#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2o1a s ALA 18 N 0.00 0.68 0.01 1.69 0.00 -1.26 -3.69 121.76 119.18 2o1a s ALA 18 Ca 0.00 -0.81 0.03 0.00 0.00 0.00 0.00 51.96 51.17 2o1a s ALA 18 Cb 0.00 0.02 -0.01 0.00 0.00 0.00 0.00 23.12 23.13 2o1a s ALA 18 CO 0.00 0.01 -0.08 0.99 0.00 0.00 0.00 175.76 176.67 2o1a s THR 19 N -1.41 0.65 0.04 0.00 2.01 -0.53 -4.99 115.64 111.41 2o1a s THR 19 Ca -0.08 -0.56 -0.03 0.00 0.31 0.00 0.00 61.69 61.32 2o1a s THR 19 Cb -0.10 -0.59 -0.02 0.00 0.01 0.00 0.00 72.50 71.80 2o1a s THR 19 CO 0.01 0.03 0.04 -0.94 -0.69 0.00 0.00 174.62 173.07 2o1a s SER 20 N -0.59 0.27 -0.04 3.53 1.04 -1.26 -0.42 113.70 116.23 2o1a s SER 20 Ca 0.00 -0.65 -0.10 0.00 0.48 0.00 0.00 55.95 55.68 2o1a s SER 20 Cb -0.05 0.19 0.02 0.00 0.10 0.00 0.00 66.02 66.28 2o1a s SER 20 CO 0.00 -0.49 0.24 -1.58 0.98 0.00 0.00 173.24 172.39 2o1a s GLN 21 N -2.73 0.46 0.66 4.02 0.74 -0.50 -4.98 119.66 117.32 2o1a s GLN 21 Ca -0.04 -0.01 -0.16 0.00 0.05 0.00 0.00 55.36 55.19 2o1a s GLN 21 Cb -0.01 0.20 0.00 0.00 1.10 0.00 0.00 33.01 34.31 2o1a s GLN 21 CO -0.05 -0.10 1.17 -1.25 -0.55 0.00 0.00 175.29 174.51 2o1a s PRO 22 N -0.71 2.62 -0.05 1.67 0.04 -1.26 -0.25 135.00 137.06 2o1a s PRO 22 Ca -0.08 1.66 -0.02 0.00 0.04 0.00 0.00 61.00 62.60 2o1a s PRO 22 Cb -0.04 -1.90 0.04 0.00 0.04 0.00 0.00 34.50 32.63 2o1a s PRO 22 CO 0.02 -1.44 0.09 -1.50 0.04 0.00 0.00 177.00 174.21 2o1a s ILE 23 N -1.97 -0.10 0.59 0.56 2.07 -0.37 -4.73 121.20 117.25 2o1a s ILE 23 Ca 0.73 0.28 -0.15 0.00 -1.41 0.00 0.00 60.65 60.09 2o1a s ILE 23 Cb -0.27 -0.18 -0.04 0.00 0.13 0.00 0.00 42.46 42.11 2o1a s ILE 23 CO 0.40 0.11 1.05 0.20 -1.91 0.00 0.00 174.94 174.80 2o1a s ASN 24 N 1.55 5.81 0.23 4.50 0.02 -1.26 -0.70 114.94 125.10 2o1a s ASN 24 Ca -0.04 1.79 -0.21 0.00 -1.02 0.00 0.00 52.86 53.38 2o1a s ASN 24 Cb -0.12 -2.53 0.04 0.00 0.02 0.00 0.00 41.25 38.66 2o1a s ASN 24 CO -0.04 -1.15 0.66 0.72 0.02 0.00 0.00 177.10 177.31 2o1a s PHE 25 N -2.50 -0.29 -0.07 2.20 -0.71 -1.26 -0.75 117.98 114.60 2o1a s PHE 25 Ca 0.63 -0.07 -0.03 0.00 -1.04 0.00 0.00 56.93 56.42 2o1a s PHE 25 Cb -0.16 0.63 0.04 0.00 -1.21 0.00 0.00 43.02 42.32 2o1a s PHE 25 CO 0.38 -1.08 0.16 -1.14 -1.34 0.00 0.00 175.22 172.20 2o1a s GLN 26 N -3.86 0.10 -0.00 1.99 0.74 -0.36 -4.96 119.66 113.30 2o1a s GLN 26 Ca 0.08 0.42 -0.30 0.00 0.05 0.00 0.00 55.36 55.61 2o1a s GLN 26 Cb -0.04 -0.18 -0.03 0.00 1.10 0.00 0.00 33.01 33.86 2o1a s GLN 26 CO -0.01 -0.18 1.04 0.08 -0.55 0.00 0.00 175.29 175.67 2o1a s VAL 27 N 1.32 4.67 0.26 1.34 1.01 -1.26 -1.13 120.40 126.61 2o1a s VAL 27 Ca -0.08 1.92 0.11 0.00 0.00 0.00 0.00 61.98 63.94 2o1a s VAL 27 Cb -0.11 -4.23 -0.05 0.00 0.00 0.00 0.00 36.38 31.99 2o1a s VAL 27 CO -0.06 0.13 -0.20 -1.10 0.00 0.00 0.00 175.10 173.86 2o1a s GLN 28 N 1.18 1.61 0.49 2.72 -0.21 0.72 -1.02 119.66 125.16 2o1a s GLN 28 Ca 0.53 -1.71 -0.21 0.00 0.02 0.00 0.00 55.36 53.99 2o1a s GLN 28 Cb -0.22 -1.70 -0.07 0.00 1.00 0.00 0.00 33.01 32.01 2o1a s GLN 28 CO 0.27 0.32 1.12 0.15 -2.12 0.00 0.00 175.29 175.03 2o1a s LYS 29 N -3.39 3.67 0.18 2.91 1.02 0.26 -1.45 119.74 122.93 2o1a s LYS 29 Ca 0.28 1.61 -0.33 0.00 0.02 0.00 0.00 55.97 57.55 2o1a s LYS 29 Cb -0.05 -2.22 -0.13 0.00 -0.52 0.00 0.00 37.83 34.91 2o1a s LYS 29 CO 0.13 -0.59 1.68 -3.47 -0.92 0.00 0.00 175.35 172.18 2o1a n ASP 30 N -0.81 3.64 0.00 2.83 2.03 -1.20 -2.42 116.55 120.60 2o1a n ASP 30 Ca 0.09 1.06 0.00 0.00 0.52 0.00 0.00 54.79 56.46 2o1a n ASP 30 Cb 0.50 -1.51 0.00 0.00 -0.72 0.00 0.00 41.12 39.39 2o1a n ASP 30 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2o1a n GLY 31 N 3.78 0.68 3.73 0.27 0.00 -1.26 -5.00 105.19 107.39 2o1a n GLY 31 Ca 0.17 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.09 2o1a n GLY 31 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2o1a s SER 32 N -2.29 0.21 0.00 1.61 1.04 -1.02 -5.03 113.70 108.21 2o1a s SER 32 Ca 0.00 -1.18 0.22 0.00 0.48 0.00 0.00 55.95 55.46 2o1a s SER 32 Cb 0.00 0.79 0.53 0.00 0.10 0.00 0.00 66.02 67.44 2o1a s SER 32 CO 0.00 -1.56 