#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ai7 h ALA 2 N 0.00 -1.04 -0.54 -1.46 0.00 -1.91 -1.22 119.26 113.10 2ai7 h ALA 2 Ca 0.00 -0.13 0.05 0.00 0.00 0.00 0.00 54.91 54.83 2ai7 h ALA 2 Cb 0.00 0.86 -0.03 0.00 0.00 0.00 0.00 17.79 18.62 2ai7 h ALA 2 CO 0.00 -1.14 0.36 0.97 0.00 0.00 0.00 179.25 179.44 2ai7 h ILE 3 N -0.81 1.01 0.37 0.00 2.10 -1.90 -1.02 117.51 117.26 2ai7 h ILE 3 Ca -0.02 -0.19 -0.02 0.00 1.08 0.00 0.00 64.86 65.72 2ai7 h ILE 3 Cb 0.78 0.43 0.00 0.00 -1.09 0.00 0.00 36.82 36.94 2ai7 h ILE 3 CO -0.23 0.10 -0.18 -0.08 -1.08 0.00 0.00 178.15 176.68 2ai7 h GLU 4 N 0.54 -0.48 -0.31 2.19 4.57 -1.80 -1.15 114.58 118.14 2ai7 h GLU 4 Ca 0.23 0.03 -0.17 0.00 -1.18 0.00 0.00 59.36 58.27 2ai7 h GLU 4 Cb 0.22 0.11 -0.00 0.00 -0.16 0.00 0.00 28.75 28.91 2ai7 h GLU 4 CO -0.06 -0.30 -0.47 0.07 -1.18 0.00 0.00 179.01 177.06 2ai7 h ARG 5 N -0.53 0.84 -0.28 1.92 0.11 -0.89 -3.14 114.38 112.40 2ai7 h ARG 5 Ca -0.05 -0.48 -0.07 0.00 0.10 0.00 0.00 59.98 59.48 2ai7 h ARG 5 Cb 0.40 0.04 -0.02 0.00 1.11 0.00 0.00 29.97 31.50 2ai7 h ARG 5 CO 0.08 1.12 -0.12 0.82 0.10 0.00 0.00 179.97 181.98 2ai7 h ILE 6 N 0.66 1.22 -0.00 0.08 2.04 -1.19 -2.71 117.51 117.61 2ai7 h ILE 6 Ca 0.03 -0.98 0.00 0.00 1.00 0.00 0.00 64.86 64.92 2ai7 h ILE 6 Cb 1.06 1.14 0.00 0.00 -0.74 0.00 0.00 36.82 38.28 2ai7 h ILE 6 CO 0.11 0.32 -0.00 -1.20 0.00 0.00 0.00 178.15 177.37 2ai7 n SER 7 N -4.22 0.03 -4.76 1.72 7.64 -0.44 -4.69 113.62 108.90 2ai7 n SER 7 Ca 0.01 -0.61 -0.41 0.00 1.01 0.00 0.00 58.87 58.86 2ai7 n SER 7 Cb 0.31 -0.13 -0.01 0.00 -1.01 0.00 0.00 64.21 63.37 2ai7 n SER 7 CO 0.00 0.00 0.00 -0.54 -3.01 0.00 0.00 175.04 171.49 2ai7 s LYS 8 N -2.27 4.17 0.30 1.43 1.02 -1.02 -4.87 119.74 118.50 2ai7 s LYS 8 Ca 0.39 2.48 0.05 0.00 0.02 0.00 0.00 55.97 58.91 2ai7 s LYS 8 Cb 0.21 -3.03 0.75 0.00 -0.52 0.00 0.00 37.83 35.24 2ai7 s LYS 8 CO 0.41 -0.50 1.72 0.00 -0.92 0.00 0.00 175.35 176.06 2ai7 h ALA 9 N 4.05 1.53 0.00 5.17 0.00 -1.90 -0.91 119.26 127.19 2ai7 h ALA 9 Ca -0.48 0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.56 2ai7 h ALA 9 Cb 1.23 0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.09 2ai7 h ALA 9 CO 0.72 -0.27 0.00 0.00 0.00 0.00 0.00 179.25 179.70 2ai7 h ALA 10 N 1.69 1.00 -2.64 0.00 0.00 -1.95 -3.46 119.26 113.91 2ai7 h ALA 10 Ca 0.57 0.00 -0.53 0.00 0.00 0.00 0.00 54.91 54.96 2ai7 h ALA 10 Cb 1.04 0.00 0.03 0.00 0.00 0.00 0.00 17.79 18.87 2ai7 h ALA 10 CO -0.48 0.00 0.70 -1.58 0.00 0.00 0.00 179.25 177.89 2ai7 s HIS 11 N -3.32 3.22 -0.17 0.00 5.04 -0.35 -5.02 115.29 114.69 2ai7 s HIS 11 Ca 0.06 1.08 -0.01 0.00 -1.54 0.00 0.00 55.06 54.65 2ai7 s HIS 11 Cb 0.07 -3.67 -0.00 0.00 0.04 0.00 0.00 32.58 29.02 2ai7 s HIS 11 CO 0.61 -2.21 -0.13 -0.51 -2.34 0.00 0.00 174.74 170.15 2ai7 s LEU 12 N 0.34 2.53 0.24 8.88 1.43 -1.26 -4.91 118.68 125.93 2ai7 s LEU 12 Ca 0.60 -0.47 -0.30 0.00 -1.03 0.00 0.00 54.13 52.94 2ai7 s LEU 12 Cb -0.38 -1.59 -0.09 0.00 0.03 0.00 0.00 46.19 44.16 2ai7 s LEU 12 CO 0.36 0.05 1.24 -0.63 0.23 0.00 0.00 176.35 177.60 2ai7 s ILE 13 N 1.00 3.23 0.35 -0.59 1.01 -1.26 -5.02 121.20 119.91 2ai7 s ILE 13 Ca -0.02 1.11 0.05 0.00 0.00 0.00 0.00 60.65 61.79 2ai7 s ILE 13 Cb -0.15 -3.71 -0.02 0.00 0.01 0.00 0.00 42.46 38.60 2ai7 s ILE 13 CO -0.03 0.21 0.36 1.51 0.00 0.00 0.00 174.94 176.99 2ai7 s ASP 14 N -0.15 1.54 0.61 3.58 1.47 -1.26 -4.86 116.67 117.59 2ai7 s ASP 14 Ca 0.51 -1.71 0.29 0.00 1.18 0.00 0.00 52.55 52.83 2ai7 s ASP 14 Cb -0.35 0.61 1.58 0.00 -0.34 0.00 0.00 42.92 44.42 2ai7 s ASP 14 CO 0.42 -1.16 1.96 0.24 0.68 0.00 0.00 175.17 177.30 2ai7 h MET 15 N 2.10 0.00 0.00 2.11 2.86 -1.84 0.10 114.93 120.26 2ai7 h MET 15 Ca -0.26 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.38 2ai7 h MET 15 Cb 1.23 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.89 2ai7 h MET 15 CO 0.36 0.00 0.00 0.00 1.06 0.00 0.00 176.91 178.33 2ai7 n ASP 17 N -1.96 0.64 -4.59 0.00 10.43 0.36 -4.86 116.55 116.57 2ai7 n ASP 17 Ca 0.03 -0.27 -0.40 0.00 2.57 0.00 0.00 54.79 56.72 2ai7 n ASP 17 Cb 0.25 0.63 -0.08 0.00 1.84 0.00 0.00 41.12 43.76 2ai7 n ASP 17 CO 0.00 0.00 0.00 -0.63 -1.07 0.00 0.00 177.20 175.50 2ai7 s ILE 18 N -3.13 5.10 0.64 0.53 1.01 -0.93 -4.31 121.20 120.12 2ai7 s ILE 18 Ca 0.06 0.53 -0.12 0.00 0.00 0.00 0.00 60.65 61.13 2ai7 s ILE 18 Cb 0.15 -3.82 -0.02 0.00 0.01 0.00 0.00 42.46 38.78 2ai7 s ILE 18 CO 0.78 0.01 1.04 0.27 0.00 0.00 0.00 174.94 177.04 2ai7 s ILE 19 N 2.22 4.34 0.53 2.92 -4.36 -0.28 -4.99 121.20 121.58 2ai7 s ILE 19 Ca 0.17 0.81 0.00 0.00 -0.26 0.00 0.00 60.65 61.38 2ai7 s ILE 19 Cb -0.16 -3.62 0.00 0.00 1.25 0.00 0.00 42.46 39.93 2ai7 s ILE 19 CO 0.11 -0.94 0.03 -0.13 0.24 0.00 0.00 174.94 174.24 2ai7 s ARG 20 N -4.96 2.23 0.33 0.37 1.81 -1.26 -4.42 118.95 113.05 2ai7 s ARG 20 Ca 0.57 -2.43 -0.27 0.00 -1.72 0.00 0.00 55.73 51.89 2ai7 s ARG 20 Cb -0.13 -1.55 -0.13 0.00 -0.45 0.00 0.00 34.95 32.69 2ai7 s ARG 20 CO 0.52 -0.43 0.97 0.39 -0.68 0.00 0.00 175.30 176.07 2ai7 n GLU 21 N -1.35 1.29 0.00 3.54 1.02 -0.37 -2.35 120.64 122.42 2ai7 n GLU 21 Ca -0.20 0.46 0.00 0.00 -0.02 0.00 0.00 57.16 57.39 2ai7 n GLU 21 Cb 0.67 -1.86 0.00 0.00 -0.02 0.00 0.00 31.44 30.22 2ai7 n GLU 21 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2ai7 n GLY 22 N 1.25 2.19 3.63 0.62 0.00 -1.26 -5.04 105.19 106.59 2ai7 n GLY 22 Ca 0.10 -0.42 -0.43 0.00 0.00 0.00 0.00 46.02 45.27 2ai7 n GLY 22 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2ai7 s ASN 23 N -0.05 6.70 0.50 1.61 3.84 -0.99 -4.89 114.94 121.66 2ai7 s ASN 23 Ca 0.00 1.29 0.33 0.00 0.21 0.00 0.00 52.86 54.69 2ai7 s ASN 23 Cb 0.00 -2.54 1.46 0.00 -0.55 0.00 0.00 41.25 39.62 2ai7 s ASN 23 CO 0.00 -1.04 1.75 -0.65 -2.79 0.00 0.00 177.10 174.37 2ai7 h PRO 24 N 9.18 0.09 -0.96 0.43 0.11 -1.96 -2.14 132.00 136.76 2ai7 h PRO 24 Ca -0.26 -0.01 0.18 0.00 0.11 0.00 0.00 66.00 66.02 2ai7 h PRO 24 Cb 1.10 -0.02 -0.09 0.00 0.11 0.00 0.00 31.00 32.10 2ai7 h PRO 24 CO 1.02 0.06 0.61 0.77 -0.21 0.00 0.00 178.00 180.25 2ai7 h SER 25 N 0.10 0.64 0.72 -2.05 0.02 -1.94 0.09 113.55 111.13 2ai7 h SER 25 Ca 0.64 0.06 0.00 0.00 -0.84 0.00 0.00 61.79 61.65 2ai7 h SER 25 Cb 2.29 -0.05 0.00 0.00 0.14 0.00 0.00 62.40 64.77 2ai7 h SER 25 CO -0.11 0.26 0.00 -0.07 -1.14 0.00 0.00 176.83 175.77 2ai7 h LEU 26 N 0.64 0.00 -2.90 5.07 3.38 -1.67 -2.50 115.31 117.33 2ai7 h LEU 26 Ca 0.52 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.49 2ai7 h LEU 26 Cb 0.95 