LEU 109 Cb -0.15 2.09 0.19 0.00 -0.00 0.00 0.00 46.19 48.33 1k23 s LEU 109 CO 0.55 -0.97 0.74 -0.47 -0.00 0.00 0.00 176.35 176.20 1k23 s TYR 110 N -2.42 3.58 -0.26 3.48 5.04 -0.94 -5.00 117.35 120.83 1k23 s TYR 110 Ca 0.19 -1.76 -0.09 0.00 -2.44 0.00 0.00 57.07 52.98 1k23 s TYR 110 Cb -0.02 -3.86 -0.04 0.00 0.35 0.00 0.00 41.96 38.38 1k23 s TYR 110 CO 0.04 -1.05 0.12 -0.47 -1.34 0.00 0.00 175.55 172.86 1k23 s TYR 111 N 0.77 3.16 -0.30 4.97 5.04 -1.26 -1.67 117.35 128.06 1k23 s TYR 111 Ca 0.16 -0.13 -0.01 0.00 -2.44 0.00 0.00 57.07 54.65 1k23 s TYR 111 Cb -0.14 -2.29 0.10 0.00 0.35 0.00 0.00 41.96 39.98 1k23 s TYR 111 CO -0.06 -0.22 0.10 0.50 -1.34 0.00 0.00 175.55 174.53 1k23 s ARG 112 N 1.56 0.65 -0.04 4.97 3.52 0.27 -4.96 118.95 124.92 1k23 s ARG 112 Ca 0.06 -0.99 0.06 0.00 -0.13 0.00 0.00 55.73 54.73 1k23 s ARG 112 Cb -0.15 -1.89 -0.02 0.00 -1.56 0.00 0.00 34.95 31.33 1k23 s ARG 112 CO 0.07 -0.98 -0.21 0.00 -0.81 0.00 0.00 175.30 173.36 1k23 s ALA 113 N 1.68 2.36 0.02 6.12 0.00 -1.26 -2.05 121.76 128.64 1k23 s ALA 113 Ca 0.09 -1.05 0.04 0.00 0.00 0.00 0.00 51.96 51.04 1k23 s ALA 113 Cb -0.17 -0.75 -0.02 0.00 0.00 0.00 0.00 23.12 22.19 1k23 s ALA 113 CO -0.26 0.51 -0.11 -1.21 0.00 0.00 0.00 175.76 174.69 1k23 s GLU 114 N -0.55 0.77 0.00 0.00 2.02 -1.06 -5.00 118.70 114.88 1k23 s GLU 114 Ca 0.08 -0.60 -0.01 0.00 0.02 0.00 0.00 54.97 54.45 1k23 s GLU 114 Cb -0.11 -0.72 -0.07 0.00 0.10 0.00 0.00 34.13 33.33 1k23 s GLU 114 CO 0.00 0.18 1.77 -2.30 0.02 0.00 0.00 175.26 174.93 1k23 n PRO 115 N 2.15 0.90 -3.32 0.39 -0.02 -1.26 -4.46 135.00 129.38 1k23 n PRO 115 Ca -0.17 -0.25 -0.21 0.00 -2.02 0.00 0.00 63.50 60.85 1k23 n PRO 115 Cb 0.55 -1.42 0.03 0.00 -0.02 0.00 0.00 33.50 32.64 1k23 n PRO 115 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 1k23 s VAL 116 N 1.08 2.13 -2.47 -1.45 -7.23 -1.26 -4.97 120.40 106.22 1k23 s VAL 116 Ca 0.16 -1.17 0.24 0.00 -1.81 0.00 0.00 61.98 59.41 1k23 s VAL 116 Cb 0.08 -2.30 0.45 0.00 0.56 0.00 0.00 36.38 35.17 1k23 s VAL 116 CO 0.00 0.00 1.55 0.61 -0.31 0.00 0.00 175.10 176.95 1k23 n GLY 117 N -2.01 0.48 3.58 2.32 0.00 -1.25 -4.90 105.19 103.42 1k23 n GLY 117 Ca 0.09 -0.51 -0.14 0.00 0.00 0.00 0.00 46.02 45.46 1k23 n GLY 117 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1k23 h THR 119 N 3.92 1.19 0.00 0.00 2.02 -1.92 -2.52 112.91 115.60 1k23 h THR 119 Ca -0.29 -0.59 -0.02 0.00 0.77 0.00 0.00 66.41 66.28 1k23 h THR 119 Cb 1.16 0.55 -0.00 0.00 -1.74 0.00 0.00 68.15 68.12 1k23 h THR 119 CO 0.11 0.24 -0.08 0.00 0.37 0.00 0.00 175.52 176.16 1k23 h ALA 120 N 1.48 1.79 -0.65 6.16 0.00 -1.93 -1.89 119.26 124.23 1k23 h ALA 120 Ca 0.18 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 1k23 h ALA 120 Cb 0.14 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 17.89 1k23 h ALA 120 CO -0.02 0.10 0.38 1.15 0.00 0.00 0.00 179.25 180.86 1k23 h THR 121 N 0.00 1.19 -0.07 0.00 2.02 -1.84 -0.08 112.91 114.13 1k23 h THR 121 Ca -0.00 -0.42 -0.12 0.00 0.77 0.00 0.00 66.41 66.64 1k23 h THR 121 Cb 0.15 0.28 0.01 0.00 -1.74 0.00 0.00 68.15 66.85 1k23 h THR 121 CO 0.01 0.20 -0.41 0.40 0.37 0.00 0.00 175.52 176.09 1k23 h ILE 122 N 0.89 1.41 -0.28 3.11 2.04 -1.46 -3.05 117.51 120.17 1k23 h ILE 122 Ca 0.23 -1.80 0.05 0.00 1.00 0.00 0.00 64.86 64.34 1k23 h ILE 122 Cb -0.02 2.32 -0.05 0.00 -0.74 0.00 0.00 36.82 38.33 1k23 h ILE 122 CO -0.04 0.53 -0.00 -0.07 0.00 0.00 0.00 178.15 178.56 1k23 h LEU 123 N -0.06 -0.12 -1.14 1.44 3.38 -0.96 -0.77 115.31 117.08 1k23 h LEU 123 Ca -0.03 0.06 0.25 0.00 0.09 0.00 0.00 57.88 58.25 1k23 h LEU 123 Cb 1.07 0.12 -0.11 0.00 0.09 0.00 0.00 40.66 41.82 1k23 h LEU 123 CO 0.08 -0.03 0.63 -1.13 0.09 0.00 0.00 178.44 178.09 1k23 h ASN 124 N 0.08 0.59 0.00 -0.43 -1.24 -1.05 0.19 115.58 113.73 1k23 h ASN 124 Ca 0.14 0.11 0.00 0.00 0.71 0.00 0.00 56.30 57.26 1k23 h ASN 124 Cb 0.18 0.02 0.00 0.00 0.73 0.00 0.00 38.32 39.25 1k23 h ASN 124 CO -0.23 0.11 0.00 0.29 -1.29 0.00 0.00 177.43 176.31 1k23 n LYS 125 N -4.78 0.36 0.00 6.67 5.02 -0.30 -2.93 118.16 122.21 1k23 n LYS 125 Ca 0.26 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.55 1k23 n LYS 125 Cb 0.79 -1.27 0.00 0.00 -0.02 0.00 0.00 35.03 34.53 1k23 n LYS 125 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 1k23 n TYR 127 N 0.64 0.00 -0.16 2.13 4.02 0.67 -0.48 117.16 123.98 1k23 n TYR 127 Ca 0.00 0.00 -0.09 0.00 -0.01 0.00 0.00 57.90 57.80 1k23 n TYR 127 Cb 0.15 0.00 0.04 0.00 -0.02 0.00 0.00 39.34 39.51 1k23 n TYR 127 CO 0.00 0.00 0.00 0.87 -1.01 0.00 0.00 176.86 176.72 1k23 h LYS 128 N 0.00 0.96 -0.47 -0.72 1.57 -1.79 -1.07 116.57 115.05 1k23 h LYS 128 Ca 0.00 -0.36 0.01 0.00 -1.87 0.00 0.00 60.65 58.43 1k23 h LYS 128 Cb 0.00 -0.06 -0.02 0.00 0.08 0.00 0.00 32.23 32.23 1k23 h LYS 128 CO 0.00 1.02 0.31 0.93 -0.57 0.00 0.00 179.45 181.15 1k23 h GLU 129 N 0.85 0.61 -0.54 3.15 5.08 -1.07 -1.34 114.58 121.32 1k23 h GLU 129 Ca 0.13 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.45 1k23 h GLU 129 Cb 0.68 -0.14 0.00 0.00 0.50 0.00 0.00 28.75 29.79 1k23 h GLU 129 CO 0.05 0.41 0.00 0.09 -1.00 0.00 0.00 179.01 178.56 1k23 n ASN 130 N -4.47 3.41 -3.74 1.42 3.02 -1.09 -4.99 115.26 108.83 1k23 n ASN 130 Ca 0.04 -1.98 -0.23 0.00 -0.03 0.00 0.00 54.58 52.38 1k23 n ASN 130 Cb 0.06 -0.36 0.00 0.00 -0.61 0.00 0.00 39.78 38.87 1k23 n ASN 130 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 1k23 n ASN 131 N 1.39 -5.10 -3.96 6.41 5.15 -0.49 -4.98 115.26 113.69 1k23 n ASN 131 Ca 0.21 -0.90 -0.25 0.00 -0.60 0.00 0.00 54.58 53.03 1k23 n ASN 131 Cb 0.56 -2.04 -0.17 0.00 -0.53 0.00 0.00 39.78 37.60 1k23 n ASN 131 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 1k23 s VAL 132 N -3.03 1.04 0.30 3.44 1.01 -0.71 -5.03 120.40 117.42 1k23 s VAL 132 Ca 0.03 -0.37 -0.29 0.00 0.00 0.00 0.00 61.98 61.35 1k23 s VAL 132 Cb -0.02 -1.00 -0.10 0.00 0.00 0.00 0.00 36.38 35.26 1k23 s VAL 132 CO 0.89 0.35 1.31 -0.75 0.00 0.00 0.00 175.10 176.90 1k23 s LYS 133 N 1.12 4.37 -0.34 2.72 2.20 -1.26 -4.62 119.74 123.93 1k23 s LYS 133 Ca -0.06 2.18 -0.20 0.00 -0.36 0.00 0.00 55.97 57.53 1k23 s LYS 133 Cb -0.14 -3.10 -0.00 0.00 -1.51 0.00 0.00 37.83 33.07 1k23 s LYS 133 CO -0.02 -0.20 0.61 0.42 -0.36 0.00 0.00 175.35 175.81 1k23 s ILE 134 N -0.81 4.92 0.37 5.43 1.01 -1.26 -5.04 121.20 125.82 1k23 s ILE 134 Ca 0.51 0.61 -0.28 0.00 0.00 0.00 0.00 60.65 61.49 1k23 s ILE 134 Cb -0.39 -4.04 -0.11 0.00 0.01 0.00 0.00 42.46 37.93 1k23 s ILE 134 CO 0.49 -0.25 1.51 -1.61 0.00 0.00 0.00 174.94 175.08 1k23 s GLU 135 N 2.63 4.09 0.20 2.79 2.02 -1.26 -4.80 118.70 124.38 1k23 s GLU 135 Ca 0.24 2.60 -0.18 0.00 0.02 0.00 0.00 54.97 57.65 1k23 s GLU 135 Cb -0.15 -2.97 0.19 