#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1a7t s VAL 5 N 0.00 0.46 -0.76 0.44 1.01 0.48 -4.94 120.40 117.10 1a7t s VAL 5 Ca 0.00 -0.17 -0.27 0.00 0.00 0.00 0.00 61.98 61.54 1a7t s VAL 5 Cb 0.00 -0.76 0.03 0.00 0.00 0.00 0.00 36.38 35.66 1a7t s VAL 5 CO 0.00 0.07 1.28 -0.54 0.00 0.00 0.00 175.10 175.91 1a7t s LYS 6 N 1.92 3.21 0.33 2.72 1.02 -1.26 -0.92 119.74 126.76 1a7t s LYS 6 Ca 0.03 -0.32 0.16 0.00 0.02 0.00 0.00 55.97 55.85 1a7t s LYS 6 Cb -0.14 -4.26 0.54 0.00 -0.52 0.00 0.00 37.83 33.45 1a7t s LYS 6 CO -0.07 -2.14 1.68 -0.84 -0.92 0.00 0.00 175.35 173.06 1a7t h ILE 7 N 6.08 1.08 -1.72 2.17 3.07 -1.59 -3.47 117.51 123.12 1a7t h ILE 7 Ca -0.25 -1.77 0.00 0.00 1.55 0.00 0.00 64.86 64.39 1a7t h ILE 7 Cb 1.05 2.03 0.00 0.00 -0.27 0.00 0.00 36.82 39.63 1a7t h ILE 7 CO 1.29 0.46 0.00 -1.54 -1.05 0.00 0.00 178.15 177.31 1a7t n SER 8 N -3.61 0.00 -0.09 2.16 3.41 -0.90 -4.98 113.62 109.60 1a7t n SER 8 Ca -0.00 -0.72 -0.07 0.00 -0.26 0.00 0.00 58.87 57.81 1a7t n SER 8 Cb 0.56 0.00 0.10 0.00 -0.26 0.00 0.00 64.21 64.61 1a7t n SER 8 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 1a7t h ASP 9 N 0.00 0.79 -0.16 4.04 5.19 -2.03 -3.24 116.42 121.01 1a7t h ASP 9 Ca 0.00 -0.27 0.00 0.00 -0.62 0.00 0.00 57.03 56.14 1a7t h ASP 9 Cb 0.00 -0.21 0.00 0.00 0.18 0.00 0.00 39.33 39.30 1a7t h ASP 9 CO 0.00 0.96 0.00 0.47 -3.12 0.00 0.00 179.24 177.55 1a7t n ASP 10 N -4.13 2.54 -3.90 6.45 8.00 -1.26 -4.98 116.55 119.27 1a7t n ASP 10 Ca 0.01 -1.74 -0.18 0.00 0.71 0.00 0.00 54.79 53.58 1a7t n ASP 10 Cb 0.41 -0.10 -0.16 0.00 -0.02 0.00 0.00 41.12 41.25 1a7t n ASP 10 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1a7t s ILE 11 N -1.15 0.46 0.12 0.53 1.01 -1.23 -0.48 121.20 120.46 1a7t s ILE 11 Ca 0.21 -0.12 0.04 0.00 0.00 0.00 0.00 60.65 60.78 1a7t s ILE 11 Cb 0.13 -0.47 -0.04 0.00 0.01 0.00 0.00 42.46 42.09 1a7t s ILE 11 CO 0.19 0.19 -0.10 -0.94 0.00 0.00 0.00 174.94 174.28 1a7t s SER 12 N 0.64 1.57 0.00 3.58 1.04 -0.95 -1.43 113.70 118.15 1a7t s SER 12 Ca -0.08 -0.92 0.03 0.00 0.48 0.00 0.00 55.95 55.46 1a7t s SER 12 Cb -0.11 0.01 -0.01 0.00 0.10 0.00 0.00 66.02 66.01 1a7t s SER 12 CO -0.00 -0.31 -0.10 -0.63 0.98 0.00 0.00 173.24 173.18 1a7t s ILE 13 N -2.93 0.77 -0.06 -1.02 -1.09 -0.10 -1.05 121.20 115.72 1a7t s ILE 13 Ca 0.11 -0.54 0.03 0.00 -2.23 0.00 0.00 60.65 58.01 1a7t s ILE 13 Cb 0.00 -0.67 0.01 0.00 -1.58 0.00 0.00 42.46 40.22 1a7t s ILE 13 CO -0.00 0.13 -0.15 -0.89 -1.23 0.00 0.00 174.94 172.79 1a7t s THR 14 N -0.41 1.34 -0.08 2.92 2.01 0.10 -0.39 115.64 121.14 1a7t s THR 14 Ca 0.02 -0.62 -0.25 0.00 0.31 0.00 0.00 61.69 61.15 1a7t s THR 14 Cb -0.05 -1.19 -0.03 0.00 0.01 0.00 0.00 72.50 71.24 1a7t s THR 14 CO -0.00 0.40 0.76 -1.58 -0.69 0.00 0.00 174.62 173.51 1a7t s GLN 15 N 0.44 4.42 -0.17 4.92 0.74 -1.26 0.28 119.66 129.03 1a7t s GLN 15 Ca -0.12 0.98 0.13 0.00 0.05 0.00 0.00 55.36 56.40 1a7t s GLN 15 Cb -0.15 -3.48 -0.24 0.00 1.10 0.00 0.00 33.01 30.25 1a7t s GLN 15 CO 0.04 -0.04 0.16 1.28 -0.55 0.00 0.00 175.29 176.19 1a7t n LEU 16 N 4.11 0.74 -4.01 3.68 4.77 0.84 -4.94 117.00 122.19 1a7t n LEU 16 Ca 0.01 0.07 -0.12 0.00 -0.03 0.00 0.00 56.01 55.94 1a7t n LEU 16 Cb 0.51 0.15 -0.03 0.00 -2.33 0.00 0.00 43.42 41.72 1a7t n LEU 16 CO 0.48 0.56 0.23 -0.94 -1.33 0.00 0.00 177.39 176.39 1a7t s SER 17 N -5.84 0.47 0.49 -1.43 1.04 -1.08 -4.98 113.70 102.37 1a7t s SER 17 Ca -0.13 -1.27 0.24 0.00 0.48 0.00 0.00 55.95 55.27 1a7t s SER 17 Cb 0.07 0.68 1.29 0.00 0.10 0.00 0.00 66.02 68.16 1a7t s SER 17 CO 0.79 -1.34 2.03 -2.24 0.98 0.00 0.00 173.24 173.46 1a7t h ASP 18 N 2.13 0.00 -0.06 7.02 2.03 -2.00 -3.06 116.42 122.47 1a7t h ASP 18 Ca -0.28 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.02 1a7t h ASP 18 Cb 1.24 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.74 1a7t h ASP 18 CO 0.38 0.16 0.00 0.29 -1.03 0.00 0.00 179.24 179.04 1a7t n LYS 19 N -3.77 0.73 -4.69 4.15 5.02 -1.26 -4.96 118.16 113.38 1a7t n LYS 19 Ca -0.02 -1.21 -0.26 0.00 -2.02 0.00 0.00 58.31 54.80 1a7t n LYS 19 Cb 0.26 -1.19 -0.17 0.00 -0.02 0.00 0.00 35.03 33.92 1a7t n LYS 19 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1a7t s VAL 20 N -0.82 1.28 0.09 -0.18 1.01 -1.16 -0.57 120.40 120.05 1a7t s VAL 20 Ca 0.12 -0.57 0.06 0.00 0.00 0.00 0.00 61.98 61.60 1a7t s VAL 20 Cb 0.08 -1.15 -0.03 0.00 0.00 0.00 0.00 36.38 35.28 1a7t s VAL 20 CO 0.12 0.39 -0.16 -0.31 0.00 0.00 0.00 175.10 175.14 1a7t s TYR 21 N 0.56 1.42 -0.02 5.22 1.51 0.13 -0.11 117.35 126.06 1a7t s TYR 21 Ca -0.14 -0.47 0.08 0.00 -1.01 0.00 0.00 57.07 55.53 1a7t s TYR 21 Cb -0.16 -0.78 -0.02 0.00 -0.11 0.00 0.00 41.96 40.89 1a7t s TYR 21 CO 0.04 0.12 -0.26 -0.08 -1.11 0.00 0.00 175.55 174.27 1a7t s THR 22 N -1.44 2.04 0.25 -0.71 -1.32 0.14 -1.10 115.64 113.51 1a7t s THR 22 Ca 0.03 -1.10 0.10 0.00 -1.21 0.00 0.00 61.69 59.51 1a7t s THR 22 Cb -0.09 -1.70 -0.05 0.00 -1.51 0.00 0.00 72.50 69.16 1a7t s THR 22 CO 0.03 0.58 -0.10 -0.72 -2.21 0.00 0.00 174.62 172.20 1a7t s TYR 23 N -0.57 2.53 -0.12 9.09 1.13 -0.59 0.01 117.35 128.83 1a7t s TYR 23 Ca 0.09 -0.27 0.02 0.00 -1.41 0.00 0.00 57.07 55.51 1a7t s TYR 23 Cb -0.10 -1.14 0.01 0.00 -1.10 0.00 0.00 41.96 39.63 1a7t s TYR 23 CO -0.01 0.63 -0.20 0.08 -2.51 0.00 0.00 175.55 173.55 1a7t s VAL 24 N -2.25 1.85 -0.08 -3.49 1.01 -0.22 -2.04 120.40 115.17 1a7t s VAL 24 Ca 0.29 -0.86 0.04 0.00 0.00 0.00 0.00 61.98 61.46 1a7t s VAL 24 Cb -0.06 -1.65 -0.01 0.00 0.00 0.00 0.00 36.38 34.66 1a7t s VAL 24 CO 0.17 0.51 -0.23 -0.94 0.00 0.00 0.00 175.10 174.61 1a7t s SER 25 N 0.83 3.24 -0.12 3.32 1.04 0.15 -2.24 113.70 119.92 1a7t s SER 25 Ca -0.08 -0.49 -0.05 0.00 0.48 0.00 0.00 55.95 55.81 1a7t s SER 25 Cb -0.16 -1.17 -0.04 0.00 0.10 0.00 0.00 66.02 64.76 