#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3kts n GLU 2 N 0.00 0.00 -3.66 3.23 1.02 -1.26 -5.13 120.64 114.85 3kts n GLU 2 Ca 0.00 0.00 -0.08 0.00 -0.02 0.00 0.00 57.16 57.06 3kts n GLU 2 Cb 0.00 0.00 -0.08 0.00 -0.02 0.00 0.00 31.44 31.34 3kts n GLU 2 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 3kts s LEU 3 N -0.54 -0.67 0.31 -4.62 1.43 -1.26 -5.07 118.68 108.27 3kts s LEU 3 Ca 0.00 1.31 0.05 0.00 -1.03 0.00 0.00 54.13 54.45 3kts s LEU 3 Cb 0.00 2.02 0.84 0.00 0.03 0.00 0.00 46.19 49.08 3kts s LEU 3 CO 0.00 -0.22 1.58 -0.65 0.23 0.00 0.00 176.35 177.29 3kts h PRO 4 N 7.12 0.03 -5.54 1.29 0.11 -2.02 -3.31 132.00 129.68 3kts h PRO 4 Ca -0.31 -0.00 -0.43 0.00 0.11 0.00 0.00 66.00 65.36 3kts h PRO 4 Cb 1.21 -0.01 -0.05 0.00 0.11 0.00 0.00 31.00 32.26 3kts h PRO 4 CO 0.20 0.02 1.41 1.97 -0.21 0.00 0.00 178.00 181.40 3kts n PHE 5 N -5.42 3.24 -4.22 0.65 1.16 -1.26 -4.90 117.46 106.70 3kts n PHE 5 Ca 0.25 -1.85 -0.35 0.00 -1.87 0.00 0.00 57.45 53.63 3kts n PHE 5 Cb 0.83 -2.61 -0.09 0.00 -1.61 0.00 0.00 39.48 36.00 3kts n PHE 5 CO 0.00 0.00 0.00 -1.12 -1.87 0.00 0.00 176.76 173.77 3kts s SER 6 N 5.82 5.54 -1.54 5.98 0.01 -1.25 -4.53 113.70 123.74 3kts s SER 6 Ca 0.64 0.21 -0.11 0.00 1.31 0.00 0.00 55.95 58.00 3kts s SER 6 Cb 0.01 -1.67 0.08 0.00 0.21 0.00 0.00 66.02 64.65 3kts s SER 6 CO 0.12 0.36 0.76 0.59 0.41 0.00 0.00 173.24 175.48 3kts n ASN 7 N 2.28 -2.86 -3.41 2.44 5.03 -1.26 -4.96 115.26 112.52 3kts n ASN 7 Ca -0.19 -0.91 -0.26 0.00 0.87 0.00 0.00 54.58 54.09 3kts n ASN 7 Cb 0.54 -3.34 -0.10 0.00 -1.02 0.00 0.00 39.78 35.85 3kts n ASN 7 CO 0.00 0.00 0.00 -1.58 -1.83 0.00 0.00 177.26 173.85 3kts s GLN 8 N -6.64 0.69 0.22 3.52 0.74 -1.26 -5.01 119.66 111.92 3kts s GLN 8 Ca 0.46 -1.54 -0.07 0.00 0.05 0.00 0.00 55.36 54.26 3kts s GLN 8 Cb -0.24 -1.24 0.18 0.00 1.10 0.00 0.00 33.01 32.81 3kts s GLN 8 CO 0.87 -1.27 1.77 0.77 -0.55 0.00 0.00 175.29 176.88 3kts h SER 9 N 6.48 1.06 -3.39 6.67 0.02 -1.93 -3.42 113.55 119.05 3kts h SER 9 Ca 0.13 -0.18 -0.65 0.00 -0.84 0.00 0.00 61.79 60.25 3kts h SER 9 Cb 0.96 -0.28 -0.24 0.00 0.14 0.00 0.00 62.40 62.98 3kts h SER 9 CO 0.28 0.97 -0.69 -0.63 -1.14 0.00 0.00 176.83 175.62 3kts s ILE 10 N -5.45 3.69 -0.36 3.27 1.09 -1.26 0.42 121.20 122.60 3kts s ILE 10 Ca -0.12 -0.41 -0.06 0.00 -1.10 0.00 0.00 60.65 58.96 3kts s ILE 10 Cb 0.15 -2.65 0.06 0.00 -1.06 0.00 0.00 42.46 38.96 3kts s ILE 10 CO 0.84 0.45 0.13 -0.63 -0.10 0.00 0.00 174.94 175.63 3kts s ILE 11 N 0.93 3.74 0.27 2.92 1.01 0.14 -4.92 121.20 125.29 3kts s ILE 11 Ca 0.00 -1.31 -0.30 0.00 0.00 0.00 0.00 60.65 59.05 3kts s ILE 11 Cb -0.15 -3.20 -0.10 0.00 0.01 0.00 0.00 42.46 39.03 3kts s ILE 11 CO 0.01 -0.29 1.37 -2.16 0.00 0.00 0.00 174.94 173.88 3kts s PRO 12 N 1.36 4.32 -0.18 2.79 0.04 -1.26 -2.87 135.00 139.21 3kts s PRO 12 Ca -0.00 2.23 -0.06 0.00 0.04 0.00 0.00 61.00 63.20 3kts s PRO 12 Cb -0.21 -3.11 -0.04 0.00 0.04 0.00 0.00 34.50 31.19 3kts s PRO 12 CO 0.02 -0.31 0.03 0.00 0.04 0.00 0.00 177.00 176.77 3kts s ALA 13 N -0.35 3.25 -0.08 8.56 0.00 0.87 -0.33 121.76 133.68 3kts s ALA 13 Ca 0.55 -0.81 -0.05 0.00 0.00 0.00 0.00 51.96 51.65 3kts s ALA 13 Cb -0.40 -1.82 -0.04 0.00 0.00 0.00 0.00 23.12 20.86 3kts s ALA 13 CO 0.45 0.12 0.16 0.00 0.00 0.00 0.00 175.76 176.49 3kts s ALA 14 N 0.49 3.91 -0.16 0.00 0.00 0.61 -4.33 121.76 122.28 3kts s ALA 14 Ca 0.01 -0.69 -0.10 0.00 0.00 0.00 0.00 51.96 51.18 3kts s ALA 14 Cb -0.13 -1.94 -0.07 0.00 0.00 0.00 0.00 23.12 20.98 3kts s ALA 14 CO 0.01 0.67 -0.24 0.72 0.00 0.00 0.00 175.76 176.93 3kts n HIS 15 N 1.59 0.00 -2.80 0.00 8.25 -1.26 -2.50 115.22 118.50 3kts n HIS 15 Ca -0.17 0.00 -0.21 0.00 -0.26 0.00 0.00 57.72 57.08 3kts n HIS 15 Cb 0.54 -0.57 0.08 0.00 1.12 0.00 0.00 29.99 31.16 3kts n HIS 15 CO 0.00 0.00 0.00 -0.80 0.64 0.00 0.00 176.34 176.18 3kts s ASN 16 N -6.46 4.82 0.18 0.41 0.01 -1.26 -4.49 114.94 108.16 3kts s ASN 16 Ca -0.24 -0.52 -0.02 0.00 -0.71 0.00 0.00 52.86 51.36 3kts s ASN 16 Cb 0.08 -0.02 0.09 0.00 0.41 0.00 0.00 41.25 41.80 3kts s ASN 16 CO 0.31 -1.51 1.47 -0.61 -1.51 0.00 0.00 177.10 175.25 3kts h GLN 17 N -0.11 0.47 0.00 -0.60 -0.00 -1.98 -3.15 115.11 109.74 3kts h GLN 17 Ca -0.35 -0.34 0.00 0.00 -0.00 0.00 0.00 58.65 57.96 3kts h GLN 17 Cb 1.28 0.06 0.00 0.00 0.00 0.00 0.00 27.48 28.82 3kts h GLN 17 CO 0.42 0.96 0.00 1.57 0.00 0.00 0.00 178.83 181.78 3kts h LYS 18 N 0.34 0.00 -0.34 1.69 2.10 -2.01 -3.27 116.57 115.07 3kts h LYS 18 Ca -0.01 0.00 -0.15 0.00 -2.00 0.00 0.00 60.65 58.49 3kts h LYS 18 Cb 1.21 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 32.53 3kts h LYS 18 CO 0.12 0.00 -0.37 -0.44 -2.00 0.00 0.00 179.45 176.75 3kts h ASP 19 N 0.00 0.84 1.31 7.07 5.19 -1.93 -3.02 116.42 125.89 3kts h ASP 19 Ca 0.00 -0.37 0.00 0.00 -0.62 0.00 0.00 57.03 56.04 3kts h ASP 19 Cb 0.75 -0.24 0.00 0.00 0.18 0.00 0.00 39.33 40.03 3kts h ASP 19 CO 0.00 1.12 0.00 0.00 -3.12 0.00 0.00 179.24 177.24 3kts h MET 20 N 0.65 0.00 -0.52 3.56 -0.00 -1.64 -2.69 114.93 114.29 3kts h MET 20 Ca 0.06 0.00 -0.09 0.00 -0.00 0.00 0.00 59.70 59.67 3kts h MET 20 Cb 0.93 0.00 -0.02 0.00 -0.00 0.00 0.00 31.60 32.51 3kts h MET 20 CO 0.09 0.00 -0.03 0.93 -0.00 0.00 0.00 176.91 177.90 3kts h GLU 21 N 0.00 0.91 -0.58 -0.10 3.07 -1.64 -1.89 114.58 114.35 3kts h GLU 21 Ca 0.00 -0.28 -0.10 0.00 -0.50 0.00 0.00 59.36 58.48 3kts h GLU 21 Cb 0.66 -0.09 -0.02 0.00 -0.84 0.00 0.00 28.75 28.46 3kts h GLU 21 CO 0.00 0.92 -0.02 0.87 -1.40 0.00 0.00 179.01 179.38 3kts h LYS 22 N 0.83 1.04 -0.24 2.33 1.79 -1.48 -3.14 116.57 117.70 3kts h LYS 22 Ca 0.15 -0.34 0.00 0.00 -2.18 0.00 0.00 60.65 58.28 3kts h LYS 22 Cb 0.53 -0.09 0.00 0.00 -1.58 0.00 0.00 32.23 31.10 3kts h LYS 22 CO 0.03 1.04 0.00 0.44 -1.08 0.00 0.00 179.45 179.88 3kts n ILE 23 N -4.19 0.31 0.14 1.86 -5.35 -1.19 -3.39 119.36 107.54 3kts n ILE 23 Ca 0.02 -0.48 0.11 0.00 -0.27 0.00 0.00 62.75 62.14 3kts n ILE 23 Cb 0.36 0.56 0.05 0.00 -1.74 0.00 0.00 39.64 38.87 3kts n ILE 23 CO 0.00 0.00 0.00 0.25 -1.76 0.00 0.00 176.55 175.04 3kts h LEU 24 N 2.92 0.00 -1.45 7.28 5.85 -1.29 -3.28 115.31 125.35 3kts h LEU 24 Ca 