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.70 2ai7 h LEU 26 CO -0.27 0.00 0.00 0.54 0.09 0.00 0.00 178.44 178.80 2ai7 n ARG 27 N -2.45 2.88 -3.97 1.13 3.00 -0.01 -4.21 116.66 113.04 2ai7 n ARG 27 Ca 0.01 -2.18 -0.32 0.00 -0.01 0.00 0.00 57.85 55.35 2ai7 n ARG 27 Cb 0.23 -1.35 -0.05 0.00 0.00 0.00 0.00 32.46 31.29 2ai7 n ARG 27 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.63 178.62 2ai7 s THR 28 N -1.14 5.15 -0.24 0.55 2.01 -0.94 -4.68 115.64 116.34 2ai7 s THR 28 Ca 0.27 -0.34 -0.27 0.00 0.31 0.00 0.00 61.69 61.67 2ai7 s THR 28 Cb 0.15 -3.42 0.00 0.00 0.01 0.00 0.00 72.50 69.24 2ai7 s THR 28 CO 0.17 0.27 0.94 -0.69 -0.69 0.00 0.00 174.62 174.63 2ai7 s VAL 29 N -1.34 4.74 0.47 3.82 1.01 -1.26 -3.40 120.40 124.44 2ai7 s VAL 29 Ca 0.28 1.78 -0.23 0.00 0.00 0.00 0.00 61.98 63.81 2ai7 s VAL 29 Cb -0.12 -4.23 -0.07 0.00 0.00 0.00 0.00 36.38 31.96 2ai7 s VAL 29 CO 0.20 -0.16 1.28 0.00 0.00 0.00 0.00 175.10 176.43 2ai7 s ALA 30 N 3.06 3.01 0.19 5.51 0.00 -0.45 -5.00 121.76 128.08 2ai7 s ALA 30 Ca 0.40 1.18 -0.28 0.00 0.00 0.00 0.00 51.96 53.26 2ai7 s ALA 30 Cb -0.15 -3.49 -0.08 0.00 0.00 0.00 0.00 23.12 19.40 2ai7 s ALA 30 CO 0.07 -0.98 0.87 -2.00 0.00 0.00 0.00 175.76 173.72 2ai7 s GLU 31 N -2.64 4.72 0.66 0.00 2.12 -0.73 -4.64 118.70 118.19 2ai7 s GLU 31 Ca 0.64 1.34 -0.17 0.00 0.36 0.00 0.00 54.97 57.15 2ai7 s GLU 31 Cb -0.36 -3.29 -0.00 0.00 0.26 0.00 0.00 34.13 30.74 2ai7 s GLU 31 CO 0.44 0.50 1.19 -1.21 -0.54 0.00 0.00 175.26 175.64 2ai7 s GLU 32 N -1.00 2.62 0.30 4.30 2.02 -1.26 -1.69 118.70 123.99 2ai7 s GLU 32 Ca 0.39 1.72 -0.06 0.00 0.02 0.00 0.00 54.97 57.04 2ai7 s GLU 32 Cb -0.24 -1.90 -0.05 0.00 0.10 0.00 0.00 34.13 32.04 2ai7 s GLU 32 CO 0.29 -1.46 0.58 0.14 0.02 0.00 0.00 175.26 174.83 2ai7 s VAL 33 N -1.88 4.99 0.17 2.63 -7.23 -1.26 -4.83 120.40 112.98 2ai7 s VAL 33 Ca 0.74 0.16 0.05 0.00 -1.81 0.00 0.00 61.98 61.13 2ai7 s VAL 33 Cb -0.28 -3.72 -0.04 0.00 0.56 0.00 0.00 36.38 32.90 2ai7 s VAL 33 CO 0.39 -0.32 0.11 0.42 -0.31 0.00 0.00 175.10 175.39 2ai7 s THR 34 N -2.10 4.35 -0.00 5.32 -4.23 -1.26 -4.96 115.64 112.77 2ai7 s THR 34 Ca 0.45 -1.14 0.04 0.00 -1.18 0.00 0.00 61.69 59.86 2ai7 s THR 34 Cb -0.11 -3.22 -0.03 0.00 1.34 0.00 0.00 72.50 70.48 2ai7 s THR 34 CO 0.29 -0.11 -0.12 -0.36 -0.54 0.00 0.00 174.62 173.78 2ai7 s PHE 35 N -1.75 2.73 0.62 3.99 0.40 -1.26 -3.53 117.98 119.18 2ai7 s PHE 35 Ca 0.30 -0.14 -0.17 0.00 -0.60 0.00 0.00 56.93 56.32 2ai7 s PHE 35 Cb -0.10 -1.57 -0.02 0.00 0.51 0.00 0.00 43.02 41.84 2ai7 s PHE 35 CO 0.23 0.28 1.16 -1.25 0.70 0.00 0.00 175.22 176.33 2ai7 s PRO 36 N -1.20 2.87 0.58 0.24 0.04 -1.26 -5.15 135.00 131.13 2ai7 s PRO 36 Ca 0.14 1.64 -0.16 0.00 0.04 0.00 0.00 61.00 62.66 2ai7 s PRO 36 Cb -0.11 -1.94 -0.04 0.00 0.04 0.00 0.00 34.50 32.46 2ai7 s PRO 36 CO 0.04 -1.24 1.07 -0.51 0.04 0.00 0.00 177.00 176.40 2ai7 s LEU 37 N -4.42 3.55 0.71 -3.56 1.43 -1.23 -5.04 118.68 110.12 2ai7 s LEU 37 Ca 0.73 1.88 -0.11 0.00 -1.03 0.00 0.00 54.13 55.59 2ai7 s LEU 37 Cb -0.26 -4.54 0.02 0.00 0.03 0.00 0.00 46.19 41.44 2ai7 s LEU 37 CO 0.36 -1.17 1.10 -0.94 0.23 0.00 0.00 176.35 175.92 2ai7 s SER 38 N -2.58 5.40 0.29 2.29 1.04 -1.26 -4.93 113.70 113.95 2ai7 s SER 38 Ca 0.65 1.15 -0.02 0.00 0.48 0.00 0.00 55.95 58.21 2ai7 s SER 38 Cb -0.17 -1.95 0.43 0.00 0.10 0.00 0.00 66.02 64.43 2ai7 s SER 38 CO 0.34 -1.37 1.94 0.44 0.98 0.00 0.00 173.24 175.58 2ai7 h ASP 39 N -0.68 0.93 -0.31 7.02 3.32 -2.00 -2.30 116.42 122.40 2ai7 h ASP 39 Ca -0.45 -0.05 -0.04 0.00 0.02 0.00 0.00 57.03 56.51 2ai7 h ASP 39 Cb 1.25 -0.23 -0.02 0.00 0.22 0.00 0.00 39.33 40.55 2ai7 h ASP 39 CO 0.63 0.71 0.06 1.56 -1.72 0.00 0.00 179.24 180.48 2ai7 h GLN 40 N 1.07 0.61 -0.19 3.56 4.20 -1.97 -0.95 115.11 121.44 2ai7 h GLN 40 Ca 0.28 -0.12 -0.12 0.00 0.06 0.00 0.00 58.65 58.76 2ai7 h GLN 40 Cb -0.06 -0.09 -0.01 0.00 0.30 0.00 0.00 27.48 27.61 2ai7 h GLN 40 CO -0.05 0.58 -0.39 0.93 -0.67 0.00 0.00 178.83 179.23 2ai7 h GLU 41 N 0.59 0.42 -0.07 1.46 5.08 -1.79 -0.19 114.58 120.08 2ai7 h GLU 41 Ca 0.13 -0.20 -0.07 0.00 -1.00 0.00 0.00 59.36 58.22 2ai7 h GLU 41 Cb 0.28 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.53 2ai7 h GLU 41 CO 0.00 0.75 -0.21 0.82 -1.00 0.00 0.00 179.01 179.37 2ai7 h ILE 42 N 0.35 1.43 -0.75 3.13 2.04 -1.20 -2.81 117.51 119.70 2ai7 h ILE 42 Ca 0.03 -1.58 0.02 0.00 1.00 0.00 0.00 64.86 64.33 2ai7 h ILE 42 Cb 0.85 2.27 -0.04 0.00 -0.74 0.00 0.00 36.82 39.16 2ai7 h ILE 42 CO 0.07 0.45 0.49 0.40 0.00 0.00 0.00 178.15 179.56 2ai7 h ILE 43 N -0.23 1.16 -0.58 -0.67 2.04 -1.11 -1.94 117.51 116.17 2ai7 h ILE 43 Ca -0.01 -0.34 0.06 0.00 1.00 0.00 0.00 64.86 65.58 2ai7 h ILE 43 Cb 0.83 0.09 -0.05 0.00 -0.74 0.00 0.00 36.82 36.95 2ai7 h ILE 43 CO 0.05 0.18 0.29 0.25 0.00 0.00 0.00 178.15 178.91 2ai7 h LEU 44 N 0.98 0.40 -0.47 1.44 5.85 -1.03 0.48 115.31 122.96 2ai7 h LEU 44 Ca 0.28 0.04 0.03 0.00 0.84 0.00 0.00 57.88 59.07 2ai7 h LEU 44 Cb -0.07 -0.03 -0.03 0.00 0.37 0.00 0.00 40.66 40.90 2ai7 h LEU 44 CO -0.08 0.26 0.27 1.23 -0.34 0.00 0.00 178.44 179.78 2ai7 h GLY 45 N 0.54 0.65 1.04 3.75 0.00 -1.15 -0.25 103.07 107.65 2ai7 h GLY 45 Ca 0.27 -0.20 -0.06 0.00 0.00 0.00 0.00 47.33 47.34 2ai7 h GLY 45 CO -0.20 0.16 0.21 0.83 0.00 0.00 0.00 176.54 177.54 2ai7 h GLU 46 N 0.53 1.07 -0.76 4.80 5.08 -0.51 -2.08 114.58 122.71 2ai7 h GLU 46 Ca 0.19 -0.23 -0.03 0.00 -1.00 0.00 0.00 59.36 58.29 2ai7 h GLU 46 Cb 0.04 -0.15 -0.03 0.00 0.50 0.00 0.00 28.75 29.10 2ai7 h GLU 46 CO -0.10 0.93 0.37 0.87 -1.00 0.00 0.00 179.01 180.08 2ai7 h LYS 47 N 1.00 1.08 -0.11 2.33 1.79 0.43 -0.70 116.57 122.39 2ai7 h LYS 47 Ca 0.22 -0.15 0.00 0.00 -2.18 0.00 0.00 60.65 58.54 2ai7 h LYS 47 Cb 0.31 -0.20 -0.01 0.00 -1.58 0.00 0.00 32.23 30.76 2ai7 h LYS 47 CO -0.01 0.84 0.07 0.52 -1.08 0.00 0.00 179.45 179.80 2ai7 h MET 48 N 1.06 0.15 -0.85 3.15 2.86 -0.76 -0.45 114.93 120.10 2ai7 h MET 48 Ca 0.26 -0.01 -0.03 0.00 -2.06 0.00 0.00 59.70 57.86 2ai7 h MET 48 Cb 0.11 -0.03 -0.04 0.00 0.06 0.00 0.00 31.60 31.69 2ai7 h MET 48 CO -0.03 0.11 0.43 1.98 1.06 0.00 0.00 176.91 180.45 2ai7 h MET 49 N 0.15 1.21 -0.81 1.72 1.85 -1.15 -1.58 114.93 116.31 2ai7 h MET 49 Ca 0.04 -0.17 -0.01 0.00 -0.61 0.00 0.00 59.70 58.96 2ai7 h MET 49 Cb -0.01 -0.22 -0.04 0.00 0.43 0.00 0.00 31.60 31.76 2ai7 h MET 49 CO -0.01 0.91 0.48 0.37 -0.40 0.00 0.00 176.91 178.26 2ai7 h GLN 50 N 1.20 1.10 -0.23 0.39 5.75 -0.75 -1.35 115.11 121.22 2ai7 h GLN 50 Ca 0.29 -0.10 -0.00 0.00 -0.15 0.00 