0.00 0.10 0.00 0.00 34.13 31.30 1k23 s GLU 135 CO 0.14 -0.57 1.59 -0.22 0.02 0.00 0.00 175.26 176.22 1k23 h LYS 136 N 3.23 -0.09 -0.59 1.61 3.64 -1.96 -1.69 116.57 120.71 1k23 h LYS 136 Ca -0.50 0.01 0.08 0.00 -1.27 0.00 0.00 60.65 58.96 1k23 h LYS 136 Cb 1.24 0.02 -0.10 0.00 -0.41 0.00 0.00 32.23 32.98 1k23 h LYS 136 CO 0.66 -0.06 -0.48 0.93 -2.27 0.00 0.00 179.45 178.23 1k23 h GLU 137 N -0.10 -0.23 -0.02 1.90 4.39 -1.90 -2.55 114.58 116.08 1k23 h GLU 137 Ca 0.28 0.02 -0.15 0.00 0.34 0.00 0.00 59.36 59.84 1k23 h GLU 137 Cb 0.55 0.05 -0.02 0.00 -0.10 0.00 0.00 28.75 29.24 1k23 h GLU 137 CO -0.73 -0.15 -0.69 -0.84 -1.16 0.00 0.00 179.01 175.43 1k23 h ILE 138 N -0.24 1.46 -0.89 3.13 3.07 -1.76 -2.93 117.51 119.35 1k23 h ILE 138 Ca 0.16 -2.29 0.14 0.00 1.55 0.00 0.00 64.86 64.42 1k23 h ILE 138 Cb 0.56 2.23 -0.07 0.00 -0.27 0.00 0.00 36.82 39.26 1k23 h ILE 138 CO -0.70 0.66 0.57 0.00 -1.05 0.00 0.00 178.15 177.63 1k23 h ALA 139 N 1.22 1.83 -0.49 0.16 0.00 -0.92 0.30 119.26 121.37 1k23 h ALA 139 Ca -0.01 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.91 1k23 h ALA 139 Cb 1.23 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.87 1k23 h ALA 139 CO 0.10 -0.07 0.28 0.78 0.00 0.00 0.00 179.25 180.33 1k23 h GLY 140 N 0.69 0.72 -1.70 0.00 0.00 -1.31 0.77 103.07 102.25 1k23 h GLY 140 Ca 0.45 -0.32 0.00 0.00 0.00 0.00 0.00 47.33 47.46 1k23 h GLY 140 CO -0.21 0.31 0.00 1.04 0.00 0.00 0.00 176.54 177.68 1k23 n LEU 141 N -4.67 0.40 0.00 3.11 4.77 0.10 -0.64 117.00 120.06 1k23 n LEU 141 Ca 0.02 -0.20 0.00 0.00 -0.03 0.00 0.00 56.01 55.80 1k23 n LEU 141 Cb 0.07 -0.08 0.00 0.00 -2.33 0.00 0.00 43.42 41.08 1k23 n LEU 141 CO 0.36 0.07 0.00 -0.11 -1.33 0.00 0.00 177.39 176.38 1k23 n LEU 143 N 0.76 0.00 0.32 2.23 -0.00 0.26 -1.45 117.00 119.13 1k23 n LEU 143 Ca 0.00 0.00 -0.17 0.00 -0.00 0.00 0.00 56.01 55.84 1k23 n LEU 143 Cb 0.07 0.00 -0.09 0.00 -0.00 0.00 0.00 43.42 43.41 1k23 n LEU 143 CO 0.00 0.00 0.66 0.28 -0.00 0.00 0.00 177.39 178.33 1k23 h SER 144 N 0.00 -0.76 -0.80 1.96 0.02 -1.13 -0.11 113.55 112.74 1k23 h SER 144 Ca 0.00 0.04 0.17 0.00 -0.84 0.00 0.00 61.79 61.16 1k23 h SER 144 Cb 0.00 0.21 -0.11 0.00 0.14 0.00 0.00 62.40 62.64 1k23 h SER 144 CO 0.00 -0.51 0.28 0.00 -1.14 0.00 0.00 176.83 175.46 1k23 h ALA 145 N -0.42 1.14 -0.29 3.77 0.00 -1.47 0.26 119.26 122.25 1k23 h ALA 145 Ca -0.07 0.15 -0.06 0.00 0.00 0.00 0.00 54.91 54.93 1k23 h ALA 145 Cb 0.65 0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.60 1k23 h ALA 145 CO 0.10 -0.30 -0.06 0.82 0.00 0.00 0.00 179.25 179.81 1k23 h ILE 146 N 0.36 1.28 -0.42 0.00 2.04 -1.77 -0.90 117.51 118.10 1k23 h ILE 146 Ca 0.46 -1.07 0.02 0.00 1.00 0.00 0.00 64.86 65.27 1k23 h ILE 146 Cb 0.80 1.39 -0.03 0.00 -0.74 0.00 0.00 36.82 38.24 1k23 h ILE 146 CO -0.49 0.34 0.25 0.40 0.00 0.00 0.00 178.15 178.65 1k23 h ILE 147 N 0.32 1.05 0.09 -0.67 1.08 0.41 -1.08 117.51 118.69 1k23 h ILE 147 Ca 0.08 -0.17 0.01 0.00 -0.39 0.00 0.00 64.86 64.38 1k23 h ILE 147 Cb 0.53 0.50 -0.01 0.00 -3.07 0.00 0.00 36.82 34.77 1k23 h ILE 147 CO 0.03 0.09 -0.10 -1.28 -0.69 0.00 0.00 178.15 176.20 1k23 h SER 148 N 0.50 -0.27 0.54 1.72 0.87 -0.40 -1.12 113.55 115.38 1k23 h SER 148 Ca 0.16 0.03 -0.09 0.00 -1.23 0.00 0.00 61.79 60.66 1k23 h SER 148 Cb 0.00 0.10 -0.01 0.00 -0.44 0.00 0.00 62.40 62.05 1k23 h SER 148 CO -0.07 -0.15 -0.44 0.44 -0.53 0.00 0.00 176.83 176.07 1k23 h ASP 149 N -0.22 0.00 -0.40 6.23 3.32 -1.02 -3.11 116.42 121.22 1k23 h ASP 149 Ca 0.01 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.06 1k23 h ASP 149 Cb 0.22 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.77 1k23 h ASP 149 CO -0.04 0.44 0.00 -1.54 -1.72 0.00 0.00 179.24 176.38 1k23 n SER 150 N -3.87 3.40 -3.88 6.45 3.41 -0.42 -4.88 113.62 113.83 1k23 n SER 150 Ca -0.01 -1.98 -0.24 0.00 -0.26 0.00 0.00 58.87 56.37 1k23 n SER 150 Cb 0.49 -0.26 -0.01 0.00 -0.26 0.00 0.00 64.21 64.17 1k23 n SER 150 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1k23 n LEU 151 N 1.44 -2.47 -3.21 1.04 4.77 -0.48 -0.35 117.00 117.75 1k23 n LEU 151 Ca 0.20 -0.96 -0.16 0.00 -0.03 0.00 0.00 56.01 55.05 1k23 n LEU 151 Cb 0.59 -2.34 0.08 0.00 -2.33 0.00 0.00 43.42 39.42 1k23 n LEU 151 CO 0.16 0.43 0.12 -0.11 -1.33 0.00 0.00 177.39 176.65 1k23 n LEU 152 N -4.36 -3.76 0.00 2.23 7.94 -0.84 -2.55 117.00 115.65 1k23 n LEU 152 Ca -0.30 -0.55 0.00 0.00 -1.11 0.00 0.00 56.01 54.05 1k23 n LEU 152 Cb 0.68 -2.86 0.00 0.00 0.53 0.00 0.00 43.42 41.77 1k23 n LEU 152 CO 0.73 0.38 0.00 0.49 -1.11 0.00 0.00 177.39 177.88 1k23 n PHE 153 N -3.95 0.00 0.57 1.96 3.01 -0.62 -4.82 117.46 113.60 1k23 n PHE 153 Ca -0.22 0.00 0.12 0.00 1.01 0.00 0.00 57.45 58.35 1k23 n PHE 153 Cb 0.64 -1.31 0.10 0.00 -0.01 0.00 0.00 39.48 38.90 1k23 n PHE 153 CO 0.00 0.00 0.00 1.63 1.01 0.00 0.00 176.76 179.40 1k23 n LYS 154 N -0.80 0.29 -1.78 -1.08 4.76 -0.37 -4.91 118.16 114.28 1k23 n LYS 154 Ca 0.00 0.04 -0.39 0.00 -2.87 0.00 0.00 58.31 55.09 1k23 n LYS 154 Cb 0.23 -1.64 0.03 0.00 -1.84 0.00 0.00 35.03 31.81 1k23 n LYS 154 CO 0.00 0.00 0.00 0.45 -1.37 0.00 0.00 177.40 176.48 1k23 s SER 155 N -4.07 5.62 0.56 4.39 0.15 0.53 -4.91 113.70 115.97 1k23 s SER 155 Ca 0.05 2.87 0.37 0.00 0.70 0.00 0.00 55.95 59.94 1k23 s SER 155 Cb 0.14 -2.65 1.78 0.00 -1.71 0.00 0.00 66.02 63.58 1k23 s SER 155 CO 0.76 -1.34 2.10 1.55 1.20 0.00 0.00 173.24 177.51 1k23 h PRO 156 N 1.98 0.00 0.00 5.44 0.13 -1.92 -2.16 132.00 135.46 1k23 h PRO 156 Ca -0.51 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.62 1k23 h PRO 156 Cb 1.28 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.41 1k23 h PRO 156 CO 0.60 0.00 -1.24 0.25 -0.23 0.00 0.00 178.00 177.37 1k23 n THR 157 N -2.95 0.48 -1.58 1.56 -2.24 -1.26 -4.96 114.28 103.33 1k23 n THR 157 Ca -0.01 -0.54 -0.41 0.00 -2.27 0.00 0.00 64.05 60.83 1k23 n THR 157 Cb 0.18 -0.26 0.02 0.00 -2.10 0.00 0.00 70.33 68.17 1k23 n THR 157 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1k23 s THR 159 N -1.37 1.53 0.42 0.00 2.01 -1.26 -4.89 115.64 112.07 1k23 s THR 159 Ca 0.66 -2.13 0.11 0.00 0.31 0.00 0.00 61.69 60.64 1k23 s THR 159 Cb -0.53 -2.28 0.30 0.00 0.01 0.00 0.00 72.50 70.00 1k23 s THR 159 CO 0.55 -0.41 2.00 0.44 -0.69 0.00 0.00 174.62 176.51 1k23 h ASP 160 N 2.42 0.44 -0.27 3.53 3.32 -2.00 -1.58 116.42 122.28 1k23 h ASP 160 Ca -0.39 0.00 -0.15 0.00 0.02 0.00 0.00 57.03 56.52 1k23 h ASP 160 Cb 1.23 -0.09 -0.01 0.00 0.22 0.00 0.00 39.33 40.68 1k23 h ASP 160 CO 0.65 0.28 -0.36 1.56 -1.72 0.00 0.00 179.24 179.65 1k23 h GLN 161 N 0.50 0.81 -0.49 3.56 4.20 -1.98 -1.50 115.11 120.21 1k23 h GLN 161 Ca 0.24 -0.41 -0.05 0.00 0.06 0.00 0.00 58.65 58.49 1k23 h GLN 161 Cb 0.33 