0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 3kts h LEU 24 Cb 0.64 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.67 3kts h LEU 24 CO 0.00 0.01 0.00 -0.62 -0.34 0.00 0.00 178.44 177.49 3kts n GLU 25 N -2.81 1.99 -3.57 1.25 1.02 -1.22 -4.97 120.64 112.33 3kts n GLU 25 Ca 0.01 -1.44 -0.25 0.00 -0.02 0.00 0.00 57.16 55.46 3kts n GLU 25 Cb 0.55 -1.47 -0.02 0.00 -0.02 0.00 0.00 31.44 30.48 3kts n GLU 25 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 3kts s LEU 26 N -1.91 4.13 0.35 -4.62 1.02 -1.24 -5.01 118.68 111.41 3kts s LEU 26 Ca 0.34 0.40 0.27 0.00 0.02 0.00 0.00 54.13 55.15 3kts s LEU 26 Cb 0.20 -3.22 0.97 0.00 0.02 0.00 0.00 46.19 44.17 3kts s LEU 26 CO 0.31 -0.17 1.79 -0.78 0.02 0.00 0.00 176.35 177.52 3kts h ASP 27 N 1.30 0.00 -3.86 2.29 3.58 -1.93 -3.45 116.42 114.35 3kts h ASP 27 Ca -0.49 0.00 -0.51 0.00 0.42 0.00 0.00 57.03 56.45 3kts h ASP 27 Cb 1.21 0.00 0.04 0.00 1.72 0.00 0.00 39.33 42.30 3kts h ASP 27 CO 0.64 0.00 0.53 -0.76 -2.88 0.00 0.00 179.24 176.77 3kts s LEU 28 N -5.18 4.44 -0.19 2.28 1.43 -1.26 -4.99 118.68 115.21 3kts s LEU 28 Ca 0.05 2.42 0.13 0.00 -1.03 0.00 0.00 54.13 55.70 3kts s LEU 28 Cb 0.09 -3.71 -0.23 0.00 0.03 0.00 0.00 46.19 42.37 3kts s LEU 28 CO 0.51 -0.38 0.08 1.07 0.23 0.00 0.00 176.35 177.86 3kts n THR 29 N 0.84 1.45 -3.74 5.49 5.66 -1.26 -4.93 114.28 117.78 3kts n THR 29 Ca 0.00 -0.78 -0.35 0.00 -3.05 0.00 0.00 64.05 59.87 3kts n THR 29 Cb 0.44 -0.78 -0.08 0.00 -1.55 0.00 0.00 70.33 68.36 3kts n THR 29 CO 0.00 0.00 0.00 -0.31 -3.05 0.00 0.00 175.07 171.71 3kts s TYR 30 N -2.51 3.42 0.15 1.09 1.51 -1.26 -0.51 117.35 119.24 3kts s TYR 30 Ca -0.16 0.34 0.07 0.00 -1.01 0.00 0.00 57.07 56.32 3kts s TYR 30 Cb 0.07 -2.15 -0.04 0.00 -0.11 0.00 0.00 41.96 39.73 3kts s TYR 30 CO 0.78 0.32 -0.16 0.00 -1.11 0.00 0.00 175.55 175.37 3kts s MET 31 N 0.27 1.16 -0.06 -0.62 0.23 -0.25 -4.09 119.30 115.95 3kts s MET 31 Ca 0.08 -1.33 0.01 0.00 -1.03 0.00 0.00 55.69 53.42 3kts s MET 31 Cb -0.11 -1.13 -0.03 0.00 -1.53 0.00 0.00 34.83 32.03 3kts s MET 31 CO -0.02 0.22 -0.05 0.08 -2.03 0.00 0.00 175.02 173.22 3kts s VAL 32 N -2.12 3.80 -0.16 5.16 1.01 0.56 -0.12 120.40 128.53 3kts s VAL 32 Ca 0.13 -0.50 0.00 0.00 0.00 0.00 0.00 61.98 61.61 3kts s VAL 32 Cb -0.05 -2.58 0.02 0.00 0.00 0.00 0.00 36.38 33.77 3kts s VAL 32 CO 0.05 0.56 -0.15 -0.32 0.00 0.00 0.00 175.10 175.23 3kts s MET 33 N -0.96 2.43 0.00 2.72 1.75 -0.69 -0.29 119.30 124.27 3kts s MET 33 Ca 0.14 -0.63 0.00 0.00 -1.25 0.00 0.00 55.69 53.95 3kts s MET 33 Cb -0.11 -2.22 0.00 0.00 2.84 0.00 0.00 34.83 35.34 3kts s MET 33 CO 0.03 -0.24 0.00 1.28 -0.65 0.00 0.00 175.02 175.44 3kts n LEU 34 N 4.74 0.00 -4.58 4.11 4.77 -1.04 -1.20 117.00 123.80 3kts n LEU 34 Ca -0.18 0.00 -0.40 0.00 -0.03 0.00 0.00 56.01 55.40 3kts n LEU 34 Cb 0.50 -0.03 -0.09 0.00 -2.33 0.00 0.00 43.42 41.47 3kts n LEU 34 CO 0.22 -0.03 0.12 -1.61 -1.33 0.00 0.00 177.39 174.76 3kts s GLU 35 N -0.07 3.81 0.37 3.23 8.01 -1.26 -4.47 118.70 128.33 3kts s GLU 35 Ca 0.00 -0.09 0.02 0.00 0.01 0.00 0.00 54.97 54.91 3kts s GLU 35 Cb 0.00 -3.73 -0.01 0.00 -4.31 0.00 0.00 34.13 26.08 3kts s GLU 35 CO 0.00 -0.44 0.08 0.25 0.01 0.00 0.00 175.26 175.16 3kts n THR 36 N 5.23 0.00 -4.35 3.63 -2.24 -0.68 -4.83 114.28 111.04 3kts n THR 36 Ca -0.07 -2.00 -0.24 0.00 -2.27 0.00 0.00 64.05 59.47 3kts n THR 36 Cb 0.50 0.60 -0.17 0.00 -2.10 0.00 0.00 70.33 69.16 3kts n THR 36 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 3kts s HIS 37 N -2.72 1.30 0.48 4.78 3.76 -1.26 -2.32 115.29 119.31 3kts s HIS 37 Ca 0.11 -0.50 0.13 0.00 -0.15 0.00 0.00 55.06 54.65 3kts s HIS 37 Cb 0.01 -1.01 1.13 0.00 1.11 0.00 0.00 32.58 33.82 3kts s HIS 37 CO 0.08 -0.31 2.11 -0.24 -0.85 0.00 0.00 174.74 175.53 3kts h VAL 38 N 6.05 1.03 -0.00 -0.90 3.04 -1.73 -0.41 116.25 123.33 3kts h VAL 38 Ca -0.32 -0.07 -0.08 0.00 -1.01 0.00 0.00 66.70 65.22 3kts h VAL 38 Cb 1.17 0.81 -0.01 0.00 -2.01 0.00 0.00 31.29 31.25 3kts h VAL 38 CO 0.46 0.04 -0.39 0.00 -1.01 0.00 0.00 177.57 176.66 3kts h ALA 39 N 1.90 1.35 0.00 3.17 0.00 -1.97 -3.08 119.26 120.63 3kts h ALA 39 Ca 0.06 -0.36 0.00 0.00 0.00 0.00 0.00 54.91 54.62 3kts h ALA 39 Cb 0.02 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.74 3kts h ALA 39 CO -0.01 0.49 -1.73 1.04 0.00 0.00 0.00 179.25 179.03 3kts n GLN 40 N -4.08 0.54 -0.10 0.00 6.02 -0.60 -4.74 117.38 114.42 3kts n GLN 40 Ca -0.02 -0.14 -0.06 0.00 -0.01 0.00 0.00 57.00 56.77 3kts n GLN 40 Cb 0.42 -1.54 0.00 0.00 1.02 0.00 0.00 30.24 30.14 3kts n GLN 40 CO 0.00 0.00 0.00 1.25 -1.01 0.00 0.00 177.06 177.30 3kts h LEU 41 N 0.00 -0.62 -1.21 1.08 5.85 -1.02 -1.83 115.31 117.56 3kts h LEU 41 Ca 0.00 0.14 0.02 0.00 0.84 0.00 0.00 57.88 58.88 3kts h LEU 41 Cb 0.91 0.33 -0.04 0.00 0.37 0.00 0.00 40.66 42.23 3kts h LEU 41 CO 0.00 -0.22 0.54 0.50 -0.34 0.00 0.00 178.44 178.92 3kts h LYS 42 N -0.12 1.03 -0.14 1.25 3.64 -1.85 -0.77 116.57 119.61 3kts h LYS 42 Ca 0.18 -0.06 -0.15 0.00 -1.27 0.00 0.00 60.65 59.35 3kts h LYS 42 Cb 0.40 -0.23 0.00 0.00 -0.41 0.00 0.00 32.23 31.99 3kts h LYS 42 CO -0.44 0.68 -0.48 0.00 -2.27 0.00 0.00 179.45 176.94 3kts h ALA 43 N 1.51 0.25 -0.71 5.00 0.00 -1.69 -2.30 119.26 121.31 3kts h ALA 43 Ca 0.31 -0.49 -0.05 0.00 0.00 0.00 0.00 54.91 54.68 3kts h ALA 43 Cb -0.04 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 17.69 3kts h ALA 43 CO -0.08 0.41 0.25 -0.07 0.00 0.00 0.00 179.25 179.76 3kts h LEU 44 N 0.21 1.00 -0.21 0.00 3.38 -0.90 0.71 115.31 119.50 3kts h LEU 44 Ca -0.02 -0.17 -0.03 0.00 0.09 0.00 0.00 57.88 57.76 3kts h LEU 44 Cb 1.11 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 41.60 3kts h LEU 44 CO 0.10 0.91 0.02 0.58 0.09 0.00 0.00 178.44 180.15 3kts h VAL 45 N 1.04 1.23 -0.82 1.22 2.07 -1.25 -2.86 116.25 116.88 3kts h VAL 45 Ca 0.23 -0.79 -0.04 0.00 0.82 0.00 0.00 66.70 66.93 3kts h VAL 45 Cb 0.25 1.34 -0.04 0.00 -1.52 0.00 0.00 31.29 31.33 3kts h VAL 45 CO -0.01 0.24 0.36 0.50 0.02 0.00 0.00 177.57 178.68 3kts h LYS 46 N 0.15 1.21 -0.51 1.57 1.63 -0.84 -2.51 116.57 117.27 3kts h LYS 46 Ca 0.06 -0.20 -0.07 0.00 -0.85 0.00 0.00 60.65 59.60 3kts h LYS 46 Cb 