#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 3.29 -0.58 -2.82 1.03 -1.26 -5.04 118.70 113.32 2i9y s GLU 18 Ca 0.00 -0.82 -0.25 0.00 0.03 0.00 0.00 54.97 53.93 2i9y s GLU 18 Cb 0.00 -2.81 0.04 0.00 -0.80 0.00 0.00 34.13 30.56 2i9y s GLU 18 CO 0.00 0.44 1.02 0.00 -1.33 0.00 0.00 175.26 175.39 2i9y s ALA 19 N -1.98 3.10 0.24 -0.84 0.00 -1.26 -4.88 121.76 116.13 2i9y s ALA 19 Ca 0.34 -1.20 -0.07 0.00 0.00 0.00 0.00 51.96 51.03 2i9y s ALA 19 Cb -0.09 -3.84 0.23 0.00 0.00 0.00 0.00 23.12 19.42 2i9y s ALA 19 CO 0.28 -2.53 1.90 0.66 0.00 0.00 0.00 175.76 176.06 2i9y h SER 20 N 9.43 1.14 0.19 0.00 4.64 -1.96 -1.01 113.55 125.97 2i9y h SER 20 Ca -0.26 -0.06 0.00 0.00 -0.47 0.00 0.00 61.79 61.00 2i9y h SER 20 Cb 1.07 -0.29 0.00 0.00 -0.31 0.00 0.00 62.40 62.87 2i9y h SER 20 CO 1.13 0.86 -0.16 -1.20 -0.87 0.00 0.00 176.83 176.59 2i9y n SER 21 N -4.37 1.04 0.00 4.97 7.64 -1.26 -4.92 113.62 116.73 2i9y n SER 21 Ca 0.11 -1.00 0.00 0.00 1.01 0.00 0.00 58.87 58.99 2i9y n SER 21 Cb 0.05 0.07 0.00 0.00 -1.01 0.00 0.00 64.21 63.31 2i9y n SER 21 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 2i9y n LEU 22 N -0.49 0.00 -4.71 -3.43 4.77 -0.38 -4.92 117.00 107.83 2i9y n LEU 22 Ca 0.14 0.00 -0.42 0.00 -0.03 0.00 0.00 56.01 55.70 2i9y n LEU 22 Cb 0.33 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.39 2i9y n LEU 22 CO 0.23 0.00 0.71 -0.69 -1.33 0.00 0.00 177.39 176.31 2i9y s VAL 23 N -0.28 4.79 0.07 4.08 1.01 -1.26 -0.59 120.40 128.21 2i9y s VAL 23 Ca 0.00 2.00 0.00 0.00 0.00 0.00 0.00 61.98 63.99 2i9y s VAL 23 Cb 0.00 -4.28 -0.04 0.00 0.00 0.00 0.00 36.38 32.05 2i9y s VAL 23 CO 0.00 0.15 -0.05 -0.83 0.00 0.00 0.00 175.10 174.37 2i9y s GLY 24 N 1.02 0.60 0.21 4.51 0.00 0.37 -4.83 107.32 109.20 2i9y s GLY 24 Ca 0.52 -1.27 0.11 0.00 0.00 0.00 0.00 44.72 44.09 2i9y s GLY 24 CO 0.28 -1.37 -0.19 0.54 0.00 0.00 0.00 173.10 172.35 2i9y s LYS 25 N -3.86 1.69 -0.09 2.90 1.02 -1.26 -1.12 119.74 119.02 2i9y s LYS 25 Ca 0.09 -1.52 -0.04 0.00 0.02 0.00 0.00 55.97 54.52 2i9y s LYS 25 Cb 0.07 -1.90 0.05 0.00 -0.52 0.00 0.00 37.83 35.52 2i9y s LYS 25 CO -0.08 0.39 0.20 -1.17 -0.92 0.00 0.00 175.35 173.77 2i9y s LEU 26 N -2.92 0.28 -0.03 3.17 2.96 -0.09 -4.99 118.68 117.07 2i9y s LEU 26 Ca 0.24 0.42 0.01 0.00 -0.22 0.00 0.00 54.13 54.58 2i9y s LEU 26 Cb -0.07 0.51 0.02 0.00 0.50 0.00 0.00 46.19 47.14 2i9y s LEU 26 CO 0.12 -0.19 -0.04 -0.70 -1.32 0.00 0.00 176.35 174.22 2i9y s GLU 27 N 1.66 0.62 0.23 1.98 2.12 -1.26 -0.15 118.70 123.90 2i9y s GLU 27 Ca -0.05 -0.10 -0.10 0.00 0.36 0.00 0.00 54.97 55.08 2i9y s GLU 27 Cb -0.11 -0.65 -0.01 0.00 0.26 0.00 0.00 34.13 33.61 2i9y s GLU 27 CO -0.07 -0.03 0.40 -0.08 -0.54 0.00 0.00 175.26 174.94 2i9y s THR 28 N 0.62 0.01 -0.15 -1.70 -1.32 -0.55 -5.02 115.64 107.53 2i9y s THR 28 Ca -0.08 -1.49 -0.00 0.00 -1.21 0.00 0.00 61.69 58.91 2i9y s THR 28 Cb -0.11 -2.20 0.03 0.00 -1.51 0.00 0.00 72.50 68.71 2i9y s THR 28 CO -0.00 -0.04 -0.09 -1.81 -2.21 0.00 0.00 174.62 170.47 2i9y s ASP 29 N -3.03 2.71 -0.01 8.08 1.01 -1.26 -0.62 116.67 123.55 2i9y s ASP 29 Ca 0.24 -0.56 0.01 0.00 0.71 0.00 0.00 52.55 52.96 2i9y s ASP 29 Cb 0.01 -1.02 -0.04 0.00 1.01 0.00 0.00 42.92 42.88 2i9y s ASP 29 CO 0.08 -0.12 0.02 -0.69 0.21 0.00 0.00 175.17 174.66 2i9y s VAL 30 N 1.57 4.28 -0.24 -1.27 1.01 -0.69 -4.95 120.40 120.11 2i9y s VAL 30 Ca 0.03 -0.54 -0.07 0.00 0.00 0.00 0.00 61.98 61.39 2i9y s VAL 30 Cb -0.14 -2.91 -0.03 0.00 0.00 0.00 0.00 36.38 33.30 2i9y s VAL 30 CO -0.09 0.39 0.07 -1.61 0.00 0.00 0.00 175.10 173.86 2i9y s GLU 31 N -1.55 3.70 0.21 2.72 2.02 -1.26 -0.54 118.70 124.01 2i9y s GLU 31 Ca 0.20 -0.46 -0.10 0.00 0.02 0.00 0.00 54.97 54.63 2i9y s GLU 31 Cb -0.12 -3.31 -0.07 0.00 0.10 0.00 0.00 34.13 30.73 2i9y s GLU 31 CO 0.10 -0.12 0.54 0.96 0.02 0.00 0.00 175.26 176.76 2i9y s ILE 32 N 1.43 4.94 -0.23 -1.63 -4.36 0.24 -4.92 121.20 116.68 2i9y s ILE 32 Ca 0.05 0.48 0.14 0.00 -0.26 0.00 0.00 60.65 61.07 2i9y s ILE 32 Cb -0.15 -3.63 0.72 0.00 1.25 0.00 0.00 42.46 40.65 2i9y s ILE 32 CO 0.04 -0.03 1.64 0.29 0.24 0.00 0.00 174.94 177.12 2i9y n LYS 33 N -0.01 4.10 -4.26 0.37 5.02 -1.26 -0.64 118.16 121.47 2i9y n LYS 33 Ca -0.00 -3.06 -0.24 0.00 -2.02 0.00 0.00 58.31 52.99 2i9y n LYS 33 Cb 0.52 -2.12 -0.07 0.00 -0.02 0.00 0.00 35.03 33.34 2i9y n LYS 33 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2i9y s ALA 34 N -2.83 3.18 0.38 7.82 0.00 -1.26 -4.12 121.76 124.93 2i9y s ALA 34 Ca 0.51 -1.56 -0.24 0.00 0.00 0.00 0.00 51.96 50.66 2i9y s ALA 34 Cb 0.40 -0.85 -0.10 0.00 0.00 0.00 0.00 23.12 22.56 2i9y s ALA 34 CO 0.13 0.32 0.96 0.45 0.00 0.00 0.00 175.76 177.63 2i9y s SER 35 N -3.47 7.09 0.57 0.00 0.15 -1.16 -3.57 113.70 113.31 2i9y s SER 35 Ca 0.30 1.81 0.27 0.00 0.70 0.00 0.00 55.95 59.03 2i9y s SER 35 Cb -0.07 -2.56 1.63 0.00 -1.71 0.00 0.00 66.02 63.30 2i9y s SER 35 CO 0.20 -0.25 2.15 0.00 1.20 0.00 0.00 173.24 176.53 2i9y h ALA 36 N 2.56 1.80 -0.76 5.45 0.00 -1.89 -0.09 119.26 126.33 2i9y h ALA 36 Ca -0.48 -0.00 0.05 0.00 0.00 0.00 0.00 54.91 54.48 2i9y h ALA 36 Cb 1.19 0.01 -0.05 0.00 0.00 0.00 0.00 17.79 18.94 2i9y h ALA 36 CO 0.63 -0.19 0.50 -0.44 0.00 0.00 