#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2i9y s GLU 18 N 0.00 4.48 -0.32 -2.82 2.02 -1.26 -4.98 118.70 115.81 2i9y s GLU 18 Ca 0.00 1.37 0.03 0.00 0.02 0.00 0.00 54.97 56.38 2i9y s GLU 18 Cb 0.00 -3.50 0.16 0.00 0.10 0.00 0.00 34.13 30.89 2i9y s GLU 18 CO 0.00 -0.18 0.42 0.00 0.02 0.00 0.00 175.26 175.51 2i9y s ALA 19 N 1.53 -1.07 0.10 5.21 0.00 -1.26 -5.04 121.76 121.23 2i9y s ALA 19 Ca 0.49 -0.14 -0.21 0.00 0.00 0.00 0.00 51.96 52.11 2i9y s ALA 19 Cb -0.19 -2.13 -0.10 0.00 0.00 0.00 0.00 23.12 20.70 2i9y s ALA 19 CO 0.22 -1.90 1.70 0.77 0.00 0.00 0.00 175.76 176.54 2i9y h SER 20 N 7.76 0.18 0.26 0.00 0.02 -1.96 -2.56 113.55 117.25 2i9y h SER 20 Ca -0.04 -0.08 0.00 0.00 -0.84 0.00 0.00 61.79 60.83 2i9y h SER 20 Cb 1.11 -0.05 0.00 0.00 0.14 0.00 0.00 62.40 63.60 2i9y h SER 20 CO 0.24 0.21 -0.32 -0.24 -1.14 0.00 0.00 176.83 175.58 2i9y n SER 21 N -4.93 1.00 -2.19 3.07 2.88 -1.26 -4.93 113.62 107.25 2i9y n SER 21 Ca -0.04 -0.83 -0.18 0.00 -1.33 0.00 0.00 58.87 56.49 2i9y n SER 21 Cb 0.07 0.18 -0.03 0.00 -0.75 0.00 0.00 64.21 63.69 2i9y n SER 21 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 2i9y n LEU 22 N -0.76 -1.60 -4.73 2.46 4.77 -0.97 -4.74 117.00 111.44 2i9y n LEU 22 Ca 0.11 0.15 -0.40 0.00 -0.03 0.00 0.00 56.01 55.84 2i9y n LEU 22 Cb 0.35 -2.66 -0.05 0.00 -2.33 0.00 0.00 43.42 38.73 2i9y n LEU 22 CO 0.28 -0.38 0.39 -0.69 -1.33 0.00 0.00 177.39 175.66 2i9y s VAL 23 N -2.81 4.95 0.09 4.08 1.01 -1.26 -0.42 120.40 126.03 2i9y s VAL 23 Ca 0.00 1.44 0.04 0.00 0.00 0.00 0.00 61.98 63.47 2i9y s VAL 23 Cb 0.00 -4.03 -0.03 0.00 0.00 0.00 0.00 36.38 32.31 2i9y s VAL 23 CO 0.00 0.31 -0.12 -0.83 0.00 0.00 0.00 175.10 174.46 2i9y s GLY 24 N 0.42 0.86 -0.03 4.51 0.00 0.55 -4.97 107.32 108.66 2i9y s GLY 24 Ca 0.36 -1.11 -0.07 0.00 0.00 0.00 0.00 44.72 43.90 2i9y s GLY 24 CO 0.19 -1.16 0.17 -1.59 0.00 0.00 0.00 173.10 170.71 2i9y s LYS 25 N -2.31 0.38 -0.01 2.90 0.00 -1.26 -0.73 119.74 118.72 2i9y s LYS 25 Ca 0.02 -0.11 0.01 0.00 0.00 0.00 0.00 55.97 55.90 2i9y s LYS 25 Cb -0.06 0.17 0.00 0.00 0.00 0.00 0.00 37.83 37.93 2i9y s LYS 25 CO 0.01 -0.08 -0.03 -1.17 0.00 0.00 0.00 175.35 174.08 2i9y s LEU 26 N -0.75 1.93 -0.02 2.77 2.96 0.84 -4.99 118.68 121.41 2i9y s LEU 26 Ca -0.08 -0.06 0.03 0.00 -0.22 0.00 0.00 54.13 53.79 2i9y s LEU 26 Cb -0.05 -0.19 0.00 0.00 0.50 0.00 0.00 46.19 46.46 2i9y s LEU 26 CO 0.01 0.03 -0.09 -1.61 -1.32 0.00 0.00 176.35 173.37 2i9y s GLU 27 N 0.02 0.95 0.20 1.98 2.02 -1.26 0.24 118.70 122.85 2i9y s GLU 27 Ca 0.00 -0.31 -0.07 0.00 0.02 0.00 0.00 54.97 54.62 2i9y s GLU 27 Cb -0.03 -0.89 -0.02 0.00 0.10 0.00 0.00 34.13 33.29 2i9y s GLU 27 CO -0.00 0.12 0.27 -0.08 0.02 0.00 0.00 175.26 175.59 2i9y s THR 28 N 0.17 0.02 -0.00 3.63 -1.32 -0.80 -5.02 115.64 112.32 2i9y s THR 28 Ca -0.03 -1.66 0.02 0.00 -1.21 0.00 0.00 61.69 58.81 2i9y s THR 28 Cb -0.08 -2.22 -0.01 0.00 -1.51 0.00 0.00 72.50 68.68 2i9y s THR 28 CO 0.00 -0.11 -0.07 1.51 -2.21 0.00 0.00 174.62 173.74 2i9y s ASP 29 N -3.06 0.87 0.04 8.08 -4.77 -1.26 -0.68 116.67 115.88 2i9y s ASP 29 Ca 0.27 -0.16 0.06 0.00 -3.30 0.00 0.00 52.55 49.42 2i9y s ASP 29 Cb 0.04 -0.09 -0.02 0.00 -1.09 0.00 0.00 42.92 41.76 2i9y s ASP 29 CO 0.07 0.07 -0.17 -0.69 0.70 0.00 0.00 175.17 175.16 2i9y s VAL 30 N -0.25 1.33 -0.21 2.11 1.01 -0.76 -4.99 120.40 118.66 2i9y s VAL 30 Ca 0.02 -1.06 -0.09 0.00 0.00 0.00 0.00 61.98 60.86 2i9y s VAL 30 Cb -0.03 -1.18 -0.04 0.00 0.00 0.00 0.00 36.38 35.12 2i9y s VAL 30 CO -0.00 0.10 0.10 -1.61 0.00 0.00 0.00 175.10 173.69 2i9y s GLU 31 N -1.11 4.01 0.02 2.72 8.01 -1.26 -0.52 118.70 130.57 2i9y s GLU 31 Ca 0.04 -0.31 -0.02 0.00 0.01 0.00 0.00 54.97 54.69 2i9y s GLU 31 Cb -0.08 -3.35 -0.04 0.00 -4.31 0.00 0.00 34.13 26.35 2i9y s GLU 31 CO 0.01 0.18 0.20 0.96 0.01 0.00 0.00 175.26 176.63 2i9y s ILE 32 N 0.66 5.41 -0.79 -1.63 -4.36 0.41 -4.95 121.20 115.94 2i9y s ILE 32 Ca 0.05 -0.21 0.13 0.00 -0.26 0.00 0.00 60.65 60.37 2i9y s ILE 32 Cb -0.13 -3.57 0.64 0.00 1.25 0.00 0.00 42.46 40.65 2i9y s ILE 32 CO 0.01 0.26 1.50 0.29 0.24 0.00 0.00 174.94 177.25 2i9y n LYS 33 N 0.72 3.75 -4.54 0.37 4.01 -1.26 -1.05 118.16 120.17 2i9y n LYS 33 Ca -0.09 -2.48 -0.25 0.00 -0.51 0.00 0.00 58.31 54.97 2i9y n LYS 33 Cb 0.52 -1.97 -0.11 0.00 -0.51 0.00 0.00 35.03 32.97 2i9y n LYS 33 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 2i9y s ALA 34 N -2.13 2.87 0.31 7.82 0.00 -1.26 -4.27 121.76 125.10 2i9y s ALA 34 Ca 0.44 -2.12 -0.27 0.00 0.00 0.00 0.00 51.96 50.00 2i9y s ALA 34 Cb 0.31 0.11 -0.09 0.00 0.00 0.00 0.00 23.12 23.45 2i9y s ALA 34 CO 0.17 -0.03 0.98 -1.12 0.00 0.00 0.00 175.76 175.76 2i9y s SER 35 N -3.60 7.32 0.56 0.00 0.01 -1.08 -3.50 113.70 113.42 2i9y s SER 35 Ca 0.33 1.96 0.24 0.00 1.31 0.00 0.00 55.95 59.79 2i9y s SER 35 Cb 0.05 -2.60 1.54 0.00 0.21 0.00 0.00 66.02 65.23 2i9y s SER 35 CO 0.16 -0.08 2.15 0.00 0.41 0.00 0.00 173.24 175.88 2i9y h ALA 36 N 3.42 1.88 -0.13 1.44 0.00 -1.88 -1.06 119.26 122.92 2i9y h ALA 36 Ca -0.47 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.43 2i9y h ALA 36 Cb 1.20 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.99 2i9y h ALA 36 CO 0.66 -0.16 0.05 -0.44 0.00 0.00 0.00 179.25 