#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 0.80 -2.38 3.23 1.02 -1.26 -5.04 120.64 117.01 3kts n GLU 2 Ca 0.00 0.00 -0.41 0.00 -0.02 0.00 0.00 57.16 56.73 3kts n GLU 2 Cb 0.00 0.00 -0.03 0.00 -0.02 0.00 0.00 31.44 31.39 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 0.00 4.44 0.47 -4.62 1.43 -1.26 -4.94 118.68 114.20 3kts s LEU 3 Ca 0.00 2.21 0.33 0.00 -1.03 0.00 0.00 54.13 55.64 3kts s LEU 3 Cb 0.00 -3.60 1.46 0.00 0.03 0.00 0.00 46.19 44.08 3kts s LEU 3 CO 0.00 -0.38 1.66 -0.65 0.23 0.00 0.00 176.35 177.21 3kts h PRO 4 N 5.40 0.09 -3.68 1.29 0.11 -2.01 -3.23 132.00 129.98 3kts h PRO 4 Ca -0.44 -0.01 -0.73 0.00 0.11 0.00 0.00 66.00 64.94 3kts h PRO 4 Cb 1.21 -0.02 -0.08 0.00 0.11 0.00 0.00 31.00 32.22 3kts h PRO 4 CO 0.75 0.06 2.74 1.97 -0.21 0.00 0.00 178.00 183.31 3kts n PHE 5 N -4.47 3.18 -3.24 0.65 1.16 -1.26 -4.92 117.46 108.56 3kts n PHE 5 Ca 0.35 -2.91 -0.39 0.00 -1.87 0.00 0.00 57.45 52.64 3kts n PHE 5 Cb 1.44 -2.29 -0.06 0.00 -1.61 0.00 0.00 39.48 36.97 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 2.11 7.03 -1.51 5.98 0.01 -1.22 -4.22 113.70 121.89 3kts s SER 6 Ca 0.46 1.23 -0.10 0.00 1.31 0.00 0.00 55.95 58.85 3kts s SER 6 Cb 0.13 -2.36 0.07 0.00 0.21 0.00 0.00 66.02 64.07 3kts s SER 6 CO -0.05 0.21 0.82 0.59 0.41 0.00 0.00 173.24 175.21 3kts n ASN 7 N 2.12 -3.26 -3.70 2.44 5.03 -1.26 -4.99 115.26 111.64 3kts n ASN 7 Ca -0.09 -0.86 -0.28 0.00 0.87 0.00 0.00 54.58 54.22 3kts n ASN 7 Cb 0.51 -3.61 -0.16 0.00 -1.02 0.00 0.00 39.78 35.50 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 -6.55 0.59 0.09 3.52 0.74 -1.26 -5.03 119.66 111.77 3kts s GLN 8 Ca 0.47 -0.63 -0.04 0.00 0.05 0.00 0.00 55.36 55.21 3kts s GLN 8 Cb -0.24 -1.93 -0.24 0.00 1.10 0.00 0.00 33.01 31.70 3kts s GLN 8 CO 0.85 -0.80 1.18 0.77 -0.55 0.00 0.00 175.29 176.73 3kts h SER 9 N 8.22 0.42 -3.53 6.67 0.02 -1.92 -3.42 113.55 120.01 3kts h SER 9 Ca -0.16 -0.43 -0.64 0.00 -0.84 0.00 0.00 61.79 59.72 3kts h SER 9 Cb 1.07 -0.14 -0.33 0.00 0.14 0.00 0.00 62.40 63.15 3kts h SER 9 CO 0.39 1.31 -0.87 -0.63 -1.14 0.00 0.00 176.83 175.90 3kts s ILE 10 N -2.76 1.83 -0.26 3.27 1.09 -1.26 -0.76 121.20 122.35 3kts s ILE 10 Ca -0.04 -0.90 -0.04 0.00 -1.10 0.00 0.00 60.65 58.56 3kts s ILE 10 Cb 0.07 -1.59 0.01 0.00 -1.06 0.00 0.00 42.46 39.90 3kts s ILE 10 CO 0.88 0.51 0.01 -0.63 -0.10 0.00 0.00 174.94 175.61 3kts s ILE 11 N 0.28 3.46 0.40 2.92 1.01 -0.20 -4.91 121.20 124.16 3kts s ILE 11 Ca -0.14 -0.78 -0.25 0.00 0.00 0.00 0.00 60.65 59.48 3kts s ILE 11 Cb -0.16 -2.74 -0.08 0.00 0.01 0.00 0.00 42.46 39.48 3kts s ILE 11 CO 0.06 0.19 1.15 -2.16 0.00 0.00 0.00 174.94 174.18 3kts s PRO 12 N 1.43 4.06 -0.16 2.79 0.04 -1.26 -2.34 135.00 139.57 3kts s PRO 12 Ca 0.02 1.78 0.01 0.00 0.04 0.00 0.00 61.00 62.85 3kts s PRO 12 Cb -0.16 -2.64 0.02 0.00 0.04 0.00 0.00 34.50 31.75 3kts s PRO 12 CO -0.01 -0.29 -0.16 0.00 0.04 0.00 0.00 177.00 176.57 3kts s ALA 13 N -1.46 2.02 -0.04 8.56 0.00 -0.81 -0.91 121.76 129.13 3kts s ALA 13 Ca 0.57 -1.01 -0.24 0.00 0.00 0.00 0.00 51.96 51.28 3kts s ALA 13 Cb -0.29 -1.09 -0.04 0.00 0.00 0.00 0.00 23.12 21.70 3kts s ALA 13 CO 0.36 -0.36 0.75 0.00 0.00 0.00 0.00 175.76 176.51 3kts s ALA 14 N 1.40 3.32 -0.12 0.00 0.00 0.04 -4.50 121.76 121.90 3kts s ALA 14 Ca 0.05 0.21 0.05 0.00 0.00 0.00 0.00 51.96 52.27 3kts s ALA 14 Cb -0.13 -3.01 -0.24 0.00 0.00 0.00 0.00 23.12 19.74 3kts s ALA 14 CO -0.11 -0.10 0.36 0.72 0.00 0.00 0.00 175.76 176.63 3kts n HIS 15 N 3.66 0.82 -4.29 0.00 8.25 -1.26 -1.63 115.22 120.78 3kts n HIS 15 Ca -0.00 0.23 -0.29 0.00 -0.26 0.00 0.00 57.72 57.40 3kts n HIS 15 Cb 0.51 -1.13 -0.05 0.00 1.12 0.00 0.00 29.99 30.45 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 -6.40 4.38 0.16 0.41 0.01 -1.26 -4.21 114.94 108.03 3kts s ASN 16 Ca -0.16 -1.40 -0.08 0.00 -0.71 0.00 0.00 52.86 50.51 3kts s ASN 16 Cb 0.07 0.33 0.01 0.00 0.41 0.00 0.00 41.25 42.07 3kts s ASN 16 CO 0.78 -0.92 1.47 -0.61 -1.51 0.00 0.00 177.10 176.31 3kts h GLN 17 N 1.10 0.78 0.00 -0.60 -0.00 -1.96 -3.24 115.11 111.20 3kts h GLN 17 Ca -0.41 -0.46 -0.08 0.00 -0.00 0.00 0.00 58.65 57.70 3kts h GLN 17 Cb 1.30 0.04 -0.01 0.00 0.00 0.00 0.00 27.48 28.81 3kts h GLN 17 CO 0.66 1.09 -0.36 0.87 0.00 0.00 0.00 178.83 181.10 3kts h LYS 18 N 0.61 0.00 0.00 1.69 1.57 -2.01 -3.24 116.57 115.20 3kts h LYS 18 Ca 0.03 0.00 -0.05 0.00 -1.87 0.00 0.00 60.65 58.76 3kts h LYS 18 Cb 1.07 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.38 3kts h LYS 18 CO 0.11 0.36 -0.25 -0.44 -0.57 0.00 0.00 179.45 178.66 3kts h ASP 19 N 0.00 0.00 1.90 0.86 5.19 -1.95 -2.11 116.42 120.30 3kts h ASP 19 Ca -0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 3kts h ASP 19 Cb 1.16 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.67 3kts h ASP 19 CO 0.05 0.25 -0.10 0.00 -3.12 0.00 0.00 179.24 176.31 3kts h MET 20 N 0.00 0.00 -0.07 3.56 -0.00 -1.63 -3.01 114.93 113.78 3kts h MET 20 Ca -0.00 0.00 -0.22 0.00 -0.00 0.00 0.00 59.70 59.48 3kts h MET 20 Cb 0.63 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 32.23 3kts h MET 20 CO 0.03 0.00 -0.84 0.93 -0.00 0.00 0.00 176.91 177.03 3kts h GLU 21 N 0.00 0.55 0.04 -0.10 5.08 -1.49 -2.68 114.58 115.98 3kts h GLU 21 Ca 0.00 -0.50 -0.00 0.00 -1.00 0.00 0.00 59.36 57.86 3kts h GLU 21 Cb 1.00 0.12 0.00 0.00 0.50 0.00 0.00 28.75 30.37 3kts h GLU 21 CO 0.00 1.13 -0.02 0.87 -1.00 0.00 0.00 179.01 179.99 3kts h LYS 22 N 0.35 -0.05 0.00 2.33 1.79 -1.50 -3.02 116.57 116.46 3kts h LYS 22 Ca -0.06 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.41 3kts h LYS 22 Cb 1.46 0.01 0.00 0.00 -1.58 0.00 0.00 32.23 32.12 3kts h LYS 22 CO 0.16 0.05 0.00 0.44 -1.08 0.00 0.00 179.45 179.01 3kts n ILE 23 N -5.07 0.04 0.26 1.86 -5.35 -1.14 -3.16 119.36 106.80 3kts n ILE 23 Ca -0.08 0.01 0.15 0.00 -0.27 0.00 0.00 62.75 62.57 3kts n ILE 23 Cb 0.09 -0.57 0.48 0.00 -1.74 0.00 0.00 39.64 37.90 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 0.00 0.00 -5.54 7.28 5.85 -1.33 -3.30 115.31 118.26 3kts h LEU 24 Ca 0.00 0.00 -0.65 0.00 