#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3kts s GLU 2 N 0.00 3.16 0.10 3.23 2.02 -1.26 -5.01 118.70 120.94 3kts s GLU 2 Ca 0.00 1.00 -0.30 0.00 0.02 0.00 0.00 54.97 55.69 3kts s GLU 2 Cb 0.00 -2.02 -0.06 0.00 0.10 0.00 0.00 34.13 32.16 3kts s GLU 2 CO 0.00 -0.92 0.99 -0.51 0.02 0.00 0.00 175.26 174.84 3kts s LEU 3 N -5.16 4.48 0.15 1.80 1.43 -1.26 -4.96 118.68 115.15 3kts s LEU 3 Ca 0.59 1.82 0.05 0.00 -1.03 0.00 0.00 54.13 55.56 3kts s LEU 3 Cb -0.14 -3.59 0.46 0.00 0.03 0.00 0.00 46.19 42.95 3kts s LEU 3 CO 0.49 -0.13 0.66 -2.65 0.23 0.00 0.00 176.35 174.96 3kts n PRO 4 N 2.93 -0.03 -2.01 1.29 -0.02 -1.26 -3.18 135.00 132.72 3kts n PRO 4 Ca 0.03 0.60 -0.42 0.00 -2.02 0.00 0.00 63.50 61.70 3kts n PRO 4 Cb 0.49 -1.03 -0.00 0.00 -0.02 0.00 0.00 33.50 32.94 3kts n PRO 4 CO 0.00 0.00 0.00 1.97 1.98 0.00 0.00 175.50 179.45 3kts n PHE 5 N -4.17 3.06 -2.50 6.00 1.16 -1.26 -4.96 117.46 114.79 3kts n PHE 5 Ca 0.13 -2.88 -0.42 0.00 -1.87 0.00 0.00 57.45 52.42 3kts n PHE 5 Cb 0.45 -2.19 -0.03 0.00 -1.61 0.00 0.00 39.48 36.09 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 1.72 7.20 -1.53 5.98 0.01 -1.19 -3.54 113.70 122.35 3kts s SER 6 Ca 0.46 2.00 -0.14 0.00 1.31 0.00 0.00 55.95 59.58 3kts s SER 6 Cb 0.13 -2.59 0.09 0.00 0.21 0.00 0.00 66.02 63.86 3kts s SER 6 CO -0.04 -0.33 0.92 -3.20 0.41 0.00 0.00 173.24 171.00 3kts n ASN 7 N 3.25 -4.72 -4.16 2.44 5.15 -1.26 -4.99 115.26 110.97 3kts n ASN 7 Ca 0.06 -0.74 -0.35 0.00 -0.60 0.00 0.00 54.58 52.95 3kts n ASN 7 Cb 0.47 -3.78 -0.14 0.00 -0.53 0.00 0.00 39.78 35.80 3kts n ASN 7 CO 0.00 0.00 0.00 -1.58 1.40 0.00 0.00 177.26 177.08 3kts s GLN 8 N -6.56 2.39 -0.01 1.20 0.74 -1.23 -4.98 119.66 111.20 3kts s GLN 8 Ca 0.64 -1.30 -0.20 0.00 0.05 0.00 0.00 55.36 54.55 3kts s GLN 8 Cb -0.32 -3.18 -0.30 0.00 1.10 0.00 0.00 33.01 30.30 3kts s GLN 8 CO 0.79 -0.64 0.98 0.77 -0.55 0.00 0.00 175.29 176.64 3kts h SER 9 N 7.98 0.60 -3.33 6.67 0.02 -1.92 -3.40 113.55 120.17 3kts h SER 9 Ca -0.20 -0.89 -0.66 0.00 -0.84 0.00 0.00 61.79 59.20 3kts h SER 9 Cb 1.06 -0.19 -0.29 0.00 0.14 0.00 0.00 62.40 63.12 3kts h SER 9 CO 0.54 1.44 -0.75 -0.63 -1.14 0.00 0.00 176.83 176.28 3kts s ILE 10 N -2.70 3.11 -0.42 3.27 1.09 -1.26 -0.09 121.20 124.21 3kts s ILE 10 Ca -0.12 -0.59 -0.07 0.00 -1.10 0.00 0.00 60.65 58.76 3kts s ILE 10 Cb 0.03 -2.39 0.09 0.00 -1.06 0.00 0.00 42.46 39.13 3kts s ILE 10 CO 0.86 0.46 0.24 -0.63 -0.10 0.00 0.00 174.94 175.77 3kts s ILE 11 N 1.28 3.95 0.20 2.92 1.01 0.93 -4.93 121.20 126.56 3kts s ILE 11 Ca 0.03 -1.59 -0.30 0.00 0.00 0.00 0.00 60.65 58.79 3kts s ILE 11 Cb -0.14 -3.49 -0.09 0.00 0.01 0.00 0.00 42.46 38.75 3kts s ILE 11 CO -0.04 -0.56 1.33 -2.16 0.00 0.00 0.00 174.94 173.51 3kts s PRO 12 N 1.35 4.37 -0.25 2.79 0.04 -1.26 -2.56 135.00 139.48 3kts s PRO 12 Ca 0.04 2.08 -0.10 0.00 0.04 0.00 0.00 61.00 63.07 3kts s PRO 12 Cb -0.23 -3.19 -0.04 0.00 0.04 0.00 0.00 34.50 31.08 3kts s PRO 12 CO 0.00 -0.28 0.14 0.00 0.04 0.00 0.00 177.00 176.90 3kts s ALA 13 N 0.15 3.46 -0.25 8.56 0.00 0.90 -0.30 121.76 134.28 3kts s ALA 13 Ca 0.57 -1.01 -0.16 0.00 0.00 0.00 0.00 51.96 51.37 3kts s ALA 13 Cb -0.37 -2.29 -0.04 0.00 0.00 0.00 0.00 23.12 20.42 3kts s ALA 13 CO 0.38 -0.36 0.41 0.00 0.00 0.00 0.00 175.76 176.20 3kts s ALA 14 N 1.39 3.57 -0.15 0.00 0.00 0.15 -4.46 121.76 122.26 3kts s ALA 14 Ca 0.07 -0.69 -0.24 0.00 0.00 0.00 0.00 51.96 51.10 3kts s ALA 14 Cb -0.15 -2.73 -0.24 0.00 0.00 0.00 0.00 23.12 19.99 3kts s ALA 14 CO 0.07 -0.58 0.57 0.45 0.00 0.00 0.00 175.76 176.26 3kts h HIS 15 N 7.92 0.11 -0.99 0.00 3.86 -1.91 -2.93 115.15 121.20 3kts h HIS 15 Ca -0.32 -0.08 -0.51 0.00 -1.16 0.00 0.00 60.37 58.30 3kts h HIS 15 Cb 1.16 -0.00 -0.01 0.00 1.06 0.00 0.00 27.41 29.61 3kts h HIS 15 CO 0.74 1.26 -0.24 -0.80 0.86 0.00 0.00 177.93 179.75 3kts s ASN 16 N -6.60 5.03 0.21 2.45 0.01 -1.26 -4.39 114.94 110.40 3kts s ASN 16 Ca -0.22 -0.88 0.05 0.00 -0.71 0.00 0.00 52.86 51.10 3kts s ASN 16 Cb 0.01 -0.01 0.16 0.00 0.41 0.00 0.00 41.25 41.82 3kts s ASN 16 CO 0.68 -1.03 1.49 -0.61 -1.51 0.00 0.00 177.10 176.12 3kts h GLN 17 N 0.60 0.17 0.00 -0.60 -0.00 -1.95 -2.90 115.11 110.44 3kts h GLN 17 Ca -0.36 -0.15 -0.01 0.00 -0.00 0.00 0.00 58.65 58.14 3kts h GLN 17 Cb 1.29 0.03 -0.00 0.00 0.00 0.00 0.00 27.48 28.80 3kts h GLN 17 CO 0.50 0.82 -0.03 0.87 0.00 0.00 0.00 178.83 180.99 3kts h LYS 18 N 0.12 0.00 -0.05 1.69 1.57 -1.98 -2.64 116.57 115.27 3kts h LYS 18 Ca -0.02 0.00 -0.22 0.00 -1.87 0.00 0.00 60.65 58.54 3kts h LYS 18 Cb 1.28 0.00 0.01 0.00 0.08 0.00 0.00 32.23 33.60 3kts h LYS 18 CO 0.11 0.03 -0.81 -0.44 -0.57 0.00 0.00 179.45 177.77 3kts h ASP 19 N 0.00 0.81 1.41 0.86 3.32 -1.92 -2.94 116.42 117.96 3kts h ASP 19 Ca -0.00 -0.70 0.00 0.00 0.02 0.00 0.00 57.03 56.35 3kts h ASP 19 Cb 0.92 -0.24 0.00 0.00 0.22 0.00 0.00 39.33 40.23 3kts h ASP 19 CO 0.00 1.39 0.00 0.00 -1.72 0.00 0.00 179.24 178.92 3kts h MET 20 N 0.29 0.00 -0.31 3.56 -0.00 -1.54 -2.42 114.93 114.51 3kts h MET 20 Ca -0.09 0.00 -0.14 0.00 -0.00 0.00 0.00 59.70 59.47 3kts h MET 20 Cb 1.47 0.00 -0.01 0.00 -0.00 0.00 0.00 31.60 33.06 3kts h MET 20 CO 0.16 0.00 -0.38 1.49 -0.00 0.00 0.00 176.91 178.19 3kts h GLU 21 N 0.00 0.72 -0.12 -0.10 4.57 -1.46 0.31 114.58 118.50 3kts h GLU 21 Ca 0.00 -0.36 -0.16 0.00 -1.18 0.00 0.00 59.36 57.65 3kts h GLU 21 Cb 0.71 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 29.29 3kts h GLU 21 CO 0.00 0.98 -0.61 0.87 -1.18 0.00 0.00 179.01 179.07 3kts h LYS 22 N 0.60 0.43 -0.14 1.92 1.79 -1.31 -3.24 116.57 116.61 3kts h LYS 22 Ca 0.05 -0.29 -0.14 0.00 -2.18 0.00 0.00 60.65 58.09 3kts h LYS 22 Cb 0.91 0.04 -0.01 0.00 -1.58 0.00 0.00 32.23 31.60 3kts h LYS 22 CO 0.08 0.91 -0.52 0.82 -1.08 0.00 0.00 179.45 179.66 3kts h ILE 23 N 0.32 1.34 0.00 1.86 2.04 -1.28 -3.21 117.51 118.58 3kts h ILE 23 Ca -0.01 -1.78 0.00 0.00 1.00 0.00 0.00 64.86 64.08 3kts h ILE 23 Cb 1.15 1.80 0.00 0.00 -0.74 0.00 0.00 36.82 39.03 3kts h ILE 23 CO 0.11 0.54 0.00 0.25 0.00 0.00 0.00 