1a7t s SER 25 CO -0.01 0.21 0.05 -0.76 0.98 0.00 0.00 173.24 173.70 1a7t s LEU 26 N 0.08 3.80 -0.16 2.42 1.43 0.36 -0.00 118.68 126.61 1a7t s LEU 26 Ca -0.10 0.18 -0.14 0.00 -1.03 0.00 0.00 54.13 53.04 1a7t s LEU 26 Cb -0.16 -1.91 0.04 0.00 0.03 0.00 0.00 46.19 44.20 1a7t s LEU 26 CO 0.06 0.32 0.43 0.00 0.23 0.00 0.00 176.35 177.39 1a7t s ALA 27 N -0.51 -1.06 -0.26 4.21 0.00 -0.95 -4.86 121.76 118.33 1a7t s ALA 27 Ca 0.10 1.25 -0.24 0.00 0.00 0.00 0.00 51.96 53.07 1a7t s ALA 27 Cb -0.12 -0.73 -0.01 0.00 0.00 0.00 0.00 23.12 22.26 1a7t s ALA 27 CO 0.02 -0.21 0.80 -2.00 0.00 0.00 0.00 175.76 174.37 1a7t s GLU 28 N 0.38 4.13 -0.17 0.00 2.12 -1.26 -0.43 118.70 123.46 1a7t s GLU 28 Ca -0.01 0.82 0.01 0.00 0.36 0.00 0.00 54.97 56.15 1a7t s GLU 28 Cb -0.04 -3.66 0.02 0.00 0.26 0.00 0.00 34.13 30.71 1a7t s GLU 28 CO -0.01 -0.54 -0.20 0.42 -0.54 0.00 0.00 175.26 174.39 1a7t s ILE 29 N 2.83 2.07 0.21 -3.70 1.01 0.41 -4.98 121.20 119.05 1a7t s ILE 29 Ca 0.33 -0.94 -0.32 0.00 0.00 0.00 0.00 60.65 59.71 1a7t s ILE 29 Cb -0.15 -1.86 -0.14 0.00 0.01 0.00 0.00 42.46 40.33 1a7t s ILE 29 CO 0.09 0.54 1.48 1.21 0.00 0.00 0.00 174.94 178.26 1a7t n GLU 30 N 4.51 2.09 0.00 2.79 4.07 -1.26 -0.95 120.64 131.90 1a7t n GLU 30 Ca -0.21 0.75 0.00 0.00 -0.06 0.00 0.00 57.16 57.64 1a7t n GLU 30 Cb 0.50 -2.46 0.00 0.00 -0.06 0.00 0.00 31.44 29.42 1a7t n GLU 30 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1a7t n GLY 31 N 2.69 2.88 0.00 8.31 0.00 -1.26 -4.77 105.19 113.04 1a7t n GLY 31 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.16 1a7t n GLY 31 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1a7t n TRP 32 N -2.00 0.00 0.00 1.61 7.02 -0.70 -5.15 117.44 118.22 1a7t n TRP 32 Ca 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.48 1a7t n TRP 32 Cb 0.00 0.00 0.00 0.00 -2.42 0.00 0.00 31.31 28.89 1a7t n TRP 32 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 1a7t n GLY 33 N 2.65 -0.40 3.54 6.99 0.00 -0.12 -4.83 105.19 113.01 1a7t n GLY 33 Ca 0.00 -1.87 -0.42 0.00 0.00 0.00 0.00 46.02 43.73 1a7t n GLY 33 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1a7t s MET 34 N 0.00 3.38 -0.17 1.61 -2.45 -1.26 -0.44 119.30 119.97 1a7t s MET 34 Ca 0.00 -0.10 -0.04 0.00 -1.25 0.00 0.00 55.69 54.30 1a7t s MET 34 Cb 0.00 -4.06 -0.03 0.00 1.25 0.00 0.00 34.83 31.99 1a7t s MET 34 CO 0.00 -1.63 -0.02 0.08 1.05 0.00 0.00 175.02 174.50 1a7t s VAL 35 N 4.48 4.04 -0.16 10.11 1.01 0.42 -4.92 120.40 135.39 1a7t s VAL 35 Ca 0.35 -0.30 -0.22 0.00 0.00 0.00 0.00 61.98 61.81 1a7t s VAL 35 Cb -0.10 -2.79 -0.03 0.00 0.00 0.00 0.00 36.38 33.46 1a7t s VAL 35 CO 0.21 0.48 0.66 -2.16 0.00 0.00 0.00 175.10 174.28 1a7t s PRO 36 N 0.47 4.28 -0.08 2.72 0.04 -1.26 -2.24 135.00 138.94 1a7t s PRO 36 Ca -0.02 0.71 0.04 0.00 0.04 0.00 0.00 61.00 61.76 1a7t s PRO 36 Cb -0.14 -3.54 -0.02 0.00 0.04 0.00 0.00 34.50 30.85 1a7t s PRO 36 CO 0.02 -0.15 -0.18 -1.12 0.04 0.00 0.00 177.00 175.61 1a7t s SER 37 N 1.05 3.63 0.11 6.66 0.01 0.10 -4.31 113.70 120.96 1a7t s SER 37 Ca 0.32 -0.36 0.05 0.00 1.31 0.00 0.00 55.95 57.26 1a7t s SER 37 Cb -0.16 -1.08 -0.04 0.00 0.21 0.00 0.00 66.02 64.95 1a7t s SER 37 CO 0.12 0.25 0.01 0.20 0.41 0.00 0.00 173.24 174.24 1a7t s ASN 38 N -0.18 5.04 0.06 2.44 0.01 -0.33 0.32 114.94 122.30 1a7t s ASN 38 Ca -0.02 -0.21 -0.00 0.00 -0.71 0.00 0.00 52.86 51.92 1a7t s ASN 38 Cb -0.14 -1.19 0.00 0.00 0.41 0.00 0.00 41.25 40.33 1a7t s ASN 38 CO 0.03 0.15 0.08 0.61 -1.51 0.00 0.00 177.10 176.46 1a7t n GLY 39 N 0.35 3.05 3.18 0.66 0.00 -0.87 -4.86 105.19 106.70 1a7t n GLY 39 Ca -0.10 -1.44 -0.13 0.00 0.00 0.00 0.00 46.02 44.34 1a7t n GLY 39 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1a7t s MET 40 N -2.14 0.87 -0.15 1.61 1.00 -0.51 -1.54 119.30 118.44 1a7t s MET 40 Ca 0.05 -1.23 0.00 0.00 0.00 0.00 0.00 55.69 54.51 1a7t s MET 40 Cb -0.00 -0.45 0.03 0.00 0.00 0.00 0.00 34.83 34.40 1a7t s MET 40 CO 0.04 0.05 -0.12 0.42 0.00 0.00 0.00 175.02 175.41 1a7t s ILE 41 N -2.84 1.42 -0.09 2.53 1.01 -0.26 -0.41 121.20 122.57 1a7t s ILE 41 Ca 0.08 -0.58 0.04 0.00 0.00 0.00 0.00 60.65 60.19 1a7t s ILE 41 Cb -0.00 -1.39 -0.01 0.00 0.01 0.00 0.00 42.46 41.08 1a7t s ILE 41 CO -0.01 0.39 -0.22 -0.69 0.00 0.00 0.00 174.94 174.41 1a7t s VAL 42 N 1.54 2.26 -0.03 2.92 1.01 -0.36 -0.70 120.40 127.05 1a7t s VAL 42 Ca 0.04 -0.96 0.04 0.00 0.00 0.00 0.00 61.98 61.10 1a7t s VAL 42 Cb -0.13 -1.87 -0.00 0.00 0.00 0.00 0.00 36.38 34.38 1a7t s VAL 42 CO -0.10 0.56 -0.14 -0.63 0.00 0.00 0.00 175.10 174.79 1a7t s ILE 43 N 0.13 1.19 -0.17 2.22 1.01 0.27 0.11 121.20 125.95 1a7t s ILE 43 Ca -0.11 -0.61 -0.07 0.00 0.00 0.00 0.00 60.65 59.86 1a7t s ILE 43 Cb -0.16 -1.02 0.07 0.00 0.01 0.00 0.00 42.46 41.37 1a7t s ILE 43 CO 0.06 0.35 0.37 0.21 0.00 0.00 0.00 174.94 175.93 1a7t s ASN 44 N -0.07 -0.17 -1.39 3.58 3.04 0.42 -4.69 114.94 115.66 1a7t s ASN 44 Ca -0.00 0.84 -0.01 0.00 0.04 0.00 0.00 52.86 53.73 1a7t s ASN 44 Cb -0.09 0.98 -0.00 0.00 -1.54 0.00 0.00 41.25 40.60 1a7t s ASN 44 CO 0.01 -0.22 0.44 -3.20 -3.04 0.00 0.00 177.10 171.09 1a7t n ASN 45 N 5.02 -0.50 -0.23 -4.21 5.15 -1.26 -1.03 115.26 118.20 1a7t n ASN 45 Ca -0.13 -1.00 -0.03 0.00 -0.60 0.00 0.00 54.58 52.82 1a7t n ASN 45 Cb 0.51 -3.11 -0.01 0.00 -0.53 0.00 0.00 39.78 36.64 1a7t n ASN 45 CO 0.00 0.00 0.00 1.41 1.40 0.00 0.00 177.26 180.07 1a7t n HIS 46 N -4.39 0.00 -4.71 1.20 8.25 -1.26 -5.00 115.22 109.31 1a7t n HIS 46 Ca -0.30 0.00 -0.30 0.00 -0.26 0.00 0.00 57.72 56.85 1a7t n HIS 46 Cb 0.68 -1.34 -0.13 0.00 1.12 0.00 0.00 29.99 30.32 1a7t n HIS 46 CO 0.00 0.00 0.00 -0.65 0.64 0.00 0.00 176.34 176.33 1a7t s GLN 47 N -1.57 1.94 0.10 -0.41 -0.21 -0.19 -1.42 119.66 117.90 1a7t s GLN 47 Ca 0.00 -1.05 0.06 0.00 0.02 0.00 0.00 55.36 54.39 