0.84 0.00 0.00 57.88 58.07 3kts h LEU 24 Cb 0.08 0.00 -0.38 0.00 0.37 0.00 0.00 40.66 40.73 3kts h LEU 24 CO 0.00 0.00 -0.20 -0.62 -0.34 0.00 0.00 178.44 177.28 3kts n GLU 25 N -3.06 3.82 -4.16 1.25 1.02 -1.19 -4.98 120.64 113.35 3kts n GLU 25 Ca 0.02 -4.82 -0.13 0.00 -0.02 0.00 0.00 57.16 52.21 3kts n GLU 25 Cb 0.39 -2.30 -0.11 0.00 -0.02 0.00 0.00 31.44 29.41 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 -3.70 2.41 0.51 -4.62 1.02 -1.25 -5.04 118.68 108.00 3kts s LEU 26 Ca 0.46 -0.82 0.25 0.00 0.02 0.00 0.00 54.13 54.04 3kts s LEU 26 Cb 0.26 -0.22 1.35 0.00 0.02 0.00 0.00 46.19 47.59 3kts s LEU 26 CO -0.14 -0.30 2.05 -0.78 0.02 0.00 0.00 176.35 177.20 3kts h ASP 27 N 3.57 0.00 -4.24 2.29 3.58 -1.94 -3.44 116.42 116.24 3kts h ASP 27 Ca -0.37 0.00 -0.50 0.00 0.42 0.00 0.00 57.03 56.58 3kts h ASP 27 Cb 1.19 0.00 0.09 0.00 1.72 0.00 0.00 39.33 42.33 3kts h ASP 27 CO 0.54 0.14 0.36 -0.76 -2.88 0.00 0.00 179.24 176.64 3kts s LEU 28 N -7.55 3.31 -0.02 2.28 1.43 -1.26 -5.00 118.68 111.87 3kts s LEU 28 Ca -0.03 1.84 0.06 0.00 -1.03 0.00 0.00 54.13 54.97 3kts s LEU 28 Cb 0.14 -4.53 -0.09 0.00 0.03 0.00 0.00 46.19 41.73 3kts s LEU 28 CO 0.61 -1.51 0.12 1.07 0.23 0.00 0.00 176.35 176.86 3kts n THR 29 N -2.62 0.07 -4.50 5.49 5.66 -1.26 -4.99 114.28 112.14 3kts n THR 29 Ca 0.09 -0.16 -0.34 0.00 -3.05 0.00 0.00 64.05 60.59 3kts n THR 29 Cb 0.53 0.13 -0.12 0.00 -1.55 0.00 0.00 70.33 69.32 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 -2.38 2.97 0.14 1.09 1.51 -1.26 -0.50 117.35 118.91 3kts s TYR 30 Ca -0.02 -0.34 0.05 0.00 -1.01 0.00 0.00 57.07 55.75 3kts s TYR 30 Cb 0.04 -1.91 -0.04 0.00 -0.11 0.00 0.00 41.96 39.93 3kts s TYR 30 CO 0.26 -0.04 -0.12 0.00 -1.11 0.00 0.00 175.55 174.54 3kts s MET 31 N 0.26 1.04 -0.08 -0.62 0.23 -0.54 -4.10 119.30 115.48 3kts s MET 31 Ca -0.04 -1.35 0.01 0.00 -1.03 0.00 0.00 55.69 53.28 3kts s MET 31 Cb -0.14 -0.74 -0.03 0.00 -1.53 0.00 0.00 34.83 32.39 3kts s MET 31 CO 0.03 0.12 -0.09 0.08 -2.03 0.00 0.00 175.02 173.13 3kts s VAL 32 N -2.77 3.53 -0.19 5.16 1.01 -0.09 0.10 120.40 127.15 3kts s VAL 32 Ca 0.13 -0.54 -0.06 0.00 0.00 0.00 0.00 61.98 61.51 3kts s VAL 32 Cb -0.01 -2.44 -0.03 0.00 0.00 0.00 0.00 36.38 33.90 3kts s VAL 32 CO 0.02 0.58 0.02 -0.32 0.00 0.00 0.00 175.10 175.40 3kts s MET 33 N -0.61 3.74 0.00 2.72 1.75 -0.96 -0.78 119.30 125.16 3kts s MET 33 Ca 0.09 -0.46 0.00 0.00 -1.25 0.00 0.00 55.69 54.07 3kts s MET 33 Cb -0.12 -3.12 0.00 0.00 2.84 0.00 0.00 34.83 34.43 3kts s MET 33 CO 0.02 0.10 0.00 1.28 -0.65 0.00 0.00 175.02 175.77 3kts n LEU 34 N 4.00 0.00 -4.50 4.11 4.77 -0.64 -1.06 117.00 123.67 3kts n LEU 34 Ca -0.17 0.00 -0.35 0.00 -0.03 0.00 0.00 56.01 55.47 3kts n LEU 34 Cb 0.52 -0.45 -0.12 0.00 -2.33 0.00 0.00 43.42 41.04 3kts n LEU 34 CO 0.33 -0.45 -0.32 -0.70 -1.33 0.00 0.00 177.39 174.92 3kts s GLU 35 N -0.90 3.71 0.06 3.23 2.12 -1.26 -4.37 118.70 121.29 3kts s GLU 35 Ca 0.00 -0.48 0.01 0.00 0.36 0.00 0.00 54.97 54.86 3kts s GLU 35 Cb 0.00 -3.08 -0.03 0.00 0.26 0.00 0.00 34.13 31.27 3kts s GLU 35 CO 0.00 0.11 -0.05 0.95 -0.54 0.00 0.00 175.26 175.73 3kts s THR 36 N 0.74 0.41 -0.17 -1.70 -4.23 -0.31 -4.76 115.64 105.62 3kts s THR 36 Ca 0.01 -1.55 -0.04 0.00 -1.18 0.00 0.00 61.69 58.93 3kts s THR 36 Cb -0.14 -1.17 -0.03 0.00 1.34 0.00 0.00 72.50 72.51 3kts s THR 36 CO 0.02 -0.75 -0.03 -1.00 -0.54 0.00 0.00 174.62 172.32 3kts s HIS 37 N -2.89 3.03 0.60 3.99 0.09 -1.26 0.10 115.29 118.95 3kts s HIS 37 Ca 0.01 -0.34 0.31 0.00 -0.00 0.00 0.00 55.06 55.04 3kts s HIS 37 Cb 0.00 -1.99 1.78 0.00 -0.00 0.00 0.00 32.58 32.37 3kts s HIS 37 CO -0.05 -0.09 2.17 -0.24 -0.00 0.00 0.00 174.74 176.53 3kts h VAL 38 N 5.21 0.43 0.00 -0.90 3.04 -1.17 0.45 116.25 123.30 3kts h VAL 38 Ca -0.33 0.00 -0.03 0.00 -1.01 0.00 0.00 66.70 65.33 3kts h VAL 38 Cb 1.19 0.90 -0.00 0.00 -2.01 0.00 0.00 31.29 31.36 3kts h VAL 38 CO 0.63 0.00 -0.16 0.00 -1.01 0.00 0.00 177.57 177.03 3kts h ALA 39 N 1.85 1.06 -0.05 3.17 0.00 -1.95 -3.20 119.26 120.14 3kts h ALA 39 Ca 0.05 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.81 3kts h ALA 39 Cb 0.29 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.05 3kts h ALA 39 CO -0.00 0.20 0.00 1.04 0.00 0.00 0.00 179.25 180.49 3kts n GLN 40 N -3.38 1.44 0.07 0.00 6.02 0.11 -4.84 117.38 116.80 3kts n GLN 40 Ca -0.00 -1.22 -0.13 0.00 -0.01 0.00 0.00 57.00 55.64 3kts n GLN 40 Cb 0.36 -1.06 -0.08 0.00 1.02 0.00 0.00 30.24 30.48 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 0.48 -0.12 -1.31 1.08 5.85 -1.45 -2.44 115.31 117.41 3kts h LEU 41 Ca 0.00 -0.19 -0.03 0.00 0.84 0.00 0.00 57.88 58.50 3kts h LEU 41 Cb 0.36 0.03 -0.02 0.00 0.37 0.00 0.00 40.66 41.41 3kts h LEU 41 CO 0.00 0.12 0.12 0.50 -0.34 0.00 0.00 178.44 178.84 3kts h LYS 42 N -0.37 0.59 -0.36 1.25 3.64 -1.88 -2.13 116.57 117.31 3kts h LYS 42 Ca -0.01 -0.09 -0.17 0.00 -1.27 0.00 0.00 60.65 59.10 3kts h LYS 42 Cb 0.31 -0.10 -0.00 0.00 -0.41 0.00 0.00 32.23 32.02 3kts h LYS 42 CO 0.02 0.53 -0.43 0.00 -2.27 0.00 0.00 179.45 177.30 3kts h ALA 43 N 1.55 0.54 0.05 5.00 0.00 -1.90 -2.97 119.26 121.53 3kts h ALA 43 Ca 0.14 -0.47 -0.00 0.00 0.00 0.00 0.00 54.91 54.57 3kts h ALA 43 Cb 0.19 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.87 3kts h ALA 43 CO -0.01 0.68 -0.02 -0.07 0.00 0.00 0.00 179.25 179.82 3kts h LEU 44 N 0.74 -0.06 -0.34 0.00 3.38 -1.15 -2.64 115.31 115.25 3kts h LEU 44 Ca 0.05 -0.45 0.04 0.00 0.09 0.00 0.00 57.88 57.60 3kts h LEU 44 Cb 1.03 0.01 -0.04 0.00 0.09 0.00 0.00 40.66 41.76 3kts h LEU 44 CO 0.10 0.44 0.12 0.58 0.09 0.00 0.00 178.44 179.77 3kts h VAL 45 N -0.57 0.91 -0.31 1.22 2.07 -1.51 -1.11 116.25 116.95 3kts h VAL 45 Ca -0.01 -0.09 -0.05 0.00 0.82 0.00 0.00 66.70 67.37 3kts h VAL 45 Cb 0.51 0.62 -0.02 0.00 -1.52 0.00 0.00 31.29 30.88 3kts h VAL 45 CO 0.01 0.05 -0.03 0.50 0.02 0.00 0.00 177.57 178.12 3kts h LYS 46 N 0.27 0.48 -0.13 1.57 3.64 -1.60 -0.46 116.57 120.34 3kts h LYS 46 Ca 0.15 -0.11 -0.18 0.00 -1.27 0.00 0.00 60.65 59.25 3kts h LYS 46 Cb 0.12 -0.07 -0.00 