1.45 -1.54 0.98 0.00 0.00 173.24 172.57 2o1a n SER 33 N -1.31 2.86 -4.77 7.02 3.41 -1.26 -4.20 113.62 115.37 2o1a n SER 33 Ca -0.06 -1.91 -0.41 0.00 -0.26 0.00 0.00 58.87 56.23 2o1a n SER 33 Cb 0.60 -0.22 -0.02 0.00 -0.26 0.00 0.00 64.21 64.31 2o1a n SER 33 CO 0.00 0.00 0.00 -0.70 -0.16 0.00 0.00 175.04 174.18 2o1a s GLU 34 N -1.55 4.36 0.33 4.33 2.12 -1.26 -4.78 118.70 122.25 2o1a s GLU 34 Ca 0.37 2.21 -0.28 0.00 0.36 0.00 0.00 54.97 57.62 2o1a s GLU 34 Cb 0.21 -3.07 -0.13 0.00 0.26 0.00 0.00 34.13 31.40 2o1a s GLU 34 CO 0.29 -0.19 1.27 1.17 -0.54 0.00 0.00 175.26 177.26 2o1a n LYS 35 N 0.85 2.05 -3.67 4.30 4.81 -1.26 -0.57 118.16 124.66 2o1a n LYS 35 Ca 0.00 0.72 -0.34 0.00 -0.87 0.00 0.00 58.31 57.82 2o1a n LYS 35 Cb 0.42 -2.28 -0.05 0.00 0.02 0.00 0.00 35.03 33.14 2o1a n LYS 35 CO 0.00 0.00 0.00 0.45 1.17 0.00 0.00 177.40 179.02 2o1a s SER 36 N -0.30 6.55 0.00 3.14 0.15 -0.18 -4.52 113.70 118.53 2o1a s SER 36 Ca 0.56 0.65 0.00 0.00 0.70 0.00 0.00 55.95 57.86 2o1a s SER 36 Cb -0.59 -2.12 0.00 0.00 -1.71 0.00 0.00 66.02 61.60 2o1a s SER 36 CO 0.61 0.16 0.49 1.41 1.20 0.00 0.00 173.24 177.11 2o1a n HIS 37 N 0.70 0.00 0.00 3.44 -0.00 -1.26 -4.28 115.22 113.81 2o1a n HIS 37 Ca -0.07 -0.06 0.00 0.00 -0.00 0.00 0.00 57.72 57.59 2o1a n HIS 37 Cb 0.52 -0.39 0.00 0.00 -0.00 0.00 0.00 29.99 30.12 2o1a n HIS 37 CO 0.00 0.00 0.00 -3.47 -0.00 0.00 0.00 176.34 172.87 2o1a n ASP 39 N 3.03 0.00 0.24 0.41 2.03 -1.26 -4.06 116.55 116.95 2o1a n ASP 39 Ca 0.00 0.00 0.16 0.00 0.52 0.00 0.00 54.79 55.47 2o1a n ASP 39 Cb 0.00 -0.00 0.69 0.00 -0.72 0.00 0.00 41.12 41.08 2o1a n ASP 39 CO 0.00 0.00 0.00 0.44 -1.92 0.00 0.00 177.20 175.72 2o1a h ASP 40 N 0.00 0.00 -0.30 1.67 3.32 -1.95 -3.44 116.42 115.72 2o1a h ASP 40 Ca 0.00 0.00 -0.21 0.00 0.02 0.00 0.00 57.03 56.84 2o1a h ASP 40 Cb 0.00 0.00 -0.08 0.00 0.22 0.00 0.00 39.33 39.47 2o1a h ASP 40 CO 0.00 0.00 0.12 -1.22 -1.72 0.00 0.00 179.24 176.42 2o1a n TYR 41 N -2.85 0.71 -4.43 4.55 4.01 -1.26 -4.88 117.16 113.01 2o1a n TYR 41 Ca 0.01 -1.53 -0.26 0.00 -0.16 0.00 0.00 57.90 55.95 2o1a n TYR 41 Cb 0.26 -0.97 -0.11 0.00 -0.31 0.00 0.00 39.34 38.21 2o1a n TYR 41 CO 0.00 0.00 0.00 -0.65 -0.46 0.00 0.00 176.86 175.75 2o1a s GLN 43 N -0.64 1.56 0.04 -0.72 -0.21 -0.04 -0.29 119.66 119.36 2o1a s GLN 43 Ca 0.30 -1.58 0.03 0.00 0.02 0.00 0.00 55.36 54.13 2o1a s GLN 43 Cb 0.19 -1.82 -0.02 0.00 1.00 0.00 0.00 33.01 32.35 2o1a s GLN 43 CO -0.03 0.38 -0.09 -1.01 -2.12 0.00 0.00 175.29 172.42 2o1a s HIS 44 N -1.87 0.79 0.92 0.91 3.76 -1.26 -4.27 115.29 114.27 2o1a s HIS 44 Ca 0.23 -0.39 -0.12 0.00 -0.15 0.00 0.00 55.06 54.62 2o1a s HIS 44 Cb -0.07 -0.47 0.14 0.00 1.11 0.00 0.00 32.58 33.29 2o1a s HIS 44 CO 0.11 -0.03 1.14 -1.25 -0.85 0.00 0.00 174.74 173.85 2o1a s PRO 45 N -1.25 1.09 0.00 8.40 0.04 -1.26 -5.15 135.00 136.87 2o1a s PRO 45 Ca -0.05 0.30 0.00 0.00 0.04 0.00 0.00 61.00 61.29 2o1a s PRO 45 Cb -0.08 -1.83 0.00 0.00 0.04 0.00 0.00 34.50 32.63 2o1a s PRO 45 CO 0.01 -2.23 0.00 0.41 0.04 0.00 0.00 177.00 175.22 2o1a n GLY 46 N -2.15 -0.07 2.92 0.56 0.00 0.12 -4.87 105.19 101.71 2o1a n GLY 46 Ca 0.06 -1.77 -0.12 0.00 0.00 0.00 0.00 46.02 44.20 2o1a n GLY 46 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2o1a s LYS 47 N -0.33 0.08 -0.16 1.61 2.20 -0.55 -1.24 119.74 121.36 2o1a s LYS 47 Ca 0.00 -0.04 -0.08 0.00 -0.36 0.00 0.00 55.97 55.49 2o1a s LYS 47 Cb 0.00 0.04 -0.04 0.00 -1.51 0.00 0.00 37.83 36.31 2o1a s LYS 47 CO 0.00 -0.01 0.12 0.14 -0.36 0.00 0.00 175.35 175.23 2o1a s VAL 48 N -0.19 5.30 -0.04 4.02 -7.23 0.65 -0.17 120.40 122.76 2o1a s VAL 48 Ca -0.02 0.14 0.05 0.00 -1.81 0.00 0.00 61.98 60.34 2o1a s VAL 48 Cb -0.02 -3.36 -0.01 0.00 0.56 0.00 0.00 36.38 33.56 2o1a s VAL 48 CO -0.00 0.52 -0.17 -0.63 -0.31 0.00 0.00 175.10 174.51 2o1a s ILE 49 N -0.26 1.42 -0.20 -0.62 1.01 0.04 -1.42 121.20 121.17 2o1a s ILE 49 Ca 0.10 -0.72 -0.02 0.00 0.00 0.00 0.00 60.65 60.01 2o1a s ILE 49 Cb -0.12 -1.21 -0.00 0.00 0.01 0.00 0.00 42.46 41.14 2o1a s ILE 49 CO 0.01 0.41 -0.08 -0.75 0.00 0.00 0.00 