0.00 58.65 58.69 2ai7 h GLN 50 Cb 0.09 -0.23 -0.01 0.00 1.07 0.00 0.00 27.48 28.40 2ai7 h GLN 50 CO -0.04 0.78 0.14 0.35 -2.65 0.00 0.00 178.83 177.40 2ai7 h PHE 51 N 1.12 0.30 -0.55 3.99 3.57 -0.17 -0.53 116.94 124.67 2ai7 h PHE 51 Ca 0.29 -0.00 0.05 0.00 3.53 0.00 0.00 57.97 61.83 2ai7 h PHE 51 Cb -0.03 -0.10 -0.05 0.00 2.79 0.00 0.00 35.95 38.57 2ai7 h PHE 51 CO 0.01 0.24 0.29 -0.07 -2.23 0.00 0.00 178.31 176.54 2ai7 h LEU 52 N 0.28 0.43 -0.37 0.59 3.38 -0.69 0.13 115.31 119.07 2ai7 h LEU 52 Ca 0.08 0.03 -0.02 0.00 0.09 0.00 0.00 57.88 58.06 2ai7 h LEU 52 Cb 0.02 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 40.70 2ai7 h LEU 52 CO -0.02 0.29 0.15 0.11 0.09 0.00 0.00 178.44 179.06 2ai7 h LYS 53 N 0.56 0.55 -0.28 1.13 1.57 -1.02 -1.75 116.57 117.32 2ai7 h LYS 53 Ca 0.24 -0.10 0.03 0.00 -1.87 0.00 0.00 60.65 58.95 2ai7 h LYS 53 Cb 0.13 -0.09 -0.03 0.00 0.08 0.00 0.00 32.23 32.32 2ai7 h LYS 53 CO -0.16 0.53 0.09 0.45 -0.57 0.00 0.00 179.45 179.80 2ai7 h HIS 54 N 0.45 0.16 0.00 -1.35 3.86 -0.56 -1.01 115.15 116.69 2ai7 h HIS 54 Ca 0.12 0.01 -0.00 0.00 -1.16 0.00 0.00 60.37 59.35 2ai7 h HIS 54 Cb 0.19 -0.03 -0.00 0.00 1.06 0.00 0.00 27.41 28.63 2ai7 h HIS 54 CO -0.00 0.07 -0.01 0.66 0.86 0.00 0.00 177.93 179.51 2ai7 h SER 55 N 0.21 0.00 0.13 2.45 4.64 -0.47 -0.91 113.55 119.60 2ai7 h SER 55 Ca 0.13 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.45 2ai7 h SER 55 Cb 0.10 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.19 2ai7 h SER 55 CO -0.14 0.01 -0.47 0.00 -0.87 0.00 0.00 176.83 175.36 2ai7 n GLN 56 N -3.25 0.79 -3.40 4.77 6.02 -0.45 -4.15 117.38 117.71 2ai7 n GLN 56 Ca -0.03 -0.58 -0.38 0.00 -0.01 0.00 0.00 57.00 56.01 2ai7 n GLN 56 Cb 0.10 -1.49 -0.07 0.00 1.02 0.00 0.00 30.24 29.80 2ai7 n GLN 56 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 177.06 176.39 2ai7 s ASP 57 N -2.61 6.45 0.12 1.08 2.15 -0.36 -5.00 116.67 118.49 2ai7 s ASP 57 Ca 0.18 0.53 -0.33 0.00 0.43 0.00 0.00 52.55 53.36 2ai7 s ASP 57 Cb 0.18 -2.23 -0.12 0.00 -0.30 0.00 0.00 42.92 40.46 2ai7 s ASP 57 CO 0.61 -0.05 1.56 -0.65 -0.17 0.00 0.00 175.17 176.46 2ai7 h PRO 58 N 7.26 -0.57 -0.52 4.34 0.11 -1.89 0.29 132.00 141.02 2ai7 h PRO 58 Ca -0.37 0.04 -0.06 0.00 0.11 0.00 0.00 66.00 65.72 2ai7 h PRO 58 Cb 1.16 0.13 -0.02 0.00 0.11 0.00 0.00 31.00 32.38 2ai7 h PRO 58 CO 0.72 -0.38 0.11 -0.24 -0.21 0.00 0.00 178.00 178.01 2ai7 h VAL 59 N -0.59 1.25 0.54 3.15 3.04 -1.94 -2.31 116.25 119.39 2ai7 h VAL 59 Ca 0.04 -0.90 -0.03 0.00 -1.01 0.00 0.00 66.70 64.80 2ai7 h VAL 59 Cb 0.68 0.82 0.01 0.00 -2.01 0.00 0.00 31.29 30.79 2ai7 h VAL 59 CO -0.42 0.32 -0.26 -0.03 -1.01 0.00 0.00 177.57 176.18 2ai7 h MET 60 N 0.74 -0.70 -0.87 4.17 -1.53 -1.75 -1.66 114.93 113.32 2ai7 h MET 60 Ca 0.16 0.05 0.11 0.00 -3.44 0.00 0.00 59.70 56.58 2ai7 h MET 60 Cb 0.36 0.16 -0.06 0.00 -0.55 0.00 0.00 31.60 31.51 2ai7 h MET 60 CO 0.01 -0.44 0.56 0.00 0.14 0.00 0.00 176.91 177.18 2ai7 h ALA 61 N -0.36 1.74 0.47 0.39 0.00 -0.23 -0.92 119.26 120.34 2ai7 h ALA 61 Ca -0.07 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.82 2ai7 h ALA 61 Cb 0.59 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.22 2ai7 h ALA 61 CO 0.12 0.06 -0.23 1.49 0.00 0.00 0.00 179.25 180.70 2ai7 h GLU 62 N 0.78 -0.61 -0.93 0.00 4.22 -1.25 0.19 114.58 116.97 2ai7 h GLU 62 Ca 0.42 0.04 0.04 0.00 0.08 0.00 0.00 59.36 59.94 2ai7 h GLU 62 Cb 0.53 0.14 -0.06 0.00 0.50 0.00 0.00 28.75 29.87 2ai7 h GLU 62 CO -0.18 -0.31 0.60 -0.22 -2.18 0.00 0.00 179.01 176.72 2ai7 h LYS 63 N -0.94 1.11 -0.13 1.92 1.63 -1.00 -2.44 116.57 116.72 2ai7 h LYS 63 Ca -0.07 -0.07 0.00 0.00 -0.85 0.00 0.00 60.65 59.67 2ai7 h LYS 63 Cb 0.59 -0.25 0.00 0.00 -0.60 0.00 0.00 32.23 31.97 2ai7 h LYS 63 CO 0.11 0.74 0.00 -1.33 -3.45 0.00 0.00 179.45 175.51 2ai7 n MET 64 N -4.51 1.73 -3.75 1.90 2.81 -0.38 -4.94 117.12 109.99 2ai7 n MET 64 Ca 0.13 -1.09 -0.27 0.00 -1.81 0.00 0.00 57.70 54.65 2ai7 n MET 64 Cb 0.12 -1.42 0.05 0.00 -0.71 0.00 0.00 33.22 31.26 2ai7 n MET 64 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2ai7 n GLY 65 N 1.15 -0.52 3.81 3.03 0.00 -0.45 -4.67 105.19 107.55 2ai7 n GLY 65 Ca 0.17 0.22 -0.38 0.00 0.00 0.00 0.00 46.02 46.03 2ai7 n GLY 65 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2ai7 s LEU 66 N -7.29 4.50 0.01 0.99 1.02 0.52 -4.72 118.68 113.71 2ai7 s LEU 66 Ca 0.63 1.25 -0.21 0.00 0.02 0.00 0.00 54.13 55.81 2ai7 s LEU 66 Cb -0.30 -2.98 -0.05 0.00 0.02 0.00 0.00 46.19 42.88 2ai7 s LEU 66 CO 0.77 0.24 0.63 -0.13 0.02 0.00 0.00 176.35 177.88 2ai7 s ARG 67 N -1.26 4.34 0.35 1.70 0.52 -1.26 -4.77 118.95 118.57 2ai7 s ARG 67 Ca 0.31 0.80 -0.28 0.00 -0.52 0.00 0.00 55.73 56.03 2ai7 s ARG 67 Cb -0.19 -3.34 -0.11 0.00 0.52 0.00 0.00 34.95 31.84 2ai7 s ARG 67 CO 0.19 0.37 1.45 0.20 0.02 0.00 0.00 175.30 177.53 2ai7 s GLY 68 N -0.24 2.85 0.00 -3.53 0.00 -1.26 -4.83 107.32 100.32 2ai7 s GLY 68 Ca 0.32 1.49 -0.10 0.00 0.00 0.00 0.00 44.72 46.43 2ai7 s GLY 68 CO 0.18 2.20 0.20 -0.32 0.00 0.00 0.00 173.10 175.36 2ai7 s GLY 69 N -0.15 -0.02 0.00 0.20 0.00 -1.26 -5.00 107.32 101.09 2ai7 s GLY 69 Ca 0.53 -0.01 0.04 0.00 0.00 0.00 0.00 44.72 45.29 2ai7 s GLY 69 CO 0.58 -0.17 0.74 3.33 0.00 0.00 0.00 173.10 177.58 2ai7 n VAL 70 N 1.33 0.23 -3.50 1.40 0.24 -1.26 -4.73 118.33 112.04 2ai7 n VAL 70 Ca -0.22 -0.61 -0.15 0.00 -2.04 0.00 0.00 64.34 61.31 2ai7 n VAL 70 Cb 0.56 0.95 -0.05 0.00 -1.47 0.00 0.00 33.84 33.84 2ai7 n VAL 70 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 2ai7 s GLY 71 N -0.50 -0.57 -0.20 7.63 0.00 -1.26 -0.75 107.32 111.67 2ai7 s GLY 71 Ca 0.06 0.92 -0.21 0.00 0.00 0.00 0.00 44.72 45.49 2ai7 s GLY 71 CO 0.05 0.58 0.59 -2.27 0.00 0.00 0.00 173.10 172.06 2ai7 s LEU 72 N -1.84 -0.28 0.00 0.66 2.96 -0.17 -5.00 118.68 115.02 2ai7 s LEU 72 Ca -0.06 1.12 0.07 0.00 -0.22 0.00 0.00 54.13 55.05 2ai7 s LEU 72 Cb -0.00 2.07 -0.02 0.00 0.50 0.00 0.00 46.19 48.73 2ai7 s LEU 72 CO 0.00 -0.25 -0.23 0.00 -1.32 0.00 0.00 176.35 174.56 2ai7 s ALA 73 N 0.13 1.92 0.30 5.97 0.00 -1.26 -0.61 121.76 128.21 2ai7 s ALA 73 Ca -0.01 -1.04 0.06 0.00 0.00 0.00 0.00 51.96 50.97 2ai7 s ALA 73 Cb -0.04 -0.45 0.82 0.00 0.00 0.00 0.00 23.12 23.45 2ai7 s ALA 73 CO 0.02 0.46 1.67 0.00 0.00 0.00 0.00 175.76 177.91 2ai7 h ALA 74 N 5.31 1.53 -0.89 0.00 0.00 -1.38 0.28 119.26 124.10 2ai7 h ALA 74 Ca -0.42 0.19 0.18 0.00 0.00 0.00 0.00 54.91 54.86 2ai7 h ALA 74 Cb 1.14 0.21 -0.07 0.00 0.00 0.00 0.00 17.79 19.07 2ai7 h ALA 74 CO 