178.15 179.05 3kts h LEU 24 N 0.32 0.00 -3.82 1.44 5.85 -0.96 -2.66 115.31 115.47 3kts h LEU 24 Ca 0.01 0.00 -0.50 0.00 0.84 0.00 0.00 57.88 58.23 3kts h LEU 24 Cb 1.02 0.00 -0.27 0.00 0.37 0.00 0.00 40.66 41.78 3kts h LEU 24 CO 0.09 0.00 0.64 -0.62 -0.34 0.00 0.00 178.44 178.21 3kts n GLU 25 N -3.08 2.21 -4.38 1.25 1.02 -1.21 -4.96 120.64 111.50 3kts n GLU 25 Ca 0.00 -2.76 -0.22 0.00 -0.02 0.00 0.00 57.16 54.16 3kts n GLU 25 Cb 0.28 -2.08 -0.11 0.00 -0.02 0.00 0.00 31.44 29.51 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 -3.07 2.51 -0.31 -4.62 1.02 -1.01 -5.03 118.68 108.17 3kts s LEU 26 Ca 0.53 -0.95 -0.02 0.00 0.02 0.00 0.00 54.13 53.71 3kts s LEU 26 Cb 0.44 -0.90 0.10 0.00 0.02 0.00 0.00 46.19 45.85 3kts s LEU 26 CO 0.07 -0.03 2.43 -0.67 0.02 0.00 0.00 176.35 178.17 3kts n ASP 27 N -0.12 6.27 -4.08 2.29 2.03 -1.26 -4.79 116.55 116.90 3kts n ASP 27 Ca -0.10 -3.01 -0.32 0.00 0.52 0.00 0.00 54.79 51.88 3kts n ASP 27 Cb 0.59 -1.16 -0.16 0.00 -0.72 0.00 0.00 41.12 39.67 3kts n ASP 27 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 3kts s LEU 28 N -1.64 2.79 -0.01 -2.67 2.01 -1.26 -5.06 118.68 112.83 3kts s LEU 28 Ca 0.42 -1.04 -0.04 0.00 0.01 0.00 0.00 54.13 53.47 3kts s LEU 28 Cb 0.28 -1.49 -0.02 0.00 0.01 0.00 0.00 46.19 44.97 3kts s LEU 28 CO -0.08 -0.11 0.46 0.00 1.01 0.00 0.00 176.35 177.63 3kts h THR 29 N 6.39 0.00 -3.31 5.49 1.03 -1.92 -3.45 112.91 117.14 3kts h THR 29 Ca -0.31 -0.18 -0.54 0.00 -0.01 0.00 0.00 66.41 65.37 3kts h THR 29 Cb 1.09 0.00 -0.01 0.00 -1.07 0.00 0.00 68.15 68.15 3kts h THR 29 CO 0.53 0.00 0.46 -0.31 -0.01 0.00 0.00 175.52 176.20 3kts s TYR 30 N -2.23 3.55 0.21 0.00 1.51 -1.26 -2.64 117.35 116.48 3kts s TYR 30 Ca -0.02 1.54 0.08 0.00 -1.01 0.00 0.00 57.07 57.65 3kts s TYR 30 Cb 0.00 -3.24 -0.05 0.00 -0.11 0.00 0.00 41.96 38.57 3kts s TYR 30 CO 0.07 -0.51 -0.15 0.00 -1.11 0.00 0.00 175.55 173.86 3kts s MET 31 N 1.16 1.34 -0.16 -0.62 0.23 -0.65 -4.11 119.30 116.48 3kts s MET 31 Ca 0.54 -1.59 -0.04 0.00 -1.03 0.00 0.00 55.69 53.57 3kts s MET 31 Cb -0.24 -1.14 -0.03 0.00 -1.53 0.00 0.00 34.83 31.89 3kts s MET 31 CO 0.27 0.19 -0.04 0.08 -2.03 0.00 0.00 175.02 173.50 3kts s VAL 32 N -2.94 3.91 -0.11 5.16 1.01 0.59 -0.75 120.40 127.28 3kts s VAL 32 Ca 0.23 -0.35 -0.02 0.00 0.00 0.00 0.00 61.98 61.84 3kts s VAL 32 Cb -0.01 -2.71 -0.03 0.00 0.00 0.00 0.00 36.38 33.63 3kts s VAL 32 CO 0.07 0.49 -0.04 -0.32 0.00 0.00 0.00 175.10 175.30 3kts s MET 33 N 0.36 3.17 0.00 2.72 1.75 0.85 0.33 119.30 128.48 3kts s MET 33 Ca -0.04 -0.50 0.00 0.00 -1.25 0.00 0.00 55.69 53.90 3kts s MET 33 Cb -0.14 -2.77 0.00 0.00 2.84 0.00 0.00 34.83 34.76 3kts s MET 33 CO 0.03 0.51 0.00 1.28 -0.65 0.00 0.00 175.02 176.19 3kts n LEU 34 N 2.72 0.00 -4.50 4.11 4.77 -1.11 -1.48 117.00 121.52 3kts n LEU 34 Ca -0.18 0.00 -0.39 0.00 -0.03 0.00 0.00 56.01 55.41 3kts n LEU 34 Cb 0.53 0.00 -0.11 0.00 -2.33 0.00 0.00 43.42 41.51 3kts n LEU 34 CO 0.30 -0.03 -0.16 -0.70 -1.33 0.00 0.00 177.39 175.47 3kts s GLU 35 N -0.06 3.49 0.34 3.23 2.12 -1.26 -4.48 118.70 122.09 3kts s GLU 35 Ca 0.00 -0.63 0.03 0.00 0.36 0.00 0.00 54.97 54.73 3kts s GLU 35 Cb 0.00 -3.69 -0.04 0.00 0.26 0.00 0.00 34.13 30.65 3kts s GLU 35 CO 0.00 -0.40 0.10 0.95 -0.54 0.00 0.00 175.26 175.38 3kts s THR 36 N 1.69 0.75 -0.08 -1.70 -4.23 -0.22 -4.81 115.64 107.03 3kts s THR 36 Ca 0.06 -2.00 0.04 0.00 -1.18 0.00 0.00 61.69 58.60 3kts s THR 36 Cb -0.17 -2.56 0.00 0.00 1.34 0.00 0.00 72.50 71.11 3kts s THR 36 CO 0.09 0.00 -0.20 -1.00 -0.54 0.00 0.00 174.62 172.97 3kts s HIS 37 N -3.38 2.13 0.52 3.99 0.09 -1.26 -1.07 115.29 116.32 3kts s HIS 37 Ca 0.32 -0.80 0.21 0.00 -0.00 0.00 0.00 55.06 54.79 3kts s HIS 37 Cb 0.06 -1.45 1.33 0.00 -0.00 0.00 0.00 32.58 32.52 3kts s HIS 37 CO 0.15 -0.32 2.05 -0.24 -0.00 0.00 0.00 174.74 176.38 3kts h VAL 38 N 5.64 0.84 0.00 -0.90 3.04 -1.60 -1.60 116.25 121.67 3kts h VAL 38 Ca -0.26 -0.01 -0.04 0.00 -1.01 0.00 0.00 66.70 65.38 3kts h VAL 38 Cb 1.21 0.81 -0.01 0.00 -2.01 0.00 0.00 31.29 31.29 3kts h VAL 38 CO 0.47 0.00 -0.20 0.00 -1.01 0.00 0.00 177.57 176.84 3kts h ALA 39 N 1.82 1.39 -0.17 3.17 0.00 -1.96 -3.07 119.26 120.45 3kts h ALA 39 Ca 0.17 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.89 3kts h ALA 39 Cb 0.63 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.39 3kts h ALA 39 CO -0.01 0.25 0.00 1.04 0.00 0.00 0.00 179.25 180.53 3kts n GLN 40 N -3.90 1.98 0.24 0.00 6.02 -0.63 -4.87 117.38 116.22 3kts n GLN 40 Ca -0.02 -1.58 -0.10 0.00 -0.01 0.00 0.00 57.00 55.29 3kts n GLN 40 Cb 0.29 -1.17 -0.05 0.00 1.02 0.00 0.00 30.24 30.33 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 1.44 -0.55 -0.80 1.08 5.85 -1.37 -2.23 115.31 118.73 3kts h LEU 41 Ca 0.00 0.02 0.17 0.00 0.84 0.00 0.00 57.88 58.91 3kts h LEU 41 Cb 0.55 0.14 -0.11 0.00 0.37 0.00 0.00 40.66 41.61 3kts h LEU 41 CO 0.00 -0.28 0.31 0.50 -0.34 0.00 0.00 178.44 178.62 3kts h LYS 42 N -0.87 0.39 0.00 1.25 3.64 -1.89 -0.90 116.57 118.18 3kts h LYS 42 Ca -0.07 -0.02 -0.07 0.00 -1.27 0.00 0.00 60.65 59.22 3kts h LYS 42 Cb 0.50 -0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 32.22 3kts h LYS 42 CO 0.11 0.26 -0.33 0.00 -2.27 0.00 0.00 179.45 177.21 3kts h ALA 43 N 1.62 0.99 0.00 5.00 0.00 -1.91 -2.01 119.26 122.95 3kts h ALA 43 Ca 0.46 -0.30 -0.26 0.00 0.00 0.00 0.00 54.91 54.81 3kts h ALA 43 Cb 0.78 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 18.48 3kts h ALA 43 CO -0.47 0.42 -1.49 -0.07 0.00 0.00 0.00 179.25 177.64 3kts h LEU 44 N 0.00 0.00 -0.22 0.00 3.38 -0.68 -2.36 115.31 115.43 3kts h LEU 44 Ca -0.00 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 57.87 3kts h LEU 44 Cb 0.87 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.62 3kts h LEU 44 CO 0.04 0.94 -0.25 0.58 0.09 0.00 0.00 178.44 179.84 3kts h VAL 45 N 0.00 1.32 -0.91 1.22 2.07 -1.18 -2.59 116.25 116.19 3kts h VAL 45 Ca -0.21 -1.44 0.05 0.00 0.82 0.00 0.00 66.70 65.92 3kts h VAL 45 Cb 1.90 1.75 -0.06 0.00 -1.52 0.00 0.00 31.29 33.36 3kts h VAL 45 