0.00 -0.41 0.00 0.00 32.23 31.87 3kts h LYS 46 CO -0.15 0.53 -0.67 -0.92 -2.27 0.00 0.00 179.45 175.97 3kts h TYR 47 N 0.46 0.67 -0.31 1.91 3.20 -1.09 -0.79 116.97 121.02 3kts h TYR 47 Ca 0.10 -0.27 -0.13 0.00 3.14 0.00 0.00 58.73 61.56 3kts h TYR 47 Cb 0.35 -0.11 -0.01 0.00 1.54 0.00 0.00 36.73 38.50 3kts h TYR 47 CO 0.01 1.03 -0.35 0.00 -1.64 0.00 0.00 178.16 177.21 3kts h ALA 48 N 0.90 0.81 0.00 1.82 0.00 -0.77 -2.20 119.26 119.82 3kts h ALA 48 Ca -0.02 -0.42 -0.13 0.00 0.00 0.00 0.00 54.91 54.34 3kts h ALA 48 Cb 1.24 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.89 3kts h ALA 48 CO 0.12 0.64 -0.61 1.96 0.00 0.00 0.00 179.25 181.37 3kts h GLN 49 N 0.58 0.00 -0.58 0.00 4.20 -1.04 -2.16 115.11 116.11 3kts h GLN 49 Ca 0.06 0.00 -0.08 0.00 0.06 0.00 0.00 58.65 58.69 3kts h GLN 49 Cb 0.87 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.62 3kts h GLN 49 CO 0.08 0.61 0.05 0.00 -0.67 0.00 0.00 178.83 178.89 3kts h ALA 50 N 1.39 0.99 -0.08 3.87 0.00 -0.96 -2.75 119.26 121.72 3kts h ALA 50 Ca -0.01 -0.27 -0.03 0.00 0.00 0.00 0.00 54.91 54.60 3kts h ALA 50 Cb 1.11 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.66 3kts h ALA 50 CO 0.08 0.63 0.03 0.41 0.00 0.00 0.00 179.25 180.40 3kts n GLY 51 N -0.59 1.94 2.71 0.00 0.00 -0.85 -4.85 105.19 103.56 3kts n GLY 51 Ca 0.03 -0.10 -0.16 0.00 0.00 0.00 0.00 46.02 45.79 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 0.19 -0.19 3.34 -0.02 0.00 -1.04 -4.97 105.19 102.52 3kts n GLY 52 Ca 0.04 -0.10 -0.26 0.00 0.00 0.00 0.00 46.02 45.70 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 -5.45 1.28 -0.14 1.61 -0.14 -0.83 -4.86 119.74 111.21 3kts s LYS 53 Ca 0.25 -1.29 -0.02 0.00 -1.36 0.00 0.00 55.97 53.55 3kts s LYS 53 Cb -0.11 -1.64 -0.02 0.00 -1.68 0.00 0.00 37.83 34.38 3kts s LYS 53 CO 0.31 0.38 -0.07 0.15 -0.76 0.00 0.00 175.35 175.35 3kts s LYS 54 N -2.09 3.50 -0.16 1.68 1.02 0.34 -3.82 119.74 120.21 3kts s LYS 54 Ca 0.11 -0.58 -0.07 0.00 0.02 0.00 0.00 55.97 55.46 3kts s LYS 54 Cb -0.10 -2.79 -0.04 0.00 -0.52 0.00 0.00 37.83 34.38 3kts s LYS 54 CO 0.06 0.27 0.07 0.08 -0.92 0.00 0.00 175.35 174.91 3kts s VAL 55 N 0.25 4.85 -0.90 3.17 1.01 -1.26 -1.47 120.40 126.04 3kts s VAL 55 Ca -0.05 -0.02 -0.04 0.00 0.00 0.00 0.00 61.98 61.87 3kts s VAL 55 Cb -0.14 -3.15 0.22 0.00 0.00 0.00 0.00 36.38 33.31 3kts s VAL 55 CO 0.04 0.50 0.80 -0.76 0.00 0.00 0.00 175.10 175.69 3kts s LEU 56 N -0.01 5.75 0.13 3.92 1.43 0.11 -0.87 118.68 129.15 3kts s LEU 56 Ca 0.06 -3.53 -0.30 0.00 -1.03 0.00 0.00 54.13 49.33 3kts s LEU 56 Cb -0.12 -1.98 -0.07 0.00 0.03 0.00 0.00 46.19 44.05 3kts s LEU 56 CO 0.01 -0.25 1.12 -0.22 0.23 0.00 0.00 176.35 177.23 3kts s LEU 57 N -1.08 4.45 -0.08 1.79 2.96 -0.41 -2.27 118.68 124.04 3kts s LEU 57 Ca 0.26 2.03 -0.30 0.00 -0.22 0.00 0.00 54.13 55.91 3kts s LEU 57 Cb -0.10 -3.59 -0.04 0.00 0.50 0.00 0.00 46.19 42.96 3kts s LEU 57 CO -0.10 -0.29 1.43 -1.00 -1.32 0.00 0.00 176.35 175.07 3kts s HIS 58 N 0.21 2.56 -0.44 5.38 3.76 -0.23 -0.64 115.29 125.89 3kts s HIS 58 Ca 0.52 0.68 0.26 0.00 -0.15 0.00 0.00 55.06 56.37 3kts s HIS 58 Cb -0.29 -3.69 0.70 0.00 1.11 0.00 0.00 32.58 30.42 3kts s HIS 58 CO 0.33 -2.63 1.73 0.00 -0.85 0.00 0.00 174.74 173.32 3kts h ALA 59 N 8.54 1.00 0.00 -1.40 0.00 -1.15 -3.31 119.26 122.94 3kts h ALA 59 Ca -0.34 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.57 3kts h ALA 59 Cb 1.15 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.94 3kts h ALA 59 CO 0.94 0.00 -0.93 -0.25 0.00 0.00 0.00 179.25 179.01 3kts n ASP 60 N -2.78 0.83 -0.51 0.00 10.43 -1.26 -4.38 116.55 118.89 3kts n ASP 60 Ca 0.04 -0.76 0.06 0.00 2.57 0.00 0.00 54.79 56.70 3kts n ASP 60 Cb 0.44 0.87 0.19 0.00 1.84 0.00 0.00 41.12 44.45 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 -1.56 2.89 -4.57 0.64 4.77 -1.24 -4.96 117.00 112.98 3kts n LEU 61 Ca 0.04 -3.49 -0.42 0.00 -0.03 0.00 0.00 56.01 52.11 3kts n LEU 61 Cb 0.35 -0.51 -0.07 0.00 -2.33 0.00 0.00 43.42 40.86 3kts n LEU 61 CO 0.41 1.05 0.38 -0.69 -1.33 0.00 0.00 177.39 177.21 3kts s VAL 62 N -3.06 4.90 0.07 4.08 1.01 -1.26 -1.17 120.40 124.97 3kts s VAL 62 Ca 0.37 0.57 -0.31 0.00 0.00 0.00 0.00 61.98 62.62 3kts s VAL 62 Cb 0.34 -4.07 -0.06 0.00 0.00 0.00 0.00 36.38 32.58 3kts s VAL 62 CO -0.01 -0.31 1.31 0.20 0.00 0.00 0.00 175.10 176.30 3kts s ASN 63 N 1.79 6.93 0.00 3.32 0.01 0.29 -3.07 114.94 124.21 3kts s ASN 63 Ca 0.24 2.16 0.00 0.00 -0.71 0.00 0.00 52.86 54.55 3kts s ASN 63 Cb -0.15 -2.58 0.00 0.00 0.41 0.00 0.00 41.25 38.94 3kts s ASN 63 CO 0.15 -0.59 0.00 0.61 -1.51 0.00 0.00 177.10 175.76 3kts n GLY 64 N 3.41 3.35 3.40 0.66 0.00 -1.26 -0.58 105.19 114.17 3kts n GLY 64 Ca 0.11 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.83 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 2.35 0.00 0.99 2.96 -1.18 -4.99 118.68 118.82 3kts s LEU 65 Ca 0.00 -0.66 0.00 0.00 -0.22 0.00 0.00 54.13 53.25 3kts s LEU 65 Cb 0.00 -1.30 0.00 0.00 0.50 0.00 0.00 46.19 45.39 3kts s LEU 65 CO 0.00 0.20 0.00 0.29 -1.32 0.00 0.00 176.35 175.52 3kts n LYS 66 N 1.15 0.18 -0.96 1.98 5.02 -1.26 -4.72 118.16 119.54 3kts n LYS 66 Ca -0.17 0.00 -0.00 0.00 -2.02 0.00 0.00 58.31 56.12 3kts n LYS 66 Cb 0.53 0.00 0.16 0.00 -0.02 0.00 0.00 35.03 35.70 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 -2.85 2.32 -4.62 4.39 6.94 -1.26 -4.84 115.26 115.34 3kts n ASN 67 Ca 0.00 -3.76 -0.29 0.00 -0.02 0.00 0.00 54.58 50.52 3kts n ASN 67 Cb 0.00 -0.48 0.20 0.00 -2.36 0.00 0.00 39.78 37.14 3kts n ASN 67 CO 0.00 0.00 0.00 -1.81 -1.03 0.00 0.00 177.26 174.42 3kts s ASP 68 N -3.26 2.11 0.18 0.53 -0.00 -1.26 -4.63 116.67 110.34 3kts s ASP 68 Ca 0.40 1.28 -0.13 0.00 -0.00 0.00 0.00 52.55 54.11 3kts s ASP 68 Cb 0.38 -1.98 0.14 0.00 -0.00 0.00 0.00 42.92 41.46 3kts s ASP 68 CO -0.05 -3.47 1.78 0.44 -0.00 0.00 0.00 175.17 173.87 3kts h ASP 69 N -2.12 0.35 -0.92 0.27 3.32 -1.98 0.23 116.42 115.56 3kts h ASP 69 Ca -0.57 0.03 0.04 0.00 0.02 0.00 0.00 57.03 56.56 3kts h ASP 69 Cb 1.33 -0.03 -0.06 0.00 0.22 0.00 0.00 39.33 40.79 