#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2i9y n GLU 18 N 0.00 -2.69 -3.63 1.09 1.02 -1.26 -5.08 120.64 110.08 2i9y n GLU 18 Ca 0.00 2.05 -0.13 0.00 -0.02 0.00 0.00 57.16 59.06 2i9y n GLU 18 Cb 0.00 -2.46 -0.07 0.00 -0.02 0.00 0.00 31.44 28.89 2i9y n GLU 18 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2i9y s ALA 19 N -4.07 -1.78 0.52 0.62 0.00 -1.26 -5.03 121.76 110.77 2i9y s ALA 19 Ca 0.00 2.08 0.20 0.00 0.00 0.00 0.00 51.96 54.24 2i9y s ALA 19 Cb 0.00 -1.21 1.40 0.00 0.00 0.00 0.00 23.12 23.31 2i9y s ALA 19 CO 0.00 -0.34 2.15 0.66 0.00 0.00 0.00 175.76 178.23 2i9y h SER 20 N 5.29 0.00 0.30 0.00 4.64 -2.01 -1.59 113.55 120.18 2i9y h SER 20 Ca -0.29 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.03 2i9y h SER 20 Cb 1.17 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.26 2i9y h SER 20 CO 0.07 0.03 0.00 -1.20 -0.87 0.00 0.00 176.83 174.86 2i9y n SER 21 N -4.26 0.00 0.00 4.97 7.64 -1.26 -2.67 113.62 118.04 2i9y n SER 21 Ca -0.03 -0.10 0.08 0.00 1.01 0.00 0.00 58.87 59.83 2i9y n SER 21 Cb 0.12 -0.24 0.44 0.00 -1.01 0.00 0.00 64.21 63.52 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 -1.24 0.00 -4.75 -3.43 4.77 -0.60 -4.71 117.00 107.05 2i9y n LEU 22 Ca 0.10 0.22 -0.41 0.00 -0.03 0.00 0.00 56.01 55.89 2i9y n LEU 22 Cb 0.14 -0.22 -0.02 0.00 -2.33 0.00 0.00 43.42 40.99 2i9y n LEU 22 CO 0.14 -0.10 1.08 0.54 -1.33 0.00 0.00 177.39 177.72 2i9y s VAL 23 N -2.44 2.65 -0.02 4.08 0.11 -1.09 -0.07 120.40 123.62 2i9y s VAL 23 Ca 0.18 0.57 -0.03 0.00 -2.93 0.00 0.00 61.98 59.77 2i9y s VAL 23 Cb 0.11 -3.37 0.00 0.00 -1.53 0.00 0.00 36.38 31.60 2i9y s VAL 23 CO 0.24 0.10 0.08 -0.83 -3.33 0.00 0.00 175.10 171.36 2i9y s GLY 24 N 0.18 0.01 0.04 6.54 0.00 0.83 -4.86 107.32 110.06 2i9y s GLY 24 Ca 0.57 0.02 -0.08 0.00 0.00 0.00 0.00 44.72 45.23 2i9y s GLY 24 CO 0.46 -0.04 0.17 -1.59 0.00 0.00 0.00 173.10 172.10 2i9y s LYS 25 N -0.50 0.67 -0.10 2.90 -2.85 -1.26 0.00 119.74 118.60 2i9y s LYS 25 Ca -0.06 -0.68 -0.11 0.00 -1.00 0.00 0.00 55.97 54.13 2i9y s LYS 25 Cb -0.04 0.27 0.03 0.00 -2.06 0.00 0.00 37.83 36.04 2i9y s LYS 25 CO 0.00 -0.19 0.30 -1.17 0.10 0.00 0.00 175.35 174.39 2i9y s LEU 26 N -2.13 0.86 0.02 2.77 2.96 -0.06 -4.99 118.68 118.10 2i9y s LEU 26 Ca -0.05 0.55 0.04 0.00 -0.22 0.00 0.00 54.13 54.45 2i9y s LEU 26 Cb -0.01 1.05 -0.02 0.00 0.50 0.00 0.00 46.19 47.71 2i9y s LEU 26 CO -0.04 -0.14 -0.11 -1.61 -1.32 0.00 0.00 176.35 173.13 2i9y s GLU 27 N 0.01 0.79 0.19 1.98 2.02 -1.26 -0.40 118.70 122.02 2i9y s GLU 27 Ca -0.01 -0.59 -0.14 0.00 0.02 0.00 0.00 54.97 54.25 2i9y s GLU 27 Cb -0.02 -0.74 0.01 0.00 0.10 0.00 0.00 34.13 33.47 2i9y s GLU 27 CO 0.01 0.19 0.43 -0.08 0.02 0.00 0.00 175.26 175.82 2i9y s THR 28 N -0.69 0.04 -0.03 3.63 -1.32 -0.71 -5.02 115.64 111.54 2i9y s THR 28 Ca 0.00 -1.11 0.01 0.00 -1.21 0.00 0.00 61.69 59.39 2i9y s THR 28 Cb -0.06 -1.77 0.02 0.00 -1.51 0.00 0.00 72.50 69.18 2i9y s THR 28 CO 0.01 -0.17 -0.02 1.51 -2.21 0.00 0.00 174.62 173.73 2i9y s ASP 29 N -2.93 0.66 0.02 8.08 -4.77 -1.26 -0.03 116.67 116.44 2i9y s ASP 29 Ca 0.14 -0.08 0.05 0.00 -3.30 0.00 0.00 52.55 49.36 2i9y s ASP 29 Cb 0.01 -0.32 -0.03 0.00 -1.09 0.00 0.00 42.92 41.48 2i9y s ASP 29 CO 0.00 -0.07 -0.12 -0.69 0.70 0.00 0.00 175.17 174.99 2i9y s VAL 30 N 0.89 3.23 -0.16 2.11 1.01 -0.41 -4.93 120.40 122.14 2i9y s VAL 30 Ca -0.10 -0.95 -0.13 0.00 0.00 0.00 0.00 61.98 60.80 2i9y s VAL 30 Cb -0.13 -2.38 -0.05 0.00 0.00 0.00 0.00 36.38 33.82 2i9y s VAL 30 CO -0.01 0.38 0.25 -1.61 0.00 0.00 0.00 175.10 174.11 2i9y s GLU 31 N -1.38 4.19 0.06 2.72 8.01 -1.26 -0.28 118.70 130.76 2i9y s GLU 31 Ca 0.16 0.01 0.03 0.00 0.01 0.00 0.00 54.97 55.18 2i9y s GLU 31 Cb -0.11 -3.41 -0.04 0.00 -4.31 0.00 0.00 34.13 26.27 2i9y s GLU 31 CO 0.06 0.29 0.06 0.96 0.01 0.00 0.00 175.26 176.65 2i9y s ILE 32 N 0.33 4.47 -2.14 -1.63 -4.36 0.11 -4.91 121.20 113.07 2i9y s ILE 32 Ca 0.14 -0.72 0.16 0.00 -0.26 0.00 0.00 60.65 59.98 2i9y s ILE 32 Cb -0.13 -3.12 0.39 0.00 1.25 0.00 0.00 42.46 40.85 2i9y s ILE 32 CO 0.03 0.18 1.40 2.29 0.24 0.00 0.00 174.94 179.08 2i9y n LYS 33 N 0.67 1.80 -2.63 0.37 2.85 -1.26 -0.12 118.16 119.84 2i9y n LYS 33 Ca -0.10 -1.23 -0.21 0.00 -1.05 0.00 0.00 58.31 55.72 2i9y n LYS 33 Cb 0.52 -1.34 0.04 0.00 -0.65 0.00 0.00 35.03 33.60 2i9y n LYS 33 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 2i9y s ALA 34 N -1.64 3.89 -0.01 0.58 0.00 -1.26 -3.78 121.76 119.53 2i9y s ALA 34 Ca 0.28 -1.37 -0.20 0.00 0.00 0.00 0.00 51.96 50.68 2i9y s ALA 34 Cb 0.15 -2.07 -0.05 0.00 0.00 0.00 0.00 23.12 21.15 2i9y s ALA 34 CO 0.21 -0.81 0.58 0.45 0.00 0.00 0.00 175.76 176.19 2i9y s SER 35 N -4.46 6.94 0.28 0.00 0.15 -1.24 -3.48 113.70 111.89 2i9y s SER 35 Ca 0.58 1.12 0.05 0.00 0.70 0.00 0.00 55.95 58.40 2i9y s SER 35 Cb -0.10 -2.35 0.41 0.00 -1.71 0.00 0.00 66.02 62.27 2i9y s SER 35 CO 0.39 0.10 1.68 0.00 1.20 0.00 0.00 173.24 176.61 2i9y h ALA 36 N 5.70 1.05 -0.41 5.45 0.00 -1.91 -1.13 119.26 128.02 2i9y h ALA 36 Ca -0.45 -0.42 -0.13 0.00 0.00 0.00 0.00 54.91 53.91 2i9y h ALA 36 Cb 1.20 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.88 2i9y h ALA 36 CO 0.70 0.61 -0.25 -0.44 0.00 0.00 0.00 179.25 179.87 2i9y h ASP 37 N 0.24 0.87 0.48 0.00 3.32 -1.94 -1.06 116.42 118.34 2i9y h ASP 37 Ca 0.02 -0.33 -0.10 0.00 0.02 0.00 0.00 57.03 56.63 2i9y h ASP 37 Cb 0.85 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 40.14 2i9y h ASP 37 CO 0.07 1.08 -0.49 0.50 -1.72 0.00 0.00 179.24 178.68 2i9y h LYS 38 N 0.73 0.01 -0.46 3.56 3.64 -1.89 0.24 116.57 122.40 2i9y h LYS 38 Ca 0.09 -0.01 -0.09 0.00 -1.27 0.00 0.00 60.65 59.38 2i9y h LYS 38 Cb 0.79 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.60 2i9y h LYS 38 CO 0.07 0.49 -0.05 0.35 -2.27 0.00 0.00 179.45 178.04 2i9y h PHE 39 N 0.01 0.93 -0.16 1.91 3.57 -0.67 -1.39 116.94 121.14 2i9y h PHE 39 Ca -0.00 -0.18 -0.09 0.00 3.53 0.00 0.00 57.97 61.23 2i9y h PHE 39 Cb 0.86 -0.24 -0.01 0.00 2.79 0.00 0.00 35.95 39.36 2i9y h PHE 39 CO 0.00 0.91 -0.29 1.25 -2.23 0.00 0.00 178.31 177.95 2i9y h HIS 40 N 0.68 0.34 -0.03 0.41 2.76 -0.84 -2.48 115.15 115.99 2i9y h HIS 40 Ca 0.12 -0.07 -0.04 0.00 -2.20 0.00 0.00 60.37 58.18 2i9y h HIS 40 Cb 0.57 -0.08 -0.01 0.00 1.55 0.00 0.00 27.41 29.44 2i9y h HIS 40 CO 0.04 0.57 -0.19 1.25 -1.30 0.00 0.00 177.93 178.30 2i9y h HIS 41 N 0.27 0.05 -0.01 5.26 -0.00 -0.06 -2.92 115.15 117.74 2i9y h HIS 41 Ca 0.04 -0.01 0.00 0.00 -0.00 0.00 0.00 60.37 60.41 2i9y h HIS 41 Cb 0.65 -0.02 -0.00 0.00 -0.00 0.00 0.00 27.41 28.05 2i9y h HIS 41 CO 0.01 0.24 0.02 0.52 -0.00 0.00 0.00 177.93 178.72 2i9y h MET 42 N 0.05 0.00 0.00 5.26 2.07 -0.78 -1.35 114.93 120.18 2i9y h MET 42 Ca 0.01 0.00 -0.14 0.00 -2.07 0.00 0.00 59.70 57.50 2i9y h MET 42 Cb 0.36 0.00 -0.02 0.00 -1.87 0.00 0.00 31.60 30.07 2i9y h MET 42 CO 0.03 0.00 -0.66 0.35 1.07 0.00 0.00 176.91 177.69 2i9y h PHE 43 N 0.00 0.00 -3.06 -0.22 3.57 -1.67 -3.40 116.94 112.17 2i9y h PHE 43 Ca 0.01 0.00 -0.73 0.00 3.53 0.00 0.00 57.97 60.78 2i9y h PHE 43 Cb 0.04 0.00 -0.22 0.00 2.79 0.00 0.00 35.95 38.56 2i9y h PHE 43 CO 0.00 0.66 0.09 0.00 -2.23 0.00 0.00 178.31 176.83 2i9y s ALA 44 N -3.28 3.58 0.00 2.41 0.00 -0.51 -4.90 121.76 119.06 2i9y s ALA 44 Ca 0.00 -2.53 0.00 0.00 0.00 0.00 0.00 51.96 49.43 2i9y s ALA 44 Cb 0.11 -3.51 0.00 0.00 0.00 0.00 0.00 23.12 19.72 2i9y s ALA 44 CO 0.76 -2.31 0.00 0.41 0.00 0.00 0.00 175.76 174.62 2i9y n GLY 45 N 5.08 0.92 3.75 0.00 0.00 -1.26 -4.98 105.19 108.70 2i9y n GLY 45 Ca -0.04 -1.96 -0.30 0.00 0.00 0.00 0.00 46.02 43.73 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 -1.73 2.77 1.01 1.61 3.01 -1.26 -5.09 119.74 120.06 2i9y s LYS 46 Ca 0.00 -0.78 -0.11 0.00 -1.01 0.00 0.00 55.97 54.07 2i9y s LYS 46 Cb 0.00 -2.65 0.20 0.00 -1.01 0.00 0.00 37.83 34.37 2i9y s LYS 46 CO 0.00 0.54 1.11 -1.25 0.51 0.00 0.00 175.35 176.26 2i9y s PRO 47 N -2.51 0.27 -0.45 -1.68 0.04 -1.26 -4.90 135.00 124.51 2i9y s PRO 47 Ca 0.29 1.33 -0.29 0.00 0.04 0.00 0.00 61.00 62.37 2i9y s PRO 47 Cb -0.12 -1.66 0.02 0.00 0.04 0.00 0.00 34.50 32.79 2i9y s PRO 47 CO 0.21 -3.07 1.28 -1.01 0.04 0.00 0.00 177.00 174.45 2i9y s HIS 48 N -2.56 2.59 0.12 0.56 3.76 -1.26 -4.96 115.29 113.53 2i9y s HIS 48 Ca 0.68 0.68 -0.31 0.00 -0.15 0.00 0.00 55.06 55.95 2i9y s HIS 48 Cb -0.24 -4.38 -0.09 0.00 1.11 0.00 0.00 32.58 28.98 2i9y s HIS 48 CO 0.60 -1.65 1.55 -1.58 -0.85 0.00 0.00 174.74 172.82 2i9y s HIS 49 N 5.01 2.90 -0.10 1.40 2.46 -1.26 -4.99 115.29 120.71 2i9y s HIS 49 Ca 0.55 0.60 0.01 0.00 0.47 0.00 0.00 55.06 56.69 2i9y s HIS 49 Cb -0.10 -3.88 -0.02 0.00 -0.13 0.00 0.00 32.58 28.44 2i9y s HIS 49 CO 0.32 -3.32 -0.12 0.54 -2.47 0.00 0.00 174.74 169.69 2i9y s VAL 50 N 1.62 3.20 -0.56 0.89 0.11 -1.26 -5.06 120.40 119.34 2i9y s VAL 50 Ca 0.70 -0.64 -0.22 0.00 -2.93 0.00 0.00 61.98 58.89 2i9y s VAL 50 Cb -0.41 -2.31 0.05 0.00 -1.53 0.00 0.00 36.38 32.18 2i9y s VAL 50 CO 0.31 0.55 0.85 -0.55 -3.33 0.00 0.00 175.10 172.94 2i9y s SER 51 N -0.16 6.27 0.07 3.54 0.15 -1.26 -4.99 113.70 117.33 2i9y s SER 51 Ca -0.00 -0.65 0.06 0.00 0.70 0.00 0.00 55.95 56.06 2i9y s SER 51 Cb -0.13 -2.39 -0.03 0.00 -1.71 0.00 0.00 66.02 61.76 2i9y s SER 51 CO 0.03 -1.17 -0.16 -0.54 1.20 0.00 0.00 173.24 172.60 2i9y s LYS 52 N 3.57 0.91 -0.02 5.44 1.02 -1.26 -5.07 119.74 124.34 2i9y s LYS 52 Ca 0.24 -0.98 -0.02 0.00 0.02 0.00 0.00 55.97 55.23 2i9y s LYS 52 Cb -0.15 -0.98 -0.01 0.00 -0.52 0.00 0.00 37.83 36.17 2i9y s LYS 52 CO 0.15 0.22 0.24 0.00 -0.92 0.00 0.00 175.35 175.04 2i9y h ALA 53 N 4.31 -0.23 -3.62 5.17 0.00 -2.06 -3.51 119.26 119.33 2i9y h ALA 53 Ca -0.42 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.47 2i9y h ALA 53 Cb 1.19 0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.01 2i9y h ALA 53 CO 0.40 -0.22 -0.83 -1.13 0.00 0.00 0.00 179.25 177.47 2i9y n SER 54 N -2.85 -7.48 -4.55 0.00 3.41 -1.26 -4.67 113.62 96.21 2i9y n SER 54 Ca -0.01 1.41 -0.39 0.00 -0.26 0.00 0.00 58.87 59.62 2i9y n SER 54 Cb 0.03 -4.67 -0.03 0.00 -0.26 0.00 0.00 64.21 59.28 2i9y n SER 54 CO 0.00 0.00 0.00 -2.84 -0.16 0.00 0.00 175.04 172.04 2i9y s PRO 55 N -4.47 2.77 0.33 4.33 0.02 -1.26 -4.97 135.00 131.76 2i9y s PRO 55 Ca 0.00 0.53 0.06 0.00 0.02 0.00 0.00 61.00 61.61 2i9y s PRO 55 Cb 0.00 -4.34 -0.01 0.00 0.02 0.00 0.00 34.50 30.17 2i9y s PRO 55 CO 0.00 -2.58 0.47 0.20 -0.33 0.00 0.00 177.00 174.77 2i9y s GLY 56 N 7.25 1.57 -0.68 0.52 0.00 -1.26 -5.04 107.32 109.68 2i9y s GLY 56 Ca 0.63 -1.42 -0.24 0.00 0.00 0.00 0.00 44.72 43.68 2i9y s GLY 56 CO 0.21 -1.34 1.06 0.54 0.00 0.00 0.00 173.10 173.56 2i9y s ASN 57 N -4.16 6.18 -0.10 1.64 4.22 -1.26 -4.38 114.94 117.08 2i9y s ASN 57 Ca 0.44 -0.79 -0.05 0.00 -2.14 0.00 0.00 52.86 50.33 2i9y s ASN 57 Cb -0.10 -2.46 0.02 0.00 1.28 0.00 0.00 41.25 39.99 2i9y s ASN 57 CO 0.31 -1.55 0.09 -0.38 -2.04 0.00 0.00 177.10 173.54 2i9y n ILE 58 N 6.08 -7.37 -1.68 0.54 5.41 -1.26 -4.77 119.36 116.30 2i9y n ILE 58 Ca -0.01 1.20 -0.50 0.00 1.00 0.00 0.00 62.75 64.44 2i9y n ILE 58 Cb 0.47 -4.99 -0.05 0.00 -0.71 0.00 0.00 39.64 34.35 2i9y n ILE 58 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2i9y n GLN 59 N 0.69 1.97 0.00 0.38 10.64 -1.26 -4.12 117.38 125.68 2i9y n GLN 59 Ca -0.16 0.72 0.00 0.00 -1.83 0.00 0.00 57.00 55.73 2i9y n GLN 59 Cb 0.25 -2.52 0.00 0.00 -0.86 0.00 0.00 30.24 27.10 2i9y n GLN 59 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 2i9y n GLY 60 N 4.22 -0.19 3.41 2.61 0.00 -1.26 -5.08 105.19 108.90 2i9y n GLY 60 Ca 0.23 0.05 -0.12 0.00 0.00 0.00 0.00 46.02 46.18 2i9y n GLY 60 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2i9y s ASP 62 N 0.70 -0.14 -1.36 0.00 2.15 -1.26 -5.05 116.67 111.71 2i9y s ASP 62 Ca -0.03 0.09 -0.15 0.00 0.43 0.00 0.00 52.55 52.89 2i9y s ASP 62 Cb -0.05 0.33 0.00 0.00 -0.30 0.00 0.00 42.92 42.91 2i9y s ASP 62 CO -0.05 -0.33 2.22 0.18 -0.17 0.00 0.00 175.17 177.02 2i9y n LEU 63 N 1.75 6.53 -4.36 -1.34 4.77 -1.26 -4.85 117.00 118.24 2i9y n LEU 63 Ca -0.20 -3.96 -0.45 0.00 -0.03 0.00 0.00 56.01 51.38 2i9y n LEU 63 Cb 0.56 -1.57 -0.06 0.00 -2.33 0.00 0.00 43.42 40.03 2i9y n LEU 63 CO 0.20 0.93 0.20 -2.28 -1.33 0.00 0.00 177.39 175.12 2i9y s HIS 64 N 3.42 3.16 0.00 -1.77 2.46 -1.26 -5.04 115.29 116.26 2i9y s HIS 64 Ca 0.49 -1.03 0.02 0.00 0.47 0.00 0.00 55.06 55.01 2i9y s HIS 64 Cb 0.14 -3.67 -0.04 0.00 -0.13 0.00 0.00 32.58 28.89 2i9y s HIS 64 CO -0.06 -1.03 -0.01 -1.21 -2.47 0.00 0.00 174.74 169.96 2i9y s GLU 65 N 2.00 2.75 -0.22 2.88 0.41 -1.26 -4.98 118.70 120.28 2i9y s GLU 65 Ca 0.07 -0.63 0.15 0.00 -0.41 0.00 0.00 54.97 54.15 2i9y s GLU 65 Cb -0.26 -2.65 0.78 0.00 -1.78 0.00 0.00 34.13 30.23 2i9y s GLU 65 CO 0.06 0.62 1.71 0.41 -0.49 0.00 0.00 175.26 177.56 2i9y n GLY 66 N 1.39 3.10 3.71 -1.39 0.00 -1.26 -4.93 105.19 105.82 2i9y n GLY 66 Ca -0.15 -0.94 -0.38 0.00 0.00 0.00 0.00 46.02 44.56 2i9y n GLY 66 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2i9y s ASP 67 N -0.93 6.66 -0.00 1.61 -1.08 -1.26 -4.91 116.67 116.76 2i9y s ASP 67 Ca 0.53 0.79 0.14 0.00 -0.52 0.00 0.00 52.55 53.49 2i9y s ASP 67 Cb 0.40 -2.29 0.42 0.00 -1.46 0.00 0.00 42.92 39.99 2i9y s ASP 67 CO 0.16 -0.04 1.35 0.79 0.52 0.00 0.00 175.17 177.95 2i9y n TRP 68 N 3.91 0.63 -0.25 -5.34 7.02 -1.26 -4.90 117.44 117.25 2i9y n TRP 68 Ca -0.07 -0.50 0.00 0.00 -1.02 0.00 0.00 57.50 55.91 2i9y n TRP 68 Cb 0.51 -0.02 0.00 0.00 -2.42 0.00 0.00 31.31 29.38 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 0.87 0.86 5.00 6.99 0.00 -1.26 -4.63 105.19 113.02 2i9y n GLY 69 Ca 0.16 -0.10 0.00 0.00 0.00 0.00 0.00 46.02 46.08 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 -2.25 0.00 -2.24 2.61 -1.04 -1.26 -4.88 114.28 105.22 2i9y n THR 70 Ca 0.00 0.00 -0.42 0.00 -2.04 0.00 0.00 64.05 61.59 2i9y n THR 70 Cb 0.00 0.00 -0.03 0.00 -1.82 0.00 0.00 70.33 68.48 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 3.86 0.00 12.58 1.01 -1.26 -2.12 120.40 134.47 2i9y s VAL 71 Ca 0.00 1.16 0.00 0.00 0.00 0.00 0.00 61.98 63.14 2i9y s VAL 71 Cb 0.00 -3.75 0.00 0.00 0.00 0.00 0.00 36.38 32.63 2i9y s VAL 71 CO 0.00 -0.05 0.00 0.61 0.00 0.00 0.00 175.10 175.66 2i9y n GLY 72 N 3.72 0.54 3.77 4.51 0.00 -0.22 -4.96 105.19 112.54 2i9y n GLY 72 Ca 0.14 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.77 2i9y n GLY 72 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2i9y s SER 73 N -2.96 6.73 -0.16 1.61 0.01 -0.90 -4.65 113.70 113.38 2i9y s SER 73 Ca 0.00 2.31 -0.01 0.00 1.31 0.00 0.00 55.95 59.56 2i9y s SER 73 Cb 0.00 -2.61 0.04 0.00 0.21 0.00 0.00 66.02 63.65 2i9y s SER 73 CO 0.00 -0.53 -0.05 -0.63 0.41 0.00 0.00 173.24 172.44 2i9y s ILE 74 N -1.38 1.08 0.06 1.44 1.01 -1.26 -0.99 121.20 121.16 2i9y s ILE 74 Ca 0.54 -0.56 0.03 0.00 0.00 0.00 0.00 60.65 60.66 2i9y s ILE 74 Cb -0.30 -1.23 -0.03 0.00 0.01 0.00 0.00 42.46 40.91 2i9y s ILE 74 CO 0.38 0.17 -0.09 -0.69 0.00 0.00 0.00 174.94 174.71 2i9y s VAL 75 N 1.65 0.72 0.02 2.92 1.01 -1.26 -5.06 120.40 120.39 2i9y s VAL 75 Ca 0.01 -1.28 0.06 0.00 0.00 0.00 0.00 61.98 60.78 2i9y s VAL 75 Cb -0.15 -0.89 -0.03 0.00 0.00 0.00 0.00 36.38 35.31 2i9y s VAL 75 CO -0.08 -0.42 -0.16 -0.36 0.00 0.00 0.00 175.10 174.08 2i9y s PHE 76 N -1.71 2.61 -0.11 5.22 0.08 -1.26 -4.10 117.98 118.72 2i9y s PHE 76 Ca -0.04 -0.22 -0.03 0.00 0.12 0.00 0.00 56.93 56.76 2i9y s PHE 76 Cb -0.08 -1.52 -0.03 0.00 -0.57 0.00 0.00 43.02 40.83 2i9y s PHE 76 CO 0.00 0.24 0.01 -1.58 -0.10 0.00 0.00 175.22 173.79 2i9y s TRP 77 N -0.88 3.17 -0.10 0.36 0.52 -0.89 -4.91 