CO 0.09 0.44 0.59 0.50 0.02 0.00 0.00 177.57 179.21 3kts h LYS 46 N 0.25 1.08 -0.61 1.57 3.64 -1.48 -1.57 116.57 119.45 3kts h LYS 46 Ca 0.03 -0.06 -0.08 0.00 -1.27 0.00 0.00 60.65 59.26 3kts h LYS 46 Cb 0.82 -0.24 -0.02 0.00 -0.41 0.00 0.00 32.23 32.37 3kts h LYS 46 CO 0.06 0.71 0.05 -0.92 -2.27 0.00 0.00 179.45 177.09 3kts h TYR 47 N 1.11 1.11 0.00 1.91 3.20 -1.37 -0.76 116.97 122.16 3kts h TYR 47 Ca 0.38 -0.16 -0.13 0.00 3.14 0.00 0.00 58.73 61.95 3kts h TYR 47 Cb 0.07 -0.30 -0.02 0.00 1.54 0.00 0.00 36.73 38.02 3kts h TYR 47 CO -0.02 0.96 -0.63 0.00 -1.64 0.00 0.00 178.16 176.83 3kts h ALA 48 N 1.09 0.69 0.00 1.82 0.00 -1.29 -3.09 119.26 118.48 3kts h ALA 48 Ca 0.18 -0.58 -0.08 0.00 0.00 0.00 0.00 54.91 54.43 3kts h ALA 48 Cb 0.48 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 3kts h ALA 48 CO 0.02 0.79 -0.47 1.96 0.00 0.00 0.00 179.25 181.55 3kts h GLN 49 N 0.00 0.00 0.00 0.00 4.20 -1.11 -2.59 115.11 115.62 3kts h GLN 49 Ca -0.01 0.00 -0.10 0.00 0.06 0.00 0.00 58.65 58.61 3kts h GLN 49 Cb 1.35 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 29.11 3kts h GLN 49 CO 0.08 0.36 -0.46 0.00 -0.67 0.00 0.00 178.83 178.15 3kts h ALA 50 N 1.62 1.06 -0.12 3.87 0.00 -1.11 -2.89 119.26 121.69 3kts h ALA 50 Ca -0.01 -0.42 0.00 0.00 0.00 0.00 0.00 54.91 54.48 3kts h ALA 50 Cb 1.30 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.02 3kts h ALA 50 CO 0.05 0.57 0.00 0.41 0.00 0.00 0.00 179.25 180.28 3kts n GLY 51 N 0.09 -0.37 1.61 0.00 0.00 -1.17 -4.90 105.19 100.45 3kts n GLY 51 Ca -0.01 -0.19 0.00 0.00 0.00 0.00 0.00 46.02 45.82 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 0.80 1.11 3.93 -0.02 0.00 -1.09 -5.05 105.19 104.87 3kts n GLY 52 Ca 0.08 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.86 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 -0.46 3.32 -0.08 1.61 -0.14 -0.98 -5.00 119.74 118.00 3kts s LYS 53 Ca 0.00 -0.22 0.04 0.00 -1.36 0.00 0.00 55.97 54.43 3kts s LYS 53 Cb 0.00 -2.53 0.00 0.00 -1.68 0.00 0.00 37.83 33.62 3kts s LYS 53 CO 0.00 -0.14 -0.22 0.15 -0.76 0.00 0.00 175.35 174.38 3kts s LYS 54 N -4.55 2.65 -0.24 1.68 1.02 -1.08 -3.89 119.74 115.32 3kts s LYS 54 Ca 0.46 -0.78 -0.12 0.00 0.02 0.00 0.00 55.97 55.54 3kts s LYS 54 Cb -0.10 -2.07 -0.05 0.00 -0.52 0.00 0.00 37.83 35.10 3kts s LYS 54 CO 0.40 0.19 0.25 0.08 -0.92 0.00 0.00 175.35 175.35 3kts s VAL 55 N 0.30 5.28 -0.38 3.17 1.01 -1.26 -1.64 120.40 126.89 3kts s VAL 55 Ca -0.15 0.36 -0.13 0.00 0.00 0.00 0.00 61.98 62.06 3kts s VAL 55 Cb -0.17 -3.59 0.02 0.00 0.00 0.00 0.00 36.38 32.64 3kts s VAL 55 CO 0.07 0.27 0.25 -0.76 0.00 0.00 0.00 175.10 174.94 3kts s LEU 56 N 1.43 4.84 -0.18 3.92 1.43 0.07 -0.04 118.68 130.15 3kts s LEU 56 Ca 0.11 -0.84 -0.08 0.00 -1.03 0.00 0.00 54.13 52.29 3kts s LEU 56 Cb -0.15 -2.10 -0.04 0.00 0.03 0.00 0.00 46.19 43.93 3kts s LEU 56 CO 0.07 -0.38 0.09 -0.22 0.23 0.00 0.00 176.35 176.14 3kts s LEU 57 N 1.64 4.01 -0.38 1.79 2.96 0.49 -0.11 118.68 129.08 3kts s LEU 57 Ca 0.04 0.18 -0.29 0.00 -0.22 0.00 0.00 54.13 53.84 3kts s LEU 57 Cb -0.19 -2.01 0.02 0.00 0.50 0.00 0.00 46.19 44.51 3kts s LEU 57 CO 0.09 0.21 1.18 -1.00 -1.32 0.00 0.00 176.35 175.51 3kts s HIS 58 N 0.15 2.87 -1.98 5.38 3.76 -0.55 0.67 115.29 125.58 3kts s HIS 58 Ca 0.07 0.91 0.31 0.00 -0.15 0.00 0.00 55.06 56.20 3kts s HIS 58 Cb -0.12 -4.06 1.75 0.00 1.11 0.00 0.00 32.58 31.26 3kts s HIS 58 CO -0.00 -1.25 2.15 0.00 -0.85 0.00 0.00 174.74 174.78 3kts n ALA 59 N 7.56 2.66 0.42 -1.40 0.00 0.52 -3.12 120.51 127.15 3kts n ALA 59 Ca 0.13 -0.22 0.04 0.00 0.00 0.00 0.00 53.44 53.39 3kts n ALA 59 Cb 0.48 -1.47 -0.04 0.00 0.00 0.00 0.00 19.45 18.42 3kts n ALA 59 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 3kts n ASP 60 N -0.90 0.61 -1.29 0.00 10.43 -1.26 -4.59 116.55 119.56 3kts n ASP 60 Ca 0.22 -0.81 -0.08 0.00 2.57 0.00 0.00 54.79 56.69 3kts n ASP 60 Cb 0.16 0.86 0.13 0.00 1.84 0.00 0.00 41.12 44.11 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 -0.97 3.88 -4.25 0.64 4.77 -1.18 -4.91 117.00 114.98 3kts n LEU 61 Ca 0.02 -4.27 -0.43 0.00 -0.03 0.00 0.00 56.01 51.30 3kts n LEU 61 Cb 0.15 -0.47 -0.05 0.00 -2.33 0.00 0.00 43.42 40.73 3kts n LEU 61 CO 0.16 1.70 0.27 -0.69 -1.33 0.00 0.00 177.39 177.50 3kts s VAL 62 N -3.85 4.95 0.12 4.08 1.01 -1.26 -1.06 120.40 124.39 3kts s VAL 62 Ca 0.45 -2.50 -0.34 0.00 0.00 0.00 0.00 61.98 59.59 3kts s VAL 62 Cb 0.39 -4.11 -0.13 0.00 0.00 0.00 0.00 36.38 32.53 3kts s VAL 62 CO -0.02 -0.96 1.64 0.59 0.00 0.00 0.00 175.10 176.35 3kts n ASN 63 N 3.98 3.20 0.00 3.32 3.02 -0.23 -1.14 115.26 127.40 3kts n ASN 63 Ca 0.09 1.06 0.00 0.00 -0.03 0.00 0.00 54.58 55.70 3kts n ASN 63 Cb 0.43 -1.42 0.00 0.00 -0.61 0.00 0.00 39.78 38.18 3kts n ASN 63 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3kts n GLY 64 N 3.61 3.09 3.59 7.41 0.00 -1.26 -1.70 105.19 119.92 3kts n GLY 64 Ca 0.18 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.88 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 3.15 0.00 0.99 2.96 -0.29 -5.01 118.68 120.47 3kts s LEU 65 Ca 0.00 -0.19 0.00 0.00 -0.22 0.00 0.00 54.13 53.72 3kts s LEU 65 Cb 0.00 -1.83 0.00 0.00 0.50 0.00 0.00 46.19 44.86 3kts s LEU 65 CO 0.00 0.26 0.00 0.29 -1.32 0.00 0.00 176.35 175.58 3kts n LYS 66 N 1.39 0.49 -2.01 1.98 5.02 -1.26 -4.72 118.16 119.04 3kts n LYS 66 Ca -0.15 0.00 -0.05 0.00 -2.02 0.00 0.00 58.31 56.10 3kts n LYS 66 Cb 0.52 0.00 0.06 0.00 -0.02 0.00 0.00 35.03 35.59 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 -1.50 2.34 -3.65 4.39 0.23 -1.26 -4.84 115.26 110.98 3kts n ASN 67 Ca 0.00 -2.74 -0.30 0.00 -0.53 0.00 0.00 54.58 51.01 3kts n ASN 67 Cb 0.00 -0.41 0.28 0.00 -2.08 0.00 0.00 39.78 37.57 3kts n ASN 67 CO 0.00 0.00 0.00 -1.81 -0.93 0.00 0.00 177.26 174.52 3kts s ASP 68 N -3.29 -0.73 0.22 0.53 -0.00 -1.26 -4.74 116.67 107.40 3kts s ASP 68 Ca 0.36 0.99 -0.08 0.00 -0.00 0.00 0.00 52.55 53.82 3kts s ASP 68 Cb 0.37 -1.44 0.19 0.00 -0.00 0.00 0.00 42.92 42.04 3kts s ASP 68 CO -0.05 -5.18 1.85 0.44 -0.00 