3kts h ASP 69 CO 0.55 0.24 0.60 1.88 -1.72 0.00 0.00 179.24 180.79 3kts h TYR 70 N 0.49 1.12 -0.26 4.55 -1.99 -1.98 0.42 116.97 119.30 3kts h TYR 70 Ca 0.23 0.03 -0.13 0.00 2.00 0.00 0.00 58.73 60.85 3kts h TYR 70 Cb 0.15 -0.37 -0.01 0.00 2.00 0.00 0.00 36.73 38.50 3kts h TYR 70 CO -0.11 0.63 -0.38 0.00 -0.00 0.00 0.00 178.16 178.30 3kts h ALA 71 N 1.39 0.84 -0.12 3.88 0.00 -1.77 -1.99 119.26 121.48 3kts h ALA 71 Ca 0.37 -0.43 -0.07 0.00 0.00 0.00 0.00 54.91 54.78 3kts h ALA 71 Cb 0.03 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 17.71 3kts h ALA 71 CO -0.13 0.64 -0.19 0.82 0.00 0.00 0.00 179.25 180.39 3kts h ILE 72 N 0.50 1.37 -1.01 0.00 1.08 0.14 -1.76 117.51 117.84 3kts h ILE 72 Ca 0.05 -1.43 0.26 0.00 -0.39 0.00 0.00 64.86 63.35 3kts h ILE 72 Cb 0.89 2.01 -0.13 0.00 -3.07 0.00 0.00 36.82 36.52 3kts h ILE 72 CO 0.08 0.42 0.59 0.44 -0.69 0.00 0.00 178.15 178.99 3kts h ASP 73 N -0.06 0.64 -0.07 1.72 3.32 -0.20 -0.87 116.42 120.89 3kts h ASP 73 Ca 0.01 0.15 -0.02 0.00 0.02 0.00 0.00 57.03 57.19 3kts h ASP 73 Cb 0.76 0.05 -0.00 0.00 0.22 0.00 0.00 39.33 40.36 3kts h ASP 73 CO 0.04 0.06 -0.02 0.15 -1.72 0.00 0.00 179.24 177.75 3kts h PHE 74 N 0.52 0.16 0.00 4.55 3.04 -1.13 -1.33 116.94 122.75 3kts h PHE 74 Ca 0.66 -0.03 -0.01 0.00 3.98 0.00 0.00 57.97 62.57 3kts h PHE 74 Cb 1.33 -0.04 -0.00 0.00 2.56 0.00 0.00 35.95 39.80 3kts h PHE 74 CO -0.01 0.46 -0.06 -0.07 -2.02 0.00 0.00 178.31 176.62 3kts h LEU 75 N -0.19 0.00 0.06 0.59 3.38 -0.39 -2.14 115.31 116.62 3kts h LEU 75 Ca 0.02 0.00 -0.34 0.00 0.09 0.00 0.00 57.88 57.65 3kts h LEU 75 Cb 0.41 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.12 3kts h LEU 75 CO 0.01 0.06 -1.98 0.00 0.09 0.00 0.00 178.44 176.61 3kts n THR 77 N -3.25 0.00 0.00 0.00 -2.24 -0.51 -4.41 114.28 103.87 3kts n THR 77 Ca -0.28 -0.34 0.00 0.00 -2.27 0.00 0.00 64.05 61.15 3kts n THR 77 Cb 1.05 1.25 0.00 0.00 -2.10 0.00 0.00 70.33 70.53 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 0.13 0.00 -0.07 -0.78 1.02 -0.83 -4.94 120.64 115.18 3kts n GLU 78 Ca 0.08 0.00 -0.11 0.00 -0.02 0.00 0.00 57.16 57.11 3kts n GLU 78 Cb 0.40 -0.51 -0.10 0.00 -0.02 0.00 0.00 31.44 31.22 3kts n GLU 78 CO 0.00 0.00 0.00 0.82 1.18 0.00 0.00 177.13 179.13 3kts h ILE 79 N 0.00 1.29 -5.74 -3.67 5.03 -1.59 -3.49 117.51 109.33 3kts h ILE 79 Ca 0.00 -2.00 -0.14 0.00 -0.12 0.00 0.00 64.86 62.60 3kts h ILE 79 Cb 0.18 2.46 0.01 0.00 -3.03 0.00 0.00 36.82 36.44 3kts h ILE 79 CO 0.00 0.44 -0.72 0.00 -0.68 0.00 0.00 178.15 177.19 3kts n PRO 81 N -0.43 -0.47 -0.46 0.00 -0.04 -1.26 -4.94 135.00 127.40 3kts n PRO 81 Ca 0.03 -1.70 0.10 0.00 -0.04 0.00 0.00 63.50 61.90 3kts n PRO 81 Cb 0.54 -0.76 0.33 0.00 -0.04 0.00 0.00 33.50 33.57 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 -3.31 4.12 0.00 3.54 8.00 -0.05 -4.90 116.55 123.96 3kts n ASP 82 Ca 0.12 -2.18 0.00 0.00 0.71 0.00 0.00 54.79 53.44 3kts n ASP 82 Cb 0.42 -0.51 0.00 0.00 -0.02 0.00 0.00 41.12 41.01 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 1.42 1.74 3.38 0.44 0.00 -0.74 -4.32 105.19 107.10 3kts n GLY 83 Ca 0.24 -0.23 -0.28 0.00 0.00 0.00 0.00 46.02 45.75 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 -1.67 2.19 -0.08 -0.61 -4.36 -0.36 -1.28 121.20 115.03 3kts s ILE 84 Ca 0.00 -1.73 0.04 0.00 -0.26 0.00 0.00 60.65 58.70 3kts s ILE 84 Cb 0.00 -1.94 -0.01 0.00 1.25 0.00 0.00 42.46 41.76 3kts s ILE 84 CO 0.00 0.07 -0.22 -0.63 0.24 0.00 0.00 174.94 174.40 3kts s ILE 85 N -1.08 2.32 0.06 8.37 1.01 0.19 -2.08 121.20 129.99 3kts s ILE 85 Ca 0.13 -0.95 -0.20 0.00 0.00 0.00 0.00 60.65 59.63 3kts s ILE 85 Cb -0.10 -1.89 0.05 0.00 0.01 0.00 0.00 42.46 40.53 3kts s ILE 85 CO 0.06 0.56 0.47 -0.55 0.00 0.00 0.00 174.94 175.48 3kts s SER 86 N 0.02 -0.37 0.00 3.58 0.15 -1.12 -0.51 113.70 115.45 3kts s SER 86 Ca -0.08 0.04 0.23 0.00 0.70 0.00 0.00 55.95 56.84 3kts s SER 86 Cb -0.15 0.47 0.04 0.00 -1.71 0.00 0.00 66.02 64.67 3kts s SER 86 CO 0.05 -0.73 1.09 1.07 1.20 0.00 0.00 173.24 175.92 3kts n THR 87 N 0.31 0.00 -3.41 6.45 5.66 -1.26 0.27 114.28 122.30 3kts n THR 87 Ca -0.18 -0.05 -0.37 0.00 -3.05 0.00 0.00 64.05 60.40 3kts n THR 87 Cb 0.61 0.83 -0.06 0.00 -1.55 0.00 0.00 70.33 70.16 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 -2.88 4.26 0.34 1.09 3.52 -1.26 -4.88 118.95 119.14 3kts s ARG 88 Ca 0.12 0.32 0.05 0.00 -0.13 0.00 0.00 55.73 56.09 3kts s ARG 88 Cb 0.17 -3.41 0.61 0.00 -1.56 0.00 0.00 34.95 30.76 3kts s ARG 88 CO 0.76 0.24 1.85 0.78 -0.81 0.00 0.00 175.30 178.13 3kts h GLY 89 N 6.49 0.48 1.85 8.12 0.00 -1.96 -2.97 103.07 115.07 3kts h GLY 89 Ca -0.42 -0.30 -0.14 0.00 0.00 0.00 0.00 47.33 46.46 3kts h GLY 89 CO 0.74 0.28 -0.62 3.43 0.00 0.00 0.00 176.54 180.37 3kts h ASN 90 N 0.42 0.18 -0.19 0.19 4.21 -1.95 -3.16 115.58 115.27 3kts h ASN 90 Ca 0.08 -0.11 -0.16 0.00 1.21 0.00 0.00 56.30 57.32 3kts h ASN 90 Cb 0.41 -0.05 -0.00 0.00 -1.12 0.00 0.00 38.32 37.55 3kts h ASN 90 CO 0.02 0.76 -0.48 0.00 -1.29 0.00 0.00 177.43 176.44 3kts h ALA 91 N 1.24 0.62 -0.44 -0.83 0.00 -1.78 -2.79 119.26 115.28 3kts h ALA 91 Ca -0.01 -0.49 -0.01 0.00 0.00 0.00 0.00 54.91 54.41 3kts h ALA 91 Cb 1.13 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.80 3kts h ALA 91 CO 0.09 0.68 0.24 0.82 0.00 0.00 0.00 179.25 181.08 3kts h ILE 92 N 0.60 1.16 -0.71 0.00 1.08 -1.56 -1.85 117.51 116.23 3kts h ILE 92 Ca 0.03 -0.40 -0.05 0.00 -0.39 0.00 0.00 64.86 64.05 3kts h ILE 92 Cb 1.05 0.62 -0.03 0.00 -3.07 0.00 0.00 36.82 35.39 3kts h ILE 92 CO 0.10 0.16 0.24 0.24 -0.69 0.00 0.00 178.15 178.20 3kts h MET 93 N 0.58 1.08 0.00 2.37 2.86 -1.51 -2.32 114.93 117.98 3kts h MET 93 Ca 0.16 -0.21 -0.13 0.00 -2.06 0.00 0.00 59.70 57.45 3kts h MET 93 Cb 0.05 -0.17 -0.02 0.00 0.06 0.00 0.00 31.60 31.52 3kts h MET 93 CO -0.03 0.91 -0.60 -0.22 1.06 0.00 0.00 176.91 178.03 3kts h LYS 94 N 1.04 0.00 -0.12 1.72 1.63 -1.32 -2.89 116.57 116.64 3kts h LYS 94 Ca 0.23 0.00 -0.12 0.00 -0.85 0.00 0.00 60.65 59.91 3kts h LYS 94 Cb 0.27 0.00 -0.01 0.00 -0.60 0.00 0.00 32.23 31.89 3kts h LYS 