0.00 179.25 179.75 2i9y h ASP 37 N 0.00 0.74 0.69 0.00 3.32 -1.96 -0.75 116.42 118.45 2i9y h ASP 37 Ca 0.06 -0.00 -0.10 0.00 0.02 0.00 0.00 57.03 57.00 2i9y h ASP 37 Cb 0.30 -0.16 -0.01 0.00 0.22 0.00 0.00 39.33 39.68 2i9y h ASP 37 CO -0.00 0.49 -0.50 0.11 -1.72 0.00 0.00 179.24 177.62 2i9y h LYS 38 N 0.84 0.00 -0.21 3.56 1.57 -1.38 0.89 116.57 121.84 2i9y h LYS 38 Ca 0.32 0.00 -0.12 0.00 -1.87 0.00 0.00 60.65 58.97 2i9y h LYS 38 Cb 0.18 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.48 2i9y h LYS 38 CO -0.10 0.50 -0.39 0.35 -0.57 0.00 0.00 179.45 179.23 2i9y h PHE 39 N 0.00 0.56 -0.21 -1.35 3.57 -1.17 0.41 116.94 118.76 2i9y h PHE 39 Ca -0.00 -0.16 -0.19 0.00 3.53 0.00 0.00 57.97 61.15 2i9y h PHE 39 Cb 0.98 -0.12 0.00 0.00 2.79 0.00 0.00 35.95 39.60 2i9y h PHE 39 CO 0.00 0.80 -0.63 1.25 -2.23 0.00 0.00 178.31 177.50 2i9y h HIS 40 N 0.40 0.96 0.00 0.41 2.76 -0.85 -3.25 115.15 115.58 2i9y h HIS 40 Ca 0.04 -0.37 -0.15 0.00 -2.20 0.00 0.00 60.37 57.68 2i9y h HIS 40 Cb 0.86 -0.17 -0.02 0.00 1.55 0.00 0.00 27.41 29.63 2i9y h HIS 40 CO 0.03 1.18 -0.71 0.45 -1.30 0.00 0.00 177.93 177.58 2i9y h HIS 41 N 0.55 0.00 -0.09 5.26 3.86 -0.50 -3.36 115.15 120.87 2i9y h HIS 41 Ca -0.01 0.00 0.03 0.00 -1.16 0.00 0.00 60.37 59.23 2i9y h HIS 41 Cb 1.23 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 29.70 2i9y h HIS 41 CO 0.07 0.71 0.36 0.00 0.86 0.00 0.00 177.93 179.93 2i9y h MET 42 N 0.00 0.00 -0.11 2.45 3.00 -0.21 0.60 114.93 120.66 2i9y h MET 42 Ca -0.01 0.00 -0.07 0.00 0.00 0.00 0.00 59.70 59.63 2i9y h MET 42 Cb 1.34 0.00 -0.01 0.00 0.00 0.00 0.00 31.60 32.93 2i9y h MET 42 CO 0.09 0.00 -0.24 0.74 0.00 0.00 0.00 176.91 177.50 2i9y h PHE 43 N 0.00 0.20 0.00 -0.10 0.04 -1.78 -3.29 116.94 112.01 2i9y h PHE 43 Ca 0.04 -0.03 -0.36 0.00 2.80 0.00 0.00 57.97 60.42 2i9y h PHE 43 Cb 0.77 -0.05 -0.06 0.00 2.20 0.00 0.00 35.95 38.81 2i9y h PHE 43 CO 0.00 0.42 -2.24 0.00 -0.60 0.00 0.00 178.31 175.89 2i9y n ALA 44 N -2.48 1.55 0.00 2.45 0.00 0.67 -0.16 120.51 122.53 2i9y n ALA 44 Ca -0.01 -0.89 0.00 0.00 0.00 0.00 0.00 53.44 52.54 2i9y n ALA 44 Cb 0.34 0.16 0.00 0.00 0.00 0.00 0.00 19.45 19.95 2i9y n ALA 44 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2i9y n GLY 45 N 1.85 0.27 3.96 0.00 0.00 0.18 -3.20 105.19 108.25 2i9y n GLY 45 Ca -0.42 -1.19 -0.21 0.00 0.00 0.00 0.00 46.02 44.20 2i9y n GLY 45 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2i9y s LYS 46 N 0.00 3.33 0.31 1.61 -0.14 -1.26 -4.31 119.74 119.28 2i9y s LYS 46 Ca 0.00 -0.84 0.05 0.00 -1.36 0.00 0.00 55.97 53.83 2i9y s LYS 46 Cb 0.00 -2.84 0.85 0.00 -1.68 0.00 0.00 37.83 34.16 2i9y s LYS 46 CO 0.00 0.37 1.59 -1.35 -0.76 0.00 0.00 175.35 175.20 2i9y h PRO 47 N 1.17 0.06 0.00 -1.68 0.10 -1.96 -3.40 132.00 126.27 2i9y h PRO 47 Ca -0.51 -0.00 0.00 0.00 0.10 0.00 0.00 66.00 65.59 2i9y h PRO 47 Cb 1.24 -0.01 0.00 0.00 0.10 0.00 0.00 31.00 32.32 2i9y h PRO 47 CO 0.60 0.04 0.00 1.58 0.10 0.00 0.00 178.00 180.31 2i9y n HIS 48 N -5.38 -0.66 -1.61 0.65 -0.00 -1.26 -4.95 115.22 102.01 2i9y n HIS 48 Ca 0.25 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.97 2i9y n HIS 48 Cb 0.84 0.34 0.00 0.00 -0.00 0.00 0.00 29.99 31.17 2i9y n HIS 48 CO 0.00 0.00 0.00 1.58 -0.00 0.00 0.00 176.34 177.92 2i9y n HIS 49 N -2.19 -2.83 -4.54 1.57 -0.00 -1.26 -0.45 115.22 105.52 2i9y n HIS 49 Ca 0.00 1.69 -0.29 0.00 0.46 0.00 0.00 57.72 59.58 2i9y n HIS 49 Cb 0.00 -3.03 -0.13 0.00 -0.12 0.00 0.00 29.99 26.71 2i9y n HIS 49 CO 0.00 0.00 0.00 0.14 0.46 0.00 0.00 176.34 176.94 2i9y s VAL 50 N -0.32 2.27 -0.38 3.57 -7.23 -1.26 -3.10 120.40 113.93 2i9y s VAL 50 Ca 0.00 -1.63 -0.17 0.00 -1.81 0.00 0.00 61.98 58.36 2i9y s VAL 50 Cb 0.00 -1.97 0.01 0.00 0.56 0.00 0.00 36.38 34.98 2i9y s VAL 50 CO 0.00 0.17 0.46 -0.55 -0.31 0.00 0.00 175.10 174.87 2i9y s SER 51 N -1.82 6.23 0.24 4.85 0.15 -1.26 -4.90 113.70 117.19 2i9y s SER 51 Ca 0.14 -0.37 0.00 0.00 0.70 0.00 0.00 55.95 56.42 2i9y s SER 51 Cb -0.10 -2.24 0.00 0.00 -1.71 0.00 0.00 66.02 61.97 2i9y s SER 51 CO 0.05 -0.51 0.00 1.17 1.20 0.00 0.00 173.24 175.15 2i9y n LYS 52 N 5.65 -1.32 -2.62 5.44 4.81 -1.26 -4.52 118.16 124.34 2i9y n LYS 52 Ca -0.07 1.08 -0.42 0.00 -0.87 0.00 0.00 58.31 58.03 2i9y n LYS 52 Cb 0.48 -1.51 -0.01 0.00 0.02 0.00 0.00 35.03 34.00 2i9y n LYS 52 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2i9y s ALA 53 N -3.60 3.13 0.29 3.14 0.00 -1.26 -4.82 121.76 118.64 2i9y s ALA 53 Ca 0.00 -2.68 -0.20 0.00 0.00 0.00 0.00 51.96 49.08 2i9y s ALA 53 Cb 0.00 -4.52 0.04 0.00 0.00 0.00 0.00 23.12 18.63 2i9y s ALA 53 CO 0.00 -3.37 0.77 -1.12 0.00 0.00 0.00 175.76 172.04 2i9y s SER 54 N 4.39 -0.17 -0.28 0.00 0.01 -1.26 -5.10 113.70 111.29 2i9y s SER 54 Ca 0.49 -0.74 -0.31 0.00 1.31 0.00 0.00 55.95 56.69 2i9y s SER 54 Cb 0.01 0.73 -0.08 0.00 0.21 0.00 0.00 66.02 66.90 2i9y s SER 54 CO -0.01 -1.39 2.22 -2.65 0.41 0.00 0.00 173.24 171.82 2i9y n PRO 55 N -0.49 1.57 0.25 12.44 -0.02 -1.26 -4.86 135.00 142.64 2i9y n PRO 55 Ca -0.05 0.42 -0.14 0.00 -2.02 0.00 0.00 63.50 61.70 2i9y n PRO 55 Cb 0.59 -2.93 -0.08 0.00 -0.02 0.00 0.00 33.50 31.06 2i9y n PRO 55 CO 0.00 0.00 0.00 0.78 1.98 0.00 