174.94 174.52 2o1a s LYS 50 N -0.06 3.31 0.01 2.79 2.20 0.44 -0.53 119.74 127.90 2o1a s LYS 50 Ca -0.01 -0.67 0.02 0.00 -0.36 0.00 0.00 55.97 54.95 2o1a s LYS 50 Cb -0.10 -2.88 -0.01 0.00 -1.51 0.00 0.00 37.83 33.33 2o1a s LYS 50 CO 0.02 -0.15 -0.07 1.14 -0.36 0.00 0.00 175.35 175.93 2o1a s GLN 51 N 1.30 0.53 0.00 4.03 -2.07 -0.09 -1.46 119.66 121.90 2o1a s GLN 51 Ca 0.04 -0.35 0.00 0.00 -1.82 0.00 0.00 55.36 53.23 2o1a s GLN 51 Cb -0.14 -0.47 0.00 0.00 -1.09 0.00 0.00 33.01 31.31 2o1a s GLN 51 CO -0.04 0.12 0.00 0.09 -1.32 0.00 0.00 175.29 174.14 2o1a n ASN 52 N 2.61 0.00 -0.23 12.60 4.13 -1.24 -0.63 115.26 132.49 2o1a n ASN 52 Ca -0.15 0.00 0.07 0.00 1.68 0.00 0.00 54.58 56.18 2o1a n ASN 52 Cb 0.57 0.00 0.11 0.00 -1.54 0.00 0.00 39.78 38.92 2o1a n ASN 52 CO 0.00 0.00 0.00 -3.20 0.28 0.00 0.00 177.26 174.34 2o1a n ASN 53 N -0.17 1.74 -4.33 6.41 4.05 -1.26 -5.00 115.26 116.70 2o1a n ASN 53 Ca 0.00 -2.87 -0.26 0.00 0.45 0.00 0.00 54.58 51.90 2o1a n ASN 53 Cb 0.00 -0.38 -0.13 0.00 1.23 0.00 0.00 39.78 40.50 2o1a n ASN 53 CO 0.00 0.00 0.00 -0.54 -3.05 0.00 0.00 177.26 173.67 2o1a s LYS 54 N -2.18 1.25 -0.00 1.20 1.02 0.20 -5.14 119.74 116.08 2o1a s LYS 54 Ca 0.25 -1.25 0.04 0.00 0.02 0.00 0.00 55.97 55.03 2o1a s LYS 54 Cb 0.22 -1.61 -0.03 0.00 -0.52 0.00 0.00 37.83 35.90 2o1a s LYS 54 CO 0.01 0.38 -0.10 0.71 -0.92 0.00 0.00 175.35 175.43 2o1a s TYR 55 N -1.16 2.80 0.04 3.18 2.02 -1.26 -0.91 117.35 122.06 2o1a s TYR 55 Ca 0.10 -0.10 0.02 0.00 -0.37 0.00 0.00 57.07 56.73 2o1a s TYR 55 Cb -0.10 -1.59 -0.02 0.00 -0.40 0.00 0.00 41.96 39.85 2o1a s TYR 55 CO 0.05 0.32 -0.08 0.71 -1.57 0.00 0.00 175.55 174.98 2o1a s TYR 56 N -0.93 0.67 -0.34 2.71 2.02 0.32 -1.67 117.35 120.12 2o1a s TYR 56 Ca 0.15 -0.48 -0.12 0.00 -0.37 0.00 0.00 57.07 56.25 2o1a s TYR 56 Cb -0.11 -0.40 -0.01 0.00 -0.40 0.00 0.00 41.96 41.04 2o1a s TYR 56 CO 0.06 -0.08 0.23 0.12 -1.57 0.00 0.00 175.55 174.30 2o1a s PHE 57 N -1.31 3.22 -0.18 2.71 5.36 0.29 -0.78 117.98 127.29 2o1a s PHE 57 Ca -0.09 -0.29 -0.07 0.00 -0.96 0.00 0.00 56.93 55.52 2o1a s PHE 57 Cb -0.10 -2.46 -0.04 0.00 -0.34 0.00 0.00 43.02 40.09 2o1a s PHE 57 CO 0.00 -0.38 0.06 -1.14 -1.46 0.00 0.00 175.22 172.30 2o1a s GLN 58 N 1.70 3.96 0.02 10.12 0.74 0.76 -0.43 119.66 136.53 2o1a s GLN 58 Ca 0.06 -0.34 -0.07 0.00 0.05 0.00 0.00 55.36 55.06 2o1a s GLN 58 Cb -0.17 -3.21 -0.00 0.00 1.10 0.00 0.00 33.01 30.73 2o1a s GLN 58 CO 0.10 0.29 0.13 -0.08 -0.55 0.00 0.00 175.29 175.18 2o1a s THR 59 N 0.32 0.10 -0.19 -0.34 -1.32 -0.38 -1.48 115.64 112.34 2o1a s THR 59 Ca 0.03 -0.84 -0.02 0.00 -1.21 0.00 0.00 61.69 59.65 2o1a s THR 59 Cb -0.12 -0.63 -0.01 0.00 -1.51 0.00 0.00 72.50 70.23 2o1a s THR 59 CO 0.00 -0.46 -0.09 -0.69 -2.21 0.00 0.00 174.62 171.17 2o1a s VAL 60 N -1.91 3.10 -0.18 5.08 1.01 -1.26 -1.12 120.40 125.11 2o1a s VAL 60 Ca -0.11 -0.60 -0.23 0.00 0.00 0.00 0.00 61.98 61.05 2o1a s VAL 60 Cb -0.05 -2.37 -0.02 0.00 0.00 0.00 0.00 36.38 33.94 2o1a s VAL 60 CO -0.01 0.47 0.71 -0.76 0.00 0.00 0.00 175.10 175.50 2o1a s LEU 61 N 1.19 4.16 0.45 3.92 1.43 0.10 -0.86 118.68 129.07 2o1a s LEU 61 Ca 0.02 0.97 -0.20 0.00 -1.03 0.00 0.00 54.13 53.88 2o1a s LEU 61 Cb -0.14 -3.02 -0.10 0.00 0.03 0.00 0.00 46.19 42.95 2o1a s LEU 61 CO -0.03 -0.32 0.97 0.20 0.23 0.00 0.00 176.35 177.40 2o1a s ASN 62 N 1.18 6.80 -1.33 2.29 0.01 0.61 -2.07 114.94 122.42 2o1a s ASN 62 Ca 0.32 1.72 -0.02 0.00 -0.71 0.00 0.00 52.86 54.17 2o1a s ASN 62 Cb -0.16 -2.54 -0.00 0.00 0.41 0.00 0.00 41.25 38.96 2o1a s ASN 62 CO 0.11 -0.46 0.57 0.59 -1.51 0.00 0.00 177.10 176.41 2o1a n ASN 63 N -0.79 -1.26 -0.06 -1.22 3.02 -0.65 -4.82 115.26 109.48 2o1a n ASN 63 Ca 0.07 -0.93 0.09 0.00 -0.03 0.00 0.00 54.58 53.78 2o1a n ASN 63 Cb 0.54 -3.51 0.47 0.00 -0.61 0.00 0.00 39.78 36.66 2o1a n ASN 63 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2o1a h ALA 64 N 0.84 1.90 -0.03 5.41 0.00 -1.12 0.19 119.26 126.45 2o1a h ALA 64 Ca -0.63 -0.02 0.01 0.00 0.00 0.00 0.00 54.91 54.28 2o1a h ALA 64 Cb 1.37 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 