0.46 -0.45 0.58 -1.35 0.00 0.00 0.00 179.25 178.50 2ai7 h PRO 75 N 0.32 0.49 0.00 0.00 0.11 -1.45 0.22 132.00 131.68 2ai7 h PRO 75 Ca 0.61 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.69 2ai7 h PRO 75 Cb 1.25 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 32.25 2ai7 h PRO 75 CO -0.60 0.32 0.00 1.04 -0.21 0.00 0.00 178.00 178.56 2ai7 n GLN 76 N -4.54 0.15 -0.42 1.05 6.02 0.09 -0.04 117.38 119.68 2ai7 n GLN 76 Ca 0.19 0.59 0.08 0.00 -0.01 0.00 0.00 57.00 57.85 2ai7 n GLN 76 Cb 0.61 -1.94 0.26 0.00 1.02 0.00 0.00 30.24 30.20 2ai7 n GLN 76 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 2ai7 n LEU 77 N -2.25 3.90 -1.51 1.08 4.77 0.70 -1.12 117.00 122.57 2ai7 n LEU 77 Ca -0.01 -2.51 -0.14 0.00 -0.03 0.00 0.00 56.01 53.32 2ai7 n LEU 77 Cb 0.07 -0.46 -0.01 0.00 -2.33 0.00 0.00 43.42 40.69 2ai7 n LEU 77 CO 0.12 0.73 -0.17 -0.67 -1.33 0.00 0.00 177.39 176.07 2ai7 n ASP 78 N 0.35 -4.35 -4.12 -1.43 2.03 0.94 -4.83 116.55 105.15 2ai7 n ASP 78 Ca 0.20 0.04 -0.34 0.00 0.52 0.00 0.00 54.79 55.21 2ai7 n ASP 78 Cb 0.75 -3.45 -0.14 0.00 -0.72 0.00 0.00 41.12 37.56 2ai7 n ASP 78 CO 0.00 0.00 0.00 -0.63 -1.92 0.00 0.00 177.20 174.65 2ai7 s ILE 79 N -2.67 2.66 -1.52 5.18 1.01 -0.84 -4.87 121.20 120.15 2ai7 s ILE 79 Ca 0.00 -1.65 -0.11 0.00 0.00 0.00 0.00 60.65 58.89 2ai7 s ILE 79 Cb 0.00 -2.62 -0.01 0.00 0.01 0.00 0.00 42.46 39.84 2ai7 s ILE 79 CO 0.00 -0.19 2.58 -0.24 0.00 0.00 0.00 174.94 177.08 2ai7 n SER 80 N 4.51 6.60 -4.22 3.58 2.88 -1.26 -1.44 113.62 124.26 2ai7 n SER 80 Ca -0.10 -2.74 -0.23 0.00 -1.33 0.00 0.00 58.87 54.46 2ai7 n SER 80 Cb 0.43 -1.58 -0.13 0.00 -0.75 0.00 0.00 64.21 62.17 2ai7 n SER 80 CO 0.00 0.00 0.00 -0.54 -1.23 0.00 0.00 175.04 173.27 2ai7 s LYS 81 N 2.26 1.19 -1.34 -1.46 1.02 -1.26 -1.77 119.74 118.38 2ai7 s LYS 81 Ca 0.58 -0.93 -0.17 0.00 0.02 0.00 0.00 55.97 55.47 2ai7 s LYS 81 Cb 0.16 -1.30 0.07 0.00 -0.52 0.00 0.00 37.83 36.24 2ai7 s LYS 81 CO -0.07 0.32 1.85 0.54 -0.92 0.00 0.00 175.35 177.07 2ai7 n ARG 82 N 1.69 3.13 -4.00 1.68 1.74 -0.68 -4.41 116.66 115.80 2ai7 n ARG 82 Ca -0.18 -3.14 -0.17 0.00 -0.77 0.00 0.00 57.85 53.59 2ai7 n ARG 82 Cb 0.54 -3.42 -0.16 0.00 -1.02 0.00 0.00 32.46 28.40 2ai7 n ARG 82 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 2ai7 s ILE 83 N 3.82 0.27 0.04 0.55 1.01 -1.26 -0.57 121.20 125.05 2ai7 s ILE 83 Ca 0.52 0.01 -0.02 0.00 0.00 0.00 0.00 60.65 61.16 2ai7 s ILE 83 Cb 0.06 -0.34 -0.02 0.00 0.01 0.00 0.00 42.46 42.17 2ai7 s ILE 83 CO 0.03 0.16 0.02 0.27 0.00 0.00 0.00 174.94 175.42 2ai7 s ILE 84 N 0.88 0.16 -0.03 2.92 -4.36 -0.43 -1.23 121.20 119.11 2ai7 s ILE 84 Ca -0.10 -1.29 0.04 0.00 -0.26 0.00 0.00 60.65 59.04 2ai7 s ILE 84 Cb -0.13 -0.94 -0.01 0.00 1.25 0.00 0.00 42.46 42.64 2ai7 s ILE 84 CO -0.01 -0.71 -0.17 0.00 0.24 0.00 0.00 174.94 174.29 2ai7 s ALA 85 N -2.76 1.45 -0.02 2.27 0.00 0.22 -0.01 121.76 122.91 2ai7 s ALA 85 Ca -0.04 -0.68 0.03 0.00 0.00 0.00 0.00 51.96 51.27 2ai7 s ALA 85 Cb -0.00 -0.45 0.00 0.00 0.00 0.00 0.00 23.12 22.67 2ai7 s ALA 85 CO -0.06 0.29 -0.09 0.14 0.00 0.00 0.00 175.76 176.04 2ai7 s VAL 86 N -0.07 0.79 -0.37 0.00 -7.23 -0.07 -1.00 120.40 112.45 2ai7 s VAL 86 Ca -0.01 -0.37 0.02 0.00 -1.81 0.00 0.00 61.98 59.81 2ai7 s VAL 86 Cb -0.10 -0.70 0.15 0.00 0.56 0.00 0.00 36.38 36.29 2ai7 s VAL 86 CO 0.01 0.24 0.32 -0.22 -0.31 0.00 0.00 175.10 175.14 2ai7 s LEU 87 N 0.13 0.37 -0.35 1.32 2.96 0.07 -1.34 118.68 121.84 2ai7 s LEU 87 Ca -0.02 -1.88 -0.12 0.00 -0.22 0.00 0.00 54.13 51.88 2ai7 s LEU 87 Cb -0.08 0.18 0.00 0.00 0.50 0.00 0.00 46.19 46.79 2ai7 s LEU 87 CO 0.00 -0.27 0.23 -0.69 -1.32 0.00 0.00 176.35 174.30 2ai7 s VAL 88 N 1.22 5.00 0.50 1.68 1.01 0.11 -4.54 120.40 125.38 2ai7 s VAL 88 Ca 0.18 -0.47 -0.21 0.00 0.00 0.00 0.00 61.98 61.48 2ai7 s VAL 88 Cb -0.17 -3.65 -0.07 0.00 0.00 0.00 0.00 36.38 32.49 2ai7 s VAL 88 CO -0.02 -0.09 1.14 -2.84 0.00 0.00 0.00 175.10 173.29 2ai7 s PRO 89 N 1.66 3.59 0.32 2.72 0.02 -1.26 0.24 135.00 142.28 2ai7 s PRO 89 Ca 0.05 1.68 -0.18 0.00 0.02 0.00 0.00 61.00 62.57 2ai7 s PRO 89 Cb -0.18 -2.22 -0.09 0.00 0.02 0.00 0.00 34.50 32.03 2ai7 s PRO 89 CO 0.09 -0.67 0.79 -0.80 -0.33 0.00 0.00 177.00 176.08 2ai7 s ASN 90 N -1.56 6.92 -0.28 2.53 0.01 -0.94 -4.34 114.94 117.28 2ai7 s ASN 90 Ca 0.68 1.43 0.11 0.00 -0.71 0.00 0.00 52.86 54.37 2ai7 s ASN 90 Cb -0.26 -2.43 0.61 0.00 0.41 0.00 0.00 41.25 39.58 2ai7 s ASN 90 CO 0.31 -0.16 1.60 -0.38 -1.51 0.00 0.00 177.10 176.95 2ai7 n ILE 91 N -0.06 2.65 0.00 0.60 -0.00 -1.26 -4.94 119.36 116.35 2ai7 n ILE 91 Ca 0.03 -2.05 0.00 0.00 -0.00 0.00 0.00 62.75 60.72 2ai7 n ILE 91 Cb 0.52 -0.32 0.00 0.00 -0.00 0.00 0.00 39.64 39.84 2ai7 n ILE 91 CO 0.00 0.00 0.00 -0.62 -0.00 0.00 0.00 176.55 175.93 2ai7 n GLU 100 N -0.61 0.00 0.13 0.38 4.71 -1.26 -5.23 120.64 118.75 2ai7 n GLU 100 Ca 0.34 0.00 -0.00 0.00 -0.01 0.00 0.00 57.16 57.49 2ai7 n GLU 100 Cb 1.16 0.00 0.09 0.00 -1.01 0.00 0.00 31.44 31.67 2ai7 n GLU 100 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 2ai7 h ALA 101 N 0.00 0.71 -4.16 0.62 0.00 -1.98 -3.45 119.26 111.00 2ai7 h ALA 101 Ca 0.00 -0.58 -0.69 0.00 0.00 0.00 0.00 54.91 53.64 2ai7 h ALA 101 Cb 0.00 -0.10 -0.25 0.00 0.00 0.00 0.00 17.79 17.44 2ai7 h ALA 101 CO 0.00 0.80 -0.88 0.71 0.00 0.00 0.00 179.25 179.88 2ai7 s TYR 102 N -3.17 2.29 0.08 0.00 1.51 -1.26 -2.22 117.35 114.57 2ai7 s TYR 102 Ca 0.01 -0.40 0.03 0.00 -1.01 0.00 0.00 57.07 55.70 2ai7 s TYR 102 Cb 0.10 -1.33 -0.24 0.00 -0.11 0.00 0.00 41.96 40.38 2ai7 s TYR 102 CO 0.76 0.19 1.14 0.22 -1.11 0.00 0.00 175.55 176.74 2ai7 h ASP 103 N 4.51 0.18 -2.68 2.29 3.58 0.29 -3.43 116.42 121.15 2ai7 h ASP 103 Ca -0.48 -0.20 -0.03 0.00 0.42 0.00 0.00 57.03 56.74 2ai7 h ASP 103 Cb 1.15 -0.06 -0.24 0.00 1.72 0.00 0.00 39.33 41.91 2ai7 h ASP 103 CO 0.42 1.16 -0.19 -0.22 -2.88 0.00 0.00 179.24 177.53 2ai7 s LEU 104 N -6.83 -0.72 -0.13 2.28 2.96 -0.72 -4.97 118.68 110.55 2ai7 s LEU 104 Ca -0.02 1.26 -0.02 0.00 -0.22 0.00 0.00 54.13 55.12 2ai7 s LEU 104 Cb 0.09 1.86 0.04 0.00 0.50 0.00 0.00 46.19 48.68 2ai7 s LEU 104 CO 0.84 -0.22 0.01 -0.70 -1.32 0.00 0.00 176.35 174.96 2ai7 s GLU 105 N 2.15 0.70 -0.12 1.98 2.12 -1.26 0.06 118.70 124.33 2ai7 s GLU 105 Ca -0.07 -0.16 -0.29 0.00 0.36 0.00 0.00 54.97 54.80 2ai7 s GLU 105 Cb -0.09 -1.55 0.08 0.00 0.26 0.00 0.00 34.13 32.83 2ai7 s GLU 105 CO -0.16 -0.46 0.74 0.00 -0.54 0.00 0.00 175.26 174.84 2ai7 s ALA 106 N 1.90 -1.80 -0.27 6.30 0.00 -0.45 -5.01 121.76 