0.00 175.50 178.26 2i9y h GLY 56 N 14.17 -0.68 0.00 -1.23 0.00 -1.88 -3.46 103.07 109.99 2i9y h GLY 56 Ca -0.35 0.25 0.00 0.00 0.00 0.00 0.00 47.33 47.23 2i9y h GLY 56 CO 0.99 -0.25 0.00 -2.01 0.00 0.00 0.00 176.54 175.27 2i9y n ASN 57 N -5.27 0.00 -4.64 0.19 2.85 -1.26 -4.75 115.26 102.38 2i9y n ASN 57 Ca -0.11 0.00 -0.43 0.00 -0.11 0.00 0.00 54.58 53.93 2i9y n ASN 57 Cb 0.31 0.00 -0.02 0.00 1.24 0.00 0.00 39.78 41.31 2i9y n ASN 57 CO 0.00 0.00 0.00 -0.63 -2.11 0.00 0.00 177.26 174.52 2i9y s ILE 58 N 0.00 4.13 0.23 -1.44 1.01 -1.26 -4.99 121.20 118.88 2i9y s ILE 58 Ca 0.00 1.32 -0.06 0.00 0.00 0.00 0.00 60.65 61.91 2i9y s ILE 58 Cb 0.00 -4.02 -0.06 0.00 0.01 0.00 0.00 42.46 38.39 2i9y s ILE 58 CO 0.00 -0.30 0.50 0.00 0.00 0.00 0.00 174.94 175.14 2i9y s GLN 59 N 3.94 3.68 0.00 2.79 -2.07 -1.26 -4.73 119.66 122.01 2i9y s GLN 59 Ca 0.58 0.05 0.20 0.00 -1.82 0.00 0.00 55.36 54.37 2i9y s GLN 59 Cb -0.20 -2.70 0.64 0.00 -1.09 0.00 0.00 33.01 29.66 2i9y s GLN 59 CO 0.20 0.32 1.49 0.41 -1.32 0.00 0.00 175.29 176.39 2i9y n GLY 60 N -0.42 0.56 3.57 2.60 0.00 0.40 -4.66 105.19 107.23 2i9y n GLY 60 Ca -0.01 -0.46 -0.38 0.00 0.00 0.00 0.00 46.02 45.17 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 8.96 0.24 -4.90 0.00 3.58 -1.82 -3.49 116.42 118.99 2i9y h ASP 62 Ca 0.30 -0.22 0.00 0.00 0.42 0.00 0.00 57.03 57.54 2i9y h ASP 62 Cb 0.93 -0.08 0.00 0.00 1.72 0.00 0.00 39.33 41.91 2i9y h ASP 62 CO 1.38 1.07 -0.59 -0.11 -2.88 0.00 0.00 179.24 178.11 2i9y n LEU 63 N -3.58 -7.13 -4.42 2.28 7.94 -1.19 -4.92 117.00 105.98 2i9y n LEU 63 Ca -0.04 0.76 -0.44 0.00 -1.11 0.00 0.00 56.01 55.18 2i9y n LEU 63 Cb 0.87 -3.04 -0.03 0.00 0.53 0.00 0.00 43.42 41.75 2i9y n LEU 63 CO 0.49 -2.31 0.72 -2.28 -1.11 0.00 0.00 177.39 172.90 2i9y s HIS 64 N -2.00 2.98 0.16 1.96 5.65 0.77 -4.96 115.29 119.85 2i9y s HIS 64 Ca 0.13 -1.03 0.07 0.00 0.25 0.00 0.00 55.06 54.48 2i9y s HIS 64 Cb -0.04 -4.19 -0.04 0.00 -1.18 0.00 0.00 32.58 27.13 2i9y s HIS 64 CO 0.66 -1.46 0.00 -1.21 -0.65 0.00 0.00 174.74 172.08 2i9y s GLU 65 N 3.00 2.44 0.22 2.88 2.02 -1.26 -4.74 118.70 123.25 2i9y s GLU 65 Ca 0.23 -1.06 -0.30 0.00 0.02 0.00 0.00 54.97 53.85 2i9y s GLU 65 Cb -0.14 -2.39 -0.09 0.00 0.10 0.00 0.00 34.13 31.61 2i9y s GLU 65 CO 0.01 0.47 1.33 0.20 0.02 0.00 0.00 175.26 177.29 2i9y s GLY 66 N -2.86 2.46 0.51 -1.39 0.00 -1.26 -4.87 107.32 99.90 2i9y s GLY 66 Ca 0.27 1.16 0.34 0.00 0.00 0.00 0.00 44.72 46.49 2i9y s GLY 66 CO 0.19 2.10 2.04 -0.55 0.00 0.00 0.00 173.10 176.88 2i9y h ASP 67 N 5.19 0.00 -0.55 1.64 3.32 -1.94 0.15 116.42 124.24 2i9y h ASP 67 Ca -0.45 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.60 2i9y h ASP 67 Cb 1.22 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.77 2i9y h ASP 67 CO 0.77 0.00 0.00 0.79 -1.72 0.00 0.00 179.24 179.08 2i9y n TRP 68 N -2.76 1.70 -0.06 4.55 7.02 -1.26 -4.87 117.44 121.76 2i9y n TRP 68 Ca -0.01 -0.71 0.00 0.00 -1.02 0.00 0.00 57.50 55.76 2i9y n TRP 68 Cb 0.11 -0.39 0.00 0.00 -2.42 0.00 0.00 31.31 28.61 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 0.61 0.97 5.11 6.99 0.00 0.46 -4.56 105.19 114.77 2i9y n GLY 69 Ca 0.26 -0.02 0.00 0.00 0.00 0.00 0.00 46.02 46.26 2i9y n GLY 69 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2i9y n THR 70 N -2.06 0.00 -2.26 2.61 -1.04 -0.80 -4.81 114.28 105.92 2i9y n THR 70 Ca 0.00 0.00 -0.43 0.00 -2.04 0.00 0.00 64.05 61.58 2i9y n THR 70 Cb 0.00 0.00 -0.02 0.00 -1.82 0.00 0.00 70.33 68.49 2i9y n THR 70 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 2i9y s VAL 71 N 0.00 4.00 0.00 12.58 1.01 -1.26 -1.22 120.40 135.51 2i9y s VAL 71 Ca 0.00 1.22 0.00 0.00 0.00 0.00 0.00 61.98 63.20 2i9y s VAL 71 Cb 0.00 -3.79 0.00 0.00 0.00 0.00 0.00 36.38 32.59 2i9y s VAL 71 CO 0.00 -0.11 0.00 0.61 0.00 0.00 0.00 175.10 175.60 2i9y n GLY 72 N 3.81 0.71 3.86 4.51 0.00 -0.20 -5.02 105.19 112.87 2i9y n GLY 72 Ca 0.15 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.86 2i9y n GLY 72 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2i9y s SER 73 N -2.99 6.64 -0.14 1.61 0.15 -0.35 -4.71 113.70 113.90 2i9y s SER 73 Ca 0.00 1.31 0.00 0.00 0.70 0.00 0.00 55.95 57.96 2i9y s SER 73 Cb 0.00 -2.39 0.02 0.00 -1.71 0.00 0.00 66.02 61.94 2i9y s SER 73 CO 0.00 -0.39 -0.14 -0.63 1.20 0.00 0.00 173.24 173.29 2i9y s ILE 74 N -2.31 1.52 0.07 6.45 1.01 -1.26 -1.47 121.20 125.21 2i9y s ILE 74 Ca 0.54 -0.60 0.09 0.00 0.00 0.00 0.00 60.65 60.68 2i9y s ILE 74 Cb -0.10 -1.43 -0.03 0.00 0.01 0.00 0.00 42.46 40.90 2i9y s ILE 74 CO 0.26 0.45 -0.22 -0.69 0.00 0.00 0.00 174.94 174.74 2i9y s VAL 75 N 1.50 2.50 0.15 2.92 1.01 -1.26 -4.98 120.40 122.23 2i9y s VAL 75 Ca 0.05 -1.42 0.11 0.00 0.00 0.00 0.00 61.98 60.71 2i9y s VAL 75 Cb -0.13 -2.06 -0.04 0.00 0.00 0.00 0.00 36.38 34.15 2i9y s VAL 75 CO -0.10 0.25 -0.25 -0.36 0.00 0.00 0.00 175.10 174.64 2i9y s PHE 76 N -0.96 2.20 -0.18 5.22 0.08 -1.26 -4.34 117.98 118.75 2i9y s PHE 76 Ca 0.14 -0.38 0.01 0.00 0.12 0.00 0.00 56.93 56.81 2i9y s PHE 76 Cb -0.10 -1.16 0.01 0.00 -0.57 0.00 0.00 43.02 41.20 2i9y s PHE 76 CO 0.05 0.37 -0.18 -1.58 -0.10 0.00 0.00 175.22 173.78 2i9y s TRP 77 N -1.32 2.78 -0.15 0.36 