19.04 2o1a h ALA 64 CO 0.58 -0.00 0.14 0.66 0.00 0.00 0.00 179.25 180.63 2o1a h SER 65 N 0.47 0.00 1.53 0.00 4.64 -1.88 -1.20 113.55 117.12 2o1a h SER 65 Ca 0.24 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.56 2o1a h SER 65 Cb 0.34 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.43 2o1a h SER 65 CO -0.07 0.00 -0.34 -0.26 -0.87 0.00 0.00 176.83 175.29 2o1a h PHE 66 N 0.00 0.00 -1.97 4.77 -1.00 -0.84 -3.43 116.94 114.47 2o1a h PHE 66 Ca 0.02 0.00 -0.63 0.00 2.81 0.00 0.00 57.97 60.17 2o1a h PHE 66 Cb 0.30 0.00 -0.13 0.00 3.61 0.00 0.00 35.95 39.73 2o1a h PHE 66 CO 0.00 0.00 1.05 -1.58 -1.61 0.00 0.00 178.31 176.17 2o1a s TRP 67 N -3.23 2.72 0.19 -0.55 0.52 -0.45 -0.97 118.94 117.16 2o1a s TRP 67 Ca 0.05 -0.88 -0.08 0.00 0.02 0.00 0.00 56.10 55.22 2o1a s TRP 67 Cb 0.08 -4.48 0.09 0.00 -1.15 0.00 0.00 33.47 28.01 2o1a s TRP 67 CO 0.70 -1.76 1.60 -0.22 0.02 0.00 0.00 176.95 177.30 2o1a h LYS 68 N 9.46 0.95 -2.72 4.98 3.64 -1.14 -3.46 116.57 128.29 2o1a h LYS 68 Ca 0.04 -0.37 -0.10 0.00 -1.27 0.00 0.00 60.65 58.95 2o1a h LYS 68 Cb 1.03 -0.05 -0.20 0.00 -0.41 0.00 0.00 32.23 32.59 2o1a h LYS 68 CO 1.26 1.03 -0.15 -2.00 -2.27 0.00 0.00 179.45 177.32 2o1a s GLU 69 N -4.75 0.74 -0.08 1.90 2.12 -1.14 -4.99 118.70 112.49 2o1a s GLU 69 Ca -0.11 0.06 -0.08 0.00 0.36 0.00 0.00 54.97 55.20 2o1a s GLU 69 Cb 0.13 0.34 0.02 0.00 0.26 0.00 0.00 34.13 34.88 2o1a s GLU 69 CO 0.86 -0.20 0.23 1.52 -0.54 0.00 0.00 175.26 177.13 2o1a s TYR 70 N -1.03 -0.25 -0.01 5.30 -0.85 -1.26 -0.86 117.35 118.40 2o1a s TYR 70 Ca -0.11 0.60 0.01 0.00 -0.52 0.00 0.00 57.07 57.05 2o1a s TYR 70 Cb -0.04 0.08 0.01 0.00 0.38 0.00 0.00 41.96 42.39 2o1a s TYR 70 CO 0.05 -0.13 -0.02 0.15 -1.52 0.00 0.00 175.55 174.08 2o1a s LYS 71 N 0.06 0.20 0.04 -3.49 -0.14 0.28 -5.01 119.74 111.68 2o1a s LYS 71 Ca -0.01 -0.04 0.09 0.00 -1.36 0.00 0.00 55.97 54.65 2o1a s LYS 71 Cb -0.02 -0.25 -0.03 0.00 -1.68 0.00 0.00 37.83 35.85 2o1a s LYS 71 CO 0.00 0.00 -0.24 -0.06 -0.76 0.00 0.00 175.35 174.29 2o1a s PHE 72 N 0.22 2.38 0.05 3.18 0.08 -1.26 -0.87 117.98 121.76 2o1a s PHE 72 Ca -0.02 -0.38 0.02 0.00 0.12 0.00 0.00 56.93 56.67 2o1a s PHE 72 Cb -0.04 -1.41 -0.03 0.00 -0.57 0.00 0.00 43.02 40.97 2o1a s PHE 72 CO -0.01 0.15 -0.06 0.71 -0.10 0.00 0.00 175.22 175.91 2o1a s TYR 73 N -0.83 0.65 1.08 0.36 2.02 0.25 -1.28 117.35 119.60 2o1a s TYR 73 Ca 0.12 -0.64 -0.18 0.00 -0.37 0.00 0.00 57.07 56.00 2o1a s TYR 73 Cb -0.10 -0.40 0.25 0.00 -0.40 0.00 0.00 41.96 41.32 2o1a s TYR 73 CO 0.03 -0.14 1.27 0.54 -1.57 0.00 0.00 175.55 175.68 2o1a s ASN 74 N -2.00 2.01 0.52 2.29 2.20 -0.35 -0.46 114.94 119.16 2o1a s ASN 74 Ca -0.05 0.28 0.35 0.00 -0.94 0.00 0.00 52.86 52.50 2o1a s ASN 74 Cb -0.05 -0.30 1.65 0.00 -2.00 0.00 0.00 41.25 40.55 2o1a s ASN 74 CO -0.02 -3.42 2.04 0.00 -2.94 0.00 0.00 177.10 172.76 2o1a h ALA 75 N -2.11 1.00 -0.44 3.54 0.00 -1.92 0.76 119.26 120.09 2o1a h ALA 75 Ca -0.43 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.48 2o1a h ALA 75 Cb 1.24 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.03 2o1a h ALA 75 CO 0.31 0.00 0.00 0.09 0.00 0.00 0.00 179.25 179.65 2o1a n ASN 76 N -2.87 2.45 -0.68 0.00 3.02 -1.26 -4.93 115.26 111.00 2o1a n ASN 76 Ca -0.01 -2.03 -0.09 0.00 -0.03 0.00 0.00 54.58 52.43 2o1a n ASN 76 Cb 0.18 -0.31 -0.04 0.00 -0.61 0.00 0.00 39.78 39.00 2o1a n ASN 76 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 2o1a n ASN 77 N 0.79 -4.54 -4.77 6.41 5.03 0.26 -5.02 115.26 113.42 2o1a n ASN 77 Ca 0.15 0.22 -0.38 0.00 0.87 0.00 0.00 54.58 55.44 2o1a n ASN 77 Cb 0.40 -2.82 -0.05 0.00 -1.02 0.00 0.00 39.78 36.29 2o1a n ASN 77 CO 0.00 0.00 0.00 -1.10 -1.83 0.00 0.00 177.26 174.33 2o1a s GLN 78 N -2.52 4.43 0.26 3.52 -0.21 -1.26 -4.79 119.66 119.08 2o1a s GLN 78 Ca 0.00 1.54 -0.30 0.00 0.02 0.00 0.00 55.36 56.63 2o1a s GLN 78 Cb 0.00 -2.82 -0.10 0.00 1.00 0.00 0.00 33.01 31.10 2o1a s GLN 78 CO 0.00 0.09 1.33 -1.21 -2.12 0.00 0.00 175.29 173.38 2o1a s GLU 79 N -2.04 4.37 -0.14 2.91 2.02 -1.26 -1.21 118.70 123.35 