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.09 1k23 h GLN 161 CO -0.07 1.04 0.09 -0.44 -0.67 0.00 0.00 178.83 178.79 1k23 h ASP 162 N 0.67 0.77 -0.30 1.46 3.32 -1.71 -0.98 116.42 119.65 1k23 h ASP 162 Ca 0.06 -0.25 -0.09 0.00 0.02 0.00 0.00 57.03 56.78 1k23 h ASP 162 Cb 0.92 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 40.26 1k23 h ASP 162 CO 0.08 0.82 -0.15 0.58 -1.72 0.00 0.00 179.24 178.85 1k23 h VAL 163 N 0.68 1.29 -0.23 -1.35 2.07 -1.31 0.78 116.25 118.19 1k23 h VAL 163 Ca 0.15 -1.25 -0.05 0.00 0.82 0.00 0.00 66.70 66.37 1k23 h VAL 163 Cb 0.37 1.48 -0.01 0.00 -1.52 0.00 0.00 31.29 31.60 1k23 h VAL 163 CO 0.01 0.40 -0.07 0.00 0.02 0.00 0.00 177.57 177.93 1k23 h ALA 164 N 0.75 1.46 -0.10 1.67 0.00 -1.22 -1.42 119.26 120.40 1k23 h ALA 164 Ca 0.07 -0.20 -0.18 0.00 0.00 0.00 0.00 54.91 54.59 1k23 h ALA 164 Cb 0.67 -0.11 0.01 0.00 0.00 0.00 0.00 17.79 18.36 1k23 h ALA 164 CO 0.04 0.38 -0.65 0.00 0.00 0.00 0.00 179.25 179.02 1k23 h ALA 165 N 1.59 0.22 -0.44 0.00 0.00 -0.93 -2.15 119.26 117.54 1k23 h ALA 165 Ca 0.07 -0.56 -0.01 0.00 0.00 0.00 0.00 54.91 54.42 1k23 h ALA 165 Cb 0.34 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.11 1k23 h ALA 165 CO 0.02 0.51 0.25 0.00 0.00 0.00 0.00 179.25 180.02 1k23 h ALA 166 N 0.48 0.56 0.20 0.00 0.00 -0.58 -0.36 119.26 119.57 1k23 h ALA 166 Ca -0.05 -0.08 0.01 0.00 0.00 0.00 0.00 54.91 54.79 1k23 h ALA 166 Cb 1.30 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.89 1k23 h ALA 166 CO 0.13 0.07 -0.23 0.87 0.00 0.00 0.00 179.25 180.09 1k23 h LYS 167 N 0.58 -0.47 -0.51 0.00 6.56 -1.25 0.26 116.57 121.75 1k23 h LYS 167 Ca 0.16 0.03 0.08 0.00 -1.06 0.00 0.00 60.65 59.85 1k23 h LYS 167 Cb 0.03 0.11 -0.06 0.00 -0.57 0.00 0.00 32.23 31.73 1k23 h LYS 167 CO -0.03 -0.31 0.16 1.49 -2.06 0.00 0.00 179.45 178.71 1k23 h GLU 168 N -0.48 0.32 -0.46 3.15 4.81 -1.22 -2.30 114.58 118.39 1k23 h GLU 168 Ca 0.00 -0.02 -0.13 0.00 -0.13 0.00 0.00 59.36 59.08 1k23 h GLU 168 Cb 0.46 -0.07 -0.01 0.00 0.63 0.00 0.00 28.75 29.76 1k23 h GLU 168 CO -0.07 0.21 -0.23 -0.07 -0.73 0.00 0.00 179.01 178.12 1k23 h LEU 169 N 0.33 0.99 -1.16 1.64 3.38 -0.73 -3.00 115.31 116.75 1k23 h LEU 169 Ca 0.25 -0.38 0.06 0.00 0.09 0.00 0.00 57.88 57.90 1k23 h LEU 169 Cb 0.29 -0.27 -0.06 0.00 0.09 0.00 0.00 40.66 40.71 1k23 h LEU 169 CO -0.27 1.17 0.58 0.00 0.09 0.00 0.00 178.44 180.00 1k23 h ALA 170 N 0.90 1.51 -0.00 1.53 0.00 -0.02 -0.05 119.26 123.13 1k23 h ALA 170 Ca 0.10 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.99 1k23 h ALA 170 Cb 0.80 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 18.32 1k23 h ALA 170 CO 0.07 0.37 -0.00 1.49 0.00 0.00 0.00 179.25 181.18 1k23 h GLU 171 N 1.03 0.00 -0.55 0.00 4.81 -1.33 -0.85 114.58 117.69 1k23 h GLU 171 Ca 0.37 -0.00 0.08 0.00 -0.13 0.00 0.00 59.36 59.68 1k23 h GLU 171 Cb 0.16 -0.00 -0.06 0.00 0.63 0.00 0.00 28.75 29.47 1k23 h GLU 171 CO -0.13 0.39 0.20 0.82 -0.73 0.00 0.00 179.01 179.55 1k23 h ILE 172 N -0.38 0.80 0.00 2.32 2.04 -1.30 0.11 117.51 121.09 1k23 h ILE 172 Ca 0.00 -0.13 0.00 0.00 1.00 0.00 0.00 64.86 65.73 1k23 h ILE 172 Cb 0.39 0.39 0.00 0.00 -0.74 0.00 0.00 36.82 36.86 1k23 h ILE 172 CO 0.00 0.07 0.00 0.00 0.00 0.00 0.00 178.15 178.22 1k23 n ALA 173 N -2.45 1.94 -2.92 1.87 0.00 -0.07 -4.64 120.51 114.23 1k23 n ALA 173 Ca 0.07 -0.08 -0.12 0.00 0.00 0.00 0.00 53.44 53.31 1k23 n ALA 173 Cb 0.23 -1.31 0.06 0.00 0.00 0.00 0.00 19.45 18.43 1k23 n ALA 173 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1k23 n GLY 174 N 0.45 -0.56 3.53 0.00 0.00 0.38 -4.91 105.19 104.08 1k23 n GLY 174 Ca 0.06 0.28 -0.11 0.00 0.00 0.00 0.00 46.02 46.26 1k23 n GLY 174 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1k23 s VAL 175 N -3.30 0.00 -0.38 1.61 1.01 -0.41 -5.04 120.40 113.90 1k23 s VAL 175 Ca 0.26 -1.51 -0.12 0.00 0.00 0.00 0.00 61.98 60.61 1k23 s VAL 175 Cb -0.03 -2.37 0.02 0.00 0.00 0.00 0.00 36.38 34.00 1k23 s VAL 175 CO 0.57 0.00 0.23 -0.62 0.00 0.00 0.00 175.10 175.28 1k23 s ASP 176 N -3.09 5.85 0.02 3.32 3.68 -1.26 -4.39 116.67 120.80 1k23 s ASP 176 Ca 0.26 -0.89 -0.04 0.00 2.13 0.00 0.00 52.55 54.01 1k23 s ASP 176 Cb 0.00 -2.07 -0.01 0.00 -1.45 0.00 0.00 42.92 39.39 1k23 s ASP 176 CO 0.12 -0.38 0.78 0.00 0.13 0.00 0.00 175.17 175.83 1k23 n ALA 177 N 5.05 -0.08 0.18 3.66 0.00 -1.26 -0.67 120.51 127.39 1k23 n ALA 177 Ca -0.12 0.11 0.02 0.00 0.00 0.00 0.00 53.44 53.46 1k23 n ALA 177 Cb 0.47 0.27 0.35 0.00 0.00 0.00 0.00 19.45 20.54 1k23 n ALA 177 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 177.50 178.55 1k23 h GLU 178 N 0.00 0.00 0.39 0.00 9.09 -1.97 0.61 114.58 122.69 1k23 h GLU 178 Ca 0.02 0.00 -0.02 0.00 0.05 0.00 0.00 59.36 59.41 1k23 h GLU 178 Cb 0.05 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.16 1k23 h GLU 178 CO -0.12 0.39 -0.19 1.49 0.05 0.00 0.00 179.01 180.62 1k23 h GLU 179 N 0.00 -0.51 -0.38 1.06 4.81 -1.51 -2.33 114.58 115.73 1k23 h GLU 179 Ca -0.00 0.03 -0.02 0.00 -0.13 0.00 0.00 59.36 59.24 1k23 h GLU 179 Cb 0.69 0.11 -0.02 0.00 0.63 0.00 0.00 28.75 30.17 1k23 h GLU 179 CO 0.05 -0.19 0.17 -0.92 -0.73 0.00 0.00 179.01 177.39 1k23 h TYR 180 N -0.94 0.56 -0.48 0.92 3.20 -0.93 -3.09 116.97 116.21 1k23 h TYR 180 Ca -0.05 -0.03 0.09 0.00 3.14 0.00 0.00 58.73 61.87 1k23 h TYR 180 Cb 0.55 -0.17 -0.10 0.00 1.54 0.00 0.00 36.73 38.55 1k23 h TYR 180 CO 0.02 0.48 -0.36 0.78 -1.64 0.00 0.00 178.16 177.45 1k23 h GLY 181 N 0.47 -0.29 0.50 1.82 0.00 -0.90 -1.85 103.07 102.82 1k23 h GLY 181 Ca 0.13 0.46 0.05 0.00 0.00 0.00 0.00 47.33 47.97 1k23 h GLY 181 CO -0.01 -0.20 -0.07 1.41 0.00 0.00 0.00 176.54 177.67 1k23 h LEU 182 N -0.24 -0.25 -0.91 3.11 3.38 -1.37 0.10 115.31 119.13 1k23 h LEU 182 Ca 0.19 0.08 0.00 0.00 0.09 0.00 0.00 57.88 58.23 1k23 h LEU 182 Cb 0.55 0.16 0.00 0.00 0.09 0.00 0.00 40.66 41.46 1k23 h LEU 182 CO -0.61 -0.09 0.00 0.59 0.09 0.00 0.00 178.44 178.42 1k23 n ASN 183 N -5.23 0.00 0.00 -0.43 3.02 -0.70 -0.38 115.26 111.54 1k23 n ASN 183 Ca -0.02 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.53 1k23 n ASN 183 Cb 0.15 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.32 1k23 n ASN 183 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 1k23 n LEU 185 N 0.29 0.00 -0.10 3.41 4.77 0.35 -1.73 117.00 123.99 1k23 n LEU 185 Ca 0.00 0.00 -0.09 0.00 -0.03 0.00 0.00 56.01 55.89 1k23 n LEU 185 Cb 0.00 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 41.08 1k23 n LEU 185 CO 0.00 0.00 1.00 0.11 -1.33 0.00 0.00 177.39 177.17 1k23 h LYS 186 N 0.00 0.41 0.00 3.23 1.57 -0.95 -1.22 116.57 119.61 1k23 h LYS 186 Ca 0.00 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.76 1k23 h LYS 186 Cb 0.00 -0.09 0.00 0.00 0.08 