0.51 -1.14 -5.00 118.94 114.99 2i9y s TRP 77 Ca 0.15 -1.47 -0.03 0.00 -2.12 0.00 0.00 56.10 52.62 2i9y s TRP 77 Cb -0.09 -1.92 -0.03 0.00 -0.81 0.00 0.00 33.47 30.62 2i9y s TRP 77 CO 0.07 -0.72 -0.04 -0.80 -0.51 0.00 0.00 176.95 174.94 2i9y s ASN 78 N 1.19 4.74 -0.02 2.95 -0.87 -1.26 -0.83 114.94 120.84 2i9y s ASN 78 Ca 0.02 -0.14 -0.29 0.00 -1.57 0.00 0.00 52.86 50.89 2i9y s ASN 78 Cb -0.14 -1.75 0.09 0.00 -0.02 0.00 0.00 41.25 39.43 2i9y s ASN 78 CO -0.09 0.18 0.76 -0.72 -2.57 0.00 0.00 177.10 174.66 2i9y s TYR 79 N 0.30 -0.52 -0.27 2.20 1.13 -0.61 -5.04 117.35 114.55 2i9y s TYR 79 Ca -0.04 0.71 -0.07 0.00 -1.41 0.00 0.00 57.07 56.25 2i9y s TYR 79 Cb -0.14 0.47 -0.02 0.00 -1.10 0.00 0.00 41.96 41.17 2i9y s TYR 79 CO 0.03 -0.60 0.08 0.08 -2.51 0.00 0.00 175.55 172.63 2i9y s VAL 80 N -2.03 4.24 -0.34 -3.49 1.01 -1.26 -0.11 120.40 118.42 2i9y s VAL 80 Ca -0.04 -0.33 -0.06 0.00 0.00 0.00 0.00 61.98 61.55 2i9y s VAL 80 Cb -0.00 -3.05 0.04 0.00 0.00 0.00 0.00 36.38 33.37 2i9y s VAL 80 CO 0.00 0.25 0.10 -2.28 0.00 0.00 0.00 175.10 173.17 2i9y s HIS 81 N 1.59 3.26 -1.57 5.22 5.04 0.12 -4.59 115.29 124.36 2i9y s HIS 81 Ca 0.05 -1.46 -0.03 0.00 -1.54 0.00 0.00 55.06 52.09 2i9y s HIS 81 Cb -0.16 -2.27 0.00 0.00 0.04 0.00 0.00 32.58 30.20 2i9y s HIS 81 CO 0.03 -0.74 0.34 -0.25 -2.34 0.00 0.00 174.74 171.79 2i9y n ASP 82 N 4.80 -5.81 0.00 9.88 8.00 -1.26 -1.61 116.55 130.55 2i9y n ASP 82 Ca -0.12 -0.17 0.00 0.00 0.71 0.00 0.00 54.79 55.21 2i9y n ASP 82 Cb 0.45 -4.72 0.00 0.00 -0.02 0.00 0.00 41.12 36.83 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 -1.30 1.38 3.65 0.44 0.00 -1.26 -5.02 105.19 103.08 2i9y n GLY 83 Ca -0.16 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.51 2i9y n GLY 83 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2i9y s GLU 84 N -0.54 3.84 -0.03 1.61 2.02 -0.63 -5.06 118.70 119.90 2i9y s GLU 84 Ca 0.00 -0.34 -0.30 0.00 0.02 0.00 0.00 54.97 54.35 2i9y s GLU 84 Cb 0.00 -3.16 -0.03 0.00 0.10 0.00 0.00 34.13 31.03 2i9y s GLU 84 CO 0.00 0.35 1.13 0.00 0.02 0.00 0.00 175.26 176.76 2i9y s ALA 85 N 0.14 3.40 0.04 5.21 0.00 -1.26 0.11 121.76 129.40 2i9y s ALA 85 Ca 0.05 0.61 0.08 0.00 0.00 0.00 0.00 51.96 52.69 2i9y s ALA 85 Cb -0.12 -3.46 -0.03 0.00 0.00 0.00 0.00 23.12 19.51 2i9y s ALA 85 CO 0.01 -0.58 -0.23 0.15 0.00 0.00 0.00 175.76 175.10 2i9y s LYS 86 N 1.75 1.61 -0.04 0.00 3.01 0.85 -4.91 119.74 122.01 2i9y s LYS 86 Ca 0.54 -1.00 0.02 0.00 -1.01 0.00 0.00 55.97 54.53 2i9y s LYS 86 Cb -0.24 -1.73 0.01 0.00 -1.01 0.00 0.00 37.83 34.86 2i9y s LYS 86 CO 0.24 0.45 -0.10 0.08 0.51 0.00 0.00 175.35 176.53 2i9y s VAL 87 N -0.77 0.88 -0.31 3.17 1.01 -1.26 -1.57 120.40 121.55 2i9y s VAL 87 Ca 0.09 -0.37 -0.07 0.00 0.00 0.00 0.00 61.98 61.63 2i9y s VAL 87 Cb -0.09 -0.81 0.02 0.00 0.00 0.00 0.00 36.38 35.49 2i9y s VAL 87 CO 0.02 0.29 0.10 0.00 0.00 0.00 0.00 175.10 175.50 2i9y s ALA 88 N 0.47 3.09 -0.18 5.51 0.00 -0.01 -3.72 121.76 126.92 2i9y s ALA 88 Ca -0.08 -1.52 -0.01 0.00 0.00 0.00 0.00 51.96 50.34 2i9y s ALA 88 Cb -0.12 -2.22 -0.00 0.00 0.00 0.00 0.00 23.12 20.78 2i9y s ALA 88 CO 0.02 -1.03 -0.11 0.15 0.00 0.00 0.00 175.76 174.78 2i9y s LYS 89 N 1.49 3.27 0.14 0.00 1.02 -1.25 -2.87 119.74 121.54 2i9y s LYS 89 Ca 0.02 -0.70 -0.09 0.00 0.02 0.00 0.00 55.97 55.22 2i9y s LYS 89 Cb -0.18 -2.77 -0.01 0.00 -0.52 0.00 0.00 37.83 34.35 2i9y s LYS 89 CO 0.03 -0.08 0.26 -1.83 -0.92 0.00 0.00 175.35 172.81 2i9y s GLU 90 N 1.11 1.07 -0.03 1.68 -1.05 -1.26 -3.07 118.70 117.15 2i9y s GLU 90 Ca 0.01 -1.11 0.01 0.00 -0.15 0.00 0.00 54.97 53.72 2i9y s GLU 90 Cb -0.14 0.37 0.02 0.00 -0.44 0.00 0.00 34.13 33.93 2i9y s GLU 90 CO -0.03 -0.38 -0.03 0.50 0.95 0.00 0.00 175.26 176.27 2i9y s ARG 91 N -3.94 0.49 -0.05 -4.83 3.52 0.11 -4.30 118.95 109.96 2i9y s ARG 91 Ca 0.14 -0.05 -0.30 0.00 -0.13 0.00 0.00 55.73 55.39 2i9y s ARG 91 Cb 0.04 -0.56 -0.05 0.00 -1.56 0.00 0.00 34.95 32.82 2i9y s ARG 91 CO -0.03 -0.05 1.42 0.42 -0.81 0.00 0.00 175.30 176.25 2i9y s ILE 92 N 0.66 3.82 -0.15 4.11 1.01 -0.54 -0.96 121.20 129.15 2i9y s ILE 92 Ca -0.07 1.12 0.06 0.00 0.00 0.00 0.00 60.65 61.75 2i9y s ILE 92 Cb -0.11 -3.72 -0.23 0.00 0.01 0.00 0.00 42.46 38.41 2i9y s ILE 92 CO -0.01 -0.04 0.23 1.21 0.00 0.00 0.00 174.94 176.33 2i9y n GLU 93 N 6.03 0.69 -3.59 2.79 0.00 0.33 -1.03 120.64 125.85 2i9y n GLU 93 Ca 0.14 0.18 -0.16 0.00 0.00 0.00 0.00 57.16 57.33 2i9y n GLU 93 Cb 0.44 -1.64 -0.07 0.00 0.00 0.00 0.00 31.44 30.17 2i9y n GLU 93 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 2i9y s ALA 94 N -2.54 -1.66 -0.07 4.31 0.00 -1.22 -4.60 121.76 115.97 2i9y s ALA 94 Ca -0.18 1.54 -0.03 0.00 0.00 0.00 0.00 51.96 53.29 2i9y s ALA 94 Cb 0.07 -0.53 0.04 0.00 0.00 0.00 0.00 23.12 22.71 2i9y s ALA 94 CO 0.76 -0.34 0.13 0.08 0.00 0.00 0.00 175.76 176.39 2i9y s VAL 95 N -0.46 -0.18 -0.35 0.00 1.01 -1.26 -0.17 120.40 119.00 2i9y s VAL 95 Ca -0.06 0.32 -0.03 0.00 0.00 0.00 0.00 61.98 62.22 2i9y s VAL 95 Cb -0.03 -0.24 0.07 0.00 0.00 0.00 0.00 36.38 36.18 2i9y s VAL 95 CO 0.05 0.14 0.09 -1.61 0.00 0.00 0.00 175.10 173.77 2i9y s GLU 96 N 1.96 2.32 0.33 2.72 0.41 0.94 -4.95 118.70 122.42 2i9y