0.34 -0.21 -0.02 0.00 -0.60 0.00 0.00 32.23 31.74 3kts h LYS 46 CO 0.01 0.96 0.05 -0.92 -3.45 0.00 0.00 179.45 176.09 3kts h TYR 47 N 1.19 0.86 -0.17 1.91 3.20 0.45 0.24 116.97 124.64 3kts h TYR 47 Ca 0.28 -0.10 -0.16 0.00 3.14 0.00 0.00 58.73 61.88 3kts h TYR 47 Cb 0.18 -0.24 -0.01 0.00 1.54 0.00 0.00 36.73 38.20 3kts h TYR 47 CO 0.02 0.76 -0.58 0.00 -1.64 0.00 0.00 178.16 176.72 3kts h ALA 48 N 1.28 0.68 -0.02 1.82 0.00 -1.39 -2.05 119.26 119.59 3kts h ALA 48 Ca 0.16 -0.53 -0.18 0.00 0.00 0.00 0.00 54.91 54.36 3kts h ALA 48 Cb 0.40 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 3kts h ALA 48 CO 0.01 0.70 -0.77 1.96 0.00 0.00 0.00 179.25 181.15 3kts h GLN 49 N 0.40 0.20 -0.03 0.00 4.20 -1.04 0.79 115.11 119.64 3kts h GLN 49 Ca 0.00 -0.19 -0.12 0.00 0.06 0.00 0.00 58.65 58.41 3kts h GLN 49 Cb 1.12 0.05 -0.01 0.00 0.30 0.00 0.00 27.48 28.93 3kts h GLN 49 CO 0.11 0.88 -0.53 0.00 -0.67 0.00 0.00 178.83 178.62 3kts h ALA 50 N 1.06 1.08 0.00 3.87 0.00 -0.55 -2.77 119.26 121.95 3kts h ALA 50 Ca -0.03 -0.48 0.00 0.00 0.00 0.00 0.00 54.91 54.40 3kts h ALA 50 Cb 1.36 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 19.06 3kts h ALA 50 CO 0.12 0.66 0.00 0.41 0.00 0.00 0.00 179.25 180.44 3kts n GLY 51 N 0.01 -1.34 0.40 0.00 0.00 -0.77 -4.93 105.19 98.56 3kts n GLY 51 Ca -0.02 -0.12 0.00 0.00 0.00 0.00 0.00 46.02 45.88 3kts n GLY 51 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3kts n GLY 52 N 1.29 1.46 3.48 -0.02 0.00 -0.90 -5.05 105.19 105.45 3kts n GLY 52 Ca 0.11 -0.19 -0.25 0.00 0.00 0.00 0.00 46.02 45.69 3kts n GLY 52 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3kts s LYS 53 N -1.27 1.72 -0.15 1.61 -0.14 0.22 -4.93 119.74 116.81 3kts s LYS 53 Ca 0.00 -1.58 -0.01 0.00 -1.36 0.00 0.00 55.97 53.02 3kts s LYS 53 Cb 0.00 -1.89 -0.01 0.00 -1.68 0.00 0.00 37.83 34.25 3kts s LYS 53 CO 0.00 0.37 -0.11 0.15 -0.76 0.00 0.00 175.35 175.00 3kts s LYS 54 N -3.11 3.39 -0.23 1.68 1.02 0.34 -3.61 119.74 119.21 3kts s LYS 54 Ca 0.26 -0.67 -0.10 0.00 0.02 0.00 0.00 55.97 55.49 3kts s LYS 54 Cb -0.07 -2.72 -0.05 0.00 -0.52 0.00 0.00 37.83 34.47 3kts s LYS 54 CO 0.13 0.12 0.13 0.08 -0.92 0.00 0.00 175.35 174.90 3kts s VAL 55 N 0.60 5.16 -0.53 3.17 1.01 -1.26 -1.09 120.40 127.46 3kts s VAL 55 Ca -0.07 0.11 -0.15 0.00 0.00 0.00 0.00 61.98 61.87 3kts s VAL 55 Cb -0.15 -3.39 0.13 0.00 0.00 0.00 0.00 36.38 32.96 3kts s VAL 55 CO 0.03 0.36 0.47 -0.76 0.00 0.00 0.00 175.10 175.21 3kts s LEU 56 N 0.99 6.08 0.38 3.92 1.43 0.83 0.50 118.68 132.82 3kts s LEU 56 Ca 0.07 -1.78 -0.21 0.00 -1.03 0.00 0.00 54.13 51.17 3kts s LEU 56 Cb -0.13 -2.18 -0.10 0.00 0.03 0.00 0.00 46.19 43.80 3kts s LEU 56 CO 0.04 -0.82 0.90 -0.22 0.23 0.00 0.00 176.35 176.48 3kts s LEU 57 N 1.57 4.06 -0.42 1.79 2.96 -0.28 -1.70 118.68 126.66 3kts s LEU 57 Ca 0.03 1.64 -0.21 0.00 -0.22 0.00 0.00 54.13 55.37 3kts s LEU 57 Cb -0.29 -4.31 0.02 0.00 0.50 0.00 0.00 46.19 42.11 3kts s LEU 57 CO 0.03 -0.25 0.66 -1.00 -1.32 0.00 0.00 176.35 174.47 3kts s HIS 58 N -2.00 3.08 -0.34 5.38 3.76 -0.34 0.90 115.29 125.73 3kts s HIS 58 Ca 0.57 0.08 0.27 0.00 -0.15 0.00 0.00 55.06 55.83 3kts s HIS 58 Cb -0.12 -3.34 0.91 0.00 1.11 0.00 0.00 32.58 31.14 3kts s HIS 58 CO 0.16 -0.83 1.78 0.00 -0.85 0.00 0.00 174.74 175.01 3kts h ALA 59 N 8.79 1.00 -0.01 -1.40 0.00 -1.52 -3.01 119.26 123.11 3kts h ALA 59 Ca -0.26 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.65 3kts h ALA 59 Cb 1.10 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.89 3kts h ALA 59 CO 0.89 0.00 -0.26 -0.25 0.00 0.00 0.00 179.25 179.63 3kts n ASP 60 N -2.72 1.12 -0.72 0.00 10.43 -1.26 -4.27 116.55 119.13 3kts n ASP 60 Ca 0.03 -0.96 0.06 0.00 2.57 0.00 0.00 54.79 56.49 3kts n ASP 60 Cb 0.37 0.15 0.16 0.00 1.84 0.00 0.00 41.12 43.64 3kts n ASP 60 CO 0.00 0.00 0.00 0.18 -1.07 0.00 0.00 177.20 176.31 3kts n LEU 61 N -0.57 2.28 -4.40 0.64 4.77 -1.14 -4.95 117.00 113.63 3kts n LEU 61 Ca 0.12 -3.40 -0.44 0.00 -0.03 0.00 0.00 56.01 52.26 3kts n LEU 61 Cb 0.36 -0.41 -0.05 0.00 -2.33 0.00 0.00 43.42 40.99 3kts n LEU 61 CO 0.26 1.14 0.44 -0.69 -1.33 0.00 0.00 177.39 177.21 3kts s VAL 62 N -2.51 4.76 0.16 4.08 1.01 -1.25 -1.69 120.40 124.96 3kts s VAL 62 Ca 0.36 -0.80 -0.31 0.00 0.00 0.00 0.00 61.98 61.23 3kts s VAL 62 Cb 0.36 -4.48 -0.11 0.00 0.00 0.00 0.00 36.38 32.15 3kts s VAL 62 CO -0.08 -1.11 1.73 0.20 0.00 0.00 0.00 175.10 175.84 3kts s ASN 63 N 3.44 6.45 0.00 3.32 0.01 -0.98 -1.11 114.94 126.06 3kts s ASN 63 Ca 0.14 2.76 0.00 0.00 -0.71 0.00 0.00 52.86 55.05 3kts s ASN 63 Cb -0.22 -2.58 0.00 0.00 0.41 0.00 0.00 41.25 38.85 3kts s ASN 63 CO 0.08 -0.95 0.00 0.61 -1.51 0.00 0.00 177.10 175.33 3kts n GLY 64 N 4.03 0.75 2.96 0.66 0.00 -1.26 -2.09 105.19 110.24 3kts n GLY 64 Ca 0.16 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 46.00 3kts n GLY 64 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3kts s LEU 65 N 0.00 1.77 0.00 0.99 2.96 -0.27 -4.95 118.68 119.17 3kts s LEU 65 Ca 0.00 -0.14 -0.17 0.00 -0.22 0.00 0.00 54.13 53.60 3kts s LEU 65 Cb 0.00 -0.43 0.25 0.00 0.50 0.00 0.00 46.19 46.51 3kts s LEU 65 CO 0.00 0.04 1.09 0.29 -1.32 0.00 0.00 176.35 176.45 3kts n LYS 66 N 3.32 -2.20 -0.33 1.98 5.02 -1.26 -4.61 118.16 120.07 3kts n LYS 66 Ca -0.18 -1.71 0.08 0.00 -2.02 0.00 0.00 58.31 54.48 3kts n LYS 66 Cb 0.55 -1.39 0.20 0.00 -0.02 0.00 0.00 35.03 34.38 3kts n LYS 66 CO 0.00 0.00 0.00 0.27 -0.52 0.00 0.00 177.40 177.15 3kts n ASN 67 N -4.31 3.04 -4.35 4.39 6.94 -1.26 -4.79 115.26 114.91 3kts n ASN 67 Ca 0.14 -3.16 -0.33 0.00 -0.02 0.00 0.00 54.58 51.21 3kts n ASN 67 Cb 0.53 -0.51 0.12 0.00 -2.36 0.00 0.00 39.78 37.57 3kts n ASN 67 CO 0.00 0.00 0.00 0.47 -1.03 0.00 0.00 177.26 176.70 3kts n ASP 68 N -0.97 -2.50 -0.29 0.53 10.43 -1.26 -4.63 116.55 117.86 3kts n ASP 68 Ca 0.20 0.24 0.05 0.00 2.57 0.00 0.00 54.79 57.85 3kts n ASP 68 Cb 0.79 -1.12 0.20 0.00 1.84 0.00 0.00 41.12 42.84 3kts n ASP 68 CO 0.00 0.00 0.00 0.44 -1.07 0.00 0.00 177.20 176.57 3kts h ASP 69 N -1.59 0.53 -0.64 -2.24 3.32 -1.97 0.25 116.42 114.09 3kts h ASP 69 Ca -0.45 0.08 0.08 0.00 0.02 0.00 0.00 57.03 56.75 3kts h ASP 69 Cb 1.30 -0.01 -0.04 0.00 0.22 0.00 0.00 39.33 40.80 3kts h ASP 69 CO 0.34 0.25 0.42 1.88 -1.72 0.00 0.00 179.24 180.42 3kts h TYR 70 N 0.64 0.59 0.22 4.55 -1.99 -1.99 0.89 116.97 119.88 3kts h TYR 70 Ca 0.43 0.02 -0.33 0.00 2.00 0.00 0.00 58.73 60.85 3kts h TYR 70 Cb 0.55 -0.19 0.04 0.00 2.00 0.00 0.00 36.73 39.12 3kts h TYR 70 CO -0.09 0.30 -1.42 0.00 -0.00 0.00 0.00 178.16 176.94 3kts h ALA 71 N 1.66 -0.12 -0.69 3.88 0.00 -1.47 -3.09 119.26 119.44 3kts h ALA 71 Ca 0.28 -0.84 -0.07 0.00 0.00 0.00 0.00 54.91 54.28 3kts h ALA 71 Cb 0.37 0.15 -0.03 0.00 0.00 0.00 0.00 17.79 18.29 3kts h ALA 71 CO -0.09 0.71 0.14 0.82 0.00 0.00 0.00 179.25 180.84 3kts h ILE 72 N 0.17 1.26 -0.29 0.00 1.08 -0.50 -0.83 117.51 118.41 3kts h ILE 72 Ca -0.24 -1.00 0.07 0.00 -0.39 0.00 0.00 64.86 63.30 3kts h ILE 72 Cb 2.11 0.58 -0.07 0.00 -3.07 0.00 0.00 36.82 36.37 3kts h ILE 72 CO 0.27 0.38 -0.17 0.44 -0.69 0.00 0.00 178.15 178.38 3kts h ASP 73 N 1.05 -0.55 -0.88 1.72 3.32 -0.93 -1.70 116.42 118.45 3kts h ASP 73 Ca 0.21 0.12 0.07 0.00 0.02 0.00 0.00 57.03 57.46 3kts h ASP 73 Cb 0.40 0.29 -0.07 0.00 0.22 0.00 0.00 39.33 40.18 3kts h ASP 73 CO 0.01 -0.20 0.54 0.15 -1.72 0.00 0.00 179.24 178.01 3kts h PHE 74 N -0.14 1.00 -0.47 4.55 3.04 -1.38 -1.34 116.94 122.20 3kts h PHE 74 Ca 0.15 0.03 -0.04 0.00 3.98 0.00 0.00 57.97 62.09 3kts h PHE 74 Cb 0.37 -0.32 -0.02 0.00 2.56 0.00 0.00 35.95 38.54 3kts h PHE 74 CO -0.36 0.48 0.13 -0.07 -2.02 0.00 0.00 178.31 176.48 3kts h LEU 75 N 0.96 0.64 0.00 0.59 3.38 -0.50 -1.64 115.31 118.75 3kts h LEU 75 Ca 0.39 -0.10 -0.23 0.00 0.09 0.00 0.00 57.88 58.03 3kts h LEU 75 Cb 0.22 -0.17 -0.04 0.00 0.09 0.00 0.00 40.66 40.77 3kts h LEU 75 CO -0.19 0.63 -1.43 0.00 0.09 0.00 0.00 178.44 177.54 3kts n THR 77 N -3.08 1.53 -0.12 0.00 -2.24 -0.56 -4.25 114.28 105.56 3kts n THR 77 Ca -0.11 -0.64 -0.16 0.00 -2.27 0.00 0.00 64.05 60.87 3kts n THR 77 Cb 0.96 -1.30 -0.13 0.00 -2.10 0.00 0.00 70.33 67.76 3kts n THR 77 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3kts n GLU 78 N -3.20 0.66 -0.09 -0.78 -0.58 -0.64 -4.73 120.64 111.28 3kts n GLU 78 Ca -0.40 0.12 -0.23 0.00 -0.42 0.00 0.00 57.16 56.23 3kts n GLU 78 Cb 1.03 -1.52 -0.12 0.00 -0.57 0.00 0.00 31.44 30.26 3kts n GLU 78 CO 0.00 0.00 0.00 -0.89 -0.48 0.00 0.00 177.13 175.76 3kts n ILE 79 N -3.16 1.59 -3.33 -3.67 -0.00 -1.08 -5.02 119.36 104.70 3kts n ILE 79 Ca -0.43 -0.36 -0.30 0.00 -0.00 0.00 0.00 62.75 61.66 3kts n ILE 79 Cb 1.03 -1.83 0.03 0.00 -0.00 0.00 0.00 39.64 38.87 3kts n ILE 79 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.55 176.55 3kts n PRO 81 N -0.32 2.53 -0.46 0.00 -0.04 -1.26 -4.98 135.00 130.47 3kts n PRO 81 Ca -0.04 0.00 0.07 0.00 -0.04 0.00 0.00 63.50 63.49 3kts n PRO 81 Cb 0.62 0.00 0.15 0.00 -0.04 0.00 0.00 33.50 34.23 3kts n PRO 81 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 3kts n ASP 82 N 0.00 1.79 0.00 3.54 8.00 0.18 -4.91 116.55 125.16 3kts n ASP 82 Ca 0.00 -3.31 0.00 0.00 0.71 0.00 0.00 54.79 52.19 3kts n ASP 82 Cb 0.00 -0.45 0.00 0.00 -0.02 0.00 0.00 41.12 40.65 3kts n ASP 82 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3kts n GLY 83 N -1.04 4.15 3.44 0.44 0.00 -1.18 -4.64 105.19 106.37 3kts n GLY 83 Ca 0.16 -0.76 -0.31 0.00 0.00 0.00 0.00 46.02 45.10 3kts n GLY 83 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3kts s ILE 84 N -1.74 2.76 -0.19 -0.61 -4.36 -0.20 -1.13 121.20 115.73 3kts s ILE 84 Ca 0.00 -1.09 -0.02 0.00 -0.26 0.00 0.00 60.65 59.28 3kts s ILE 84 Cb 0.00 -2.13 -0.00 0.00 1.25 0.00 0.00 42.46 41.58 3kts s ILE 84 CO 0.00 0.41 -0.11 -0.63 0.24 0.00 0.00 174.94 174.85 3kts s ILE 85 N -0.86 2.90 0.00 8.37 1.01 0.26 -0.94 121.20 131.94 3kts s ILE 85 Ca 0.14 -0.67 -0.08 0.00 0.00 0.00 0.00 60.65 60.04 3kts s ILE 85 Cb -0.10 -2.27 0.00 0.00 0.01 0.00 0.00 42.46 40.10 3kts s ILE 85 CO 0.04 0.48 0.16 -0.55 0.00 0.00 0.00 174.94 175.07 3kts s SER 86 N 1.21 0.00 0.15 3.58 0.15 -0.79 -1.26 113.70 116.74 3kts s SER 86 Ca 0.02 -0.18 0.25 0.00 0.70 0.00 0.00 55.95 56.74 3kts s SER 86 Cb -0.14 0.22 0.54 0.00 -1.71 0.00 0.00 66.02 64.93 3kts s SER 86 CO -0.04 -0.39 1.51 1.07 1.20 0.00 0.00 173.24 176.59 3kts n THR 87 N 1.40 0.43 -3.81 6.45 5.66 -1.26 -0.70 114.28 122.44 3kts n THR 87 Ca -0.23 -0.26 -0.35 0.00 -3.05 0.00 0.00 64.05 60.16 3kts n THR 87 Cb 0.56 -0.29 -0.08 0.00 -1.55 0.00 0.00 70.33 68.97 3kts n THR 87 CO 0.00 0.00 0.00 -0.60 -3.05 0.00 0.00 175.07 171.42 3kts s ARG 88 N -3.13 3.95 0.20 1.09 3.52 -1.26 -4.78 118.95 118.55 3kts s ARG 88 Ca 0.08 -0.21 -0.09 0.00 -0.13 0.00 0.00 55.73 55.38 3kts s ARG 88 Cb 0.13 -3.33 0.14 0.00 -1.56 0.00 0.00 34.95 30.33 3kts s ARG 88 CO 0.67 0.43 1.77 0.78 -0.81 0.00 0.00 175.30 178.14 3kts h GLY 89 N 6.21 1.19 1.66 8.12 0.00 -1.94 -2.85 103.07 115.47 3kts h GLY 89 Ca -0.44 -0.64 -0.04 0.00 0.00 0.00 0.00 47.33 46.21 3kts h GLY 89 CO 0.70 0.60 -0.01 3.43 0.00 0.00 0.00 176.54 181.27 3kts h ASN 90 N 1.07 0.39 0.20 0.19 4.21 -1.95 -1.85 115.58 117.84 3kts h ASN 90 Ca 0.25 -0.07 -0.14 0.00 1.21 0.00 0.00 56.30 57.55 3kts h ASN 90 Cb 0.20 -0.10 -0.01 0.00 -1.12 0.00 0.00 38.32 37.29 3kts h ASN 90 CO -0.02 0.47 -0.53 0.00 -1.29 0.00 0.00 177.43 176.05 3kts h ALA 91 N 1.59 0.85 -0.22 -0.83 0.00 -1.77 -0.90 119.26 117.98 3kts h ALA 91 Ca 0.09 -0.50 -0.06 0.00 0.00 0.00 0.00 54.91 54.44 3kts h ALA 91 Cb 0.29 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.99 3kts h ALA 91 CO 0.01 0.68 -0.11 0.82 0.00 0.00 0.00 179.25 180.65 3kts h ILE 92 N 0.28 1.30 -0.71 0.00 1.08 -1.33 -2.29 117.51 115.86 3kts h ILE 92 Ca 0.01 -1.18 0.02 0.00 -0.39 0.00 0.00 64.86 63.32 3kts h ILE 92 Cb 1.02 1.61 -0.04 0.00 -3.07 0.00 0.00 36.82 36.34 3kts h ILE 92 CO 0.09 0.36 0.45 0.24 -0.69 0.00 0.00 178.15 178.60 3kts h MET 93 N 0.17 0.88 0.00 2.37 2.86 -1.18 -2.33 114.93 117.69 3kts h MET 93 Ca 0.05 -0.05 -0.14 0.00 -2.06 0.00 0.00 59.70 57.49 3kts h MET 93 Cb 0.60 -0.20 -0.02 0.00 0.06 0.00 0.00 31.60 32.05 3kts h MET 93 CO 0.03 0.58 -0.68 -0.22 1.06 0.00 0.00 176.91 177.68 3kts h LYS 94 N 0.90 0.00 -0.28 1.72 1.63 -1.18 -3.11 116.57 116.25 3kts h LYS 94 Ca 0.27 0.00 -0.10 0.00 -0.85 0.00 0.00 