#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2car s SER 0 N 0.00 3.55 0.25 1.61 1.04 -1.26 -4.92 113.70 113.97 2car s SER 0 Ca 0.00 0.95 -0.04 0.00 0.48 0.00 0.00 55.95 57.35 2car s SER 0 Cb 0.00 -1.52 0.30 0.00 0.10 0.00 0.00 66.02 64.90 2car s SER 0 CO 0.00 -2.53 1.77 -0.03 0.98 0.00 0.00 173.24 173.44 2car h MET 1 N -1.48 0.92 -0.50 4.02 4.05 -2.00 -0.85 114.93 119.08 2car h MET 1 Ca -0.50 -0.21 0.03 0.00 -0.28 0.00 0.00 59.70 58.74 2car h MET 1 Cb 1.33 -0.12 -0.04 0.00 -0.80 0.00 0.00 31.60 31.97 2car h MET 1 CO 0.62 0.84 0.28 0.00 0.23 0.00 0.00 176.91 178.88 2car h ALA 2 N 1.24 0.64 0.00 0.39 0.00 -1.98 -2.90 119.26 116.66 2car h ALA 2 Ca 0.18 0.00 -0.10 0.00 0.00 0.00 0.00 54.91 55.00 2car h ALA 2 Cb 0.36 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 2car h ALA 2 CO 0.01 -0.03 -0.47 0.00 0.00 0.00 0.00 179.25 178.75 2car h ALA 3 N 1.24 1.17 0.00 0.00 0.00 -1.85 -1.22 119.26 118.61 2car h ALA 3 Ca 0.21 -0.43 -0.02 0.00 0.00 0.00 0.00 54.91 54.68 2car h ALA 3 Cb 0.06 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 17.77 2car h ALA 3 CO -0.11 0.59 -0.07 0.66 0.00 0.00 0.00 179.25 180.31 2car h SER 4 N 0.00 0.00 0.29 0.00 4.64 -0.96 -2.49 113.55 115.03 2car h SER 4 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2car h SER 4 Cb 0.86 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.95 2car h SER 4 CO 0.06 0.07 -0.72 0.18 -0.87 0.00 0.00 176.83 175.55 2car n LEU 5 N -3.50 0.71 -4.69 5.97 4.77 -0.48 -4.89 117.00 114.89 2car n LEU 5 Ca -0.02 -0.21 -0.44 0.00 -0.03 0.00 0.00 56.01 55.31 2car n LEU 5 Cb 0.21 -0.14 -0.03 0.00 -2.33 0.00 0.00 43.42 41.12 2car n LEU 5 CO 0.28 0.17 1.19 0.52 -1.33 0.00 0.00 177.39 178.22 2car n VAL 6 N -1.52 0.34 -1.02 4.08 0.31 -0.94 -1.31 118.33 118.29 2car n VAL 6 Ca 0.05 -0.09 -0.01 0.00 -0.01 0.00 0.00 64.34 64.29 2car n VAL 6 Cb 0.34 -1.66 -0.00 0.00 -0.91 0.00 0.00 33.84 31.60 2car n VAL 6 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2car n GLY 7 N 3.07 0.34 3.78 2.92 0.00 0.48 -4.99 105.19 110.79 2car n GLY 7 Ca 0.14 -0.04 -0.26 0.00 0.00 0.00 0.00 46.02 45.87 2car n GLY 7 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2car s LYS 8 N -0.99 2.81 0.19 1.61 -0.14 -0.42 -4.81 119.74 118.00 2car s LYS 8 Ca 0.00 -0.95 -0.31 0.00 -1.36 0.00 0.00 55.97 53.36 2car s LYS 8 Cb 0.00 -2.58 -0.09 0.00 -1.68 0.00 0.00 37.83 33.48 2car s LYS 8 CO 0.00 0.46 1.42 0.21 -0.76 0.00 0.00 175.35 176.68 2car s LYS 9 N -3.21 4.30 -0.12 1.68 2.20 -1.26 -1.12 119.74 122.22 2car s LYS 9 Ca 0.31 2.20 0.02 0.00 -0.36 0.00 0.00 55.97 58.14 2car s LYS 9 Cb -0.09 -3.17 0.01 0.00 -1.51 0.00 0.00 37.83 33.07 2car s LYS 9 CO 0.23 -0.41 -0.19 0.42 -0.36 0.00 0.00 175.35 175.04 2car s ILE 10 N 0.44 1.76 -0.16 5.43 1.01 0.47 -4.52 121.20 125.63 2car s ILE 10 Ca 0.62 -0.81 -0.29 0.00 0.00 0.00 0.00 60.65 60.16 2car s ILE 10 Cb -0.40 -1.57 -0.01 0.00 0.01 0.00 0.00 42.46 40.50 2car s ILE 10 CO 0.37 0.49 1.10 -0.69 0.00 0.00 0.00 174.94 176.22 2car s VAL 11 N 0.81 4.56 -0.29 2.92 1.01 -0.66 -0.62 120.40 128.13 2car s VAL 11 Ca -0.09 1.87 -0.15 0.00 0.00 0.00 0.00 61.98 63.61 2car s VAL 11 Cb -0.16 -4.20 -0.03 0.00 0.00 0.00 0.00 36.38 31.99 2car s VAL 11 CO 0.00 -0.10 0.37 0.12 0.00 0.00 0.00 175.10 175.49 2car s PHE 12 N 2.82 3.23 -0.27 5.22 5.36 0.65 -0.34 117.98 134.65 2car s PHE 12 Ca 0.49 0.31 -0.29 0.00 -0.96 0.00 0.00 56.93 56.48 2car s PHE 12 Cb -0.19 -2.60 0.01 0.00 -0.34 0.00 0.00 43.02 39.90 2car s PHE 12 CO 0.13 -0.28 1.15 0.08 -1.46 0.00 0.00 175.22 174.85 2car s VAL 13 N 2.06 4.41 -0.03 3.12 1.01 -0.45 -1.66 120.40 128.86 2car s VAL 13 Ca 0.14 1.65 -0.30 0.00 0.00 0.00 0.00 61.98 63.47 2car s VAL 13 Cb -0.16 -4.27 0.11 0.00 0.00 0.00 0.00 36.38 32.06 2car s VAL 13 CO 0.10 -0.37 1.06 0.28 0.00 0.00 0.00 175.10 176.18 2car s THR 14 N 3.72 0.00 -1.14 3.92 -1.32 -1.02 -4.70 115.64 115.09 2car s THR 14 Ca 0.49 -0.16 0.13 0.00 -1.21 0.00 0.00 61.69 60.94 2car s THR 14 Cb -0.15 -1.35 0.35 0.00 -1.51 0.00 0.00 72.50 69.84 2car s THR 14 CO 0.15 0.00 1.29 0.61 -2.21 0.00 0.00 174.62 174.46 2car n GLY 15 N -0.28 2.57 3.63 6.08 0.00 -1.26 -2.45 105.19 113.48 2car n GLY 15 Ca -0.05 -0.45 -0.11 0.00 0.00 0.00 0.00 46.02 45.41 2car n GLY 15 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2car s ASN 16 N -1.01 -0.59 0.53 1.61 4.22 -1.26 -4.99 114.94 113.46 2car s ASN 16 Ca 0.27 1.14 0.26 0.00 -2.14 0.00 0.00 52.86 52.39 2car s ASN 16 Cb 0.14 1.15 1.42 0.00 1.28 0.00 0.00 41.25 45.24 2car s ASN 16 CO 0.19 -0.20 1.98 0.00 -2.04 0.00 0.00 177.10 177.03 2car h ALA 17 N 4.61 2.54 0.00 3.54 0.00 -2.00 -1.10 119.26 126.85 2car h ALA 17 Ca -0.29 -0.02 -0.08 0.00 0.00 0.00 0.00 54.91 54.52 2car h ALA 17 Cb 1.17 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.99 2car h ALA 17 CO 0.08 -0.72 -0.38 0.87 0.00 0.00 0.00 179.25 179.10 2car h LYS 18 N 0.00 0.00 -0.13 0.00 1.79 -1.99 -0.32 116.57 115.91 2car h LYS 18 Ca 0.28 0.00 -0.18 0.00 -2.18 0.00 0.00 60.65 58.57 2car h LYS 18 Cb 1.12 0.00 -0.00 0.00 -1.58 0.00 0.00 32.23 31.76 2car h LYS 18 CO -0.00 0.38 -0.66 0.87 -1.08 0.00 0.00 179.45 178.95 2car h LYS 19 N 0.00 0.53 -0.18 3.15 1.79 -1.63 -1.22 116.57 119.00 2car h LYS 19 Ca -0.00 -0.39 -0.01 0.00 -2.18 0.00 0.00 60.65 58.07 2car h LYS 19 Cb 0.76 0.07 -0.01 0.00 -1.58 0.00 0.00 32.23 31.47 2car h LYS 19 CO 0.05 1.01 0.08 1.25 -1.08 0.00 0.00 179.45 180.76 2car h LEU 20 N 0.38 0.25 -1.02 2.94 5.85 -1.43 -2.57 115.31 119.71 2car h LEU 20 Ca -0.02 -0.15 0.07 0.00 0.84 0.00 0.00 57.88 58.62 2car h LEU 20 Cb 1.24 -0.06 -0.07 0.00 0.37 0.00 0.00 40.66 42.13 2car h LEU 20 CO 0.12 0.34 0.65 -0.08 -0.34 0.00 0.00 178.44 179.12 2car h GLU 21 N 0.15 1.12 -0.60 1.25 4.81 -0.85 -0.32 114.58 120.15 2car h GLU 21 Ca 0.06 -0.07 0.05 0.00 -0.13 0.00 0.00 59.36 59.27 2car h GLU 21 Cb 0.16 -0.25 -0.05 0.00 0.63 0.00 0.00 28.75 29.24 2car h GLU 21 CO -0.01 0.74 0.32 0.93 -0.73 0.00 0.00 179.01 180.27 2car h GLU 22 N 1.16 0.59 -0.11 1.92 5.08 -0.90 -0.82 114.58 121.50 2car h GLU 22 Ca 0.44 -0.04 -0.06 0.00 -1.00 0.00 0.00 59.36 58.70 2car h GLU 22 Cb 0.20 -0.13 -0.00 0.00 0.50 0.00 0.00 28.75 29.31 2car h GLU 22 CO -0.18 0.39 -0.15 0.28 -1.00 0.00 0.00 179.01 178.35 2car h VAL 23 N 0.61 1.37 -0.68 3.13 2.07 -0.82 -2.19 116.25 119.75 2car h VAL 23 Ca 0.26 -1.37 0.01 0.00 0.82 0.00 