1a7t s GLN 47 Cb 0.00 -2.10 -0.03 0.00 1.00 0.00 0.00 33.01 31.87 1a7t s GLN 47 CO 0.00 0.52 -0.15 0.00 -2.12 0.00 0.00 175.29 173.55 1a7t s ALA 48 N -0.90 1.43 -0.03 6.09 0.00 0.08 -0.44 121.76 127.98 1a7t s ALA 48 Ca 0.14 -1.20 0.07 0.00 0.00 0.00 0.00 51.96 50.97 1a7t s ALA 48 Cb -0.10 -0.10 -0.02 0.00 0.00 0.00 0.00 23.12 22.90 1a7t s ALA 48 CO 0.04 0.15 -0.25 0.00 0.00 0.00 0.00 175.76 175.70 1a7t s ALA 49 N -1.77 2.10 -0.19 0.00 0.00 0.12 -1.67 121.76 120.35 1a7t s ALA 49 Ca 0.05 -1.07 -0.07 0.00 0.00 0.00 0.00 51.96 50.88 1a7t s ALA 49 Cb -0.07 -0.57 -0.04 0.00 0.00 0.00 0.00 23.12 22.44 1a7t s ALA 49 CO 0.03 0.48 0.05 -1.17 0.00 0.00 0.00 175.76 175.15 1a7t s LEU 50 N -0.45 3.64 -0.36 0.00 2.96 -0.39 -1.22 118.68 122.86 1a7t s LEU 50 Ca 0.06 -0.01 -0.09 0.00 -0.22 0.00 0.00 54.13 53.87 1a7t s LEU 50 Cb -0.11 -1.92 0.04 0.00 0.50 0.00 0.00 46.19 44.70 1a7t s LEU 50 CO 0.00 0.13 0.16 -0.76 -1.32 0.00 0.00 176.35 174.57 1a7t s LEU 51 N 0.61 4.58 0.17 -0.68 1.43 0.45 -2.20 118.68 123.04 1a7t s LEU 51 Ca 0.02 -1.13 0.00 0.00 -1.03 0.00 0.00 54.13 51.99 1a7t s LEU 51 Cb -0.13 -1.94 0.00 0.00 0.03 0.00 0.00 46.19 44.14 1a7t s LEU 51 CO 0.02 -0.38 0.00 0.47 0.23 0.00 0.00 176.35 176.69 1a7t n ASP 52 N 4.90 -2.63 -4.75 2.29 9.92 -0.63 -1.42 116.55 124.23 1a7t n ASP 52 Ca -0.12 0.51 -0.22 0.00 -0.53 0.00 0.00 54.79 54.43 1a7t n ASP 52 Cb 0.45 -0.76 -0.06 0.00 -0.64 0.00 0.00 41.12 40.11 1a7t n ASP 52 CO 0.00 0.00 0.00 0.42 0.13 0.00 0.00 177.20 177.75 1a7t s THR 53 N -4.00 3.61 1.38 -3.53 -4.23 -0.41 -4.69 115.64 103.76 1a7t s THR 53 Ca 0.00 -1.64 -0.20 0.00 -1.18 0.00 0.00 61.69 58.67 1a7t s THR 53 Cb 0.00 -3.08 0.35 0.00 1.34 0.00 0.00 72.50 71.12 1a7t s THR 53 CO 0.00 -0.29 0.93 -2.65 -0.54 0.00 0.00 174.62 172.07 1a7t n PRO 54 N -1.11 -4.02 0.30 3.99 -0.02 -1.26 -3.94 135.00 128.94 1a7t n PRO 54 Ca -0.05 -1.18 0.19 0.00 -2.02 0.00 0.00 63.50 60.44 1a7t n PRO 54 Cb 0.59 -2.02 0.94 0.00 -0.02 0.00 0.00 33.50 33.00 1a7t n PRO 54 CO 0.00 0.00 0.00 0.97 1.98 0.00 0.00 175.50 178.45 1a7t h ILE 55 N -3.31 0.13 -4.02 4.25 2.10 -1.88 -3.13 117.51 111.65 1a7t h ILE 55 Ca -0.50 -0.27 -0.17 0.00 1.08 0.00 0.00 64.86 65.00 1a7t h ILE 55 Cb 1.34 1.23 -0.10 0.00 -1.09 0.00 0.00 36.82 38.21 1a7t h ILE 55 CO 0.35 0.02 -0.26 0.54 -1.08 0.00 0.00 178.15 177.72 1a7t s ASN 56 N -5.56 0.27 0.30 2.19 2.20 -1.26 -4.33 114.94 108.75 1a7t s ASN 56 Ca -0.03 -1.21 0.00 0.00 -0.94 0.00 0.00 52.86 50.69 1a7t s ASN 56 Cb 0.12 0.56 0.48 0.00 -2.00 0.00 0.00 41.25 40.41 1a7t s ASN 56 CO 0.49 -1.11 1.88 0.44 -2.94 0.00 0.00 177.10 175.86 1a7t h ASP 57 N 2.30 0.73 0.12 3.54 3.32 -1.86 -2.24 116.42 122.32 1a7t h ASP 57 Ca -0.29 -0.10 0.00 0.00 0.02 0.00 0.00 57.03 56.66 1a7t h ASP 57 Cb 1.25 -0.19 -0.01 0.00 0.22 0.00 0.00 39.33 40.60 1a7t h ASP 57 CO 0.41 0.68 -0.09 0.00 -1.72 0.00 0.00 179.24 178.51 1a7t h ALA 58 N 1.43 -0.20 -0.15 3.45 0.00 -1.96 0.18 119.26 122.02 1a7t h ALA 58 Ca 0.18 -0.03 -0.08 0.00 0.00 0.00 0.00 54.91 54.98 1a7t h ALA 58 Cb 0.19 0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 1a7t h ALA 58 CO -0.01 -0.62 -0.28 1.96 0.00 0.00 0.00 179.25 180.30 1a7t h GLN 59 N -0.22 0.27 -0.22 0.00 4.20 -1.96 -1.98 115.11 115.20 1a7t h GLN 59 Ca -0.00 -0.10 -0.03 0.00 0.06 0.00 0.00 58.65 58.58 1a7t h GLN 59 Cb 0.20 -0.02 -0.01 0.00 0.30 0.00 0.00 27.48 27.95 1a7t h GLN 59 CO -0.01 0.53 0.03 1.15 -0.67 0.00 0.00 178.83 179.86 1a7t h THR 60 N 0.24 1.24 -0.92 -0.54 2.02 -1.03 -1.29 112.91 112.62 1a7t h THR 60 Ca 0.04 -0.79 0.01 0.00 0.77 0.00 0.00 66.41 66.44 1a7t h THR 60 Cb 0.62 1.33 -0.05 0.00 -1.74 0.00 0.00 68.15 68.31 1a7t h THR 60 CO 0.04 0.25 0.61 -0.08 0.37 0.00 0.00 175.52 176.71 1a7t h GLU 61 N 0.16 1.19 -0.44 6.66 4.81 -0.57 0.59 114.58 126.98 1a7t h GLU 61 Ca 0.07 -0.07 -0.11 0.00 -0.13 0.00 0.00 59.36 59.12 1a7t h GLU 61 Cb 0.35 -0.27 -0.02 0.00 0.63 0.00 0.00 28.75 29.44 1a7t h GLU 61 CO 0.01 0.79 -0.16 1.98 -0.73 0.00 0.00 179.01 180.90 1a7t h MET 62 N 1.23 0.84 -0.32 1.92 4.05 -1.04 -1.19 114.93 120.42 1a7t h MET 62 Ca 0.34 -0.31 -0.11 0.00 -0.28 0.00 0.00 59.70 59.34 1a7t h MET 62 Cb -0.11 -0.05 -0.01 0.00 -0.80 0.00 0.00 31.60 30.63 1a7t h MET 62 CO -0.08 0.94 -0.22 1.25 0.23 0.00 0.00 176.91 179.04 1a7t h LEU 63 N 0.75 0.74 -0.76 3.39 5.85 -0.71 -2.52 115.31 122.05 1a7t h LEU 63 Ca 0.11 -0.43 -0.09 0.00 0.84 0.00 0.00 57.88 58.31 1a7t h LEU 63 Cb 0.68 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 41.48 1a7t h LEU 63 CO 0.05 1.02 -0.03 0.58 -0.34 0.00 0.00 178.44 179.72 1a7t h VAL 64 N 0.47 1.26 -0.35 1.05 2.07 -0.78 -1.95 116.25 118.03 1a7t h VAL 64 Ca 0.06 -1.12 -0.05 0.00 0.82 0.00 0.00 66.70 66.41 1a7t h VAL 64 Cb 0.77 0.88 -0.02 0.00 -1.52 0.00 0.00 31.29 31.40 1a7t h VAL 64 CO 0.06 0.40 -0.01 0.78 0.02 0.00 0.00 177.57 178.82 1a7t h ASN 65 N 0.84 0.51 0.02 0.57 2.35 -1.14 -2.10 115.58 116.64 1a7t h ASN 65 Ca 0.15 -0.10 -0.17 0.00 -0.55 0.00 0.00 56.30 55.63 1a7t h ASN 65 Cb 0.54 -0.13 -0.00 0.00 0.05 0.00 0.00 38.32 38.77 1a7t h ASN 65 CO 0.03 0.59 -0.61 -0.25 -1.65 0.00 0.00 177.43 175.54 1a7t h TRP 66 N 0.52 0.75 -0.36 1.19 7.01 -1.02 -1.69 115.95 122.36 1a7t h TRP 66 Ca 0.11 -0.29 -0.05 0.00 2.11 0.00 0.00 58.89 60.77 1a7t h TRP 66 Cb 0.35 -0.13 -0.01 0.00 -2.10 0.00 0.00 29.16 27.26 1a7t h TRP 66 CO 0.01 1.04 0.02 0.28 -2.79 0.00 0.00 178.44 177.01 1a7t h VAL 67 N 0.43 1.25 0.99 2.65 2.07 -0.99 0.33 116.25 122.99 1a7t h VAL 67 Ca -0.01 -0.93 -0.05 0.00 0.82 0.00 0.00 66.70 66.54 1a7t h VAL 67 Cb 1.18 1.15 0.01 0.00 -1.52 0.00 0.00 31.29 32.11 1a7t h VAL 67 CO 0.12 0.31 -0.48 0.74 0.02 0.00 0.00 177.57 178.27 1a7t h THR 68 N 0.44 0.00 -0.49 2.57 2.02 -1.30 0.13 112.91 116.28 1a7t h THR 68 Ca 0.10 0.00 -0.12 0.00 0.77 