60.65 59.98 3kts h LYS 94 Cb -0.04 0.00 -0.01 0.00 -0.60 0.00 0.00 32.23 31.59 3kts h LYS 94 CO -0.09 0.68 -0.20 0.00 -3.45 0.00 0.00 179.45 176.40 3kts h ALA 95 N 1.32 0.41 -0.89 5.00 0.00 -1.19 -3.18 119.26 120.73 3kts h ALA 95 Ca -0.01 -0.36 0.05 0.00 0.00 0.00 0.00 54.91 54.60 3kts h ALA 95 Cb 1.25 -0.09 -0.06 0.00 0.00 0.00 0.00 17.79 18.89 3kts h ALA 95 CO 0.09 0.34 0.58 0.87 0.00 0.00 0.00 179.25 181.13 3kts h LYS 96 N 0.37 1.02 -0.28 0.00 1.57 -1.39 -0.65 116.57 117.22 3kts h LYS 96 Ca 0.06 -0.06 -0.01 0.00 -1.87 0.00 0.00 60.65 58.77 3kts h LYS 96 Cb 0.74 -0.23 -0.01 0.00 0.08 0.00 0.00 32.23 32.80 3kts h LYS 96 CO 0.05 0.67 0.14 1.96 -0.57 0.00 0.00 179.45 181.71 3kts h GLN 97 N 1.05 0.38 -0.25 3.15 4.20 -1.53 -1.02 115.11 121.09 3kts h GLN 97 Ca 0.37 -0.03 0.00 0.00 0.06 0.00 0.00 58.65 59.05 3kts h GLN 97 Cb 0.13 -0.08 0.00 0.00 0.30 0.00 0.00 27.48 27.83 3kts h GLN 97 CO -0.13 0.29 0.00 0.72 -0.67 0.00 0.00 178.83 179.04 3kts n HIS 98 N -4.45 0.33 -1.34 2.96 8.25 -0.39 -4.89 115.22 115.69 3kts n HIS 98 Ca 0.01 -0.16 -0.12 0.00 -0.26 0.00 0.00 57.72 57.19 3kts n HIS 98 Cb 0.11 0.00 -0.05 0.00 1.12 0.00 0.00 29.99 31.17 3kts n HIS 98 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 3kts n LYS 99 N 0.25 -1.41 -2.60 -0.41 4.76 -0.39 -4.99 118.16 113.38 3kts n LYS 99 Ca 0.10 0.89 -0.36 0.00 -2.87 0.00 0.00 58.31 56.07 3kts n LYS 99 Cb 0.23 -5.16 -0.05 0.00 -1.84 0.00 0.00 35.03 28.21 3kts n LYS 99 CO 0.00 0.00 0.00 -1.64 -1.37 0.00 0.00 177.40 174.39 3kts s MET 100 N -2.90 4.22 0.07 1.97 -1.94 -0.41 -4.97 119.30 115.33 3kts s MET 100 Ca 0.00 1.45 -0.31 0.00 -1.71 0.00 0.00 55.69 55.12 3kts s MET 100 Cb 0.00 -2.53 -0.09 0.00 2.01 0.00 0.00 34.83 34.22 3kts s MET 100 CO 0.00 -0.08 1.71 -1.17 -0.01 0.00 0.00 175.02 175.47 3kts s LEU 101 N -2.63 4.37 -0.29 -0.03 0.20 -1.26 -4.13 118.68 114.92 3kts s LEU 101 Ca 0.57 2.54 -0.01 0.00 0.69 0.00 0.00 54.13 57.92 3kts s LEU 101 Cb -0.20 -3.56 0.05 0.00 -0.43 0.00 0.00 46.19 42.05 3kts s LEU 101 CO 0.26 -0.93 -0.02 0.00 -0.29 0.00 0.00 176.35 175.37 3kts s ALA 102 N 2.90 2.77 -0.27 5.97 0.00 -1.26 -1.03 121.76 130.84 3kts s ALA 102 Ca 0.76 -1.73 -0.09 0.00 0.00 0.00 0.00 51.96 50.90 3kts s ALA 102 Cb -0.41 -1.87 -0.03 0.00 0.00 0.00 0.00 23.12 20.81 3kts s ALA 102 CO 0.34 -1.21 0.13 0.42 0.00 0.00 0.00 175.76 175.43 3kts s ILE 103 N 1.24 4.77 -0.21 0.00 1.01 -0.12 -1.48 121.20 126.41 3kts s ILE 103 Ca -0.05 -0.06 -0.16 0.00 0.00 0.00 0.00 60.65 60.38 3kts s ILE 103 Cb -0.19 -3.27 -0.04 0.00 0.01 0.00 0.00 42.46 38.96 3kts s ILE 103 CO -0.02 0.27 0.41 -1.58 0.00 0.00 0.00 174.94 174.02 3kts s GLN 104 N 1.68 4.15 0.03 2.79 0.74 -0.44 -1.88 119.66 126.73 3kts s GLN 104 Ca 0.06 0.20 -0.20 0.00 0.05 0.00 0.00 55.36 55.47 3kts s GLN 104 Cb -0.16 -3.56 -0.06 0.00 1.10 0.00 0.00 33.01 30.34 3kts s GLN 104 CO 0.07 -0.09 0.58 0.50 -0.55 0.00 0.00 175.29 175.81 3kts s ARG 105 N 1.47 4.27 -0.02 1.67 3.52 0.12 -0.85 118.95 129.14 3kts s ARG 105 Ca 0.19 0.73 0.00 0.00 -0.13 0.00 0.00 55.73 56.53 3kts s ARG 105 Cb -0.15 -3.30 0.01 0.00 -1.56 0.00 0.00 34.95 29.95 3kts s ARG 105 CO 0.08 0.48 -0.01 -1.17 -0.81 0.00 0.00 175.30 173.87 3kts s LEU 106 N -0.55 1.55 -0.22 -0.88 2.96 -0.17 -4.45 118.68 116.92 3kts s LEU 106 Ca 0.30 -0.02 -0.07 0.00 -0.22 0.00 0.00 54.13 54.12 3kts s LEU 106 Cb -0.19 -0.15 -0.03 0.00 0.50 0.00 0.00 46.19 46.32 3kts s LEU 106 CO 0.18 -0.04 0.05 -0.36 -1.32 0.00 0.00 176.35 174.85 3kts s PHE 107 N 0.52 3.11 -1.24 5.38 0.08 -1.26 -1.13 117.98 123.45 3kts s PHE 107 Ca -0.05 -0.28 -0.20 0.00 0.12 0.00 0.00 56.93 56.53 3kts s PHE 107 Cb -0.08 -2.15 0.03 0.00 -0.57 0.00 0.00 43.02 40.26 3kts s PHE 107 CO -0.01 -0.17 1.76 -1.64 -0.10 0.00 0.00 175.22 175.06 3kts s MET 108 N 1.08 3.59 0.00 0.44 -1.94 0.60 -4.73 119.30 118.34 3kts s MET 108 Ca 0.04 -1.69 0.00 0.00 -1.71 0.00 0.00 55.69 52.32 3kts s MET 108 Cb -0.14 -5.45 0.00 0.00 2.01 0.00 0.00 34.83 31.25 3kts s MET 108 CO 0.03 -2.67 0.00 -0.89 -0.01 0.00 0.00 175.02 171.48 3kts n ILE 109 N 6.79 0.00 -4.05 2.53 5.41 -1.26 -4.78 119.36 124.00 3kts n ILE 109 Ca 0.46 0.25 -0.03 0.00 1.00 0.00 0.00 62.75 64.44 3kts n ILE 109 Cb 0.47 -1.17 -0.01 0.00 -0.71 0.00 0.00 39.64 38.22 3kts n ILE 109 CO 0.00 0.00 0.00 -0.90 0.00 0.00 0.00 176.55 175.65 3kts n ASP 110 N -1.88 0.74 0.16 4.38 5.68 -1.26 -5.02 116.55 119.34 3kts n ASP 110 Ca 0.00 -1.23 0.03 0.00 -0.50 0.00 0.00 54.79 53.09 3kts n ASP 110 Cb 0.00 0.13 0.19 0.00 -1.14 0.00 0.00 41.12 40.30 3kts n ASP 110 CO 0.00 0.00 0.00 0.77 -1.33 0.00 0.00 177.20 176.64 3kts h SER 111 N 0.18 0.00 -0.57 -1.12 4.64 -1.99 -2.18 113.55 112.52 3kts h SER 111 Ca -0.03 0.00 -0.10 0.00 -0.47 0.00 0.00 61.79 61.18 3kts h SER 111 Cb 0.13 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.20 3kts h SER 111 CO 0.05 0.49 -0.05 -1.28 -0.87 0.00 0.00 176.83 175.17 3kts h SER 112 N 0.00 1.03 0.55 4.97 0.87 -1.99 -1.33 113.55 117.64 3kts h SER 112 Ca -0.00 -0.31 -0.05 0.00 -1.23 0.00 0.00 61.79 60.19 3kts h SER 112 Cb 1.14 -0.28 -0.01 0.00 -0.44 0.00 0.00 62.40 62.81 3kts h SER 112 CO 0.06 1.10 -0.24 0.00 -0.53 0.00 0.00 176.83 177.22 3kts h ALA 113 N 0.99 1.21 0.02 6.23 0.00 -1.85 -2.36 119.26 123.51 3kts h ALA 113 Ca 0.16 -0.22 -0.07 0.00 0.00 0.00 0.00 54.91 54.78 3kts h ALA 113 Cb 0.60 -0.04 0.01 0.00 0.00 0.00 0.00 17.79 18.36 3kts h ALA 113 CO 0.04 0.30 -0.30 -0.92 0.00 0.00 0.00 179.25 178.37 3kts h TYR 114 N 0.00 0.26 -0.08 0.00 3.20 -1.07 -2.38 116.97 116.89 3kts h TYR 114 Ca -0.00 -0.16 -0.17 0.00 3.14 0.00 0.00 58.73 61.54 3kts h TYR 114 Cb 0.58 -0.02 -0.01 0.00 1.54 0.00 0.00 36.73 38.82 3kts h TYR 114 CO 0.00 1.00 -0.67 -0.91 -1.64 0.00 0.00 178.16 175.95 3kts h ASN 115 N -0.55 0.41 0.08 -2.11 4.21 -1.21 0.17 115.58 116.58 3kts h ASN 115 Ca -0.04 -0.25 -0.22 0.00 1.21 0.00 0.00 56.30 57.00 3kts h ASN 115 Cb 1.10 -0.12 0.01 0.00 -1.12 0.00 0.00 38.32 38.19 3kts h ASN 115 CO 0.06 0.96 -0.84 0.11 -1.29 0.00 0.00 177.43 176.43 3kts h LYS 116 N 0.25 0.60 0.23 0.81 1.57 -1.59 -3.06 116.57 115.38 3kts h LYS 116 Ca -0.02 -0.54 -0.01 0.00 -1.87 0.00 0.00 60.65 58.22 3kts h LYS 116 Cb 1.21 