0.00 66.70 66.43 2car h VAL 23 Cb 0.15 2.02 -0.04 0.00 -1.52 0.00 0.00 31.29 31.91 2car h VAL 23 CO -0.17 0.39 0.44 0.58 0.02 0.00 0.00 177.57 178.84 2car h VAL 24 N -0.13 1.15 -0.21 2.57 2.07 -0.89 0.68 116.25 121.49 2car h VAL 24 Ca 0.01 -0.30 0.00 0.00 0.82 0.00 0.00 66.70 67.23 2car h VAL 24 Cb 0.70 0.18 -0.01 0.00 -1.52 0.00 0.00 31.29 30.64 2car h VAL 24 CO 0.04 0.16 0.13 1.56 0.02 0.00 0.00 177.57 179.48 2car h GLN 25 N 0.89 0.28 -0.73 1.57 4.20 -1.10 -1.63 115.11 118.58 2car h GLN 25 Ca 0.26 -0.02 -0.04 0.00 0.06 0.00 0.00 58.65 58.90 2car h GLN 25 Cb -0.07 -0.06 -0.03 0.00 0.30 0.00 0.00 27.48 27.62 2car h GLN 25 CO -0.07 0.21 0.29 0.82 -0.67 0.00 0.00 178.83 179.41 2car h ILE 26 N 0.27 1.25 0.00 2.54 2.04 -0.89 -2.39 117.51 120.33 2car h ILE 26 Ca 0.08 -0.79 -0.06 0.00 1.00 0.00 0.00 64.86 65.09 2car h ILE 26 Cb -0.01 0.40 -0.01 0.00 -0.74 0.00 0.00 36.82 36.47 2car h ILE 26 CO -0.02 0.32 -0.26 -0.07 0.00 0.00 0.00 178.15 178.12 2car h LEU 27 N 1.05 0.00 0.00 1.44 3.38 -0.73 -3.48 115.31 116.96 2car h LEU 27 Ca 0.24 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.21 2car h LEU 27 Cb 0.21 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.96 2car h LEU 27 CO -0.02 0.26 0.00 0.61 0.09 0.00 0.00 178.44 179.38 2car n GLY 28 N -0.29 -1.19 0.10 0.83 0.00 -0.63 -4.17 105.19 99.83 2car n GLY 28 Ca -0.01 -1.61 0.12 0.00 0.00 0.00 0.00 46.02 44.53 2car n GLY 28 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2car n ASP 29 N -1.38 0.65 -0.92 1.61 2.03 -1.26 -2.50 116.55 114.78 2car n ASP 29 Ca 0.00 0.60 0.12 0.00 0.52 0.00 0.00 54.79 56.03 2car n ASP 29 Cb 0.00 -0.76 0.19 0.00 -0.72 0.00 0.00 41.12 39.83 2car n ASP 29 CO 0.00 0.00 0.00 0.29 -1.92 0.00 0.00 177.20 175.57 2car n LYS 30 N -2.15 2.26 -1.76 -0.67 5.02 -1.26 -4.90 118.16 114.70 2car n LYS 30 Ca 0.04 -1.85 -0.42 0.00 -2.02 0.00 0.00 58.31 54.07 2car n LYS 30 Cb 0.34 -1.47 -0.03 0.00 -0.02 0.00 0.00 35.03 33.85 2car n LYS 30 CO 0.00 0.00 0.00 0.12 -0.52 0.00 0.00 177.40 177.00 2car s PHE 31 N -1.89 1.45 -0.37 2.13 5.36 -1.04 -4.31 117.98 119.31 2car s PHE 31 Ca 0.32 -0.19 0.06 0.00 -0.96 0.00 0.00 56.93 56.16 2car s PHE 31 Cb 0.21 -4.14 0.62 0.00 -0.34 0.00 0.00 43.02 39.37 2car s PHE 31 CO 0.31 -4.96 1.71 -0.35 -1.46 0.00 0.00 175.22 170.47 2car n PRO 32 N 7.57 2.89 -4.36 10.12 -0.04 -1.26 -4.88 135.00 145.04 2car n PRO 32 Ca 0.20 -2.63 -0.18 0.00 -0.04 0.00 0.00 63.50 60.85 2car n PRO 32 Cb 0.42 -2.07 -0.10 0.00 -0.04 0.00 0.00 33.50 31.71 2car n PRO 32 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2car s THR 34 N -3.37 4.59 0.00 0.00 2.01 -0.28 -4.94 115.64 113.66 2car s THR 34 Ca 0.30 -0.71 -0.21 0.00 0.31 0.00 0.00 61.69 61.38 2car s THR 34 Cb 0.06 -3.49 -0.05 0.00 0.01 0.00 0.00 72.50 69.03 2car s THR 34 CO 0.10 -0.14 0.62 -0.76 -0.69 0.00 0.00 174.62 173.76 2car s LEU 35 N 1.57 4.42 -0.13 4.42 1.43 -1.26 -0.40 118.68 128.73 2car s LEU 35 Ca 0.03 1.20 0.01 0.00 -1.03 0.00 0.00 54.13 54.34 2car s LEU 35 Cb -0.18 -2.97 0.02 0.00 0.03 0.00 0.00 46.19 43.09 2car s LEU 35 CO 0.07 0.09 -0.16 -0.69 0.23 0.00 0.00 176.35 175.88 2car s VAL 36 N -0.16 1.66 0.20 -1.59 1.01 0.21 -4.94 120.40 116.80 2car s VAL 36 Ca 0.32 -0.72 -0.30 0.00 0.00 0.00 0.00 61.98 61.29 2car s VAL 36 Cb -0.18 -1.52 -0.08 0.00 0.00 0.00 0.00 36.38 34.59 2car s VAL 36 CO 0.18 0.47 1.07 0.00 0.00 0.00 0.00 175.10 176.82 2car s ALA 37 N 1.17 3.36 -0.11 5.51 0.00 -1.26 -0.25 121.76 130.19 2car s ALA 37 Ca -0.01 0.79 -0.11 0.00 0.00 0.00 0.00 51.96 52.62 2car s ALA 37 Cb -0.14 -3.32 0.03 0.00 0.00 0.00 0.00 23.12 19.69 2car s ALA 37 CO -0.06 -0.13 0.31 -1.14 0.00 0.00 0.00 175.76 174.74 2car s GLN 38 N -0.69 0.40 -0.60 0.00 0.74 -0.66 -4.91 119.66 113.94 2car s GLN 38 Ca 0.47 0.36 -0.25 0.00 0.05 0.00 0.00 55.36 55.99 2car s GLN 38 Cb -0.29 0.19 0.04 0.00 1.10 0.00 0.00 33.01 34.05 2car s GLN 38 CO 0.35 -0.06 1.06 0.21 -0.55 0.00 0.00 175.29 176.31 2car s LYS 39 N -0.00 3.34 -0.22 1.67 2.47 -1.02 -2.45 119.74 123.52 2car s LYS 39 Ca -0.02 -0.18 -0.08 0.00 -1.56 0.00 0.00 55.97 54.14 2car s LYS 39 Cb -0.03 -4.08 -0.04 0.00 -1.46 0.00 0.00 37.83 32.23 2car s LYS 39 CO 0.01 -1.66 0.08 0.42 0.16 0.00 0.00 175.35 174.35 2car s ILE 40 N 4.48 4.62 -0.30 5.43 -1.09 -1.26 -5.02 121.20 128.05 2car s ILE 40 Ca 0.34 -0.08 -0.29 0.00 -2.23 0.00 0.00 60.65 58.39 2car s ILE 40 Cb -0.11 -3.12 -0.02 0.00 -1.58 0.00 0.00 42.46 37.63 2car s ILE 40 CO 0.19 0.39 1.62 -0.62 -1.23 0.00 0.00 174.94 175.30 2car s ASP 41 N 1.02 6.22 0.01 3.58 2.15 -1.26 -4.94 116.67 123.46 2car s ASP 41 Ca 0.04 1.35 0.05 0.00 0.43 0.00 0.00 52.55 54.42 2car s ASP 41 Cb -0.14 -2.53 -0.02 0.00 -0.30 0.00 0.00 42.92 39.93 2car s ASP 41 CO 0.03 -1.43 -0.15 -0.76 -0.17 0.00 0.00 175.17 172.69 2car s LEU 42 N 5.76 2.08 1.11 -1.34 1.43 -1.26 -4.99 118.68 121.47 2car s LEU 42 Ca 0.72 -0.34 -0.12 0.00 -1.03 0.00 0.00 54.13 53.35 2car s LEU 42 Cb -0.22 -0.72 0.25 0.00 0.03 0.00 0.00 46.19 45.53 2car s LEU 42 CO 0.31 0.13 1.05 -2.84 0.23 0.00 0.00 176.35 175.24 2car s PRO 43 N -0.65 -0.48 -0.05 1.29 0.02 -1.26 -5.05 135.00 128.82 2car s PRO 43 Ca 0.05 0.91 0.05 0.00 0.02 0.00 0.00 61.00 62.02 2car s PRO 43 Cb -0.07 -1.60 -0.02 0.00 0.02 0.00 0.00 34.50 32.83 2car s PRO 43 CO 0.00 -3.45 -0.19 -1.21 -0.33 0.00 0.00 177.00 171.82 2car s GLU 44 N -4.55 2.49 0.12 5.54 0.41 -1.26 -4.93 118.70 116.52 2car s GLU 44 Ca 0.68 -0.78 0.11 0.00 -0.41 0.00 0.00 54.97 54.56 2car s GLU 44 Cb -0.24 -2.29 -0.04 0.00 -1.78 0.00 0.00 34.13 29.78 2car s GLU 44 CO 0.63 0.54 -0.25 0.71 -0.49 0.00 0.00 175.26 176.39 2car s TYR 45 N -0.53 2.35 0.27 1.61 2.02 -1.26 -5.12 117.35 116.69 2car s TYR 45 Ca 0.07 -0.36 -0.08 0.00 -0.37 0.00 0.00 57.07 56.33 2car s TYR 45 Cb -0.11 -1.27 -0.06 0.00 -0.40 0.00 0.00 41.96 40.11 2car s TYR 45 CO 0.01 0.34 0.57 -0.65 -1.57 0.00 0.00 175.55 174.25 2car s GLN 46 N -2.03 3.74 0.00 -0.62 -0.21 -1.26 -4.89 119.66 114.39 2car s GLN 46 Ca 0.15 0.19 0.00 0.00 0.02 0.00 0.00 55.36 55.72 2car s GLN 46 Cb -0.10 -2.62 0.00 0.00 1.00 0.00 0.00 33.01 31.29 2car s GLN 46 CO 0.06 0.24 0.00 0.41 -2.12 0.00 0.00 175.29 173.89 2car n GLY 47 N -0.55 -0.26 3.76 3.09 0.00 -1.26 -4.80 105.19 105.17 2car n GLY 47 Ca -0.00 -1.74 -0.33 0.00 0.00 0.00 0.00 46.02 43.95 2car n GLY 47 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2car