0.00 0.00 66.41 67.16 1a7t h THR 68 Cb 0.42 0.00 -0.01 0.00 -1.74 0.00 0.00 68.15 66.81 1a7t h THR 68 CO 0.01 0.00 -0.18 0.44 0.37 0.00 0.00 175.52 176.16 1a7t h ASP 69 N -1.34 0.99 0.00 4.18 3.32 -1.29 -1.03 116.42 121.25 1a7t h ASP 69 Ca -0.14 -0.36 -0.17 0.00 0.02 0.00 0.00 57.03 56.39 1a7t h ASP 69 Cb 1.03 -0.27 -0.03 0.00 0.22 0.00 0.00 39.33 40.28 1a7t h ASP 69 CO 0.22 1.14 -2.04 -1.20 -1.72 0.00 0.00 179.24 175.65 1a7t n SER 70 N -4.12 0.71 -0.47 6.45 7.64 0.12 -4.43 113.62 119.51 1a7t n SER 70 Ca 0.01 0.00 0.09 0.00 1.01 0.00 0.00 58.87 59.97 1a7t n SER 70 Cb 0.44 1.36 0.02 0.00 -1.01 0.00 0.00 64.21 65.02 1a7t n SER 70 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 1a7t n LEU 71 N -2.41 1.89 -3.52 -3.43 4.77 0.32 -4.99 117.00 109.62 1a7t n LEU 71 Ca -0.17 -0.82 -0.26 0.00 -0.03 0.00 0.00 56.01 54.73 1a7t n LEU 71 Cb 0.80 0.00 0.02 0.00 -2.33 0.00 0.00 43.42 41.91 1a7t n LEU 71 CO 0.38 0.35 0.04 1.41 -1.33 0.00 0.00 177.39 178.24 1a7t n HIS 72 N 0.18 -2.08 -4.21 -1.77 8.25 -0.34 -4.93 115.22 110.32 1a7t n HIS 72 Ca 0.08 0.68 -0.14 0.00 -0.26 0.00 0.00 57.72 58.08 1a7t n HIS 72 Cb 0.38 -3.77 -0.10 0.00 1.12 0.00 0.00 29.99 27.61 1a7t n HIS 72 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1a7t s ALA 73 N -3.15 1.26 -0.15 -1.41 0.00 -1.12 -4.67 121.76 112.52 1a7t s ALA 73 Ca 0.50 -1.34 -0.04 0.00 0.00 0.00 0.00 51.96 51.08 1a7t s ALA 73 Cb -0.25 0.05 -0.03 0.00 0.00 0.00 0.00 23.12 22.89 1a7t s ALA 73 CO 0.61 -0.08 -0.03 0.21 0.00 0.00 0.00 175.76 176.48 1a7t s LYS 74 N -3.32 3.64 -0.22 0.00 2.20 -0.51 -3.03 119.74 118.51 1a7t s LYS 74 Ca 0.11 -0.49 -0.29 0.00 -0.36 0.00 0.00 55.97 54.94 1a7t s LYS 74 Cb 0.00 -2.93 -0.01 0.00 -1.51 0.00 0.00 37.83 33.39 1a7t s LYS 74 CO -0.00 0.29 1.26 0.08 -0.36 0.00 0.00 175.35 176.62 1a7t s VAL 75 N 0.25 4.25 -0.07 4.02 1.01 -1.26 -0.75 120.40 127.86 1a7t s VAL 75 Ca -0.02 1.48 0.03 0.00 0.00 0.00 0.00 61.98 63.47 1a7t s VAL 75 Cb -0.14 -4.08 -0.03 0.00 0.00 0.00 0.00 36.38 32.13 1a7t s VAL 75 CO 0.03 -0.26 0.09 0.35 0.00 0.00 0.00 175.10 175.30 1a7t n THR 76 N 5.68 0.00 -4.07 3.92 -2.24 -0.67 -4.79 114.28 112.11 1a7t n THR 76 Ca 0.14 -0.27 -0.14 0.00 -2.27 0.00 0.00 64.05 61.51 1a7t n THR 76 Cb 0.46 0.75 -0.14 0.00 -2.10 0.00 0.00 70.33 69.29 1a7t n THR 76 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 1a7t s THR 77 N -1.67 0.32 -0.01 4.28 2.01 -1.17 -1.72 115.64 117.67 1a7t s THR 77 Ca 0.00 -0.31 -0.01 0.00 0.31 0.00 0.00 61.69 61.68 1a7t s THR 77 Cb 0.02 -0.30 0.00 0.00 0.01 0.00 0.00 72.50 72.23 1a7t s THR 77 CO 0.11 -0.00 0.02 0.12 -0.69 0.00 0.00 174.62 174.18 1a7t s PHE 78 N -0.32 -0.02 -0.05 4.92 5.36 -0.18 -1.26 117.98 126.43 1a7t s PHE 78 Ca -0.01 0.06 -0.01 0.00 -0.96 0.00 0.00 56.93 56.01 1a7t s PHE 78 Cb -0.03 -0.01 0.03 0.00 -0.34 0.00 0.00 43.02 42.67 1a7t s PHE 78 CO -0.00 -0.02 0.02 0.42 -1.46 0.00 0.00 175.22 174.19 1a7t s ILE 79 N 0.10 0.13 0.17 3.12 1.01 -0.93 -1.50 121.20 123.29 1a7t s ILE 79 Ca -0.01 0.24 -0.14 0.00 0.00 0.00 0.00 60.65 60.74 1a7t s ILE 79 Cb -0.01 -0.32 -0.07 0.00 0.01 0.00 0.00 42.46 42.07 1a7t s ILE 79 CO -0.00 0.20 0.57 -2.16 0.00 0.00 0.00 174.94 173.55 1a7t s PRO 80 N 1.84 3.98 0.19 2.79 0.04 -1.26 -1.61 135.00 140.97 1a7t s PRO 80 Ca 0.02 0.50 -0.05 0.00 0.04 0.00 0.00 61.00 61.50 1a7t s PRO 80 Cb -0.12 -2.87 0.12 0.00 0.04 0.00 0.00 34.50 31.67 1a7t s PRO 80 CO -0.04 0.44 1.55 -0.97 0.04 0.00 0.00 177.00 178.02 1a7t h ASN 81 N 3.35 0.76 -1.73 6.66 -0.73 -1.93 -3.45 115.58 118.51 1a7t h ASN 81 Ca -0.48 -0.34 0.05 0.00 1.87 0.00 0.00 56.30 57.40 1a7t h ASN 81 Cb 1.19 -0.21 -0.01 0.00 0.27 0.00 0.00 38.32 39.56 1a7t h ASN 81 CO 0.66 1.06 0.24 0.00 -0.37 0.00 0.00 177.43 179.02 1a7t n HIS 82 N -4.04 -1.23 1.76 0.67 1.44 -1.26 -2.16 115.22 110.40 1a7t n HIS 82 Ca -0.02 -0.75 0.13 0.00 -2.01 0.00 0.00 57.72 55.07 1a7t n HIS 82 Cb 0.52 0.37 0.65 0.00 0.12 0.00 0.00 29.99 31.66 1a7t n HIS 82 CO 0.00 0.00 0.00 -2.67 -2.81 0.00 0.00 176.34 170.86 1a7t n TRP 83 N -0.33 0.04 -1.32 -1.40 4.27 -1.26 -4.53 117.44 112.89 1a7t n TRP 83 Ca -0.02 -0.02 -0.30 0.00 -3.89 0.00 0.00 57.50 53.27 1a7t n TRP 83 Cb 0.30 0.00 0.12 0.00 -1.36 0.00 0.00 31.31 30.36 1a7t n TRP 83 CO 0.00 0.00 0.00 -1.01 -2.29 0.00 0.00 177.69 174.39 1a7t s HIS 84 N -1.96 2.52 0.46 -2.67 3.76 -1.26 -4.72 115.29 111.41 1a7t s HIS 84 Ca 0.38 1.26 0.13 0.00 -0.15 0.00 0.00 55.06 56.68 1a7t s HIS 84 Cb 0.18 -3.13 1.04 0.00 1.11 0.00 0.00 32.58 31.79 1a7t s HIS 84 CO 0.30 -2.11 2.05 0.78 -0.85 0.00 0.00 174.74 174.91 1a7t h GLY 85 N -1.34 0.16 0.02 -2.22 0.00 -1.93 -1.05 103.07 96.70 1a7t h GLY 85 Ca -0.48 -0.07 0.00 0.00 0.00 0.00 0.00 47.33 46.78 1a7t h GLY 85 CO 0.56 0.07 0.00 2.09 0.00 0.00 0.00 176.54 179.25 1a7t n ASP 86 N -4.43 0.00 0.00 0.19 5.75 -1.26 -1.32 116.55 115.47 1a7t n ASP 86 Ca -0.01 -1.73 0.00 0.00 -0.01 0.00 0.00 54.79 53.04 1a7t n ASP 86 Cb 0.15 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.24 1a7t n ASP 86 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1a7t n ILE 88 N -2.54 1.20 0.17 0.00 -5.35 -0.82 -1.29 119.36 110.72 1a7t n ILE 88 Ca 0.00 -1.43 0.09 0.00 -0.27 0.00 0.00 62.75 61.14 1a7t n ILE 88 Cb 0.50 0.06 0.61 0.00 -1.74 0.00 0.00 39.64 39.07 1a7t n ILE 88 CO 0.00 0.00 0.00 1.23 -1.76 0.00 0.00 176.55 176.02 1a7t h GLY 89 N 0.00 0.12 -1.65 3.28 0.00 -1.30 -1.77 103.07 101.75 1a7t h GLY 89 Ca 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 47.33 47.29 1a7t h GLY 89 CO 0.00 0.04 0.00 0.61 0.00 0.00 0.00 176.54 177.19 1a7t n GLY 90 N -1.54 3.38 0.25 4.60 0.00 -1.18 -3.89 105.19 106.81 1a7t n GLY 90 Ca 0.00 -0.75 0.04 0.00 0.00 0.00 0.00 46.02 45.31 1a7t n GLY 90 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1a7t h LEU 91 N 2.15 