0.13 0.00 0.00 0.08 0.00 0.00 32.23 33.65 3kts h LYS 116 CO 0.11 1.16 -0.11 0.78 -0.57 0.00 0.00 179.45 180.82 3kts h GLY 117 N 0.87 -0.32 1.10 3.86 0.00 -1.09 -1.90 103.07 105.59 3kts h GLY 117 Ca -0.06 0.12 -0.05 0.00 0.00 0.00 0.00 47.33 47.33 3kts h GLY 117 CO 0.16 -0.12 0.26 -0.39 0.00 0.00 0.00 176.54 176.45 3kts h VAL 118 N -0.32 1.26 -0.20 4.60 -1.51 -0.78 -1.20 116.25 118.10 3kts h VAL 118 Ca -0.03 -0.86 -0.07 0.00 -1.23 0.00 0.00 66.70 64.51 3kts h VAL 118 Cb 0.25 0.41 -0.01 0.00 -2.13 0.00 0.00 31.29 29.81 3kts h VAL 118 CO 0.05 0.34 -0.17 0.00 -1.23 0.00 0.00 177.57 176.56 3kts h ALA 119 N 1.18 1.33 -0.19 5.19 0.00 -1.49 0.11 119.26 125.39 3kts h ALA 119 Ca 0.24 -0.27 -0.21 0.00 0.00 0.00 0.00 54.91 54.68 3kts h ALA 119 Cb 0.27 -0.11 0.01 0.00 0.00 0.00 0.00 17.79 17.96 3kts h ALA 119 CO -0.01 0.45 -0.70 1.25 0.00 0.00 0.00 179.25 180.24 3kts h LEU 120 N 0.31 0.90 -0.28 0.00 5.85 -0.93 -1.14 115.31 120.03 3kts h LEU 120 Ca 0.06 -0.55 -0.00 0.00 0.84 0.00 0.00 57.88 58.22 3kts h LEU 120 Cb 0.50 -0.26 -0.01 0.00 0.37 0.00 0.00 40.66 41.25 3kts h LEU 120 CO 0.03 1.35 0.16 0.40 -0.34 0.00 0.00 178.44 180.04 3kts h ILE 121 N 0.55 1.11 -0.64 4.05 2.04 -0.78 -2.03 117.51 121.81 3kts h ILE 121 Ca -0.03 -0.27 0.09 0.00 1.00 0.00 0.00 64.86 65.64 3kts h ILE 121 Cb 1.31 0.78 -0.07 0.00 -0.74 0.00 0.00 36.82 38.11 3kts h ILE 121 CO 0.14 0.11 0.28 1.56 0.00 0.00 0.00 178.15 180.25 3kts h GLN 122 N 0.35 0.48 0.03 2.37 4.20 -0.75 -0.89 115.11 120.90 3kts h GLN 122 Ca 0.10 -0.03 -0.00 0.00 0.06 0.00 0.00 58.65 58.78 3kts h GLN 122 Cb 0.03 -0.11 0.00 0.00 0.30 0.00 0.00 27.48 27.70 3kts h GLN 122 CO -0.02 0.32 -0.01 -0.22 -0.67 0.00 0.00 178.83 178.23 3kts h LYS 123 N 0.50 -0.04 0.00 1.46 3.64 -1.04 -3.36 116.57 117.73 3kts h LYS 123 Ca 0.31 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.70 3kts h LYS 123 Cb 0.35 0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.18 3kts h LYS 123 CO -0.27 0.36 -0.87 1.33 -2.27 0.00 0.00 179.45 177.73 3kts n VAL 124 N -4.91 0.05 -3.40 2.00 0.24 -0.78 -5.03 118.33 106.50 3kts n VAL 124 Ca -0.08 -0.08 -0.20 0.00 -2.04 0.00 0.00 64.34 61.93 3kts n VAL 124 Cb 0.22 0.50 0.01 0.00 -1.47 0.00 0.00 33.84 33.10 3kts n VAL 124 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3kts n GLN 125 N -1.65 -1.75 -1.38 7.34 1.13 -0.35 -4.67 117.38 116.04 3kts n GLN 125 Ca 0.04 1.34 -0.31 0.00 -1.94 0.00 0.00 57.00 56.12 3kts n GLN 125 Cb 0.37 -3.56 0.08 0.00 0.11 0.00 0.00 30.24 27.24 3kts n GLN 125 CO 0.00 0.00 0.00 -1.25 -1.44 0.00 0.00 177.06 174.37 3kts s PRO 126 N -3.45 2.51 0.46 -1.09 0.04 -1.26 -4.94 135.00 127.27 3kts s PRO 126 Ca 0.15 1.10 0.26 0.00 0.04 0.00 0.00 61.00 62.55 3kts s PRO 126 Cb -0.02 -1.93 0.89 0.00 0.04 0.00 0.00 34.50 33.48 3kts s PRO 126 CO 0.84 -1.44 1.81 -0.44 0.04 0.00 0.00 177.00 177.80 3kts h ASP 127 N -0.95 0.00 -4.68 6.66 3.32 -1.63 -3.47 116.42 115.66 3kts h ASP 127 Ca -0.44 0.00 0.08 0.00 0.02 0.00 0.00 57.03 56.69 3kts h ASP 127 Cb 1.22 0.00 -0.15 0.00 0.22 0.00 0.00 39.33 40.62 3kts h ASP 127 CO 0.53 0.16 0.44 0.00 -1.72 0.00 0.00 179.24 178.65 3kts s ILE 129 N -3.02 0.31 -0.39 0.00 2.07 -0.65 -1.32 121.20 118.20 3kts s ILE 129 Ca 0.03 -0.49 -0.27 0.00 -1.41 0.00 0.00 60.65 58.51 3kts s ILE 129 Cb -0.01 -0.92 0.02 0.00 0.13 0.00 0.00 42.46 41.68 3kts s ILE 129 CO -0.08 -0.29 1.00 -0.70 -1.91 0.00 0.00 174.94 172.96 3kts s GLU 130 N 1.95 3.84 -0.20 3.50 2.12 -0.03 -0.59 118.70 129.29 3kts s GLU 130 Ca 0.01 0.65 -0.08 0.00 0.36 0.00 0.00 54.97 55.92 3kts s GLU 130 Cb -0.17 -3.82 -0.04 0.00 0.26 0.00 0.00 34.13 30.37 3kts s GLU 130 CO -0.11 -1.05 0.07 -1.17 -0.54 0.00 0.00 175.26 172.46 3kts s LEU 131 N 3.74 3.74 0.00 2.70 0.20 0.29 -1.00 118.68 128.34 3kts s LEU 131 Ca 0.42 0.01 0.05 0.00 0.69 0.00 0.00 54.13 55.30 3kts s LEU 131 Cb -0.11 -1.96 -0.02 0.00 -0.43 0.00 0.00 46.19 43.67 3kts s LEU 131 CO 0.21 0.11 -0.17 -0.76 -0.29 0.00 0.00 176.35 175.45 3kts s LEU 132 N 0.75 2.08 0.68 -0.68 1.02 -0.28 -1.88 118.68 120.37 3kts s LEU 132 Ca 0.04 -0.36 -0.11 0.00 0.02 0.00 0.00 54.13 53.72 3kts s LEU 132 Cb -0.13 -0.84 -0.00 0.00 0.02 0.00 0.00 46.19 45.24 3kts s LEU 132 CO 0.02 0.17 1.06 -2.16 0.02 0.00 0.00 176.35 175.46 3kts s PRO 133 N -0.63 3.09 -0.22 1.29 0.04 -1.26 -0.29 135.00 137.02 3kts s PRO 133 Ca 0.06 0.82 0.11 0.00 0.04 0.00 0.00 61.00 62.04 3kts s PRO 133 Cb -0.07 -2.02 0.70 0.00 0.04 0.00 0.00 34.50 33.16 3kts s PRO 133 CO 0.00 -0.95 1.60 0.41 0.04 0.00 0.00 177.00 178.09 3kts n GLY 134 N -2.33 2.88 0.93 0.56 0.00 0.20 -4.22 105.19 103.20 3kts n GLY 134 Ca 0.07 -0.81 0.02 0.00 0.00 0.00 0.00 46.02 45.30 3kts n GLY 134 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 3kts n ILE 135 N 0.44 2.38 -3.86 -0.61 -5.35 -1.26 -4.69 119.36 106.41 3kts n ILE 135 Ca 0.26 -2.46 -0.29 0.00 -0.27 0.00 0.00 62.75 59.99 3kts n ILE 135 Cb 1.11 -0.29 -0.13 0.00 -1.74 0.00 0.00 39.64 38.59 3kts n ILE 135 CO 0.00 0.00 0.00 -0.63 -1.76 0.00 0.00 176.55 174.16 3kts s ILE 136 N -3.08 2.36 0.54 7.28 1.01 -1.26 -5.00 121.20 123.04 3kts s ILE 136 Ca 0.42 -3.51 0.23 0.00 0.00 0.00 0.00 60.65 57.79 3kts s ILE 136 Cb 0.37 -2.60 0.30 0.00 0.01 0.00 0.00 42.46 40.54 3kts s ILE 136 CO 0.02 -0.92 2.18 -0.65 0.00 0.00 0.00 174.94 175.57 3kts h PRO 137 N 6.07 0.00 -0.22 2.79 0.11 -1.92 -2.86 132.00 135.96 3kts h PRO 137 Ca 0.04 0.00 -0.10 0.00 0.11 0.00 0.00 66.00 66.05 3kts h PRO 137 Cb 0.85 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.95 3kts h PRO 137 CO 0.65 0.03 -0.25 1.49 -0.21 0.00 0.00 178.00 179.70 3kts h GLU 138 N 0.00 0.56 0.00 1.05 4.81 -1.95 -2.98 114.58 116.08 3kts h GLU 138 Ca -0.00 -0.31 -0.02 0.00 -0.13 0.00 0.00 59.36 58.90 3kts h GLU 138 Cb 0.07 0.02 -0.00 0.00 0.63 0.00 0.00 28.75 29.46 3kts h GLU 138 CO 0.00 0.90 -0.08 1.96 -0.73 0.00 0.00 179.01 181.06 3kts h GLN 139 N 0.25 0.00 -0.21 1.92 1.08 -1.93 -1.20 115.11 115.02 3kts h GLN 139 Ca 0.03 0.00 -0.13 0.00 -1.45 0.00 0.00 58.65 57.10 3kts h GLN 139 Cb 0.81 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.24 3kts h GLN 139 CO 0.06 0.08 -0.37 0.28 -0.95 0.00 0.00 178.83 177.94 3kts h VAL 