s GLU 48 N -1.40 2.73 0.18 1.61 2.02 -1.26 -4.72 118.70 117.86 2car s GLU 48 Ca 0.00 1.46 -0.15 0.00 0.02 0.00 0.00 54.97 56.30 2car s GLU 48 Cb 0.00 -1.94 0.15 0.00 0.10 0.00 0.00 34.13 32.44 2car s GLU 48 CO 0.00 -1.32 1.67 -1.35 0.02 0.00 0.00 175.26 174.28 2car h PRO 49 N 0.05 0.04 -0.84 0.39 0.11 -1.99 0.12 132.00 129.88 2car h PRO 49 Ca -0.47 -0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.62 2car h PRO 49 Cb 1.26 -0.01 -0.04 0.00 0.11 0.00 0.00 31.00 32.32 2car h PRO 49 CO 0.54 0.03 0.46 -0.44 -0.21 0.00 0.00 178.00 178.37 2car h ASP 50 N 0.04 1.05 0.65 -2.05 5.19 -1.99 -1.35 116.42 117.95 2car h ASP 50 Ca 0.23 -0.10 -0.15 0.00 -0.62 0.00 0.00 57.03 56.39 2car h ASP 50 Cb 0.34 -0.27 -0.02 0.00 0.18 0.00 0.00 39.33 39.57 2car h ASP 50 CO -0.44 0.84 -0.72 1.05 -3.12 0.00 0.00 179.24 176.86 2car h GLU 51 N 1.17 0.05 -0.22 3.56 4.11 -1.33 -0.29 114.58 121.63 2car h GLU 51 Ca 0.30 -0.04 -0.01 0.00 0.07 0.00 0.00 59.36 59.68 2car h GLU 51 Cb 0.03 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.28 2car h GLU 51 CO -0.05 0.74 0.12 0.82 0.07 0.00 0.00 179.01 180.71 2car h ILE 52 N 0.03 1.12 -0.32 -1.06 2.04 -0.54 -1.62 117.51 117.16 2car h ILE 52 Ca -0.01 -0.32 0.05 0.00 1.00 0.00 0.00 64.86 65.58 2car h ILE 52 Cb 1.26 0.93 -0.05 0.00 -0.74 0.00 0.00 36.82 38.23 2car h ILE 52 CO 0.10 0.11 0.02 0.28 0.00 0.00 0.00 178.15 178.66 2car h SER 53 N 0.24 -0.08 -0.75 1.72 0.02 -0.95 -0.21 113.55 113.54 2car h SER 53 Ca 0.08 0.07 -0.01 0.00 -0.84 0.00 0.00 61.79 61.09 2car h SER 53 Cb 0.08 0.11 -0.04 0.00 0.14 0.00 0.00 62.40 62.69 2car h SER 53 CO -0.01 -0.00 0.45 0.40 -1.14 0.00 0.00 176.83 176.52 2car h ILE 54 N 0.12 1.21 -0.38 3.27 2.04 -1.01 -0.96 117.51 121.81 2car h ILE 54 Ca 0.15 -0.48 -0.03 0.00 1.00 0.00 0.00 64.86 65.50 2car h ILE 54 Cb 0.19 0.17 -0.02 0.00 -0.74 0.00 0.00 36.82 36.43 2car h ILE 54 CO -0.24 0.22 0.12 1.56 0.00 0.00 0.00 178.15 179.81 2car h GLN 55 N 1.03 0.59 -0.65 2.37 4.20 -0.96 0.44 115.11 122.12 2car h GLN 55 Ca 0.27 -0.13 -0.05 0.00 0.06 0.00 0.00 58.65 58.80 2car h GLN 55 Cb -0.03 -0.08 -0.03 0.00 0.30 0.00 0.00 27.48 27.64 2car h GLN 55 CO -0.05 0.61 0.20 -0.22 -0.67 0.00 0.00 178.83 178.70 2car h LYS 56 N 0.47 1.02 -0.39 1.46 3.64 -0.88 -1.41 116.57 120.48 2car h LYS 56 Ca 0.12 -0.22 -0.14 0.00 -1.27 0.00 0.00 60.65 59.14 2car h LYS 56 Cb 0.26 -0.15 -0.01 0.00 -0.41 0.00 0.00 32.23 31.93 2car h LYS 56 CO -0.00 0.89 -0.31 0.00 -2.27 0.00 0.00 179.45 177.76 2car h GLN 58 N 0.72 1.16 -0.40 0.00 4.20 -0.70 -0.61 115.11 119.49 2car h GLN 58 Ca 0.08 -0.07 -0.13 0.00 0.06 0.00 0.00 58.65 58.59 2car h GLN 58 Cb 0.86 -0.26 -0.01 0.00 0.30 0.00 0.00 27.48 28.37 2car h GLN 58 CO 0.08 0.77 -0.26 1.49 -0.67 0.00 0.00 178.83 180.23 2car h GLU 59 N 1.19 0.88 -0.87 1.46 4.57 -0.91 -2.08 114.58 118.82 2car h GLU 59 Ca 0.36 -0.42 0.13 0.00 -1.18 0.00 0.00 59.36 58.25 2car h GLU 59 Cb -0.05 -0.01 -0.09 0.00 -0.16 0.00 0.00 28.75 28.44 2car h GLU 59 CO -0.10 1.06 0.49 0.00 -1.18 0.00 0.00 179.01 179.28 2car h ALA 60 N 0.80 1.31 -0.84 2.92 0.00 -0.85 -1.52 119.26 121.07 2car h ALA 60 Ca 0.08 0.06 -0.01 0.00 0.00 0.00 0.00 54.91 55.04 2car h ALA 60 Cb 0.84 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 18.51 2car h ALA 60 CO 0.07 0.01 0.48 0.28 0.00 0.00 0.00 179.25 180.09 2car h VAL 61 N 0.73 1.24 -0.16 0.00 2.07 -0.76 0.11 116.25 119.48 2car h VAL 61 Ca 0.46 -0.58 -0.07 0.00 0.82 0.00 0.00 66.70 67.33 2car h VAL 61 Cb 0.57 0.09 -0.01 0.00 -1.52 0.00 0.00 31.29 30.41 2car h VAL 61 CO -0.32 0.27 -0.20 0.03 0.02 0.00 0.00 177.57 177.36 2car h ARG 62 N 1.17 0.28 0.21 1.57 3.08 -0.61 0.57 114.38 120.65 2car h ARG 62 Ca 0.30 -0.08 -0.01 0.00 0.07 0.00 0.00 59.98 60.25 2car h ARG 62 Cb 0.00 -0.03 0.00 0.00 0.08 0.00 0.00 29.97 30.03 2car h ARG 62 CO -0.05 0.48 -0.10 1.96 -1.07 0.00 0.00 179.97 181.19 2car h GLN 63 N 0.26 -0.27 -0.44 0.04 1.08 -0.71 -3.39 115.11 111.68 2car h GLN 63 Ca 0.05 0.02 -0.14 0.00 -1.45 0.00 0.00 58.65 57.13 2car h GLN 63 Cb 0.51 0.06 -0.01 0.00 -0.05 0.00 0.00 27.48 27.99 2car h GLN 63 CO 0.03 -0.18 -0.25 0.28 -0.95 0.00 0.00 178.83 177.77 2car h VAL 64 N -0.67 1.27 -5.61 -0.54 2.07 -0.83 -3.48 116.25 108.47 2car h VAL 64 Ca -0.03 -1.42 -0.41 0.00 0.82 0.00 0.00 66.70 65.66 2car h VAL 64 Cb 0.21 1.22 0.09 0.00 -1.52 0.00 0.00 31.29 31.29 2car h VAL 64 CO 0.05 0.48 -0.67 0.00 0.02 0.00 0.00 177.57 177.45 2car n GLN 65 N -4.13 -6.85 -3.72 1.57 6.02 0.20 -4.93 117.38 105.55 2car n GLN 65 Ca -0.01 0.80 -0.01 0.00 -0.01 0.00 0.00 57.00 57.77 2car n GLN 65 Cb 0.47 -5.79 0.02 0.00 1.02 0.00 0.00 30.24 25.96 2car n GLN 65 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2car n GLY 66 N -1.84 0.54 3.76 1.08 0.00 -1.26 -4.94 105.19 102.52 2car n GLY 66 Ca -0.01 -1.10 -0.41 0.00 0.00 0.00 0.00 46.02 44.49 2car n GLY 66 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2car n PRO 67 N -0.72 2.69 -3.84 1.61 -0.02 -0.88 -3.63 135.00 130.21 2car n PRO 67 Ca -0.00 0.95 -0.12 0.00 -2.02 0.00 0.00 63.50 62.31 2car n PRO 67 Cb 0.53 -2.71 -0.10 0.00 -0.02 0.00 0.00 33.50 31.21 2car n PRO 67 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2car s VAL 68 N -0.47 0.07 -0.07 -1.45 1.01 -0.14 -1.65 120.40 117.69 2car s VAL 68 Ca 0.59 -0.58 0.00 0.00 0.00 0.00 0.00 61.98 61.99 2car s VAL 68 Cb -0.49 -0.48 0.02 0.00 0.00 0.00 0.00 36.38 35.44 2car s VAL 68 CO 0.55 -0.32 -0.05 -0.22 0.00 0.00 0.00 175.10 175.06 2car s LEU 69 N -1.27 1.16 0.15 3.92 2.96 0.54 -1.88 118.68 124.26 2car s LEU 69 Ca -0.13 -0.19 0.09 0.00 -0.22 0.00 0.00 54.13 53.67 2car s LEU 69 Cb -0.07 -0.61 -0.04 0.00 0.50 0.00 0.00 46.19 45.98 2car s LEU 69 CO 0.02 -0.09 -0.19 0.68 -1.32 0.00 0.00 176.35 175.45 2car s VAL 70 N 1.33 1.81 0.06 1.68 -7.23 -0.60 -1.35 120.40 116.10 2car s VAL 70 Ca -0.04 -1.81 0.05 0.00 -1.81 0.00 0.00 61.98 58.36 2car s VAL 70 Cb -0.14 -1.77 -0.03 0.00 0.56 0.00 0.00 36.38 35.00 2car s VAL 70 CO -0.03 -0.23 -0.13 -1.83 -0.31 0.00 0.00 175.10 172.57 2car s GLU 71 N -2.53 0.80 -0.02 4.82 -1.05 -1.26 -0.67 118.70 118.79 2car s GLU 71 Ca 0.13 -0.85 -0.01 0.00 -0.15 0.00 0.00 54.97 54.08 2car s GLU 71 Cb -0.07 -0.78 0.01 0.00 -0.44 0.00 0.00 34.13 32.85 2car s GLU 71 CO 0.06 0.18 0.05 -0.51 0.95 0.00 0.00 175.26 175.99 2car s ASP 72 N -1.51 -0.04 0.10 0.83 1.01 -0.37 -5.01 