118.94 116.21 2i9y s TRP 77 Ca 0.14 0.14 0.04 0.00 0.02 0.00 0.00 56.10 56.43 2i9y s TRP 77 Cb -0.11 -1.85 0.00 0.00 -1.15 0.00 0.00 33.47 30.37 2i9y s TRP 77 CO 0.04 0.39 -0.24 -0.80 0.02 0.00 0.00 176.95 176.36 2i9y s ASN 78 N -0.60 3.12 0.25 2.95 -0.87 -1.26 -0.96 114.94 117.56 2i9y s ASN 78 Ca 0.10 -0.56 -0.17 0.00 -1.57 0.00 0.00 52.86 50.66 2i9y s ASN 78 Cb -0.12 -1.42 0.01 0.00 -0.02 0.00 0.00 41.25 39.71 2i9y s ASN 78 CO 0.02 0.16 0.59 -0.72 -2.57 0.00 0.00 177.10 174.58 2i9y s TYR 79 N 0.37 0.05 -0.14 2.20 1.13 -0.86 -4.99 117.35 115.10 2i9y s TYR 79 Ca -0.18 -0.45 -0.00 0.00 -1.41 0.00 0.00 57.07 55.03 2i9y s TYR 79 Cb -0.18 0.44 -0.01 0.00 -1.10 0.00 0.00 41.96 41.11 2i9y s TYR 79 CO 0.08 -1.09 -0.12 0.08 -2.51 0.00 0.00 175.55 171.99 2i9y s VAL 80 N -3.95 3.04 -0.03 -3.49 1.01 -1.26 0.37 120.40 116.10 2i9y s VAL 80 Ca 0.15 -0.66 -0.00 0.00 0.00 0.00 0.00 61.98 61.47 2i9y s VAL 80 Cb -0.03 -2.29 0.03 0.00 0.00 0.00 0.00 36.38 34.09 2i9y s VAL 80 CO 0.06 0.51 0.05 -2.28 0.00 0.00 0.00 175.10 173.44 2i9y s HIS 81 N 0.50 -0.00 -1.47 5.22 5.04 0.38 -4.82 115.29 120.14 2i9y s HIS 81 Ca -0.09 0.18 0.00 0.00 -1.54 0.00 0.00 55.06 53.62 2i9y s HIS 81 Cb -0.16 -0.20 0.00 0.00 0.04 0.00 0.00 32.58 32.26 2i9y s HIS 81 CO 0.04 -0.10 0.00 -3.47 -2.34 0.00 0.00 174.74 168.87 2i9y n ASP 82 N 4.14 -4.91 0.00 9.88 2.03 -1.26 -1.28 116.55 125.14 2i9y n ASP 82 Ca -0.27 0.05 0.00 0.00 0.52 0.00 0.00 54.79 55.09 2i9y n ASP 82 Cb 0.51 -3.99 0.00 0.00 -0.72 0.00 0.00 41.12 36.91 2i9y n ASP 82 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2i9y n GLY 83 N -1.01 2.94 3.88 0.27 0.00 -1.26 -4.99 105.19 105.01 2i9y n GLY 83 Ca -0.19 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.47 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 3.59 -0.27 1.61 2.12 -0.41 -5.04 118.70 120.31 2i9y s GLU 84 Ca 0.00 -0.01 -0.29 0.00 0.36 0.00 0.00 54.97 55.03 2i9y s GLU 84 Cb 0.00 -3.14 0.00 0.00 0.26 0.00 0.00 34.13 31.25 2i9y s GLU 84 CO 0.00 0.70 1.24 0.00 -0.54 0.00 0.00 175.26 176.66 2i9y s ALA 85 N -1.18 3.47 0.12 6.30 0.00 -1.26 -0.47 121.76 128.75 2i9y s ALA 85 Ca 0.23 0.16 0.01 0.00 0.00 0.00 0.00 51.96 52.36 2i9y s ALA 85 Cb -0.13 -3.71 -0.04 0.00 0.00 0.00 0.00 23.12 19.24 2i9y s ALA 85 CO 0.12 -1.55 0.27 0.15 0.00 0.00 0.00 175.76 174.75 2i9y s LYS 86 N 3.88 3.45 -0.04 0.00 -0.14 0.16 -4.93 119.74 122.12 2i9y s LYS 86 Ca 0.53 -0.50 0.05 0.00 -1.36 0.00 0.00 55.97 54.70 2i9y s LYS 86 Cb -0.17 -2.98 -0.01 0.00 -1.68 0.00 0.00 37.83 32.99 2i9y s LYS 86 CO 0.19 0.54 -0.20 0.08 -0.76 0.00 0.00 175.35 175.20 2i9y s VAL 87 N -1.66 1.64 -0.10 3.17 1.01 -1.26 -2.03 120.40 121.18 2i9y s VAL 87 Ca 0.35 -0.85 -0.02 0.00 0.00 0.00 0.00 61.98 61.46 2i9y s VAL 87 Cb -0.12 -1.39 -0.03 0.00 0.00 0.00 0.00 36.38 34.84 2i9y s VAL 87 CO 0.28 0.47 -0.01 0.00 0.00 0.00 0.00 175.10 175.84 2i9y s ALA 88 N -0.17 3.23 -0.13 5.51 0.00 -0.14 -4.91 121.76 125.15 2i9y s ALA 88 Ca -0.00 -0.81 0.01 0.00 0.00 0.00 0.00 51.96 51.16 2i9y s ALA 88 Cb -0.11 -1.48 0.02 0.00 0.00 0.00 0.00 23.12 21.55 2i9y s ALA 88 CO 0.02 0.53 -0.15 -1.59 0.00 0.00 0.00 175.76 174.56 2i9y s LYS 89 N -0.69 2.31 0.01 0.00 -2.85 -1.26 -2.09 119.74 115.18 2i9y s LYS 89 Ca 0.11 -0.58 -0.09 0.00 -1.00 0.00 0.00 55.97 54.41 2i9y s LYS 89 Cb -0.12 -2.01 0.00 0.00 -2.06 0.00 0.00 37.83 33.65 2i9y s LYS 89 CO 0.02 -0.12 0.18 -1.83 0.10 0.00 0.00 175.35 173.70 2i9y s GLU 90 N 1.15 0.58 -0.05 1.78 -1.05 -1.26 -4.42 118.70 115.44 2i9y s GLU 90 Ca -0.02 -0.46 -0.01 0.00 -0.15 0.00 0.00 54.97 54.33 2i9y s GLU 90 Cb -0.14 0.24 0.03 0.00 -0.44 0.00 0.00 34.13 33.82 2i9y s GLU 90 CO -0.05 -0.15 0.02 0.50 0.95 0.00 0.00 175.26 176.53 2i9y s ARG 91 N -1.79 0.24 -0.14 -4.83 3.00 0.16 -4.13 118.95 111.46 2i9y s ARG 91 Ca -0.11 0.21 -0.29 0.00 -1.00 0.00 0.00 55.73 54.53 2i9y s ARG 91 Cb -0.05 -0.64 -0.02 0.00 0.00 0.00 0.00 34.95 34.25 2i9y s ARG 91 CO 0.00 -0.26 1.19 0.42 0.00 0.00 0.00 175.30 176.65 2i9y s ILE 92 N 1.76 4.37 -0.21 4.11 1.01 -0.16 -0.70 121.20 131.38 2i9y s ILE 92 Ca 0.00 1.66 -0.05 0.00 0.00 0.00 0.00 60.65 62.27 2i9y s ILE 92 Cb -0.13 -4.07 -0.20 0.00 0.01 0.00 0.00 42.46 38.07 2i9y s ILE 92 CO -0.03 -0.09 0.00 -0.62 0.00 0.00 0.00 174.94 174.19 2i9y n GLU 93 N 6.05 0.68 -3.54 2.79 -0.58 -0.28 -1.06 120.64 124.69 2i9y n GLU 93 Ca 0.12 0.24 -0.16 0.00 -0.42 0.00 0.00 57.16 56.94 2i9y n GLU 93 Cb 0.46 -1.60 -0.06 0.00 -0.57 0.00 0.00 31.44 29.67 2i9y n GLU 93 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2i9y s ALA 94 N -2.52 -1.57 -0.10 0.62 0.00 -1.25 -4.82 121.76 112.12 2i9y s ALA 94 Ca -0.31 0.97 -0.08 0.00 0.00 0.00 0.00 51.96 52.55 2i9y s ALA 94 Cb 0.09 0.21 0.03 0.00 0.00 0.00 0.00 23.12 23.44 2i9y s ALA 94 CO 0.65 -0.44 0.26 0.54 0.00 0.00 0.00 175.76 176.76 2i9y s VAL 95 N -1.81 -0.01 -0.33 0.00 0.11 -1.26 -0.62 120.40 116.49 2i9y s VAL 95 Ca -0.08 0.05 -0.01 0.00 -2.93 0.00 0.00 61.98 59.00 2i9y s VAL 95 Cb -0.01 -0.38 0.07 0.00 -1.53 0.00 0.00 36.38 34.54 2i9y s VAL 95 CO 0.04 0.02 0.04 -1.61 -3.33 0.00 0.00 175.10 170.26 2i9y s GLU 96 N 0.50 2.23 0.35 1.54 0.41 0.11 -4.94 118.70 118.91 2i9y s GLU 96 Ca -0.03 -1.45 0.12 0.00 -0.41 0.00 0.00 54.97 53.20 2i9y s GLU 96 Cb -0.04 -3.25 0.65 0.00 -1.78 0.00 0.00 34.13 29.70 2i9y s GLU 96 CO -0.03 -0.75 1.78 -1.35 -0.49 0.00 0.00 175.26 174.43 2i9y h PRO 97 N 7.96 0.00 0.17 0.39 0.11 -1.97 -0.08 132.00 138.58 2i9y h PRO 97 Ca -0.17 0.00 -0.29 0.00 0.11 0.00 0.00 66.00 65.64 2i9y h PRO 97 Cb 1.05 0.00 0.02 0.00 0.11 0.00 0.00 31.00 32.18 2i9y h PRO 97 CO 0.56 0.42 -1.31 0.22 -0.21 0.00 0.00 178.00 177.69 2i9y h ASP 98 N 0.00 0.59 -0.18 -2.05 3.58 -1.95 -3.34 116.42 113.07 2i9y h ASP 98 Ca -0.00 -0.62 0.00 0.00 0.42 0.00 0.00 57.03 56.83 2i9y h ASP 98 Cb 0.75 -0.19 0.00 0.00 1.72 0.00 0.00 39.33 41.61 2i9y h ASP 98 CO 0.05 1.48 0.00 0.29 -2.88 0.00 0.00 179.24 178.18 2i9y n LYS 99 N -3.61 2.00 -3.53 0.28 5.02 -1.21 -4.97 118.16 112.14 2i9y n LYS 99 Ca -0.11 -1.88 -0.19 0.00 -2.02 0.00 0.00 58.31 54.11 2i9y n LYS 99 Cb 1.04 -1.40 0.07 0.00 -0.02 0.00 0.00 35.03 34.72 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 1.15 -1.96 -4.37 4.39 3.02 -0.18 -4.56 115.26 112.75 2i9y n ASN 100 Ca 0.14 -0.71 -0.31 0.00 -0.03 0.00 0.00 54.58 53.67 2i9y n ASN 100 Cb 0.51 -4.70 -0.15 0.00 -0.61 0.00 0.00 39.78 34.83 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 -6.43 2.28 -0.15 3.41 2.96 -0.41 -1.53 118.68 118.80 2i9y s LEU 101 Ca 0.03 -0.46 -0.06 0.00 -0.22 0.00 0.00 54.13 53.42 2i9y s LEU 101 Cb -0.01 -1.39 0.07 0.00 0.50 0.00 0.00 46.19 45.37 2i9y s LEU 101 CO 0.76 0.30 0.32 -0.51 -1.32 0.00 0.00 176.35 175.90 2i9y s ILE 102 N -0.74 -0.37 -0.26 6.68 1.10 -0.40 0.08 121.20 127.30 2i9y s ILE 102 Ca 0.11 0.21 -0.11 0.00 -0.51 0.00 0.00 60.65 60.36 2i9y s ILE 102 Cb -0.10 -0.51 -0.05 0.00 0.15 0.00 0.00 42.46 41.95 2i9y s ILE 102 CO 0.01 0.09 0.17 -0.89 -2.11 0.00 0.00 174.94 172.21 2i9y s THR 103 N 2.17 5.25 -0.15 4.00 2.01 0.21 -1.27 115.64 127.85 2i9y s THR 103 Ca -0.02 0.15 -0.04 0.00 0.31 0.00 0.00 61.69 62.08 2i9y s THR 103 Cb -0.11 -3.48 -0.03 0.00 0.01 0.00 0.00 72.50 68.89 2i9y s THR 103 CO -0.10 0.29 -0.03 -0.36 -0.69 0.00 0.00 174.62 173.73 2i9y s PHE 104 N 1.50 3.04 -0.11 4.92 0.08 0.12 -1.13 117.98 126.40 2i9y s PHE 104 Ca 0.07 -0.24 -0.02 0.00 0.12 0.00 0.00 56.93 56.86 2i9y s PHE 104 Cb -0.15 -1.94 -0.03 0.00 -0.57 0.00 0.00 43.02 40.33 2i9y s PHE 104 CO 0.08 0.02 -0.04 0.50 -0.10 0.00 0.00 175.22 175.68 2i9y s ARG 105 N 0.25 3.23 -0.15 0.44 3.52 0.13 -0.68 118.95 125.68 2i9y s ARG 105 Ca -0.02 -0.50 -0.24 0.00 -0.13 0.00 0.00 55.73 54.84 2i9y s ARG 105 Cb -0.14 -2.79 -0.02 0.00 -1.56 0.00 0.00 34.95 30.44 2i9y s ARG 105 CO 0.03 0.49 0.78 0.08 -0.81 0.00 0.00 175.30 175.87 2i9y s VAL 106 N -0.30 4.93 -0.18 7.11 1.01 -0.77 -0.66 120.40 131.53 2i9y s VAL 106 Ca 0.05 1.54 0.09 0.00 0.00 0.00 0.00 61.98 63.66 2i9y s VAL 106 Cb -0.12 -4.10 -0.17 0.00 0.00 0.00 0.00 36.38 31.99 2i9y s VAL 106 CO 0.02 0.08 -0.05 2.30 0.00 0.00 0.00 175.10 177.45 2i9y n ILE 107 N 4.57 1.13 -2.78 2.22 -0.00 -1.26 -4.75 119.36 118.49 2i9y n ILE 107 Ca 0.03 -0.58 -0.36 0.00 -0.00 0.00 0.00 62.75 61.84 2i9y n ILE 107 Cb 0.49 -0.86 -0.06 0.00 -0.00 0.00 0.00 39.64 39.21 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 -2.40 4.48 0.54 6.28 -6.30 -1.26 -4.96 118.70 115.07 2i9y s GLU 108 Ca -0.17 1.28 0.23 0.00 -2.50 0.00 0.00 54.97 53.82 2i9y s GLU 108 Cb 0.06 -2.64 1.39 0.00 0.00 0.00 0.00 34.13 32.95 2i9y s GLU 108 CO 0.58 0.19 2.05 0.78 0.02 0.00 0.00 175.26 178.88 2i9y h GLY 109 N 2.83 0.00 0.22 -1.50 0.00 -1.96 -3.30 103.07 99.36 2i9y h GLY 109 Ca -0.47 0.00 0.08 0.00 0.00 0.00 0.00 47.33 46.94 2i9y h GLY 109 CO 0.64 0.00 -0.06 -0.55 0.00 0.00 0.00 176.54 176.57 2i9y h ASP 110 N 0.00 -0.30 1.28 0.19 3.32 -2.01 0.33 116.42 119.24 2i9y h ASP 110 Ca 0.16 0.11 -0.07 0.00 0.02 0.00 0.00 57.03 57.25 2i9y h ASP 110 Cb 0.64 0.22 -0.01 0.00 0.22 0.00 0.00 39.33 40.41 2i9y h ASP 110 CO -0.00 -0.10 -0.32 -0.07 -1.72 0.00 0.00 179.24 177.02 2i9y h LEU 111 N 0.04 0.00 0.00 1.55 3.38 -1.95 -2.97 115.31 115.37 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 0.31 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.06 2i9y h LEU 111 CO -0.40 0.32 0.00 0.23 0.09 0.00 0.00 178.44 178.68 2i9y n MET 112 N -3.29 0.28 0.15 1.13 2.81 -0.02 -1.31 117.12 116.86 2i9y n MET 112 Ca 0.01 0.06 0.12 0.00 -1.81 0.00 0.00 57.70 56.08 2i9y n MET 112 Cb 0.57 -1.50 0.13 0.00 -0.71 0.00 0.00 33.22 31.71 2i9y n MET 112 CO 0.00 0.00 0.00 0.87 1.51 0.00 0.00 175.97 178.35 2i9y h LYS 113 N 0.00 0.00 0.00 0.03 1.79 -1.04 -3.35 116.57 114.00 2i9y h LYS 113 Ca 0.00 0.00 -0.34 0.00 -2.18 0.00 0.00 60.65 58.13 2i9y h LYS 113 Cb 0.27 0.00 -0.06 0.00 -1.58 0.00 0.00 32.23 30.86 2i9y h LYS 113 CO 0.00 0.00 -2.30 0.39 -1.08 0.00 0.00 179.45 176.46 2i9y n GLU 114 N -2.74 0.68 -4.26 3.15 -0.58 -0.85 -4.98 120.64 111.07 2i9y n GLU 114 Ca 0.03 0.10 -0.21 0.00 -0.42 0.00 0.00 57.16 56.66 2i9y n GLU 114 Cb 0.52 -1.46 -0.12 0.00 -0.57 0.00 0.00 31.44 29.80 2i9y n GLU 114 CO 0.00 0.00 0.00 0.71 -0.48 0.00 0.00 177.13 177.36 2i9y s TYR 115 N -2.46 1.58 -0.22 -0.32 2.02 -0.43 -3.82 117.35 113.71 2i9y s TYR 115 Ca -0.26 -0.46 0.17 0.00 -0.37 0.00 0.00 57.07 56.15 2i9y s TYR 115 Cb 0.07 -0.85 