140 N 0.00 1.33 -0.21 -0.54 2.07 -1.51 -2.97 116.25 114.41 3kts h VAL 140 Ca -0.00 -1.59 -0.11 0.00 0.82 0.00 0.00 66.70 65.82 3kts h VAL 140 Cb 0.37 1.83 -0.01 0.00 -1.52 0.00 0.00 31.29 31.95 3kts h VAL 140 CO 0.01 0.49 -0.35 -0.61 0.02 0.00 0.00 177.57 177.14 3kts h GLN 141 N 0.30 0.46 -1.00 1.57 4.15 -1.16 -2.33 115.11 117.10 3kts h GLN 141 Ca 0.01 -0.21 0.07 0.00 0.77 0.00 0.00 58.65 59.29 3kts h GLN 141 Cb 0.96 -0.01 -0.07 0.00 0.21 0.00 0.00 27.48 28.57 3kts h GLN 141 CO 0.08 0.75 0.65 0.87 -1.93 0.00 0.00 178.83 179.25 3kts h LYS 142 N 0.39 1.14 0.00 1.69 1.57 -1.29 -2.84 116.57 117.23 3kts h LYS 142 Ca 0.04 -0.07 -0.21 0.00 -1.87 0.00 0.00 60.65 58.54 3kts h LYS 142 Cb 0.80 -0.26 -0.00 0.00 0.08 0.00 0.00 32.23 32.85 3kts h LYS 142 CO 0.06 0.75 -0.91 0.52 -0.57 0.00 0.00 179.45 179.31 3kts h MET 143 N 1.17 0.30 0.00 3.15 2.86 -1.27 -3.13 114.93 118.01 3kts h MET 143 Ca 0.43 -0.33 0.00 0.00 -2.06 0.00 0.00 59.70 57.74 3kts h MET 143 Cb 0.17 0.09 0.00 0.00 0.06 0.00 0.00 31.60 31.92 3kts h MET 143 CO -0.17 1.03 0.00 1.79 1.06 0.00 0.00 176.91 180.62 3kts h THR 144 N 0.17 0.00 -0.06 2.22 1.35 -1.36 -3.00 112.91 112.23 3kts h THR 144 Ca -0.06 -0.58 0.00 0.00 -0.55 0.00 0.00 66.41 65.22 3kts h THR 144 Cb 1.54 1.53 0.00 0.00 -1.73 0.00 0.00 68.15 69.49 3kts h THR 144 CO 0.15 0.00 0.00 0.00 -0.25 0.00 0.00 175.52 175.42 3kts n GLN 145 N -2.86 2.07 -0.01 4.72 6.02 -1.08 -4.32 117.38 121.92 3kts n GLN 145 Ca 0.02 -1.57 -0.01 0.00 -0.01 0.00 0.00 57.00 55.44 3kts n GLN 145 Cb 0.36 -1.47 -0.00 0.00 1.02 0.00 0.00 30.24 30.15 3kts n GLN 145 CO 0.00 0.00 0.00 0.87 -1.01 0.00 0.00 177.06 176.92 3kts h LYS 146 N 3.72 0.00 -5.78 -1.09 1.57 -1.47 -3.50 116.57 110.01 3kts h LYS 146 Ca 0.00 0.00 -0.60 0.00 -1.87 0.00 0.00 60.65 58.18 3kts h LYS 146 Cb 0.79 0.00 -0.10 0.00 0.08 0.00 0.00 32.23 33.00 3kts h LYS 146 CO 0.00 0.00 -0.54 -0.51 -0.57 0.00 0.00 179.45 177.83 3kts s LEU 147 N -5.02 3.00 0.00 2.94 1.43 -1.18 -5.05 118.68 114.79 3kts s LEU 147 Ca -0.02 -1.22 0.24 0.00 -1.03 0.00 0.00 54.13 52.11 3kts s LEU 147 Cb 0.00 -1.19 0.40 0.00 0.03 0.00 0.00 46.19 45.42 3kts s LEU 147 CO 0.03 -0.52 1.38 1.57 0.23 0.00 0.00 176.35 179.04 3kts n HIS 148 N -1.13 0.13 -1.52 0.29 -0.00 -1.26 -4.42 115.22 107.30 3kts n HIS 148 Ca -0.03 -0.07 -0.53 0.00 0.46 0.00 0.00 57.72 57.56 3kts n HIS 148 Cb 0.66 0.00 -0.07 0.00 -0.12 0.00 0.00 29.99 30.45 3kts n HIS 148 CO 0.00 0.00 0.00 -0.89 0.46 0.00 0.00 176.34 175.91 3kts n ILE 149 N 1.17 0.25 -1.60 3.57 2.08 -1.26 -4.89 119.36 118.66 3kts n ILE 149 Ca 0.16 -0.18 -0.62 0.00 0.56 0.00 0.00 62.75 62.68 3kts n ILE 149 Cb 0.55 -1.50 -0.09 0.00 -0.75 0.00 0.00 39.64 37.86 3kts n ILE 149 CO 0.00 0.00 0.00 -2.65 0.56 0.00 0.00 176.55 174.46 3kts n PRO 150 N 7.33 0.12 -3.99 0.38 -0.02 -1.26 -4.79 135.00 132.77 3kts n PRO 150 Ca 0.37 0.04 -0.31 0.00 -2.02 0.00 0.00 63.50 61.57 3kts n PRO 150 Cb 0.19 -1.56 -0.05 0.00 -0.02 0.00 0.00 33.50 32.06 3kts n PRO 150 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 3kts s VAL 151 N 1.25 5.02 -0.17 -1.45 -7.23 -1.26 -1.64 120.40 114.92 3kts s VAL 151 Ca 0.96 -0.48 0.01 0.00 -1.81 0.00 0.00 61.98 60.66 3kts s VAL 151 Cb -1.32 -3.40 0.02 0.00 0.56 0.00 0.00 36.38 32.23 3kts s VAL 151 CO 0.66 0.20 -0.19 -0.63 -0.31 0.00 0.00 175.10 174.82 3kts s ILE 152 N -1.39 1.95 0.15 -0.62 -1.09 0.24 -2.40 121.20 118.05 3kts s ILE 152 Ca 0.30 -0.88 -0.25 0.00 -2.23 0.00 0.00 60.65 57.59 3kts s ILE 152 Cb -0.13 -1.77 -0.08 0.00 -1.58 0.00 0.00 42.46 38.90 3kts s ILE 152 CO 0.23 0.52 0.78 0.00 -1.23 0.00 0.00 174.94 175.24 3kts s ALA 153 N 1.30 3.43 0.07 9.38 0.00 -1.19 0.10 121.76 134.85 3kts s ALA 153 Ca 0.04 0.36 -0.18 0.00 0.00 0.00 0.00 51.96 52.18 3kts s ALA 153 Cb -0.13 -2.97 0.04 0.00 0.00 0.00 0.00 23.12 20.05 3kts s ALA 153 CO -0.12 0.25 0.43 0.20 0.00 0.00 0.00 175.76 176.52 3kts s GLY 154 N -0.96 -0.31 0.00 0.00 0.00 -0.79 -0.90 107.32 104.37 3kts s GLY 154 Ca 0.36 0.26 0.00 0.00 0.00 0.00 0.00 44.72 45.34 3kts s GLY 154 CO 0.26 -0.01 0.00 0.61 0.00 0.00 0.00 173.10 173.96 3kts n GLY 155 N 0.26 0.05 2.63 0.20 0.00 -1.15 0.58 105.19 107.76 3kts n GLY 155 Ca -0.18 -1.28 -0.04 0.00 0.00 0.00 0.00 46.02 44.52 3kts n GLY 155 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3kts n LEU 156 N -0.21 0.22 -4.66 0.99 4.77 -1.26 -2.05 117.00 114.79 3kts n LEU 156 Ca 0.00 0.10 -0.43 0.00 -0.03 0.00 0.00 56.01 55.65 3kts n LEU 156 Cb 0.00 -1.98 -0.02 0.00 -2.33 0.00 0.00 43.42 39.09 3kts n LEU 156 CO 0.00 -0.72 1.11 -0.63 -1.33 0.00 0.00 177.39 175.82 3kts s ILE 157 N -1.64 4.22 -0.14 -0.08 1.09 -1.26 -4.89 121.20 118.49 3kts s ILE 157 Ca 0.00 1.46 0.03 0.00 -1.10 0.00 0.00 60.65 61.03 3kts s ILE 157 Cb 0.00 -3.98 -0.11 0.00 -1.06 0.00 0.00 42.46 37.31 3kts s ILE 157 CO 0.00 -0.17 -0.10 -0.62 -0.10 0.00 0.00 174.94 173.94 3kts n GLU 158 N 6.74 0.67 -4.38 2.79 1.02 -1.26 -4.76 120.64 121.46 3kts n GLU 158 Ca 0.14 0.07 -0.26 0.00 -0.02 0.00 0.00 57.16 57.10 3kts n GLU 158 Cb 0.45 -1.30 -0.10 0.00 -0.02 0.00 0.00 31.44 30.47 3kts n GLU 158 CO 0.00 0.00 0.00 0.95 1.18 0.00 0.00 177.13 179.26 3kts s THR 159 N -2.30 2.77 -0.10 2.62 -4.23 -1.26 -4.86 115.64 108.29 3kts s THR 159 Ca -0.18 -2.01 0.30 0.00 -1.18 0.00 0.00 61.69 58.63 3kts s THR 159 Cb 0.05 -2.40 0.35 0.00 1.34 0.00 0.00 72.50 71.84 3kts s THR 159 CO 0.37 -0.23 1.89 0.28 -0.54 0.00 0.00 174.62 176.40 3kts h SER 160 N 2.69 0.00 -0.43 3.99 0.02 -1.99 -2.60 113.55 115.23 3kts h SER 160 Ca -0.44 0.00 -0.12 0.00 -0.84 0.00 0.00 61.79 60.38 3kts h SER 160 Cb 1.23 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 63.75 3kts h SER 160 CO 0.55 0.00 -0.18 -0.33 -1.14 0.00 0.00 176.83 175.72 3kts h GLU 161 N 0.00 0.93 -0.14 3.45 5.08 -1.99 -1.42 114.58 120.49 3kts h GLU 161 Ca 0.00 -0.37 -0.12 0.00 -1.00 0.00 0.00 59.36 57.87 3kts h GLU 161 Cb 0.49 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.68 3kts h GLU 161 CO 0.00 1.03 -0.44 1.96 -1.00 0.00 0.00 179.01 180.56 3kts h GLN 162 N 0.81 0.34 -0.03 2.33 4.20 -1.89 -1.51 115.11 119.37 3kts h GLN 162 Ca 0.12 -0.18 -0.00 0.00 0.06 0.00 0.00 58.65 58.64 3kts h GLN 162 Cb 