116.67 111.68 2car s ASP 72 Ca -0.02 0.10 0.08 0.00 0.71 0.00 0.00 52.55 53.42 2car s ASP 72 Cb -0.09 0.08 -0.04 0.00 1.01 0.00 0.00 42.92 43.88 2car s ASP 72 CO 0.02 -0.04 -0.16 -0.89 0.21 0.00 0.00 175.17 174.31 2car s THR 73 N 0.20 2.95 0.05 -1.27 2.01 -1.26 -0.68 115.64 117.64 2car s THR 73 Ca -0.01 -1.38 0.03 0.00 0.31 0.00 0.00 61.69 60.64 2car s THR 73 Cb -0.02 -2.33 -0.02 0.00 0.01 0.00 0.00 72.50 70.13 2car s THR 73 CO -0.01 0.16 -0.10 0.00 -0.69 0.00 0.00 174.62 173.98 2car s LEU 75 N -1.55 2.10 -0.21 0.00 2.96 -1.07 -1.19 118.68 119.72 2car s LEU 75 Ca -0.06 -0.81 0.01 0.00 -0.22 0.00 0.00 54.13 53.05 2car s LEU 75 Cb -0.10 -1.16 0.03 0.00 0.50 0.00 0.00 46.19 45.46 2car s LEU 75 CO 0.01 -0.15 -0.16 0.00 -1.32 0.00 0.00 176.35 174.73 2car s PHE 77 N 1.24 3.36 0.35 0.00 0.08 -0.04 -0.75 117.98 122.23 2car s PHE 77 Ca 0.01 0.62 0.09 0.00 0.12 0.00 0.00 56.93 57.77 2car s PHE 77 Cb -0.15 -2.55 0.66 0.00 -0.57 0.00 0.00 43.02 40.41 2car s PHE 77 CO -0.10 -0.04 1.82 -0.91 -0.10 0.00 0.00 175.22 175.89 2car h ASN 78 N 7.45 0.19 0.61 1.36 -0.26 -1.35 -1.75 115.58 121.82 2car h ASN 78 Ca -0.35 -0.06 -0.02 0.00 -0.56 0.00 0.00 56.30 55.31 2car h ASN 78 Cb 1.16 -0.05 -0.00 0.00 -1.06 0.00 0.00 38.32 38.37 2car h ASN 78 CO 0.71 0.47 -0.10 0.00 -1.06 0.00 0.00 177.43 177.46 2car h ALA 79 N 1.55 1.11 -0.65 -0.83 0.00 -1.75 -2.47 119.26 116.22 2car h ALA 79 Ca 0.03 -0.09 -0.12 0.00 0.00 0.00 0.00 54.91 54.73 2car h ALA 79 Cb 0.58 -0.02 -0.07 0.00 0.00 0.00 0.00 17.79 18.29 2car h ALA 79 CO 0.04 0.12 0.15 1.28 0.00 0.00 0.00 179.25 180.84 2car n LEU 80 N -3.37 5.87 -1.70 0.00 4.77 -0.74 -4.94 117.00 116.88 2car n LEU 80 Ca -0.01 -3.11 -0.19 0.00 -0.03 0.00 0.00 56.01 52.67 2car n LEU 80 Cb 0.27 -0.71 -0.06 0.00 -2.33 0.00 0.00 43.42 40.59 2car n LEU 80 CO 0.29 0.74 -0.20 0.61 -1.33 0.00 0.00 177.39 177.49 2car n GLY 81 N 0.13 1.06 0.00 -0.72 0.00 -0.93 -1.95 105.19 102.78 2car n GLY 81 Ca 0.35 -0.10 0.00 0.00 0.00 0.00 0.00 46.02 46.27 2car n GLY 81 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2car n GLY 82 N -0.77 0.36 3.86 -0.02 0.00 -0.74 -4.99 105.19 102.89 2car n GLY 82 Ca -0.20 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.51 2car n GLY 82 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2car s LEU 83 N 0.00 2.98 0.49 0.99 1.43 -0.82 -2.22 118.68 121.52 2car s LEU 83 Ca 0.00 1.29 0.33 0.00 -1.03 0.00 0.00 54.13 54.72 2car s LEU 83 Cb 0.00 -4.14 1.67 0.00 0.03 0.00 0.00 46.19 43.74 2car s LEU 83 CO 0.00 -1.29 2.00 -0.65 0.23 0.00 0.00 176.35 176.64 2car h PRO 84 N -0.62 0.00 0.00 1.29 0.11 -1.89 -0.06 132.00 130.83 2car h PRO 84 Ca -0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 2car h PRO 84 Cb 1.23 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.34 2car h PRO 84 CO 0.62 0.00 0.00 0.41 -0.21 0.00 0.00 178.00 178.82 2car n GLY 85 N -0.77 3.88 0.09 -0.55 0.00 0.47 -1.06 105.19 107.24 2car n GLY 85 Ca -0.01 0.04 0.10 0.00 0.00 0.00 0.00 46.02 46.15 2car n GLY 85 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2car n PRO 86 N 14.00 0.12 -0.44 1.61 -0.04 -1.26 -2.36 135.00 146.63 2car n PRO 86 Ca 0.00 0.40 0.09 0.00 -0.04 0.00 0.00 63.50 63.95 2car n PRO 86 Cb 0.00 -1.75 0.29 0.00 -0.04 0.00 0.00 33.50 32.00 2car n PRO 86 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 2car n TYR 87 N -1.98 1.08 -0.15 0.54 4.01 -0.22 -4.58 117.16 115.86 2car n TYR 87 Ca 0.02 -0.47 0.08 0.00 -0.16 0.00 0.00 57.90 57.37 2car n TYR 87 Cb 0.18 -0.12 0.40 0.00 -0.31 0.00 0.00 39.34 39.49 2car n TYR 87 CO 0.00 0.00 0.00 0.97 -0.46 0.00 0.00 176.86 177.37 2car h ILE 88 N 3.58 0.98 -0.60 -0.72 6.09 -1.59 -1.89 117.51 123.37 2car h ILE 88 Ca 0.00 -0.22 0.10 0.00 -1.37 0.00 0.00 64.86 63.37 2car h ILE 88 Cb 1.08 0.28 -0.07 0.00 0.47 0.00 0.00 36.82 38.57 2car h ILE 88 CO 0.11 0.12 0.21 0.50 -3.07 0.00 0.00 178.15 176.01 2car h LYS 89 N 0.64 0.36 -0.31 2.19 3.64 -1.87 0.35 116.57 121.57 2car h LYS 89 Ca 0.30 -0.02 -0.07 0.00 -1.27 0.00 0.00 60.65 59.59 2car h LYS 89 Cb 0.35 -0.08 -0.01 0.00 -0.41 0.00 0.00 32.23 32.08 2car h LYS 89 CO -0.10 0.24 -0.09 -1.49 -2.27 0.00 0.00 179.45 175.74 2car h TRP 90 N 0.37 0.68 -0.57 1.91 4.06 -1.71 0.09 115.95 120.77 2car h TRP 90 Ca 0.31 -0.15 -0.10 0.00 2.06 0.00 0.00 58.89 61.01 2car h TRP 90 Cb 0.40 -0.16 -0.02 0.00 -1.00 0.00 0.00 29.16 28.37 2car h TRP 90 CO -0.18 0.79 -0.02 0.74 -3.56 0.00 0.00 178.44 176.21 2car h PHE 91 N 0.37 1.11 -0.75 0.49 0.04 -1.23 -1.57 116.94 115.41 2car h PHE 91 Ca 0.08 -0.20 -0.04 0.00 2.80 0.00 0.00 57.97 60.61 2car h PHE 91 Cb 0.58 -0.29 -0.03 0.00 2.20 0.00 0.00 35.95 38.41 2car h PHE 91 CO 0.05 1.00 0.32 1.25 -0.60 0.00 0.00 178.31 180.34 2car h LEU 92 N 0.91 1.01 -0.44 1.54 5.85 -0.15 0.10 115.31 124.13 2car h LEU 92 Ca 0.16 -0.16 -0.02 0.00 0.84 0.00 0.00 57.88 58.70 2car h LEU 92 Cb 0.57 -0.26 -0.02 0.00 0.37 0.00 0.00 40.66 41.32 2car h LEU 92 CO 0.03 0.89 0.19 -0.08 -0.34 0.00 0.00 178.44 179.13 2car h GLU 93 N 1.07 0.64 0.05 1.25 4.22 -0.67 0.15 114.58 121.29 2car h GLU 93 Ca 0.25 -0.11 -0.23 0.00 0.08 0.00 0.00 59.36 59.36 2car h GLU 93 Cb 0.18 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.31 2car h GLU 93 CO -0.03 0.57 -1.05 0.87 -2.18 0.00 0.00 179.01 177.19 2car h LYS 94 N 0.56 0.18 0.00 1.92 1.79 -1.23 -3.39 116.57 116.39 2car h LYS 94 Ca 0.15 -0.26 -0.13 0.00 -2.18 0.00 0.00 60.65 58.23 2car h LYS 94 Cb 0.16 0.09 -0.02 0.00 -1.58 0.00 0.00 32.23 30.87 2car h LYS 94 CO -0.02 1.07 -1.80 1.28 -1.08 0.00 0.00 179.45 178.91 2car n LEU 95 N -3.53 0.00 -0.55 2.94 4.77 0.01 -5.06 117.00 115.58 2car n LEU 95 Ca -0.05 0.00 0.07 0.00 -0.03 0.00 0.00 56.01 56.00 2car n LEU 95 Cb 0.93 0.17 -0.03 0.00 -2.33 0.00 0.00 43.42 42.16 2car n LEU 95 CO 0.50 0.17 -0.22 0.29 -1.33 0.00 0.00 177.39 176.81 2car n LYS 96 N -2.26 -1.25 -0.32 3.23 4.76 0.52 -1.96 118.16 120.87 2car n LYS 96 Ca -0.13 0.99 0.11 0.00 -2.87 0.00 0.00 58.31 56.40 2car n LYS 96 Cb 0.67 -1.47 0.28 0.00 -1.84 0.00 0.00 35.03 32.67 2car n LYS 96 CO 0.00 0.00 0.00 -1.35 -1.37 0.00 0.00 177.40 174.68 2car h PRO 97 N -0.54 0.65 -0.38 1.97 0.11 -1.86 0.33 132.00 132.28 2car h PRO 97 Ca -0.06 -0.04 0.08 0.00 0.11 0.00 0.00 66.00 66.09 2car h PRO 97 Cb 0.53 -0.15 -0.07 0.00 0.11 0.00 0.00 31.00 31.42 2car h PRO 97 CO 0.02 0.43 -0.10 0.93 -0.21 0.00 0.00 