0.17 -0.48 0.99 5.85 -1.66 -2.93 115.31 119.39 1a7t h LEU 91 Ca 0.00 -0.02 0.10 0.00 0.84 0.00 0.00 57.88 58.79 1a7t h LEU 91 Cb 1.17 -0.04 -0.09 0.00 0.37 0.00 0.00 40.66 42.07 1a7t h LEU 91 CO 0.14 0.26 -0.09 1.23 -0.34 0.00 0.00 178.44 179.64 1a7t h GLY 92 N 0.52 0.39 1.02 3.75 0.00 -1.83 -0.60 103.07 106.33 1a7t h GLY 92 Ca 0.04 0.13 -0.02 0.00 0.00 0.00 0.00 47.33 47.48 1a7t h GLY 92 CO 0.01 -0.17 0.42 -1.82 0.00 0.00 0.00 176.54 174.98 1a7t h TYR 93 N 0.03 1.11 -0.22 5.60 3.20 -1.88 -2.80 116.97 122.02 1a7t h TYR 93 Ca 0.24 -0.04 -0.15 0.00 3.14 0.00 0.00 58.73 61.92 1a7t h TYR 93 Cb 0.36 -0.35 -0.01 0.00 1.54 0.00 0.00 36.73 38.27 1a7t h TYR 93 CO -0.38 0.79 -0.49 -0.07 -1.64 0.00 0.00 178.16 176.37 1a7t h LEU 94 N 1.11 0.65 -0.74 2.82 3.38 -1.42 -3.01 115.31 118.11 1a7t h LEU 94 Ca 0.28 -0.32 -0.08 0.00 0.09 0.00 0.00 57.88 57.84 1a7t h LEU 94 Cb 0.06 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.61 1a7t h LEU 94 CO -0.04 1.03 0.06 1.56 0.09 0.00 0.00 178.44 181.14 1a7t h GLN 95 N 0.47 1.02 -0.29 1.13 4.20 -1.01 -1.83 115.11 118.81 1a7t h GLN 95 Ca 0.02 -0.28 -0.07 0.00 0.06 0.00 0.00 58.65 58.38 1a7t h GLN 95 Cb 1.03 -0.11 -0.02 0.00 0.30 0.00 0.00 27.48 28.68 1a7t h GLN 95 CO 0.10 0.96 -0.12 0.00 -0.67 0.00 0.00 178.83 179.10 1a7t h ARG 96 N 0.95 0.48 0.00 1.46 3.08 -1.47 -1.91 114.38 116.98 1a7t h ARG 96 Ca 0.18 -0.14 0.00 0.00 0.07 0.00 0.00 59.98 60.10 1a7t h ARG 96 Cb 0.47 -0.05 0.00 0.00 0.08 0.00 0.00 29.97 30.47 1a7t h ARG 96 CO 0.02 0.60 0.00 1.63 -1.07 0.00 0.00 179.97 181.15 1a7t n LYS 97 N -4.21 0.25 -0.73 0.04 4.76 -0.87 -4.89 118.16 112.50 1a7t n LYS 97 Ca 0.01 0.11 0.00 0.00 -2.87 0.00 0.00 58.31 55.56 1a7t n LYS 97 Cb 0.32 -1.50 0.00 0.00 -1.84 0.00 0.00 35.03 32.01 1a7t n LYS 97 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1a7t n GLY 98 N 0.36 0.63 3.77 0.72 0.00 -0.72 -5.03 105.19 104.92 1a7t n GLY 98 Ca 0.09 -0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.70 1a7t n GLY 98 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1a7t s VAL 99 N -2.00 2.82 -0.10 1.61 1.01 -0.74 -4.99 120.40 118.00 1a7t s VAL 99 Ca 0.00 0.79 -0.14 0.00 0.00 0.00 0.00 61.98 62.64 1a7t s VAL 99 Cb 0.00 -3.49 -0.05 0.00 0.00 0.00 0.00 36.38 32.84 1a7t s VAL 99 CO 0.00 0.17 0.33 -1.10 0.00 0.00 0.00 175.10 174.49 1a7t s GLN 100 N -1.90 4.06 -0.04 2.72 -0.21 -0.70 -4.65 119.66 118.94 1a7t s GLN 100 Ca 0.51 0.20 0.04 0.00 0.02 0.00 0.00 55.36 56.12 1a7t s GLN 100 Cb -0.38 -3.34 -0.03 0.00 1.00 0.00 0.00 33.01 30.27 1a7t s GLN 100 CO 0.49 0.43 -0.13 -1.12 -2.12 0.00 0.00 175.29 172.84 1a7t s SER 101 N -0.16 4.11 -0.01 5.90 0.01 -1.26 -1.01 113.70 121.27 1a7t s SER 101 Ca 0.19 -0.20 0.04 0.00 1.31 0.00 0.00 55.95 57.30 1a7t s SER 101 Cb -0.14 -0.87 -0.01 0.00 0.21 0.00 0.00 66.02 65.21 1a7t s SER 101 CO 0.07 0.33 -0.14 -0.31 0.41 0.00 0.00 173.24 173.61 1a7t s TYR 102 N -0.78 1.28 0.21 2.43 1.51 -0.56 -1.35 117.35 120.09 1a7t s TYR 102 Ca 0.12 -0.25 -0.23 0.00 -1.01 0.00 0.00 57.07 55.70 1a7t s TYR 102 Cb -0.11 -0.83 0.04 0.00 -0.11 0.00 0.00 41.96 40.96 1a7t s TYR 102 CO 0.02 -0.03 0.78 0.00 -1.11 0.00 0.00 175.55 175.21 1a7t s ALA 103 N -0.29 -1.43 0.23 3.71 0.00 -0.53 -4.06 121.76 119.39 1a7t s ALA 103 Ca 0.05 -0.01 -0.31 0.00 0.00 0.00 0.00 51.96 51.69 1a7t s ALA 103 Cb -0.06 0.77 -0.11 0.00 0.00 0.00 0.00 23.12 23.72 1a7t s ALA 103 CO -0.00 -0.99 1.60 1.21 0.00 0.00 0.00 175.76 177.58 1a7t s ASN 104 N -2.88 6.47 0.45 0.00 3.84 -1.26 -1.32 114.94 120.24 1a7t s ASN 104 Ca 0.10 2.80 0.22 0.00 0.21 0.00 0.00 52.86 56.19 1a7t s ASN 104 Cb -0.04 -2.61 1.21 0.00 -0.55 0.00 0.00 41.25 39.26 1a7t s ASN 104 CO 0.02 -0.87 1.86 -0.61 -2.79 0.00 0.00 177.10 174.70 1a7t h GLN 105 N 5.92 0.27 -0.37 0.43 5.75 -1.14 0.11 115.11 126.09 1a7t h GLN 105 Ca -0.45 -0.02 -0.06 0.00 -0.15 0.00 0.00 58.65 57.98 1a7t h GLN 105 Cb 1.21 -0.06 -0.02 0.00 1.07 0.00 0.00 27.48 29.68 1a7t h GLN 105 CO 0.87 0.18 -0.01 0.52 -2.65 0.00 0.00 178.83 177.74 1a7t h MET 106 N 0.28 0.58 -0.31 1.69 2.86 -1.89 -1.10 114.93 117.04 1a7t h MET 106 Ca 0.47 -0.13 -0.05 0.00 -2.06 0.00 0.00 59.70 57.93 1a7t h MET 106 Cb 1.38 -0.08 -0.01 0.00 0.06 0.00 0.00 31.60 32.95 1a7t h MET 106 CO -0.14 0.61 -0.00 1.15 1.06 0.00 0.00 176.91 179.59 1a7t h THR 107 N 0.55 1.26 -0.09 2.22 2.02 -1.11 -2.01 112.91 115.76 1a7t h THR 107 Ca 0.12 -0.95 0.01 0.00 0.77 0.00 0.00 66.41 66.36 1a7t h THR 107 Cb 0.37 1.27 -0.01 0.00 -1.74 0.00 0.00 68.15 68.03 1a7t h THR 107 CO 0.01 0.31 0.02 0.40 0.37 0.00 0.00 175.52 176.63 1a7t h ILE 108 N 0.35 0.96 -0.95 3.11 2.04 -0.90 -0.17 117.51 121.94 1a7t h ILE 108 Ca 0.09 -0.02 0.04 0.00 1.00 0.00 0.00 64.86 65.97 1a7t h ILE 108 Cb 0.44 0.90 -0.06 0.00 -0.74 0.00 0.00 36.82 37.37 1a7t h ILE 108 CO 0.02 0.01 0.62 0.44 0.00 0.00 0.00 178.15 179.23 1a7t h ASP 109 N 0.05 1.02 -0.36 1.72 3.32 -1.17 -0.87 116.42 120.14 1a7t h ASP 109 Ca 0.04 -0.01 -0.06 0.00 0.02 0.00 0.00 57.03 57.03 1a7t h ASP 109 Cb 0.03 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 39.34 1a7t h ASP 109 CO -0.05 0.69 0.00 -0.07 -1.72 0.00 0.00 179.24 178.09 1a7t h LEU 110 N 1.19 0.62 -0.28 1.55 3.38 -1.04 -2.33 115.31 118.38 1a7t h LEU 110 Ca 0.38 -0.31 -0.00 0.00 0.09 0.00 0.00 57.88 58.04 1a7t h LEU 110 Cb 0.03 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.60 1a7t h LEU 110 CO -0.13 0.77 0.16 0.00 0.09 0.00 0.00 178.44 179.33 1a7t h ALA 111 N 0.87 0.36 -0.72 1.53 0.00 -0.71 -2.15 119.26 118.43 1a7t h ALA 111 Ca 0.10 -0.06 0.04 0.00 0.00 0.00 0.00 54.91 54.99 1a7t h ALA 111 Cb 0.45 -0.11 -0.05 0.00 0.00 0.00 0.00 17.79 18.08 1a7t h ALA 111 CO 0.02 -0.11 0.44 0.87 0.00 0.00 0.00 179.25 180.47 1a7t h LYS 112 N 0.35 0.81 -0.78 0.00 1.57 -1.09 -2.51 116.57 114.91 