2o1a s GLU 79 Ca 0.51 2.14 -0.02 0.00 0.02 0.00 0.00 54.97 57.63 2o1a s GLU 79 Cb -0.24 -3.14 -0.02 0.00 0.10 0.00 0.00 34.13 30.83 2o1a s GLU 79 CO 0.30 -0.24 -0.08 -0.51 0.02 0.00 0.00 175.26 174.76 2o1a s LEU 80 N -0.77 3.04 0.26 1.80 1.43 -0.40 -4.86 118.68 119.18 2o1a s LEU 80 Ca 0.54 -0.19 -0.30 0.00 -1.03 0.00 0.00 54.13 53.15 2o1a s LEU 80 Cb -0.38 -1.71 -0.11 0.00 0.03 0.00 0.00 46.19 44.02 2o1a s LEU 80 CO 0.44 0.19 1.53 0.00 0.23 0.00 0.00 176.35 178.74 2o1a s ALA 81 N 0.23 3.71 0.10 4.21 0.00 -1.26 -4.57 121.76 124.18 2o1a s ALA 81 Ca -0.05 1.46 0.09 0.00 0.00 0.00 0.00 51.96 53.46 2o1a s ALA 81 Cb -0.14 -3.61 -0.04 0.00 0.00 0.00 0.00 23.12 19.33 2o1a s ALA 81 CO 0.04 -0.87 -0.22 0.95 0.00 0.00 0.00 175.76 175.66 2o1a s THR 82 N 0.11 2.56 0.00 0.00 -4.23 -1.26 -0.83 115.64 111.99 2o1a s THR 82 Ca 0.62 -1.52 0.02 0.00 -1.18 0.00 0.00 61.69 59.63 2o1a s THR 82 Cb -0.45 -2.13 -0.01 0.00 1.34 0.00 0.00 72.50 71.25 2o1a s THR 82 CO 0.44 0.17 -0.07 -0.89 -0.54 0.00 0.00 174.62 173.73 2o1a s THR 83 N -1.04 0.57 -0.20 3.99 2.01 -0.56 -4.98 115.64 115.43 2o1a s THR 83 Ca 0.15 -0.43 -0.25 0.00 0.31 0.00 0.00 61.69 61.48 2o1a s THR 83 Cb -0.10 -0.50 -0.01 0.00 0.01 0.00 0.00 72.50 71.89 2o1a s THR 83 CO 0.07 0.07 0.81 -0.69 -0.69 0.00 0.00 174.62 174.19 2o1a s VAL 84 N -0.35 4.88 -0.13 3.82 1.01 -1.26 -0.93 120.40 127.43 2o1a s VAL 84 Ca 0.01 1.56 -0.08 0.00 0.00 0.00 0.00 61.98 63.48 2o1a s VAL 84 Cb -0.04 -4.11 -0.25 0.00 0.00 0.00 0.00 36.38 31.98 2o1a s VAL 84 CO -0.00 -0.00 0.34 0.52 0.00 0.00 0.00 175.10 175.95 2o1a n VAL 85 N 4.92 1.76 -3.67 2.92 0.31 0.74 -4.96 118.33 120.35 2o1a n VAL 85 Ca 0.04 -0.61 -0.14 0.00 -0.01 0.00 0.00 64.34 63.63 2o1a n VAL 85 Cb 0.48 -1.75 -0.08 0.00 -0.91 0.00 0.00 33.84 31.58 2o1a n VAL 85 CO 0.00 0.00 0.00 0.21 -1.32 0.00 0.00 176.83 175.72 2o1a s ASN 86 N -7.02 -0.60 -0.19 4.52 2.47 -1.01 -4.98 114.94 108.13 2o1a s ASN 86 Ca -0.23 1.13 0.00 0.00 0.42 0.00 0.00 52.86 54.18 2o1a s ASN 86 Cb 0.07 1.14 0.02 0.00 -1.45 0.00 0.00 41.25 41.03 2o1a s ASN 86 CO 0.75 -0.23 -0.18 -1.81 -3.72 0.00 0.00 177.10 171.91 2o1a s ASP 87 N 0.19 3.30 -0.51 -4.21 1.01 -1.26 -0.23 116.67 114.95 2o1a s ASP 87 Ca -0.01 -0.64 -0.04 0.00 0.71 0.00 0.00 52.55 52.58 2o1a s ASP 87 Cb -0.04 -1.51 0.13 0.00 1.01 0.00 0.00 42.92 42.51 2o1a s ASP 87 CO 0.01 -0.01 0.33 0.21 0.21 0.00 0.00 175.17 175.93 2o1a s ASN 88 N 1.31 5.32 0.24 0.27 3.84 -0.28 -4.95 114.94 120.69 2o1a s ASN 88 Ca 0.05 -2.39 0.02 0.00 0.21 0.00 0.00 52.86 50.75 2o1a s ASN 88 Cb -0.13 -1.86 0.28 0.00 -0.55 0.00 0.00 41.25 38.98 2o1a s ASN 88 CO -0.12 -0.48 1.61 0.11 -2.79 0.00 0.00 177.10 175.43 2o1a h LYS 89 N 7.64 0.41 -0.54 0.43 1.57 -1.96 0.03 116.57 124.15 2o1a h LYS 89 Ca -0.08 -0.22 -0.01 0.00 -1.87 0.00 0.00 60.65 58.46 2o1a h LYS 89 Cb 1.01 0.01 -0.03 0.00 0.08 0.00 0.00 32.23 33.30 2o1a h LYS 89 CO 0.72 0.79 0.28 -0.22 -0.57 0.00 0.00 179.45 180.45 2o1a h LYS 90 N 0.33 0.77 -0.00 3.15 3.64 -1.95 -2.78 116.57 119.72 2o1a h LYS 90 Ca 0.02 -0.10 0.00 0.00 -1.27 0.00 0.00 60.65 59.30 2o1a h LYS 90 Cb 0.94 -0.15 0.00 0.00 -0.41 0.00 0.00 32.23 32.62 2o1a h LYS 90 CO 0.08 0.61 -0.35 0.00 -2.27 0.00 0.00 179.45 177.52 2o1a n ALA 91 N -2.31 3.23 -3.70 5.00 0.00 -1.14 -4.96 120.51 116.64 2o1a n ALA 91 Ca 0.03 -0.32 -0.22 0.00 0.00 0.00 0.00 53.44 52.93 2o1a n ALA 91 Cb 0.10 -1.18 0.03 0.00 0.00 0.00 0.00 19.45 18.39 2o1a n ALA 91 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 2o1a n ASP 92 N -1.26 -1.30 -4.39 0.00 2.03 -0.11 -4.73 116.55 106.79 2o1a n ASP 92 Ca 0.08 -0.83 -0.20 0.00 0.52 0.00 0.00 54.79 54.36 2o1a n ASP 92 Cb 0.33 -4.03 -0.10 0.00 -0.72 0.00 0.00 41.12 36.60 2o1a n ASP 92 CO 0.00 0.00 0.00 0.42 -1.92 0.00 0.00 177.20 175.70 2o1a s THR 93 N -3.67 1.93 -0.02 5.18 -4.23 -0.58 -0.80 115.64 113.46 2o1a s THR 93 Ca 0.02 -2.26 0.01 0.00 -1.18 0.00 0.00 61.69 58.28 2o1a s THR 93 Cb -0.01 -2.15 0.02 0.00 1.34 0.00 0.00 72.50 71.70 2o1a s THR 93 CO 0.81 -0.52 -0.01 -0.60 -0.54 0.00 0.00 174.62 173.77 2o1a s ARG 94 N -3.61 