178.00 179.07 2car h GLU 98 N 0.67 -0.01 0.00 1.05 3.07 -1.94 -2.53 114.58 114.90 2car h GLU 98 Ca 0.53 0.00 -0.11 0.00 -0.50 0.00 0.00 59.36 59.28 2car h GLU 98 Cb 0.81 0.00 -0.02 0.00 -0.84 0.00 0.00 28.75 28.71 2car h GLU 98 CO -0.39 -0.01 -0.54 0.78 -1.40 0.00 0.00 179.01 177.46 2car h GLY 99 N -0.01 0.00 1.03 -3.84 0.00 -0.63 -1.68 103.07 97.94 2car h GLY 99 Ca 0.18 0.00 -0.03 0.00 0.00 0.00 0.00 47.33 47.49 2car h GLY 99 CO -0.40 0.00 0.39 1.41 0.00 0.00 0.00 176.54 177.95 2car h LEU 100 N 0.00 1.07 -0.33 3.11 3.38 -0.63 -1.43 115.31 120.48 2car h LEU 100 Ca -0.01 -0.13 -0.14 0.00 0.09 0.00 0.00 57.88 57.69 2car h LEU 100 Cb 1.16 -0.27 -0.00 0.00 0.09 0.00 0.00 40.66 41.63 2car h LEU 100 CO 0.07 0.90 -0.34 -0.74 0.09 0.00 0.00 178.44 178.42 2car h HIS 101 N 1.16 0.98 0.00 1.13 2.76 -1.35 -3.07 115.15 116.76 2car h HIS 101 Ca 0.28 -0.30 -0.02 0.00 -2.20 0.00 0.00 60.37 58.13 2car h HIS 101 Cb 0.11 -0.21 -0.00 0.00 1.55 0.00 0.00 27.41 28.87 2car h HIS 101 CO 0.01 1.09 -0.09 0.37 -1.30 0.00 0.00 177.93 178.01 2car h GLN 102 N 0.60 0.00 0.00 5.26 4.15 -1.02 -1.71 115.11 122.39 2car h GLN 102 Ca 0.05 0.00 -0.00 0.00 0.77 0.00 0.00 58.65 59.47 2car h GLN 102 Cb 0.93 0.00 -0.00 0.00 0.21 0.00 0.00 27.48 28.62 2car h GLN 102 CO 0.08 0.09 -0.02 1.25 -1.93 0.00 0.00 178.83 178.31 2car h LEU 103 N 0.00 0.00 -1.46 -2.39 5.85 -1.16 -1.40 115.31 114.75 2car h LEU 103 Ca -0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 2car h LEU 103 Cb 0.21 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.24 2car h LEU 103 CO 0.01 0.02 0.00 0.18 -0.34 0.00 0.00 178.44 178.31 2car n LEU 104 N -3.38 2.22 -0.07 2.25 4.77 -0.64 -4.53 117.00 117.61 2car n LEU 104 Ca -0.03 -0.87 0.12 0.00 -0.03 0.00 0.00 56.01 55.20 2car n LEU 104 Cb 0.11 -0.10 0.51 0.00 -2.33 0.00 0.00 43.42 41.61 2car n LEU 104 CO 0.24 0.44 1.18 0.00 -1.33 0.00 0.00 177.39 177.92 2car h ALA 105 N 4.32 2.02 -0.01 -1.18 0.00 -1.37 0.49 119.26 123.53 2car h ALA 105 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2car h ALA 105 Cb 0.67 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.38 2car h ALA 105 CO 0.00 -0.15 0.00 0.41 0.00 0.00 0.00 179.25 179.51 2car n GLY 106 N -1.52 -0.95 3.11 0.00 0.00 -1.26 -4.79 105.19 99.78 2car n GLY 106 Ca 0.09 -0.12 -0.26 0.00 0.00 0.00 0.00 46.02 45.72 2car n GLY 106 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2car s PHE 107 N -1.99 1.75 0.30 1.61 0.08 0.16 -5.03 117.98 114.85 2car s PHE 107 Ca 0.27 -0.59 0.10 0.00 0.12 0.00 0.00 56.93 56.83 2car s PHE 107 Cb 0.13 -1.21 0.45 0.00 -0.57 0.00 0.00 43.02 41.82 2car s PHE 107 CO 0.21 -0.24 1.68 0.93 -0.10 0.00 0.00 175.22 177.70 2car h GLU 108 N 6.56 0.07 -6.27 0.44 3.07 -1.86 -3.42 114.58 113.18 2car h GLU 108 Ca -0.30 -0.04 -0.58 0.00 -0.50 0.00 0.00 59.36 57.94 2car h GLU 108 Cb 1.19 0.00 -0.09 0.00 -0.84 0.00 0.00 28.75 29.01 2car h GLU 108 CO 0.48 0.57 0.78 0.34 -1.40 0.00 0.00 179.01 179.78 2car s ASP 109 N -6.88 6.41 0.00 1.42 2.15 -1.26 -4.88 116.67 113.63 2car s ASP 109 Ca -0.03 -0.06 0.21 0.00 0.43 0.00 0.00 52.55 53.10 2car s ASP 109 Cb 0.13 -2.50 0.54 0.00 -0.30 0.00 0.00 42.92 40.79 2car s ASP 109 CO 0.76 -1.34 1.45 0.29 -0.17 0.00 0.00 175.17 176.16 2car n LYS 110 N 7.94 2.39 -1.88 4.34 4.76 -1.26 -4.28 118.16 130.17 2car n LYS 110 Ca 0.06 -2.14 -0.32 0.00 -2.87 0.00 0.00 58.31 53.04 2car n LYS 110 Cb 0.48 -1.48 0.02 0.00 -1.84 0.00 0.00 35.03 32.21 2car n LYS 110 CO 0.00 0.00 0.00 -1.54 -1.37 0.00 0.00 177.40 174.49 2car s SER 111 N -1.21 5.67 0.28 4.39 1.04 -1.26 -0.85 113.70 121.77 2car s SER 111 Ca 0.40 1.72 -0.21 0.00 0.48 0.00 0.00 55.95 58.35 2car s SER 111 Cb 0.22 -2.52 0.02 0.00 0.10 0.00 0.00 66.02 63.84 2car s SER 111 CO 0.29 -1.24 0.72 0.00 0.98 0.00 0.00 173.24 173.99 2car s ALA 112 N -2.69 -1.20 0.01 5.32 0.00 -0.33 -0.98 121.76 121.88 2car s ALA 112 Ca 0.61 -0.32 -0.03 0.00 0.00 0.00 0.00 51.96 52.22 2car s ALA 112 Cb -0.15 0.85 -0.01 0.00 0.00 0.00 0.00 23.12 23.81 2car s ALA 112 CO 0.44 -1.04 0.04 1.52 0.00 0.00 0.00 175.76 176.72 2car s TYR 113 N -3.91 0.13 0.00 0.00 -0.85 0.07 -0.45 117.35 112.36 2car s TYR 113 Ca 0.11 -0.29 -0.10 0.00 -0.52 0.00 0.00 57.07 56.28 2car s TYR 113 Cb -0.06 -0.11 -0.05 0.00 0.38 0.00 0.00 41.96 42.12 2car s TYR 113 CO 0.07 -0.20 0.32 0.00 -1.52 0.00 0.00 175.55 174.22 2car s ALA 114 N -1.21 3.78 -0.06 9.51 0.00 0.32 -1.07 121.76 133.04 2car s ALA 114 Ca -0.13 -0.44 0.00 0.00 0.00 0.00 0.00 51.96 51.40 2car s ALA 114 Cb -0.08 -2.19 0.02 0.00 0.00 0.00 0.00 23.12 20.88 2car s ALA 114 CO 0.00 0.58 -0.04 -1.17 0.00 0.00 0.00 175.76 175.13 2car s LEU 115 N -1.49 1.17 -0.07 0.00 2.96 -0.33 -0.88 118.68 120.04 2car s LEU 115 Ca 0.26 -0.14 0.04 0.00 -0.22 0.00 0.00 54.13 54.07 2car s LEU 115 Cb -0.14 -0.50 -0.02 0.00 0.50 0.00 0.00 46.19 46.03 2car s LEU 115 CO 0.14 -0.09 -0.18 0.00 -1.32 0.00 0.00 176.35 174.90 2car s THR 117 N -0.33 1.49 -0.03 0.00 2.01 0.14 -1.37 115.64 117.56 2car s THR 117 Ca 0.02 -0.67 -0.02 0.00 0.31 0.00 0.00 61.69 61.33 2car s THR 117 Cb -0.13 -1.34 -0.04 0.00 0.01 0.00 0.00 72.50 71.00 2car s THR 117 CO 0.02 0.44 0.12 -0.36 -0.69 0.00 0.00 174.62 174.15 2car s PHE 118 N 0.73 3.41 -0.03 4.92 0.08 0.12 -1.24 117.98 125.96 2car s PHE 118 Ca -0.12 0.31 0.03 0.00 0.12 0.00 0.00 56.93 57.27 2car s PHE 118 Cb -0.16 -1.80 0.00 0.00 -0.57 0.00 0.00 43.02 40.49 2car s PHE 118 CO 0.03 0.61 -0.13 0.00 -0.10 0.00 0.00 175.22 175.63 2car s ALA 119 N -1.18 1.15 -0.01 5.36 0.00 0.16 -1.43 121.76 125.82 2car s ALA 119 Ca 0.22 -0.48 0.05 0.00 0.00 0.00 0.00 51.96 51.75 2car s ALA 119 Cb -0.12 -0.41 -0.01 0.00 0.00 0.00 0.00 23.12 22.58 2car s ALA 119 CO 0.13 0.20 -0.18 -1.17 0.00 0.00 0.00 175.76 174.74 2car s LEU 120 N 0.14 2.05 0.01 0.00 2.96 0.32 -1.56 118.68 122.61 2car s LEU 120 Ca -0.04 -0.34 -0.08 0.00 -0.22 0.00 0.00 54.13 53.46 2car s LEU 120 Cb -0.10 -0.89 0.00 0.00 0.50 0.00 0.00 46.19 45.70 2car s LEU 120 CO 0.01 0.20 0.15 -0.55 -1.32 0.00 0.00 176.35 174.84 2car s SER 121 N -0.51 0.03 0.00 3.68 0.15 -0.79 -0.91 113.70 115.35 2car s SER 121 Ca 0.07 -0.25 0.28 0.00 0.70 0.00 0.00 55.95 56.75 2car s SER 121 Cb -0.07 0.22 1.11 0.00 -1.71 0.00 0.00 66.02 65.57 2car s SER 121 CO -0.00 -0.41 1.83 0.35 1.20 0.00 0.00 173.24 176.20 2car n THR 122 N 1.27 0.00 -0.63 6.45 -2.24 -1.26 -0.96 