94 CO -0.01 0.60 -0.45 0.00 -3.45 0.00 0.00 179.45 176.14 3kts h ALA 95 N 1.40 1.01 -0.03 5.00 0.00 -0.99 -3.11 119.26 122.54 3kts h ALA 95 Ca -0.01 -0.45 -0.13 0.00 0.00 0.00 0.00 54.91 54.33 3kts h ALA 95 Cb 1.18 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.86 3kts h ALA 95 CO 0.08 0.63 -0.59 0.87 0.00 0.00 0.00 179.25 180.24 3kts h LYS 96 N 0.23 0.10 -0.81 0.00 1.57 -1.25 0.80 116.57 117.22 3kts h LYS 96 Ca 0.02 -0.07 -0.02 0.00 -1.87 0.00 0.00 60.65 58.71 3kts h LYS 96 Cb 0.90 0.01 -0.04 0.00 0.08 0.00 0.00 32.23 33.18 3kts h LYS 96 CO 0.07 0.66 0.43 1.96 -0.57 0.00 0.00 179.45 182.00 3kts h GLN 97 N 0.07 1.14 -0.22 3.15 4.20 -1.45 -2.23 115.11 119.77 3kts h GLN 97 Ca -0.01 -0.14 0.00 0.00 0.06 0.00 0.00 58.65 58.56 3kts h GLN 97 Cb 1.06 -0.22 0.00 0.00 0.30 0.00 0.00 27.48 28.62 3kts h GLN 97 CO 0.08 0.85 0.00 0.72 -0.67 0.00 0.00 178.83 179.81 3kts n HIS 98 N -4.39 0.29 -3.65 2.96 8.25 -1.07 -4.91 115.22 112.70 3kts n HIS 98 Ca 0.08 -0.15 -0.27 0.00 -0.26 0.00 0.00 57.72 57.13 3kts n HIS 98 Cb 0.11 0.00 0.04 0.00 1.12 0.00 0.00 29.99 31.26 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 0.18 -6.20 -3.04 -0.41 4.76 -0.84 -5.00 118.16 107.61 3kts n LYS 99 Ca 0.10 0.71 -0.30 0.00 -2.87 0.00 0.00 58.31 55.96 3kts n LYS 99 Cb 0.22 -5.65 -0.03 0.00 -1.84 0.00 0.00 35.03 27.73 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 -6.36 3.72 -0.40 1.97 -1.94 0.23 -5.01 119.30 111.51 3kts s MET 100 Ca 0.58 0.29 -0.28 0.00 -1.71 0.00 0.00 55.69 54.57 3kts s MET 100 Cb -0.27 -2.49 -0.03 0.00 2.01 0.00 0.00 34.83 34.05 3kts s MET 100 CO 0.71 0.06 1.92 -1.17 -0.01 0.00 0.00 175.02 176.54 3kts s LEU 101 N -3.73 3.44 -0.72 -0.03 0.20 -1.26 -4.48 118.68 112.09 3kts s LEU 101 Ca 0.48 1.10 -0.14 0.00 0.69 0.00 0.00 54.13 56.27 3kts s LEU 101 Cb -0.10 -3.16 0.19 0.00 -0.43 0.00 0.00 46.19 42.68 3kts s LEU 101 CO 0.31 -2.03 0.65 0.00 -0.29 0.00 0.00 176.35 174.99 3kts s ALA 102 N 8.15 3.90 -0.23 5.97 0.00 -1.26 -1.22 121.76 137.08 3kts s ALA 102 Ca 0.81 -3.05 -0.17 0.00 0.00 0.00 0.00 51.96 49.55 3kts s ALA 102 Cb -0.21 -3.37 -0.03 0.00 0.00 0.00 0.00 23.12 19.51 3kts s ALA 102 CO 0.30 -2.18 0.46 -1.50 0.00 0.00 0.00 175.76 172.84 3kts s ILE 103 N 0.64 5.14 0.09 0.00 2.07 -0.88 -1.35 121.20 126.90 3kts s ILE 103 Ca 0.13 0.80 -0.15 0.00 -1.41 0.00 0.00 60.65 60.01 3kts s ILE 103 Cb -0.17 -3.78 -0.06 0.00 0.13 0.00 0.00 42.46 38.57 3kts s ILE 103 CO -0.05 0.18 0.51 -1.58 -1.91 0.00 0.00 174.94 172.09 3kts s GLN 104 N 1.75 4.00 -0.12 3.50 0.74 0.17 -2.79 119.66 126.92 3kts s GLN 104 Ca 0.20 0.51 -0.04 0.00 0.05 0.00 0.00 55.36 56.08 3kts s GLN 104 Cb -0.15 -3.07 -0.04 0.00 1.10 0.00 0.00 33.01 30.85 3kts s GLN 104 CO 0.09 0.57 0.04 0.50 -0.55 0.00 0.00 175.29 175.94 3kts s ARG 105 N -1.56 3.36 -0.01 1.67 3.52 0.14 0.84 118.95 126.92 3kts s ARG 105 Ca 0.32 -0.35 0.00 0.00 -0.13 0.00 0.00 55.73 55.57 3kts s ARG 105 Cb -0.16 -2.98 0.01 0.00 -1.56 0.00 0.00 34.95 30.26 3kts s ARG 105 CO 0.18 0.58 0.01 -1.17 -0.81 0.00 0.00 175.30 174.09 3kts s LEU 106 N -0.52 1.59 -0.31 -0.88 2.96 -0.50 -4.38 118.68 116.64 3kts s LEU 106 Ca 0.10 0.01 -0.10 0.00 -0.22 0.00 0.00 54.13 53.91 3kts s LEU 106 Cb -0.12 -0.06 -0.02 0.00 0.50 0.00 0.00 46.19 46.50 3kts s LEU 106 CO 0.02 -0.05 0.17 -0.36 -1.32 0.00 0.00 176.35 174.81 3kts s PHE 107 N 0.48 3.19 -1.25 5.38 0.08 -1.26 -1.74 117.98 122.85 3kts s PHE 107 Ca -0.04 -0.38 -0.19 0.00 0.12 0.00 0.00 56.93 56.44 3kts s PHE 107 Cb -0.06 -2.38 0.01 0.00 -0.57 0.00 0.00 43.02 40.02 3kts s PHE 107 CO -0.01 -0.39 1.85 -1.33 -0.10 0.00 0.00 175.22 175.24 3kts n MET 108 N 5.02 2.60 -0.08 0.44 2.81 0.94 -4.64 117.12 124.21 3kts n MET 108 Ca -0.14 -2.91 -0.13 0.00 -1.81 0.00 0.00 57.70 52.72 3kts n MET 108 Cb 0.50 -3.53 -0.07 0.00 -0.71 0.00 0.00 33.22 29.41 3kts n MET 108 CO 0.00 0.00 0.00 0.82 1.51 0.00 0.00 175.97 178.30 3kts h ILE 109 N 5.57 0.70 -3.56 2.02 2.04 -1.94 -3.43 117.51 118.92 3kts h ILE 109 Ca 0.39 -1.72 -0.18 0.00 1.00 0.00 0.00 64.86 64.35 3kts h ILE 109 Cb 0.86 1.53 -0.04 0.00 -0.74 0.00 0.00 36.82 38.43 3kts h ILE 109 CO 1.45 0.24 0.02 -0.90 0.00 0.00 0.00 178.15 178.95 3kts n ASP 110 N -4.57 -1.67 -0.12 1.72 5.75 -1.26 -5.04 116.55 111.37 3kts n ASP 110 Ca -0.17 -2.72 -0.01 0.00 -0.01 0.00 0.00 54.79 51.88 3kts n ASP 110 Cb 0.43 2.94 0.23 0.00 -1.03 0.00 0.00 41.12 43.70 3kts n ASP 110 CO 0.00 0.00 0.00 0.77 -0.11 0.00 0.00 177.20 177.86 3kts h SER 111 N 1.91 0.74 -0.37 -1.12 4.64 -1.98 -1.57 113.55 115.79 3kts h SER 111 Ca -0.29 -0.10 -0.02 0.00 -0.47 0.00 0.00 61.79 60.91 3kts h SER 111 Cb 1.17 -0.19 -0.02 0.00 -0.31 0.00 0.00 62.40 63.04 3kts h SER 111 CO 0.38 0.68 0.17 -1.28 -0.87 0.00 0.00 176.83 175.91 3kts h SER 112 N 0.79 0.54 0.80 4.97 0.87 -1.99 0.30 113.55 119.83 3kts h SER 112 Ca 0.19 -0.06 -0.20 0.00 -1.23 0.00 0.00 61.79 60.49 3kts h SER 112 Cb 0.19 -0.14 -0.02 0.00 -0.44 0.00 0.00 62.40 61.99 3kts h SER 112 CO -0.01 0.49 -0.92 0.00 -0.53 0.00 0.00 176.83 175.86 3kts h ALA 113 N 1.59 0.49 -0.13 6.23 0.00 -1.80 -3.07 119.26 122.57 3kts h ALA 113 Ca 0.15 -0.80 -0.08 0.00 0.00 0.00 0.00 54.91 54.18 3kts h ALA 113 Cb 0.12 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.80 3kts h ALA 113 CO -0.01 1.06 -0.24 -0.92 0.00 0.00 0.00 179.25 179.13 3kts h TYR 114 N 0.03 0.49 -0.08 0.00 3.20 -0.38 -0.83 116.97 119.40 3kts h TYR 114 Ca -0.03 -0.18 -0.01 0.00 3.14 0.00 0.00 58.73 61.66 3kts h TYR 114 Cb 1.59 -0.09 -0.00 0.00 1.54 0.00 0.00 36.73 39.77 3kts h TYR 114 CO 0.01 0.86 0.02 -0.91 -1.64 0.00 0.00 178.16 176.50 3kts h ASN 115 N -0.02 0.13 -0.40 -2.11 2.35 -0.56 -0.33 115.58 114.64 3kts h ASN 115 Ca 0.01 -0.24 -0.04 0.00 -0.55 0.00 0.00 56.30 55.48 3kts h ASN 115 Cb 0.83 -0.03 -0.02 0.00 0.05 0.00 0.00 38.32 39.14 3kts h ASN 115 CO 0.05 0.34 0.14 0.11 -1.65 0.00 0.00 177.43 176.42 3kts h LYS 116 N -0.08 0.68 0.51 0.81 1.57 -1.66 -2.52 116.57 115.88 3kts h LYS 116 Ca 0.03 -0.11 -0.02 0.00 -1.87 0.00 0.00 60.65 58.67 3kts h LYS 116 Cb 0.26 -0.12 0.00 0.00 0.08 0.00 0.00 