0.23 -0.17 3.99 3.52 -0.88 -1.12 118.95 120.90 2o1a s ARG 94 Ca 0.25 0.02 -0.06 0.00 -0.13 0.00 0.00 55.73 55.81 2o1a s ARG 94 Cb -0.01 -0.34 -0.04 0.00 -1.56 0.00 0.00 34.95 33.00 2o1a s ARG 94 CO 0.09 -0.06 0.02 -0.08 -0.81 0.00 0.00 175.30 174.46 2o1a s THR 95 N 0.60 4.41 0.15 4.11 -1.32 0.67 0.02 115.64 124.29 2o1a s THR 95 Ca -0.06 -0.17 0.08 0.00 -1.21 0.00 0.00 61.69 60.33 2o1a s THR 95 Cb -0.09 -2.96 -0.04 0.00 -1.51 0.00 0.00 72.50 67.90 2o1a s THR 95 CO -0.01 0.48 -0.18 0.27 -2.21 0.00 0.00 174.62 172.97 2o1a s ILE 96 N 0.34 1.75 -0.12 5.08 -4.36 -0.28 -0.19 121.20 123.42 2o1a s ILE 96 Ca 0.00 -1.87 -0.04 0.00 -0.26 0.00 0.00 60.65 58.49 2o1a s ILE 96 Cb -0.13 -1.78 -0.03 0.00 1.25 0.00 0.00 42.46 41.76 2o1a s ILE 96 CO 0.01 -0.31 0.02 0.20 0.24 0.00 0.00 174.94 175.10 2o1a s ASN 97 N -2.59 5.35 -0.16 4.36 0.01 -0.11 -1.25 114.94 120.54 2o1a s ASN 97 Ca 0.14 0.11 -0.00 0.00 -0.71 0.00 0.00 52.86 52.40 2o1a s ASN 97 Cb -0.06 -1.69 -0.00 0.00 0.41 0.00 0.00 41.25 39.91 2o1a s ASN 97 CO 0.06 0.30 -0.15 -0.69 -1.51 0.00 0.00 177.10 175.11 2o1a s VAL 98 N -0.39 2.67 0.24 1.60 1.01 0.43 -1.50 120.40 124.47 2o1a s VAL 98 Ca 0.08 -0.76 -0.30 0.00 0.00 0.00 0.00 61.98 60.99 2o1a s VAL 98 Cb -0.12 -2.14 -0.10 0.00 0.00 0.00 0.00 36.38 34.02 2o1a s VAL 98 CO 0.02 0.51 1.52 0.00 0.00 0.00 0.00 175.10 177.15 2o1a s ALA 99 N 0.90 3.70 0.29 5.51 0.00 -0.01 -0.55 121.76 131.61 2o1a s ALA 99 Ca -0.03 1.41 0.04 0.00 0.00 0.00 0.00 51.96 53.38 2o1a s ALA 99 Cb -0.15 -3.60 -0.03 0.00 0.00 0.00 0.00 23.12 19.34 2o1a s ALA 99 CO -0.01 -0.82 0.22 0.14 0.00 0.00 0.00 175.76 175.28 2o1a s VAL 100 N 0.28 0.04 0.10 0.00 -7.23 -0.67 -4.69 120.40 108.23 2o1a s VAL 100 Ca 0.63 -2.00 0.05 0.00 -1.81 0.00 0.00 61.98 58.85 2o1a s VAL 100 Cb -0.44 -2.50 -0.03 0.00 0.56 0.00 0.00 36.38 33.97 2o1a s VAL 100 CO 0.42 0.00 -0.14 -1.61 -0.31 0.00 0.00 175.10 173.46 2o1a s GLU 101 N -3.70 0.93 0.36 4.82 2.02 -1.26 -4.17 118.70 117.70 2o1a s GLU 101 Ca 0.39 -1.13 -0.26 0.00 0.02 0.00 0.00 54.97 54.00 2o1a s GLU 101 Cb 0.04 -0.83 -0.12 0.00 0.10 0.00 0.00 34.13 33.32 2o1a s GLU 101 CO 0.22 0.16 1.06 -2.30 0.02 0.00 0.00 175.26 174.42 2o1a n PRO 102 N 0.80 1.49 0.00 0.39 -0.02 -1.26 -1.81 135.00 134.59 2o1a n PRO 102 Ca -0.18 0.53 0.00 0.00 -2.02 0.00 0.00 63.50 61.83 2o1a n PRO 102 Cb 0.56 -2.03 0.00 0.00 -0.02 0.00 0.00 33.50 32.01 2o1a n PRO 102 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2o1a n GLY 103 N 1.12 3.33 3.70 -1.23 0.00 0.45 -4.93 105.19 107.63 2o1a n GLY 103 Ca 0.09 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.67 2o1a n GLY 103 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2o1a n TYR 104 N -1.79 2.52 -0.05 1.61 4.02 -0.75 -4.58 117.16 118.13 2o1a n TYR 104 Ca 0.00 0.25 -0.02 0.00 -0.01 0.00 0.00 57.90 58.12 2o1a n TYR 104 Cb 0.00 -2.57 -0.13 0.00 -0.02 0.00 0.00 39.34 36.62 2o1a n TYR 104 CO 0.00 0.00 0.00 1.17 -1.01 0.00 0.00 176.86 177.02 2o1a n LYS 105 N 2.87 1.09 -3.99 -0.72 3.00 -1.26 -0.63 118.16 118.51 2o1a n LYS 105 Ca 0.13 -0.06 -0.10 0.00 -0.00 0.00 0.00 58.31 58.28 2o1a n LYS 105 Cb 0.33 -1.40 -0.06 0.00 0.00 0.00 0.00 35.03 33.89 2o1a n LYS 105 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.40 175.86 2o1a s SER 106 N -4.58 -0.04 -0.05 3.14 1.04 -1.26 -1.11 113.70 110.84 2o1a s SER 106 Ca -0.07 -0.94 0.04 0.00 0.48 0.00 0.00 55.95 55.46 2o1a s SER 106 Cb 0.07 0.52 0.00 0.00 0.10 0.00 0.00 66.02 66.71 2o1a s SER 106 CO 0.67 -1.03 -0.16 -0.76 0.98 0.00 0.00 173.24 172.94 2o1a s LEU 107 N -3.01 1.85 0.20 2.42 1.43 0.06 -4.28 118.68 117.34 2o1a s LEU 107 Ca 0.22 -0.34 -0.29 0.00 -1.03 0.00 0.00 54.13 52.69 2o1a s LEU 107 Cb 0.01 -0.92 -0.08 0.00 0.03 0.00 0.00 46.19 45.23 2o1a s LEU 107 CO 0.06 0.12 0.92 -0.89 0.23 0.00 0.00 176.35 176.78 2o1a s THR 108 N 0.22 4.22 0.09 5.49 2.01 0.40 0.11 115.64 128.19 2o1a s THR 108 Ca -0.07 2.02 0.07 0.00 0.31 0.00 0.00 61.69 64.02 2o1a s THR 108 Cb -0.13 -4.30 -0.03 0.00 0.01 0.00 0.00 72.50 68.05 2o1a s THR 108 CO 0.03 0.46 -0.19 0.42 -0.69 0.00 0.00 