1a7t h LYS 112 Ca 0.10 -0.05 -0.03 0.00 -1.87 0.00 0.00 60.65 58.80 1a7t h LYS 112 Cb 0.05 -0.18 -0.04 0.00 0.08 0.00 0.00 32.23 32.14 1a7t h LYS 112 CO -0.02 0.54 0.36 1.49 -0.57 0.00 0.00 179.45 181.25 1a7t h GLU 113 N 0.84 1.13 -0.01 3.15 4.81 -1.16 -3.25 114.58 120.10 1a7t h GLU 113 Ca 0.30 -0.17 0.00 0.00 -0.13 0.00 0.00 59.36 59.36 1a7t h GLU 113 Cb 0.09 -0.20 0.00 0.00 0.63 0.00 0.00 28.75 29.27 1a7t h GLU 113 CO -0.14 0.89 -0.11 1.63 -0.73 0.00 0.00 179.01 180.55 1a7t n LYS 114 N -4.31 1.24 -0.94 1.92 5.02 -0.83 -4.96 118.16 115.30 1a7t n LYS 114 Ca 0.08 -0.69 0.00 0.00 -2.02 0.00 0.00 58.31 55.68 1a7t n LYS 114 Cb 0.15 -1.49 0.00 0.00 -0.02 0.00 0.00 35.03 33.68 1a7t n LYS 114 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1a7t n GLY 115 N 1.24 0.62 3.88 0.72 0.00 -1.05 -5.06 105.19 105.54 1a7t n GLY 115 Ca 0.16 -0.76 -0.21 0.00 0.00 0.00 0.00 46.02 45.21 1a7t n GLY 115 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1a7t s LEU 116 N 0.00 3.59 0.33 0.99 1.43 -0.97 -5.08 118.68 118.97 1a7t s LEU 116 Ca 0.00 -0.52 -0.29 0.00 -1.03 0.00 0.00 54.13 52.29 1a7t s LEU 116 Cb 0.00 -2.25 -0.12 0.00 0.03 0.00 0.00 46.19 43.86 1a7t s LEU 116 CO 0.00 -0.45 1.51 -0.81 0.23 0.00 0.00 176.35 176.83 1a7t n PRO 117 N -1.46 2.58 -3.88 1.29 -0.04 -1.26 -4.53 135.00 127.70 1a7t n PRO 117 Ca -0.00 0.91 -0.35 0.00 -0.04 0.00 0.00 63.50 64.02 1a7t n PRO 117 Cb 0.60 -2.64 -0.14 0.00 -0.04 0.00 0.00 33.50 31.28 1a7t n PRO 117 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1a7t s VAL 118 N -0.56 3.42 0.45 0.52 1.01 -1.26 -4.85 120.40 119.12 1a7t s VAL 118 Ca 0.59 -0.63 -0.24 0.00 0.00 0.00 0.00 61.98 61.70 1a7t s VAL 118 Cb -0.51 -2.64 -0.09 0.00 0.00 0.00 0.00 36.38 33.14 1a7t s VAL 118 CO 0.56 0.30 1.21 -2.65 0.00 0.00 0.00 175.10 174.52 1a7t n PRO 119 N 4.79 1.72 0.04 2.72 -0.02 -1.26 -4.95 135.00 138.03 1a7t n PRO 119 Ca -0.17 0.62 -0.01 0.00 -2.02 0.00 0.00 63.50 61.92 1a7t n PRO 119 Cb 0.49 -2.32 -0.08 0.00 -0.02 0.00 0.00 33.50 31.57 1a7t n PRO 119 CO 0.00 0.00 0.00 1.05 1.98 0.00 0.00 175.50 178.53 1a7t h GLU 120 N 1.80 0.00 -5.20 -0.52 9.09 -1.97 -3.46 114.58 114.32 1a7t h GLU 120 Ca -0.47 0.00 -0.63 0.00 0.05 0.00 0.00 59.36 58.30 1a7t h GLU 120 Cb 1.31 0.00 -0.20 0.00 -1.65 0.00 0.00 28.75 28.21 1a7t h GLU 120 CO 0.58 0.35 -0.63 -1.01 0.05 0.00 0.00 179.01 178.36 1a7t s HIS 121 N -2.88 3.10 0.32 2.06 3.76 -0.46 -5.04 115.29 116.15 1a7t s HIS 121 Ca -0.02 -0.24 0.09 0.00 -0.15 0.00 0.00 55.06 54.74 1a7t s HIS 121 Cb 0.09 -2.07 -0.05 0.00 1.11 0.00 0.00 32.58 31.66 1a7t s HIS 121 CO 0.81 -0.08 0.03 0.20 -0.85 0.00 0.00 174.74 174.85 1a7t s GLY 122 N 0.71 1.91 0.01 -2.22 0.00 -1.26 -1.46 107.32 105.02 1a7t s GLY 122 Ca 0.01 -1.83 -0.07 0.00 0.00 0.00 0.00 44.72 42.82 1a7t s GLY 122 CO 0.02 -1.82 0.14 -0.11 0.00 0.00 0.00 173.10 171.33 1a7t s PHE 123 N -2.44 0.06 -0.23 1.90 -0.12 -0.44 -4.84 117.98 111.87 1a7t s PHE 123 Ca 0.34 -0.19 0.05 0.00 -0.05 0.00 0.00 56.93 57.09 1a7t s PHE 123 Cb -0.03 -0.06 -0.19 0.00 -0.63 0.00 0.00 43.02 42.11 1a7t s PHE 123 CO 0.20 -0.31 -0.11 0.25 -0.05 0.00 0.00 175.22 175.20 1a7t n THR 124 N 1.30 1.49 -0.02 -4.49 -2.24 -1.26 -0.53 114.28 108.53 1a7t n THR 124 Ca -0.22 -0.64 -0.04 0.00 -2.27 0.00 0.00 64.05 60.88 1a7t n THR 124 Cb 0.56 -1.22 -0.01 0.00 -2.10 0.00 0.00 70.33 67.56 1a7t n THR 124 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 1a7t n ASP 125 N -3.16 0.25 -3.75 3.42 8.00 -1.26 -4.77 116.55 115.28 1a7t n ASP 125 Ca -0.42 0.04 -0.09 0.00 0.71 0.00 0.00 54.79 55.03 1a7t n ASP 125 Cb 1.03 -0.10 -0.04 0.00 -0.02 0.00 0.00 41.12 41.99 1a7t n ASP 125 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 1a7t s SER 126 N -5.31 -0.27 -0.28 -2.24 1.04 -1.26 -0.66 113.70 104.71 1a7t s SER 126 Ca -0.05 -0.49 -0.19 0.00 0.48 0.00 0.00 55.95 55.70 1a7t s SER 126 Cb 0.02 0.60 0.11 0.00 0.10 0.00 0.00 66.02 66.85 1a7t s SER 126 CO 0.06 -1.09 0.87 -0.22 0.98 0.00 0.00 173.24 173.84 1a7t s LEU 127 N -2.88 -0.66 -0.22 2.42 2.96 -0.53 -4.95 118.68 114.82 1a7t s LEU 127 Ca 0.10 1.11 -0.10 0.00 -0.22 0.00 0.00 54.13 55.02 1a7t s LEU 127 Cb -0.02 2.05 -0.05 0.00 0.50 0.00 0.00 46.19 48.68 1a7t s LEU 127 CO -0.01 -0.18 0.14 -0.89 -1.32 0.00 0.00 176.35 174.08 1a7t s THR 128 N 1.10 5.29 -0.13 3.68 2.01 -1.26 -1.51 115.64 124.82 1a7t s THR 128 Ca -0.06 0.15 -0.03 0.00 0.31 0.00 0.00 61.69 62.07 1a7t s THR 128 Cb -0.04 -3.44 -0.03 0.00 0.01 0.00 0.00 72.50 69.00 1a7t s THR 128 CO -0.13 0.39 -0.04 -0.69 -0.69 0.00 0.00 174.62 173.47 1a7t s VAL 129 N 0.75 3.94 -0.22 3.82 1.01 -0.39 -4.95 120.40 124.37 1a7t s VAL 129 Ca 0.07 -0.36 -0.11 0.00 0.00 0.00 0.00 61.98 61.59 1a7t s VAL 129 Cb -0.13 -2.70 -0.05 0.00 0.00 0.00 0.00 36.38 33.51 1a7t s VAL 129 CO 0.02 0.53 0.16 -0.55 0.00 0.00 0.00 175.10 175.26 1a7t s SER 130 N -0.04 6.19 -0.90 3.32 0.15 -1.26 -0.50 113.70 120.65 1a7t s SER 130 Ca 0.01 0.20 -0.05 0.00 0.70 0.00 0.00 55.95 56.81 1a7t s SER 130 Cb -0.13 -2.11 0.23 0.00 -1.71 0.00 0.00 66.02 62.30 1a7t s SER 130 CO 0.03 0.11 0.81 -0.22 1.20 0.00 0.00 173.24 175.17 1a7t s LEU 131 N 0.72 5.87 -1.47 3.45 2.96 0.72 -4.61 118.68 126.32 1a7t s LEU 131 Ca 0.09 -3.42 -0.09 0.00 -0.22 0.00 0.00 54.13 50.49 1a7t s LEU 131 Cb -0.12 -2.02 0.06 0.00 0.50 0.00 0.00 46.19 44.61 1a7t s LEU 131 CO 0.02 -0.29 0.84 -0.67 -1.32 0.00 0.00 176.35 174.93 1a7t n ASP 132 N 2.82 -3.24 0.00 3.68 2.03 -1.26 -2.03 116.55 118.55 1a7t n ASP 132 Ca 0.19 -0.83 0.00 0.00 0.52 0.00 0.00 54.79 54.67 1a7t n ASP 132 Cb 0.39 -3.80 0.00 0.00 -0.72 0.00 0.00 41.12 36.99 1a7t n ASP 132 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1a7t n GLY 133 N -1.67 2.49 3.68 0.27 0.00 -1.26 -4.99 105.19 103.71 1a7t n GLY 133 Ca -0.09 