0.73 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.52 3kts h GLN 162 CO 0.06 0.72 0.00 0.28 -0.67 0.00 0.00 178.83 179.22 3kts h VAL 163 N 0.28 1.22 -0.63 -0.54 2.07 -1.41 -2.96 116.25 114.28 3kts h VAL 163 Ca 0.02 -0.66 -0.07 0.00 0.82 0.00 0.00 66.70 66.81 3kts h VAL 163 Cb 0.89 1.60 -0.03 0.00 -1.52 0.00 0.00 31.29 32.24 3kts h VAL 163 CO 0.07 0.18 0.12 0.78 0.02 0.00 0.00 177.57 178.74 3kts h ASN 164 N -0.21 0.99 -0.52 0.57 4.21 -1.17 -1.68 115.58 117.78 3kts h ASN 164 Ca 0.01 -0.25 0.00 0.00 1.21 0.00 0.00 56.30 57.27 3kts h ASN 164 Cb 0.28 -0.26 -0.03 0.00 -1.12 0.00 0.00 38.32 37.19 3kts h ASN 164 CO 0.00 0.99 0.33 1.56 -1.29 0.00 0.00 177.43 179.02 3kts h GLN 165 N 0.95 0.69 0.00 0.81 4.20 -1.35 -2.42 115.11 118.00 3kts h GLN 165 Ca 0.19 -0.05 -0.09 0.00 0.06 0.00 0.00 58.65 58.76 3kts h GLN 165 Cb 0.41 -0.15 -0.01 0.00 0.30 0.00 0.00 27.48 28.03 3kts h GLN 165 CO 0.01 0.48 -0.54 -0.24 -0.67 0.00 0.00 178.83 177.87 3kts h VAL 166 N 0.70 0.64 0.05 -0.54 3.04 -1.36 -2.42 116.25 116.37 3kts h VAL 166 Ca 0.19 -1.94 -0.26 0.00 -1.01 0.00 0.00 66.70 63.68 3kts h VAL 166 Cb -0.05 2.27 0.01 0.00 -2.01 0.00 0.00 31.29 31.52 3kts h VAL 166 CO -0.04 0.37 -1.08 0.40 -1.01 0.00 0.00 177.57 176.21 3kts h ILE 167 N 0.00 1.37 0.00 3.17 2.04 -1.29 -2.83 117.51 119.97 3kts h ILE 167 Ca -0.02 -2.53 0.00 0.00 1.00 0.00 0.00 64.86 63.31 3kts h ILE 167 Cb 1.33 2.57 0.00 0.00 -0.74 0.00 0.00 36.82 39.97 3kts h ILE 167 CO 0.05 0.76 0.00 0.00 0.00 0.00 0.00 178.15 178.96 3kts h ALA 168 N 0.56 1.00 -0.01 1.87 0.00 -1.41 -2.75 119.26 118.52 3kts h ALA 168 Ca -0.12 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.79 3kts h ALA 168 Cb 1.74 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.53 3kts h ALA 168 CO 0.19 0.00 -0.06 0.43 0.00 0.00 0.00 179.25 179.81 3kts n SER 169 N -2.75 0.76 0.00 0.00 7.64 -0.91 -4.90 113.62 113.45 3kts n SER 169 Ca 0.01 -1.02 0.00 0.00 1.01 0.00 0.00 58.87 58.87 3kts n SER 169 Cb 0.24 -0.01 0.00 0.00 -1.01 0.00 0.00 64.21 63.43 3kts n SER 169 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3kts n GLY 170 N 1.18 0.97 3.72 0.23 0.00 -1.04 -3.37 105.19 106.89 3kts n GLY 170 Ca 0.18 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.79 3kts n GLY 170 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3kts s ALA 171 N -1.95 3.26 0.13 4.61 0.00 -1.11 -4.43 121.76 122.27 3kts s ALA 171 Ca 0.00 0.35 -0.09 0.00 0.00 0.00 0.00 51.96 52.22 3kts s ALA 171 Cb 0.00 -3.14 -0.09 0.00 0.00 0.00 0.00 23.12 19.89 3kts s ALA 171 CO 0.00 -0.12 1.35 0.97 0.00 0.00 0.00 175.76 177.96 3kts h ILE 172 N 4.61 1.30 -4.47 0.00 2.10 -1.78 -3.41 117.51 115.86 3kts h ILE 172 Ca -0.42 -2.00 -0.41 0.00 1.08 0.00 0.00 64.86 63.11 3kts h ILE 172 Cb 1.21 1.99 -0.14 0.00 -1.09 0.00 0.00 36.82 38.80 3kts h ILE 172 CO 0.74 0.63 -0.54 0.00 -1.08 0.00 0.00 178.15 177.90 3kts s ALA 173 N -3.74 1.78 -0.06 0.18 0.00 -1.26 -4.71 121.76 113.96 3kts s ALA 173 Ca -0.09 -1.86 0.01 0.00 0.00 0.00 0.00 51.96 50.02 3kts s ALA 173 Cb 0.09 1.34 0.02 0.00 0.00 0.00 0.00 23.12 24.57 3kts s ALA 173 CO 0.89 -0.59 -0.07 0.08 0.00 0.00 0.00 175.76 176.06 3kts s VAL 174 N -3.65 0.78 -0.16 0.00 1.01 0.17 -3.20 120.40 115.35 3kts s VAL 174 Ca 0.38 -0.25 -0.08 0.00 0.00 0.00 0.00 61.98 62.03 3kts s VAL 174 Cb 0.04 -0.77 -0.04 0.00 0.00 0.00 0.00 36.38 35.61 3kts s VAL 174 CO 0.21 0.28 0.13 0.42 0.00 0.00 0.00 175.10 176.14 3kts s THR 175 N 0.96 5.43 0.01 3.92 -4.23 -0.07 0.28 115.64 121.94 3kts s THR 175 Ca -0.10 0.19 -0.17 0.00 -1.18 0.00 0.00 61.69 60.43 3kts s THR 175 Cb -0.15 -3.42 0.03 0.00 1.34 0.00 0.00 72.50 70.31 3kts s THR 175 CO 0.00 0.54 0.38 0.28 -0.54 0.00 0.00 174.62 175.28 3kts s THR 176 N -0.39 0.06 -1.03 3.99 -1.32 -1.14 -2.93 115.64 112.88 3kts s THR 176 Ca 0.12 -0.46 0.12 0.00 -1.21 0.00 0.00 61.69 60.26 3kts s THR 176 Cb -0.12 -0.83 0.35 0.00 -1.51 0.00 0.00 72.50 70.40 3kts s THR 176 CO 0.01 -0.25 1.29 -1.54 -2.21 0.00 0.00 174.62 171.92 3kts n SER 177 N 0.85 3.08 -4.70 8.08 3.41 -1.26 -0.09 113.62 122.98 3kts n SER 177 Ca -0.20 -2.02 -0.42 0.00 -0.26 0.00 0.00 58.87 55.97 3kts n SER 177 Cb 0.58 -0.27 -0.03 0.00 -0.26 0.00 0.00 64.21 64.23 3kts n SER 177 CO 0.00 0.00 0.00 0.21 -0.16 0.00 0.00 175.04 175.09 3kts s ASN 178 N -1.02 7.03 0.27 4.04 3.84 -1.26 -4.93 114.94 122.91 3kts s ASN 178 Ca 0.27 1.97 0.14 0.00 0.21 0.00 0.00 52.86 55.45 3kts s ASN 178 Cb 0.14 -2.57 0.15 0.00 -0.55 0.00 0.00 41.25 38.42 3kts s ASN 178 CO 0.18 -0.55 1.48 0.50 -2.79 0.00 0.00 177.10 175.91 3kts h LYS 179 N 7.19 0.00 0.72 0.43 3.64 -1.96 -3.34 116.57 123.26 3kts h LYS 179 Ca -0.38 0.00 -0.04 0.00 -1.27 0.00 0.00 60.65 58.96 3kts h LYS 179 Cb 1.19 0.00 0.01 0.00 -0.41 0.00 0.00 32.23 33.02 3kts h LYS 179 CO 0.85 0.57 -0.35 1.25 -2.27 0.00 0.00 179.45 179.50 3kts h HIS 180 N 0.00 -0.90 -0.54 1.91 2.76 -1.96 -3.28 115.15 113.14 3kts h HIS 180 Ca -0.01 -0.02 -0.69 0.00 -2.20 0.00 0.00 60.37 57.46 3kts h HIS 180 Cb 1.35 0.30 -0.05 0.00 1.55 0.00 0.00 27.41 30.56 3kts h HIS 180 CO 0.00 -0.54 3.04 1.47 -1.30 0.00 0.00 177.93 180.60 3kts n LEU 181 N -5.44 8.32 -0.01 0.26 -0.00 -1.25 -3.66 117.00 115.22 3kts n LEU 181 Ca -0.13 -4.57 -0.01 0.00 -0.00 0.00 0.00 56.01 51.31 3kts n LEU 181 Cb 0.39 -1.46 -0.01 0.00 -0.00 0.00 0.00 43.42 42.34 3kts n LEU 181 CO 0.32 2.06 -0.55 0.79 -0.00 0.00 0.00 177.39 180.00 3kts n TRP 182 N 2.66 0.00 0.60 1.47 8.01 -1.24 -4.67 117.44 124.28 3kts n TRP 182 Ca 0.70 0.00 0.07 0.00 -1.31 0.00 0.00 57.50 56.96 3kts n TRP 182 Cb 0.26 -0.07 0.02 0.00 -2.01 0.00 0.00 31.31 29.51 3kts n TRP 182 CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 177.69 177.07 3kts n GLU 183 N -2.23 1.54 0.14 -0.99 4.71 -1.24 -4.72 120.64 117.85 3kts n GLU 183 Ca -0.03 -0.95 -0.07 0.00 -0.01 0.00 0.00 57.16 56.11 3kts n GLU 183 Cb 0.54 -1.22 -0.03 0.00 -1.01 0.00 0.00 31.44 29.72 3kts n GLU 183 CO 0.00 0.00 0.00 0.78 0.09 0.00 0.00 177.13 178.00 3kts h GLY 184 N 2.88 -0.45 -0.43 0.62 0.00 -1.83 -3.54 103.07 100.33 3kts h GLY 184 Ca 0.00 0.17 0.00 0.00 0.00 0.00 0.00 47.33 47.50 3kts h GLY 184 CO 0.00 -0.16 0.00 1.57 0.00 0.00 0.00 176.54 177.95