114.28 116.91 2car n THR 122 Ca -0.22 -0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.56 2car n THR 122 Cb 0.56 -0.32 0.00 0.00 -2.10 0.00 0.00 70.33 68.47 2car n THR 122 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2car n GLY 123 N 1.47 1.19 0.00 3.38 0.00 -1.24 -2.08 105.19 107.91 2car n GLY 123 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.10 2car n GLY 123 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2car n ASP 124 N 0.00 0.00 0.00 1.61 8.00 -1.26 -4.37 116.55 120.52 2car n ASP 124 Ca 0.00 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.50 2car n ASP 124 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.10 2car n ASP 124 CO 0.00 0.00 0.00 -0.81 -0.39 0.00 0.00 177.20 176.00 2car n PRO 125 N 0.53 0.00 0.00 -0.24 -0.04 -1.26 -4.94 135.00 129.05 2car n PRO 125 Ca 0.00 0.12 0.00 0.00 -0.04 0.00 0.00 63.50 63.58 2car n PRO 125 Cb 0.00 -0.79 0.00 0.00 -0.04 0.00 0.00 33.50 32.67 2car n PRO 125 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 2car n SER 126 N -0.40 0.00 -4.60 3.54 3.41 -1.26 -5.13 113.62 109.17 2car n SER 126 Ca 0.00 0.00 -0.39 0.00 -0.26 0.00 0.00 58.87 58.22 2car n SER 126 Cb 0.00 0.00 -0.09 0.00 -0.26 0.00 0.00 64.21 63.86 2car n SER 126 CO 0.00 0.00 0.00 -1.58 -0.16 0.00 0.00 175.04 173.30 2car s GLN 127 N -0.68 3.98 0.54 4.33 2.00 -1.26 -5.07 119.66 123.49 2car s GLN 127 Ca 0.00 -0.01 -0.19 0.00 -2.00 0.00 0.00 55.36 53.17 2car s GLN 127 Cb 0.00 -3.67 -0.06 0.00 0.80 0.00 0.00 33.01 30.08 2car s GLN 127 CO 0.00 -0.30 1.08 -1.25 -0.50 0.00 0.00 175.29 174.32 2car s PRO 128 N 2.06 3.46 0.39 1.67 0.04 -1.26 -4.87 135.00 136.50 2car s PRO 128 Ca 0.14 1.41 -0.27 0.00 0.04 0.00 0.00 61.00 62.32 2car s PRO 128 Cb -0.16 -2.04 -0.09 0.00 0.04 0.00 0.00 34.50 32.25 2car s PRO 128 CO 0.10 -0.72 1.38 0.08 0.04 0.00 0.00 177.00 177.88 2car s VAL 129 N -2.05 2.38 -0.08 -0.36 1.01 -1.26 -4.83 120.40 115.20 2car s VAL 129 Ca 0.68 0.36 0.03 0.00 0.00 0.00 0.00 61.98 63.05 2car s VAL 129 Cb -0.19 -3.22 -0.02 0.00 0.00 0.00 0.00 36.38 32.96 2car s VAL 129 CO 0.28 0.07 -0.18 -0.13 0.00 0.00 0.00 175.10 175.14 2car s ARG 130 N -2.16 2.83 0.02 2.72 1.81 -0.09 -4.95 118.95 119.14 2car s ARG 130 Ca 0.55 -0.77 0.02 0.00 -1.72 0.00 0.00 55.73 53.81 2car s ARG 130 Cb -0.42 -2.38 -0.04 0.00 -0.45 0.00 0.00 34.95 31.66 2car s ARG 130 CO 0.55 0.39 -0.01 -0.51 -0.68 0.00 0.00 175.30 175.04 2car s LEU 131 N -0.14 3.46 -0.10 2.53 1.43 -1.26 -0.52 118.68 124.08 2car s LEU 131 Ca -0.02 -0.06 -0.01 0.00 -1.03 0.00 0.00 54.13 53.00 2car s LEU 131 Cb -0.14 -2.04 0.03 0.00 0.03 0.00 0.00 46.19 44.08 2car s LEU 131 CO 0.04 0.25 -0.02 -0.36 0.23 0.00 0.00 176.35 176.49 2car s PHE 132 N -1.13 1.00 0.14 0.29 0.08 -0.52 -4.99 117.98 112.85 2car s PHE 132 Ca 0.21 -0.46 0.06 0.00 0.12 0.00 0.00 56.93 56.86 2car s PHE 132 Cb -0.12 -0.98 -0.04 0.00 -0.57 0.00 0.00 43.02 41.32 2car s PHE 132 CO 0.12 -0.43 -0.14 -0.98 -0.10 0.00 0.00 175.22 173.69 2car s ARG 133 N 1.87 1.07 -0.05 0.44 1.70 -1.26 -0.71 118.95 122.01 2car s ARG 133 Ca 0.04 -1.32 -0.04 0.00 -0.47 0.00 0.00 55.73 53.94 2car s ARG 133 Cb -0.13 -0.90 0.01 0.00 -0.57 0.00 0.00 34.95 33.36 2car s ARG 133 CO -0.07 0.16 0.12 0.20 -1.08 0.00 0.00 175.30 174.64 2car s GLY 134 N -2.67 -0.08 0.02 3.88 0.00 -0.47 -3.97 107.32 104.02 2car s GLY 134 Ca 0.12 0.38 0.02 0.00 0.00 0.00 0.00 44.72 45.23 2car s GLY 134 CO 0.03 0.37 -0.06 0.50 0.00 0.00 0.00 173.10 173.95 2car s ARG 135 N 0.20 0.42 -0.10 2.90 0.52 -1.26 -0.45 118.95 121.18 2car s ARG 135 Ca -0.01 -0.44 0.00 0.00 -0.52 0.00 0.00 55.73 54.76 2car s ARG 135 Cb -0.02 -0.29 0.02 0.00 0.52 0.00 0.00 34.95 35.18 2car s ARG 135 CO -0.01 0.07 -0.08 0.99 0.02 0.00 0.00 175.30 176.29 2car s THR 136 N -0.73 0.99 0.32 0.02 2.01 -0.06 -4.77 115.64 113.42 2car s THR 136 Ca -0.04 -0.29 -0.26 0.00 0.31 0.00 0.00 61.69 61.40 2car s THR 136 Cb -0.06 -1.00 -0.10 0.00 0.01 0.00 0.00 72.50 71.36 2car s THR 136 CO -0.00 0.35 0.97 -0.94 -0.69 0.00 0.00 174.62 174.31 2car s SER 137 N 1.51 7.30 0.00 3.53 1.04 -1.26 -0.52 113.70 125.31 2car s SER 137 Ca 0.01 1.90 0.00 0.00 0.48 0.00 0.00 55.95 58.34 2car s SER 137 Cb -0.13 -2.59 0.00 0.00 0.10 0.00 0.00 66.02 63.40 2car s SER 137 CO -0.06 -0.10 0.00 0.61 0.98 0.00 0.00 173.24 174.68 2car n GLY 138 N 0.68 1.83 2.99 7.32 0.00 0.41 -0.94 105.19 117.49 2car n GLY 138 Ca 0.02 -0.43 -0.09 0.00 0.00 0.00 0.00 46.02 45.51 2car n GLY 138 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2car s ARG 139 N 1.69 0.35 -0.13 1.61 0.52 -0.11 -1.18 118.95 121.70 2car s ARG 139 Ca 0.00 -0.67 -0.18 0.00 -0.52 0.00 0.00 55.73 54.37 2car s ARG 139 Cb 0.00 0.09 -0.04 0.00 0.52 0.00 0.00 34.95 35.52 2car s ARG 139 CO 0.00 -0.05 0.46 0.42 0.02 0.00 0.00 175.30 176.15 2car s ILE 140 N -1.64 5.20 0.15 1.52 -1.09 -0.03 -0.96 121.20 124.34 2car s ILE 140 Ca -0.14 0.90 0.04 0.00 -2.23 0.00 0.00 60.65 59.22 2car s ILE 140 Cb -0.09 -3.79 -0.04 0.00 -1.58 0.00 0.00 42.46 36.96 2car s ILE 140 CO -0.02 0.32 -0.09 0.68 -1.23 0.00 0.00 174.94 174.60 2car s VAL 141 N 0.72 1.09 0.31 2.92 -7.23 0.62 -4.92 120.40 113.92 2car s VAL 141 Ca 0.24 -2.04 -0.30 0.00 -1.81 0.00 0.00 61.98 58.07 2car s VAL 141 Cb -0.15 -1.87 -0.12 0.00 0.56 0.00 0.00 36.38 34.81 2car s VAL 141 CO 0.09 -0.73 1.52 0.00 -0.31 0.00 0.00 175.10 175.67 2car n ALA 142 N -0.19 2.18 -1.76 1.32 0.00 -1.26 -4.54 120.51 116.25 2car n ALA 142 Ca -0.10 0.37 -0.40 0.00 0.00 0.00 0.00 53.44 53.32 2car n ALA 142 Cb 0.61 -2.41 0.01 0.00 0.00 0.00 0.00 19.45 17.67 2car n ALA 142 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 2car s PRO 143 N -0.92 3.69 0.00 0.00 0.04 -1.26 -4.85 135.00 131.70 2car s PRO 143 Ca 0.62 2.33 0.01 0.00 0.04 0.00 0.00 61.00 64.00 2car s PRO 143 Cb -0.52 -2.63 -0.00 0.00 0.04 0.00 0.00 34.50 31.38 2car s PRO 143 CO 0.53 -0.78 -0.03 1.03 0.04 0.00 0.00 177.00 177.79 2car s ARG 144 N -2.46 0.21 0.00 4.56 0.52 0.28 -4.99 118.95 117.07 2car s ARG 144 Ca 0.61 -0.16 0.00 0.00 -0.52 0.00 0.00 55.73 55.66 2car s ARG 144 Cb -0.42 -0.17 0.00 0.00 0.52 0.00 0.00 34.95 34.89 2car s ARG 144 CO 0.53 0.04 0.00 0.41 0.02 0.00 0.00 175.30 176.31 2car n GLY 145 N 2.83 0.34 3.70 -3.53 0.00 -1.26 -4.21 105.19 103.07 2car n GLY 145 Ca -0.14 -2.06 -0.42 0.00 0.00 0.00 0.00 46.02 43.40 2car n GLY 145 