0.09 0.00 -0.40 0.00 0.00 41.96 40.87 2i9y s TYR 115 CO 0.58 0.18 1.38 0.87 -1.57 0.00 0.00 175.55 176.98 2i9y h LYS 116 N 3.92 0.00 -2.45 -0.62 1.57 -1.22 -3.35 116.57 114.42 2i9y h LYS 116 Ca -0.43 0.00 -0.09 0.00 -1.87 0.00 0.00 60.65 58.26 2i9y h LYS 116 Cb 1.19 0.00 -0.23 0.00 0.08 0.00 0.00 32.23 33.27 2i9y h LYS 116 CO 0.43 0.34 -0.12 0.45 -0.57 0.00 0.00 179.45 179.98 2i9y s SER 117 N -6.25 -0.58 -0.18 0.86 0.15 -1.24 -4.99 113.70 101.47 2i9y s SER 117 Ca 0.03 1.07 -0.05 0.00 0.70 0.00 0.00 55.95 57.71 2i9y s SER 117 Cb 0.07 1.06 0.09 0.00 -1.71 0.00 0.00 66.02 65.53 2i9y s SER 117 CO 0.74 -0.19 0.33 0.12 1.20 0.00 0.00 173.24 175.44 2i9y s PHE 118 N 0.56 -0.61 0.11 3.44 5.36 -1.26 -0.75 117.98 124.83 2i9y s PHE 118 Ca -0.02 1.06 0.06 0.00 -0.96 0.00 0.00 56.93 57.07 2i9y s PHE 118 Cb -0.04 0.06 -0.04 0.00 -0.34 0.00 0.00 43.02 42.66 2i9y s PHE 118 CO -0.03 -0.49 -0.15 -0.51 -1.46 0.00 0.00 175.22 172.59 2i9y s LEU 119 N 2.50 2.38 -0.02 6.12 1.02 -0.22 -1.84 118.68 128.61 2i9y s LEU 119 Ca 0.03 -0.77 -0.01 0.00 0.02 0.00 0.00 54.13 53.39 2i9y s LEU 119 Cb -0.13 -0.57 0.01 0.00 0.02 0.00 0.00 46.19 45.52 2i9y s LEU 119 CO -0.12 -0.12 0.05 -1.48 0.02 0.00 0.00 176.35 174.71 2i9y s LEU 120 N -2.31 1.58 -0.06 1.79 2.34 0.15 -0.61 118.68 121.56 2i9y s LEU 120 Ca 0.07 0.10 0.03 0.00 0.06 0.00 0.00 54.13 54.39 2i9y s LEU 120 Cb -0.06 0.13 0.01 0.00 -0.56 0.00 0.00 46.19 45.70 2i9y s LEU 120 CO 0.03 -0.05 -0.14 -0.89 -1.06 0.00 0.00 176.35 174.24 2i9y s THR 121 N 0.33 1.28 0.06 5.48 2.01 0.12 0.14 115.64 125.06 2i9y s THR 121 Ca -0.03 -0.58 0.09 0.00 0.31 0.00 0.00 61.69 61.48 2i9y s THR 121 Cb -0.04 -1.14 -0.03 0.00 0.01 0.00 0.00 72.50 71.31 2i9y s THR 121 CO -0.01 0.38 -0.25 0.27 -0.69 0.00 0.00 174.62 174.32 2i9y s ILE 122 N 0.44 2.03 -0.03 1.82 -4.36 -0.40 -0.03 121.20 120.66 2i9y s ILE 122 Ca -0.11 -1.40 -0.01 0.00 -0.26 0.00 0.00 60.65 58.87 2i9y s ILE 122 Cb -0.14 -1.75 0.03 0.00 1.25 0.00 0.00 42.46 41.84 2i9y s ILE 122 CO 0.04 0.27 0.04 -1.58 0.24 0.00 0.00 174.94 173.95 2i9y s GLN 123 N -1.37 0.00 -0.27 0.37 0.74 -0.47 -1.27 119.66 117.39 2i9y s GLN 123 Ca 0.11 0.24 -0.11 0.00 0.05 0.00 0.00 55.36 55.66 2i9y s GLN 123 Cb -0.10 -0.39 -0.05 0.00 1.10 0.00 0.00 33.01 33.57 2i9y s GLN 123 CO 0.03 -0.23 0.18 0.08 -0.55 0.00 0.00 175.29 174.79 2i9y s VAL 124 N 1.50 5.28 0.04 1.34 1.01 -0.59 -0.51 120.40 128.47 2i9y s VAL 124 Ca -0.04 0.16 0.00 0.00 0.00 0.00 0.00 61.98 62.10 2i9y s VAL 124 Cb -0.13 -3.50 -0.03 0.00 0.00 0.00 0.00 36.38 32.73 2i9y s VAL 124 CO -0.03 0.28 -0.04 0.28 0.00 0.00 0.00 175.10 175.60 2i9y s THR 125 N 1.53 0.25 0.95 3.92 -1.32 -0.23 -4.69 115.64 116.05 2i9y s THR 125 Ca 0.07 -1.31 -0.12 0.00 -1.21 0.00 0.00 61.69 59.13 2i9y s THR 125 Cb -0.15 -0.83 0.16 0.00 -1.51 0.00 0.00 72.50 70.17 2i9y s THR 125 CO 0.09 -0.68 1.09 -2.16 -2.21 0.00 0.00 174.62 170.75 2i9y s PRO 126 N -2.46 0.82 0.11 7.08 0.04 -1.26 -0.70 135.00 138.63 2i9y s PRO 126 Ca -0.06 0.94 0.00 0.00 0.04 0.00 0.00 61.00 61.93 2i9y s PRO 126 Cb -0.03 -1.75 0.00 0.00 0.04 0.00 0.00 34.50 32.76 2i9y s PRO 126 CO -0.04 -2.57 0.00 1.17 0.04 0.00 0.00 177.00 175.60 2i9y n LYS 127 N -4.13 0.00 0.20 4.56 4.81 -1.26 -4.68 118.16 117.67 2i9y n LYS 127 Ca 0.07 0.00 -0.14 0.00 -0.87 0.00 0.00 58.31 57.37 2i9y n LYS 127 Cb 0.55 0.00 -0.08 0.00 0.02 0.00 0.00 35.03 35.52 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 0.00 -0.51 0.00 1.64 0.11 -1.93 -3.50 132.00 127.81 2i9y h PRO 128 Ca 0.00 0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.14 2i9y h PRO 128 Cb 0.00 0.12 0.00 0.00 0.11 0.00 0.00 31.00 31.23 2i9y h PRO 128 CO 0.00 -0.20 0.00 0.41 -0.21 0.00 0.00 178.00 178.00 2i9y n GLY 129 N -0.50 2.61 6.73 -0.55 0.00 -0.93 -5.04 105.19 107.52 2i9y n GLY 129 Ca -0.10 -0.87 0.00 0.00 0.00 0.00 0.00 46.02 45.05 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 0.00 1.89 3.56 -0.02 0.00 -1.26 -4.55 105.19 104.80 2i9y n GLY 130 Ca 0.00 -0.39 -0.26 0.00 0.00 0.00 0.00 46.02 45.37 2i9y n GLY 130 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2i9y s PRO 131 N 0.00 2.40 0.00 1.61 0.04 -1.26 -3.72 135.00 134.08 2i9y s PRO 131 Ca 0.00 -0.05 0.00 0.00 0.04 0.00 0.00 61.00 60.99 2i9y s PRO 131 Cb 0.00 -4.95 0.00 0.00 0.04 0.00 0.00 34.50 29.59 2i9y s PRO 131 CO 0.00 -3.48 0.00 0.41 0.04 0.00 0.00 177.00 173.97 2i9y n GLY 132 N 6.73 1.51 3.20 0.56 0.00 -1.08 -4.89 105.19 111.21 2i9y n GLY 132 Ca 0.39 -0.18 -0.18 0.00 0.00 0.00 0.00 46.02 46.05 2i9y n GLY 132 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2i9y s SER 133 N 0.00 1.82 -0.20 1.61 0.01 0.83 -2.19 113.70 115.57 2i9y s SER 133 Ca 0.00 -0.70 -0.08 0.00 1.31 0.00 0.00 55.95 56.48 2i9y s SER 133 Cb 0.00 -0.06 -0.04 0.00 0.21 0.00 0.00 66.02 66.13 2i9y s SER 133 CO 0.00 -0.11 0.09 -0.63 0.41 0.00 0.00 173.24 173.00 2i9y s ILE 134 N -1.65 4.91 -0.32 1.44 -1.09 0.12 0.05 121.20 124.65 2i9y s ILE 134 Ca 0.03 0.01 -0.10 0.00 -2.23 0.00 0.00 60.65 58.36 2i9y s ILE 134 Cb -0.08 -3.24 -0.00 0.00 -1.58 0.00 0.00 42.46 37.56 2i9y s ILE 134 CO 0.02 0.42 0.17 0.54 -1.23 0.00 0.00 174.94 174.86 2i9y s VAL 135 N 0.67 4.66 -0.33 2.92 