179.36 2i9y h ASP 37 N 0.00 0.16 0.09 0.00 5.19 -1.94 -1.77 116.42 118.14 2i9y h ASP 37 Ca 0.05 -0.01 -0.10 0.00 -0.62 0.00 0.00 57.03 56.35 2i9y h ASP 37 Cb 0.25 -0.04 -0.01 0.00 0.18 0.00 0.00 39.33 39.71 2i9y h ASP 37 CO -0.00 0.15 -0.35 0.11 -3.12 0.00 0.00 179.24 176.03 2i9y h LYS 38 N 0.18 0.36 -0.47 3.56 1.57 -1.58 0.18 116.57 120.37 2i9y h LYS 38 Ca 0.05 -0.16 -0.11 0.00 -1.87 0.00 0.00 60.65 58.56 2i9y h LYS 38 Cb 0.04 -0.01 -0.02 0.00 0.08 0.00 0.00 32.23 32.33 2i9y h LYS 38 CO -0.01 0.67 -0.16 0.35 -0.57 0.00 0.00 179.45 179.74 2i9y h PHE 39 N 0.31 1.02 -0.72 -1.35 3.57 -1.45 -2.48 116.94 115.83 2i9y h PHE 39 Ca 0.04 -0.22 -0.06 0.00 3.53 0.00 0.00 57.97 61.26 2i9y h PHE 39 Cb 0.77 -0.25 -0.03 0.00 2.79 0.00 0.00 35.95 39.23 2i9y h PHE 39 CO 0.02 0.99 0.23 1.25 -2.23 0.00 0.00 178.31 178.57 2i9y h HIS 40 N 0.80 1.15 -0.84 0.41 2.76 -0.72 -2.47 115.15 116.24 2i9y h HIS 40 Ca 0.12 -0.11 0.03 0.00 -2.20 0.00 0.00 60.37 58.21 2i9y h HIS 40 Cb 0.70 -0.34 -0.05 0.00 1.55 0.00 0.00 27.41 29.28 2i9y h HIS 40 CO 0.04 0.90 0.56 0.45 -1.30 0.00 0.00 177.93 178.58 2i9y h HIS 41 N 1.07 1.02 -0.01 5.26 3.86 -0.58 -0.43 115.15 125.35 2i9y h HIS 41 Ca 0.24 0.02 0.00 0.00 -1.16 0.00 0.00 60.37 59.47 2i9y h HIS 41 Cb 0.29 -0.34 -0.00 0.00 1.06 0.00 0.00 27.41 28.41 2i9y h HIS 41 CO 0.02 0.61 0.01 0.52 0.86 0.00 0.00 177.93 179.95 2i9y h MET 42 N 1.07 0.00 0.00 2.45 2.07 -1.01 0.12 114.93 119.63 2i9y h MET 42 Ca 0.33 0.00 -0.34 0.00 -2.07 0.00 0.00 59.70 57.61 2i9y h MET 42 Cb -0.02 0.00 -0.06 0.00 -1.87 0.00 0.00 31.60 29.65 2i9y h MET 42 CO -0.09 0.00 -2.30 0.34 1.07 0.00 0.00 176.91 175.93 2i9y n PHE 43 N -4.03 0.00 0.11 -0.22 7.35 -0.83 -3.84 117.46 115.99 2i9y n PHE 43 Ca -0.03 0.00 -0.20 0.00 -0.76 0.00 0.00 57.45 56.46 2i9y n PHE 43 Cb 0.09 -0.92 -0.15 0.00 0.35 0.00 0.00 39.48 38.86 2i9y n PHE 43 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 2i9y h ALA 44 N 0.74 0.05 -0.80 3.13 0.00 -0.82 -3.43 119.26 118.14 2i9y h ALA 44 Ca -0.51 -0.95 -0.10 0.00 0.00 0.00 0.00 54.91 53.34 2i9y h ALA 44 Cb 2.09 0.17 -0.16 0.00 0.00 0.00 0.00 17.79 19.89 2i9y h ALA 44 CO 0.01 0.92 -0.40 0.20 0.00 0.00 0.00 179.25 179.98 2i9y s GLY 45 N -4.75 -1.42 0.10 0.00 0.00 0.37 -5.07 107.32 96.56 2i9y s GLY 45 Ca -0.08 -0.13 -0.35 0.00 0.00 0.00 0.00 44.72 44.15 2i9y s GLY 45 CO 0.90 3.82 1.12 0.58 0.00 0.00 0.00 173.10 179.52 2i9y n LYS 46 N 2.93 0.72 -0.02 2.90 0.00 -0.99 -4.56 118.16 119.12 2i9y n LYS 46 Ca 0.16 0.26 0.10 0.00 -0.00 0.00 0.00 58.31 58.83 2i9y n LYS 46 Cb 0.58 -1.75 0.52 0.00 -0.00 0.00 0.00 35.03 34.39 2i9y n LYS 46 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.40 177.05 2i9y n PRO 47 N 1.82 1.25 -3.62 -1.58 -0.04 -1.26 -4.44 135.00 127.14 2i9y n PRO 47 Ca 0.18 -0.38 -0.29 0.00 -0.04 0.00 0.00 63.50 62.97 2i9y n PRO 47 Cb 0.18 -1.34 -0.13 0.00 -0.04 0.00 0.00 33.50 32.17 2i9y n PRO 47 CO 0.00 0.00 0.00 -1.58 -0.04 0.00 0.00 175.50 173.88 2i9y s HIS 48 N -1.94 1.30 0.16 0.54 5.04 -1.26 -4.73 115.29 114.40 2i9y s HIS 48 Ca 0.31 -1.81 -0.04 0.00 -1.54 0.00 0.00 55.06 51.98 2i9y s HIS 48 Cb 0.15 -1.41 -0.05 0.00 0.04 0.00 0.00 32.58 31.31 2i9y s HIS 48 CO 0.24 -0.83 0.38 -3.38 -2.34 0.00 0.00 174.74 168.82 2i9y s HIS 49 N 1.10 3.48 -0.67 3.88 -3.43 -1.26 -5.04 115.29 113.35 2i9y s HIS 49 Ca 0.15 0.52 -0.16 0.00 -0.80 0.00 0.00 55.06 54.77 2i9y s HIS 49 Cb -0.21 -1.98 0.15 0.00 -1.43 0.00 0.00 32.58 29.11 2i9y s HIS 49 CO -0.10 0.41 0.67 0.14 -2.00 0.00 0.00 174.74 173.87 2i9y s VAL 50 N -1.71 5.22 -0.32 -5.38 -7.23 -1.26 -4.92 120.40 104.80 2i9y s VAL 50 Ca 0.41 -1.71 -0.01 0.00 -1.81 0.00 0.00 61.98 58.86 2i9y s VAL 50 Cb -0.12 -4.45 0.13 0.00 0.56 0.00 0.00 36.38 32.51 2i9y s VAL 50 CO 0.26 -1.02 0.25 -0.44 -0.31 0.00 0.00 175.10 173.83 2i9y s SER 51 N 3.15 2.35 0.23 4.85 0.01 -1.26 -4.92 113.70 118.11 2i9y s SER 51 Ca 0.12 -1.32 0.00 0.00 1.31 0.00 0.00 55.95 56.06 2i9y s SER 51 Cb -0.21 0.11 0.00 0.00 0.21 0.00 0.00 66.02 66.13 2i9y s SER 51 CO -0.01 -0.37 0.00 1.17 0.41 0.00 0.00 173.24 174.45 2i9y n LYS 52 N 4.86 0.00 -1.89 12.44 4.81 -1.26 -5.15 118.16 131.98 2i9y n LYS 52 Ca 0.02 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.46 2i9y n LYS 52 Cb 0.43 -0.13 0.00 0.00 0.02 0.00 0.00 35.03 35.35 2i9y n LYS 52 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2i9y n ALA 53 N -3.43 -2.23 -1.83 3.14 0.00 -1.26 -4.92 120.51 109.98 2i9y n ALA 53 Ca 0.00 0.38 -0.42 0.00 0.00 0.00 0.00 53.44 53.41 2i9y n ALA 53 Cb 0.01 -1.21 -0.02 0.00 0.00 0.00 0.00 19.45 18.22 2i9y n ALA 53 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 2i9y s SER 54 N -0.44 6.51 -0.03 0.00 1.04 -1.26 -4.91 113.70 114.61 2i9y s SER 54 Ca 0.00 2.78 -0.32 0.00 0.48 0.00 0.00 55.95 58.89 2i9y s SER 54 Cb 0.00 -2.62 -0.10 0.00 0.10 0.00 0.00 66.02 63.40 2i9y s SER 54 CO 0.00 -0.83 1.94 -2.65 0.98 0.00 0.00 173.24 172.68 2i9y n PRO 55 N 2.72 2.52 0.00 4.02 -0.02 -1.26 -3.12 135.00 139.86 2i9y n PRO 55 Ca 0.09 0.92 0.00 0.00 -2.02 0.00 0.00 63.50 62.49 2i9y n PRO 55 Cb 0.38 -2.84 0.00 0.00 -0.02 0.00 0.00 33.50 31.03 2i9y n PRO 55 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2i9y n GLY 56 N 4.52 0.63 3.20 -1.23 0.00 -1.26 -5.13 105.19 105.91 2i9y n GLY 56 Ca 0.22 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.15 2i9y n GLY 56 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2i9y s ASN 57 N -1.06 0.16 0.40 1.61 3.84 -1.18 -5.02 114.94 113.68 2i9y s ASN 57 Ca 0.00 -0.69 0.11 0.00 0.21 0.00 0.00 52.86 52.49 2i9y s ASN 57 Cb 0.00 0.33 0.83 0.00 -0.55 0.00 0.00 41.25 41.86 2i9y s ASN 57 CO 0.00 -0.72 1.92 0.40 -2.79 0.00 0.00 177.10 175.92 2i9y h ILE 58 N 2.79 1.18 -3.86 -5.21 2.04 -2.00 -3.48 117.51 108.96 2i9y h ILE 58 Ca -0.34 -0.80 0.00 0.00 1.00 0.00 0.00 64.86 64.72 2i9y h ILE 58 Cb 1.19 1.31 -0.04 0.00 -0.74 0.00 0.00 36.82 38.55 2i9y h ILE 58 CO 0.57 0.24 -0.58 0.00 0.00 0.00 0.00 178.15 178.38 2i9y n GLN 59 N -4.27 -1.77 0.03 2.37 6.02 -1.26 -5.06 117.38 113.44 2i9y n GLN 59 Ca -0.01 1.64 -0.01 0.00 -0.01 0.00 0.00 57.00 58.61 2i9y n GLN 59 Cb 0.28 -2.77 -0.00 0.00 1.02 0.00 0.00 30.24 28.77 2i9y n GLN 59 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2i9y n GLY 60 N 0.55 -0.08 2.42 1.08 0.00 -1.26 -5.00 105.19 102.90 2i9y n GLY 60 Ca -0.11 -0.03 -0.20 0.00 0.00 0.00 0.00 46.02 45.68 2i9y n GLY 60 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2i9y h ASP 62 N 0.00 0.00 -3.18 0.00 3.58 -1.97 -3.42 116.42 111.43 2i9y h ASP 62 Ca -0.48 0.00 -0.57 0.00 0.42 0.00 0.00 57.03 56.41 2i9y h ASP 62 Cb 1.36 0.00 -0.05 0.00 1.72 0.00 0.00 39.33 42.36 2i9y h ASP 62 CO 0.58 0.72 1.08 -0.76 -2.88 0.00 0.00 179.24 177.97 2i9y s LEU 63 N -7.03 3.64 -0.07 2.28 1.43 -1.26 -4.96 118.68 112.71 2i9y s LEU 63 Ca 0.01 0.97 -0.30 0.00 -1.03 0.00 0.00 54.13 53.78 2i9y s LEU 63 Cb 0.11 -3.54 -0.03 0.00 0.03 0.00 0.00 46.19 42.76 2i9y s LEU 63 CO 0.77 -1.39 1.29 -2.28 0.23 0.00 0.00 176.35 174.97 2i9y s HIS 64 N 5.38 2.95 0.10 0.29 5.65 -1.26 -5.01 115.29 123.39 2i9y s HIS 64 Ca 0.63 1.01 0.03 0.00 0.25 0.00 0.00 55.06 56.98 2i9y s HIS 64 Cb -0.15 -3.52 -0.04 0.00 -1.18 0.00 0.00 32.58 27.68 2i9y s HIS 64 CO 0.31 -1.81 -0.08 -2.00 -0.65 0.00 0.00 174.74 170.51 2i9y s GLU 65 N 2.71 0.87 0.00 2.88 2.12 -1.26 -4.81 118.70 121.21 2i9y s GLU 65 Ca 0.58 -1.29 0.00 0.00 0.36 0.00 0.00 54.97 54.63 2i9y s GLU 65 Cb -0.26 -0.37 0.00 0.00 0.26 0.00 0.00 34.13 33.76 2i9y s GLU 65 CO 0.21 0.03 0.00 0.41 -0.54 0.00 0.00 175.26 175.37 2i9y n GLY 66 N 0.15 1.72 3.64 -1.50 0.00 -1.26 -4.67 105.19 103.26 2i9y n GLY 66 Ca -0.13 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 45.86 2i9y n GLY 66 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 2i9y s ASP 67 N -1.91 -0.06 -0.01 1.61 -4.77 -1.26 -5.04 116.67 105.23 2i9y s ASP 67 Ca 0.00 0.06 0.15 0.00 -3.30 0.00 0.00 52.55 49.46 2i9y s ASP 67 Cb 0.00 0.05 -0.21 0.00 -1.09 0.00 0.00 42.92 41.67 2i9y s ASP 67 CO 0.00 -0.06 0.43 0.79 0.70 0.00 0.00 175.17 177.03 2i9y n TRP 68 N 0.46 0.00 -0.31 2.11 7.02 -1.26 -4.99 117.44 120.47 2i9y n TRP 68 Ca -0.00 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.48 2i9y n TRP 68 Cb 0.59 -0.23 0.00 0.00 -2.42 0.00 0.00 31.31 29.24 2i9y n TRP 68 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 2i9y n GLY 69 N 1.54 1.68 3.46 6.99 0.00 -1.26 -5.02 105.19 112.58 2i9y n GLY 69 Ca -0.01 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.70 2i9y n GLY 69 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2i9y s THR 70 N -3.05 2.84 0.19 2.61 -4.23 -1.26 -5.10 115.64 107.64 2i9y s THR 70 Ca 0.00 -1.11 -0.30 0.00 -1.18 0.00 0.00 61.69 59.10 2i9y s THR 70 Cb 0.00 -2.18 -0.08 0.00 1.34 0.00 0.00 72.50 71.58 2i9y s THR 70 CO 0.00 0.38 1.21 -0.69 -0.54 0.00 0.00 174.62 174.98 2i9y s VAL 71 N -0.90 3.49 0.00 2.29 1.01 -1.26 -2.89 120.40 122.15 2i9y s VAL 71 Ca 0.14 1.27 0.00 0.00 0.00 0.00 0.00 61.98 63.39 2i9y s VAL 71 Cb -0.11 -3.81 0.00 0.00 0.00 0.00 0.00 36.38 32.47 2i9y s VAL 71 CO 0.05 0.21 0.00 0.61 0.00 0.00 0.00 175.10 175.96 2i9y n GLY 72 N 2.14 0.49 3.81 4.51 0.00 -0.47 -5.03 105.19 110.64 2i9y n GLY 72 Ca 0.04 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.74 2i9y n GLY 72 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2i9y s SER 73 N -2.94 5.81 -0.24 1.61 1.04 -1.14 -4.63 113.70 113.21 2i9y s SER 73 Ca 0.00 1.79 -0.01 0.00 0.48 0.00 0.00 55.95 58.21 2i9y s SER 73 Cb 0.00 -2.53 0.02 0.00 0.10 0.00 0.00 66.02 63.61 2i9y s SER 73 CO 0.00 -1.15 -0.08 -0.63 0.98 0.00 0.00 173.24 172.37 2i9y s ILE 74 N -2.49 2.82 0.29 -1.02 1.01 -1.26 -1.14 121.20 119.40 2i9y s ILE 74 Ca 0.63 -0.98 0.06 0.00 0.00 0.00 0.00 60.65 60.36 2i9y s ILE 74 Cb -0.16 -2.40 -0.06 0.00 0.01 0.00 0.00 42.46 39.86 2i9y s ILE 74 CO 0.38 0.25 -0.02 0.68 0.00 0.00 0.00 174.94 176.22 2i9y s VAL 75 N 1.33 1.47 0.08 2.92 -7.23 -1.26 -5.02 120.40 112.69 2i9y s VAL 75 Ca 0.01 -2.08 0.08 0.00 -1.81 0.00 0.00 61.98 58.18 2i9y s VAL 75 Cb -0.16 -2.53 -0.03 0.00 0.56 0.00 0.00 36.38 34.22 2i9y s VAL 75 CO -0.05 -0.23 -0.21 -0.36 -0.31 0.00 0.00 175.10 173.94 2i9y s PHE 76 N -3.12 1.79 -0.17 2.82 0.08 -1.26 -4.25 117.98 113.87 2i9y s PHE 76 Ca 0.31 -0.40 -0.05 0.00 0.12 0.00 0.00 56.93 56.90 2i9y s PHE 76 Cb 0.05 -1.01 -0.03 0.00 -0.57 0.00 0.00 43.02 41.46 2i9y s PHE 76 CO 0.12 0.16 0.01 -1.58 -0.10 0.00 0.00 175.22 173.84 2i9y s TRP 77 N -1.02 3.14 -0.16 0.36 0.52 -1.24 -4.97 