122.43 2ai7 s ALA 106 Ca 0.02 1.52 -0.03 0.00 0.00 0.00 0.00 51.96 53.47 2ai7 s ALA 106 Cb -0.14 -0.38 0.03 0.00 0.00 0.00 0.00 23.12 22.62 2ai7 s ALA 106 CO -0.07 -0.35 -0.02 0.42 0.00 0.00 0.00 175.76 175.74 2ai7 s ILE 107 N -0.80 3.12 -0.14 0.00 1.01 -1.26 -0.90 121.20 122.23 2ai7 s ILE 107 Ca -0.07 -1.02 -0.02 0.00 0.00 0.00 0.00 60.65 59.53 2ai7 s ILE 107 Cb -0.01 -2.63 -0.02 0.00 0.01 0.00 0.00 42.46 39.80 2ai7 s ILE 107 CO 0.07 0.12 -0.07 -0.04 0.00 0.00 0.00 174.94 175.02 2ai7 s MET 108 N 1.35 3.56 -0.16 2.79 -1.94 0.98 -4.67 119.30 121.21 2ai7 s MET 108 Ca -0.00 -0.57 -0.05 0.00 -1.71 0.00 0.00 55.69 53.36 2ai7 s MET 108 Cb -0.17 -2.82 -0.03 0.00 2.01 0.00 0.00 34.83 33.81 2ai7 s MET 108 CO -0.02 0.25 0.02 0.71 -0.01 0.00 0.00 175.02 175.97 2ai7 s TYR 109 N 0.31 3.16 -1.40 -0.03 1.51 -0.24 -1.31 117.35 119.34 2ai7 s TYR 109 Ca -0.06 -0.05 -0.02 0.00 -1.01 0.00 0.00 57.07 55.94 2ai7 s TYR 109 Cb -0.15 -2.00 0.01 0.00 -0.11 0.00 0.00 41.96 39.72 2ai7 s TYR 109 CO 0.04 0.12 0.54 0.09 -1.11 0.00 0.00 175.55 175.23 2ai7 n ASN 110 N 3.37 -0.90 -4.77 2.29 3.02 0.26 -1.31 115.26 117.22 2ai7 n ASN 110 Ca -0.17 -0.94 -0.38 0.00 -0.03 0.00 0.00 54.58 53.05 2ai7 n ASN 110 Cb 0.52 -3.36 -0.00 0.00 -0.61 0.00 0.00 39.78 36.34 2ai7 n ASN 110 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 2ai7 s PRO 111 N -6.42 3.82 -0.11 3.52 0.04 -1.26 -4.56 135.00 130.03 2ai7 s PRO 111 Ca 0.07 1.99 -0.09 0.00 0.04 0.00 0.00 61.00 63.01 2ai7 s PRO 111 Cb -0.04 -2.57 0.03 0.00 0.04 0.00 0.00 34.50 31.96 2ai7 s PRO 111 CO 0.87 -0.56 0.29 0.21 0.04 0.00 0.00 177.00 177.84 2ai7 s LYS 112 N -2.47 0.32 -0.31 4.56 2.20 0.84 -4.98 119.74 119.90 2ai7 s LYS 112 Ca 0.61 0.45 -0.25 0.00 -0.36 0.00 0.00 55.97 56.41 2ai7 s LYS 112 Cb -0.34 0.10 0.01 0.00 -1.51 0.00 0.00 37.83 36.09 2ai7 s LYS 112 CO 0.42 -0.07 0.89 0.42 -0.36 0.00 0.00 175.35 176.65 2ai7 s ILE 113 N 0.44 4.69 -0.93 5.43 1.01 -1.26 -0.44 121.20 130.14 2ai7 s ILE 113 Ca -0.02 1.36 0.19 0.00 0.00 0.00 0.00 60.65 62.18 2ai7 s ILE 113 Cb -0.04 -4.24 -0.20 0.00 0.01 0.00 0.00 42.46 37.99 2ai7 s ILE 113 CO -0.02 -0.34 0.81 1.33 0.00 0.00 0.00 174.94 176.72 2ai7 n VAL 114 N 5.66 0.00 -3.60 2.92 0.24 0.12 -4.97 118.33 118.69 2ai7 n VAL 114 Ca 0.07 -0.06 -0.13 0.00 -2.04 0.00 0.00 64.34 62.18 2ai7 n VAL 114 Cb 0.48 1.01 -0.06 0.00 -1.47 0.00 0.00 33.84 33.79 2ai7 n VAL 114 CO 0.00 0.00 0.00 -0.55 -2.14 0.00 0.00 176.83 174.14 2ai7 s SER 115 N -2.77 -0.57 0.05 -1.34 0.15 -1.19 -4.97 113.70 103.05 2ai7 s SER 115 Ca 0.08 0.93 -0.09 0.00 0.70 0.00 0.00 55.95 57.56 2ai7 s SER 115 Cb 0.14 0.88 0.00 0.00 -1.71 0.00 0.00 66.02 65.34 2ai7 s SER 115 CO 0.77 -0.31 0.19 -1.38 1.20 0.00 0.00 173.24 173.71 2ai7 s HIS 116 N -0.27 0.08 0.67 3.44 -0.00 -1.26 -0.10 115.29 117.85 2ai7 s HIS 116 Ca -0.02 -0.35 -0.11 0.00 -0.00 0.00 0.00 55.06 54.59 2ai7 s HIS 116 Cb -0.03 -0.04 -0.01 0.00 -0.00 0.00 0.00 32.58 32.50 2ai7 s HIS 116 CO 0.01 -0.45 1.05 -1.54 -0.00 0.00 0.00 174.74 173.81 2ai7 s SER 117 N -2.26 5.66 0.07 7.38 1.04 -0.29 -4.97 113.70 120.34 2ai7 s SER 117 Ca -0.03 1.53 -0.16 0.00 0.48 0.00 0.00 55.95 57.78 2ai7 s SER 117 Cb 0.00 -2.46 -0.15 0.00 0.10 0.00 0.00 66.02 63.50 2ai7 s SER 117 CO -0.05 -1.25 1.29 0.58 0.98 0.00 0.00 173.24 174.79 2ai7 h VAL 118 N -0.58 1.33 -3.94 5.02 2.07 -1.99 -3.44 116.25 114.72 2ai7 h VAL 118 Ca -0.44 -1.80 -0.55 0.00 0.82 0.00 0.00 66.70 64.73 2ai7 h VAL 118 Cb 1.21 2.01 0.12 0.00 -1.52 0.00 0.00 31.29 33.11 2ai7 h VAL 118 CO 0.59 0.56 0.71 1.67 0.02 0.00 0.00 177.57 181.11 2ai7 n GLN 119 N -4.15 2.32 -3.72 1.57 7.27 -1.26 -4.92 117.38 114.49 2ai7 n GLN 119 Ca -0.07 0.82 -0.23 0.00 0.07 0.00 0.00 57.00 57.59 2ai7 n GLN 119 Cb 0.62 -2.63 -0.02 0.00 2.41 0.00 0.00 30.24 30.62 2ai7 n GLN 119 CO 0.00 0.00 0.00 -0.51 0.07 0.00 0.00 177.06 176.62 2ai7 s ASP 120 N -0.41 4.82 0.18 1.69 1.01 -0.19 -1.69 116.67 122.08 2ai7 s ASP 120 Ca 0.60 -0.97 -0.21 0.00 0.71 0.00 0.00 52.55 52.67 2ai7 s ASP 120 Cb -0.46 -0.15 0.05 0.00 1.01 0.00 0.00 42.92 43.38 2ai7 s ASP 120 CO 0.59 -0.85 0.57 0.00 0.21 0.00 0.00 175.17 175.69 2ai7 s ALA 121 N -2.61 -1.33 -0.17 5.23 0.00 0.68 -0.73 121.76 122.84 2ai7 s ALA 121 Ca 0.43 0.17 -0.28 0.00 0.00 0.00 0.00 51.96 52.28 2ai7 s ALA 121 Cb -0.02 0.85 0.08 0.00 0.00 0.00 0.00 23.12 24.03 2ai7 s ALA 121 CO 0.25 -0.79 0.77 0.00 0.00 0.00 0.00 175.76 175.99 2ai7 s ALA 122 N -3.80 -1.81 0.26 0.00 0.00 -0.46 -1.08 121.76 114.87 2ai7 s ALA 122 Ca 0.04 1.66 -0.30 0.00 0.00 0.00 0.00 51.96 53.37 2ai7 s ALA 122 Cb -0.01 -0.65 -0.09 0.00 0.00 0.00 0.00 23.12 22.36 2ai7 s ALA 122 CO -0.08 -0.34 1.29 -0.51 0.00 0.00 0.00 175.76 176.11 2ai7 s LEU 123 N -0.47 4.44 0.48 0.00 1.43 -1.26 -0.15 118.68 123.15 2ai7 s LEU 123 Ca -0.05 2.50 0.15 0.00 -1.03 0.00 0.00 54.13 55.71 2ai7 s LEU 123 Cb -0.02 -3.63 1.12 0.00 0.03 0.00 0.00 46.19 43.69 2ai7 s LEU 123 CO 0.04 -0.48 2.06 1.23 0.23 0.00 0.00 176.35 179.42 2ai7 h GLY 124 N 4.41 0.00 1.58 -3.19 0.00 -1.05 -1.28 103.07 103.55 2ai7 h GLY 124 Ca -0.47 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.86 2ai7 h GLY 124 CO 0.72 0.00 -0.18 -1.84 0.00 0.00 0.00 176.54 175.23 2ai7 n GLU 125 N -4.38 0.04 0.00 4.80 0.28 -1.26 -4.98 120.64 115.14 2ai7 n GLU 125 Ca -0.03 -0.01 0.00 0.00 -0.16 0.00 0.00 57.16 56.96 2ai7 n GLU 125 Cb 0.18 -1.50 0.00 0.00 1.43 0.00 0.00 31.44 31.55 2ai7 n GLU 125 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 2ai7 n GLY 126 N 1.49 -1.73 3.21 -1.84 0.00 -0.48 -4.87 105.19 100.96 2ai7 n GLY 126 Ca 0.07 -1.50 -0.12 0.00 0.00 0.00 0.00 46.02 44.47 2ai7 n GLY 126 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2ai7 s GLU 128 N 0.00 0.96 0.30 1.61 2.02 -1.26 -4.73 118.70 117.60 2ai7 s GLU 128 Ca 0.00 -1.41 0.03 0.00 0.02 0.00 0.00 54.97 53.61 2ai7 s GLU 128 Cb 0.00 -0.37 -0.05 0.00 0.10 0.00 0.00 34.13 33.81 2ai7 s GLU 128 CO 0.00 -0.00 0.10 0.20 0.02 0.00 0.00 175.26 175.58 2ai7 s GLY 129 N -3.11 1.99 -0.12 -1.39 0.00 -1.26 -4.67 107.32 98.76 2ai7 s GLY 129 Ca 0.15 -1.84 -0.08 0.00 0.00 0.00 0.00 44.72 42.95 2ai7 s GLY 129 CO -0.02 -1.69 0.30 0.00 0.00 0.00 0.00 173.10 171.69 2ai7 h LEU 131 N 6.50 0.00 -1.59 0.00 3.38 -1.95 0.13 115.31 121.78 2ai7 h LEU 131 Ca -0.33 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.64 2ai7 h LEU 131 Cb 1.18 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.93 2ai7 h LEU 131 CO 0.33 0.00 0.00 -1.20 0.09 0.00 0.00 178.44 177.66 2ai7 n SER 132 N -3.73 2.40 -4.04 -0.43 7.64 -1.26 -4.78 113.62 109.41 2ai7 n SER 132 Ca 0.00 -1.82 -0.32 0.00 1.01 0.00 0.00 58.87 57.74 2ai7 n SER 132 Cb 0.26 -0.14 -0.15 0.00 -1.01 0.00 0.00 64.21 63.17 2ai7 n SER 132 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 2ai7 s VAL 133 N -1.72 1.98 -1.19 0.44 1.01 0.45 -1.24 120.40 120.13 2ai7 s VAL 133 Ca 0.34 -1.44 -0.07 0.00 0.00 0.00 0.00 61.98 60.81 2ai7 s VAL 133 Cb 0.20 -2.09 0.23 0.00 0.00 0.00 0.00 36.38 34.71 2ai7 s VAL 133 CO 0.29 0.02 1.68 0.47 0.00 0.00 0.00 175.10 177.56 2ai7 n ASP 134 N 4.52 5.63 0.00 3.32 8.00 -1.26 -4.52 116.55 132.24 2ai7 n ASP 134 Ca -0.14 -3.22 0.00 0.00 0.71 0.00 0.00 54.79 52.13 2ai7 n ASP 134 Cb 0.43 -1.40 0.00 0.00 -0.02 0.00 0.00 41.12 40.14 2ai7 n ASP 134 CO 0.00 0.00 0.00 -2.11 -0.39 0.00 0.00 177.20 174.70 2ai7 n ARG 135 N 2.90 0.00 -3.60 -1.24 1.85 -1.26 -5.14 116.66 110.17 2ai7 n ARG 135 Ca 0.34 0.00 -0.37 0.00 -1.00 0.00 0.00 57.85 56.82 2ai7 n ARG 135 Cb 0.35 0.00 -0.09 0.00 -1.05 0.00 0.00 32.46 31.68 2ai7 n ARG 135 CO 0.00 0.00 0.00 -0.80 -0.01 0.00 0.00 177.63 176.82 2ai7 s ASN 136 N 0.00 6.23 -0.43 2.89 0.01 -1.26 -4.88 114.94 117.50 2ai7 s ASN 136 Ca 0.00 0.25 0.01 0.00 -0.71 0.00 0.00 52.86 52.42 2ai7 s ASN 136 Cb 0.00 -2.14 0.12 0.00 0.41 0.00 0.00 41.25 39.64 2ai7 s ASN 136 CO 0.00 0.06 0.18 -0.69 -1.51 0.00 0.00 177.10 175.13 2ai7 s VAL 137 N 0.95 2.79 0.77 1.60 1.01 -1.26 -5.10 120.40 121.16 2ai7 s VAL 137 Ca 0.11 -2.52 -0.14 0.00 0.00 0.00 0.00 61.98 59.43 2ai7 s VAL 137 Cb -0.13 -2.96 0.06 0.00 0.00 0.00 0.00 36.38 33.35 2ai7 s VAL 137 CO 0.04 -0.70 1.18 -2.16 0.00 0.00 0.00 175.10 173.47 2ai7 s PRO 138 N 0.63 1.93 0.00 2.72 0.04 -1.26 -4.71 135.00 134.35 2ai7 s PRO 138 Ca 0.12 1.65 0.00 0.00 0.04 0.00 0.00 61.00 62.81 2ai7 s PRO 138 Cb -0.22 -1.82 0.00 0.00 0.04 0.00 0.00 34.50 32.51 2ai7 s PRO 138 CO -0.05 -1.97 0.00 0.41 0.04 0.00 0.00 177.00 175.43 2ai7 n GLY 139 N 0.19 3.81 3.64 0.56 0.00 -1.26 -4.96 105.19 107.18 2ai7 n GLY 139 Ca 0.13 -1.75 -0.41 0.00 0.00 0.00 0.00 46.02 43.99 2ai7 n GLY 139 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2ai7 s TYR 140 N -2.51 3.33 -0.60 1.61 2.02 -0.01 -4.31 117.35 116.88 2ai7 s TYR 140 Ca 0.00 1.03 -0.24 0.00 -0.37 0.00 0.00 57.07 57.49 2ai7 s TYR 140 Cb 0.00 -2.94 0.05 0.00 -0.40 0.00 0.00 41.96 38.67 2ai7 s TYR 140 CO 0.00 -0.32 0.96 0.08 -1.57 0.00 0.00 175.55 174.71 2ai7 s VAL 141 N 2.49 4.33 -0.12 0.71 1.01 -1.26 -4.21 120.40 123.35 2ai7 s VAL 141 Ca 0.32 0.07 -0.29 0.00 0.00 0.00 0.00 61.98 62.08 2ai7 s VAL 141 Cb -0.16 -4.61 -0.03 0.00 0.00 0.00 0.00 36.38 31.59 2ai7 s VAL 141 CO 0.09 -1.26 1.41 -0.69 0.00 0.00 0.00 175.10 174.64 2ai7 s VAL 142 N 4.08 4.00 0.32 2.92 1.01 -0.61 -4.42 120.40 127.70 2ai7 s VAL 142 Ca 0.28 1.22 0.04 0.00 0.00 0.00 0.00 61.98 63.52 2ai7 s VAL 142 Cb -0.14 -3.79 -0.03 0.00 0.00 0.00 0.00 36.38 32.42 2ai7 s VAL 142 CO 0.16 -0.10 0.17 -0.13 0.00 0.00 0.00 175.10 175.20 2ai7 s ARG 143 N 3.64 1.67 0.16 2.72 0.52 -0.24 -4.88 118.95 122.54 2ai7 s ARG 143 Ca 0.62 -1.96 -0.30 0.00 -0.52 0.00 0.00 55.73 53.56 2ai7 s ARG 143 Cb -0.26 -0.11 -0.08 0.00 0.52 0.00 0.00 34.95 35.03 2ai7 s ARG 143 CO 0.21 -0.48 1.17 -1.01 0.02 0.00 0.00 175.30 175.20 2ai7 s HIS 144 N -3.53 3.47 0.14 -0.53 3.76 -1.26 -0.23 115.29 117.11 2ai7 s HIS 144 Ca 0.35 1.45 -0.16 0.00 -0.15 0.00 0.00 55.06 56.55 2ai7 s HIS 144 Cb 0.04 -3.39 0.00 0.00 1.11 0.00 0.00 32.58 30.35 2ai7 s HIS 144 CO 0.19 -1.05 1.70 0.00 -0.85 0.00 0.00 174.74 174.72 2ai7 h ALA 145 N 5.44 0.53 -3.85 -1.40 0.00 -1.53 -3.41 119.26 115.03 2ai7 h ALA 145 Ca -0.44 -0.13 -0.43 0.00 0.00 0.00 0.00 54.91 53.91 2ai7 h ALA 145 Cb 1.21 -0.16 -0.26 0.00 0.00 0.00 0.00 17.79 18.58 2ai7 h ALA 145 CO 0.75 0.12 -0.79 1.03 0.00 0.00 0.00 179.25 180.36 2ai7 s ARG 146 N -5.61 0.92 0.01 0.00 0.52 -1.26 -4.11 118.95 109.42 2ai7 s ARG 146 Ca -0.13 -0.64 -0.05 0.00 -0.52 0.00 0.00 55.73 54.39 2ai7 s ARG 146 Cb 0.10 -0.90 -0.01 0.00 0.52 0.00 0.00 34.95 34.66 2ai7 s ARG 146 CO 0.75 0.23 0.09 0.14 0.02 0.00 0.00 175.30 176.53 2ai7 s VAL 147 N -0.67 0.10 -0.21 3.52 -7.23 -1.04 -1.14 120.40 113.74 2ai7 s VAL 147 Ca 0.02 -0.84 -0.04 0.00 -1.81 0.00 0.00 61.98 59.32 2ai7 s VAL 147 Cb -0.07 -0.49 -0.01 0.00 0.56 0.00 0.00 36.38 36.37 2ai7 s VAL 147 CO 0.01 -0.46 -0.05 -0.89 -0.31 0.00 0.00 175.10 173.40 2ai7 s THR 148 N -1.67 3.41 -0.08 5.32 2.01 0.86 -0.94 115.64 124.56 2ai7 s THR 148 Ca -0.13 -0.49 0.04 0.00 0.31 0.00 0.00 61.69 61.42 2ai7 s THR 148 Cb -0.07 -2.54 -0.01 0.00 0.01 0.00 0.00 72.50 69.89 2ai7 s THR 148 CO -0.00 0.44 -0.21 -0.69 -0.69 0.00 0.00 174.62 173.47 2ai7 s VAL 149 N 1.27 2.42 -0.07 3.82 1.01 0.71 -0.71 120.40 128.86 2ai7 s VAL 149 Ca 0.03 -0.92 -0.03 0.00 0.00 0.00 0.00 61.98 61.06 2ai7 s VAL 149 Cb -0.14 -1.93 -0.04 0.00 0.00 0.00 0.00 36.38 34.27 2ai7 s VAL 149 CO -0.02 0.56 0.06 -1.81 0.00 0.00 0.00 175.10 173.90 2ai7 s ASP 150 N -0.06 5.70 0.21 3.32 1.11 0.41 -0.97 116.67 126.39 2ai7 s ASP 150 Ca -0.05 0.24 -0.23 0.00 0.18 0.00 0.00 52.55 52.69 2ai7 s ASP 150 Cb -0.14 -1.69 0.04 0.00 1.07 0.00 0.00 42.92 42.20 2ai7 s ASP 150 CO 0.04 0.36 0.74 -0.72 1.18 0.00 0.00 175.17 176.77 2ai7 s TYR 151 N -1.02 -0.27 -0.00 4.23 -0.85 -0.30 -0.11 117.35 119.03 2ai7 s TYR 151 Ca 0.17 -0.08 0.06 0.00 -0.52 0.00 0.00 57.07 56.70 2ai7 s TYR 151 Cb -0.12 0.65 -0.03 0.00 0.38 0.00 0.00 41.96 42.85 2ai7 s TYR 151 CO 0.06 -1.04 -0.20 -0.06 -1.52 0.00 0.00 175.55 172.80 2ai7 s PHE 152 N -3.73 2.52 0.81 -3.49 0.40 -0.43 0.09 117.98 114.16 2ai7 s PHE 152 Ca 0.08 -0.29 -0.04 0.00 -0.60 0.00 0.00 56.93 56.08 2ai7 s PHE 152 Cb -0.04 -1.52 0.17 0.00 0.51 0.00 0.00 43.02 42.14 2ai7 s PHE 152 CO 0.00 0.15 1.11 0.16 0.70 0.00 0.00 175.22 177.34 2ai7 s ASP 153 N -0.98 3.82 0.61 1.36 1.47 -0.52 -1.07 116.67 121.35 2ai7 s ASP 153 Ca 0.12 -0.34 0.30 0.00 1.18 0.00 0.00 52.55 53.81 2ai7 s ASP 153 Cb -0.10 0.16 1.72 0.00 -0.34 0.00 0.00 42.92 44.36 2ai7 s ASP 153 CO 0.02 -2.24 2.09 0.07 0.68 0.00 0.00 175.17 175.79 2ai7 h LYS 154 N -0.91 0.00 -0.12 2.11 2.10 -1.91 0.05 116.57 117.90 2ai7 h LYS 154 Ca -0.37 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.28 2ai7 h LYS 154 Cb 1.25 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.58 2ai7 h LYS 154 CO 0.35 0.00 0.00 -0.25 -2.00 0.00 0.00 179.45 177.55 2ai7 n ASP 155 N -3.62 1.67 0.00 7.07 8.00 -1.26 -4.76 116.55 123.64 2ai7 n ASP 155 Ca 0.01 -1.65 0.00 0.00 0.71 0.00 0.00 54.79 53.86 2ai7 n ASP 155 Cb 0.33 -0.07 0.00 0.00 -0.02 0.00 0.00 41.12 41.36 2ai7 n ASP 155 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2ai7 n GLY 156 N 1.16 0.58 3.76 0.44 0.00 0.01 -5.03 105.19 106.10 2ai7 n GLY 156 Ca 0.17 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.79 2ai7 n GLY 156 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2ai7 s GLU 157 N -0.11 4.65 0.12 1.61 0.41 -1.26 -4.80 118.70 119.33 2ai7 s GLU 157 Ca 0.00 1.27 -0.25 0.00 -0.41 0.00 0.00 54.97 55.58 2ai7 s GLU 157 Cb 0.00 -3.29 -0.07 0.00 -1.78 0.00 0.00 34.13 28.99 2ai7 s GLU 157 CO 0.00 0.48 0.75 0.21 -0.49 0.00 0.00 175.26 176.21 2ai7 s LYS 158 N -0.88 4.51 0.01 1.61 2.20 -1.26 -1.44 119.74 124.49 2ai7 s LYS 158 Ca 0.39 1.09 0.05 0.00 -0.36 0.00 0.00 55.97 57.14 2ai7 s LYS 158 Cb -0.24 -3.29 -0.02 0.00 -1.51 0.00 0.00 37.83 32.78 2ai7 s LYS 158 CO 0.28 0.50 -0.16 -1.01 -0.36 0.00 0.00 175.35 174.60 2ai7 s HIS 159 N -0.83 1.39 -0.17 4.03 3.76 0.11 -4.98 115.29 118.60 2ai7 s HIS 159 Ca 0.36 -0.30 -0.01 0.00 -0.15 0.00 0.00 55.06 54.96 2ai7 s HIS 159 Cb -0.22 -0.86 0.05 0.00 1.11 0.00 0.00 32.58 32.65 2ai7 s HIS 159 CO 0.25 0.01 -0.03 0.50 -0.85 0.00 0.00 174.74 174.62 2ai7 s ARG 160 N -0.69 1.22 0.17 1.40 3.52 -1.26 -1.15 118.95 122.16 2ai7 s ARG 160 Ca 0.05 -0.48 0.08 0.00 -0.13 0.00 0.00 55.73 55.25 2ai7 s ARG 160 Cb -0.07 -1.98 -0.04 0.00 -1.56 0.00 0.00 34.95 31.30 2ai7 s ARG 160 CO 0.00 -0.48 -0.17 0.96 -0.81 0.00 0.00 175.30 174.80 2ai7 s ILE 161 N 1.69 1.76 -0.14 4.11 -4.36 -0.15 -4.96 121.20 119.15 2ai7 s ILE 161 Ca 0.00 -1.94 0.00 0.00 -0.26 0.00 0.00 60.65 58.46 2ai7 s ILE 161 Cb -0.16 -1.84 -0.01 0.00 1.25 0.00 0.00 42.46 41.71 2ai7 s ILE 161 CO -0.07 -0.37 -0.15 -0.54 0.24 0.00 0.00 174.94 174.05 2ai7 s LYS 162 N -2.90 3.29 0.16 0.37 1.02 -1.26 -0.20 119.74 120.21 2ai7 s LYS 162 Ca 0.16 -0.73 0.11 0.00 0.02 0.00 0.00 55.97 55.53 2ai7 s LYS 162 Cb -0.05 -2.60 -0.04 0.00 -0.52 0.00 0.00 37.83 34.61 2ai7 s LYS 162 CO 0.06 0.13 -0.25 -0.51 -0.92 0.00 0.00 175.35 173.86 2ai7 s LEU 163 N 0.55 2.39 0.33 3.17 1.43 -0.12 -5.01 118.68 121.41 2ai7 s LEU 163 Ca -0.09 -0.80 -0.01 0.00 -1.03 0.00 0.00 54.13 52.20 2ai7 s LEU 163 Cb -0.16 -1.21 -0.01 0.00 0.03 0.00 0.00 46.19 44.85 2ai7 s LEU 163 CO 0.04 0.15 0.41 -1.59 0.23 0.00 0.00 176.35 175.59 2ai7 s LYS 164 N -2.37 1.83 4.04 1.70 -2.85 -1.26 -2.49 119.74 118.34 2ai7 s LYS 164 Ca 0.18 -1.79 0.00 0.00 -1.00 0.00 0.00 55.97 53.35 2ai7 s LYS 164 Cb -0.09 0.41 0.00 0.00 -2.06 0.00 0.00 37.83 36.09 2ai7 s LYS 164 CO 0.08 -0.74 0.00 0.41 0.10 0.00 0.00 175.35 175.20 2ai7 n GLY 165 N -0.56 2.62 0.23 0.59 0.00 -1.26 -2.24 105.19 104.57 2ai7 n GLY 165 Ca 0.02 -0.23 -0.10 0.00 0.00 0.00 0.00 46.02 45.71 2ai7 n GLY 165 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 2ai7 h TYR 166 N 0.00 0.80 -0.75 1.61 0.99 -1.99 -2.88 116.97 114.75 2ai7 h TYR 166 Ca 0.00 -0.12 0.08 0.00 2.00 0.00 0.00 58.73 60.69 2ai7 h TYR 166 Cb 0.00 -0.22 -0.07 0.00 1.00 0.00 0.00 36.73 37.45 2ai7 h TYR 166 CO 0.00 0.78 0.41 -0.91 -0.00 0.00 0.00 178.16 178.44 2ai7 h ASN 167 N 0.60 0.58 -0.54 3.88 2.35 -1.95 -0.23 115.58 120.27 2ai7 h ASN 167 Ca 0.13 0.05 0.02 0.00 -0.55 0.00 0.00 56.30 55.94 2ai7 h ASN 167 Cb 0.43 -0.06 -0.03 0.00 0.05 0.00 0.00 38.32 38.71 2ai7 h ASN 167 CO 0.01 0.34 0.34 -1.28 -1.65 0.00 0.00 177.43 175.20 2ai7 h SER 168 N 0.71 0.56 -0.09 5.81 0.87 -1.34 -1.36 113.55 118.72 2ai7 h SER 168 Ca 0.36 -0.00 -0.00 0.00 -1.23 0.00 0.00 61.79 60.91 2ai7 h SER 168 Cb 0.32 -0.12 -0.00 0.00 -0.44 0.00 0.00 62.40 62.15 2ai7 h SER 168 CO -0.24 0.40 0.04 0.40 -0.53 0.00 0.00 176.83 176.90 2ai7 h ILE 169 N 0.67 1.11 -0.31 2.23 1.08 -1.06 -2.50 117.51 118.73 2ai7 h ILE 169 Ca 0.21 -0.32 0.01 0.00 -0.39 0.00 0.00 64.86 64.38 2ai7 h ILE 169 Cb -0.02 1.16 -0.02 0.00 -3.07 0.00 0.00 36.82 34.87 2ai7 h ILE 169 CO -0.08 0.09 0.18 0.58 -0.69 0.00 0.00 178.15 178.24 2ai7 h VAL 170 N 0.02 1.04 -0.63 1.67 2.07 -0.81 -1.26 116.25 118.35 2ai7 h VAL 170 Ca 0.03 -0.13 -0.05 0.00 0.82 0.00 0.00 66.70 67.37 2ai7 h VAL 170 Cb 0.11 0.63 -0.03 0.00 -1.52 0.00 0.00 31.29 30.48 2ai7 h VAL 170 CO -0.00 0.07 0.20 0.58 0.02 0.00 0.00 177.57 178.44 2ai7 h VAL 171 N 0.38 1.24 -0.53 2.57 2.07 -1.25 -2.25 116.25 118.47 2ai7 h VAL 171 Ca 0.12 -0.80 -0.08 0.00 0.82 0.00 0.00 66.70 66.76 2ai7 h VAL 171 Cb -0.00 0.53 -0.02 0.00 -1.52 0.00 0.00 31.29 30.28 2ai7 h VAL 171 CO -0.05 0.31 -0.01 1.56 0.02 0.00 0.00 177.57 179.40 2ai7 h GLN 172 N 0.93 0.89 -0.48 1.57 4.20 -1.13 -0.62 115.11 120.48 2ai7 h GLN 172 Ca 0.21 -0.26 0.00 0.00 0.06 0.00 0.00 58.65 58.66 2ai7 h GLN 172 Cb 0.25 -0.09 -0.02 0.00 0.30 0.00 0.00 27.48 27.92 2ai7 h GLN 172 CO -0.01 0.89 0.30 1.25 -0.67 0.00 0.00 178.83 180.59 2ai7 h HIS 173 N 0.83 0.61 -0.38 2.96 2.76 -0.78 -0.51 115.15 120.65 2ai7 h HIS 173 Ca 0.15 0.01 -0.16 0.00 -2.20 0.00 0.00 60.37 58.17 2ai7 h HIS 173 Cb 0.50 -0.20 -0.01 0.00 1.55 0.00 0.00 27.41 29.25 2ai7 h HIS 173 CO 0.03 0.41 -0.38 0.93 -1.30 0.00 0.00 177.93 177.62 2ai7 h GLU 174 N 0.64 0.92 -0.39 5.26 4.39 -1.11 -2.86 114.58 121.43 2ai7 h GLU 174 Ca 0.17 -0.49 -0.03 0.00 0.34 0.00 0.00 59.36 59.35 2ai7 h GLU 174 Cb -0.04 0.02 -0.02 0.00 -0.10 0.00 0.00 28.75 28.61 2ai7 h GLU 174 CO -0.03 1.14 0.09 0.82 -1.16 0.00 0.00 179.01 179.87 2ai7 h ILE 175 N 0.74 1.18 -0.94 3.13 2.04 -0.96 -1.28 117.51 121.43 2ai7 h ILE 175 Ca 0.06 -0.63 0.00 0.00 1.00 0.00 0.00 64.86 65.29 2ai7 h ILE 175 Cb 0.97 0.78 -0.05 0.00 -0.74 0.00 0.00 36.82 37.79 2ai7 h ILE 175 CO 0.09 0.23 0.59 0.44 0.00 0.00 0.00 178.15 179.50 2ai7 h ASP 176 N 0.56 1.10 -0.51 1.72 3.32 -0.88 -2.38 116.42 119.35 2ai7 h ASP 176 Ca 0.13 -0.05 0.04 0.00 0.02 0.00 0.00 57.03 57.17 2ai7 h ASP 176 Cb 0.22 -0.28 -0.04 0.00 0.22 0.00 0.00 39.33 39.45 2ai7 h ASP 176 CO -0.00 0.82 0.28 0.45 -1.72 0.00 0.00 179.24 179.07 2ai7 h HIS 177 N 1.28 0.51 0.00 4.55 3.86 -1.02 0.10 115.15 124.44 2ai7 h HIS 177 Ca 0.34 0.02 0.00 0.00 -1.16 0.00 0.00 60.37 59.57 2ai7 h HIS 177 Cb -0.10 -0.16 0.00 0.00 1.06 0.00 0.00 27.41 28.22 2ai7 h HIS 177 CO 0.00 0.26 0.00 0.44 0.86 0.00 0.00 177.93 179.50 2ai7 n ILE 178 N -4.85 0.20 -0.41 2.45 -5.35 -0.92 -1.65 119.36 108.83 2ai7 n ILE 178 Ca 0.04 0.05 0.05 0.00 -0.27 0.00 0.00 62.75 62.62 2ai7 n ILE 178 Cb 0.12 -0.74 0.12 0.00 -1.74 0.00 0.00 39.64 37.40 2ai7 n ILE 178 CO 0.00 0.00 0.00 0.59 -1.76 0.00 0.00 176.55 175.38 2ai7 n ASN 179 N -1.13 2.74 -1.49 7.28 3.02 -0.11 -1.35 115.26 124.22 2ai7 n ASN 179 Ca 0.12 -2.35 -0.13 0.00 -0.03 0.00 0.00 54.58 52.19 2ai7 n ASN 179 Cb 0.11 -0.25 -0.01 0.00 -0.61 0.00 0.00 39.78 39.02 2ai7 n ASN 179 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2ai7 n GLY 180 N -0.28 -0.10 3.52 7.41 0.00 -0.66 -4.67 105.19 110.41 2ai7 n GLY 180 Ca 0.11 -0.33 -0.33 0.00 0.00 0.00 0.00 46.02 45.46 2ai7 n GLY 180 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2ai7 s ILE 181 N -2.65 3.27 0.11 -0.61 1.01 0.17 -4.53 121.20 117.98 2ai7 s ILE 181 Ca 0.00 -0.69 0.05 0.00 0.00 0.00 0.00 60.65 60.01 2ai7 s ILE 181 Cb 0.00 -2.32 -0.04 0.00 0.01 0.00 0.00 42.46 40.11 2ai7 s ILE 181 CO 0.00 0.56 0.03 -0.04 0.00 0.00 0.00 174.94 175.49 2ai7 s MET 182 N -0.87 2.62 0.31 2.79 -1.94 -1.26 -3.64 119.30 117.31 2ai7 s MET 182 Ca 0.12 -0.86 0.04 0.00 -1.71 0.00 0.00 55.69 53.28 2ai7 s MET 182 Cb -0.11 -2.55 0.66 0.00 2.01 0.00 0.00 34.83 34.84 2ai7 s MET 182 CO 0.02 0.52 1.84 0.27 -0.01 0.00 0.00 175.02 177.66 2ai7 h PHE 183 N 3.15 1.03 0.00 -0.03 -5.15 -1.96 -0.21 116.94 113.78 2ai7 h PHE 183 Ca -0.47 0.03 0.00 0.00 -0.20 0.00 0.00 57.97 57.33 2ai7 h PHE 183 Cb 1.18 -0.33 0.00 0.00 0.22 0.00 0.00 35.95 37.02 2ai7 h PHE 183 CO 0.60 0.38 0.00 2.48 -2.00 0.00 0.00 178.31 179.77 2ai7 n TYR 184 N -4.62 0.00 0.41 6.09 0.18 -1.26 -1.92 117.16 116.04 2ai7 n TYR 184 Ca 0.19 0.00 0.13 0.00 1.88 0.00 0.00 57.90 60.10 2ai7 n TYR 184 Cb 0.42 -0.24 0.43 0.00 -0.38 0.00 0.00 39.34 39.57 2ai7 n TYR 184 CO 0.00 0.00 0.00 -0.44 -2.08 0.00 0.00 176.86 174.34 2ai7 h ASP 185 N 0.00 0.00 -0.43 9.48 3.32 -1.44 -3.14 116.42 124.21 2ai7 h ASP 185 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 2ai7 h ASP 185 Cb 0.13 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.68 2ai7 h ASP 185 CO 0.00 0.00 0.00 0.54 -1.72 0.00 0.00 179.24 178.06 2ai7 n ARG 186 N -2.61 3.10 -3.68 3.56 1.74 -0.81 -4.96 116.66 113.00 2ai7 n ARG 186 Ca 0.03 -2.50 -0.38 0.00 -0.77 0.00 0.00 57.85 54.24 2ai7 n ARG 186 Cb 0.38 -1.58 -0.06 0.00 -1.02 0.00 0.00 32.46 30.17 2ai7 n ARG 186 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 2ai7 s ILE 187 N -1.64 5.25 -0.22 0.55 1.01 -1.19 -1.57 121.20 123.39 2ai7 s ILE 187 Ca 0.37 0.54 -0.29 0.00 0.00 0.00 0.00 60.65 61.27 2ai7 s ILE 187 Cb 0.24 -3.56 -0.03 0.00 0.01 0.00 0.00 42.46 39.11 2ai7 s ILE 187 CO 0.18 0.60 1.76 0.21 0.00 0.00 0.00 174.94 177.69 2ai7 s ASN 188 N -1.06 6.16 0.10 3.58 3.84 -1.26 -4.91 114.94 121.38 2ai7 s ASN 188 Ca 0.20 1.66 -0.33 0.00 0.21 0.00 0.00 52.86 54.60 2ai7 s ASN 188 Cb -0.14 -2.53 -0.14 0.00 -0.55 0.00 0.00 41.25 37.89 2ai7 s ASN 188 CO 0.09 -1.43 1.58 -0.33 -2.79 0.00 0.00 177.10 174.22 2ai7 h GLU 189 N 11.75 -0.78 0.01 0.43 5.08 -1.95 -2.33 114.58 126.78 2ai7 h GLU 189 Ca -0.36 0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.05 2ai7 h GLU 189 Cb 1.17 0.18 -0.00 0.00 0.50 0.00 0.00 28.75 30.60 2ai7 h GLU 189 CO 1.00 -0.52 -0.03 0.87 -1.00 0.00 0.00 179.01 179.33 2ai7 h LYS 190 N -0.81 -0.04 -4.38 2.33 6.56 -2.06 -3.37 116.57 114.80 2ai7 h LYS 190 Ca -0.02 0.00 -0.67 0.00 -1.06 0.00 0.00 60.65 58.91 2ai7 h LYS 190 Cb 0.76 0.01 -0.39 0.00 -0.57 0.00 0.00 32.23 32.04 2ai7 h LYS 190 CO -0.14 -0.02 -0.65 0.34 -2.06 0.00 0.00 179.45 176.91 2ai7 s ASP 191 N -2.55 4.82 0.55 0.86 -1.08 -1.23 -4.98 116.67 113.07 2ai7 s ASP 191 Ca -0.01 -2.31 0.29 0.00 -0.52 0.00 0.00 52.55 50.01 2ai7 s ASP 191 Cb 0.00 -1.68 1.46 0.00 -1.46 0.00 0.00 42.92 41.24 2ai7 s ASP 191 CO 0.03 -0.39 1.91 -0.65 0.52 0.00 0.00 175.17 176.60 2ai7 h PRO 192 N 7.49 0.00 -0.24 4.34 0.11 -1.60 -1.80 132.00 140.31 2ai7 h PRO 192 Ca -0.06 0.00 -0.10 0.00 0.11 0.00 0.00 66.00 65.95 2ai7 h PRO 192 Cb 1.00 0.00 -0.06 0.00 0.11 0.00 0.00 31.00 32.05 2ai7 h PRO 192 CO 0.59 0.00 -0.14 1.19 -0.21 0.00 0.00 178.00 179.43 2ai7 n PHE 193 N -4.10 0.75 -2.37 0.65 3.01 -1.26 -0.83 117.46 113.31 2ai7 n PHE 193 Ca 0.13 -1.41 -0.40 0.00 1.01 0.00 0.00 57.45 56.77 2ai7 n PHE 193 Cb 0.79 -0.39 -0.04 0.00 -0.01 0.00 0.00 39.48 39.83 2ai7 n PHE 193 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2ai7 s ALA 194 N -3.15 3.43 -0.67 4.37 0.00 -0.68 -4.99 121.76 120.08 2ai7 s ALA 194 Ca 0.42 1.00 -0.05 0.00 0.00 0.00 0.00 51.96 53.32 2ai7 s ALA 194 Cb 0.38 -3.37 0.17 0.00 0.00 0.00 0.00 23.12 20.30 2ai7 s ALA 194 CO 0.00 -0.30 0.51 0.14 0.00 0.00 0.00 175.76 176.11 2ai7 s VAL 195 N -1.07 4.15 0.84 0.00 -7.23 -1.26 -4.98 120.40 110.85 2ai7 s VAL 195 Ca 0.46 -2.84 -0.11 0.00 -1.81 0.00 0.00 61.98 57.68 2ai7 s VAL 195 Cb -0.34 -3.66 0.10 0.00 0.56 0.00 0.00 36.38 33.03 2ai7 s VAL 195 CO 0.44 -0.91 1.09 -0.75 -0.31 0.00 0.00 175.10 174.66 2ai7 s LYS 196 N -0.00 1.68 0.26 4.82 2.20 -1.26 -4.93 119.74 122.50 2ai7 s LYS 196 Ca 0.17 1.02 -0.30 0.00 -0.36 0.00 0.00 55.97 56.50 2ai7 s LYS 196 Cb -0.18 -1.84 -0.11 0.00 -1.51 0.00 0.00 37.83 34.19 2ai7 s LYS 196 CO -0.05 -2.01 1.50 0.34 -0.36 0.00 0.00 175.35 174.78 2ai7 s ASP 197 N -3.36 6.55 0.00 1.43 2.15 -1.26 -2.14 116.67 120.04 2ai7 s ASP 197 Ca 0.63 2.77 0.00 0.00 0.43 0.00 0.00 52.55 56.38 2ai7 s ASP 197 Cb -0.18 -2.63 0.00 0.00 -0.30 0.00 0.00 42.92 39.81 2ai7 s ASP 197 CO 0.57 -0.79 0.00 0.61 -0.17 0.00 0.00 175.17 175.39 2ai7 n GLY 198 N 2.25 0.70 3.61 2.66 0.00 -1.26 -4.96 105.19 108.19 2ai7 n GLY 198 Ca 0.08 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.71 2ai7 n GLY 198 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2ai7 s LEU 199 N 0.00 4.04 -0.41 0.99 2.96 -0.91 -1.02 118.68 124.33 2ai7 s LEU 199 Ca 0.00 0.14 -0.16 0.00 -0.22 0.00 0.00 54.13 53.89 2ai7 s LEU 199 Cb 0.00 -2.25 0.02 0.00 0.50 0.00 0.00 46.19 44.45 2ai7 s LEU 199 CO 0.00 -0.09 0.37 -0.22 -1.32 0.00 0.00 176.35 175.08 2ai7 s LEU 200 N 1.80 4.92 -0.23 -0.68 2.96 0.10 -4.90 118.68 122.65 2ai7 s LEU 200 Ca 0.11 -0.72 -0.26 0.00 -0.22 0.00 0.00 54.13 53.04 2ai7 s LEU 200 Cb -0.16 -2.28 -0.00 0.00 0.50 0.00 0.00 46.19 44.25 2ai7 s LEU 200 CO 0.10 -0.49 0.87 -0.63 -1.32 0.00 0.00 176.35 174.88 2ai7 s ILE 201 N 1.92 4.81 -0.18 6.68 -1.09 -1.26 -1.35 121.20 130.73 2ai7 s ILE 201 Ca 0.09 1.67 -0.22 0.00 -2.23 0.00 0.00 60.65 59.96 2ai7 s ILE 201 Cb -0.18 -4.16 -0.03 0.00 -1.58 0.00 0.00 42.46 36.52 2ai7 s ILE 201 CO 0.12 -0.09 0.66 -0.76 -1.23 0.00 0.00 174.94 173.64 2ai7 s LEU 202 N 2.87 4.17 0.00 2.97 1.43 0.79 -4.86 118.68 126.06 2ai7 s LEU 202 Ca 0.37 0.92 0.00 0.00 -1.03 0.00 0.00 54.13 54.39 2ai7 s LEU 202 Cb -0.15 -2.95 0.00 0.00 0.03 0.00 0.00 46.19 43.11 2ai7 s LEU 202 CO 0.07 -0.26 0.00 -0.62 0.23 0.00 0.00 176.35 175.77