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2car n GLN 147 N 4.62 0.69 0.11 0.00 1.13 -1.26 -3.27 117.38 119.39 2car n GLN 147 Ca 0.13 0.01 0.13 0.00 -1.94 0.00 0.00 57.00 55.33 2car n GLN 147 Cb 0.42 -1.50 0.41 0.00 0.11 0.00 0.00 30.24 29.68 2car n GLN 147 CO 0.00 0.00 0.00 -0.25 -1.44 0.00 0.00 177.06 175.37 2car n ASP 148 N -1.07 0.81 -2.96 1.08 8.00 -1.26 -4.34 116.55 116.81 2car n ASP 148 Ca 0.17 0.58 -0.34 0.00 0.71 0.00 0.00 54.79 55.91 2car n ASP 148 Cb 0.11 -0.80 -0.02 0.00 -0.02 0.00 0.00 41.12 40.39 2car n ASP 148 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 2car n PHE 149 N -2.26 2.16 -0.74 1.24 3.72 -1.20 -5.00 117.46 115.37 2car n PHE 149 Ca 0.05 -2.33 0.00 0.00 -0.05 0.00 0.00 57.45 55.13 2car n PHE 149 Cb 0.43 -1.50 0.00 0.00 -0.94 0.00 0.00 39.48 37.46 2car n PHE 149 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2car n GLY 150 N 0.96 3.39 0.33 1.37 0.00 -1.26 -1.61 105.19 108.37 2car n GLY 150 Ca 0.54 -0.13 0.14 0.00 0.00 0.00 0.00 46.02 46.56 2car n GLY 150 CO 0.00 0.00 0.00 -2.67 0.00 0.00 0.00 173.32 170.65 2car n TRP 151 N 14.00 0.00 -0.34 1.61 4.27 -1.26 -4.41 117.44 131.32 2car n TRP 151 Ca 0.00 0.00 0.16 0.00 -3.89 0.00 0.00 57.50 53.77 2car n TRP 151 Cb 0.00 -0.07 0.38 0.00 -1.36 0.00 0.00 31.31 30.26 2car n TRP 151 CO 0.00 0.00 0.00 -0.44 -2.29 0.00 0.00 177.69 174.96 2car h ASP 152 N 1.64 0.68 0.00 -0.67 5.19 -1.68 -1.28 116.42 120.30 2car h ASP 152 Ca 0.00 0.10 0.00 0.00 -0.62 0.00 0.00 57.03 56.51 2car h ASP 152 Cb 0.49 -0.02 0.00 0.00 0.18 0.00 0.00 39.33 39.98 2car h ASP 152 CO 0.00 0.21 0.02 -2.65 -3.12 0.00 0.00 179.24 173.70 2car n PRO 153 N -4.74 0.11 -0.00 3.56 -0.02 -1.26 -2.46 135.00 130.19 2car n PRO 153 Ca 0.24 0.61 0.08 0.00 -2.02 0.00 0.00 63.50 62.41 2car n PRO 153 Cb 0.66 -1.88 -0.11 0.00 -0.02 0.00 0.00 33.50 32.15 2car n PRO 153 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2car s PHE 155 N -2.78 3.13 -0.33 0.00 5.36 -1.03 -0.27 117.98 122.06 2car s PHE 155 Ca 0.04 -0.89 -0.09 0.00 -0.96 0.00 0.00 56.93 55.03 2car s PHE 155 Cb 0.13 -2.25 0.01 0.00 -0.34 0.00 0.00 43.02 40.57 2car s PHE 155 CO 0.72 -0.54 0.14 -1.14 -1.46 0.00 0.00 175.22 172.94 2car s GLN 156 N 1.52 3.05 0.31 10.12 0.74 -0.14 -0.48 119.66 134.78 2car s GLN 156 Ca 0.03 -0.91 -0.28 0.00 0.05 0.00 0.00 55.36 54.25 2car s GLN 156 Cb -0.17 -3.54 -0.09 0.00 1.10 0.00 0.00 33.01 30.31 2car s GLN 156 CO 0.02 -0.53 1.10 -1.25 -0.55 0.00 0.00 175.29 174.09 2car s PRO 157 N 1.54 4.52 0.27 1.67 0.04 -1.26 -0.93 135.00 140.85 2car s PRO 157 Ca 0.03 1.77 -0.29 0.00 0.04 0.00 0.00 61.00 62.54 2car s PRO 157 Cb -0.18 -3.05 -0.14 0.00 0.04 0.00 0.00 34.50 31.17 2car s PRO 157 CO 0.05 0.11 1.12 -0.25 0.04 0.00 0.00 177.00 178.07 2car n ASP 158 N 0.91 1.66 0.00 6.66 10.43 -0.12 -1.60 116.55 134.50 2car n ASP 158 Ca 0.00 1.17 0.00 0.00 2.57 0.00 0.00 54.79 58.53 2car n ASP 158 Cb 0.46 -1.32 0.00 0.00 1.84 0.00 0.00 41.12 42.10 2car n ASP 158 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 2car n GLY 159 N 1.44 2.18 3.33 0.44 0.00 -1.26 -5.00 105.19 106.32 2car n GLY 159 Ca 0.10 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.95 2car n GLY 159 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2car s TYR 160 N -2.16 1.59 -0.16 1.61 1.51 -0.63 -5.04 117.35 114.06 2car s TYR 160 Ca 0.00 -0.85 0.17 0.00 -1.01 0.00 0.00 57.07 55.38 2car s TYR 160 Cb 0.00 -0.90 0.38 0.00 -0.11 0.00 0.00 41.96 41.33 2car s TYR 160 CO 0.00 0.04 1.26 0.39 -1.11 0.00 0.00 175.55 176.13 2car n GLU 161 N -0.41 2.05 -4.33 -0.62 -0.58 -1.26 -4.74 120.64 110.74 2car n GLU 161 Ca -0.06 -2.64 -0.25 0.00 -0.42 0.00 0.00 57.16 53.78 2car n GLU 161 Cb 0.63 -1.62 -0.12 0.00 -0.57 0.00 0.00 31.44 29.76 2car n GLU 161 CO 0.00 0.00 0.00 -0.65 -0.48 0.00 0.00 177.13 176.00 2car s GLN 162 N -2.75 1.25 0.69 3.49 -0.21 -1.26 -5.13 119.66 115.73 2car s GLN 162 Ca 0.35 -1.27 -0.11 0.00 0.02 0.00 0.00 55.36 54.35 2car s GLN 162 Cb 0.29 -1.57 0.00 0.00 1.00 0.00 0.00 33.01 32.74 2car s GLN 162 CO 0.06 0.36 1.06 0.95 -2.12 0.00 0.00 175.29 175.60 2car s THR 163 N -1.26 3.98 0.33 -0.19 -4.23 -1.26 -4.12 115.64 108.89 2car s THR 163 Ca 0.11 0.64 0.07 0.00 -1.18 0.00 0.00 61.69 61.34 2car s THR 163 Cb -0.09 -3.51 0.31 0.00 1.34 0.00 0.00 72.50 70.55 2car s THR 163 CO 0.05 -0.84 1.81 1.88 -0.54 0.00 0.00 174.62 176.98 2car h TYR 164 N -0.64 0.96 -0.46 3.99 0.05 -0.75 -1.09 116.97 119.02 2car h TYR 164 Ca -0.45 0.03 -0.10 0.00 0.05 0.00 0.00 58.73 58.26 2car h TYR 164 Cb 1.22 -0.30 -0.02 0.00 1.01 0.00 0.00 36.73 38.65 2car h TYR 164 CO 0.58 0.27 -0.11 0.00 -1.05 0.00 0.00 178.16 177.85 2car h ALA 165 N 1.61 0.93 -0.11 3.88 0.00 -1.75 -3.15 119.26 120.68 2car h ALA 165 Ca 0.53 -0.33 -0.16 0.00 0.00 0.00 0.00 54.91 54.95 2car h ALA 165 Cb 0.85 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.46 2car h ALA 165 CO -0.30 0.62 -0.62 0.93 0.00 0.00 0.00 179.25 179.88 2car h GLU 166 N 0.76 0.38 -7.00 0.00 5.08 -1.53 -3.40 114.58 108.88 2car h GLU 166 Ca 0.13 -0.27 -0.52 0.00 -1.00 0.00 0.00 59.36 57.70 2car h GLU 166 Cb 0.61 0.04 0.08 0.00 0.50 0.00 0.00 28.75 29.98 2car h GLU 166 CO 0.04 0.88 0.53 -1.64 -1.00 0.00 0.00 179.01 177.82 2car s MET 167 N -3.80 3.71 0.56 2.33 -1.94 -0.49 -4.96 119.30 114.72 2car s MET 167 Ca -0.06 1.91 -0.18 0.00 -1.71 0.00 0.00 55.69 55.65 2car s MET 167 Cb 0.11 -2.46 -0.05 0.00 2.01 0.00 0.00 34.83 34.45 2car s MET 167 CO 0.82 -0.63 1.11 -1.25 -0.01 0.00 0.00 175.02 175.07 2car s PRO 168 N -2.63 3.28 0.29 2.03 0.04 -1.26 -4.76 135.00 132.00 2car s PRO 168 Ca 0.63 1.52 -0.02 0.00 0.04 0.00 0.00 61.00 63.17 2car s PRO 168 Cb -0.32 -2.00 0.41 0.00 0.04 0.00 0.00 34.50 32.63 2car s PRO 168 CO 0.39 -0.89 1.94 -0.22 0.04 0.00 0.00 177.00 178.26 2car h LYS 169 N 0.96 1.08 -0.08 4.56 3.64 -1.94 -0.62 116.57 124.16 2car h LYS 169 Ca -0.49 -0.09 -0.07 0.00 -1.27 0.00 0.00 60.65 58.73 2car h LYS 169 Cb 1.25 -0.23 -0.01 0.00 -0.41 0.00 0.00 32.23 32.83 2car h LYS 169 CO 0.57 0.74 -0.26 0.00 -2.27 0.00 0.00 179.45 178.23 2car h ALA 170 N 1.44 1.42 0.04 5.00 0.00 -1.99 0.68 119.26 125.85 2car h ALA 170 Ca 0.29 -0.28 -0.26 0.00 0.00 0.00 0.00 54.91 54.66 2car h ALA 170 Cb -0.06 -0.07 0.01 0.00 0.00 0.00 0.00 17.79 17.67 2car h ALA 170 CO -0.06 0.42 -1.07 1.49 0.00 0.00 0.00 179.25 180.03 2car h GLU 171 N 0.13 0.54 -0.86 0.00 