118.94 115.57 2i9y s TRP 77 Ca 0.07 -0.10 -0.07 0.00 0.02 0.00 0.00 56.10 56.02 2i9y s TRP 77 Cb -0.09 -2.01 -0.04 0.00 -1.15 0.00 0.00 33.47 30.17 2i9y s TRP 77 CO 0.03 0.08 0.08 -0.80 0.02 0.00 0.00 176.95 176.36 2i9y s ASN 78 N 0.32 5.81 0.03 2.95 0.01 -1.26 -2.28 114.94 120.52 2i9y s ASN 78 Ca -0.00 0.18 -0.05 0.00 -0.71 0.00 0.00 52.86 52.28 2i9y s ASN 78 Cb -0.13 -1.94 -0.01 0.00 0.41 0.00 0.00 41.25 39.57 2i9y s ASN 78 CO 0.02 0.24 0.08 -0.72 -1.51 0.00 0.00 177.10 175.20 2i9y s TYR 79 N -0.02 0.22 -0.23 2.20 1.13 -0.51 -4.95 117.35 115.19 2i9y s TYR 79 Ca 0.07 -0.52 -0.07 0.00 -1.41 0.00 0.00 57.07 55.14 2i9y s TYR 79 Cb -0.12 -0.16 -0.03 0.00 -1.10 0.00 0.00 41.96 40.55 2i9y s TYR 79 CO 0.01 -0.34 0.06 0.08 -2.51 0.00 0.00 175.55 172.85 2i9y s VAL 80 N -2.49 4.37 -0.06 -3.49 1.01 -1.26 0.50 120.40 118.98 2i9y s VAL 80 Ca -0.06 -0.16 -0.02 0.00 0.00 0.00 0.00 61.98 61.74 2i9y s VAL 80 Cb -0.02 -3.02 0.04 0.00 0.00 0.00 0.00 36.38 33.38 2i9y s VAL 80 CO -0.04 0.37 0.12 -2.28 0.00 0.00 0.00 175.10 173.27 2i9y s HIS 81 N 1.31 -0.12 -1.48 5.22 5.04 -0.30 -4.79 115.29 120.17 2i9y s HIS 81 Ca 0.05 0.42 0.00 0.00 -1.54 0.00 0.00 55.06 53.99 2i9y s HIS 81 Cb -0.15 -0.13 0.00 0.00 0.04 0.00 0.00 32.58 32.35 2i9y s HIS 81 CO 0.03 -0.16 0.00 -0.25 -2.34 0.00 0.00 174.74 172.02 2i9y n ASP 82 N 4.28 -4.99 0.00 9.88 8.00 -1.26 -1.97 116.55 130.49 2i9y n ASP 82 Ca -0.25 0.03 0.00 0.00 0.71 0.00 0.00 54.79 55.28 2i9y n ASP 82 Cb 0.51 -4.07 0.00 0.00 -0.02 0.00 0.00 41.12 37.54 2i9y n ASP 82 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2i9y n GLY 83 N -1.00 2.82 3.88 0.44 0.00 -1.26 -4.99 105.19 105.07 2i9y n GLY 83 Ca -0.20 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.48 2i9y n GLY 83 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2i9y s GLU 84 N 0.00 3.69 -0.35 1.61 2.12 -0.83 -5.03 118.70 119.91 2i9y s GLU 84 Ca 0.00 0.07 -0.27 0.00 0.36 0.00 0.00 54.97 55.13 2i9y s GLU 84 Cb 0.00 -2.99 0.01 0.00 0.26 0.00 0.00 34.13 31.42 2i9y s GLU 84 CO 0.00 0.56 0.97 0.00 -0.54 0.00 0.00 175.26 176.25 2i9y s ALA 85 N -1.43 3.45 -0.04 6.30 0.00 -1.26 -1.15 121.76 127.63 2i9y s ALA 85 Ca 0.33 -0.30 -0.03 0.00 0.00 0.00 0.00 51.96 51.95 2i9y s ALA 85 Cb -0.13 -3.57 -0.04 0.00 0.00 0.00 0.00 23.12 19.38 2i9y s ALA 85 CO 0.19 -1.54 0.15 0.15 0.00 0.00 0.00 175.76 174.72 2i9y s LYS 86 N 3.51 3.37 -0.06 0.00 -0.14 0.18 -4.91 119.74 121.69 2i9y s LYS 86 Ca 0.40 -0.30 0.05 0.00 -1.36 0.00 0.00 55.97 54.76 2i9y s LYS 86 Cb -0.12 -3.08 -0.00 0.00 -1.68 0.00 0.00 37.83 32.95 2i9y s LYS 86 CO 0.17 0.70 -0.21 0.08 -0.76 0.00 0.00 175.35 175.33 2i9y s VAL 87 N -1.22 1.74 -0.09 3.17 1.01 -1.26 -1.42 120.40 122.33 2i9y s VAL 87 Ca 0.23 -0.88 -0.00 0.00 0.00 0.00 0.00 61.98 61.33 2i9y s VAL 87 Cb -0.12 -1.50 -0.03 0.00 0.00 0.00 0.00 36.38 34.73 2i9y s VAL 87 CO 0.14 0.49 -0.05 0.00 0.00 0.00 0.00 175.10 175.68 2i9y s ALA 88 N 0.09 3.04 -0.19 5.51 0.00 -0.97 -4.98 121.76 124.27 2i9y s ALA 88 Ca -0.08 -0.86 -0.16 0.00 0.00 0.00 0.00 51.96 50.86 2i9y s ALA 88 Cb -0.14 -1.33 -0.04 0.00 0.00 0.00 0.00 23.12 21.61 2i9y s ALA 88 CO 0.04 0.52 0.39 0.15 0.00 0.00 0.00 175.76 176.86 2i9y s LYS 89 N -0.63 4.19 0.25 0.00 1.02 -1.26 -3.67 119.74 119.64 2i9y s LYS 89 Ca 0.10 0.21 -0.15 0.00 0.02 0.00 0.00 55.97 56.14 2i9y s LYS 89 Cb -0.12 -3.52 0.01 0.00 -0.52 0.00 0.00 37.83 33.68 2i9y s LYS 89 CO 0.02 -0.00 0.54 -1.83 -0.92 0.00 0.00 175.35 173.15 2i9y s GLU 90 N 1.19 1.57 0.01 1.68 -1.05 -1.26 -3.85 118.70 117.00 2i9y s GLU 90 Ca 0.19 -1.14 0.02 0.00 -0.15 0.00 0.00 54.97 53.89 2i9y s GLU 90 Cb -0.15 0.51 -0.01 0.00 -0.44 0.00 0.00 34.13 34.04 2i9y s GLU 90 CO 0.08 -0.67 -0.06 0.50 0.95 0.00 0.00 175.26 176.06 2i9y s ARG 91 N -3.98 0.44 -0.15 -4.83 3.52 0.42 -4.20 118.95 110.18 2i9y s ARG 91 Ca 0.18 -0.40 -0.29 0.00 -0.13 0.00 0.00 55.73 55.09 2i9y s ARG 91 Cb -0.02 -0.34 -0.01 0.00 -1.56 0.00 0.00 34.95 33.02 2i9y s ARG 91 CO 0.07 0.08 1.20 0.42 -0.81 0.00 0.00 175.30 176.26 2i9y s ILE 92 N -0.61 4.37 -0.16 4.11 1.01 -0.29 -1.70 121.20 127.93 2i9y s ILE 92 Ca -0.03 1.66 -0.00 0.00 0.00 0.00 0.00 60.65 62.28 2i9y s ILE 92 Cb -0.05 -4.07 -0.10 0.00 0.01 0.00 0.00 42.46 38.25 2i9y s ILE 92 CO 0.00 -0.10 -0.15 1.21 0.00 0.00 0.00 174.94 175.90 2i9y n GLU 93 N 6.14 0.38 -3.77 2.79 4.07 -0.32 -1.37 120.64 128.58 2i9y n GLU 93 Ca 0.13 0.10 -0.13 0.00 -0.06 0.00 0.00 57.16 57.20 2i9y n GLU 93 Cb 0.46 -1.28 -0.11 0.00 -0.06 0.00 0.00 31.44 30.45 2i9y n GLU 93 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 2i9y s ALA 94 N -2.31 -0.77 -0.11 4.31 0.00 -1.22 -4.71 121.76 116.95 2i9y s ALA 94 Ca -0.21 0.83 -0.05 0.00 0.00 0.00 0.00 51.96 52.53 2i9y s ALA 94 Cb 0.06 -0.46 0.05 0.00 0.00 0.00 0.00 23.12 22.77 2i9y s ALA 94 CO 0.35 -0.16 0.24 0.54 0.00 0.00 0.00 175.76 176.73 2i9y s VAL 95 N 0.03 -0.26 -0.31 0.00 0.11 -1.26 0.16 120.40 118.87 2i9y s VAL 95 Ca -0.01 0.24 -0.06 0.00 -2.93 0.00 0.00 61.98 59.22 2i9y s VAL 95 Cb -0.03 -0.39 0.02 0.00 -1.53 0.00 0.00 36.38 34.46 2i9y s VAL 95 CO 0.01 0.10 0.08 -1.61 -3.33 0.00 0.00 175.10 170.35 2i9y s GLU 96 N 1.97 2.86 0.08 1.54 0.41 0.59 -4.95 118.70 121.19 2i9y s GLU 96 Ca -0.02 -1.01 -0.19 