0.00 0.00 32.23 32.22 1k23 h LYS 186 CO 0.00 0.27 0.07 0.00 -0.57 0.00 0.00 179.45 179.22 1k23 n ALA 187 N -2.20 0.88 -0.47 3.86 0.00 -0.71 -0.90 120.51 120.98 1k23 n ALA 187 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.43 1k23 n ALA 187 Cb 0.03 -0.86 0.00 0.00 0.00 0.00 0.00 19.45 18.62 1k23 n ALA 187 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1k23 n GLY 188 N -1.41 -2.73 0.09 0.00 0.00 -0.46 -3.83 105.19 96.84 1k23 n GLY 188 Ca 0.00 0.04 -0.04 0.00 0.00 0.00 0.00 46.02 46.03 1k23 n GLY 188 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1k23 n ALA 189 N -1.35 1.77 -2.83 4.61 0.00 -1.20 -4.46 120.51 117.05 1k23 n ALA 189 Ca 0.00 -0.73 -0.02 0.00 0.00 0.00 0.00 53.44 52.69 1k23 n ALA 189 Cb 0.00 -0.80 -0.01 0.00 0.00 0.00 0.00 19.45 18.64 1k23 n ALA 189 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1k23 n ASP 190 N -2.88 -5.56 0.05 0.00 -0.08 -0.08 -4.93 116.55 103.07 1k23 n ASP 190 Ca -0.15 1.15 0.05 0.00 -1.51 0.00 0.00 54.79 54.33 1k23 n ASP 190 Cb 0.94 -4.05 -0.06 0.00 2.34 0.00 0.00 41.12 40.29 1k23 n ASP 190 CO 0.00 0.00 0.00 0.18 0.12 0.00 0.00 177.20 177.50 1k23 n LEU 191 N 1.36 0.75 0.16 -2.67 4.77 -1.26 -3.94 117.00 116.18 1k23 n LEU 191 Ca -0.12 0.31 0.11 0.00 -0.03 0.00 0.00 56.01 56.28 1k23 n LEU 191 Cb 0.29 0.03 0.58 0.00 -2.33 0.00 0.00 43.42 41.98 1k23 n LEU 191 CO 0.28 0.00 0.84 -1.54 -1.33 0.00 0.00 177.39 175.65 1k23 n SER 192 N -2.74 0.59 -1.64 -1.43 3.41 -1.26 -1.42 113.62 109.13 1k23 n SER 192 Ca -0.06 0.75 -0.16 0.00 -0.26 0.00 0.00 58.87 59.14 1k23 n SER 192 Cb 0.70 -0.84 0.10 0.00 -0.26 0.00 0.00 64.21 63.92 1k23 n SER 192 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1k23 n LYS 193 N -2.27 2.71 -4.38 4.33 5.02 -1.25 -5.00 118.16 117.31 1k23 n LYS 193 Ca -0.01 -3.65 -0.19 0.00 -2.02 0.00 0.00 58.31 52.43 1k23 n LYS 193 Cb 0.06 -2.06 -0.14 0.00 -0.02 0.00 0.00 35.03 32.87 1k23 n LYS 193 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 1k23 s LYS 194 N -3.49 0.86 0.57 1.97 1.02 -0.51 -5.12 119.74 115.04 1k23 s LYS 194 Ca 0.50 -0.57 -0.20 0.00 0.02 0.00 0.00 55.97 55.72 1k23 s LYS 194 Cb 0.42 -0.84 -0.04 0.00 -0.52 0.00 0.00 37.83 36.85 1k23 s LYS 194 CO 0.01 0.22 1.24 0.99 -0.92 0.00 0.00 175.35 176.88 1k23 s THR 195 N -0.59 2.54 0.47 2.17 2.01 -1.26 -4.86 115.64 116.13 1k23 s THR 195 Ca 0.02 0.36 0.28 0.00 0.31 0.00 0.00 61.69 62.66 1k23 s THR 195 Cb -0.06 -3.16 0.32 0.00 0.01 0.00 0.00 72.50 69.61 1k23 s THR 195 CO 0.00 -0.05 2.13 0.58 -0.69 0.00 0.00 174.62 176.60 1k23 h VAL 196 N 1.11 0.54 0.00 3.82 2.07 -1.96 0.22 116.25 122.05 1k23 h VAL 196 Ca -0.50 -0.36 0.00 0.00 0.82 0.00 0.00 66.70 66.66 1k23 h VAL 196 Cb 1.29 1.23 0.00 0.00 -1.52 0.00 0.00 31.29 32.30 1k23 h VAL 196 CO 0.56 0.08 -0.31 -0.08 0.02 0.00 0.00 177.57 177.84 1k23 h GLU 197 N 0.00 0.00 0.17 1.57 4.81 -1.95 -3.21 114.58 115.97 1k23 h GLU 197 Ca -0.00 0.00 -0.23 0.00 -0.13 0.00 0.00 59.36 59.00 1k23 h GLU 197 Cb 0.23 0.00 0.03 0.00 0.63 0.00 0.00 28.75 29.63 1k23 h GLU 197 CO 0.01 0.00 -0.99 0.93 -0.73 0.00 0.00 179.01 178.23 1k23 h GLU 198 N 0.00 0.36 -0.38 1.92 5.08 -0.94 -3.31 114.58 117.32 1k23 h GLU 198 Ca 0.00 -0.62 0.00 0.00 -1.00 0.00 0.00 59.36 57.75 1k23 h GLU 198 Cb 0.80 0.23 -0.02 0.00 0.50 0.00 0.00 28.75 30.26 1k23 h GLU 198 CO 0.00 1.29 0.25 -0.07 -1.00 0.00 0.00 179.01 179.48 1k23 h LEU 199 N -0.24 0.44 0.00 1.33 3.38 -1.41 -1.72 115.31 117.09 1k23 h LEU 199 Ca -0.17 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.77 1k23 h LEU 199 Cb 1.78 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 42.42 1k23 h LEU 199 CO 0.18 0.33 0.00 -0.38 0.09 0.00 0.00 178.44 178.66 1k23 n ILE 200 N -4.81 0.07 0.00 1.22 5.41 -1.21 -2.89 119.36 117.15 1k23 n ILE 200 Ca 0.00 0.02 0.00 0.00 1.00 0.00 0.00 62.75 63.77 1k23 n ILE 200 Cb 0.03 -0.81 0.00 0.00 -0.71 0.00 0.00 39.64 38.15 1k23 n ILE 200 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 176.55 175.01 1k23 n SER 201 N -1.03 3.67 -0.12 4.38 3.41 -0.71 -4.66 113.62 118.55 1k23 n SER 201 Ca 0.09 -0.12 -0.07 0.00 -0.26 0.00 0.00 58.87 58.51 1k23 n SER 201 Cb 0.05 0.97 -0.05 0.00 -0.26 0.00 0.00 64.21 64.92 1k23 n SER 201 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 1k23 h LEU 202 N 0.00 -1.06 -6.83 1.04 3.38 -1.25 -3.30 115.31 107.29 1k23 h LEU 202 Ca 0.00 0.15 -0.61 0.00 0.09 0.00 0.00 57.88 57.51 1k23 h LEU 202 Cb 0.00 0.45 -0.40 0.00 0.09 0.00 0.00 40.66 40.79 1k23 h LEU 202 CO 0.00 -0.19 -0.73 -0.62 0.09 0.00 0.00 178.44 176.99 1k23 s ASP 203 N -4.09 3.51 -0.13 -0.43 -1.08 -1.26 -5.07 116.67 108.12 1k23 s ASP 203 Ca -0.07 -3.42 0.01 0.00 -0.52 0.00 0.00 52.55 48.55 1k23 s ASP 203 Cb 0.05 -1.15 -0.01 0.00 -1.46 0.00 0.00 42.92 40.35 1k23 s ASP 203 CO 0.33 -0.14 -0.16 0.00 0.52 0.00 0.00 175.17 175.73 1k23 s ALA 204 N -0.69 2.50 -0.02 3.66 0.00 -1.25 -1.64 121.76 124.33 1k23 s ALA 204 Ca 0.26 -0.96 0.04 0.00 0.00 0.00 0.00 51.96 51.30 1k23 s ALA 204 Cb -0.05 -1.15 -0.01 0.00 0.00 0.00 0.00 23.12 21.92 1k23 s ALA 204 CO -0.15 0.16 -0.12 0.15 0.00 0.00 0.00 175.76 175.79 1k23 s LYS 205 N 0.52 1.11 0.03 0.00 1.02 -1.11 -5.01 119.74 116.29 1k23 s LYS 205 Ca -0.10 -0.43 -0.02 0.00 0.02 0.00 0.00 55.97 55.44 1k23 s LYS 205 Cb -0.16 -1.04 -0.04 0.00 -0.52 0.00 0.00 37.83 36.07 1k23 s LYS 205 CO 0.04 0.23 0.20 -1.21 -0.92 0.00 0.00 175.35 173.69 1k23 s GLU 206 N -0.12 3.45 0.24 1.68 2.02 -1.26 -1.94 118.70 122.77 1k23 s GLU 206 Ca 0.02 -0.36 0.00 0.00 0.02 0.00 0.00 54.97 54.65 1k23 s GLU 206 Cb -0.07 -3.06 -0.05 0.00 0.10 0.00 0.00 34.13 31.05 1k23 s GLU 206 CO 0.00 0.64 0.11 -0.06 0.02 0.00 0.00 175.26 175.97 1k23 s PHE 207 N -1.42 1.41 -0.37 1.61 0.40 0.56 -4.99 117.98 115.19 1k23 s PHE 207 Ca 0.31 -1.25 0.12 0.00 -0.60 0.00 0.00 56.93 55.52 1k23 s PHE 207 Cb -0.13 -0.79 0.36 0.00 0.51 0.00 0.00 43.02 42.97 1k23 s PHE 207 CO 0.23 -0.44 0.75 2.41 0.70 0.00 0.00 175.22 178.87 1k23 n THR 208 N -0.40 -0.00 -2.40 0.64 -1.04 -1.26 -1.21 114.28 108.60 1k23 n THR 208 Ca 0.01 -4.51 -0.43 0.00 -2.04 0.00 0.00 64.05 57.07 1k23 n THR 208 Cb 0.66 -0.23 -0.02 0.00 -1.82 0.00 0.00 70.33 68.92 1k23 n THR 208 CO 0.00 0.00 0.00 -1.48 -0.64 0.00 0.00 175.07 172.95 1k23 s LEU 209 N -2.51 3.78 -0.37 -4.42 2.34 -1.09 -3.54 118.68 112.87 1k23 s LEU 209 Ca 0.39 1.07 -0.00 0.00 0.06 0.00 0.00 54.13 55.65 1k23 s LEU 209 Cb 0.36 -3.54 0.00 0.00 -0.56 0.00 0.00 46.19 42.45 1k23 s LEU 209 CO -0.07 -1.19 0.01 0.61 -1.06 0.00 0.00 176.35 174.64 1k23 n GLY 210 N 4.57 0.21 3.01 -3.48 0.00 -1.26 -3.21 105.19 105.03 1k23 n GLY 210 Ca 0.15 -0.69 0.00 0.00 0.00 0.00 0.00 46.02 45.48 1k23 n GLY 210 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1k23 n SER 211 