0.00 0.00 175.17 172.22 3kts h ASP 69 N -3.30 1.06 -1.00 0.27 3.32 -1.99 -2.48 116.42 112.30 3kts h ASP 69 Ca -0.47 -0.09 0.04 0.00 0.02 0.00 0.00 57.03 56.52 3kts h ASP 69 Cb 1.34 -0.27 -0.06 0.00 0.22 0.00 0.00 39.33 40.56 3kts h ASP 69 CO 0.33 0.85 0.65 1.88 -1.72 0.00 0.00 179.24 181.23 3kts h TYR 70 N 1.19 1.22 0.00 4.55 -1.99 -1.99 0.56 116.97 120.51 3kts h TYR 70 Ca 0.30 0.03 -0.07 0.00 2.00 0.00 0.00 58.73 60.99 3kts h TYR 70 Cb 0.02 -0.41 -0.01 0.00 2.00 0.00 0.00 36.73 38.33 3kts h TYR 70 CO 0.01 0.70 -0.32 0.00 -0.00 0.00 0.00 178.16 178.54 3kts h ALA 71 N 1.41 0.86 0.16 3.88 0.00 -1.83 -2.50 119.26 121.24 3kts h ALA 71 Ca 0.40 -0.30 -0.25 0.00 0.00 0.00 0.00 54.91 54.77 3kts h ALA 71 Cb 0.02 -0.05 0.02 0.00 0.00 0.00 0.00 17.79 17.78 3kts h ALA 71 CO -0.13 0.41 -1.15 0.82 0.00 0.00 0.00 179.25 179.19 3kts h ILE 72 N 0.00 1.30 -0.86 0.00 1.08 -1.06 -2.95 117.51 115.02 3kts h ILE 72 Ca -0.00 -2.52 0.20 0.00 -0.39 0.00 0.00 64.86 62.14 3kts h ILE 72 Cb 1.07 3.01 -0.16 0.00 -3.07 0.00 0.00 36.82 37.67 3kts h ILE 72 CO 0.04 0.74 -0.08 0.44 -0.69 0.00 0.00 178.15 178.60 3kts h ASP 73 N -0.24 -0.56 -0.42 1.72 3.32 -0.91 0.99 116.42 120.31 3kts h ASP 73 Ca -0.22 0.24 0.04 0.00 0.02 0.00 0.00 57.03 57.11 3kts h ASP 73 Cb 1.79 0.46 -0.04 0.00 0.22 0.00 0.00 39.33 41.76 3kts h ASP 73 CO 0.15 -0.26 0.20 0.15 -1.72 0.00 0.00 179.24 177.75 3kts h PHE 74 N 0.04 0.36 -0.66 4.55 3.04 -1.52 -0.95 116.94 121.79 3kts h PHE 74 Ca 0.46 0.02 -0.07 0.00 3.98 0.00 0.00 57.97 62.35 3kts h PHE 74 Cb 0.81 -0.10 -0.03 0.00 2.56 0.00 0.00 35.95 39.20 3kts h PHE 74 CO -0.54 0.17 0.12 -0.07 -2.02 0.00 0.00 178.31 175.97 3kts h LEU 75 N 0.40 1.03 -0.12 0.59 3.38 -0.84 -0.17 115.31 119.58 3kts h LEU 75 Ca 0.19 -0.25 -0.11 0.00 0.09 0.00 0.00 57.88 57.79 3kts h LEU 75 Cb 0.12 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 40.60 3kts h LEU 75 CO -0.15 1.02 -0.35 0.00 0.09 0.00 0.00 178.44 179.05 3kts h THR 77 N 0.04 0.83 0.00 0.00 1.35 -1.23 -3.38 112.91 110.53 3kts h THR 77 Ca -0.01 -2.28 0.00 0.00 -0.55 0.00 0.00 66.41 63.57 3kts h THR 77 Cb 0.97 2.43 0.00 0.00 -1.73 0.00 0.00 68.15 69.82 3kts h THR 77 CO 0.08 0.61 -1.52 -0.62 -0.25 0.00 0.00 175.52 173.82 3kts n GLU 78 N -3.98 0.74 -0.08 4.72 1.02 -0.11 -4.68 120.64 118.26 3kts n GLU 78 Ca -0.31 -0.11 -0.15 0.00 -0.02 0.00 0.00 57.16 56.57 3kts n GLU 78 Cb 0.86 -1.41 -0.06 0.00 -0.02 0.00 0.00 31.44 30.81 3kts n GLU 78 CO 0.00 0.00 0.00 -0.89 1.18 0.00 0.00 177.13 177.42 3kts n ILE 79 N -1.91 0.87 -3.10 -3.67 -0.00 -0.97 -4.88 119.36 105.70 3kts n ILE 79 Ca -0.01 -0.25 -0.20 0.00 -0.00 0.00 0.00 62.75 62.29 3kts n ILE 79 Cb 0.41 -1.51 0.02 0.00 -0.00 0.00 0.00 39.64 38.56 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 -0.26 0.08 -0.85 0.00 -0.04 -1.26 -4.93 135.00 127.73 3kts n PRO 81 Ca 0.04 0.00 0.02 0.00 -0.04 0.00 0.00 63.50 63.52 3kts n PRO 81 Cb 0.55 0.00 0.33 0.00 -0.04 0.00 0.00 33.50 34.34 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 -2.77 4.89 0.00 3.54 8.00 0.94 -4.93 116.55 126.22 3kts n ASP 82 Ca 0.00 -3.10 0.00 0.00 0.71 0.00 0.00 54.79 52.40 3kts n ASP 82 Cb 0.00 -0.68 0.00 0.00 -0.02 0.00 0.00 41.12 40.42 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 0.02 4.12 3.49 0.44 0.00 -1.06 -4.60 105.19 107.60 3kts n GLY 83 Ca 0.32 -0.43 -0.34 0.00 0.00 0.00 0.00 46.02 45.57 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 -1.17 3.62 -0.16 -0.61 -5.25 0.33 -0.38 121.20 117.58 3kts s ILE 84 Ca 0.00 -0.47 -0.12 0.00 -0.99 0.00 0.00 60.65 59.07 3kts s ILE 84 Cb 0.00 -2.54 -0.05 0.00 2.95 0.00 0.00 42.46 42.83 3kts s ILE 84 CO 0.00 0.53 0.22 -0.63 -1.79 0.00 0.00 174.94 173.27 3kts s ILE 85 N -0.02 5.35 0.00 8.37 1.01 0.21 -1.41 121.20 134.72 3kts s ILE 85 Ca -0.01 0.39 -0.16 0.00 0.00 0.00 0.00 60.65 60.87 3kts s ILE 85 Cb -0.14 -3.55 0.03 0.00 0.01 0.00 0.00 42.46 38.81 3kts s ILE 85 CO 0.03 0.44 0.35 -0.55 0.00 0.00 0.00 174.94 175.21 3kts s SER 86 N 0.20 -0.22 -0.14 3.58 0.15 -0.97 -0.35 113.70 115.94 3kts s SER 86 Ca 0.13 0.06 -0.17 0.00 0.70 0.00 0.00 55.95 56.67 3kts s SER 86 Cb -0.12 0.35 -0.25 0.00 -1.71 0.00 0.00 66.02 64.30 3kts s SER 86 CO 0.02 -0.53 0.44 0.74 1.20 0.00 0.00 173.24 175.12 3kts h THR 87 N 3.53 0.99 -2.95 6.45 2.02 -1.90 -0.46 112.91 120.59 3kts h THR 87 Ca -0.30 -2.32 -0.53 0.00 0.77 0.00 0.00 66.41 64.02 3kts h THR 87 Cb 1.18 2.58 0.01 0.00 -1.74 0.00 0.00 68.15 70.19 3kts h THR 87 CO 0.42 0.61 0.77 -0.60 0.37 0.00 0.00 175.52 177.09 3kts s ARG 88 N -2.44 4.30 0.39 6.66 3.52 -1.26 -4.85 118.95 125.27 3kts s ARG 88 Ca -0.23 2.05 0.14 0.00 -0.13 0.00 0.00 55.73 57.56 3kts s ARG 88 Cb 0.05 -3.38 0.79 0.00 -1.56 0.00 0.00 34.95 30.85 3kts s ARG 88 CO 0.71 -0.50 1.86 0.78 -0.81 0.00 0.00 175.30 177.34 3kts h GLY 89 N 7.43 0.00 2.00 8.12 0.00 -1.97 -2.64 103.07 116.01 3kts h GLY 89 Ca -0.41 0.00 -0.03 0.00 0.00 0.00 0.00 47.33 46.89 3kts h GLY 89 CO 0.88 0.00 -0.16 3.43 0.00 0.00 0.00 176.54 180.69 3kts h ASN 90 N 0.00 0.00 0.25 0.19 -0.26 -1.96 -2.65 115.58 111.15 3kts h ASN 90 Ca -0.00 0.00 -0.17 0.00 -0.56 0.00 0.00 56.30 55.57 3kts h ASN 90 Cb 0.61 0.00 -0.01 0.00 -1.06 0.00 0.00 38.32 37.86 3kts h ASN 90 CO 0.04 0.16 -0.67 0.00 -1.06 0.00 0.00 177.43 175.90 3kts h ALA 91 N 1.84 0.67 -0.26 -0.83 0.00 -1.76 -2.43 119.26 116.49 3kts h ALA 91 Ca -0.00 -0.58 -0.16 0.00 0.00 0.00 0.00 54.91 54.18 3kts h ALA 91 Cb 0.89 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.61 3kts h ALA 91 CO 0.02 0.74 -0.46 0.82 0.00 0.00 0.00 179.25 180.37 3kts h ILE 92 N 0.27 1.30 -0.11 0.00 1.08 -1.45 -2.51 117.51 116.09 3kts h ILE 92 Ca -0.02 -1.66 -0.01 0.00 -0.39 0.00 0.00 64.86 62.79 3kts h ILE 92 Cb 1.23 1.59 -0.01 0.00 -3.07 0.00 0.00 36.82 36.56 3kts h ILE 92 CO 0.11 0.53 0.05 0.24 -0.69 0.00 0.00 178.15 178.40 3kts h MET 93 N 0.55 0.17 -0.13 2.37 2.86 -1.48 -2.62 114.93 116.65 3kts h MET 93 Ca 0.03 -0.03 -0.08 0.00 -2.06 0.00 0.00 59.70 57.56 3kts h MET 93 Cb 1.02 -0.03 -0.01 0.00 0.06 0.00 0.00 31.60 32.63 