0.00 -0.41 0.00 0.00 54.97 53.33 2i9y s GLU 96 Cb -0.11 -3.39 -0.09 0.00 -1.78 0.00 0.00 34.13 28.76 2i9y s GLU 96 CO -0.08 -0.54 1.53 -1.35 -0.49 0.00 0.00 175.26 174.33 2i9y h PRO 97 N 8.21 0.38 0.15 0.39 0.11 -1.97 -0.81 132.00 138.47 2i9y h PRO 97 Ca -0.28 -0.11 -0.28 0.00 0.11 0.00 0.00 66.00 65.43 2i9y h PRO 97 Cb 1.10 -0.04 0.01 0.00 0.11 0.00 0.00 31.00 32.19 2i9y h PRO 97 CO 0.60 0.55 -1.27 -0.44 -0.21 0.00 0.00 178.00 177.23 2i9y h ASP 98 N 0.17 0.54 0.53 -2.05 3.32 -1.97 -3.20 116.42 113.75 2i9y h ASP 98 Ca 0.07 -0.56 0.00 0.00 0.02 0.00 0.00 57.03 56.55 2i9y h ASP 98 Cb 0.36 -0.17 0.00 0.00 0.22 0.00 0.00 39.33 39.74 2i9y h ASP 98 CO 0.01 1.43 -0.22 0.29 -1.72 0.00 0.00 179.24 179.03 2i9y n LYS 99 N -3.60 0.35 -3.40 3.56 5.02 -1.25 -4.96 118.16 113.88 2i9y n LYS 99 Ca -0.10 -0.14 -0.13 0.00 -2.02 0.00 0.00 58.31 55.92 2i9y n LYS 99 Cb 1.03 -1.50 0.01 0.00 -0.02 0.00 0.00 35.03 34.55 2i9y n LYS 99 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 2i9y n ASN 100 N -1.20 -6.42 -4.06 4.39 5.15 -0.42 -4.67 115.26 108.03 2i9y n ASN 100 Ca 0.10 -0.53 -0.19 0.00 -0.60 0.00 0.00 54.58 53.37 2i9y n ASN 100 Cb 0.32 -3.78 -0.14 0.00 -0.53 0.00 0.00 39.78 35.64 2i9y n ASN 100 CO 0.00 0.00 0.00 -0.22 1.40 0.00 0.00 177.26 178.44 2i9y s LEU 101 N -4.70 2.08 -0.06 1.20 0.20 -0.56 -2.16 118.68 114.67 2i9y s LEU 101 Ca 0.08 -0.27 -0.03 0.00 0.69 0.00 0.00 54.13 54.60 2i9y s LEU 101 Cb -0.02 -0.48 0.04 0.00 -0.43 0.00 0.00 46.19 45.29 2i9y s LEU 101 CO 0.82 0.07 0.11 -0.51 -0.29 0.00 0.00 176.35 176.55 2i9y s ILE 102 N -0.47 -0.17 -0.24 6.68 1.10 -0.21 -0.30 121.20 127.59 2i9y s ILE 102 Ca 0.02 0.35 -0.12 0.00 -0.51 0.00 0.00 60.65 60.38 2i9y s ILE 102 Cb -0.05 -0.22 -0.05 0.00 0.15 0.00 0.00 42.46 42.29 2i9y s ILE 102 CO 0.00 0.14 0.24 -0.89 -2.11 0.00 0.00 174.94 172.32 2i9y s THR 103 N 2.00 5.30 -0.11 4.00 2.01 0.12 -0.72 115.64 128.25 2i9y s THR 103 Ca 0.01 0.33 -0.05 0.00 0.31 0.00 0.00 61.69 62.30 2i9y s THR 103 Cb -0.12 -3.57 -0.04 0.00 0.01 0.00 0.00 72.50 68.78 2i9y s THR 103 CO -0.05 0.30 0.07 -0.36 -0.69 0.00 0.00 174.62 173.89 2i9y s PHE 104 N 1.28 3.36 -0.14 4.92 0.08 0.18 -1.17 117.98 126.49 2i9y s PHE 104 Ca 0.11 0.33 0.00 0.00 0.12 0.00 0.00 56.93 57.49 2i9y s PHE 104 Cb -0.14 -1.89 0.02 0.00 -0.57 0.00 0.00 43.02 40.44 2i9y s PHE 104 CO 0.06 0.55 -0.13 0.50 -0.10 0.00 0.00 175.22 176.10 2i9y s ARG 105 N -0.80 2.17 -0.08 0.44 6.06 -0.69 -1.06 118.95 124.98 2i9y s ARG 105 Ca 0.13 -0.51 -0.30 0.00 -2.50 0.00 0.00 55.73 52.56 2i9y s ARG 105 Cb -0.12 -2.01 -0.02 0.00 0.06 0.00 0.00 34.95 32.86 2i9y s ARG 105 CO 0.03 -0.24 1.13 0.54 -2.50 0.00 0.00 175.30 174.26 2i9y s VAL 106 N 1.52 4.46 -0.10 7.11 0.11 -0.97 -0.43 120.40 132.09 2i9y s VAL 106 Ca 0.05 1.76 0.15 0.00 -2.93 0.00 0.00 61.98 61.00 2i9y s VAL 106 Cb -0.13 -4.13 -0.21 0.00 -1.53 0.00 0.00 36.38 30.38 2i9y s VAL 106 CO -0.10 -0.01 0.17 2.30 -3.33 0.00 0.00 175.10 174.12 2i9y n ILE 107 N 4.65 0.66 -3.66 7.04 -0.00 -1.25 -4.71 119.36 122.09 2i9y n ILE 107 Ca 0.10 -0.55 -0.08 0.00 -0.00 0.00 0.00 62.75 62.23 2i9y n ILE 107 Cb 0.47 -0.33 -0.02 0.00 -0.00 0.00 0.00 39.64 39.77 2i9y n ILE 107 CO 0.00 0.00 0.00 -0.70 -0.00 0.00 0.00 176.55 175.85 2i9y s GLU 108 N -2.66 1.40 0.00 6.28 -6.30 -1.26 -5.07 118.70 111.09 2i9y s GLU 108 Ca -0.07 -0.68 0.00 0.00 -2.50 0.00 0.00 54.97 51.72 2i9y s GLU 108 Cb 0.07 0.54 0.00 0.00 0.00 0.00 0.00 34.13 34.73 2i9y s GLU 108 CO 0.65 -0.63 0.00 0.41 0.02 0.00 0.00 175.26 175.71 2i9y n GLY 109 N -0.41 0.94 0.10 -1.50 0.00 -1.26 -4.29 105.19 98.77 2i9y n GLY 109 Ca -0.09 -1.93 -0.12 0.00 0.00 0.00 0.00 46.02 43.88 2i9y n GLY 109 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 2i9y h ASP 110 N 0.00 0.20 0.91 1.61 3.58 -1.94 -3.22 116.42 117.56 2i9y h ASP 110 Ca 0.00 -0.31 -0.06 0.00 0.42 0.00 0.00 57.03 57.07 2i9y h ASP 110 Cb 0.00 -0.05 -0.01 0.00 1.72 0.00 0.00 39.33 40.99 2i9y h ASP 110 CO 0.00 0.47 -0.29 -0.07 -2.88 0.00 0.00 179.24 176.47 2i9y h LEU 111 N -0.07 0.00 -0.64 2.28 3.38 -1.94 -3.18 115.31 115.14 2i9y h LEU 111 Ca 0.03 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.00 2i9y h LEU 111 Cb 0.37 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.12 2i9y h LEU 111 CO 0.01 0.29 0.00 0.23 0.09 0.00 0.00 178.44 179.06 2i9y n MET 112 N -3.44 0.12 0.05 1.13 2.81 -1.22 -0.03 117.12 116.54 2i9y n MET 112 Ca 0.00 0.45 0.12 0.00 -1.81 0.00 0.00 57.70 56.45 2i9y n MET 112 Cb 0.47 -1.77 0.08 0.00 -0.71 0.00 0.00 33.22 31.29 2i9y n MET 112 CO 0.00 0.00 0.00 1.63 1.51 0.00 0.00 175.97 179.11 2i9y n LYS 113 N -2.00 0.33 -0.07 0.03 4.76 -1.20 -4.22 118.16 115.80 2i9y n LYS 113 Ca 0.01 0.05 -0.08 0.00 -2.87 0.00 0.00 58.31 55.42 2i9y n LYS 113 Cb 0.14 -1.66 -0.08 0.00 -1.84 0.00 0.00 35.03 31.59 2i9y n LYS 113 CO 0.00 0.00 0.00 0.39 -1.37 0.00 0.00 177.40 176.42 2i9y n GLU 114 N -2.12 1.31 -4.77 1.97 4.71 -0.49 -4.98 120.64 116.27 2i9y n GLU 114 Ca 0.02 0.04 -0.33 0.00 -0.01 0.00 0.00 57.16 56.87 2i9y n GLU 114 Cb 0.45 -1.31 -0.12 0.00 -1.01 0.00 0.00 31.44 29.45 2i9y n GLU 114 CO 0.00 0.00 0.00 0.71 0.09 0.00 0.00 177.13 177.93 2i9y s TYR 115 N -2.30 2.81 -1.85 -0.32 1.51 0.96 -3.80 117.35 114.35 2i9y s TYR 