174.62 174.65 2o1a s THR 109 N -0.89 1.52 -0.15 -0.82 -4.23 0.26 -0.58 115.64 110.75 2o1a s THR 109 Ca 0.42 -1.46 -0.01 0.00 -1.18 0.00 0.00 61.69 59.45 2o1a s THR 109 Cb -0.25 -1.40 0.04 0.00 1.34 0.00 0.00 72.50 72.23 2o1a s THR 109 CO 0.31 -0.11 -0.05 -0.54 -0.54 0.00 0.00 174.62 173.69 2o1a s LYS 110 N -1.84 1.33 -0.03 3.99 1.02 -0.05 -2.12 119.74 122.04 2o1a s LYS 110 Ca 0.04 -0.38 0.01 0.00 0.02 0.00 0.00 55.97 55.66 2o1a s LYS 110 Cb -0.10 -1.81 0.01 0.00 -0.52 0.00 0.00 37.83 35.41 2o1a s LYS 110 CO 0.04 -0.39 -0.04 0.08 -0.92 0.00 0.00 175.35 174.11 2o1a s VAL 111 N 1.70 0.47 -0.32 3.17 1.01 -0.37 -0.55 120.40 125.51 2o1a s VAL 111 Ca 0.02 -0.14 -0.05 0.00 0.00 0.00 0.00 61.98 61.80 2o1a s VAL 111 Cb -0.14 -0.47 0.03 0.00 0.00 0.00 0.00 36.38 35.80 2o1a s VAL 111 CO -0.08 0.18 0.07 -2.28 0.00 0.00 0.00 175.10 173.00 2o1a s HIS 112 N 0.57 3.22 -0.21 5.22 2.46 -0.04 -0.15 115.29 126.36 2o1a s HIS 112 Ca -0.07 -1.43 -0.10 0.00 0.47 0.00 0.00 55.06 53.93 2o1a s HIS 112 Cb -0.10 -2.23 -0.05 0.00 -0.13 0.00 0.00 32.58 30.07 2o1a s HIS 112 CO -0.00 -0.72 0.13 0.42 -2.47 0.00 0.00 174.74 172.10 2o1a s ILE 113 N 1.39 5.33 -0.03 0.89 -1.09 -0.00 -0.62 121.20 127.07 2o1a s ILE 113 Ca -0.01 0.16 0.01 0.00 -2.23 0.00 0.00 60.65 58.57 2o1a s ILE 113 Cb -0.19 -3.44 0.02 0.00 -1.58 0.00 0.00 42.46 37.27 2o1a s ILE 113 CO 0.02 0.42 -0.01 -0.69 -1.23 0.00 0.00 174.94 173.45 2o1a s VAL 114 N 0.50 0.24 -0.46 2.92 1.01 -0.14 -0.59 120.40 123.88 2o1a s VAL 114 Ca 0.07 0.03 0.03 0.00 0.00 0.00 0.00 61.98 62.11 2o1a s VAL 114 Cb -0.12 -0.31 0.14 0.00 0.00 0.00 0.00 36.38 36.09 2o1a s VAL 114 CO -0.01 0.15 0.27 -0.69 0.00 0.00 0.00 175.10 174.83 2o1a s VAL 115 N 0.88 1.42 0.46 2.92 1.01 -0.31 -4.49 120.40 122.29 2o1a s VAL 115 Ca -0.09 -2.72 0.13 0.00 0.00 0.00 0.00 61.98 59.30 2o1a s VAL 115 Cb -0.13 -1.99 0.29 0.00 0.00 0.00 0.00 36.38 34.56 2o1a s VAL 115 CO -0.01 -0.94 2.07 -0.65 0.00 0.00 0.00 175.10 175.56 2o1a h PRO 116 N 6.50 0.28 0.00 2.72 0.11 -1.96 -2.15 132.00 137.50 2o1a h PRO 116 Ca 0.03 -0.02 -0.00 0.00 0.11 0.00 0.00 66.00 66.13 2o1a h PRO 116 Cb 0.91 -0.06 -0.00 0.00 0.11 0.00 0.00 31.00 31.96 2o1a h PRO 116 CO 0.49 0.18 -0.01 1.96 -0.21 0.00 0.00 178.00 180.41 2o1a h GLN 117 N 0.28 0.00 -0.22 1.05 1.08 -1.95 -1.19 115.11 114.16 2o1a h GLN 117 Ca 0.14 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.34 2o1a h GLN 117 Cb 0.20 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.63 2o1a h GLN 117 CO -0.03 0.01 0.00 -0.89 -0.95 0.00 0.00 178.83 176.98 2o1a n ILE 118 N -4.02 0.67 -3.63 2.54 5.41 -0.86 -4.97 119.36 114.49 2o1a n ILE 118 Ca -0.03 -0.83 -0.27 0.00 1.00 0.00 0.00 62.75 62.62 2o1a n ILE 118 Cb 0.10 0.74 0.03 0.00 -0.71 0.00 0.00 39.64 39.80 2o1a n ILE 118 CO 0.00 0.00 0.00 -3.20 0.00 0.00 0.00 176.55 173.35 2o1a n ASN 119 N 0.47 -5.16 -4.72 4.38 5.15 -0.45 -4.95 115.26 109.98 2o1a n ASN 119 Ca 0.09 -0.60 -0.37 0.00 -0.60 0.00 0.00 54.58 53.10 2o1a n ASN 119 Cb 0.36 -4.13 -0.06 0.00 -0.53 0.00 0.00 39.78 35.41 2o1a n ASN 119 CO 0.00 0.00 0.00 -0.47 1.40 0.00 0.00 177.26 178.19 2o1a s TYR 120 N -3.22 3.49 -0.26 1.20 5.04 -0.87 -5.00 117.35 117.72 2o1a s TYR 120 Ca 0.56 0.77 -0.01 0.00 -2.44 0.00 0.00 57.07 55.94 2o1a s TYR 120 Cb -0.27 -2.47 0.15 0.00 0.35 0.00 0.00 41.96 39.71 2o1a s TYR 120 CO 0.69 0.19 0.42 1.21 -1.34 0.00 0.00 175.55 176.72 2o1a s ASN 121 N 0.59 -0.05 -0.02 4.32 3.84 -1.26 -1.16 114.94 121.21 2o1a s ASN 121 Ca 0.22 0.24 0.02 0.00 0.21 0.00 0.00 52.86 53.55 2o1a s ASN 121 Cb -0.14 1.31 0.00 0.00 -0.55 0.00 0.00 41.25 41.87 2o1a s ASN 121 CO 0.08 -0.30 -0.07 -2.28 -2.79 0.00 0.00 177.10 171.74 2o1a s HIS 122 N 2.60 0.68 -0.22 0.43 2.46 0.25 -5.01 115.29 116.48 2o1a s HIS 122 Ca 0.14 -0.14 -0.05 0.00 0.47 0.00 0.00 55.06 55.47 2o1a s HIS 122 Cb -0.15 -0.48 -0.02 0.00 -0.13 0.00 0.00 32.58 31.80 2o1a s HIS 122 CO -0.19 -0.06 -0.00 1.03 -2.47 0.00 0.00 174.74 173.05 2o1a s ARG 123 N 0.09 3.54 -0.14 2.88 0.52 -1.26 -0.82 118.95 123.76 2o1a s ARG 123 Ca -0.01 -0.55 -0.09 0.00 -0.52 