0.11 0.61 -1.07 120.40 127.97 2i9y s VAL 135 Ca 0.05 -0.45 -0.22 0.00 -2.93 0.00 0.00 61.98 58.43 2i9y s VAL 135 Cb -0.13 -3.40 -0.00 0.00 -1.53 0.00 0.00 36.38 31.32 2i9y s VAL 135 CO 0.01 0.03 0.70 -1.00 -3.33 0.00 0.00 175.10 171.51 2i9y s HIS 136 N 1.62 3.18 -0.26 1.54 3.76 0.33 -1.28 115.29 124.18 2i9y s HIS 136 Ca 0.04 0.58 -0.12 0.00 -0.15 0.00 0.00 55.06 55.41 2i9y s HIS 136 Cb -0.17 -3.15 -0.05 0.00 1.11 0.00 0.00 32.58 30.32 2i9y s HIS 136 CO 0.07 -0.58 0.25 -1.58 -0.85 0.00 0.00 174.74 172.05 2i9y s TRP 137 N 2.80 3.27 -0.29 1.40 0.52 0.95 -1.37 118.94 126.23 2i9y s TRP 137 Ca 0.28 0.28 -0.02 0.00 0.02 0.00 0.00 56.10 56.66 2i9y s TRP 137 Cb -0.14 -2.41 0.04 0.00 -1.15 0.00 0.00 33.47 29.81 2i9y s TRP 137 CO 0.14 -0.09 -0.02 -1.58 0.02 0.00 0.00 176.95 175.41 2i9y s HIS 138 N 1.57 3.21 -0.17 -1.98 2.46 0.95 -1.73 115.29 119.60 2i9y s HIS 138 Ca 0.11 -1.81 -0.05 0.00 0.47 0.00 0.00 55.06 53.78 2i9y s HIS 138 Cb -0.15 -2.09 -0.03 0.00 -0.13 0.00 0.00 32.58 30.18 2i9y s HIS 138 CO 0.08 -0.79 0.00 -0.51 -2.47 0.00 0.00 174.74 171.06 2i9y s LEU 139 N 1.27 3.43 -0.05 8.88 1.02 0.46 0.12 118.68 133.81 2i9y s LEU 139 Ca -0.04 -0.08 0.00 0.00 0.02 0.00 0.00 54.13 54.03 2i9y s LEU 139 Cb -0.19 -1.85 0.02 0.00 0.02 0.00 0.00 46.19 44.19 2i9y s LEU 139 CO -0.02 0.15 -0.04 -0.70 0.02 0.00 0.00 176.35 175.76 2i9y s GLU 140 N 0.52 0.82 0.23 1.70 2.12 0.22 -0.89 118.70 123.41 2i9y s GLU 140 Ca -0.01 -0.07 -0.15 0.00 0.36 0.00 0.00 54.97 55.10 2i9y s GLU 140 Cb -0.14 -0.91 0.01 0.00 0.26 0.00 0.00 34.13 33.36 2i9y s GLU 140 CO 0.02 -0.14 0.51 1.52 -0.54 0.00 0.00 175.26 176.63 2i9y s TYR 141 N 1.18 0.13 -0.15 5.30 -0.85 0.10 -1.06 117.35 121.99 2i9y s TYR 141 Ca -0.07 -0.50 0.01 0.00 -0.52 0.00 0.00 57.07 55.99 2i9y s TYR 141 Cb -0.14 0.30 0.02 0.00 0.38 0.00 0.00 41.96 42.52 2i9y s TYR 141 CO -0.01 -0.97 -0.17 -2.00 -1.52 0.00 0.00 175.55 170.87 2i9y s GLU 142 N -3.95 2.62 0.35 -3.49 2.12 0.07 -0.12 118.70 116.30 2i9y s GLU 142 Ca 0.16 -0.69 -0.28 0.00 0.36 0.00 0.00 54.97 54.52 2i9y s GLU 142 Cb -0.01 -2.28 -0.10 0.00 0.26 0.00 0.00 34.13 32.00 2i9y s GLU 142 CO 0.04 -0.18 1.31 0.15 -0.54 0.00 0.00 175.26 176.04 2i9y s LYS 143 N 1.28 4.25 0.12 4.30 3.01 0.89 -0.84 119.74 132.75 2i9y s LYS 143 Ca 0.02 2.21 0.00 0.00 -1.01 0.00 0.00 55.97 57.19 2i9y s LYS 143 Cb -0.13 -2.98 -0.15 0.00 -1.01 0.00 0.00 37.83 33.55 2i9y s LYS 143 CO -0.09 -0.28 1.27 0.82 0.51 0.00 0.00 175.35 177.58 2i9y h ILE 144 N 2.88 1.53 -2.43 2.17 2.04 -1.87 -3.43 117.51 118.41 2i9y h ILE 144 Ca -0.49 -2.90 0.09 0.00 1.00 0.00 0.00 64.86 62.56 2i9y h ILE 144 Cb 1.23 2.70 -0.14 0.00 -0.74 0.00 0.00 36.82 39.87 2i9y h ILE 144 CO 0.65 0.84 0.44 -0.55 0.00 0.00 0.00 178.15 179.53 2i9y s SER 145 N -6.99 -0.39 0.02 1.72 0.15 -1.26 -4.96 113.70 101.98 2i9y s SER 145 Ca -0.03 -0.03 -0.27 0.00 0.70 0.00 0.00 55.95 56.32 2i9y s SER 145 Cb 0.09 0.43 -0.16 0.00 -1.71 0.00 0.00 66.02 64.68 2i9y s SER 145 CO 0.85 -0.71 1.19 -0.33 1.20 0.00 0.00 173.24 175.44 2i9y h GLU 146 N 2.00 -0.74 0.00 5.44 4.39 -1.95 -3.23 114.58 120.49 2i9y h GLU 146 Ca -0.24 0.05 0.00 0.00 0.34 0.00 0.00 59.36 59.51 2i9y h GLU 146 Cb 1.25 0.17 0.00 0.00 -0.10 0.00 0.00 28.75 30.07 2i9y h GLU 146 CO 0.32 -0.44 0.00 0.93 -1.16 0.00 0.00 179.01 178.66 2i9y h GLU 147 N -1.06 0.00 0.00 2.33 5.08 -1.98 -0.58 114.58 118.37 2i9y h GLU 147 Ca -0.08 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.28 2i9y h GLU 147 Cb 0.65 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.90 2i9y h GLU 147 CO 0.13 0.00 -0.42 -0.24 -1.00 0.00 0.00 179.01 177.48 2i9y h VAL 148 N 0.00 0.00 -3.39 3.13 3.04 -1.88 -3.46 116.25 113.69 2i9y h VAL 148 Ca 0.00 -0.70 -0.50 0.00 -1.01 0.00 0.00 66.70 64.49 2i9y h VAL 148 Cb 0.14 1.45 0.01 0.00 -2.01 0.00 0.00 31.29 30.87 2i9y h VAL 148 CO 0.00 0.00 -0.01 0.00 -1.01 0.00 0.00 177.57 176.55 2i9y s ALA 149 N -3.20 3.50 -0.38 3.17 0.00 -0.23 -4.60 121.76 120.02 2i9y s ALA 149 Ca 0.06 -0.48 0.02 0.00 0.00 0.00 0.00 51.96 51.57 2i9y s ALA 149 Cb 0.11 -2.47 0.15 0.00 0.00 0.00 0.00 23.12 20.91 2i9y s ALA 149 CO 0.69 0.01 0.32 -1.01 0.00 0.00 0.00 175.76 175.77 2i9y s HIS 150 N -2.34 0.30 0.65 0.00 0.09 -1.26 -4.98 115.29 107.74 2i9y s HIS 150 Ca 0.46 -1.41 0.40 0.00 -0.00 0.00 0.00 55.06 54.52 2i9y s HIS 150 Cb -0.10 -0.67 2.24 0.00 -0.00 0.00 0.00 32.58 34.05 2i9y s HIS 150 CO 0.34 -0.90 2.33 -1.35 -0.00 0.00 0.00 174.74 175.16 2i9y h PRO 151 N 6.69 0.00 -0.25 8.40 0.11 -1.97 -2.78 132.00 142.20 2i9y h PRO 151 Ca 0.09 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 66.20 2i9y h PRO 151 Cb 1.00 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.10 2i9y h PRO 151 CO 0.24 0.00 0.14 0.93 -0.21 0.00 0.00 178.00 179.11 2i9y h GLU 152 N 0.00 0.35 0.00 1.05 4.39 -2.01 -2.80 114.58 115.56 2i9y h GLU 152 Ca 0.00 -0.04 -0.14 0.00 0.34 0.00 0.00 59.36 59.52 2i9y h GLU 152 Cb 0.02 -0.07 -0.02 0.00 -0.10 0.00 0.00 28.75 28.58 2i9y h GLU 152 CO -0.00 0.30 -0.67 1.79 -1.16 0.00 0.00 179.01 179.26 2i9y h THR 153 N 0.30 1.44 -0.58 1.13 1.35 -1.93 -2.83 112.91 111.79 2i9y h THR 153 Ca 0.09 -2.35 -0.00 0.00 -0.55 0.00 0.00 66.41 63.60 