s GLU 96 Ca 0.00 -1.44 0.06 0.00 -0.41 0.00 0.00 54.97 53.18 2i9y s GLU 96 Cb -0.12 -3.37 0.58 0.00 -1.78 0.00 0.00 34.13 29.44 2i9y s GLU 96 CO -0.05 -0.79 1.81 -1.35 -0.49 0.00 0.00 175.26 174.39 2i9y h PRO 97 N 8.06 0.34 0.12 0.39 0.11 -1.97 -0.11 132.00 138.94 2i9y h PRO 97 Ca -0.19 -0.11 -0.28 0.00 0.11 0.00 0.00 66.00 65.54 2i9y h PRO 97 Cb 1.06 -0.03 0.01 0.00 0.11 0.00 0.00 31.00 32.15 2i9y h PRO 97 CO 0.60 0.54 -1.21 0.22 -0.21 0.00 0.00 178.00 177.94 2i9y h ASP 98 N 0.31 0.55 0.20 -2.05 1.82 -1.95 -3.26 116.42 112.04 2i9y h ASP 98 Ca 0.05 -0.55 0.00 0.00 -0.39 0.00 0.00 57.03 56.15 2i9y h ASP 98 Cb 0.55 -0.18 0.00 0.00 0.68 0.00 0.00 39.33 40.39 2i9y h ASP 98 CO 0.04 1.40 -0.29 0.29 -1.61 0.00 0.00 179.24 179.07 2i9y n LYS 99 N -3.63 0.88 -3.66 0.28 5.02 -1.17 -4.94 118.16 110.93 2i9y n LYS 99 Ca -0.10 -0.55 -0.23 0.00 -2.02 0.00 0.00 58.31 55.41 2i9y n LYS 99 Cb 0.99 -1.49 0.05 0.00 -0.02 0.00 0.00 35.03 34.57 2i9y n LYS 99 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 2i9y n ASN 100 N -0.58 -3.18 -4.34 4.39 3.02 -0.16 -4.69 115.26 109.71 2i9y n ASN 100 Ca 0.12 -0.71 -0.31 0.00 -0.03 0.00 0.00 54.58 53.65 2i9y n ASN 100 Cb 0.36 -4.47 -0.15 0.00 -0.61 0.00 0.00 39.78 34.91 2i9y n ASN 100 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 2i9y s LEU 101 N -6.86 2.17 -0.16 3.41 2.96 -0.54 -1.65 118.68 118.01 2i9y s LEU 101 Ca 0.26 -0.49 -0.07 0.00 -0.22 0.00 0.00 54.13 53.61 2i9y s LEU 101 Cb -0.12 -1.35 0.07 0.00 0.50 0.00 0.00 46.19 45.29 2i9y s LEU 101 CO 0.78 0.30 0.36 -0.51 -1.32 0.00 0.00 176.35 175.96 2i9y s ILE 102 N -0.70 -0.33 -0.26 6.68 2.07 -0.44 -0.04 121.20 128.18 2i9y s ILE 102 Ca 0.11 0.17 -0.10 0.00 -1.41 0.00 0.00 60.65 59.41 2i9y s ILE 102 Cb -0.10 -0.56 -0.05 0.00 0.13 0.00 0.00 42.46 41.88 2i9y s ILE 102 CO 0.00 0.07 0.16 -0.89 -1.91 0.00 0.00 174.94 172.38 2i9y s THR 103 N 2.02 5.22 -0.19 4.00 2.01 0.76 -1.14 115.64 128.32 2i9y s THR 103 Ca -0.04 0.14 -0.05 0.00 0.31 0.00 0.00 61.69 62.04 2i9y s THR 103 Cb -0.11 -3.46 -0.03 0.00 0.01 0.00 0.00 72.50 68.91 2i9y s THR 103 CO -0.11 0.30 0.01 -0.36 -0.69 0.00 0.00 174.62 173.76 2i9y s PHE 104 N 1.46 3.08 -0.08 4.92 0.08 0.11 -0.52 117.98 127.03 2i9y s PHE 104 Ca 0.07 -0.31 0.01 0.00 0.12 0.00 0.00 56.93 56.82 2i9y s PHE 104 Cb -0.15 -2.06 -0.03 0.00 -0.57 0.00 0.00 43.02 40.21 2i9y s PHE 104 CO 0.08 -0.12 -0.10 0.50 -0.10 0.00 0.00 175.22 175.48 2i9y s ARG 105 N 0.77 2.83 -0.04 0.44 3.52 -0.13 -0.75 118.95 125.59 2i9y s ARG 105 Ca 0.01 -0.61 -0.23 0.00 -0.13 0.00 0.00 55.73 54.76 2i9y s ARG 105 Cb -0.14 -2.56 -0.04 0.00 -1.56 0.00 0.00 34.95 30.65 2i9y s ARG 105 CO 0.02 0.56 0.70 0.54 -0.81 0.00 0.00 175.30 176.31 2i9y s VAL 106 N -0.54 4.97 -0.07 7.11 0.11 -0.27 0.06 120.40 131.78 2i9y s VAL 106 Ca 0.08 1.46 0.13 0.00 -2.93 0.00 0.00 61.98 60.72 2i9y s VAL 106 Cb -0.12 -4.05 -0.19 0.00 -1.53 0.00 0.00 36.38 30.50 2i9y s VAL 106 CO 0.02 0.29 0.19 2.30 -3.33 0.00 0.00 175.10 174.56 2i9y n ILE 107 N 3.48 0.38 -3.83 7.04 -0.00 -1.18 -4.68 119.36 120.58 2i9y n ILE 107 Ca -0.02 -0.41 -0.03 0.00 -0.00 0.00 0.00 62.75 62.29 2i9y n ILE 107 Cb 0.51 -0.19 0.01 0.00 -0.00 0.00 0.00 39.64 39.97 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 1.25 0.00 6.28 2.12 -1.26 -5.06 118.70 119.37 2i9y s GLU 108 Ca -0.06 -0.77 0.00 0.00 0.36 0.00 0.00 54.97 54.51 2i9y s GLU 108 Cb 0.07 0.37 0.00 0.00 0.26 0.00 0.00 34.13 34.83 2i9y s GLU 108 CO 0.54 -0.58 0.00 0.41 -0.54 0.00 0.00 175.26 175.09 2i9y n GLY 109 N -0.62 0.11 0.18 -1.50 0.00 -1.26 -3.83 105.19 98.26 2i9y n GLY 109 Ca -0.04 -2.30 -0.04 0.00 0.00 0.00 0.00 46.02 43.64 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 -0.08 0.73 1.61 3.58 -1.96 -1.95 116.42 118.34 2i9y h ASP 110 Ca 0.00 0.09 -0.04 0.00 0.42 0.00 0.00 57.03 57.49 2i9y h ASP 110 Cb 0.00 0.14 -0.01 0.00 1.72 0.00 0.00 39.33 41.18 2i9y h ASP 110 CO 0.00 -0.01 -0.21 -0.07 -2.88 0.00 0.00 179.24 176.07 2i9y h LEU 111 N 0.16 0.00 -0.60 2.28 3.38 -1.88 -2.86 115.31 115.79 2i9y h LEU 111 Ca 0.21 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.18 2i9y h LEU 111 Cb 0.28 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.03 2i9y h LEU 111 CO -0.31 0.21 0.00 -0.03 0.09 0.00 0.00 178.44 178.40 2i9y h MET 112 N 0.00 0.00 -0.01 1.13 4.05 -1.49 0.61 114.93 119.22 2i9y h MET 112 Ca -0.00 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.42 2i9y h MET 112 Cb 0.63 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.43 2i9y h MET 112 CO 0.03 0.00 -0.15 1.63 0.23 0.00 0.00 176.91 178.65 2i9y n LYS 113 N -2.34 1.21 -0.02 0.39 4.76 -1.08 -4.08 118.16 117.00 2i9y n LYS 113 Ca 0.03 -0.73 -0.02 0.00 -2.87 0.00 0.00 58.31 54.72 2i9y n LYS 113 Cb 0.29 -1.48 -0.02 0.00 -1.84 0.00 0.00 35.03 31.98 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 -0.26 1.93 -4.92 1.97 1.02 -0.71 -4.99 120.64 114.68 2i9y n GLU 114 Ca 0.15 0.01 -0.28 0.00 -0.02 0.00 0.00 57.16 57.02 2i9y n GLU 114 Cb 0.36 -1.07 -0.16 0.00 -0.02 0.00 0.00 31.44 30.54 2i9y n GLU 114 CO 0.00 0.00 0.00 0.71 1.18 0.00 0.00 177.13 179.02 2i9y s TYR 115 N -2.07 1.95 -1.25 -0.32 2.02 0.13 -3.00 117.35 114.81 2i9y s TYR 