4.57 -1.52 -3.08 114.58 114.35 2car h GLU 171 Ca 0.02 -0.63 0.01 0.00 -1.18 0.00 0.00 59.36 57.58 2car h GLU 171 Cb 0.54 0.19 -0.04 0.00 -0.16 0.00 0.00 28.75 29.27 2car h GLU 171 CO 0.04 1.24 0.57 -0.22 -1.18 0.00 0.00 179.01 179.46 2car h LYS 172 N 0.28 1.13 -0.76 1.92 3.64 -0.72 -2.34 116.57 119.71 2car h LYS 172 Ca -0.12 -0.07 0.05 0.00 -1.27 0.00 0.00 60.65 59.24 2car h LYS 172 Cb 1.72 -0.26 -0.05 0.00 -0.41 0.00 0.00 32.23 33.24 2car h LYS 172 CO 0.20 0.75 0.50 -0.91 -2.27 0.00 0.00 179.45 177.71 2car h ASN 173 N 1.17 0.75 0.54 4.20 2.35 -0.84 -0.21 115.58 123.53 2car h ASN 173 Ca 0.32 -0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 56.06 2car h ASN 173 Cb -0.14 -0.16 -0.00 0.00 0.05 0.00 0.00 38.32 38.07 2car h ASN 173 CO -0.07 0.49 -0.01 0.00 -1.65 0.00 0.00 177.43 176.20 2car h ALA 174 N 1.58 1.01 0.00 -0.83 0.00 -1.33 -2.88 119.26 116.81 2car h ALA 174 Ca 0.32 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.22 2car h ALA 174 Cb 0.17 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.96 2car h ALA 174 CO -0.10 0.01 0.00 1.33 0.00 0.00 0.00 179.25 180.49 2car n VAL 175 N -3.12 0.87 -2.20 0.00 0.24 -0.64 -5.07 118.33 108.41 2car n VAL 175 Ca -0.01 -0.88 -0.41 0.00 -2.04 0.00 0.00 64.34 61.01 2car n VAL 175 Cb 0.20 0.57 -0.03 0.00 -1.47 0.00 0.00 33.84 33.11 2car n VAL 175 CO 0.00 0.00 0.00 -0.55 -2.14 0.00 0.00 176.83 174.14 2car s SER 176 N -0.87 6.90 0.29 -1.34 0.15 -0.18 -4.75 113.70 113.89 2car s SER 176 Ca 0.00 2.58 0.02 0.00 0.70 0.00 0.00 55.95 59.25 2car s SER 176 Cb 0.00 -2.64 0.45 0.00 -1.71 0.00 0.00 66.02 62.12 2car s SER 176 CO 0.00 -0.44 1.77 1.12 1.20 0.00 0.00 173.24 176.89 2car h HIS 177 N 3.56 0.59 -0.13 3.44 2.07 -1.87 -1.35 115.15 121.46 2car h HIS 177 Ca -0.48 -0.10 -0.14 0.00 -2.85 0.00 0.00 60.37 56.80 2car h HIS 177 Cb 1.22 -0.16 0.01 0.00 2.57 0.00 0.00 27.41 31.05 2car h HIS 177 CO 0.57 0.67 -0.47 -0.09 -3.07 0.00 0.00 177.93 175.53 2car h ARG 178 N 0.50 0.55 -0.92 5.12 2.43 -1.91 -1.77 114.38 118.37 2car h ARG 178 Ca 0.09 -0.42 0.06 0.00 -0.81 0.00 0.00 59.98 58.90 2car h ARG 178 Cb 0.54 0.08 -0.06 0.00 -0.42 0.00 0.00 29.97 30.11 2car h ARG 178 CO 0.03 1.04 0.59 0.74 -1.51 0.00 0.00 179.97 180.86 2car h PHE 179 N 0.17 1.09 -0.54 2.20 -1.00 -1.82 -1.21 116.94 115.83 2car h PHE 179 Ca -0.02 0.03 -0.11 0.00 2.81 0.00 0.00 57.97 60.67 2car h PHE 179 Cb 1.10 -0.35 -0.02 0.00 3.61 0.00 0.00 35.95 40.29 2car h PHE 179 CO 0.11 0.56 -0.10 0.00 -1.61 0.00 0.00 178.31 177.26 2car h ARG 180 N 1.07 1.02 -0.45 1.51 3.08 -1.08 -1.29 114.38 118.24 2car h ARG 180 Ca 0.40 -0.37 -0.00 0.00 0.07 0.00 0.00 59.98 60.07 2car h ARG 180 Cb 0.16 -0.07 -0.02 0.00 0.08 0.00 0.00 29.97 30.12 2car h ARG 180 CO -0.17 1.06 0.26 0.00 -1.07 0.00 0.00 179.97 180.05 2car h ALA 181 N 0.96 0.57 -0.05 0.04 0.00 -0.99 -2.73 119.26 117.07 2car h ALA 181 Ca 0.14 -0.07 -0.08 0.00 0.00 0.00 0.00 54.91 54.90 2car h ALA 181 Cb 0.67 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 2car h ALA 181 CO 0.05 0.07 -0.35 -0.07 0.00 0.00 0.00 179.25 178.95 2car h LEU 182 N 0.59 0.09 -0.76 0.00 3.38 -0.97 -2.27 115.31 115.36 2car h LEU 182 Ca 0.16 -0.03 -0.05 0.00 0.09 0.00 0.00 57.88 58.05 2car h LEU 182 Cb 0.01 -0.03 -0.03 0.00 0.09 0.00 0.00 40.66 40.70 2car h LEU 182 CO -0.03 0.44 0.28 0.25 0.09 0.00 0.00 178.44 179.47 2car h LEU 183 N 0.08 1.08 -0.63 1.67 5.85 -0.97 0.34 115.31 122.73 2car h LEU 183 Ca 0.01 -0.19 0.02 0.00 0.84 0.00 0.00 57.88 58.56 2car h LEU 183 Cb 0.65 -0.28 -0.04 0.00 0.37 0.00 0.00 40.66 41.37 2car h LEU 183 CO 0.05 0.98 0.40 -0.33 -0.34 0.00 0.00 178.44 179.19 2car h GLU 184 N 1.12 0.78 -0.33 1.25 4.39 -1.13 0.24 114.58 120.90 2car h GLU 184 Ca 0.25 -0.05 0.01 0.00 0.34 0.00 0.00 59.36 59.92 2car h GLU 184 Cb 0.25 -0.18 -0.02 0.00 -0.10 0.00 0.00 28.75 28.71 2car h GLU 184 CO -0.02 0.52 0.19 1.25 -1.16 0.00 0.00 179.01 179.80 2car h LEU 185 N 0.80 0.32 -0.24 1.33 5.85 -1.16 -1.84 115.31 120.37 2car h LEU 185 Ca 0.24 0.00 0.02 0.00 0.84 0.00 0.00 57.88 58.98 2car h LEU 185 Cb -0.03 -0.07 -0.02 0.00 0.37 0.00 0.00 40.66 40.91 2car h LEU 185 CO -0.08 0.23 0.10 -0.61 -0.34 0.00 0.00 178.44 177.74 2car h GLN 186 N 0.40 0.22 -0.23 1.25 4.15 -0.68 -2.71 115.11 117.50 2car h GLN 186 Ca 0.13 -0.01 -0.04 0.00 0.77 0.00 0.00 58.65 59.49 2car h GLN 186 Cb -0.01 -0.05 -0.01 0.00 0.21 0.00 0.00 27.48 27.62 2car h GLN 186 CO -0.06 0.14 -0.04 1.49 -1.93 0.00 0.00 178.83 178.44 2car h GLU 187 N 0.22 0.36 -0.86 1.69 4.22 -0.80 -1.78 114.58 117.63 2car h GLU 187 Ca 0.10 -0.07 0.06 0.00 0.08 0.00 0.00 59.36 59.53 2car h GLU 187 Cb 0.05 -0.06 -0.06 0.00 0.50 0.00 0.00 28.75 29.19 2car h GLU 187 CO -0.09 0.42 0.54 -0.92 -2.18 0.00 0.00 179.01 176.78 2car h TYR 188 N 0.34 1.00 0.00 0.92 3.20 -1.00 -2.58 116.97 118.86 2car h TYR 188 Ca 0.08 0.03 -0.17 0.00 3.14 0.00 0.00 58.73 61.80 2car h TYR 188 Cb 0.30 -0.32 -0.03 0.00 1.54 0.00 0.00 36.73 38.22 2car h TYR 188 CO 0.01 0.52 -0.95 0.74 -1.64 0.00 0.00 178.16 176.84 2car h PHE 189 N 0.99 0.00 -0.74 -3.82 0.04 -1.42 -3.47 116.94 108.53 2car h PHE 189 Ca 0.37 0.00 0.08 0.00 2.80 0.00 0.00 57.97 61.22 2car h PHE 189 Cb 0.14 0.00 -0.03 0.00 2.20 0.00 0.00 35.95 38.26 2car h PHE 189 CO -0.03 0.72 -0.20 0.41 -0.60 0.00 0.00 178.31 178.62 2car n GLY 190 N 1.33 -2.09 2.13 -1.45 0.00 -0.71 -4.73 105.19 99.68 2car n GLY 190 Ca -0.03 -1.41 -0.25 0.00 0.00 0.00 0.00 46.02 44.33 2car n GLY 190 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2car n SER 191 N -2.89 4.94 -0.15 1.61 3.41 -1.26 -4.63 113.62 114.65 2car n SER 191 Ca -0.01 -3.74 0.02 0.00 -0.26 0.00 0.00 58.87 54.88 2car n SER 191 Cb 0.15 -0.38 0.01 0.00 -0.26 0.00 0.00 64.21 63.73 2car n SER 191 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2car n LEU 192 N -0.66 1.19 -0.08 1.04 4.77 -1.26 -4.69 117.00 117.30 2car n LEU 192 Ca 0.43 -0.93 0.05 0.00 -0.03 0.00 0.00 56.01 55.54 2car n LEU 192 Cb 0.89 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.94 2car n LEU 192 CO 0.39 0.26 0.05 0.00 -1.33 0.00 0.00 177.39 176.76 2car n ALA 193 N 0.05 3.29 -1.80 -1.18 0.00 -1.26 -5.22 120.51 114.39 2car n ALA 193 Ca 0.02 -0.36 0.00 0.00 0.00 0.00 0.00 53.44 53.10 2car n ALA 193 Cb 0.10 -0.40 0.00 0.00 0.00 0.00 0.00 19.45 19.15 2car n ALA 193 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50