0.00 0.00 55.73 54.56 2o1a s ARG 123 Cb -0.06 -3.11 -0.04 0.00 0.52 0.00 0.00 34.95 32.26 2o1a s ARG 123 CO -0.00 -0.11 0.17 0.71 0.02 0.00 0.00 175.30 176.10 2o1a s TYR 124 N 1.31 3.54 -0.26 -0.53 2.02 0.78 -4.97 117.35 119.24 2o1a s TYR 124 Ca 0.04 0.52 0.01 0.00 -0.37 0.00 0.00 57.07 57.26 2o1a s TYR 124 Cb -0.15 -2.07 0.07 0.00 -0.40 0.00 0.00 41.96 39.42 2o1a s TYR 124 CO 0.01 0.56 -0.00 0.95 -1.57 0.00 0.00 175.55 175.49 2o1a s THR 125 N -0.50 1.40 0.28 -0.71 -4.23 -1.26 -1.23 115.64 109.38 2o1a s THR 125 Ca 0.14 -1.33 0.03 0.00 -1.18 0.00 0.00 61.69 59.36 2o1a s THR 125 Cb -0.12 -1.81 -0.04 0.00 1.34 0.00 0.00 72.50 71.88 2o1a s THR 125 CO 0.03 -0.28 0.20 0.42 -0.54 0.00 0.00 174.62 174.45 2o1a s THR 126 N 1.42 0.05 -0.10 3.99 -4.23 -0.90 -3.28 115.64 112.60 2o1a s THR 126 Ca -0.00 -2.00 0.01 0.00 -1.18 0.00 0.00 61.69 58.51 2o1a s THR 126 Cb -0.18 -2.50 0.02 0.00 1.34 0.00 0.00 72.50 71.18 2o1a s THR 126 CO -0.10 0.00 -0.10 -1.38 -0.54 0.00 0.00 174.62 172.50 2o1a s HIS 127 N -3.74 1.53 -0.36 3.99 -3.43 -0.53 -0.58 115.29 112.17 2o1a s HIS 127 Ca 0.39 -0.71 -0.23 0.00 -0.80 0.00 0.00 55.06 53.71 2o1a s HIS 127 Cb 0.05 -1.21 0.01 0.00 -1.43 0.00 0.00 32.58 30.00 2o1a s HIS 127 CO 0.20 -0.45 0.77 -1.17 -2.00 0.00 0.00 174.74 172.09 2o1a s LEU 128 N 1.34 4.14 -0.31 5.38 0.20 0.12 -0.20 118.68 129.35 2o1a s LEU 128 Ca -0.02 0.37 -0.10 0.00 0.69 0.00 0.00 54.13 55.07 2o1a s LEU 128 Cb -0.14 -3.00 -0.02 0.00 -0.43 0.00 0.00 46.19 42.60 2o1a s LEU 128 CO -0.04 -0.70 0.17 -1.61 -0.29 0.00 0.00 176.35 173.88 2o1a s GLU 129 N 3.03 3.52 0.40 1.98 0.41 -0.28 -0.76 118.70 127.01 2o1a s GLU 129 Ca 0.31 -0.60 -0.24 0.00 -0.41 0.00 0.00 54.97 54.02 2o1a s GLU 129 Cb -0.13 -3.62 -0.09 0.00 -1.78 0.00 0.00 34.13 28.51 2o1a s GLU 129 CO 0.16 -0.35 1.09 -0.06 -0.49 0.00 0.00 175.26 175.61 2o1a s PHE 130 N 1.67 3.18 0.31 1.61 0.08 -0.26 -1.23 117.98 123.34 2o1a s PHE 130 Ca 0.06 1.61 0.04 0.00 0.12 0.00 0.00 56.93 58.76 2o1a s PHE 130 Cb -0.17 -3.22 0.51 0.00 -0.57 0.00 0.00 43.02 39.58 2o1a s PHE 130 CO 0.08 -0.88 1.79 1.49 -0.10 0.00 0.00 175.22 177.61 2o1a h GLU 131 N 2.50 0.47 -4.67 0.44 4.81 -1.26 -3.42 114.58 113.44 2o1a h GLU 131 Ca -0.48 -0.14 -0.24 0.00 -0.13 0.00 0.00 59.36 58.37 2o1a h GLU 131 Cb 1.22 -0.05 -0.16 0.00 0.63 0.00 0.00 28.75 30.40 2o1a h GLU 131 CO 0.62 0.62 -0.70 -1.59 -0.73 0.00 0.00 179.01 177.23 2o1a s LYS 132 N -4.69 0.81 0.60 1.92 -2.85 -1.26 -5.08 119.74 109.19 2o1a s LYS 132 Ca -0.07 -1.28 -0.19 0.00 -1.00 0.00 0.00 55.97 53.44 2o1a s LYS 132 Cb 0.15 -0.24 -0.04 0.00 -2.06 0.00 0.00 37.83 35.63 2o1a s LYS 132 CO 0.78 -0.00 1.01 0.00 0.10 0.00 0.00 175.35 177.24 2o1a n ALA 133 N 0.12 0.33 -1.67 0.59 0.00 -1.26 -4.86 120.51 113.75 2o1a n ALA 133 Ca -0.13 0.01 -0.49 0.00 0.00 0.00 0.00 53.44 52.83 2o1a n ALA 133 Cb 0.60 -2.14 -0.05 0.00 0.00 0.00 0.00 19.45 17.86 2o1a n ALA 133 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 2o1a n ILE 134 N -1.70 0.31 -1.97 0.00 2.08 0.19 -4.77 119.36 113.50 2o1a n ILE 134 Ca 0.14 -0.06 -0.31 0.00 0.56 0.00 0.00 62.75 63.08 2o1a n ILE 134 Cb 0.47 -1.56 0.01 0.00 -0.75 0.00 0.00 39.64 37.80 2o1a n ILE 134 CO 0.00 0.00 0.00 -2.16 0.56 0.00 0.00 176.55 174.95 2o1a s PRO 135 N 2.70 3.55 0.15 0.38 0.04 -1.26 -0.41 135.00 140.14 2o1a s PRO 135 Ca 0.89 0.88 -0.30 0.00 0.04 0.00 0.00 61.00 62.51 2o1a s PRO 135 Cb -0.78 -2.07 -0.07 0.00 0.04 0.00 0.00 34.50 31.62 2o1a s PRO 135 CO 0.49 -0.61 0.99 0.95 0.04 0.00 0.00 177.00 178.86 2o1a s THR 136 N -2.94 4.29 0.12 1.26 -4.23 -1.26 -4.60 115.64 108.27 2o1a s THR 136 Ca 0.57 1.97 0.09 0.00 -1.18 0.00 0.00 61.69 63.15 2o1a s THR 136 Cb -0.12 -4.26 -0.04 0.00 1.34 0.00 0.00 72.50 69.42 2o1a s THR 136 CO 0.47 0.34 -0.21 -0.76 -0.54 0.00 0.00 174.62 173.92 2o1a s LEU 137 N -0.28 2.57 0.00 4.79 1.43 -1.26 -5.16 118.68 120.77 2o1a s LEU 137 Ca 0.46 -0.61 0.31 0.00 -1.03 0.00 0.00 54.13 53.26 2o1a s LEU 137 Cb -0.25 -1.44 1.69 0.00 0.03 0.00 0.00 46.19 46.21 2o1a s LEU 137 CO 0.31 0.18 2.10 0.00 0.23 0.00 0.00 176.35 179.18