115 Ca -0.12 -0.08 0.27 0.00 -1.01 0.00 0.00 57.07 56.12 2i9y s TYR 115 Cb 0.04 -1.67 0.81 0.00 -0.11 0.00 0.00 41.96 41.04 2i9y s TYR 115 CO 0.43 0.25 1.60 0.36 -1.11 0.00 0.00 175.55 177.08 2i9y n LYS 116 N 2.28 0.95 -3.63 -0.62 2.85 -0.53 -4.15 118.16 115.29 2i9y n LYS 116 Ca -0.18 -0.55 -0.09 0.00 -1.05 0.00 0.00 58.31 56.45 2i9y n LYS 116 Cb 0.52 -1.49 -0.07 0.00 -0.65 0.00 0.00 35.03 33.35 2i9y n LYS 116 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 177.40 177.80 2i9y s SER 117 N -2.43 -0.41 -0.19 -5.58 0.15 -1.22 -4.94 113.70 99.06 2i9y s SER 117 Ca 0.26 0.77 -0.05 0.00 0.70 0.00 0.00 55.95 57.64 2i9y s SER 117 Cb 0.19 0.78 0.10 0.00 -1.71 0.00 0.00 66.02 65.38 2i9y s SER 117 CO 0.49 -0.16 0.36 0.12 1.20 0.00 0.00 173.24 175.26 2i9y s PHE 118 N 0.10 -0.70 -0.07 3.44 5.36 -1.26 -1.04 117.98 123.81 2i9y s PHE 118 Ca 0.03 1.17 0.02 0.00 -0.96 0.00 0.00 56.93 57.19 2i9y s PHE 118 Cb -0.05 0.13 0.01 0.00 -0.34 0.00 0.00 43.02 42.77 2i9y s PHE 118 CO -0.06 -0.52 -0.13 -1.17 -1.46 0.00 0.00 175.22 171.88 2i9y s LEU 119 N 2.54 1.67 -0.01 6.12 2.96 0.75 -2.28 118.68 130.43 2i9y s LEU 119 Ca 0.03 -0.34 0.01 0.00 -0.22 0.00 0.00 54.13 53.61 2i9y s LEU 119 Cb -0.13 -0.91 0.01 0.00 0.50 0.00 0.00 46.19 45.66 2i9y s LEU 119 CO -0.13 0.04 -0.03 -1.48 -1.32 0.00 0.00 176.35 173.43 2i9y s LEU 120 N 0.71 1.77 -0.06 -0.68 2.34 -0.23 -0.08 118.68 122.46 2i9y s LEU 120 Ca -0.13 -0.06 0.05 0.00 0.06 0.00 0.00 54.13 54.05 2i9y s LEU 120 Cb -0.16 -0.20 -0.01 0.00 -0.56 0.00 0.00 46.19 45.26 2i9y s LEU 120 CO 0.03 0.00 -0.23 -0.89 -1.06 0.00 0.00 176.35 174.21 2i9y s THR 121 N 0.23 1.86 -0.06 5.48 2.01 0.74 0.50 115.64 126.40 2i9y s THR 121 Ca -0.02 -0.95 0.05 0.00 0.31 0.00 0.00 61.69 61.07 2i9y s THR 121 Cb -0.05 -1.59 -0.02 0.00 0.01 0.00 0.00 72.50 70.86 2i9y s THR 121 CO -0.00 0.52 -0.20 0.27 -0.69 0.00 0.00 174.62 174.52 2i9y s ILE 122 N -0.06 2.53 -0.09 1.82 -4.36 0.10 -0.04 121.20 121.10 2i9y s ILE 122 Ca -0.05 -0.90 -0.01 0.00 -0.26 0.00 0.00 60.65 59.43 2i9y s ILE 122 Cb -0.13 -1.96 0.03 0.00 1.25 0.00 0.00 42.46 41.64 2i9y s ILE 122 CO 0.04 0.57 -0.02 -1.58 0.24 0.00 0.00 174.94 174.19 2i9y s GLN 123 N -0.34 0.88 -0.13 0.37 0.74 -0.64 -1.04 119.66 119.49 2i9y s GLN 123 Ca 0.02 -0.04 -0.02 0.00 0.05 0.00 0.00 55.36 55.37 2i9y s GLN 123 Cb -0.12 -1.24 -0.03 0.00 1.10 0.00 0.00 33.01 32.72 2i9y s GLN 123 CO 0.02 -0.32 -0.05 0.08 -0.55 0.00 0.00 175.29 174.47 2i9y s VAL 124 N 1.89 3.78 0.02 1.34 1.01 -0.92 -0.46 120.40 127.06 2i9y s VAL 124 Ca 0.05 -0.41 0.00 0.00 0.00 0.00 0.00 61.98 61.62 2i9y s VAL 124 Cb -0.13 -2.62 -0.02 0.00 0.00 0.00 0.00 36.38 33.61 2i9y s VAL 124 CO -0.06 0.52 -0.04 0.28 0.00 0.00 0.00 175.10 175.80 2i9y s THR 125 N 0.08 0.19 -0.32 3.92 -1.32 -0.64 -4.75 115.64 112.81 2i9y s THR 125 Ca -0.01 -0.93 -0.28 0.00 -1.21 0.00 0.00 61.69 59.26 2i9y s THR 125 Cb -0.14 -0.32 -0.02 0.00 -1.51 0.00 0.00 72.50 70.51 2i9y s THR 125 CO 0.03 -0.47 1.84 -2.16 -2.21 0.00 0.00 174.62 171.65 2i9y s PRO 126 N -1.46 3.32 -0.05 7.08 0.04 -1.26 -0.48 135.00 142.20 2i9y s PRO 126 Ca -0.15 1.49 -0.04 0.00 0.04 0.00 0.00 61.00 62.35 2i9y s PRO 126 Cb -0.10 -4.21 -0.01 0.00 0.04 0.00 0.00 34.50 30.21 2i9y s PRO 126 CO -0.01 -1.88 -0.09 1.17 0.04 0.00 0.00 177.00 176.24 2i9y n LYS 127 N 8.46 0.13 -0.26 4.56 4.81 -1.15 -4.59 118.16 130.12 2i9y n LYS 127 Ca 0.24 0.07 -0.06 0.00 -0.87 0.00 0.00 58.31 57.68 2i9y n LYS 127 Cb 0.47 -0.75 0.08 0.00 0.02 0.00 0.00 35.03 34.84 2i9y n LYS 127 CO 0.00 0.00 0.00 -1.35 1.17 0.00 0.00 177.40 177.22 2i9y h PRO 128 N -0.25 1.15 0.00 1.64 0.11 -1.89 -3.50 132.00 129.25 2i9y h PRO 128 Ca 0.00 -0.23 0.00 0.00 0.11 0.00 0.00 66.00 65.88 2i9y h PRO 128 Cb 0.25 -0.17 0.00 0.00 0.11 0.00 0.00 31.00 31.18 2i9y h PRO 128 CO 0.00 0.96 0.00 0.41 -0.21 0.00 0.00 178.00 179.16 2i9y n GLY 129 N -0.81 2.18 6.65 -0.55 0.00 -0.67 -4.96 105.19 107.03 2i9y n GLY 129 Ca 0.06 -1.49 0.00 0.00 0.00 0.00 0.00 46.02 44.59 2i9y n GLY 129 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2i9y n GLY 130 N 2.10 1.67 1.07 -0.02 0.00 -1.26 -3.79 105.19 104.96 2i9y n GLY 130 Ca 0.00 -0.32 -0.02 0.00 0.00 0.00 0.00 46.02 45.68 2i9y n GLY 130 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2i9y n PRO 131 N 0.66 1.11 -3.32 1.61 -0.04 -1.26 -2.62 135.00 131.13 2i9y n PRO 131 Ca 0.00 -0.24 -0.08 0.00 -0.04 0.00 0.00 63.50 63.14 2i9y n PRO 131 Cb 0.00 -1.12 -0.07 0.00 -0.04 0.00 0.00 33.50 32.27 2i9y n PRO 131 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 2i9y s GLY 132 N 0.77 -0.50 0.03 0.55 0.00 -1.25 -4.15 107.32 102.78 2i9y s GLY 132 Ca 0.04 0.72 0.04 0.00 0.00 0.00 0.00 44.72 45.53 2i9y s GLY 132 CO 0.01 2.83 -0.12 -0.56 0.00 0.00 0.00 173.10 175.26 2i9y s SER 133 N 2.56 1.43 -0.20 1.64 0.01 -0.21 -1.67 113.70 117.26 2i9y s SER 133 Ca 0.12 -0.42 -0.08 0.00 1.31 0.00 0.00 55.95 56.88 2i9y s SER 133 Cb -0.14 -0.09 -0.04 0.00 0.21 0.00 0.00 66.02 65.96 2i9y s SER 133 CO -0.21 0.01 0.09 -0.63 0.41 0.00 0.00 173.24 172.91 2i9y s ILE 134 N -0.81 4.98 -0.35 1.44 -1.09 0.37 -0.44 121.20 125.30 2i9y s ILE 134 Ca 0.00 0.04 -0.13 0.00 -2.23 0.00 0.00 60.65 58.33 2i9y s ILE 134 Cb -0.07 -3.26 -0.01 0.00 -1.58 