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.51 1a7t n GLY 133 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1a7t s MET 134 N -0.03 4.31 0.13 1.61 0.00 -0.86 -5.00 119.30 119.46 1a7t s MET 134 Ca 0.00 1.64 -0.25 0.00 0.00 0.00 0.00 55.69 57.08 1a7t s MET 134 Cb 0.00 -3.63 -0.07 0.00 0.00 0.00 0.00 34.83 31.13 1a7t s MET 134 CO 0.00 -0.54 0.77 -1.25 0.00 0.00 0.00 175.02 174.00 1a7t s PRO 135 N 2.69 4.53 -0.21 4.11 0.04 -1.26 -0.20 135.00 144.70 1a7t s PRO 135 Ca 0.55 1.12 -0.01 0.00 0.04 0.00 0.00 61.00 62.70 1a7t s PRO 135 Cb -0.23 -3.29 0.01 0.00 0.04 0.00 0.00 34.50 31.04 1a7t s PRO 135 CO 0.19 0.50 -0.12 -0.51 0.04 0.00 0.00 177.00 177.10 1a7t s LEU 136 N -0.86 2.65 -0.30 -3.56 1.43 0.34 -4.49 118.68 113.89 1a7t s LEU 136 Ca 0.36 -0.65 -0.08 0.00 -1.03 0.00 0.00 54.13 52.72 1a7t s LEU 136 Cb -0.22 -1.60 -0.00 0.00 0.03 0.00 0.00 46.19 44.39 1a7t s LEU 136 CO 0.25 -0.04 0.12 -1.10 0.23 0.00 0.00 176.35 175.81 1a7t s GLN 137 N 1.35 3.24 -0.17 1.70 -0.21 -0.02 -1.27 119.66 124.28 1a7t s GLN 137 Ca 0.04 -0.77 -0.14 0.00 0.02 0.00 0.00 55.36 54.51 1a7t s GLN 137 Cb -0.14 -3.47 -0.05 0.00 1.00 0.00 0.00 33.01 30.35 1a7t s GLN 137 CO -0.08 -0.42 0.29 0.00 -2.12 0.00 0.00 175.29 172.96 1a7t s TYR 139 N 0.53 1.12 -0.33 0.00 2.02 -0.77 -1.45 117.35 118.47 1a7t s TYR 139 Ca 0.16 -0.23 -0.06 0.00 -0.37 0.00 0.00 57.07 56.57 1a7t s TYR 139 Cb -0.13 -0.71 0.03 0.00 -0.40 0.00 0.00 41.96 40.75 1a7t s TYR 139 CO 0.04 -0.01 0.09 -0.47 -1.57 0.00 0.00 175.55 173.63 1a7t s TYR 140 N -0.39 3.23 -1.57 2.71 5.04 0.16 -1.86 117.35 124.68 1a7t s TYR 140 Ca 0.04 -1.37 0.15 0.00 -2.44 0.00 0.00 57.07 53.45 1a7t s TYR 140 Cb -0.05 -2.25 0.25 0.00 0.35 0.00 0.00 41.96 40.25 1a7t s TYR 140 CO -0.00 -0.70 1.14 1.28 -1.34 0.00 0.00 175.55 175.93 1a7t n LEU 141 N 4.81 2.70 0.00 6.97 4.77 -1.26 -4.86 117.00 130.12 1a7t n LEU 141 Ca -0.13 -1.46 0.00 0.00 -0.03 0.00 0.00 56.01 54.39 1a7t n LEU 141 Cb 0.45 -0.14 0.00 0.00 -2.33 0.00 0.00 43.42 41.40 1a7t n LEU 141 CO 0.31 0.59 0.00 0.61 -1.33 0.00 0.00 177.39 177.57 1a7t n GLY 142 N 0.84 2.26 3.72 -0.72 0.00 -1.26 -4.69 105.19 105.34 1a7t n GLY 142 Ca 0.12 -2.02 -0.30 0.00 0.00 0.00 0.00 46.02 43.81 1a7t n GLY 142 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1a7t s GLY 143 N 0.00 1.63 0.00 -0.02 0.00 -1.26 -4.70 107.32 102.97 1a7t s GLY 143 Ca 0.00 0.03 0.00 0.00 0.00 0.00 0.00 44.72 44.75 1a7t s GLY 143 CO 0.00 0.49 0.00 0.61 0.00 0.00 0.00 173.10 174.20 1a7t n GLY 144 N -1.04 1.29 0.37 0.20 0.00 -1.26 -3.48 105.19 101.27 1a7t n GLY 144 Ca 0.07 0.38 0.10 0.00 0.00 0.00 0.00 46.02 46.57 1a7t n GLY 144 CO 0.00 0.00 0.00 0.84 0.00 0.00 0.00 173.32 174.16 1a7t h HIS 145 N 0.00 0.92 -3.66 1.61 -0.00 -1.85 -0.05 115.15 112.11 1a7t h HIS 145 Ca 0.00 0.03 -0.40 0.00 -0.00 0.00 0.00 60.37 60.00 1a7t h HIS 145 Cb 0.00 -0.29 -0.19 0.00 -0.00 0.00 0.00 27.41 26.93 1a7t h HIS 145 CO 0.00 0.37 -0.76 0.00 -0.00 0.00 0.00 177.93 177.54 1a7t s ALA 146 N -5.77 1.38 0.38 5.26 0.00 -1.26 -2.61 121.76 119.13 1a7t s ALA 146 Ca -0.11 -1.23 0.36 0.00 0.00 0.00 0.00 51.96 50.99 1a7t s ALA 146 Cb 0.22 -0.06 1.78 0.00 0.00 0.00 0.00 23.12 25.06 1a7t s ALA 146 CO 0.79 0.09 2.15 1.79 0.00 0.00 0.00 175.76 180.58 1a7t h THR 147 N 3.65 0.13 -0.22 0.00 1.35 -1.58 -3.16 112.91 113.07 1a7t h THR 147 Ca -0.40 -0.33 0.00 0.00 -0.55 0.00 0.00 66.41 65.13 1a7t h THR 147 Cb 1.19 1.29 0.00 0.00 -1.73 0.00 0.00 68.15 68.90 1a7t h THR 147 CO 0.49 0.03 0.00 -0.90 -0.25 0.00 0.00 175.52 174.89 1a7t n ASP 148 N -3.20 2.55 -4.72 5.36 5.75 -1.26 -4.12 116.55 116.91 1a7t n ASP 148 Ca -0.01 -1.80 -0.43 0.00 -0.01 0.00 0.00 54.79 52.54 1a7t n ASP 148 Cb 0.21 -0.14 -0.01 0.00 -1.03 0.00 0.00 41.12 40.14 1a7t n ASP 148 CO 0.00 0.00 0.00 -0.46 -0.11 0.00 0.00 177.20 176.63 1a7t n ASN 149 N 0.57 3.22 -4.29 -1.12 2.04 -1.19 -4.75 115.26 109.73 1a7t n ASN 149 Ca 0.10 1.18 -0.26 0.00 -0.44 0.00 0.00 54.58 55.15 1a7t n ASN 149 Cb 0.37 -1.52 -0.04 0.00 -2.53 0.00 0.00 39.78 36.06 1a7t n ASN 149 CO 0.00 0.00 0.00 2.30 -0.44 0.00 0.00 177.26 179.12 1a7t n ILE 150 N 1.31 0.00 -4.20 1.53 -5.35 -0.92 -4.62 119.36 107.10 1a7t n ILE 150 Ca 0.07 -1.99 -0.14 0.00 -0.27 0.00 0.00 62.75 60.42 1a7t n ILE 150 Cb 0.35 0.29 -0.11 0.00 -1.74 0.00 0.00 39.64 38.44 1a7t n ILE 150 CO 0.00 0.00 0.00 0.68 -1.76 0.00 0.00 176.55 175.47 1a7t s VAL 151 N -2.49 1.02 -0.12 7.28 -7.23 -0.77 -4.71 120.40 113.38 1a7t s VAL 151 Ca 0.06 -1.79 0.01 0.00 -1.81 0.00 0.00 61.98 58.44 1a7t s VAL 151 Cb -0.00 -1.54 0.02 0.00 0.56 0.00 0.00 36.38 35.42 1a7t s VAL 151 CO 0.04 -0.63 -0.12 -0.69 -0.31 0.00 0.00 175.10 173.39 1a7t s VAL 152 N -2.76 1.29 -0.15 1.32 1.01 -0.83 -1.85 120.40 118.43 1a7t s VAL 152 Ca 0.09 -0.49 -0.07 0.00 0.00 0.00 0.00 61.98 61.52 1a7t s VAL 152 Cb -0.01 -1.23 -0.04 0.00 0.00 0.00 0.00 36.38 35.10 1a7t s VAL 152 CO 0.00 0.41 0.08 0.86 0.00 0.00 0.00 175.10 176.45 1a7t s TRP 153 N 1.35 3.36 -0.66 5.22 -0.00 0.11 -0.30 118.94 128.02 1a7t s TRP 153 Ca -0.00 0.27 -0.01 0.00 -0.00 0.00 0.00 56.10 56.36 1a7t s TRP 153 Cb -0.14 -2.00 0.17 0.00 -0.00 0.00 0.00 33.47 31.51 1a7t s TRP 153 CO -0.06 0.41 0.48 -0.51 -0.00 0.00 0.00 176.95 177.27 1a7t s LEU 154 N -0.29 5.14 0.42 5.86 1.43 -0.35 -0.84 118.68 130.05 1a7t s LEU 154 Ca 0.09 -3.09 0.11 0.00 -1.03 0.00 0.00 54.13 50.21 1a7t s LEU 154 Cb -0.12 -1.82 0.94 0.00 0.03 0.00 0.00 46.19 45.23 1a7t s LEU 154 CO 0.01 -0.30 1.99 1.55 0.23 0.00 0.00 176.35 179.83 1a7t h PRO 155 N 6.68 0.49 0.00 1.29 0.13 -1.84 0.05 132.00 138.79 1a7t h PRO 155 Ca 0.02 -0.03 0.00 0.00 -0.87 0.00 0.00 66.00 65.12 1a7t h PRO 155 Cb 0.91 -0.11 0.00 0.00 0.13 0.00 0.00 31.00 31.93 1a7t h PRO 155 CO 0.73 0.32 0.00 1.79 -0.23 0.00 0.00 178.00 180.61 1a7t h THR 