115 Ca -0.03 -0.68 0.30 0.00 -0.37 0.00 0.00 57.07 56.29 2i9y s TYR 115 Cb 0.01 -1.33 1.38 0.00 -0.40 0.00 0.00 41.96 41.62 2i9y s TYR 115 CO 0.10 -0.27 1.99 0.36 -1.57 0.00 0.00 175.55 176.16 2i9y n LYS 116 N 3.40 0.25 -3.64 -0.62 2.85 -0.26 -4.07 118.16 116.07 2i9y n LYS 116 Ca -0.20 -0.01 -0.06 0.00 -1.05 0.00 0.00 58.31 57.00 2i9y n LYS 116 Cb 0.52 -1.50 -0.07 0.00 -0.65 0.00 0.00 35.03 33.34 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 -2.76 -0.80 -0.13 -5.58 0.15 -1.22 -4.98 113.70 98.39 2i9y s SER 117 Ca 0.22 1.28 -0.04 0.00 0.70 0.00 0.00 55.95 58.12 2i9y s SER 117 Cb 0.20 1.33 0.06 0.00 -1.71 0.00 0.00 66.02 65.89 2i9y s SER 117 CO 0.49 -0.20 0.16 0.12 1.20 0.00 0.00 173.24 175.01 2i9y s PHE 118 N 1.47 -0.12 -0.03 3.44 5.36 -1.26 -0.15 117.98 126.70 2i9y s PHE 118 Ca -0.09 0.31 0.00 0.00 -0.96 0.00 0.00 56.93 56.19 2i9y s PHE 118 Cb -0.05 -0.38 0.03 0.00 -0.34 0.00 0.00 43.02 42.28 2i9y s PHE 118 CO -0.17 -0.40 0.01 -1.17 -1.46 0.00 0.00 175.22 172.03 2i9y s LEU 119 N 2.27 1.12 -0.01 6.12 0.20 -0.64 -1.12 118.68 126.62 2i9y s LEU 119 Ca 0.04 -0.00 0.03 0.00 0.69 0.00 0.00 54.13 54.89 2i9y s LEU 119 Cb -0.14 -0.17 -0.01 0.00 -0.43 0.00 0.00 46.19 45.44 2i9y s LEU 119 CO -0.08 -0.11 -0.11 -1.48 -0.29 0.00 0.00 176.35 174.28 2i9y s LEU 120 N 1.05 1.99 -0.05 -0.68 2.34 0.07 -1.21 118.68 122.18 2i9y s LEU 120 Ca -0.09 -0.21 0.06 0.00 0.06 0.00 0.00 54.13 53.95 2i9y s LEU 120 Cb -0.13 -0.60 -0.01 0.00 -0.56 0.00 0.00 46.19 44.89 2i9y s LEU 120 CO -0.02 0.13 -0.25 -0.89 -1.06 0.00 0.00 176.35 174.26 2i9y s THR 121 N -0.20 2.09 0.05 5.48 2.01 0.77 0.07 115.64 125.91 2i9y s THR 121 Ca 0.03 -1.06 0.08 0.00 0.31 0.00 0.00 61.69 61.05 2i9y s THR 121 Cb -0.05 -1.75 -0.03 0.00 0.01 0.00 0.00 72.50 70.68 2i9y s THR 121 CO -0.00 0.57 -0.22 0.27 -0.69 0.00 0.00 174.62 174.55 2i9y s ILE 122 N -0.22 1.76 -0.07 1.82 -4.36 -0.29 -1.00 121.20 118.84 2i9y s ILE 122 Ca -0.02 -1.29 -0.03 0.00 -0.26 0.00 0.00 60.65 59.05 2i9y s ILE 122 Cb -0.13 -1.53 0.04 0.00 1.25 0.00 0.00 42.46 42.08 2i9y s ILE 122 CO 0.03 0.19 0.14 -1.58 0.24 0.00 0.00 174.94 173.96 2i9y s GLN 123 N -1.31 0.06 -0.17 0.37 0.74 -1.04 -1.33 119.66 116.98 2i9y s GLN 123 Ca 0.08 0.42 -0.13 0.00 0.05 0.00 0.00 55.36 55.78 2i9y s GLN 123 Cb -0.09 -0.22 -0.05 0.00 1.10 0.00 0.00 33.01 33.75 2i9y s GLN 123 CO 0.02 -0.21 0.25 0.08 -0.55 0.00 0.00 175.29 174.88 2i9y s VAL 124 N 1.53 5.33 0.02 1.34 1.01 -0.66 -1.22 120.40 127.76 2i9y s VAL 124 Ca -0.05 0.45 0.01 0.00 0.00 0.00 0.00 61.98 62.39 2i9y s VAL 124 Cb -0.12 -3.59 -0.02 0.00 0.00 0.00 0.00 36.38 32.65 2i9y s VAL 124 CO -0.06 0.40 -0.04 0.28 0.00 0.00 0.00 175.10 175.69 2i9y s THR 125 N 0.43 0.22 -0.42 3.92 -1.32 -0.71 -4.67 115.64 113.08 2i9y s THR 125 Ca 0.14 -0.86 -0.27 0.00 -1.21 0.00 0.00 61.69 59.49 2i9y s THR 125 Cb -0.12 -0.33 -0.04 0.00 -1.51 0.00 0.00 72.50 70.50 2i9y s THR 125 CO 0.02 -0.41 2.04 -2.16 -2.21 0.00 0.00 174.62 171.90 2i9y s PRO 126 N -1.33 2.81 0.06 7.08 0.04 -1.26 -2.55 135.00 139.85 2i9y s PRO 126 Ca -0.13 1.31 -0.01 0.00 0.04 0.00 0.00 61.00 62.22 2i9y s PRO 126 Cb -0.09 -4.37 -0.00 0.00 0.04 0.00 0.00 34.50 30.08 2i9y s PRO 126 CO -0.01 -2.48 -0.01 1.17 0.04 0.00 0.00 177.00 175.71 2i9y n LYS 127 N 8.83 0.02 0.00 4.56 4.81 -1.26 -4.87 118.16 130.25 2i9y n LYS 127 Ca 0.27 0.01 -0.08 0.00 -0.87 0.00 0.00 58.31 57.63 2i9y n LYS 127 Cb 0.50 -0.54 -0.07 0.00 0.02 0.00 0.00 35.03 34.94 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 -0.04 -0.12 0.00 1.64 0.11 -1.86 -3.50 132.00 128.23 2i9y h PRO 128 Ca -0.01 0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.11 2i9y h PRO 128 Cb 0.33 0.03 0.00 0.00 0.11 0.00 0.00 31.00 31.47 2i9y h PRO 128 CO -0.01 0.32 0.00 0.41 -0.21 0.00 0.00 178.00 178.52 2i9y n GLY 129 N 1.17 3.44 7.00 -0.55 0.00 -0.23 -5.01 105.19 111.01 2i9y n GLY 129 Ca -0.06 -1.58 0.00 0.00 0.00 0.00 0.00 46.02 44.38 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 -0.11 3.33 1.50 -0.02 0.00 -1.26 -3.27 105.19 105.36 2i9y n GLY 130 Ca 0.00 -0.14 0.00 0.00 0.00 0.00 0.00 46.02 45.88 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 13.15 0.94 -3.30 1.61 -0.04 -1.26 -2.98 135.00 143.12 2i9y n PRO 131 Ca 0.00 0.00 0.03 0.00 -0.04 0.00 0.00 63.50 63.49 2i9y n PRO 131 Cb 0.00 -1.03 -0.02 0.00 -0.04 0.00 0.00 33.50 32.41 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 1.95 -0.74 0.03 0.55 0.00 -1.20 -4.30 107.32 103.60 2i9y s GLY 132 Ca 0.00 2.25 0.03 0.00 0.00 0.00 0.00 44.72 47.00 2i9y s GLY 132 CO 0.00 3.35 -0.09 -0.56 0.00 0.00 0.00 173.10 175.80 2i9y s SER 133 N 2.84 1.07 -0.20 1.64 0.01 0.18 -1.06 113.70 118.18 2i9y s SER 133 Ca 0.08 -0.37 -0.10 0.00 1.31 0.00 0.00 55.95 56.88 2i9y s SER 133 Cb -0.13 -0.05 -0.05 0.00 0.21 0.00 0.00 66.02 66.01 2i9y s SER 133 CO -0.19 -0.03 0.12 -0.63 0.41 0.00 0.00 173.24 172.92 2i9y s ILE 134 N -0.79 5.31 -0.24 1.44 -1.09 -1.06 -0.59 121.20 124.17 2i9y s ILE 134 Ca -0.02 0.15 -0.06 0.00 -2.23 0.00 0.00 60.65 58.49 2i9y s ILE 134 Cb -0.07 -3.42 -0.02 0.00 -1.58 0.00 0.00 42.46 37.38 2i9y s ILE 134 CO 0.00 0.45 0.04 0.54 -1.23 0.00 0.00 174.94 174.74 2i9y s VAL 135 N 0.34 