3kts h MET 93 CO 0.10 0.25 -0.29 -0.22 1.06 0.00 0.00 176.91 177.80 3kts h LYS 94 N 0.05 0.24 -0.31 1.72 1.63 -1.43 -1.71 116.57 116.76 3kts h LYS 94 Ca 0.04 -0.09 -0.07 0.00 -0.85 0.00 0.00 60.65 59.69 3kts h LYS 94 Cb 0.14 -0.02 -0.01 0.00 -0.60 0.00 0.00 32.23 31.74 3kts h LYS 94 CO -0.00 0.51 -0.07 0.00 -3.45 0.00 0.00 179.45 176.44 3kts h ALA 95 N 1.49 0.42 -0.13 5.00 0.00 -1.44 -2.85 119.26 121.74 3kts h ALA 95 Ca 0.03 -0.28 -0.04 0.00 0.00 0.00 0.00 54.91 54.62 3kts h ALA 95 Cb 0.63 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.30 3kts h ALA 95 CO 0.05 0.24 -0.11 0.87 0.00 0.00 0.00 179.25 180.30 3kts h LYS 96 N 0.36 0.20 0.00 0.00 1.57 -1.16 0.37 116.57 117.91 3kts h LYS 96 Ca 0.08 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.82 3kts h LYS 96 Cb 0.56 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.84 3kts h LYS 96 CO 0.03 0.32 0.00 1.96 -0.57 0.00 0.00 179.45 181.19 3kts h GLN 97 N 0.19 0.00 -0.28 3.15 4.20 -1.11 -2.04 115.11 119.22 3kts h GLN 97 Ca 0.04 0.00 -0.07 0.00 0.06 0.00 0.00 58.65 58.69 3kts h GLN 97 Cb 0.32 0.00 -0.04 0.00 0.30 0.00 0.00 27.48 28.06 3kts h GLN 97 CO 0.02 0.00 -0.01 0.72 -0.67 0.00 0.00 178.83 178.88 3kts n HIS 98 N -2.66 0.96 -3.88 2.96 8.25 -0.67 -4.99 115.22 115.18 3kts n HIS 98 Ca 0.02 -1.13 -0.28 0.00 -0.26 0.00 0.00 57.72 56.07 3kts n HIS 98 Cb 0.28 -0.37 0.02 0.00 1.12 0.00 0.00 29.99 31.04 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 -0.78 -4.95 -3.67 -0.41 5.02 -0.77 -4.99 118.16 107.60 3kts n LYS 99 Ca 0.25 0.57 -0.33 0.00 -2.02 0.00 0.00 58.31 56.78 3kts n LYS 99 Cb 0.93 -5.27 -0.05 0.00 -0.02 0.00 0.00 35.03 30.62 3kts n LYS 99 CO 0.00 0.00 0.00 -1.64 -0.52 0.00 0.00 177.40 175.24 3kts s MET 100 N -6.46 3.65 -0.71 1.97 -1.94 0.12 -4.97 119.30 110.96 3kts s MET 100 Ca 0.42 -0.00 -0.26 0.00 -1.71 0.00 0.00 55.69 54.13 3kts s MET 100 Cb -0.21 -2.97 -0.07 0.00 2.01 0.00 0.00 34.83 33.59 3kts s MET 100 CO 0.84 0.55 2.15 -1.17 -0.01 0.00 0.00 175.02 177.38 3kts s LEU 101 N -2.14 3.17 -1.16 -0.03 0.20 -1.26 -4.26 118.68 113.19 3kts s LEU 101 Ca 0.34 0.16 -0.11 0.00 0.69 0.00 0.00 54.13 55.21 3kts s LEU 101 Cb -0.13 -2.54 0.23 0.00 -0.43 0.00 0.00 46.19 43.32 3kts s LEU 101 CO 0.20 -2.98 1.29 0.00 -0.29 0.00 0.00 176.35 174.56 3kts n ALA 102 N 15.34 4.13 -2.66 5.97 0.00 -1.26 -0.51 120.51 141.51 3kts n ALA 102 Ca 0.36 -4.48 -0.42 0.00 0.00 0.00 0.00 53.44 48.90 3kts n ALA 102 Cb 0.49 -2.73 -0.04 0.00 0.00 0.00 0.00 19.45 17.17 3kts n ALA 102 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 177.50 176.00 3kts s ILE 103 N -0.04 4.82 -0.19 0.00 2.07 -0.50 -2.69 121.20 124.67 3kts s ILE 103 Ca 0.36 1.72 -0.17 0.00 -1.41 0.00 0.00 60.65 61.16 3kts s ILE 103 Cb -0.06 -4.18 -0.04 0.00 0.13 0.00 0.00 42.46 38.31 3kts s ILE 103 CO -0.04 -0.04 0.44 -1.58 -1.91 0.00 0.00 174.94 171.81 3kts s GLN 104 N 2.53 4.20 0.24 3.50 0.74 0.40 -2.30 119.66 128.97 3kts s GLN 104 Ca 0.39 0.28 -0.29 0.00 0.05 0.00 0.00 55.36 55.79 3kts s GLN 104 Cb -0.16 -3.53 -0.09 0.00 1.10 0.00 0.00 33.01 30.33 3kts s GLN 104 CO 0.10 -0.04 0.93 0.50 -0.55 0.00 0.00 175.29 176.23 3kts s ARG 105 N 1.31 4.81 -0.07 1.67 3.52 -0.18 -0.92 118.95 129.10 3kts s ARG 105 Ca 0.21 1.45 -0.04 0.00 -0.13 0.00 0.00 55.73 57.22 3kts s ARG 105 Cb -0.15 -3.24 0.04 0.00 -1.56 0.00 0.00 34.95 30.04 3kts s ARG 105 CO 0.09 0.50 0.17 -1.17 -0.81 0.00 0.00 175.30 174.08 3kts s LEU 106 N -1.25 0.78 -0.20 -0.88 2.96 0.42 -4.62 118.68 115.88 3kts s LEU 106 Ca 0.41 0.35 -0.10 0.00 -0.22 0.00 0.00 54.13 54.57 3kts s LEU 106 Cb -0.25 0.47 -0.05 0.00 0.50 0.00 0.00 46.19 46.86 3kts s LEU 106 CO 0.31 -0.14 0.13 -0.36 -1.32 0.00 0.00 176.35 174.98 3kts s PHE 107 N 0.99 3.40 -1.32 5.38 0.08 -1.26 -1.33 117.98 123.92 3kts s PHE 107 Ca -0.08 0.31 -0.17 0.00 0.12 0.00 0.00 56.93 57.12 3kts s PHE 107 Cb -0.09 -2.17 0.07 0.00 -0.57 0.00 0.00 43.02 40.26 3kts s PHE 107 CO -0.05 0.26 1.81 -1.33 -0.10 0.00 0.00 175.22 175.80 3kts n MET 108 N 3.62 3.16 0.00 0.44 2.81 0.25 -4.70 117.12 122.70 3kts n MET 108 Ca -0.16 -3.21 0.00 0.00 -1.81 0.00 0.00 57.70 52.53 3kts n MET 108 Cb 0.52 -3.42 0.00 0.00 -0.71 0.00 0.00 33.22 29.61 3kts n MET 108 CO 0.00 0.00 0.00 -0.89 1.51 0.00 0.00 175.97 176.59 3kts n ILE 109 N 5.98 0.00 -3.83 2.02 5.41 -1.26 -4.75 119.36 122.93 3kts n ILE 109 Ca 0.48 0.27 0.00 0.00 1.00 0.00 0.00 62.75 64.50 3kts n ILE 109 Cb 0.44 -1.03 0.00 0.00 -0.71 0.00 0.00 39.64 38.34 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 -1.67 0.30 -0.04 4.38 5.68 -1.26 -5.03 116.55 118.91 3kts n ASP 110 Ca 0.00 -0.83 -0.05 0.00 -0.50 0.00 0.00 54.79 53.40 3kts n ASP 110 Cb 0.00 0.00 0.15 0.00 -1.14 0.00 0.00 41.12 40.13 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 0.00 0.63 0.06 -1.12 4.64 -1.99 -2.26 113.55 113.51 3kts h SER 111 Ca 0.00 -0.22 -0.10 0.00 -0.47 0.00 0.00 61.79 61.00 3kts h SER 111 Cb 0.00 -0.17 -0.01 0.00 -0.31 0.00 0.00 62.40 61.91 3kts h SER 111 CO 0.00 0.85 -0.34 -1.28 -0.87 0.00 0.00 176.83 175.19 3kts h SER 112 N 0.55 0.40 0.28 4.97 0.87 -1.99 -2.04 113.55 116.59 3kts h SER 112 Ca 0.08 -0.15 -0.24 0.00 -1.23 0.00 0.00 61.79 60.25 3kts h SER 112 Cb 0.69 -0.11 0.01 0.00 -0.44 0.00 0.00 62.40 62.55 3kts h SER 112 CO 0.05 0.72 -0.98 0.00 -0.53 0.00 0.00 176.83 176.10 3kts h ALA 113 N 1.31 0.31 -0.25 6.23 0.00 -1.90 -2.95 119.26 122.01 3kts h ALA 113 Ca 0.04 -0.71 -0.05 0.00 0.00 0.00 0.00 54.91 54.19 3kts h ALA 113 Cb 0.76 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.54 3kts h ALA 113 CO 0.06 0.79 -0.02 -0.92 0.00 0.00 0.00 179.25 179.16 3kts h TYR 114 N 0.26 0.50 -0.46 0.00 3.20 -1.34 -2.13 116.97 117.00 3kts h TYR 114 Ca -0.09 -0.09 -0.12 0.00 3.14 0.00 0.00 58.73 61.56 3kts h TYR 114 Cb 1.62 -0.13 -0.01 0.00 1.54 0.00 0.00 36.73 39.75 3kts h TYR 114 CO 0.07 0.64 -0.18 -0.91 -1.64 0.00 0.00 178.16 176.14 3kts h ASN 115 N 0.21 0.95 0.67 -2.11 2.35 -1.46 -1.97 115.58 114.23 3kts h ASN 115 Ca 0.07 -0.39 -0.16 0.00 -0.55 0.00 0.00 56.30 55.27 3kts h ASN 115 Cb 0.46 -0.26 -0.02 0.00 0.05 0.00 0.00 38.32 38.55 3kts h ASN 115 CO 0.02 1.13 -0.74 0.11 -1.65 0.00 0.00 177.43 176.30 3kts h LYS 116 N 0.77 0.05 -0.01 0.81 1.57 -1.61 -2.70 116.57 115.45 3kts h LYS 116 Ca 0.11 -0.05 -0.00 0.00 -1.87 0.00 0.00 60.65 58.84 3kts h LYS 116 Cb 0.75 0.01 -0.00 0.00 0.08 0.00 0.00 32.23 33.07 3kts h LYS 116 CO 0.06 0.76 0.00 0.78 -0.57 0.00 0.00 179.45 180.49 3kts h GLY 117 N 2.07 0.02 1.53 3.86 0.00 -1.20 -0.53 103.07 108.81 3kts h GLY 117 Ca -0.01 -0.01 -0.08 0.00 0.00 0.00 0.00 47.33 47.22 3kts h GLY 117 CO 0.10 0.01 -0.14 -0.39 0.00 0.00 0.00 176.54 176.12 3kts h VAL 118 N -0.17 1.24 -0.55 4.60 -1.51 -1.42 -0.14 116.25 118.31 3kts h VAL 118 Ca 0.00 -1.10 -0.00 0.00 -1.23 0.00 0.00 66.70 64.37 3kts h VAL 118 Cb 0.19 1.15 -0.03 0.00 -2.13 0.00 0.00 31.29 30.48 3kts h VAL 118 CO -0.00 0.36 0.34 0.00 -1.23 0.00 0.00 177.57 177.05 3kts h ALA 119 N 1.33 0.70 -0.37 5.19 0.00 -1.39 -1.79 119.26 122.94 3kts h ALA 119 Ca 0.09 -0.06 -0.13 0.00 0.00 0.00 0.00 54.91 54.81 3kts h ALA 119 Cb 0.55 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 3kts h ALA 119 CO 0.03 0.17 -0.30 1.25 0.00 0.00 0.00 179.25 180.40 3kts h LEU 120 N 0.75 0.83 -0.56 0.00 5.85 -0.82 -2.44 115.31 118.92 3kts h LEU 120 Ca 0.20 -0.34 0.02 0.00 0.84 0.00 0.00 57.88 58.60 3kts h LEU 120 Cb -0.04 -0.23 -0.03 0.00 0.37 0.00 0.00 40.66 40.73 3kts h LEU 120 CO -0.04 1.07 0.35 0.40 -0.34 0.00 0.00 178.44 179.88 3kts h ILE 121 N 0.67 1.09 -0.45 4.05 2.04 -0.88 -1.77 117.51 122.27 3kts h ILE 121 Ca 0.08 -0.24 -0.03 0.00 1.00 0.00 0.00 64.86 65.67 3kts h ILE 121 Cb 0.84 0.33 -0.02 0.00 -0.74 0.00 0.00 36.82 37.23 3kts h ILE 121 CO 0.07 0.13 0.15 -0.61 0.00 0.00 0.00 178.15 177.89 3kts h GLN 122 N 0.70 0.65 -0.14 2.37 5.75 -1.21 -1.36 115.11 121.87 3kts h GLN 122 Ca 0.22 -0.10 -0.09 0.00 -0.15 0.00 0.00 58.65 58.53 3kts h GLN 122 Cb -0.02 -0.12 0.00 0.00 1.07 0.00 0.00 27.48 28.41 3kts h GLN 122 CO -0.08 0.56 -0.26 -0.22 -2.65 0.00 0.00 178.83 176.18 3kts h LYS 123 N 0.64 0.42 0.00 1.69 3.64 -0.93 -3.38 116.57 118.65 3kts h LYS 123 Ca 0.15 -0.27 0.00 0.00 -1.27 0.00 0.00 60.65 59.27 3kts h LYS 123 Cb 0.17 0.03 0.00 0.00 -0.41 0.00 0.00 32.23 32.02 3kts h LYS 123 CO -0.01 0.86 -1.35 1.33 -2.27 0.00 0.00 179.45 178.01 3kts n VAL 124 N -4.44 0.00 -3.37 2.00 0.24 -0.71 -5.05 118.33 106.99 3kts n VAL 124 Ca -0.07 -0.25 -0.19 0.00 -2.04 0.00 0.00 64.34 61.80 3kts n VAL 124 Cb 0.45 0.53 0.01 0.00 -1.47 0.00 0.00 33.84 33.36 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 -1.79 -1.72 -1.90 7.34 1.13 -0.52 -4.76 117.38 115.16 3kts n GLN 125 Ca -0.00 1.34 -0.33 0.00 -1.94 0.00 0.00 57.00 56.07 3kts n GLN 125 Cb 0.38 -3.73 0.03 0.00 0.11 0.00 0.00 30.24 27.03 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 -3.47 3.01 0.47 -1.09 0.04 -1.26 -4.93 135.00 127.77 3kts s PRO 126 Ca 0.13 1.37 0.26 0.00 0.04 0.00 0.00 61.00 62.81 3kts s PRO 126 Cb -0.02 -1.98 1.09 0.00 0.04 0.00 0.00 34.50 33.63 3kts s PRO 126 CO 0.83 -1.08 1.89 -0.44 0.04 0.00 0.00 177.00 178.25 3kts h ASP 127 N 0.30 0.00 -5.01 6.66 3.32 -1.88 -3.46 116.42 116.35 3kts h ASP 127 Ca -0.47 0.00 -0.04 0.00 0.02 0.00 0.00 57.03 56.54 3kts h ASP 127 Cb 1.24 0.00 -0.14 0.00 0.22 0.00 0.00 39.33 40.65 3kts h ASP 127 CO 0.55 0.17 0.15 0.00 -1.72 0.00 0.00 179.24 178.39 3kts s ILE 129 N -3.15 0.75 -0.11 0.00 -4.36 -0.53 -0.45 121.20 113.35 3kts s ILE 129 Ca -0.02 -0.61 -0.27 0.00 -0.26 0.00 0.00 60.65 59.49 3kts s ILE 129 Cb -0.00 -1.14 -0.02 0.00 1.25 0.00 0.00 42.46 42.55 3kts s ILE 129 CO -0.07 -0.10 0.91 -0.70 0.24 0.00 0.00 174.94 175.21 3kts s GLU 130 N 1.77 4.40 -0.07 0.37 2.12 -0.09 -0.37 118.70 126.81 3kts s GLU 130 Ca -0.01 1.21 0.01 0.00 0.36 0.00 0.00 54.97 56.54 3kts s GLU 130 Cb -0.17 -3.53 -0.03 0.00 0.26 0.00 0.00 34.13 30.66 3kts s GLU 130 CO -0.07 -0.24 -0.09 -0.51 -0.54 0.00 0.00 175.26 173.81 3kts s LEU 131 N 1.80 3.05 -0.01 2.70 1.02 0.27 -0.44 118.68 127.06 3kts s LEU 131 Ca 0.44 -0.09 0.01 0.00 0.02 0.00 0.00 54.13 54.51 3kts s LEU 131 Cb -0.18 -1.66 0.00 0.00 0.02 0.00 0.00 46.19 44.38 3kts s LEU 131 CO 0.17 0.34 -0.02 -0.76 0.02 0.00 0.00 176.35 176.10 3kts s LEU 132 N -0.66 1.85 1.04 1.79 1.02 -0.44 -0.57 118.68 122.71 3kts s LEU 132 Ca 0.10 -0.04 -0.15 0.00 0.02 0.00 0.00 54.13 54.06 3kts s LEU 132 Cb -0.11 -0.14 0.21 0.00 0.02 0.00 0.00 46.19 46.16 3kts s LEU 132 CO 0.01 0.01 1.13 -2.16 0.02 0.00 0.00 176.35 175.37 3kts s PRO 133 N 0.14 0.07 -0.18 1.29 0.04 -1.26 0.86 135.00 135.97 3kts s PRO 133 Ca -0.01 0.16 0.16 0.00 0.04 0.00 0.00 61.00 61.35 3kts s PRO 133 Cb -0.03 -1.73 0.74 0.00 0.04 0.00 0.00 34.50 33.52 3kts s PRO 133 CO -0.00 -2.89 1.66 0.41 0.04 0.00 0.00 177.00 176.21 3kts n GLY 134 N -1.62 3.01 0.41 0.56 0.00 -0.17 -4.27 105.19 103.11 3kts n GLY 134 Ca 0.09 -0.90 0.07 0.00 0.00 0.00 0.00 46.02 45.29 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 0.70 2.08 -3.86 -0.61 -5.35 -1.25 -4.77 119.36 106.30 3kts n ILE 135 Ca 0.26 -2.87 -0.32 0.00 -0.27 0.00 0.00 62.75 59.55 3kts n ILE 135 Cb 1.03 -0.23 -0.12 0.00 -1.74 0.00 0.00 39.64 38.57 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 -3.09 3.03 0.27 7.28 1.01 -1.26 -4.96 121.20 123.47 3kts s ILE 136 Ca 0.36 -3.32 0.22 0.00 0.00 0.00 0.00 60.65 57.91 3kts s ILE 136 Cb 0.34 -3.03 0.20 0.00 0.01 0.00 0.00 42.46 39.98 3kts s ILE 136 CO -0.03 -0.85 1.88 -0.65 0.00 0.00 0.00 174.94 175.28 3kts h PRO 137 N 6.55 0.00 -0.35 2.79 0.11 -1.92 -3.06 132.00 136.11 3kts h PRO 137 Ca -0.03 0.00 -0.11 0.00 0.11 0.00 0.00 66.00 65.96 3kts h PRO 137 Cb 0.90 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.99 3kts h PRO 137 CO 0.70 0.26 -0.25 1.49 -0.21 0.00 0.00 178.00 179.99 3kts h GLU 138 N 0.00 0.70 0.00 1.05 4.81 -1.96 -2.32 114.58 116.86 3kts h GLU 138 Ca -0.00 -0.29 -0.17 0.00 -0.13 0.00 0.00 59.36 58.77 3kts h GLU 138 Cb 0.65 -0.03 -0.03 0.00 0.63 0.00 0.00 28.75 29.97 3kts h GLU 138 CO 0.03 0.88 -0.88 1.96 -0.73 0.00 0.00 179.01 180.28 3kts h GLN 139 N 0.61 0.00 -0.34 