2i9y h THR 153 Cb 0.05 2.28 -0.03 0.00 -1.73 0.00 0.00 68.15 68.72 2i9y h THR 153 CO -0.02 0.66 0.36 -0.07 -0.25 0.00 0.00 175.52 176.20 2i9y h LEU 154 N 0.00 0.68 -0.68 3.87 3.38 -1.50 0.65 115.31 121.71 2i9y h LEU 154 Ca -0.01 -0.05 -0.06 0.00 0.09 0.00 0.00 57.88 57.86 2i9y h LEU 154 Cb 1.23 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 41.78 2i9y h LEU 154 CO 0.09 0.53 0.20 -0.07 0.09 0.00 0.00 178.44 179.27 2i9y h LEU 155 N 0.78 1.01 -0.62 1.67 3.38 -1.30 -0.77 115.31 119.46 2i9y h LEU 155 Ca 0.21 -0.22 0.02 0.00 0.09 0.00 0.00 57.88 57.98 2i9y h LEU 155 Cb -0.04 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 40.41 2i9y h LEU 155 CO -0.04 0.96 0.40 1.56 0.09 0.00 0.00 178.44 181.41 2i9y h GLN 156 N 1.01 0.79 -0.74 1.13 1.08 -1.18 0.12 115.11 117.31 2i9y h GLN 156 Ca 0.22 -0.05 0.03 0.00 -1.45 0.00 0.00 58.65 57.40 2i9y h GLN 156 Cb 0.33 -0.18 -0.04 0.00 -0.05 0.00 0.00 27.48 27.53 2i9y h GLN 156 CO -0.00 0.52 0.47 0.35 -0.95 0.00 0.00 178.83 179.22 2i9y h PHE 157 N 0.81 0.89 -0.29 2.96 3.57 -0.50 -0.34 116.94 124.04 2i9y h PHE 157 Ca 0.24 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.75 2i9y h PHE 157 Cb -0.05 -0.29 -0.01 0.00 2.79 0.00 0.00 35.95 38.38 2i9y h PHE 157 CO -0.04 0.52 0.15 0.00 -2.23 0.00 0.00 178.31 176.71 2i9y h VAL 159 N 0.34 1.14 -0.40 0.00 2.07 -0.27 0.22 116.25 119.36 2i9y h VAL 159 Ca 0.10 -0.34 -0.07 0.00 0.82 0.00 0.00 66.70 67.21 2i9y h VAL 159 Cb 0.08 0.56 -0.02 0.00 -1.52 0.00 0.00 31.29 30.39 2i9y h VAL 159 CO -0.02 0.15 -0.06 -0.33 0.02 0.00 0.00 177.57 177.34 2i9y h GLU 160 N 0.59 0.67 -0.05 1.57 4.39 -0.94 -1.66 114.58 119.16 2i9y h GLU 160 Ca 0.16 -0.19 -0.20 0.00 0.34 0.00 0.00 59.36 59.48 2i9y h GLU 160 Cb 0.01 -0.07 -0.00 0.00 -0.10 0.00 0.00 28.75 28.58 2i9y h GLU 160 CO -0.03 0.73 -0.81 0.28 -1.16 0.00 0.00 179.01 178.02 2i9y h VAL 161 N 0.62 1.40 -0.41 3.13 2.07 -0.92 -3.08 116.25 119.06 2i9y h VAL 161 Ca 0.12 -2.28 0.04 0.00 0.82 0.00 0.00 66.70 65.40 2i9y h VAL 161 Cb 0.47 2.24 -0.04 0.00 -1.52 0.00 0.00 31.29 32.44 2i9y h VAL 161 CO 0.02 0.68 0.18 0.28 0.02 0.00 0.00 177.57 178.76 2i9y h SER 162 N 0.24 0.24 0.16 0.57 0.02 0.08 0.16 113.55 115.03 2i9y h SER 162 Ca -0.05 0.03 -0.07 0.00 -0.84 0.00 0.00 61.79 60.87 2i9y h SER 162 Cb 1.40 -0.01 -0.01 0.00 0.14 0.00 0.00 62.40 63.92 2i9y h SER 162 CO 0.14 0.18 -0.25 0.07 -1.14 0.00 0.00 176.83 175.82 2i9y h LYS 163 N 0.37 0.17 0.07 3.45 2.10 -1.37 -0.79 116.57 120.57 2i9y h LYS 163 Ca 0.18 -0.05 -0.00 0.00 -2.00 0.00 0.00 60.65 58.77 2i9y h LYS 163 Cb 0.12 -0.02 0.00 0.00 -0.90 0.00 0.00 32.23 31.43 2i9y h LYS 163 CO -0.15 0.42 -0.03 0.93 -2.00 0.00 0.00 179.45 178.62 2i9y h GLU 164 N 0.15 -0.09 -0.38 0.07 4.39 -1.26 -2.28 114.58 115.19 2i9y h GLU 164 Ca 0.02 0.01 -0.08 0.00 0.34 0.00 0.00 59.36 59.65 2i9y h GLU 164 Cb 0.54 0.02 -0.02 0.00 -0.10 0.00 0.00 28.75 29.19 2i9y h GLU 164 CO 0.04 0.38 -0.11 0.97 -1.16 0.00 0.00 179.01 179.13 2i9y h ILE 165 N -0.62 1.25 0.10 3.13 -0.00 -0.93 0.15 117.51 120.60 2i9y h ILE 165 Ca -0.01 -1.10 0.00 0.00 -0.00 0.00 0.00 64.86 63.75 2i9y h ILE 165 Cb 0.52 1.08 -0.01 0.00 -0.00 0.00 0.00 36.82 38.41 2i9y h ILE 165 CO 0.02 0.37 -0.09 -0.78 -0.00 0.00 0.00 178.15 177.66 2i9y h ASP 166 N 0.60 -0.24 0.09 2.19 3.58 -1.20 -2.11 116.42 119.34 2i9y h ASP 166 Ca 0.11 0.02 -0.11 0.00 0.42 0.00 0.00 57.03 57.47 2i9y h ASP 166 Cb 0.54 0.08 -0.01 0.00 1.72 0.00 0.00 39.33 41.66 2i9y h ASP 166 CO 0.03 -0.14 -0.38 -0.08 -2.88 0.00 0.00 179.24 175.79 2i9y h GLU 167 N -0.21 0.39 -0.63 0.28 4.22 -1.10 -2.67 114.58 114.85 2i9y h GLU 167 Ca 0.00 -0.18 -0.02 0.00 0.08 0.00 0.00 59.36 59.24 2i9y h GLU 167 Cb 0.20 -0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.41 2i9y h GLU 167 CO -0.02 0.71 0.32 1.25 -2.18 0.00 0.00 179.01 179.09 2i9y h HIS 168 N 0.32 0.87 0.08 0.92 2.76 -0.34 0.67 115.15 120.43 2i9y h HIS 168 Ca 0.03 -0.02 -0.26 0.00 -2.20 0.00 0.00 60.37 57.92 2i9y h HIS 168 Cb 0.82 -0.28 0.02 0.00 1.55 0.00 0.00 27.41 29.53 2i9y h HIS 168 CO 0.02 0.62 -1.05 -0.07 -1.30 0.00 0.00 177.93 176.15 2i9y h LEU 169 N 0.88 0.78 0.19 0.26 3.38 -1.10 -3.35 115.31 116.35 2i9y h LEU 169 Ca 0.22 -0.81 -0.33 0.00 0.09 0.00 0.00 57.88 57.05 2i9y h LEU 169 Cb 0.07 -0.24 0.02 0.00 0.09 0.00 0.00 40.66 40.59 2i9y h LEU 169 CO -0.03 1.51 -1.57 -0.07 0.09 0.00 0.00 178.44 178.37 2i9y h LEU 170 N 0.15 0.64 -2.77 1.67 3.38 -1.36 -3.50 115.31 113.53 2i9y h LEU 170 Ca -0.16 -0.92 -0.15 0.00 0.09 0.00 0.00 57.88 56.74 2i9y h LEU 170 Cb 1.75 -0.21 0.01 0.00 0.09 0.00 0.00 40.66 42.29 2i9y h LEU 170 CO 0.20 1.72 -0.70 0.00 0.09 0.00 0.00 178.44 179.75 2i9y n ALA 171 N -2.83 -2.73 -2.50 1.53 0.00 0.23 -4.99 120.51 109.22 2i9y n ALA 171 Ca -0.22 0.71 -0.25 0.00 0.00 0.00 0.00 53.44 53.68 2i9y n ALA 171 Cb 1.04 -2.89 -0.01 0.00 0.00 0.00 0.00 19.45 17.59 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 -2.76 3.45 0.00 0.00 -1.05 -1.26 -5.10 118.70 111.98 2i9y s GLU 172 Ca 0.25 -0.19 0.00 0.00 -0.15 0.00 0.00 54.97 54.88 2i9y s GLU 172 Cb -0.05 -2.56 0.00 0.00 -0.44 0.00 0.00 34.13 31.08 2i9y s GLU 172 CO 0.81 -0.01 0.00 -1.91 0.95 0.00 0.00 175.26 175.10