4.04 -0.36 2.92 0.11 0.30 -1.74 120.40 126.00 2i9y s VAL 135 Ca 0.07 -0.27 -0.21 0.00 -2.93 0.00 0.00 61.98 58.64 2i9y s VAL 135 Cb -0.11 -2.88 0.00 0.00 -1.53 0.00 0.00 36.38 31.86 2i9y s VAL 135 CO -0.02 0.36 0.67 -1.00 -3.33 0.00 0.00 175.10 171.79 2i9y s HIS 136 N 1.58 3.14 -0.25 1.54 0.09 -0.36 -1.71 115.29 119.32 2i9y s HIS 136 Ca 0.06 0.40 -0.16 0.00 -0.00 0.00 0.00 55.06 55.37 2i9y s HIS 136 Cb -0.15 -3.20 -0.03 0.00 -0.00 0.00 0.00 32.58 29.19 2i9y s HIS 136 CO 0.02 -0.65 0.42 -1.58 -0.00 0.00 0.00 174.74 172.94 2i9y s TRP 137 N 2.81 3.27 -0.25 1.40 0.52 0.21 -2.50 118.94 124.40 2i9y s TRP 137 Ca 0.26 0.52 0.02 0.00 0.02 0.00 0.00 56.10 56.92 2i9y s TRP 137 Cb -0.14 -2.61 0.06 0.00 -1.15 0.00 0.00 33.47 29.63 2i9y s TRP 137 CO 0.15 -0.21 -0.10 -1.58 0.02 0.00 0.00 176.95 175.23 2i9y s HIS 138 N 2.01 3.06 -0.11 -1.98 2.46 -0.17 -1.48 115.29 119.08 2i9y s HIS 138 Ca 0.18 -2.17 0.01 0.00 0.47 0.00 0.00 55.06 53.54 2i9y s HIS 138 Cb -0.16 -1.86 -0.02 0.00 -0.13 0.00 0.00 32.58 30.42 2i9y s HIS 138 CO 0.09 -0.85 -0.14 -0.51 -2.47 0.00 0.00 174.74 170.86 2i9y s LEU 139 N 1.17 2.68 -0.05 8.88 1.02 0.79 -0.17 118.68 133.00 2i9y s LEU 139 Ca -0.08 -0.31 0.01 0.00 0.02 0.00 0.00 54.13 53.77 2i9y s LEU 139 Cb -0.19 -1.58 0.02 0.00 0.02 0.00 0.00 46.19 44.46 2i9y s LEU 139 CO -0.06 0.21 -0.05 -1.61 0.02 0.00 0.00 176.35 174.87 2i9y s GLU 140 N 0.05 0.92 -0.00 1.70 2.02 -0.35 -0.91 118.70 122.13 2i9y s GLU 140 Ca -0.05 -0.11 -0.15 0.00 0.02 0.00 0.00 54.97 54.68 2i9y s GLU 140 Cb -0.15 -0.95 0.02 0.00 0.10 0.00 0.00 34.13 33.15 2i9y s GLU 140 CO 0.04 -0.11 0.31 1.52 0.02 0.00 0.00 175.26 177.04 2i9y s TYR 141 N 1.09 -0.17 -0.32 1.61 1.13 -0.27 -1.62 117.35 118.80 2i9y s TYR 141 Ca -0.08 0.21 -0.09 0.00 -1.41 0.00 0.00 57.07 55.69 2i9y s TYR 141 Cb -0.14 0.10 0.00 0.00 -1.10 0.00 0.00 41.96 40.82 2i9y s TYR 141 CO -0.01 -0.42 0.14 -2.00 -2.51 0.00 0.00 175.55 170.75 2i9y s GLU 142 N -1.61 3.20 0.36 -3.49 2.56 0.79 -0.48 118.70 120.03 2i9y s GLU 142 Ca -0.12 -0.80 -0.27 0.00 0.00 0.00 0.00 54.97 53.78 2i9y s GLU 142 Cb -0.04 -3.54 -0.09 0.00 2.00 0.00 0.00 34.13 32.46 2i9y s GLU 142 CO 0.03 -0.46 1.19 0.15 -0.56 0.00 0.00 175.26 175.60 2i9y s LYS 143 N 1.58 4.22 0.03 4.30 3.01 0.24 -1.10 119.74 132.01 2i9y s LYS 143 Ca 0.04 1.91 -0.18 0.00 -1.01 0.00 0.00 55.97 56.73 2i9y s LYS 143 Cb -0.17 -2.85 -0.24 0.00 -1.01 0.00 0.00 37.83 33.56 2i9y s LYS 143 CO 0.05 -0.20 1.12 0.82 0.51 0.00 0.00 175.35 177.65 2i9y h ILE 144 N 2.61 1.37 -2.68 2.17 2.04 -1.87 -3.43 117.51 117.72 2i9y h ILE 144 Ca -0.48 -2.20 0.11 0.00 1.00 0.00 0.00 64.86 63.29 2i9y h ILE 144 Cb 1.23 2.57 -0.05 0.00 -0.74 0.00 0.00 36.82 39.83 2i9y h ILE 144 CO 0.64 0.66 0.38 -0.55 0.00 0.00 0.00 178.15 179.27 2i9y s SER 145 N -7.01 -0.17 0.06 1.72 0.15 -1.26 -5.06 113.70 102.14 2i9y s SER 145 Ca -0.12 -0.60 0.03 0.00 0.70 0.00 0.00 55.95 55.97 2i9y s SER 145 Cb 0.05 0.62 -0.24 0.00 -1.71 0.00 0.00 66.02 64.73 2i9y s SER 145 CO 0.87 -1.17 1.05 -0.33 1.20 0.00 0.00 173.24 174.86 2i9y h GLU 146 N 2.00 0.11 0.00 5.44 4.39 -1.94 -3.23 114.58 121.35 2i9y h GLU 146 Ca -0.24 -0.19 0.00 0.00 0.34 0.00 0.00 59.36 59.27 2i9y h GLU 146 Cb 1.24 0.07 0.00 0.00 -0.10 0.00 0.00 28.75 29.96 2i9y h GLU 146 CO 0.27 0.99 0.00 0.93 -1.16 0.00 0.00 179.01 180.04 2i9y h GLU 147 N 0.03 0.00 -0.12 2.33 3.07 -1.98 -1.26 114.58 116.64 2i9y h GLU 147 Ca -0.13 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.73 2i9y h GLU 147 Cb 1.91 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.82 2i9y h GLU 147 CO 0.14 0.00 0.00 1.33 -1.40 0.00 0.00 179.01 179.08 2i9y n VAL 148 N -3.04 0.28 -3.30 3.13 0.24 -1.22 -4.98 118.33 109.43 2i9y n VAL 148 Ca -0.03 -0.64 -0.38 0.00 -2.04 0.00 0.00 64.34 61.25 2i9y n VAL 148 Cb 0.09 1.06 -0.06 0.00 -1.47 0.00 0.00 33.84 33.46 2i9y n VAL 148 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2i9y s ALA 149 N -1.06 3.50 -0.55 2.33 0.00 -0.48 -4.64 121.76 120.85 2i9y s ALA 149 Ca 0.19 -0.13 0.04 0.00 0.00 0.00 0.00 51.96 52.06 2i9y s ALA 149 Cb 0.12 -2.65 0.16 0.00 0.00 0.00 0.00 23.12 20.74 2i9y s ALA 149 CO 0.17 0.09 0.37 -1.01 0.00 0.00 0.00 175.76 175.38 2i9y s HIS 150 N 0.25 2.58 0.54 0.00 3.76 -1.26 -4.94 115.29 116.22 2i9y s HIS 150 Ca 0.27 -2.86 0.23 0.00 -0.15 0.00 0.00 55.06 52.55 2i9y s HIS 150 Cb -0.16 -2.12 1.44 0.00 1.11 0.00 0.00 32.58 32.85 2i9y s HIS 150 CO 0.13 -0.69 2.07 -1.35 -0.85 0.00 0.00 174.74 174.05 2i9y h PRO 151 N 5.91 0.00 -0.38 8.40 0.11 -1.99 -2.61 132.00 141.44 2i9y h PRO 151 Ca 0.11 0.00 0.03 0.00 0.11 0.00 0.00 66.00 66.25 2i9y h PRO 151 Cb 0.85 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 31.92 2i9y h PRO 151 CO 0.58 0.00 0.19 1.49 -0.21 0.00 0.00 178.00 180.05 2i9y h GLU 152 N 0.00 0.37 -0.01 1.05 4.57 -2.01 -2.13 114.58 116.43 2i9y h GLU 152 Ca 0.13 -0.02 -0.14 0.00 -1.18 0.00 0.00 59.36 58.14 2i9y h GLU 152 Cb 0.55 -0.08 -0.02 0.00 -0.16 0.00 0.00 28.75 29.04 2i9y h GLU 152 CO -0.00 0.25 -0.67 1.79 -1.18 0.00 0.00 179.01 179.20 2i9y h THR 153 N 0.39 1.46 -0.21 0.32 1.35 -1.90 -2.81 112.91 111.52 2i9y h THR 153 Ca 0.16 -2.24 -0.01 0.00 -0.55 0.00 0.00 66.41 