1.92 1.08 -1.98 -2.59 115.11 113.82 3kts h GLN 139 Ca 0.08 0.00 -0.11 0.00 -1.45 0.00 0.00 58.65 57.18 3kts h GLN 139 Cb 0.74 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 28.16 3kts h GLN 139 CO 0.06 0.70 -0.23 0.28 -0.95 0.00 0.00 178.83 178.69 3kts h VAL 140 N 0.00 1.27 -0.22 -0.54 2.07 -1.44 -2.25 116.25 115.14 3kts h VAL 140 Ca -0.04 -1.30 -0.19 0.00 0.82 0.00 0.00 66.70 65.99 3kts h VAL 140 Cb 1.61 1.26 0.00 0.00 -1.52 0.00 0.00 31.29 32.64 3kts h VAL 140 CO 0.09 0.43 -0.60 -0.61 0.02 0.00 0.00 177.57 176.90 3kts h GLN 141 N 0.58 0.79 -0.17 1.57 4.15 -1.44 -2.61 115.11 117.98 3kts h GLN 141 Ca 0.08 -0.56 -0.02 0.00 0.77 0.00 0.00 58.65 58.93 3kts h GLN 141 Cb 0.70 0.09 -0.01 0.00 0.21 0.00 0.00 27.48 28.47 3kts h GLN 141 CO 0.05 1.18 0.02 0.87 -1.93 0.00 0.00 178.83 179.03 3kts h LYS 142 N 0.54 0.24 0.02 1.69 1.57 -1.33 -3.02 116.57 116.28 3kts h LYS 142 Ca -0.01 -0.03 -0.29 0.00 -1.87 0.00 0.00 60.65 58.45 3kts h LYS 142 Cb 1.21 -0.05 -0.04 0.00 0.08 0.00 0.00 32.23 33.44 3kts h LYS 142 CO 0.13 0.25 -1.63 0.52 -0.57 0.00 0.00 179.45 178.15 3kts h MET 143 N 0.24 0.04 0.00 3.15 2.86 -1.45 -3.19 114.93 116.58 3kts h MET 143 Ca 0.06 -0.07 0.00 0.00 -2.06 0.00 0.00 59.70 57.63 3kts h MET 143 Cb 0.13 0.03 0.00 0.00 0.06 0.00 0.00 31.60 31.82 3kts h MET 143 CO -0.00 0.66 0.00 1.79 1.06 0.00 0.00 176.91 180.42 3kts h THR 144 N 0.01 0.00 0.00 2.22 1.35 -1.37 -2.80 112.91 112.33 3kts h THR 144 Ca -0.26 -0.40 -0.25 0.00 -0.55 0.00 0.00 66.41 64.95 3kts h THR 144 Cb 1.98 1.35 -0.04 0.00 -1.73 0.00 0.00 68.15 69.71 3kts h THR 144 CO 0.09 0.00 -1.69 0.00 -0.25 0.00 0.00 175.52 173.67 3kts n GLN 145 N -2.94 0.63 -0.17 4.72 6.02 -1.15 -4.32 117.38 120.17 3kts n GLN 145 Ca 0.00 0.23 -0.11 0.00 -0.01 0.00 0.00 57.00 57.12 3kts n GLN 145 Cb 0.26 -1.76 0.00 0.00 1.02 0.00 0.00 30.24 29.76 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 0.00 0.94 -4.26 -1.09 1.79 -1.48 -3.46 116.57 109.01 3kts h LYS 146 Ca -0.27 -0.35 -0.15 0.00 -2.18 0.00 0.00 60.65 57.70 3kts h LYS 146 Cb 1.88 -0.06 -0.14 0.00 -1.58 0.00 0.00 32.23 32.33 3kts h LYS 146 CO 0.06 1.01 -0.56 -1.17 -1.08 0.00 0.00 179.45 177.71 3kts s LEU 147 N -9.24 1.64 0.00 2.94 2.96 -1.16 -5.07 118.68 110.75 3kts s LEU 147 Ca -0.12 -1.09 0.23 0.00 -0.22 0.00 0.00 54.13 52.94 3kts s LEU 147 Cb 0.12 0.53 0.46 0.00 0.50 0.00 0.00 46.19 47.79 3kts s LEU 147 CO 0.85 -0.75 1.41 1.57 -1.32 0.00 0.00 176.35 178.11 3kts n HIS 148 N -0.10 0.32 -2.26 5.38 -0.00 -1.26 -4.56 115.22 112.73 3kts n HIS 148 Ca -0.07 -0.16 -0.42 0.00 0.46 0.00 0.00 57.72 57.53 3kts n HIS 148 Cb 0.63 0.00 -0.03 0.00 -0.12 0.00 0.00 29.99 30.47 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 -1.68 3.83 0.45 3.57 1.01 -1.26 -4.99 121.20 122.13 3kts s ILE 149 Ca 0.35 1.18 -0.24 0.00 0.00 0.00 0.00 60.65 61.95 3kts s ILE 149 Cb 0.21 -3.76 -0.09 0.00 0.01 0.00 0.00 42.46 38.83 3kts s ILE 149 CO 0.31 -0.01 1.13 -2.65 0.00 0.00 0.00 174.94 173.71 3kts n PRO 150 N 5.52 1.55 -4.39 2.79 -0.02 -1.26 -4.77 135.00 134.42 3kts n PRO 150 Ca 0.13 0.56 -0.30 0.00 -2.02 0.00 0.00 63.50 61.87 3kts n PRO 150 Cb 0.44 -2.23 -0.12 0.00 -0.02 0.00 0.00 33.50 31.57 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 -1.27 2.76 -0.06 -1.45 -7.23 -1.26 -1.46 120.40 110.43 3kts s VAL 151 Ca 0.64 -1.47 0.02 0.00 -1.81 0.00 0.00 61.98 59.36 3kts s VAL 151 Cb -0.51 -2.24 -0.03 0.00 0.56 0.00 0.00 36.38 34.16 3kts s VAL 151 CO 0.56 0.15 -0.11 -0.63 -0.31 0.00 0.00 175.10 174.75 3kts s ILE 152 N -1.09 3.36 -0.13 -0.62 -1.09 0.50 -0.79 121.20 121.35 3kts s ILE 152 Ca 0.17 -0.61 -0.11 0.00 -2.23 0.00 0.00 60.65 57.87 3kts s ILE 152 Cb -0.10 -2.35 -0.05 0.00 -1.58 0.00 0.00 42.46 38.38 3kts s ILE 152 CO 0.09 0.59 0.24 0.00 -1.23 0.00 0.00 174.94 174.63 3kts s ALA 153 N -0.72 3.72 -0.07 9.38 0.00 -1.08 0.95 121.76 133.94 3kts s ALA 153 Ca 0.11 -0.51 -0.05 0.00 0.00 0.00 0.00 51.96 51.51 3kts s ALA 153 Cb -0.11 -2.22 0.03 0.00 0.00 0.00 0.00 23.12 20.82 3kts s ALA 153 CO 0.01 0.34 0.17 0.20 0.00 0.00 0.00 175.76 176.48 3kts s GLY 154 N -0.30 -0.10 0.00 0.00 0.00 0.27 0.03 107.32 107.23 3kts s GLY 154 Ca 0.16 0.59 0.00 0.00 0.00 0.00 0.00 44.72 45.47 3kts s GLY 154 CO 0.05 0.67 0.00 0.61 0.00 0.00 0.00 173.10 174.43 3kts n GLY 155 N 3.49 2.32 2.99 0.20 0.00 -1.21 -1.05 105.19 111.93 3kts n GLY 155 Ca -0.18 -1.32 0.00 0.00 0.00 0.00 0.00 46.02 44.51 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 0.00 0.73 -4.58 0.99 4.77 -1.26 -1.00 117.00 116.65 3kts n LEU 156 Ca 0.00 0.00 -0.42 0.00 -0.03 0.00 0.00 56.01 55.56 3kts n LEU 156 Cb 0.00 -1.73 -0.02 0.00 -2.33 0.00 0.00 43.42 39.33 3kts n LEU 156 CO 0.00 -0.63 1.20 -0.63 -1.33 0.00 0.00 177.39 175.99 3kts s ILE 157 N -1.41 3.89 -0.18 -0.08 1.09 -1.26 -4.81 121.20 118.43 3kts s ILE 157 Ca 0.00 0.80 0.02 0.00 -1.10 0.00 0.00 60.65 60.37 3kts s ILE 157 Cb 0.00 -4.48 -0.12 0.00 -1.06 0.00 0.00 42.46 36.80 3kts s ILE 157 CO 0.00 -1.14 -0.15 -0.62 -0.10 0.00 0.00 174.94 172.93 3kts n GLU 158 N 8.46 0.48 -4.05 2.79 1.02 -1.26 -4.65 120.64 123.43 3kts n GLU 158 Ca 0.12 0.10 -0.22 0.00 -0.02 0.00 0.00 57.16 57.14 3kts n GLU 158 Cb 0.49 -1.36 -0.04 0.00 -0.02 0.00 0.00 31.44 30.52 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 -2.36 4.81 0.16 2.62 -4.23 -1.26 -4.86 115.64 110.52 3kts s THR 159 Ca -0.24 -1.16 0.32 0.00 -1.18 0.00 0.00 61.69 59.43 3kts s THR 159 Cb 0.06 -3.58 0.36 0.00 1.34 0.00 0.00 72.50 70.68 3kts s THR 159 CO 0.41 -0.29 1.98 0.28 -0.54 0.00 0.00 174.62 176.46 3kts h SER 160 N 1.55 0.00 -0.61 3.99 0.02 -1.98 -2.05 113.55 114.48 3kts h SER 160 Ca -0.50 0.00 -0.09 0.00 -0.84 0.00 0.00 61.79 60.36 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 0.62 0.06 0.01 -0.33 -1.14 0.00 0.00 176.83 176.05 3kts h GLU 161 N 0.00 1.06 -0.28 3.45 3.07 -1.98 0.96 114.58 120.86 3kts h GLU 161 Ca -0.00 -0.33 -0.15 0.00 -0.50 0.00 0.00 59.36 58.38 3kts h GLU 161 Cb 0.52 -0.10 -0.01 0.00 -0.84 0.00 0.00 28.75 28.33 3kts h GLU 161 CO 0.01 1.03 -0.44 1.96 -1.40 