N 1.13 0.00 -4.81 1.61 3.41 -1.23 -4.96 113.62 108.76 1k23 n SER 211 Ca -0.05 0.00 -0.38 0.00 -0.26 0.00 0.00 58.87 58.18 1k23 n SER 211 Cb 0.54 -0.01 -0.06 0.00 -0.26 0.00 0.00 64.21 64.41 1k23 n SER 211 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 1k23 s LYS 212 N -0.00 4.06 -0.22 4.33 -0.14 -1.20 -5.06 119.74 121.51 1k23 s LYS 212 Ca 0.00 0.53 -0.22 0.00 -1.36 0.00 0.00 55.97 54.92 1k23 s LYS 212 Cb 0.00 -3.25 -0.02 0.00 -1.68 0.00 0.00 37.83 32.88 1k23 s LYS 212 CO 0.00 0.61 0.71 0.21 -0.76 0.00 0.00 175.35 176.12 1k23 s LYS 213 N -0.89 4.18 0.07 1.68 2.20 -1.26 -2.67 119.74 123.05 1k23 s LYS 213 Ca 0.26 0.74 0.02 0.00 -0.36 0.00 0.00 55.97 56.62 1k23 s LYS 213 Cb -0.17 -3.62 -0.03 0.00 -1.51 0.00 0.00 37.83 32.49 1k23 s LYS 213 CO 0.15 -0.38 -0.07 0.08 -0.36 0.00 0.00 175.35 174.77 1k23 s VAL 214 N 2.38 0.60 -0.03 4.02 1.01 -0.35 -0.42 120.40 127.61 1k23 s VAL 214 Ca 0.31 -1.55 0.00 0.00 0.00 0.00 0.00 61.98 60.74 1k23 s VAL 214 Cb -0.16 -1.19 0.03 0.00 0.00 0.00 0.00 36.38 35.06 1k23 s VAL 214 CO 0.09 -0.66 0.02 -0.70 0.00 0.00 0.00 175.10 173.85 1k23 s GLU 215 N -2.83 0.13 -0.17 2.72 2.12 -0.70 -0.32 118.70 119.65 1k23 s GLU 215 Ca 0.02 0.15 0.01 0.00 0.36 0.00 0.00 54.97 55.50 1k23 s GLU 215 Cb -0.01 -0.39 0.02 0.00 0.26 0.00 0.00 34.13 34.01 1k23 s GLU 215 CO -0.03 -0.17 -0.16 0.42 -0.54 0.00 0.00 175.26 174.78 1k23 s ILE 216 N 1.14 1.81 0.02 -3.70 1.01 -0.82 -1.18 121.20 119.48 1k23 s ILE 216 Ca -0.08 -0.84 0.04 0.00 0.00 0.00 0.00 60.65 59.77 1k23 s ILE 216 Cb -0.13 -1.69 -0.03 0.00 0.01 0.00 0.00 42.46 40.61 1k23 s ILE 216 CO -0.02 0.45 -0.07 0.00 0.00 0.00 0.00 174.94 175.30 1k23 s ALA 217 N 1.38 3.01 0.06 9.38 0.00 -0.73 -2.74 121.76 132.12 1k23 s ALA 217 Ca 0.04 -1.05 0.08 0.00 0.00 0.00 0.00 51.96 51.03 1k23 s ALA 217 Cb -0.13 -1.10 -0.03 0.00 0.00 0.00 0.00 23.12 21.86 1k23 s ALA 217 CO -0.11 0.62 -0.22 -1.14 0.00 0.00 0.00 175.76 174.90 1k23 s GLN 218 N -1.53 1.41 -0.03 0.00 0.74 -0.65 -0.12 119.66 119.48 1k23 s GLN 218 Ca 0.18 -1.04 -0.01 0.00 0.05 0.00 0.00 55.36 54.54 1k23 s GLN 218 Cb -0.11 -1.59 0.03 0.00 1.10 0.00 0.00 33.01 32.44 1k23 s GLN 218 CO 0.08 0.40 0.04 0.08 -0.55 0.00 0.00 175.29 175.34 1k23 s VAL 219 N -0.89 -0.05 -0.23 1.34 1.01 -0.86 -4.01 120.40 116.71 1k23 s VAL 219 Ca 0.08 0.28 -0.08 0.00 0.00 0.00 0.00 61.98 62.26 1k23 s VAL 219 Cb -0.09 -0.12 -0.04 0.00 0.00 0.00 0.00 36.38 36.12 1k23 s VAL 219 CO 0.03 0.13 0.09 0.20 0.00 0.00 0.00 175.10 175.55 1k23 s ASN 220 N 1.46 5.54 0.24 3.32 0.01 -1.26 -1.06 114.94 123.19 1k23 s ASN 220 Ca -0.04 -0.04 0.01 0.00 -0.71 0.00 0.00 52.86 52.07 1k23 s ASN 220 Cb -0.13 -1.98 -0.05 0.00 0.41 0.00 0.00 41.25 39.50 1k23 s ASN 220 CO -0.03 0.05 0.11 0.28 -1.51 0.00 0.00 177.10 175.99 1k23 s THR 221 N 1.13 0.41 -2.38 1.60 -1.32 -0.44 -4.98 115.64 109.66 1k23 s THR 221 Ca 0.05 -2.00 0.23 0.00 -1.21 0.00 0.00 61.69 58.76 1k23 s THR 221 Cb -0.14 -2.60 0.44 0.00 -1.51 0.00 0.00 72.50 68.68 1k23 s THR 221 CO 0.04 -0.00 1.40 1.33 -2.21 0.00 0.00 174.62 175.18 1k23 n VAL 222 N -0.41 0.55 -3.15 5.08 0.24 -1.26 -1.58 118.33 117.79 1k23 n VAL 222 Ca 0.01 -0.77 0.04 0.00 -2.04 0.00 0.00 64.34 61.58 1k23 n VAL 222 Cb 0.66 0.95 -0.00 0.00 -1.47 0.00 0.00 33.84 33.97 1k23 n VAL 222 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 1k23 s ASP 223 N -1.43 -1.25 0.53 -1.34 -1.08 -1.26 -4.82 116.67 106.03 1k23 s ASP 223 Ca 0.39 0.34 0.25 0.00 -0.52 0.00 0.00 52.55 53.01 1k23 s ASP 223 Cb 0.23 1.87 1.40 0.00 -1.46 0.00 0.00 42.92 44.96 1k23 s ASP 223 CO 0.31 -0.23 2.01 0.40 0.52 0.00 0.00 175.17 178.18 1k23 h ILE 224 N 5.67 0.73 -1.00 4.11 2.04 -1.90 -1.09 117.51 126.07 1k23 h ILE 224 Ca -0.09 0.00 0.20 0.00 1.00 0.00 0.00 64.86 65.97 1k23 h ILE 224 Cb 1.18 0.75 -0.11 0.00 -0.74 0.00 0.00 36.82 37.91 1k23 h ILE 224 CO 0.11 0.00 0.61 -0.08 0.00 0.00 0.00 178.15 178.79 1k23 h GLU 225 N 0.00 0.71 -0.66 2.37 4.57 -1.97 0.14 114.58 119.74 1k23 h GLU 225 Ca 0.23 -0.04 0.06 0.00 -1.18 0.00 0.00 59.36 58.43 1k23 h GLU 225 Cb 0.93 -0.16 -0.04 0.00 -0.16 0.00 0.00 28.75 29.32 1k23 h GLU 225 CO -0.00 0.47 0.44 -0.44 -1.18 0.00 0.00 179.01 178.29 1k23 h ASP 226 N 0.73 0.59 0.29 1.04 3.32 -1.62 -1.95 116.42 118.82 1k23 h ASP 226 Ca 0.58 0.00 -0.23 0.00 0.02 0.00 0.00 57.03 57.40 1k23 h ASP 226 Cb 0.95 -0.13 -0.04 0.00 0.22 0.00 0.00 39.33 40.33 1k23 h ASP 226 CO -0.38 0.39 -1.92 0.52 -1.72 0.00 0.00 179.24 176.13 1k23 n VAL 227 N -4.48 1.12 0.09 -1.35 0.31 -0.06 -4.32 118.33 109.65 1k23 n VAL 227 Ca 0.09 -0.74 -0.06 0.00 -0.01 0.00 0.00 64.34 63.62 1k23 n VAL 227 Cb 0.22 -0.55 0.06 0.00 -0.91 0.00 0.00 33.84 32.66 1k23 n VAL 227 CO 0.00 0.00 0.00 0.50 -1.32 0.00 0.00 176.83 176.01 1k23 h LYS 228 N 0.00 0.18 0.00 5.55 3.64 -0.63 -3.00 116.57 122.31 1k23 h LYS 228 Ca -0.30 -0.16 0.00 0.00 -1.27 0.00 0.00 60.65 58.92 1k23 h LYS 228 Cb 1.79 0.04 0.00 0.00 -0.41 0.00 0.00 32.23 33.65 1k23 h LYS 228 CO 0.04 0.85 0.04 -0.22 -2.27 0.00 0.00 179.45 177.88 1k23 h LYS 229 N 0.12 0.00 -0.72 1.90 3.11 -1.55 -1.20 116.57 118.23 1k23 h LYS 229 Ca -0.02 0.00 -0.50 0.00 -2.81 0.00 0.00 60.65 57.31 1k23 h LYS 229 Cb 1.31 0.00 -0.33 0.00 -1.00 0.00 0.00 32.23 32.22 1k23 h LYS 229 CO 0.11 0.00 -0.24 0.54 -2.81 0.00 0.00 179.45 177.05 1k23 n ARG 230 N -2.79 3.00 -0.02 1.90 1.74 -1.13 -4.73 116.66 114.63 1k23 n ARG 230 Ca -0.02 -3.75 -0.06 0.00 -0.77 0.00 0.00 57.85 53.25 1k23 n ARG 230 Cb 0.09 -2.18 0.13 0.00 -1.02 0.00 0.00 32.46 29.48 1k23 n ARG 230 CO 0.00 0.00 0.00 0.37 -1.52 0.00 0.00 177.63 176.48 1k23 h GLN 231 N 1.89 0.58 0.02 5.56 4.15 -1.34 -2.20 115.11 123.77 1k23 h GLN 231 Ca 0.40 -0.26 0.02 0.00 0.77 0.00 0.00 58.65 59.57 1k23 h GLN 231 Cb 1.37 -0.01 -0.03 0.00 0.21 0.00 0.00 27.48 29.02 1k23 h GLN 231 CO 0.89 0.84 -0.14 0.00 -1.93 0.00 0.00 178.83 178.49 1k23 h ALA 232 N 1.14 -0.18 -0.27 3.38 0.00 -1.85 0.55 119.26 122.04 1k23 h ALA 232 Ca 0.06 0.00 -0.09 0.00 0.00 0.00 0.00 54.91 54.88 1k23 h ALA 232 Cb 0.82 0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.83 1k23 h ALA 232 CO 0.07 -0.64 -0.20 0.93 0.00 0.00 0.00 179.25 179.40 1k23 h GLU 233 N -0.24 0.49 0.10 0.00 3.07 -1.93 -2.62 114.58 113.44 1k23 h GLU 233 Ca 0.04 -0.17 -0.00 0.00 -0.50 0.00 0.00 59.36 58.73 1k23 h GLU 233 Cb 0.30 -0.04 0.00 0.00 -0.84 0.00 0.00 28.75 28.17 1k23 h GLU 233 CO -0.12 0.67 -0.05 -0.07 -1.40 0.00 0.00 179.01 178.04 1k23 h LEU 234 N 0.44 -0.11 -1.64 1.33 -0.00 -0.83 -2.56 115.31 111.93 1k23 h LEU 234 Ca 0.07 -0.19 0.02 0.00 -0.00 0.00 0.00 57.88 57.78 1k23 h LEU 234 Cb 0.60 0.03 -0.02 0.00 -0.00 0.00 0.00 40.66 41.27 1k23 h LEU 234 CO 0.04 0.13 0.27 -0.33 -0.00 0.00 0.00 178.44 178.55 1k23 h GLU 