32.23 32.46 3kts h LYS 116 CO 0.00 0.60 -0.24 0.78 -0.57 0.00 0.00 179.45 180.02 3kts h GLY 117 N 0.86 -0.71 2.00 3.86 0.00 -0.76 -1.19 103.07 107.13 3kts h GLY 117 Ca 0.16 0.26 -0.05 0.00 0.00 0.00 0.00 47.33 47.70 3kts h GLY 117 CO -0.01 -0.26 -0.23 -0.39 0.00 0.00 0.00 176.54 175.66 3kts h VAL 118 N -0.74 0.97 -0.31 4.60 -1.51 -1.08 -0.05 116.25 118.13 3kts h VAL 118 Ca -0.07 -0.83 -0.05 0.00 -1.23 0.00 0.00 66.70 64.52 3kts h VAL 118 Cb 0.55 1.47 -0.01 0.00 -2.13 0.00 0.00 31.29 31.17 3kts h VAL 118 CO 0.11 0.22 -0.01 0.00 -1.23 0.00 0.00 177.57 176.67 3kts h ALA 119 N 1.77 0.42 -0.36 5.19 0.00 -1.29 0.26 119.26 125.26 3kts h ALA 119 Ca -0.00 -0.24 -0.15 0.00 0.00 0.00 0.00 54.91 54.52 3kts h ALA 119 Cb 0.46 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 3kts h ALA 119 CO 0.03 0.18 -0.35 1.25 0.00 0.00 0.00 179.25 180.36 3kts h LEU 120 N 0.35 0.93 -0.30 0.00 5.85 -0.82 -0.97 115.31 120.35 3kts h LEU 120 Ca 0.09 -0.47 0.01 0.00 0.84 0.00 0.00 57.88 58.35 3kts h LEU 120 Cb 0.45 -0.26 -0.02 0.00 0.37 0.00 0.00 40.66 41.20 3kts h LEU 120 CO 0.02 1.21 0.17 0.40 -0.34 0.00 0.00 178.44 179.90 3kts h ILE 121 N 0.67 1.03 -0.98 4.05 2.04 -1.00 0.15 117.51 123.48 3kts h ILE 121 Ca 0.06 -0.12 0.00 0.00 1.00 0.00 0.00 64.86 65.80 3kts h ILE 121 Cb 0.94 0.64 -0.05 0.00 -0.74 0.00 0.00 36.82 37.62 3kts h ILE 121 CO 0.09 0.07 0.63 -0.61 0.00 0.00 0.00 178.15 178.33 3kts h GLN 122 N 0.36 1.31 0.02 2.37 5.75 -0.90 0.72 115.11 124.73 3kts h GLN 122 Ca 0.12 -0.09 -0.00 0.00 -0.15 0.00 0.00 58.65 58.52 3kts h GLN 122 Cb -0.00 -0.29 0.00 0.00 1.07 0.00 0.00 27.48 28.26 3kts h GLN 122 CO -0.05 0.88 -0.01 -0.22 -2.65 0.00 0.00 178.83 176.78 3kts h LYS 123 N 1.34 -0.02 0.00 1.69 3.64 -0.74 -3.36 116.57 119.12 3kts h LYS 123 Ca 0.36 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.74 3kts h LYS 123 Cb -0.12 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.70 3kts h LYS 123 CO -0.07 0.40 -1.20 1.33 -2.27 0.00 0.00 179.45 177.63 3kts n VAL 124 N -4.90 0.24 -3.22 2.00 0.24 0.50 -5.04 118.33 108.14 3kts n VAL 124 Ca -0.08 -0.36 -0.24 0.00 -2.04 0.00 0.00 64.34 61.62 3kts n VAL 124 Cb 0.22 0.06 0.02 0.00 -1.47 0.00 0.00 33.84 32.67 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 -2.17 -2.10 -1.77 7.34 1.13 0.24 -4.78 117.38 115.27 3kts n GLN 125 Ca 0.00 1.71 -0.31 0.00 -1.94 0.00 0.00 57.00 56.47 3kts n GLN 125 Cb 0.49 -3.74 0.04 0.00 0.11 0.00 0.00 30.24 27.13 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 -2.63 3.13 0.59 -1.09 0.04 -1.26 -4.94 135.00 128.84 3kts s PRO 126 Ca 0.30 0.73 0.35 0.00 0.04 0.00 0.00 61.00 62.43 3kts s PRO 126 Cb -0.05 -2.03 1.82 0.00 0.04 0.00 0.00 34.50 34.28 3kts s PRO 126 CO 0.83 -0.90 2.18 -0.44 0.04 0.00 0.00 177.00 178.71 3kts h ASP 127 N -0.56 0.00 -4.86 6.66 3.32 -1.59 -3.46 116.42 115.92 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 -0.13 0.00 0.22 0.00 0.00 39.33 40.64 3kts h ASP 127 CO 0.61 0.04 0.40 0.00 -1.72 0.00 0.00 179.24 178.57 3kts s ILE 129 N -3.36 0.27 -0.05 0.00 -4.36 -1.05 -0.65 121.20 112.00 3kts s ILE 129 Ca 0.05 -0.75 -0.30 0.00 -0.26 0.00 0.00 60.65 59.39 3kts s ILE 129 Cb -0.01 -1.07 -0.03 0.00 1.25 0.00 0.00 42.46 42.59 3kts s ILE 129 CO -0.08 -0.52 1.19 -0.70 0.24 0.00 0.00 174.94 175.08 3kts s GLU 130 N 1.94 4.36 -0.15 0.37 2.12 0.25 -2.14 118.70 125.45 3kts s GLU 130 Ca 0.06 1.67 -0.04 0.00 0.36 0.00 0.00 54.97 57.02 3kts s GLU 130 Cb -0.17 -3.54 -0.03 0.00 0.26 0.00 0.00 34.13 30.65 3kts s GLU 130 CO -0.23 -0.43 -0.01 -0.51 -0.54 0.00 0.00 175.26 173.55 3kts s LEU 131 N 2.11 3.44 -0.03 2.70 1.02 0.15 -1.41 118.68 126.67 3kts s LEU 131 Ca 0.56 -0.02 0.04 0.00 0.02 0.00 0.00 54.13 54.72 3kts s LEU 131 Cb -0.25 -1.83 -0.00 0.00 0.02 0.00 0.00 46.19 44.13 3kts s LEU 131 CO 0.22 0.22 -0.14 -0.76 0.02 0.00 0.00 176.35 175.91 3kts s LEU 132 N 0.09 1.91 1.03 1.79 1.02 -0.71 -0.77 118.68 123.04 3kts s LEU 132 Ca 0.01 -0.28 -0.17 0.00 0.02 0.00 0.00 54.13 53.71 3kts s LEU 132 Cb -0.13 -0.80 0.22 0.00 0.02 0.00 0.00 46.19 45.50 3kts s LEU 132 CO 0.02 0.14 1.25 -2.16 0.02 0.00 0.00 176.35 175.62 3kts s PRO 133 N -0.03 0.09 0.00 1.29 0.04 -1.26 -0.04 135.00 135.09 3kts s PRO 133 Ca -0.01 -0.28 0.23 0.00 0.04 0.00 0.00 61.00 60.98 3kts s PRO 133 Cb -0.09 -1.77 0.08 0.00 0.04 0.00 0.00 34.50 32.76 3kts s PRO 133 CO 0.01 -2.80 1.12 0.41 0.04 0.00 0.00 177.00 175.78 3kts n GLY 134 N -2.85 -0.99 1.78 0.56 0.00 0.67 -4.45 105.19 99.91 3kts n GLY 134 Ca 0.14 -0.51 0.07 0.00 0.00 0.00 0.00 46.02 45.72 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 -1.36 2.53 -3.88 -0.61 -5.35 -1.26 -4.51 119.36 104.93 3kts n ILE 135 Ca 0.05 -1.29 -0.32 0.00 -0.27 0.00 0.00 62.75 60.93 3kts n ILE 135 Cb 0.34 -0.28 -0.12 0.00 -1.74 0.00 0.00 39.64 37.84 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 -2.60 2.95 0.11 7.28 1.01 -1.26 -4.95 121.20 123.73 3kts s ILE 136 Ca 0.50 -3.35 0.26 0.00 0.00 0.00 0.00 60.65 58.06 3kts s ILE 136 Cb 0.38 -2.99 0.27 0.00 0.01 0.00 0.00 42.46 40.13 3kts s ILE 136 CO 0.15 -0.85 1.85 -0.65 0.00 0.00 0.00 174.94 175.44 3kts h PRO 137 N 6.49 0.00 -0.48 2.79 0.11 -1.93 -3.16 132.00 135.83 3kts h PRO 137 Ca -0.04 0.00 -0.11 0.00 0.11 0.00 0.00 66.00 65.96 3kts h PRO 137 Cb 0.89 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.98 3kts h PRO 137 CO 0.70 0.17 -0.14 1.49 -0.21 0.00 0.00 178.00 180.02 3kts h GLU 138 N 0.00 0.94 0.00 1.05 4.81 -1.96 -1.41 114.58 118.01 3kts h GLU 138 Ca -0.00 -0.37 -0.03 0.00 -0.13 0.00 0.00 59.36 58.82 3kts h GLU 138 Cb 0.71 -0.05 -0.00 0.00 0.63 0.00 0.00 28.75 30.04 3kts h GLU 138 CO 0.02 1.04 -0.16 1.96 -0.73 0.00 0.00 179.01 181.14 3kts h GLN 139 N 0.79 0.00 -0.19 1.92 1.08 -1.99 -2.47 115.11 114.25 3kts h GLN 139 Ca 0.12 0.00 -0.20 0.00 -1.45 0.00 0.00 58.65 57.12 3kts h GLN 139 Cb 0.70 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.13 3kts h GLN 139 CO 0.05 0.16 -0.66 0.28 -0.95 0.00 0.00 178.83 177.71 3kts h VAL 140 N 0.00 1.30 0.00 -0.54 2.07 -1.45 -2.71 116.25 114.92 3kts h VAL 140 Ca -0.00 -1.90 -0.11 