0.00 0.00 179.01 180.17 3kts h GLN 162 N 0.96 0.70 -0.30 2.33 4.20 -1.87 -1.53 115.11 119.60 3kts h GLN 162 Ca 0.17 -0.38 0.00 0.00 0.06 0.00 0.00 58.65 58.50 3kts h GLN 162 Cb 0.55 0.02 -0.01 0.00 0.30 0.00 0.00 27.48 28.33 3kts h GLN 162 CO 0.03 1.00 0.19 0.28 -0.67 0.00 0.00 178.83 179.66 3kts h VAL 163 N 0.56 1.09 -0.08 -0.54 2.07 -1.23 -3.10 116.25 115.02 3kts h VAL 163 Ca 0.04 -0.18 -0.01 0.00 0.82 0.00 0.00 66.70 67.37 3kts h VAL 163 Cb 0.98 0.67 -0.00 0.00 -1.52 0.00 0.00 31.29 31.42 3kts h VAL 163 CO 0.09 0.09 0.02 0.78 0.02 0.00 0.00 177.57 178.56 3kts h ASN 164 N 0.40 0.12 -0.16 0.57 2.35 -0.71 -2.70 115.58 115.46 3kts h ASN 164 Ca 0.11 -0.25 0.03 0.00 -0.55 0.00 0.00 56.30 55.64 3kts h ASN 164 Cb -0.03 -0.03 -0.03 0.00 0.05 0.00 0.00 38.32 38.28 3kts h ASN 164 CO -0.02 0.34 -0.04 1.56 -1.65 0.00 0.00 177.43 177.62 3kts h GLN 165 N -0.10 0.00 0.00 0.81 4.20 -1.32 -1.90 115.11 116.80 3kts h GLN 165 Ca 0.02 -0.00 -0.10 0.00 0.06 0.00 0.00 58.65 58.63 3kts h GLN 165 Cb 0.27 -0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.03 3kts h GLN 165 CO 0.00 0.00 -0.48 -0.24 -0.67 0.00 0.00 178.83 177.44 3kts h VAL 166 N 0.00 1.12 -0.00 -0.54 3.04 -1.61 -2.74 116.25 115.51 3kts h VAL 166 Ca 0.07 -1.80 -0.18 0.00 -1.01 0.00 0.00 66.70 63.78 3kts h VAL 166 Cb 0.11 2.04 -0.02 0.00 -2.01 0.00 0.00 31.29 31.42 3kts h VAL 166 CO -0.16 0.47 -0.82 0.40 -1.01 0.00 0.00 177.57 176.46 3kts h ILE 167 N 0.00 1.51 0.00 3.17 2.04 -1.27 -2.76 117.51 120.20 3kts h ILE 167 Ca -0.00 -2.58 -0.01 0.00 1.00 0.00 0.00 64.86 63.27 3kts h ILE 167 Cb 1.00 2.42 -0.00 0.00 -0.74 0.00 0.00 36.82 39.49 3kts h ILE 167 CO 0.06 0.75 -0.04 0.00 0.00 0.00 0.00 178.15 178.92 3kts h ALA 168 N 1.07 1.01 0.00 1.87 0.00 -1.12 -2.86 119.26 119.23 3kts h ALA 168 Ca -0.03 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.84 3kts h ALA 168 Cb 1.43 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.21 3kts h ALA 168 CO 0.12 0.05 -0.02 0.43 0.00 0.00 0.00 179.25 179.84 3kts n SER 169 N -3.16 0.78 0.00 0.00 7.64 -1.06 -4.89 113.62 112.93 3kts n SER 169 Ca 0.00 0.56 0.00 0.00 1.01 0.00 0.00 58.87 60.45 3kts n SER 169 Cb 0.33 -0.76 0.00 0.00 -1.01 0.00 0.00 64.21 62.77 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 1.32 0.87 3.67 0.23 0.00 -1.08 -3.71 105.19 106.48 3kts n GLY 170 Ca 0.06 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.65 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 -1.49 3.60 -0.15 4.61 0.00 -1.12 -4.54 121.76 122.68 3kts s ALA 171 Ca 0.00 0.57 0.29 0.00 0.00 0.00 0.00 51.96 52.82 3kts s ALA 171 Cb 0.00 -3.59 1.04 0.00 0.00 0.00 0.00 23.12 20.57 3kts s ALA 171 CO 0.00 -1.04 1.85 0.97 0.00 0.00 0.00 175.76 177.54 3kts h ILE 172 N 5.31 0.00 -2.56 0.00 2.10 -1.29 -3.42 117.51 117.64 3kts h ILE 172 Ca -0.30 -0.59 0.13 0.00 1.08 0.00 0.00 64.86 65.18 3kts h ILE 172 Cb 1.13 1.56 -0.05 0.00 -1.09 0.00 0.00 36.82 38.37 3kts h ILE 172 CO 0.94 0.00 0.45 0.00 -1.08 0.00 0.00 178.15 178.46 3kts s ALA 173 N -3.48 -1.46 -0.08 0.18 0.00 -1.25 -4.73 121.76 110.94 3kts s ALA 173 Ca 0.03 -0.16 0.02 0.00 0.00 0.00 0.00 51.96 51.85 3kts s ALA 173 Cb 0.08 0.70 0.01 0.00 0.00 0.00 0.00 23.12 23.92 3kts s ALA 173 CO 0.56 -1.04 -0.12 0.08 0.00 0.00 0.00 175.76 175.24 3kts s VAL 174 N -2.97 1.16 -0.18 0.00 1.01 0.87 -2.63 120.40 117.67 3kts s VAL 174 Ca 0.15 -0.47 -0.14 0.00 0.00 0.00 0.00 61.98 61.52 3kts s VAL 174 Cb -0.03 -1.08 -0.04 0.00 0.00 0.00 0.00 36.38 35.23 3kts s VAL 174 CO 0.05 0.37 0.31 0.42 0.00 0.00 0.00 175.10 176.24 3kts s THR 175 N 0.85 5.29 0.03 3.92 -4.23 0.10 -0.05 115.64 121.55 3kts s THR 175 Ca -0.11 0.55 -0.14 0.00 -1.18 0.00 0.00 61.69 60.82 3kts s THR 175 Cb -0.15 -3.64 0.02 0.00 1.34 0.00 0.00 72.50 70.06 3kts s THR 175 CO 0.01 0.35 0.29 0.28 -0.54 0.00 0.00 174.62 175.02 3kts s THR 176 N 0.74 0.08 -0.42 3.99 -1.32 -1.06 -3.32 115.64 114.32 3kts s THR 176 Ca 0.16 -0.64 0.11 0.00 -1.21 0.00 0.00 61.69 60.10 3kts s THR 176 Cb -0.13 -0.84 0.28 0.00 -1.51 0.00 0.00 72.50 70.29 3kts s THR 176 CO 0.05 -0.35 1.22 -1.54 -2.21 0.00 0.00 174.62 171.78 3kts n SER 177 N 0.79 2.85 -4.63 8.08 3.41 -1.26 -0.07 113.62 122.78 3kts n SER 177 Ca -0.19 -2.38 -0.43 0.00 -0.26 0.00 0.00 58.87 55.61 3kts n SER 177 Cb 0.58 -0.27 -0.02 0.00 -0.26 0.00 0.00 64.21 64.24 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 -1.46 6.50 0.15 4.04 3.84 -1.26 -4.92 114.94 121.82 3kts s ASN 178 Ca 0.23 1.50 -0.09 0.00 0.21 0.00 0.00 52.86 54.71 3kts s ASN 178 Cb 0.16 -2.53 -0.02 0.00 -0.55 0.00 0.00 41.25 38.30 3kts s ASN 178 CO 0.09 -1.17 1.44 0.50 -2.79 0.00 0.00 177.10 175.16 3kts h LYS 179 N 10.13 0.78 -0.97 0.43 3.64 -1.96 -3.25 116.57 125.37 3kts h LYS 179 Ca -0.31 -0.49 -0.39 0.00 -1.27 0.00 0.00 60.65 58.19 3kts h LYS 179 Cb 1.13 0.06 -0.23 0.00 -0.41 0.00 0.00 32.23 32.78 3kts h LYS 179 CO 1.01 1.12 0.49 -2.39 -2.27 0.00 0.00 179.45 177.41 3kts n HIS 180 N -3.99 2.45 -2.27 1.91 1.44 -1.26 -3.17 115.22 110.33 3kts n HIS 180 Ca -0.04 -1.52 0.04 0.00 -2.01 0.00 0.00 57.72 54.19 3kts n HIS 180 Cb 0.62 -0.79 0.07 0.00 0.12 0.00 0.00 29.99 30.01 3kts n HIS 180 CO 0.00 0.00 0.00 1.47 -2.81 0.00 0.00 176.34 175.00 3kts n LEU 181 N -0.73 1.55 -0.10 2.39 -0.00 -1.23 -4.98 117.00 113.91 3kts n LEU 181 Ca 0.47 -2.60 -0.16 0.00 -0.00 0.00 0.00 56.01 53.72 3kts n LEU 181 Cb 1.43 -0.12 -0.06 0.00 -0.00 0.00 0.00 43.42 44.67 3kts n LEU 181 CO 0.48 0.80 -0.85 0.79 -0.00 0.00 0.00 177.39 178.61 3kts n TRP 182 N -0.00 0.24 0.23 1.47 8.01 -1.19 -4.61 117.44 121.59 3kts n TRP 182 Ca 0.10 0.10 -0.10 0.00 -1.31 0.00 0.00 57.50 56.30 3kts n TRP 182 Cb 1.01 -0.75 -0.05 0.00 -2.01 0.00 0.00 31.31 29.51 3kts n TRP 182 CO 0.00 0.00 0.00 1.05 -1.01 0.00 0.00 177.69 177.73 3kts h GLU 183 N -1.00 -0.60 0.00 -0.99 9.09 -1.94 -3.49 114.58 115.65 3kts h GLU 183 Ca -0.25 0.04 0.00 0.00 0.05 0.00 0.00 59.36 59.20 3kts h GLU 183 Cb 1.14 0.14 0.00 0.00 -1.65 0.00 0.00 28.75 28.38 3kts h GLU 183 CO -0.15 -0.40 0.00 0.41 0.05 0.00 0.00 179.01 178.92