235 N -0.35 0.47 0.15 1.13 5.08 -0.85 0.21 114.58 120.41 1k23 h GLU 235 Ca -0.01 -0.03 -0.01 0.00 -1.00 0.00 0.00 59.36 58.31 1k23 h GLU 235 Cb 0.29 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 29.44 1k23 h GLU 235 CO 0.02 0.31 -0.07 0.00 -1.00 0.00 0.00 179.01 178.27 1k23 h ALA 236 N 1.76 -0.20 -0.20 3.43 0.00 -1.25 -0.19 119.26 122.59 1k23 h ALA 236 Ca 0.16 -0.10 -0.15 0.00 0.00 0.00 0.00 54.91 54.82 1k23 h ALA 236 Cb 0.05 0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 1k23 h ALA 236 CO -0.04 -0.54 -0.48 0.28 0.00 0.00 0.00 179.25 178.46 1k23 h VAL 237 N -0.35 1.31 -0.10 0.00 2.07 -1.14 -2.65 116.25 115.39 1k23 h VAL 237 Ca -0.02 -1.70 -0.01 0.00 0.82 0.00 0.00 66.70 65.79 1k23 h VAL 237 Cb 0.27 1.68 -0.00 0.00 -1.52 0.00 0.00 31.29 31.72 1k23 h VAL 237 CO 0.03 0.53 0.03 0.40 0.02 0.00 0.00 177.57 178.58 1k23 h ILE 238 N 0.43 1.18 -0.41 4.57 2.04 -0.89 -2.30 117.51 122.12 1k23 h ILE 238 Ca 0.02 -0.55 0.06 0.00 1.00 0.00 0.00 64.86 65.39 1k23 h ILE 238 Cb 1.00 1.36 -0.02 0.00 -0.74 0.00 0.00 36.82 38.42 1k23 h ILE 238 CO 0.09 0.16 0.28 0.28 0.00 0.00 0.00 178.15 178.96 1k23 h SER 239 N -0.03 0.25 -0.06 1.72 0.02 -0.97 0.37 113.55 114.85 1k23 h SER 239 Ca 0.03 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 60.97 1k23 h SER 239 Cb 0.23 -0.05 -0.00 0.00 0.14 0.00 0.00 62.40 62.71 1k23 h SER 239 CO -0.00 0.16 -0.00 0.50 -1.14 0.00 0.00 176.83 176.35 1k23 h LYS 240 N 0.28 0.10 -0.75 3.45 3.64 -1.17 -2.29 116.57 119.83 1k23 h LYS 240 Ca 0.18 -0.04 -0.00 0.00 -1.27 0.00 0.00 60.65 59.53 1k23 h LYS 240 Cb 0.36 -0.01 -0.04 0.00 -0.41 0.00 0.00 32.23 32.14 1k23 h LYS 240 CO -0.04 0.40 0.46 0.28 -2.27 0.00 0.00 179.45 178.29 1k23 h VAL 241 N -0.20 1.21 -0.22 2.00 2.07 -0.72 -0.48 116.25 119.90 1k23 h VAL 241 Ca 0.02 -0.44 0.02 0.00 0.82 0.00 0.00 66.70 67.11 1k23 h VAL 241 Cb 0.36 0.15 -0.01 0.00 -1.52 0.00 0.00 31.29 30.26 1k23 h VAL 241 CO 0.00 0.21 0.15 0.58 0.02 0.00 0.00 177.57 178.54 1k23 h VAL 242 N 1.03 1.01 0.04 2.57 2.07 -0.89 -0.94 116.25 121.14 1k23 h VAL 242 Ca 0.27 -0.08 -0.08 0.00 0.82 0.00 0.00 66.70 67.64 1k23 h VAL 242 Cb -0.05 0.77 0.01 0.00 -1.52 0.00 0.00 31.29 30.49 1k23 h VAL 242 CO -0.05 0.04 -0.33 0.00 0.02 0.00 0.00 177.57 177.25 1k23 h ALA 243 N 1.87 -0.02 -0.47 1.67 0.00 -0.61 -1.72 119.26 119.99 1k23 h ALA 243 Ca 0.09 -0.55 -0.04 0.00 0.00 0.00 0.00 54.91 54.40 1k23 h ALA 243 Cb 0.07 0.03 -0.02 0.00 0.00 0.00 0.00 17.79 17.88 1k23 h ALA 243 CO -0.02 0.14 0.11 0.93 0.00 0.00 0.00 179.25 180.41 1k23 h GLU 244 N -0.65 0.71 -0.32 0.00 5.08 -0.86 -3.00 114.58 115.54 1k23 h GLU 244 Ca -0.05 -0.14 0.00 0.00 -1.00 0.00 0.00 59.36 58.17 1k23 h GLU 244 Cb 1.20 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 30.33 1k23 h GLU 244 CO 0.06 0.65 0.00 1.63 -1.00 0.00 0.00 179.01 180.35 1k23 n LYS 245 N -4.29 2.39 -3.88 2.33 5.02 -0.38 -4.98 118.16 114.37 1k23 n LYS 245 Ca 0.03 -2.18 -0.26 0.00 -2.02 0.00 0.00 58.31 53.89 1k23 n LYS 245 Cb 0.21 -1.48 -0.00 0.00 -0.02 0.00 0.00 35.03 33.74 1k23 n LYS 245 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1k23 n ASN 246 N 1.39 -1.11 -4.78 4.39 3.02 -0.92 -4.93 115.26 112.33 1k23 n ASN 246 Ca 0.18 -0.98 -0.39 0.00 -0.03 0.00 0.00 54.58 53.35 1k23 n ASN 246 Cb 0.58 -3.24 -0.06 0.00 -0.61 0.00 0.00 39.78 36.46 1k23 n ASN 246 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1k23 s LEU 247 N -6.86 4.59 0.26 3.41 1.43 -0.69 -4.81 118.68 116.01 1k23 s LEU 247 Ca 0.07 1.67 0.23 0.00 -1.03 0.00 0.00 54.13 55.07 1k23 s LEU 247 Cb -0.02 -3.35 0.21 0.00 0.03 0.00 0.00 46.19 43.06 1k23 s LEU 247 CO 0.87 0.19 1.31 0.44 0.23 0.00 0.00 176.35 179.40 1k23 h ASP 248 N 4.25 0.00 -3.02 2.29 3.32 -1.08 -3.44 116.42 118.74 1k23 h ASP 248 Ca -0.47 -0.04 0.05 0.00 0.02 0.00 0.00 57.03 56.59 1k23 h ASP 248 Cb 1.20 0.00 -0.24 0.00 0.22 0.00 0.00 39.33 40.52 1k23 h ASP 248 CO 0.66 0.02 0.22 -0.22 -1.72 0.00 0.00 179.24 178.20 1k23 s LEU 249 N -5.36 -0.70 -0.21 1.55 2.96 -1.20 -0.32 118.68 115.39 1k23 s LEU 249 Ca 0.04 1.19 0.01 0.00 -0.22 0.00 0.00 54.13 55.14 1k23 s LEU 249 Cb 0.09 2.12 0.05 0.00 0.50 0.00 0.00 46.19 48.95 1k23 s LEU 249 CO 0.73 -0.19 -0.07 0.12 -1.32 0.00 0.00 176.35 175.62 1k23 s PHE 250 N 1.15 2.30 -0.34 5.38 5.36 -0.61 -1.73 117.98 129.50 1k23 s PHE 250 Ca -0.06 -1.62 -0.09 0.00 -0.96 0.00 0.00 56.93 54.20 1k23 s PHE 250 Cb -0.05 -1.56 0.02 0.00 -0.34 0.00 0.00 43.02 41.10 1k23 s PHE 250 CO -0.13 -0.74 0.15 -1.17 -1.46 0.00 0.00 175.22 171.86 1k23 s LEU 251 N 1.43 4.35 -0.13 6.12 2.96 -0.32 -2.04 118.68 131.04 1k23 s LEU 251 Ca -0.04 -0.90 -0.20 0.00 -0.22 0.00 0.00 54.13 52.77 1k23 s LEU 251 Cb -0.18 -1.95 -0.04 0.00 0.50 0.00 0.00 46.19 44.53 1k23 s LEU 251 CO -0.07 -0.30 0.56 -0.22 -1.32 0.00 0.00 176.35 175.00 1k23 s LEU 252 N 1.51 4.24 -0.42 -0.68 2.96 -0.09 -1.77 118.68 124.44 1k23 s LEU 252 Ca 0.02 0.89 -0.04 0.00 -0.22 0.00 0.00 54.13 54.78 1k23 s LEU 252 Cb -0.18 -2.82 0.11 0.00 0.50 0.00 0.00 46.19 43.80 1k23 s LEU 252 CO 0.05 -0.10 0.23 -0.69 -1.32 0.00 0.00 176.35 174.51 1k23 s VAL 253 N 1.03 3.41 -0.77 1.68 1.01 0.83 -0.84 120.40 126.75 1k23 s VAL 253 Ca 0.29 -2.04 -0.21 0.00 0.00 0.00 0.00 61.98 60.02 1k23 s VAL 253 Cb -0.16 -3.32 0.10 0.00 0.00 0.00 0.00 36.38 33.00 1k23 s VAL 253 CO 0.12 -0.71 1.01 -0.63 0.00 0.00 0.00 175.10 174.90 1k23 s ILE 254 N 1.15 4.54 -0.04 2.22 1.01 0.15 -2.02 121.20 128.21 1k23 s ILE 254 Ca 0.08 -0.96 -0.25 0.00 0.00 0.00 0.00 60.65 59.52 1k23 s ILE 254 Cb -0.23 -4.71 -0.04 0.00 0.01 0.00 0.00 42.46 37.49 1k23 s ILE 254 CO -0.04 -1.45 0.75 -0.89 0.00 0.00 0.00 174.94 173.31 1k23 s THR 255 N 3.33 4.99 -0.55 2.92 2.01 -0.22 -0.55 115.64 127.56 1k23 s THR 255 Ca 0.26 1.55 -0.19 0.00 0.31 0.00 0.00 61.69 63.62 1k23 s THR 255 Cb -0.12 -4.09 0.08 0.00 0.01 0.00 0.00 72.50 68.38 1k23 s THR 255 CO 0.01 0.25 0.69 -0.62 -0.69 0.00 0.00 174.62 174.26 1k23 s ASP 256 N 0.73 6.21 0.10 3.53 -1.08 -0.24 -1.32 116.67 124.60 1k23 s ASP 256 Ca 0.40 -1.09 0.14 0.00 -0.52 0.00 0.00 52.55 51.48 1k23 s ASP 256 Cb -0.18 -2.31 0.62 0.00 -1.46 0.00 0.00 42.92 39.59 1k23 s ASP 256 CO 0.20 -1.03 1.43 2.30 0.52 0.00 0.00 175.17 178.59 1k23 n ILE 257 N 5.64 1.21 -0.08 4.11 -5.35 -0.61 -1.01 119.36 123.26 1k23 n ILE 257 Ca -0.07 0.37 -0.16 0.00 -0.27 0.00 0.00 62.75 62.62 1k23 n ILE 257 Cb 0.44 -1.25 -0.12 0.00 -1.74 0.00 0.00 39.64 36.98 1k23 n ILE 257 CO 0.00 0.00 0.00 -0.07 -1.76 0.00 0.00 176.55 174.72 1k23 h LEU 258 N 0.00 0.00 -0.85 7.28 3.38 -1.88 -3.37 115.31 119.87 1k23 h LEU 258 Ca 0.00 -0.77 0.00 0.00 0.09 0.00 0.00 57.88 57.20 1k23 h LEU 258 Cb 0.18 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.93 1k23 h LEU 258 CO 