0.00 0.82 0.00 0.00 66.70 65.52 3kts h VAL 140 Cb 0.89 1.86 -0.02 0.00 -1.52 0.00 0.00 31.29 32.51 3kts h VAL 140 CO 0.02 0.60 -0.50 -0.61 0.02 0.00 0.00 177.57 177.10 3kts h GLN 141 N 0.52 0.00 -0.14 1.57 4.15 -1.19 -2.63 115.11 117.38 3kts h GLN 141 Ca -0.02 0.00 -0.00 0.00 0.77 0.00 0.00 58.65 59.40 3kts h GLN 141 Cb 1.26 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 28.95 3kts h GLN 141 CO 0.13 0.50 0.08 0.87 -1.93 0.00 0.00 178.83 178.48 3kts h LYS 142 N 0.00 0.20 -0.03 1.69 1.57 -1.40 -3.08 116.57 115.52 3kts h LYS 142 Ca -0.01 -0.02 -0.19 0.00 -1.87 0.00 0.00 60.65 58.56 3kts h LYS 142 Cb 1.03 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 33.29 3kts h LYS 142 CO 0.07 0.22 -0.80 0.52 -0.57 0.00 0.00 179.45 178.88 3kts h MET 143 N 0.13 0.28 -0.14 3.15 2.86 -1.31 0.28 114.93 120.17 3kts h MET 143 Ca 0.05 -0.26 -0.14 0.00 -2.06 0.00 0.00 59.70 57.29 3kts h MET 143 Cb 0.08 0.06 -0.01 0.00 0.06 0.00 0.00 31.60 31.79 3kts h MET 143 CO -0.01 0.94 -0.51 1.79 1.06 0.00 0.00 176.91 180.18 3kts h THR 144 N 0.18 1.34 0.00 2.22 1.35 -1.59 -2.40 112.91 114.00 3kts h THR 144 Ca -0.04 -1.75 0.00 0.00 -0.55 0.00 0.00 66.41 64.07 3kts h THR 144 Cb 1.39 1.79 0.00 0.00 -1.73 0.00 0.00 68.15 69.59 3kts h THR 144 CO 0.13 0.53 -0.63 1.56 -0.25 0.00 0.00 175.52 176.86 3kts h GLN 145 N 0.31 0.00 0.06 4.72 4.20 -1.43 -3.23 115.11 119.73 3kts h GLN 145 Ca 0.01 0.00 -0.21 0.00 0.06 0.00 0.00 58.65 58.51 3kts h GLN 145 Cb 1.00 0.00 0.02 0.00 0.30 0.00 0.00 27.48 28.80 3kts h GLN 145 CO 0.09 0.00 -0.86 0.87 -0.67 0.00 0.00 178.83 178.25 3kts h LYS 146 N 0.00 0.48 -3.04 1.46 1.79 -0.44 -3.46 116.57 113.37 3kts h LYS 146 Ca 0.00 -0.60 -0.23 0.00 -2.18 0.00 0.00 60.65 57.64 3kts h LYS 146 Cb 0.93 0.19 -0.32 0.00 -1.58 0.00 0.00 32.23 31.44 3kts h LYS 146 CO 0.00 1.23 -0.56 -1.17 -1.08 0.00 0.00 179.45 177.87 3kts s LEU 147 N -8.10 0.15 -0.15 2.94 2.96 -0.91 -5.06 118.68 110.51 3kts s LEU 147 Ca -0.12 0.45 -0.05 0.00 -0.22 0.00 0.00 54.13 54.20 3kts s LEU 147 Cb 0.04 0.54 -0.12 0.00 0.50 0.00 0.00 46.19 47.15 3kts s LEU 147 CO 0.86 -0.20 3.13 1.57 -1.32 0.00 0.00 176.35 180.39 3kts n HIS 148 N 4.81 0.54 -3.54 5.38 -0.00 -1.22 -4.18 115.22 117.01 3kts n HIS 148 Ca -0.15 -1.60 -0.37 0.00 0.46 0.00 0.00 57.72 56.06 3kts n HIS 148 Cb 0.51 -1.39 -0.08 0.00 -0.12 0.00 0.00 29.99 28.91 3kts n HIS 148 CO 0.00 0.00 0.00 0.42 0.46 0.00 0.00 176.34 177.22 3kts s ILE 149 N -0.21 5.29 0.33 3.57 1.01 -1.26 -5.07 121.20 124.86 3kts s ILE 149 Ca 0.56 0.45 -0.29 0.00 0.00 0.00 0.00 60.65 61.37 3kts s ILE 149 Cb 0.30 -3.61 -0.10 0.00 0.01 0.00 0.00 42.46 39.06 3kts s ILE 149 CO -0.06 0.32 1.31 -2.16 0.00 0.00 0.00 174.94 174.35 3kts s PRO 150 N 1.00 4.35 0.26 2.79 0.04 -1.26 -4.75 135.00 137.42 3kts s PRO 150 Ca 0.14 2.23 0.05 0.00 0.04 0.00 0.00 61.00 63.46 3kts s PRO 150 Cb -0.14 -3.07 -0.03 0.00 0.04 0.00 0.00 34.50 31.31 3kts s PRO 150 CO 0.05 -0.20 0.38 0.14 0.04 0.00 0.00 177.00 177.41 3kts s VAL 151 N -1.13 4.95 -0.04 -0.36 -7.23 -1.26 -2.54 120.40 112.78 3kts s VAL 151 Ca 0.49 -1.01 0.07 0.00 -1.81 0.00 0.00 61.98 59.72 3kts s VAL 151 Cb -0.40 -3.74 -0.01 0.00 0.56 0.00 0.00 36.38 32.79 3kts s VAL 151 CO 0.53 -0.29 -0.24 -0.63 -0.31 0.00 0.00 175.10 174.16 3kts s ILE 152 N -2.03 1.97 -0.15 -0.62 -1.09 -0.91 -1.78 121.20 116.59 3kts s ILE 152 Ca 0.37 -1.04 -0.14 0.00 -2.23 0.00 0.00 60.65 57.61 3kts s ILE 152 Cb -0.09 -1.65 -0.05 0.00 -1.58 0.00 0.00 42.46 39.09 3kts s ILE 152 CO 0.29 0.55 0.30 0.00 -1.23 0.00 0.00 174.94 174.85 3kts s ALA 153 N -0.34 3.61 0.02 9.38 0.00 -0.80 0.32 121.76 133.94 3kts s ALA 153 Ca 0.02 -0.44 0.01 0.00 0.00 0.00 0.00 51.96 51.55 3kts s ALA 153 Cb -0.12 -2.38 -0.02 0.00 0.00 0.00 0.00 23.12 20.61 3kts s ALA 153 CO 0.01 0.13 -0.04 0.20 0.00 0.00 0.00 175.76 176.06 3kts s GLY 154 N 0.32 0.28 0.00 0.00 0.00 0.05 -0.52 107.32 107.46 3kts s GLY 154 Ca 0.17 -0.49 0.00 0.00 0.00 0.00 0.00 44.72 44.41 3kts s GLY 154 CO 0.05 -0.52 0.00 0.61 0.00 0.00 0.00 173.10 173.23 3kts n GLY 155 N 2.02 -1.60 2.40 0.20 0.00 -1.22 -0.31 105.19 106.67 3kts n GLY 155 Ca -0.20 -1.13 -0.15 0.00 0.00 0.00 0.00 46.02 44.54 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 -0.37 -1.22 -4.66 0.99 4.77 -1.26 -0.23 117.00 115.01 3kts n LEU 156 Ca 0.00 0.28 -0.43 0.00 -0.03 0.00 0.00 56.01 55.83 3kts n LEU 156 Cb 0.00 -2.19 -0.02 0.00 -2.33 0.00 0.00 43.42 38.88 3kts n LEU 156 CO 0.00 -0.63 0.93 -0.63 -1.33 0.00 0.00 177.39 175.73 3kts s ILE 157 N -2.59 4.65 -0.05 -0.08 1.09 -1.26 -4.78 121.20 118.17 3kts s ILE 157 Ca 0.00 1.98 -0.00 0.00 -1.10 0.00 0.00 60.65 61.53 3kts s ILE 157 Cb 0.00 -4.28 -0.03 0.00 -1.06 0.00 0.00 42.46 37.09 3kts s ILE 157 CO 0.00 -0.16 -0.05 -0.62 -0.10 0.00 0.00 174.94 174.01 3kts n GLU 158 N 6.23 0.13 -4.41 2.79 1.02 -1.26 -4.69 120.64 120.45 3kts n GLU 158 Ca 0.12 0.03 -0.25 0.00 -0.02 0.00 0.00 57.16 57.04 3kts n GLU 158 Cb 0.46 -1.05 -0.09 0.00 -0.02 0.00 0.00 31.44 30.74 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 -2.11 2.44 0.26 2.62 -4.23 -1.26 -5.02 115.64 108.34 3kts s THR 159 Ca -0.07 -2.03 0.25 0.00 -1.18 0.00 0.00 61.69 58.66 3kts s THR 159 Cb 0.02 -2.78 0.26 0.00 1.34 0.00 0.00 72.50 71.33 3kts s THR 159 CO 0.12 -0.17 1.93 0.28 -0.54 0.00 0.00 174.62 176.24 3kts h SER 160 N 1.84 0.00 0.46 3.99 0.02 -2.01 -3.10 113.55 114.76 3kts h SER 160 Ca -0.43 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 60.51 3kts h SER 160 Cb 1.25 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 63.77 3kts h SER 160 CO 0.69 0.19 -0.44 -0.33 -1.14 0.00 0.00 176.83 175.80 3kts h GLU 161 N 0.00 -0.88 0.00 3.45 3.07 -2.01 -3.00 114.58 115.22 3kts h GLU 161 Ca -0.00 0.06 0.00 0.00 -0.50 0.00 0.00 59.36 58.92 3kts h GLU 161 Cb 0.57 0.20 0.00 0.00 -0.84 0.00 0.00 28.75 28.68 3kts h GLU 161 CO 0.02 -0.58 0.00 1.96 -1.40 0.00 0.00 179.01 179.01 3kts h GLN 162 N -0.91 0.00 -0.23 2.33 4.20 -1.96 0.09 115.11 118.63 3kts h GLN 162 Ca -0.05 0.00 -0.15 0.00 0.06 0.00 0.00 58.65 58.51 3kts h GLN 162 Cb 0.79 