63.77 2i9y h THR 153 Cb 0.07 2.20 -0.01 0.00 -1.73 0.00 0.00 68.15 68.69 2i9y h THR 153 CO -0.12 0.64 0.10 -0.07 -0.25 0.00 0.00 175.52 175.82 2i9y h LEU 154 N 0.03 0.28 -0.94 3.87 3.38 -1.28 0.20 115.31 120.85 2i9y h LEU 154 Ca -0.01 -0.13 -0.06 0.00 0.09 0.00 0.00 57.88 57.77 2i9y h LEU 154 Cb 1.18 -0.07 -0.02 0.00 0.09 0.00 0.00 40.66 41.83 2i9y h LEU 154 CO 0.09 0.33 0.10 -0.07 0.09 0.00 0.00 178.44 178.98 2i9y h LEU 155 N 0.20 0.82 -0.64 1.67 3.38 -1.34 -1.03 115.31 118.37 2i9y h LEU 155 Ca 0.07 -0.17 -0.15 0.00 0.09 0.00 0.00 57.88 57.73 2i9y h LEU 155 Cb 0.13 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.65 2i9y h LEU 155 CO -0.01 0.83 -0.64 0.06 0.09 0.00 0.00 178.44 178.77 2i9y h GLN 156 N 0.83 0.16 -0.32 1.13 -0.00 -1.25 -2.49 115.11 113.16 2i9y h GLN 156 Ca 0.17 -0.12 -0.01 0.00 -0.00 0.00 0.00 58.65 58.70 2i9y h GLN 156 Cb 0.36 0.02 -0.02 0.00 -0.00 0.00 0.00 27.48 27.84 2i9y h GLN 156 CO 0.01 0.75 0.18 0.35 -0.00 0.00 0.00 178.83 180.11 2i9y h PHE 157 N 0.12 0.44 -0.37 0.06 3.57 0.01 -1.94 116.94 118.83 2i9y h PHE 157 Ca -0.01 -0.01 -0.07 0.00 3.53 0.00 0.00 57.97 61.41 2i9y h PHE 157 Cb 1.15 -0.14 -0.02 0.00 2.79 0.00 0.00 35.95 39.73 2i9y h PHE 157 CO 0.02 0.36 -0.07 0.00 -2.23 0.00 0.00 178.31 176.39 2i9y h VAL 159 N 0.58 1.31 -0.17 0.00 3.04 -1.22 -0.81 116.25 118.98 2i9y h VAL 159 Ca 0.11 -1.76 -0.01 0.00 -1.01 0.00 0.00 66.70 64.04 2i9y h VAL 159 Cb 0.47 1.72 -0.01 0.00 -2.01 0.00 0.00 31.29 31.46 2i9y h VAL 159 CO 0.02 0.55 0.08 -0.33 -1.01 0.00 0.00 177.57 176.89 2i9y h GLU 160 N 0.47 0.24 -0.63 4.17 5.08 -1.07 -2.33 114.58 120.51 2i9y h GLU 160 Ca 0.01 -0.03 -0.04 0.00 -1.00 0.00 0.00 59.36 58.31 2i9y h GLU 160 Cb 1.07 -0.04 -0.03 0.00 0.50 0.00 0.00 28.75 30.25 2i9y h GLU 160 CO 0.10 0.27 0.25 0.28 -1.00 0.00 0.00 179.01 178.92 2i9y h VAL 161 N 0.15 1.22 -0.85 3.13 2.07 -1.21 -2.12 116.25 118.65 2i9y h VAL 161 Ca 0.06 -0.70 0.06 0.00 0.82 0.00 0.00 66.70 66.95 2i9y h VAL 161 Cb 0.11 0.47 -0.05 0.00 -1.52 0.00 0.00 31.29 30.29 2i9y h VAL 161 CO -0.01 0.28 0.55 0.28 0.02 0.00 0.00 177.57 178.69 2i9y h SER 162 N 0.91 0.83 -0.22 0.57 0.02 -0.77 -0.36 113.55 114.53 2i9y h SER 162 Ca 0.21 0.01 -0.15 0.00 -0.84 0.00 0.00 61.79 61.02 2i9y h SER 162 Cb 0.18 -0.17 0.00 0.00 0.14 0.00 0.00 62.40 62.55 2i9y h SER 162 CO -0.02 0.53 -0.46 0.11 -1.14 0.00 0.00 176.83 175.85 2i9y h LYS 163 N 0.94 0.69 -0.27 3.45 1.57 -0.88 -1.86 116.57 120.21 2i9y h LYS 163 Ca 0.36 -0.46 0.03 0.00 -1.87 0.00 0.00 60.65 58.72 2i9y h LYS 163 Cb 0.22 0.06 -0.03 0.00 0.08 0.00 0.00 32.23 32.56 2i9y h LYS 163 CO -0.13 1.08 0.07 0.93 -0.57 0.00 0.00 179.45 180.82 2i9y h GLU 164 N 0.40 0.17 -0.24 3.15 4.39 -0.71 -1.07 114.58 120.67 2i9y h GLU 164 Ca 0.00 -0.01 -0.09 0.00 0.34 0.00 0.00 59.36 59.60 2i9y h GLU 164 Cb 1.07 -0.04 -0.00 0.00 -0.10 0.00 0.00 28.75 29.67 2i9y h GLU 164 CO 0.10 0.11 -0.21 0.97 -1.16 0.00 0.00 179.01 178.82 2i9y h ILE 165 N 0.18 1.32 -0.69 3.13 6.09 -1.12 -2.79 117.51 123.63 2i9y h ILE 165 Ca 0.12 -1.37 0.10 0.00 -1.37 0.00 0.00 64.86 62.35 2i9y h ILE 165 Cb 0.11 1.67 -0.08 0.00 0.47 0.00 0.00 36.82 39.00 2i9y h ILE 165 CO -0.15 0.43 0.31 -0.78 -3.07 0.00 0.00 178.15 174.88 2i9y h ASP 166 N 0.27 0.36 -0.28 2.19 1.82 -1.13 0.18 116.42 119.83 2i9y h ASP 166 Ca 0.04 0.08 -0.00 0.00 -0.39 0.00 0.00 57.03 56.75 2i9y h ASP 166 Cb 0.76 0.03 -0.02 0.00 0.68 0.00 0.00 39.33 40.78 2i9y h ASP 166 CO 0.05 0.19 0.17 -0.33 -1.61 0.00 0.00 179.24 177.71 2i9y h GLU 167 N 0.51 0.40 -0.08 0.28 4.39 -1.11 0.27 114.58 119.26 2i9y h GLU 167 Ca 0.35 -0.03 -0.13 0.00 0.34 0.00 0.00 59.36 59.89 2i9y h GLU 167 Cb 0.43 -0.09 -0.01 0.00 -0.10 0.00 0.00 28.75 28.98 2i9y h GLU 167 CO -0.31 0.30 -0.54 0.45 -1.16 0.00 0.00 179.01 177.75 2i9y h HIS 168 N 0.41 0.28 0.00 4.33 3.86 -0.70 0.19 115.15 123.52 2i9y h HIS 168 Ca 0.11 -0.09 -0.23 0.00 -1.16 0.00 0.00 60.37 59.00 2i9y h HIS 168 Cb 0.01 -0.05 0.02 0.00 1.06 0.00 0.00 27.41 28.44 2i9y h HIS 168 CO 0.00 0.71 -0.89 -0.07 0.86 0.00 0.00 177.93 178.54 2i9y h LEU 169 N 0.17 0.78 -0.25 2.43 4.07 -0.76 -3.30 115.31 118.46 2i9y h LEU 169 Ca 0.00 -0.75 -0.11 0.00 0.08 0.00 0.00 57.88 57.10 2i9y h LEU 169 Cb 1.01 -0.24 -0.00 0.00 1.08 0.00 0.00 40.66 42.50 2i9y h LEU 169 CO 0.08 1.43 -0.29 -0.07 -1.08 0.00 0.00 178.44 178.51 2i9y h LEU 170 N 0.21 0.68 -3.09 1.67 3.38 -0.92 -3.48 115.31 113.77 2i9y h LEU 170 Ca -0.11 -0.49 -0.35 0.00 0.09 0.00 0.00 57.88 57.02 2i9y h LEU 170 Cb 1.57 -0.19 0.01 0.00 0.09 0.00 0.00 40.66 42.13 2i9y h LEU 170 CO 0.18 1.03 -0.96 0.00 0.09 0.00 0.00 178.44 178.78 2i9y n ALA 171 N -2.49 -2.19 -2.68 1.53 0.00 0.68 -4.99 120.51 110.37 2i9y n ALA 171 Ca -0.05 0.09 -0.19 0.00 0.00 0.00 0.00 53.44 53.30 2i9y n ALA 171 Cb 0.47 -1.36 -0.12 0.00 0.00 0.00 0.00 19.45 18.43 2i9y n ALA 171 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 177.50 175.67 2i9y s GLU 172 N -2.84 0.86 0.00 0.00 -1.05 -1.26 -5.10 118.70 109.31 2i9y s GLU 172 Ca 0.20 -0.88 0.14 0.00 -0.15 0.00 0.00 54.97 54.28 2i9y s GLU 172 Cb -0.02 -0.88 0.11 0.00 -0.44 0.00 0.00 34.13 32.90 2i9y s GLU 172 CO 0.72 0.20 0.94 0.39 0.95 0.00 0.00 175.26 178.46