0.00 0.00 42.46 37.54 2i9y s ILE 134 CO 0.01 0.44 0.24 0.54 -1.23 0.00 0.00 174.94 174.94 2i9y s VAL 135 N 0.49 5.19 -0.41 2.92 0.11 0.32 -1.61 120.40 127.40 2i9y s VAL 135 Ca 0.05 -0.36 -0.22 0.00 -2.93 0.00 0.00 61.98 58.52 2i9y s VAL 135 Cb -0.12 -3.72 0.02 0.00 -1.53 0.00 0.00 36.38 31.02 2i9y s VAL 135 CO 0.00 -0.08 0.70 -1.00 -3.33 0.00 0.00 175.10 171.40 2i9y s HIS 136 N 1.70 3.07 -0.23 1.54 3.76 0.39 -1.82 115.29 123.70 2i9y s HIS 136 Ca 0.06 0.20 -0.17 0.00 -0.15 0.00 0.00 55.06 54.99 2i9y s HIS 136 Cb -0.18 -3.40 -0.03 0.00 1.11 0.00 0.00 32.58 30.08 2i9y s HIS 136 CO 0.10 -0.82 0.47 -1.58 -0.85 0.00 0.00 174.74 172.06 2i9y s TRP 137 N 2.98 3.32 -0.26 1.40 0.52 0.14 -1.62 118.94 125.41 2i9y s TRP 137 Ca 0.26 0.65 0.02 0.00 0.02 0.00 0.00 56.10 57.05 2i9y s TRP 137 Cb -0.13 -2.65 0.05 0.00 -1.15 0.00 0.00 33.47 29.59 2i9y s TRP 137 CO 0.19 -0.16 -0.09 -1.01 0.02 0.00 0.00 176.95 175.89 2i9y s HIS 138 N 1.86 3.23 -0.19 -1.98 3.76 0.94 -1.90 115.29 121.00 2i9y s HIS 138 Ca 0.21 -2.16 -0.04 0.00 -0.15 0.00 0.00 55.06 52.92 2i9y s HIS 138 Cb -0.15 -1.97 -0.02 0.00 1.11 0.00 0.00 32.58 31.55 2i9y s HIS 138 CO 0.09 -0.85 -0.04 -0.51 -0.85 0.00 0.00 174.74 172.58 2i9y s LEU 139 N 1.15 3.02 -0.08 0.89 1.02 0.14 -0.18 118.68 124.63 2i9y s LEU 139 Ca -0.07 -0.30 0.02 0.00 0.02 0.00 0.00 54.13 53.80 2i9y s LEU 139 Cb -0.19 -1.75 0.01 0.00 0.02 0.00 0.00 46.19 44.28 2i9y s LEU 139 CO -0.05 0.05 -0.13 -1.61 0.02 0.00 0.00 176.35 174.63 2i9y s GLU 140 N 1.05 1.88 0.20 1.70 2.02 0.89 -0.11 118.70 126.33 2i9y s GLU 140 Ca 0.01 -0.46 -0.15 0.00 0.02 0.00 0.00 54.97 54.40 2i9y s GLU 140 Cb -0.15 -1.60 0.01 0.00 0.10 0.00 0.00 34.13 32.50 2i9y s GLU 140 CO 0.00 -0.02 0.46 1.52 0.02 0.00 0.00 175.26 177.24 2i9y s TYR 141 N 0.85 0.08 -0.08 1.61 1.13 0.09 -0.18 117.35 120.87 2i9y s TYR 141 Ca -0.10 -0.44 0.03 0.00 -1.41 0.00 0.00 57.07 55.14 2i9y s TYR 141 Cb -0.15 0.25 0.01 0.00 -1.10 0.00 0.00 41.96 40.97 2i9y s TYR 141 CO 0.01 -0.88 -0.15 -2.00 -2.51 0.00 0.00 175.55 170.02 2i9y s GLU 142 N -3.92 2.06 0.19 -3.49 2.12 -0.20 -0.33 118.70 115.13 2i9y s GLU 142 Ca 0.13 -0.53 -0.29 0.00 0.36 0.00 0.00 54.97 54.64 2i9y s GLU 142 Cb 0.00 -1.66 -0.08 0.00 0.26 0.00 0.00 34.13 32.65 2i9y s GLU 142 CO -0.00 0.05 0.92 0.15 -0.54 0.00 0.00 175.26 175.84 2i9y s LYS 143 N 0.64 4.78 0.08 4.30 3.01 0.44 -1.46 119.74 131.52 2i9y s LYS 143 Ca -0.15 1.43 -0.11 0.00 -1.01 0.00 0.00 55.97 56.14 2i9y s LYS 143 Cb -0.16 -3.30 -0.22 0.00 -1.01 0.00 0.00 37.83 33.13 2i9y s LYS 143 CO 0.04 0.45 1.18 0.82 0.51 0.00 0.00 175.35 178.35 2i9y h ILE 144 N 3.41 1.33 -3.35 2.17 2.04 -1.89 -3.44 117.51 117.78 2i9y h ILE 144 Ca -0.45 -2.47 -0.03 0.00 1.00 0.00 0.00 64.86 62.91 2i9y h ILE 144 Cb 1.20 2.57 -0.11 0.00 -0.74 0.00 0.00 36.82 39.74 2i9y h ILE 144 CO 0.69 0.75 -0.01 -0.55 0.00 0.00 0.00 178.15 179.02 2i9y s SER 145 N -7.28 -0.25 0.07 1.72 0.15 -1.26 -5.05 113.70 101.80 2i9y s SER 145 Ca -0.08 -0.43 -0.16 0.00 0.70 0.00 0.00 55.95 55.98 2i9y s SER 145 Cb 0.07 0.54 -0.16 0.00 -1.71 0.00 0.00 66.02 64.76 2i9y s SER 145 CO 0.91 -0.98 1.27 -0.33 1.20 0.00 0.00 173.24 175.31 2i9y h GLU 146 N 2.25 0.64 0.00 5.44 5.08 -1.91 -3.15 114.58 122.93 2i9y h GLU 146 Ca -0.31 -0.50 -0.02 0.00 -1.00 0.00 0.00 59.36 57.53 2i9y h GLU 146 Cb 1.26 0.10 -0.00 0.00 0.50 0.00 0.00 28.75 30.61 2i9y h GLU 146 CO 0.41 1.12 -0.09 0.93 -1.00 0.00 0.00 179.01 180.39 2i9y h GLU 147 N 0.30 0.00 0.00 2.33 5.08 -1.99 -2.49 114.58 117.81 2i9y h GLU 147 Ca -0.03 0.00 -0.11 0.00 -1.00 0.00 0.00 59.36 58.22 2i9y h GLU 147 Cb 1.22 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.45 2i9y h GLU 147 CO 0.12 0.09 -1.56 1.55 -1.00 0.00 0.00 179.01 178.20 2i9y n VAL 148 N -3.57 0.79 -3.30 3.13 3.14 -1.22 -4.83 118.33 112.47 2i9y n VAL 148 Ca -0.02 -0.63 -0.38 0.00 -2.96 0.00 0.00 64.34 60.35 2i9y n VAL 148 Cb 0.21 -0.43 -0.06 0.00 -1.06 0.00 0.00 33.84 32.49 2i9y n VAL 148 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 2i9y s ALA 149 N -3.12 3.51 -0.38 1.55 0.00 -0.94 -4.83 121.76 117.54 2i9y s ALA 149 Ca -0.04 -0.31 0.01 0.00 0.00 0.00 0.00 51.96 51.62 2i9y s ALA 149 Cb 0.10 -2.70 0.13 0.00 0.00 0.00 0.00 23.12 20.65 2i9y s ALA 149 CO 0.83 -0.18 0.19 -1.01 0.00 0.00 0.00 175.76 175.59 2i9y s HIS 150 N 1.04 1.65 0.19 0.00 3.76 -1.26 -4.92 115.29 115.75 2i9y s HIS 150 Ca 0.24 -2.06 0.14 0.00 -0.15 0.00 0.00 55.06 53.23 2i9y s HIS 150 Cb -0.15 -1.65 0.75 0.00 1.11 0.00 0.00 32.58 32.63 2i9y s HIS 150 CO 0.10 -0.82 1.32 -1.35 -0.85 0.00 0.00 174.74 173.14 2i9y h PRO 151 N 7.21 0.00 -0.65 8.40 0.11 -1.96 -0.54 132.00 144.58 2i9y h PRO 151 Ca -0.04 0.00 0.04 0.00 0.11 0.00 0.00 66.00 66.11 2i9y h PRO 151 Cb 0.96 0.00 -0.05 0.00 0.11 0.00 0.00 31.00 32.03 2i9y h PRO 151 CO 0.44 0.00 0.38 0.93 -0.21 0.00 0.00 178.00 179.54 2i9y h GLU 152 N 0.00 0.72 -0.11 1.05 4.39 -2.00 -1.80 114.58 116.84 2i9y h GLU 152 Ca 0.00 -0.04 -0.08 0.00 0.34 0.00 0.00 59.36 59.58 2i9y h GLU 152 Cb 0.78 -0.16 -0.01 0.00 -0.10 0.00 0.00 28.75 29.25 2i9y h GLU 152 CO 0.00 0.48 -0.29 1.79 -1.16 0.00 0.00 179.01 179.83 2i9y h THR 153 N 0.74 1.25 -0.14 1.13 1.35 -1.52 -1.85 112.91 113.86 2i9y h THR 153 Ca 0.27 -1.17 -0.18 0.00 -0.55 0.00 0.00 66.41 64.78 2i9y h THR 153 Cb 0.08 1.49 0.01 0.00 -1.73 0.00 0.00 68.15 68.00 2i9y h THR 153 CO -0.13 0.35 -0.61 -0.07 -0.25 0.00 0.00 175.52 174.81 2i9y h LEU 154 N 0.18 0.79 -0.90 3.87 3.38 -1.53 0.21 115.31 121.29 2i9y h LEU 154 Ca 0.03 -0.62 -0.03 0.00 0.09 0.00 0.00 57.88 57.35 2i9y h LEU 154 Cb 0.61 -0.23 -0.04 0.00 0.09 0.00 0.00 40.66 41.09 2i9y h LEU 154 CO 0.04 1.28 0.42 -0.07 0.09 0.00 0.00 178.44 180.21 2i9y h LEU 155 N 0.34 1.10 -0.49 1.67 3.38 -1.07 -0.61 115.31 119.62 2i9y h LEU 155 Ca -0.04 -0.12 -0.11 0.00 0.09 0.00 0.00 57.88 57.70 2i9y h LEU 155 Cb 1.24 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 41.70 2i9y h LEU 155 CO 0.13 0.91 -0.13 1.56 0.09 0.00 0.00 178.44 181.00 2i9y h GLN 156 N 1.21 0.96 -0.92 1.13 4.20 -1.13 -2.45 115.11 118.11 2i9y h GLN 156 Ca 0.29 -0.37 0.03 0.00 0.06 0.00 0.00 58.65 58.66 2i9y h GLN 156 Cb 0.09 -0.05 -0.05 0.00 0.30 0.00 0.00 27.48 27.77 2i9y h GLN 156 CO -0.04 1.04 0.60 0.35 -0.67 0.00 0.00 178.83 180.11 2i9y h PHE 157 N 0.82 1.12 -0.08 2.96 3.57 -0.02 0.19 116.94 125.49 2i9y h PHE 157 Ca 0.12 0.03 -0.09 0.00 3.53 0.00 0.00 57.97 61.56 2i9y h PHE 157 Cb 0.70 -0.37 -0.01 0.00 2.79 0.00 0.00 35.95 39.05 2i9y h PHE 157 CO 0.05 0.64 -0.35 0.00 -2.23 0.00 0.00 178.31 176.43 2i9y h VAL 159 N 0.14 1.28 -0.58 0.00 2.07 -0.63 -0.68 116.25 117.84 2i9y h VAL 159 Ca 0.02 -0.96 0.11 0.00 0.82 0.00 0.00 66.70 66.69 2i9y h VAL 159 Cb 0.68 1.58 -0.09 0.00 -1.52 0.00 0.00 31.29 31.95 2i9y h VAL 159 CO 0.05 0.28 0.10 -0.33 0.02 0.00 0.00 177.57 177.70 2i9y h GLU 160 N 0.02 0.22 -0.36 1.57 3.07 -0.34 0.75 114.58 119.51 2i9y h GLU 160 Ca 0.04 -0.01 -0.09 0.00 -0.50 0.00 0.00 59.36 58.80 2i9y h GLU 160 Cb 0.45 -0.05 -0.01 0.00 -0.84 0.00 0.00 28.75 28.30 2i9y h GLU 160 CO 0.01 0.15 -0.12 0.28 -1.40 0.00 0.00 179.01 177.93 2i9y h VAL 161 N 0.23 1.28 -0.61 3.13 2.07 -1.25 -2.92 116.25 118.17 2i9y h VAL 161 Ca 0.31 -1.21 0.07 0.00 0.82 0.00 0.00 66.70 66.69 2i9y h VAL 161 Cb 0.46 1.32 -0.04 0.00 -1.52 0.00 0.00 31.29 31.51 2i9y h VAL 161 CO -0.41 0.40 0.41 0.28 0.02 0.00 0.00 177.57 178.26 2i9y h SER 162 N 0.50 0.48 0.31 0.57 0.02 -0.09 0.08 113.55 115.42 2i9y h SER 162 Ca 0.09 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 61.03 2i9y h SER 162 Cb 0.64 -0.10 -0.01 0.00 0.14 0.00 0.00 62.40 63.08 2i9y h SER 162 CO 0.04 0.31 -0.19 0.11 -1.14 0.00 0.00 176.83 175.95 2i9y h LYS 163 N 0.54 -0.47 0.20 3.45 1.57 -0.70 -0.86 116.57 120.30 2i9y h LYS 163 Ca 0.27 0.03 -0.01 0.00 -1.87 0.00 0.00 60.65 59.07 2i9y h LYS 163 Cb 0.36 0.11 0.00 0.00 0.08 0.00 0.00 32.23 32.78 2i9y h LYS 163 CO -0.08 -0.31 -0.10 1.49 -0.57 0.00 0.00 179.45 179.88 2i9y h GLU 164 N -0.49 -0.26 -0.29 3.15 4.57 -1.36 -2.85 114.58 117.05 2i9y h GLU 164 Ca -0.03 0.02 -0.02 0.00 -1.18 0.00 0.00 59.36 58.14 2i9y h GLU 164 Cb 0.41 0.06 -0.01 0.00 -0.16 0.00 0.00 28.75 29.04 2i9y h GLU 164 CO 0.03 0.06 0.09 0.97 -1.18 0.00 0.00 179.01 178.98 2i9y h ILE 165 N -0.60 1.20 0.12 2.32 6.09 -0.99 0.23 117.51 125.88 2i9y h ILE 165 Ca -0.03 -0.64 -0.01 0.00 -1.37 0.00 0.00 64.86 62.82 2i9y h ILE 165 Cb 0.44 1.07 0.00 0.00 0.47 0.00 0.00 36.82 38.80 2i9y h ILE 165 CO 0.05 0.21 -0.06 -0.78 -3.07 0.00 0.00 178.15 174.50 2i9y h ASP 166 N 0.31 -0.13 0.37 2.19 3.58 -1.25 -1.66 116.42 119.82 2i9y h ASP 166 Ca 0.09 -0.19 -0.09 0.00 0.42 0.00 0.00 57.03 57.26 2i9y h ASP 166 Cb 0.24 0.03 -0.01 0.00 1.72 0.00 0.00 39.33 41.31 2i9y h ASP 166 CO -0.00 0.11 -0.41 -0.33 -2.88 0.00 0.00 179.24 175.73 2i9y h GLU 167 N -0.38 0.06 -0.62 0.28 5.08 -1.45 -2.74 114.58 114.80 2i9y h GLU 167 Ca -0.02 -0.02 -0.03 0.00 -1.00 0.00 0.00 59.36 58.29 2i9y h GLU 167 Cb 0.31 -0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.53 2i9y h GLU 167 CO 0.03 0.46 0.28 1.25 -1.00 0.00 0.00 179.01 180.03 2i9y h HIS 168 N 0.05 0.92 -0.06 4.33 2.76 -0.25 0.72 115.15 123.61 2i9y h HIS 168 Ca 0.00 -0.06 -0.06 0.00 -2.20 0.00 0.00 60.37 58.06 2i9y h HIS 168 Cb 0.75 -0.28 -0.01 0.00 1.55 0.00 0.00 27.41 29.42 2i9y h HIS 168 CO 0.00 0.71 -0.24 -0.07 -1.30 0.00 0.00 177.93 177.04 2i9y h LEU 169 N 0.86 0.10 0.00 0.26 4.07 -1.02 -0.47 115.31 119.11 2i9y h LEU 169 Ca 0.21 -0.03 0.00 0.00 0.08 0.00 0.00 57.88 58.15 2i9y h LEU 169 Cb 0.16 -0.03 0.00 0.00 1.08 0.00 0.00 40.66 41.87 2i9y h LEU 169 CO -0.02 0.35 -0.40 -0.07 -1.08 0.00 0.00 178.44 177.21 2i9y h LEU 170 N 0.10 0.00 0.12 1.67 3.38 -1.17 -3.34 115.31 116.07 2i9y h LEU 170 Ca 0.02 -0.01 -0.17 0.00 0.09 0.00 0.00 57.88 57.80 2i9y h LEU 170 Cb 0.48 0.00 0.02 0.00 0.09 0.00 0.00 40.66 41.24 2i9y h LEU 170 CO 0.03 0.01 -0.78 0.00 0.09 0.00 0.00 178.44 177.79 2i9y h ALA 171 N 2.06 -0.06 -1.64 1.53 0.00 -0.12 -3.48 119.26 117.57 2i9y h ALA 171 Ca 0.00 -0.71 -0.52 0.00 0.00 0.00 0.00 54.91 53.68 2i9y h ALA 171 Cb 0.97 0.13 -0.05 0.00 0.00 0.00 0.00 17.79 18.83 2i9y h ALA 171 CO 0.00 0.37 -0.44 -1.21 0.00 0.00 0.00 179.25 177.98 2i9y s GLU 172 N -2.41 2.46 0.00 0.00 2.02 -0.26 -5.08 118.70 115.44 2i9y s GLU 172 Ca -0.15 -1.58 0.00 0.00 0.02 0.00 0.00 54.97 53.27 2i9y s GLU 172 Cb 0.01 -2.27 0.00 0.00 0.10 0.00 0.00 34.13 31.97 2i9y s GLU 172 CO 0.81 -0.09 0.00 -1.91 0.02 0.00 0.00 175.26 174.09