0.00 1.12 -0.18 -0.62 0.09 0.00 0.00 178.44 178.86 1k23 n GLU 259 N -4.56 1.30 -2.55 1.13 -0.58 -1.15 -4.91 120.64 109.31 1k23 n GLU 259 Ca -0.16 -0.85 -0.17 0.00 -0.42 0.00 0.00 57.16 55.56 1k23 n GLU 259 Cb 0.51 -1.48 -0.00 0.00 -0.57 0.00 0.00 31.44 29.90 1k23 n GLU 259 CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74 1k23 n ASN 260 N -0.11 -4.81 -4.38 1.62 3.02 -0.18 -4.87 115.26 105.55 1k23 n ASN 260 Ca 0.14 0.03 -0.28 0.00 -0.03 0.00 0.00 54.58 54.44 1k23 n ASN 260 Cb 0.39 -4.02 -0.13 0.00 -0.61 0.00 0.00 39.78 35.41 1k23 n ASN 260 CO 0.00 0.00 0.00 -1.81 -2.62 0.00 0.00 177.26 172.83 1k23 s ASP 261 N -2.15 3.23 -0.04 6.41 1.01 -1.24 -3.00 116.67 120.89 1k23 s ASP 261 Ca 0.06 -0.76 0.01 0.00 0.71 0.00 0.00 52.55 52.57 1k23 s ASP 261 Cb -0.03 -0.21 0.02 0.00 1.01 0.00 0.00 42.92 43.71 1k23 s ASP 261 CO 0.07 0.15 -0.03 -0.94 0.21 0.00 0.00 175.17 174.64 1k23 s SER 262 N -2.14 0.72 0.19 0.27 1.04 -0.93 -1.08 113.70 111.78 1k23 s SER 262 Ca 0.14 -0.09 -0.30 0.00 0.48 0.00 0.00 55.95 56.18 1k23 s SER 262 Cb -0.10 -0.35 -0.08 0.00 0.10 0.00 0.00 66.02 65.59 1k23 s SER 262 CO 0.06 -0.06 0.95 -0.22 0.98 0.00 0.00 173.24 174.95 1k23 s LEU 263 N 0.90 4.60 -0.09 2.42 0.20 0.28 -1.25 118.68 125.74 1k23 s LEU 263 Ca -0.11 1.90 -0.00 0.00 0.69 0.00 0.00 54.13 56.61 1k23 s LEU 263 Cb -0.14 -3.60 -0.03 0.00 -0.43 0.00 0.00 46.19 41.99 1k23 s LEU 263 CO -0.00 0.08 -0.07 0.00 -0.29 0.00 0.00 176.35 176.06 1k23 s ALA 264 N -0.76 2.93 -0.33 5.97 0.00 -0.47 0.31 121.76 129.41 1k23 s ALA 264 Ca 0.43 -0.88 0.03 0.00 0.00 0.00 0.00 51.96 51.54 1k23 s ALA 264 Cb -0.25 -1.28 0.10 0.00 0.00 0.00 0.00 23.12 21.69 1k23 s ALA 264 CO 0.31 0.47 0.04 -1.17 0.00 0.00 0.00 175.76 175.41 1k23 s LEU 265 N -0.45 4.34 -0.19 0.00 2.96 -0.02 -2.36 118.68 122.96 1k23 s LEU 265 Ca 0.07 -2.02 -0.08 0.00 -0.22 0.00 0.00 54.13 51.88 1k23 s LEU 265 Cb -0.12 -1.53 -0.04 0.00 0.50 0.00 0.00 46.19 45.00 1k23 s LEU 265 CO 0.02 -0.37 0.07 0.00 -1.32 0.00 0.00 176.35 174.75 1k23 s ALA 266 N 1.01 3.40 -0.14 5.97 0.00 -0.79 -0.91 121.76 130.29 1k23 s ALA 266 Ca 0.09 -0.79 -0.01 0.00 0.00 0.00 0.00 51.96 51.25 1k23 s ALA 266 Cb -0.19 -1.96 0.04 0.00 0.00 0.00 0.00 23.12 21.01 1k23 s ALA 266 CO -0.10 0.10 -0.03 0.42 0.00 0.00 0.00 175.76 176.16 1k23 s ILE 267 N 0.51 0.83 -5.00 0.00 -1.09 -0.86 -4.79 121.20 110.80 1k23 s ILE 267 Ca 0.03 -0.40 0.00 0.00 -2.23 0.00 0.00 60.65 58.05 1k23 s ILE 267 Cb -0.13 -1.04 0.00 0.00 -1.58 0.00 0.00 42.46 39.71 1k23 s ILE 267 CO 0.01 0.13 0.00 0.61 -1.23 0.00 0.00 174.94 174.46 1k23 n GLY 268 N 4.98 -1.68 0.13 6.18 0.00 -1.26 -1.57 105.19 111.97 1k23 n GLY 268 Ca -0.10 -1.31 -0.20 0.00 0.00 0.00 0.00 46.02 44.41 1k23 n GLY 268 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 1k23 h ASN 269 N 0.00 0.56 -0.14 1.61 -0.26 -0.96 -3.23 115.58 113.16 1k23 h ASN 269 Ca 0.00 -0.89 -0.01 0.00 -0.56 0.00 0.00 56.30 54.84 1k23 h ASN 269 Cb 0.00 -0.18 -0.01 0.00 -1.06 0.00 0.00 38.32 37.07 1k23 h ASN 269 CO 0.00 1.40 0.01 -0.62 -1.06 0.00 0.00 177.43 177.16 1k23 n GLU 270 N -4.08 1.87 0.02 0.81 -0.58 -0.67 -4.24 120.64 113.78 1k23 n GLU 270 Ca -0.13 -0.73 0.02 0.00 -0.42 0.00 0.00 57.16 55.90 1k23 n GLU 270 Cb 0.83 -1.65 0.11 0.00 -0.57 0.00 0.00 31.44 30.16 1k23 n GLU 270 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1k23 n ALA 271 N 0.14 1.07 0.39 0.62 0.00 -1.22 -0.06 120.51 121.45 1k23 n ALA 271 Ca 0.07 0.03 0.12 0.00 0.00 0.00 0.00 53.44 53.65 1k23 n ALA 271 Cb 0.49 -1.07 0.12 0.00 0.00 0.00 0.00 19.45 19.00 1k23 n ALA 271 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1k23 h ALA 272 N 2.04 0.59 0.00 0.00 0.00 -1.88 -3.28 119.26 116.73 1k23 h ALA 272 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 1k23 h ALA 272 Cb 0.02 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.81 1k23 h ALA 272 CO 0.00 0.00 -0.05 0.87 0.00 0.00 0.00 179.25 180.07 1k23 h LYS 273 N 0.00 0.00 0.02 0.00 6.56 -0.81 -1.40 116.57 120.94 1k23 h LYS 273 Ca 0.00 0.00 -0.21 0.00 -1.06 0.00 0.00 60.65 59.38 1k23 h LYS 273 Cb 0.85 0.00 -0.01 0.00 -0.57 0.00 0.00 32.23 32.50 1k23 h LYS 273 CO 0.00 0.05 -0.93 0.28 -2.06 0.00 0.00 179.45 176.79 1k23 h VAL 274 N 0.00 1.49 -0.03 0.50 2.07 -1.67 -1.78 116.25 116.83 1k23 h VAL 274 Ca -0.00 -2.68 -0.12 0.00 0.82 0.00 0.00 66.70 64.72 1k23 h VAL 274 Cb 0.54 2.53 -0.01 0.00 -1.52 0.00 0.00 31.29 32.82 1k23 h VAL 274 CO 0.01 0.78 -0.51 -0.33 0.02 0.00 0.00 177.57 177.54 1k23 h GLU 275 N 0.11 0.09 0.03 1.57 5.08 -1.43 -2.71 114.58 117.33 1k23 h GLU 275 Ca -0.06 -0.05 -0.00 0.00 -1.00 0.00 0.00 59.36 58.25 1k23 h GLU 275 Cb 1.57 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.83 1k23 h GLU 275 CO 0.14 0.59 -0.01 -0.22 -1.00 0.00 0.00 179.01 178.51 1k23 h LYS 276 N 0.07 -0.04 0.00 2.33 3.64 -1.28 -1.56 116.57 119.74 1k23 h LYS 276 Ca -0.00 0.00 -0.00 0.00 -1.27 0.00 0.00 60.65 59.38 1k23 h LYS 276 Cb 0.93 0.01 -0.00 0.00 -0.41 0.00 0.00 32.23 32.76 1k23 h LYS 276 CO 0.07 0.20 -0.00 0.00 -2.27 0.00 0.00 179.45 177.45 1k23 h ALA 277 N -0.77 1.33 -0.01 5.00 0.00 -1.42 -2.53 119.26 120.86 1k23 h ALA 277 Ca -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1k23 h ALA 277 Cb 0.25 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.04 1k23 h ALA 277 CO 0.01 0.00 -0.10 1.19 0.00 0.00 0.00 179.25 180.35 1k23 n PHE 278 N -3.57 0.00 -3.23 0.00 3.01 -1.02 -4.87 117.46 107.78 1k23 n PHE 278 Ca -0.03 0.00 -0.10 0.00 1.01 0.00 0.00 57.45 58.33 1k23 n PHE 278 Cb 0.08 0.00 0.03 0.00 -0.01 0.00 0.00 39.48 39.58 1k23 n PHE 278 CO 0.00 0.00 0.00 -1.71 1.01 0.00 0.00 176.76 176.06 1k23 n ASN 279 N -0.14 -7.00 -3.64 4.37 2.85 -0.84 -5.02 115.26 105.84 1k23 n ASN 279 Ca 0.03 -0.44 -0.15 0.00 -0.11 0.00 0.00 54.58 53.92 1k23 n ASN 279 Cb 0.15 -4.88 -0.07 0.00 1.24 0.00 0.00 39.78 36.21 1k23 n ASN 279 CO 0.00 0.00 0.00 0.68 -2.11 0.00 0.00 177.26 175.83 1k23 s VAL 280 N -3.18 0.00 -0.27 3.44 -7.23 -0.65 -5.04 120.40 107.48 1k23 s VAL 280 Ca 0.20 -1.80 0.01 0.00 -1.81 0.00 0.00 61.98 58.59 1k23 s VAL 280 Cb -0.04 -2.50 0.07 0.00 0.56 0.00 0.00 36.38 34.47 1k23 s VAL 280 CO 0.77 0.00 -0.02 -0.89 -0.31 0.00 0.00 175.10 174.65 1k23 s THR 281 N -3.60 1.62 -0.00 5.32 2.01 -1.26 -4.60 115.64 115.13 1k23 s THR 281 Ca 0.35 -1.48 -0.30 0.00 0.31 0.00 0.00 61.69 60.57 1k23 s THR 281 Cb 0.02 -1.98 -0.06 0.00 0.01 0.00 0.00 72.50 70.50 1k23 s THR 281 CO 0.19 -0.27 1.47 -0.76 -0.69 0.00 0.00 174.62 174.56 1k23 s LEU 282 N 1.31 4.32 -0.39 4.42 1.43 -1.26 -4.74 118.68 123.78 1k23 s LEU 282 Ca -0.01 2.17 0.02 0.00 -1.03 0.00 0.00 54.13 55.28 1k23 s LEU 282 Cb -0.19 -3.56 0.12 0.00 0.03 0.00 0.00 46.19 42.59 1k23 s LEU 282 CO -0.09 -0.77 0.16 -1.61 0.23 0.00 0.00 176.35 174.26 1k23 s GLU 283 N 2.67 1.22 0.00 1.70 2.02 -1.15 -4.58 118.70 120.59 1k23 s GLU 283 Ca 0.66 -1.76 0.00 0.00 0.02 0.00 0.00 54.97 53.90 1k23 s GLU 283 Cb -0.33 -2.52 0.00 0.00 0.10 0.00 0.00 34.13 31.38 1k23 s GLU 283 CO 0.27 -1.05 0.00 -1.71 0.02 0.00 0.00 175.26 172.79 1k23 n ASN 284 N 4.05 -1.12 0.00 -0.19 5.15 -1.26 -3.73 115.26 118.16 1k23 n ASN 284 Ca 0.04 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 54.02 1k23 n ASN 284 Cb 0.38 -0.22 0.00 0.00 -0.53 0.00 0.00 39.78 39.41 1k23 n ASN 284 CO 0.00 0.00 0.00 0.59 1.40 0.00 0.00 177.26 179.25 1k23 n ASN 285 N 0.89 -3.46 -4.11 1.20 4.13 -1.26 -5.00 115.26 107.65 1k23 n ASN 285 Ca 0.00 0.00 -0.32 0.00 1.68 0.00 0.00 54.58 55.94 1k23 n ASN 285 Cb 0.05 -1.31 -0.16 0.00 -1.54 0.00 0.00 39.78 36.82 1k23 n ASN 285 CO 0.00 0.00 0.00 -0.89 0.28 0.00 0.00 177.26 176.65 1k23 s THR 286 N -1.86 1.93 -0.00 3.41 2.01 -1.24 -1.88 115.64 118.00 1k23 s THR 286 Ca 0.00 -0.87 0.01 0.00 0.31 0.00 0.00 61.69 61.14 1k23 s THR 286 Cb 0.00 -1.75 -0.00 0.00 0.01 0.00 0.00 72.50 70.76 1k23 s THR 286 CO 0.00 0.52 -0.03 0.00 -0.69 0.00 0.00 174.62 174.42 1k23 s ALA 287 N 1.23 0.27 -0.34 7.40 0.00 -0.99 -2.92 121.76 126.40 1k23 s ALA 287 Ca 0.02 -0.14 -0.27 0.00 0.00 0.00 0.00 51.96 51.57 1k23 s ALA 287 Cb -0.13 -0.07 0.02 0.00 0.00 0.00 0.00 23.12 22.93 1k23 s ALA 287 CO -0.10 0.07 1.00 -1.17 0.00 0.00 0.00 175.76 175.56 1k23 s LEU 288 N -0.07 3.95 -0.79 0.00 2.96 -1.26 -1.37 118.68 122.10 1k23 s LEU 288 Ca 0.01 0.84 -0.18 0.00 -0.22 0.00 0.00 54.13 54.58 1k23 s LEU 288 Cb -0.01 -3.41 0.13 0.00 0.50 0.00 0.00 46.19 43.40 1k23 s LEU 288 CO -0.00 -0.86 0.93 -0.76 -1.32 0.00 0.00 176.35 174.33 1k23 s LEU 289 N 3.57 5.40 0.38 -0.68 1.43 -0.38 -4.98 118.68 123.42 1k23 s LEU 289 Ca 0.42 -1.89 -0.27 0.00 -1.03 0.00 0.00 54.13 51.36 1k23 s LEU 289 Cb -0.12 -2.34 -0.10 0.00 0.03 0.00 0.00 46.19 43.66 1k23 s LEU 289 CO 0.17 -1.03 1.38 -0.54 0.23 0.00 0.00 176.35 176.56 1k23 s LYS 290 N 2.36 4.10 0.00 1.70 1.02 -1.26 -2.18 119.74 125.47 1k23 s LYS 290 Ca 0.23 2.35 0.00 0.00 0.02 0.00 0.00 55.97 58.57 1k23 s LYS 290 Cb -0.12 -2.91 0.00 0.00 -0.52 0.00 0.00 37.83 34.27 1k23 s LYS 290 CO -0.03 -0.45 0.00 0.41 -0.92 0.00 0.00 175.35 174.36 1k23 n GLY 291 N 0.63 1.79 3.68 -3.33 0.00 -1.16 -4.91 105.19 101.88 1k23 n GLY 291 Ca 0.02 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.61 1k23 n GLY 291 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1k23 s VAL 292 N -1.99 4.61 0.00 1.61 1.01 -1.18 -4.83 120.40 119.63 1k23 s VAL 292 Ca 0.00 1.91 0.00 0.00 0.00 0.00 0.00 61.98 63.89 1k23 s VAL 292 Cb 0.00 -4.23 0.00 0.00 0.00 0.00 0.00 36.38 32.15 1k23 s VAL 292 CO 0.00 -0.07 0.00 0.52 0.00 0.00 0.00 175.10 175.55 1k23 n VAL 293 N 4.87 0.00 -5.22 2.92 0.31 -1.26 -3.22 118.33 116.72 1k23 n VAL 293 Ca 0.11 0.00 -0.32 0.00 -0.01 0.00 0.00 64.34 64.12 1k23 n VAL 293 Cb 0.47 -0.06 -0.16 0.00 -0.91 0.00 0.00 33.84 33.18 1k23 n VAL 293 CO 0.00 0.00 0.00 -0.55 -1.32 0.00 0.00 176.83 174.96 1k23 s SER 294 N -1.13 3.17 0.07 4.52 0.15 -1.26 -5.02 113.70 114.21 1k23 s SER 294 Ca 0.00 -0.48 0.19 0.00 0.70 0.00 0.00 55.95 56.37 1k23 s SER 294 Cb 0.00 -0.82 -0.13 0.00 -1.71 0.00 0.00 66.02 63.36 1k23 s SER 294 CO 0.00 0.26 0.79 -2.11 1.20 0.00 0.00 173.24 173.38 1k23 n ARG 295 N 2.87 0.63 0.06 5.44 1.85 -1.26 -1.79 116.66 124.46 1k23 n ARG 295 Ca -0.17 0.12 -0.10 0.00 -1.00 0.00 0.00 57.85 56.71 1k23 n ARG 295 Cb 0.52 -1.76 0.03 0.00 -1.05 0.00 0.00 32.46 30.20 1k23 n ARG 295 CO 0.00 0.00 0.00 0.87 -0.01 0.00 0.00 177.63 178.49 1k23 h LYS 296 N 0.00 0.37 0.00 2.89 1.79 -1.96 0.33 116.57 119.99 1k23 h LYS 296 Ca -0.12 -0.31 -0.35 0.00 -2.18 0.00 0.00 60.65 57.69 1k23 h LYS 296 Cb 1.38 0.07 -0.07 0.00 -1.58 0.00 0.00 32.23 32.03 1k23 h LYS 296 CO 0.02 0.96 -2.32 1.63 -1.08 0.00 0.00 179.45 178.67 1k23 n LYS 297 N -3.81 0.85 -0.00 3.15 5.02 -1.26 -4.50 118.16 117.60 1k23 n LYS 297 Ca -0.04 0.00 0.03 0.00 -2.02 0.00 0.00 58.31 56.28 1k23 n LYS 297 Cb 0.72 -1.49 -0.05 0.00 -0.02 0.00 0.00 35.03 34.19 1k23 n LYS 297 CO 0.00 0.00 0.00 1.04 -0.52 0.00 0.00 177.40 177.92 1k23 n GLN 298 N -2.75 0.48 -0.09 1.97 6.02 -0.74 -4.68 117.38 117.59 1k23 n GLN 298 Ca -0.32 -0.05 -0.15 0.00 -0.01 0.00 0.00 57.00 56.46 1k23 n GLN 298 Cb 1.11 -1.13 -0.05 0.00 1.02 0.00 0.00 30.24 31.19 1k23 n GLN 298 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 177.06 176.33 1k23 n VAL 299 N -1.68 1.44 -0.21 5.09 0.31 -0.89 -4.43 118.33 117.95 1k23 n VAL 299 Ca -0.01 -0.03 -0.01 0.00 -0.01 0.00 0.00 64.34 64.28 1k23 n VAL 299 Cb 0.16 -2.11 0.10 0.00 -0.91 0.00 0.00 33.84 31.07 1k23 n VAL 299 CO 0.00 0.00 0.00 0.58 -1.32 0.00 0.00 176.83 176.09 1k23 h VAL 300 N -0.90 0.91 -0.04 2.52 2.07 -0.61 -2.04 116.25 118.14 1k23 h VAL 300 Ca -0.24 -0.20 -0.11 0.00 0.82 0.00 0.00 66.70 66.98 1k23 h VAL 300 Cb 1.15 0.28 -0.01 0.00 -1.52 0.00 0.00 31.29 31.19 1k23 h VAL 300 CO -0.14 0.10 -0.47 1.55 0.02 0.00 0.00 177.57 178.63 1k23 h PRO 301 N 0.57 0.11 0.00 1.57 0.13 -1.80 -2.03 132.00 130.55 1k23 h PRO 301 Ca 0.29 -0.06 -0.02 0.00 -0.87 0.00 0.00 66.00 65.34 1k23 h PRO 301 Cb 0.24 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.37 1k23 h PRO 301 CO -0.21 0.56 -0.39 -0.24 -0.23 0.00 0.00 178.00 177.48 1k23 h VAL 302 N 0.09 0.15 0.00 1.56 3.04 -1.72 -3.20 116.25 116.17 1k23 h VAL 302 Ca 0.00 -1.23 -0.11 0.00 -1.01 0.00 0.00 66.70 64.35 1k23 h VAL 302 Cb 0.87 1.94 -0.02 0.00 -2.01 0.00 0.00 31.29 32.07 1k23 h VAL 302 CO 0.07 0.09 -1.46 -0.11 -1.01 0.00 0.00 177.57 175.15 1k23 n LEU 303 N -3.01 0.67 0.05 3.16 0.00 -0.79 -3.57 117.00 113.51 1k23 n LEU 303 Ca 0.02 0.28 -0.09 0.00 0.00 0.00 0.00 56.01 56.22 1k23 n LEU 303 Cb 0.58 0.06 0.05 0.00 0.00 0.00 0.00 43.42 44.11 1k23 n LEU 303 CO 0.37 0.06 0.40 0.74 0.00 0.00 0.00 177.39 178.95 1k23 h THR 304 N 0.00 1.37 -0.33 1.96 2.02 -1.44 -2.83 112.91 113.65 1k23 h THR 304 Ca -0.12 -2.06 0.00 0.00 0.77 0.00 0.00 66.41 64.99 1k23 h THR 304 Cb 1.39 2.04 0.00 0.00 -1.74 0.00 0.00 68.15 69.84 1k23 h THR 304 CO 0.02 0.62 0.00 -0.67 0.37 0.00 0.00 175.52 175.87 1k23 n ASP 305 N -3.86 1.78 -2.11 4.18 -0.08 -1.21 -4.14 116.55 111.11 1k23 n ASP 305 Ca -0.04 -1.99 -0.27 0.00 -1.51 0.00 0.00 54.79 50.98 1k23 n ASP 305 Cb 0.67 -0.22 0.04 0.00 2.34 0.00 0.00 41.12 43.95 1k23 n ASP 305 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1k23 n ALA 306 N 0.47 5.43 -1.27 -1.67 0.00 -1.07 -5.06 120.51 117.35 1k23 n ALA 306 Ca 0.11 -3.69 0.00 0.00 0.00 0.00 0.00 53.44 49.87 1k23 n ALA 306 Cb 0.28 -0.78 0.00 0.00 0.00 0.00 0.00 19.45 18.95 1k23 n ALA 306 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50