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.58 3kts h GLN 162 CO -0.05 0.00 -0.43 0.28 -0.67 0.00 0.00 178.83 177.96 3kts h VAL 163 N 0.00 1.31 -0.09 -0.54 2.07 -1.53 -3.33 116.25 114.14 3kts h VAL 163 Ca 0.00 -1.64 -0.17 0.00 0.82 0.00 0.00 66.70 65.71 3kts h VAL 163 Cb 0.24 1.78 0.01 0.00 -1.52 0.00 0.00 31.29 31.80 3kts h VAL 163 CO 0.00 0.52 -0.61 0.78 0.02 0.00 0.00 177.57 178.28 3kts h ASN 164 N 0.41 0.69 -0.45 0.57 2.35 -0.84 -2.63 115.58 115.67 3kts h ASN 164 Ca 0.01 -0.66 -0.02 0.00 -0.55 0.00 0.00 56.30 55.08 3kts h ASN 164 Cb 1.03 -0.20 -0.02 0.00 0.05 0.00 0.00 38.32 39.18 3kts h ASN 164 CO 0.10 1.25 0.22 1.56 -1.65 0.00 0.00 177.43 178.90 3kts h GLN 165 N 0.18 0.65 -0.03 0.81 4.20 -1.65 0.09 115.11 119.37 3kts h GLN 165 Ca -0.05 -0.09 -0.13 0.00 0.06 0.00 0.00 58.65 58.43 3kts h GLN 165 Cb 1.26 -0.12 -0.02 0.00 0.30 0.00 0.00 27.48 28.90 3kts h GLN 165 CO 0.12 0.54 -0.60 -0.24 -0.67 0.00 0.00 178.83 177.99 3kts h VAL 166 N 0.59 1.41 -0.17 -0.54 3.04 -1.67 -1.02 116.25 117.89 3kts h VAL 166 Ca 0.16 -2.03 -0.20 0.00 -1.01 0.00 0.00 66.70 63.62 3kts h VAL 166 Cb 0.11 2.07 0.00 0.00 -2.01 0.00 0.00 31.29 31.46 3kts h VAL 166 CO -0.02 0.59 -0.68 0.40 -1.01 0.00 0.00 177.57 176.85 3kts h ILE 167 N 0.07 1.31 0.00 3.17 2.04 -1.21 -2.61 117.51 120.28 3kts h ILE 167 Ca -0.01 -1.93 0.00 0.00 1.00 0.00 0.00 64.86 63.93 3kts h ILE 167 Cb 1.08 1.90 0.00 0.00 -0.74 0.00 0.00 36.82 39.06 3kts h ILE 167 CO 0.08 0.61 0.00 0.00 0.00 0.00 0.00 178.15 178.84 3kts h ALA 168 N 0.74 1.00 -0.23 1.87 0.00 -0.80 -2.70 119.26 119.13 3kts h ALA 168 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.89 3kts h ALA 168 Cb 1.28 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.07 3kts h ALA 168 CO 0.14 0.00 0.00 0.43 0.00 0.00 0.00 179.25 179.82 3kts n SER 169 N -2.58 1.89 0.00 0.00 7.64 -0.40 -4.91 113.62 115.26 3kts n SER 169 Ca 0.01 -1.80 0.00 0.00 1.01 0.00 0.00 58.87 58.09 3kts n SER 169 Cb 0.26 -0.15 0.00 0.00 -1.01 0.00 0.00 64.21 63.30 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 1.15 0.95 3.72 0.23 0.00 -1.02 -3.48 105.19 106.74 3kts n GLY 170 Ca 0.16 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.76 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 -2.00 3.25 0.09 4.61 0.00 -1.04 -4.43 121.76 122.24 3kts s ALA 171 Ca 0.00 0.63 0.00 0.00 0.00 0.00 0.00 51.96 52.59 3kts s ALA 171 Cb 0.00 -3.32 -0.26 0.00 0.00 0.00 0.00 23.12 19.54 3kts s ALA 171 CO 0.00 -0.15 1.18 0.82 0.00 0.00 0.00 175.76 177.60 3kts h ILE 172 N 4.26 1.56 -3.89 0.00 5.03 -1.67 -3.42 117.51 119.39 3kts h ILE 172 Ca -0.42 -3.19 -0.11 0.00 -0.12 0.00 0.00 64.86 61.02 3kts h ILE 172 Cb 1.21 2.90 -0.12 0.00 -3.03 0.00 0.00 36.82 37.78 3kts h ILE 172 CO 0.74 0.92 -0.30 0.00 -0.68 0.00 0.00 178.15 178.83 3kts s ALA 173 N -2.67 0.05 -0.19 1.87 0.00 -1.25 -4.70 121.76 114.86 3kts s ALA 173 Ca -0.02 -0.95 -0.00 0.00 0.00 0.00 0.00 51.96 50.98 3kts s ALA 173 Cb 0.08 0.96 0.05 0.00 0.00 0.00 0.00 23.12 24.21 3kts s ALA 173 CO 0.86 -0.69 -0.05 0.08 0.00 0.00 0.00 175.76 175.96 3kts s VAL 174 N -4.00 1.25 0.09 0.00 1.01 0.06 -1.91 120.40 116.91 3kts s VAL 174 Ca 0.20 -0.85 -0.28 0.00 0.00 0.00 0.00 61.98 61.05 3kts s VAL 174 Cb 0.03 -1.47 -0.06 0.00 0.00 0.00 0.00 36.38 34.88 3kts s VAL 174 CO 0.03 0.04 0.88 0.42 0.00 0.00 0.00 175.10 176.47 3kts s THR 175 N 1.55 4.58 -0.14 3.92 -4.23 0.32 -1.03 115.64 120.62 3kts s THR 175 Ca -0.02 1.90 -0.28 0.00 -1.18 0.00 0.00 61.69 62.11 3kts s THR 175 Cb -0.17 -4.24 0.07 0.00 1.34 0.00 0.00 72.50 69.50 3kts s THR 175 CO -0.07 0.34 0.68 0.28 -0.54 0.00 0.00 174.62 175.31 3kts s THR 176 N -0.05 0.00 -1.27 3.99 -1.32 -0.99 -3.40 115.64 112.61 3kts s THR 176 Ca 0.44 -0.01 0.17 0.00 -1.21 0.00 0.00 61.69 61.07 3kts s THR 176 Cb -0.22 -0.98 -0.06 0.00 -1.51 0.00 0.00 72.50 69.72 3kts s THR 176 CO 0.27 -0.01 0.81 -1.54 -2.21 0.00 0.00 174.62 171.95 3kts n SER 177 N 1.64 1.36 -4.64 8.08 3.41 -1.26 -1.91 113.62 120.30 3kts n SER 177 Ca -0.17 -1.18 -0.47 0.00 -0.26 0.00 0.00 58.87 56.79 3kts n SER 177 Cb 0.56 0.66 -0.04 0.00 -0.26 0.00 0.00 64.21 65.12 3kts n SER 177 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 3kts n ASN 178 N -0.55 3.38 0.15 4.04 5.15 -1.26 -4.90 115.26 121.27 3kts n ASN 178 Ca 0.06 0.78 -0.10 0.00 -0.60 0.00 0.00 54.58 54.72 3kts n ASN 178 Cb 0.32 -1.41 -0.06 0.00 -0.53 0.00 0.00 39.78 38.10 3kts n ASN 178 CO 0.00 0.00 0.00 0.50 1.40 0.00 0.00 177.26 179.16 3kts h LYS 179 N 10.72 -0.44 -0.15 1.20 3.64 -1.95 -3.33 116.57 126.26 3kts h LYS 179 Ca -0.45 0.03 0.00 0.00 -1.27 0.00 0.00 60.65 58.96 3kts h LYS 179 Cb 1.27 0.10 0.00 0.00 -0.41 0.00 0.00 32.23 33.19 3kts h LYS 179 CO 0.96 -0.17 0.00 0.72 -2.27 0.00 0.00 179.45 178.68 3kts n HIS 180 N -5.09 0.20 -1.15 1.91 8.25 -1.26 -2.07 115.22 116.00 3kts n HIS 180 Ca -0.08 -0.10 -0.11 0.00 -0.26 0.00 0.00 57.72 57.17 3kts n HIS 180 Cb 0.24 0.00 0.25 0.00 1.12 0.00 0.00 29.99 31.60 3kts n HIS 180 CO 0.00 0.00 0.00 1.47 0.64 0.00 0.00 176.34 178.45 3kts n LEU 181 N -0.06 6.05 -0.02 2.41 -0.00 -1.25 -3.76 117.00 120.37 3kts n LEU 181 Ca 0.07 -3.41 -0.11 0.00 -0.00 0.00 0.00 56.01 52.56 3kts n LEU 181 Cb 0.15 -0.76 -0.14 0.00 -0.00 0.00 0.00 43.42 42.67 3kts n LEU 181 CO 0.05 0.93 -0.59 0.79 -0.00 0.00 0.00 177.39 178.58 3kts n TRP 182 N -0.61 1.06 0.53 1.47 8.01 -0.88 -4.20 117.44 122.82 3kts n TRP 182 Ca 0.46 0.34 0.12 0.00 -1.31 0.00 0.00 57.50 57.11 3kts n TRP 182 Cb 1.44 -1.18 0.08 0.00 -2.01 0.00 0.00 31.31 29.64 3kts n TRP 182 CO 0.00 0.00 0.00 -1.91 -1.01 0.00 0.00 177.69 174.77 3kts n GLU 183 N -3.14 0.32 0.05 -0.99 4.07 -1.26 -4.42 120.64 115.27 3kts n GLU 183 Ca -0.20 0.04 -0.08 0.00 -0.06 0.00 0.00 57.16 56.86 3kts n GLU 183 Cb 1.05 -1.65 0.07 0.00 -0.06 0.00 0.00 31.44 30.85 3kts n GLU 183 CO 0.00 0.00 0.00 0.78 -0.06 0.00 0.00 177.13 177.85 3kts h GLY 184 N 4.48 0.41 -1.74 8.31 0.00 -1.73 -3.54 103.07 109.27 3kts h GLY 184 Ca 0.00 -0.53 0.00 0.00 0.00 0.00 0.00 47.33 46.80 3kts h GLY 184 CO 0.00 0.48 0.00 1.57 0.00 0.00 0.00 176.54 178.59