156 N 0.50 0.00 0.00 1.56 1.35 -1.94 -3.25 112.91 111.13 1a7t h THR 156 Ca 0.26 -0.41 0.00 0.00 -0.55 0.00 0.00 66.41 65.71 1a7t h THR 156 Cb 0.37 1.31 0.00 0.00 -1.73 0.00 0.00 68.15 68.10 1a7t h THR 156 CO -0.07 0.00 -0.97 -0.62 -0.25 0.00 0.00 175.52 173.61 1a7t n GLU 157 N -2.36 1.95 -3.41 4.72 -0.58 -0.70 -5.02 120.64 115.23 1a7t n GLU 157 Ca 0.04 -0.04 -0.20 0.00 -0.42 0.00 0.00 57.16 56.54 1a7t n GLU 157 Cb 0.35 -1.07 0.07 0.00 -0.57 0.00 0.00 31.44 30.22 1a7t n GLU 157 CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74 1a7t n ASN 158 N -1.54 -5.30 -4.27 1.62 4.13 -0.08 -4.81 115.26 105.01 1a7t n ASN 158 Ca -0.00 -0.47 -0.32 0.00 1.68 0.00 0.00 54.58 55.47 1a7t n ASN 158 Cb 0.18 -4.38 -0.16 0.00 -1.54 0.00 0.00 39.78 33.88 1a7t n ASN 158 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 1a7t s ILE 159 N -3.28 2.09 -0.12 2.41 1.01 -1.20 0.50 121.20 122.61 1a7t s ILE 159 Ca 0.44 -1.05 0.02 0.00 0.00 0.00 0.00 60.65 60.06 1a7t s ILE 159 Cb -0.19 -1.76 -0.00 0.00 0.01 0.00 0.00 42.46 40.51 1a7t s ILE 159 CO 0.62 0.57 -0.19 -0.22 0.00 0.00 0.00 174.94 175.72 1a7t s LEU 160 N -0.13 2.33 -0.53 2.97 2.96 -0.83 -1.21 118.68 124.24 1a7t s LEU 160 Ca -0.04 -0.48 -0.18 0.00 -0.22 0.00 0.00 54.13 53.20 1a7t s LEU 160 Cb -0.14 -1.49 0.09 0.00 0.50 0.00 0.00 46.19 45.14 1a7t s LEU 160 CO 0.04 0.14 0.59 0.12 -1.32 0.00 0.00 176.35 175.92 1a7t s PHE 161 N 0.46 3.10 -0.04 5.38 5.36 0.59 -1.73 117.98 131.10 1a7t s PHE 161 Ca -0.13 -0.87 0.12 0.00 -0.96 0.00 0.00 56.93 55.09 1a7t s PHE 161 Cb -0.17 -3.66 -0.06 0.00 -0.34 0.00 0.00 43.02 38.79 1a7t s PHE 161 CO 0.06 -1.07 1.34 0.78 -1.46 0.00 0.00 175.22 174.87 1a7t h GLY 162 N 9.48 0.00 0.00 13.12 0.00 -1.38 -2.20 103.07 122.09 1a7t h GLY 162 Ca -0.29 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.04 1a7t h GLY 162 CO 1.00 0.00 0.00 0.61 0.00 0.00 0.00 176.54 178.15 1a7t n GLY 163 N 1.29 -1.50 0.19 4.60 0.00 -1.04 -4.09 105.19 104.64 1a7t n GLY 163 Ca 0.00 -1.28 0.13 0.00 0.00 0.00 0.00 46.02 44.88 1a7t n GLY 163 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1a7t n MET 165 N -2.43 0.07 -4.76 0.00 0.00 -1.26 -4.55 117.12 104.19 1a7t n MET 165 Ca -0.01 0.40 -0.33 0.00 0.00 0.00 0.00 57.70 57.77 1a7t n MET 165 Cb 0.11 -1.66 -0.12 0.00 0.00 0.00 0.00 33.22 31.55 1a7t n MET 165 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 175.97 175.46 1a7t s LEU 166 N -3.58 2.92 0.01 3.17 1.43 -0.68 -4.76 118.68 117.19 1a7t s LEU 166 Ca 0.03 -0.13 -0.01 0.00 -1.03 0.00 0.00 54.13 52.99 1a7t s LEU 166 Cb 0.07 -1.62 -0.04 0.00 0.03 0.00 0.00 46.19 44.63 1a7t s LEU 166 CO 0.23 0.33 0.14 -0.54 0.23 0.00 0.00 176.35 176.74 1a7t s LYS 167 N -0.64 3.25 0.85 1.70 -0.14 -1.26 -3.90 119.74 119.59 1a7t s LYS 167 Ca 0.10 -0.44 -0.12 0.00 -1.36 0.00 0.00 55.97 54.15 1a7t s LYS 167 Cb -0.11 -2.97 0.10 0.00 -1.68 0.00 0.00 37.83 33.17 1a7t s LYS 167 CO 0.01 0.64 1.15 0.16 -0.76 0.00 0.00 175.35 176.56 1a7t s ASP 168 N -2.01 4.14 0.12 2.83 -4.77 -1.26 -4.67 116.67 111.05 1a7t s ASP 168 Ca 0.27 0.92 0.20 0.00 -3.30 0.00 0.00 52.55 50.64 1a7t s ASP 168 Cb -0.12 -1.49 0.82 0.00 -1.09 0.00 0.00 42.92 41.04 1a7t s ASP 168 CO 0.19 -2.15 1.62 0.59 0.70 0.00 0.00 175.17 176.11 1a7t n ASN 169 N -3.50 0.32 0.01 2.11 3.02 -1.26 -2.61 115.26 113.35 1a7t n ASN 169 Ca 0.07 0.57 0.11 0.00 -0.03 0.00 0.00 54.58 55.30 1a7t n ASN 169 Cb 0.60 -0.64 0.04 0.00 -0.61 0.00 0.00 39.78 39.16 1a7t n ASN 169 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1a7t n GLN 170 N -1.85 0.12 -2.99 3.52 6.02 -1.26 -4.92 117.38 116.03 1a7t n GLN 170 Ca 0.03 -0.01 -0.40 0.00 -0.01 0.00 0.00 57.00 56.61 1a7t n GLN 170 Cb 0.22 -1.53 -0.04 0.00 1.02 0.00 0.00 30.24 29.90 1a7t n GLN 170 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 177.06 177.04 1a7t s THR 171 N -3.08 5.01 -0.16 5.09 2.01 -1.07 -4.97 115.64 118.47 1a7t s THR 171 Ca 0.07 1.53 0.03 0.00 0.31 0.00 0.00 61.69 63.63 1a7t s THR 171 Cb 0.16 -4.08 -0.02 0.00 0.01 0.00 0.00 72.50 68.57 1a7t s THR 171 CO 0.80 0.21 0.19 0.35 -0.69 0.00 0.00 174.62 175.47 1a7t n THR 172 N 3.92 0.00 -4.22 -0.82 -2.24 -1.26 -4.84 114.28 104.82 1a7t n THR 172 Ca 0.00 -0.45 -0.29 0.00 -2.27 0.00 0.00 64.05 61.05 1a7t n THR 172 Cb 0.51 1.01 -0.09 0.00 -2.10 0.00 0.00 70.33 69.66 1a7t n THR 172 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1a7t s SER 173 N -1.08 4.54 0.54 3.42 0.15 -1.26 -4.96 113.70 115.05 1a7t s SER 173 Ca 0.01 -0.39 0.31 0.00 0.70 0.00 0.00 55.95 56.59 1a7t s SER 173 Cb 0.02 -0.90 1.46 0.00 -1.71 0.00 0.00 66.02 64.89 1a7t s SER 173 CO 0.09 0.15 2.04 -0.29 1.20 0.00 0.00 173.24 176.43 1a7t h ILE 174 N 2.96 0.31 0.00 6.45 2.10 -1.96 -3.48 117.51 123.88 1a7t h ILE 174 Ca -0.48 -0.57 0.00 0.00 1.08 0.00 0.00 64.86 64.89 1a7t h ILE 174 Cb 1.18 1.43 0.00 0.00 -1.09 0.00 0.00 36.82 38.34 1a7t h ILE 174 CO 0.55 0.09 0.00 0.61 -1.08 0.00 0.00 178.15 178.31 1a7t n GLY 175 N -0.35 0.07 3.59 8.18 0.00 -1.26 -4.72 105.19 110.70 1a7t n GLY 175 Ca -0.01 -0.97 -0.42 0.00 0.00 0.00 0.00 46.02 44.62 1a7t n GLY 175 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1a7t s ASN 176 N -4.00 5.90 -0.25 1.61 2.47 -1.26 -4.87 114.94 114.54 1a7t s ASN 176 Ca 0.00 1.07 0.10 0.00 0.42 0.00 0.00 52.86 54.44 1a7t s ASN 176 Cb 0.00 -2.53 0.45 0.00 -1.45 0.00 0.00 41.25 37.72 1a7t s ASN 176 CO 0.00 -1.74 1.31 2.30 -3.72 0.00 0.00 177.10 175.25 1a7t n ILE 177 N 7.31 2.37 0.26 -5.21 -5.35 -1.26 -4.75 119.36 112.74 1a7t n ILE 177 Ca 0.21 -3.15 0.15 0.00 -0.27 0.00 0.00 62.75 59.69 1a7t n ILE 177 Cb 0.48 -0.34 0.67 0.00 -1.74 0.00 0.00 39.64 38.70 1a7t n ILE 177 CO 0.00 0.00 0.00 0.77 -1.76 0.00 0.00 176.55 175.56 1a7t h SER 178 N 1.09 0.00 0.00 7.28 4.64 -1.89 -2.98 113.55 121.69 1a7t h SER 178 Ca 0.11 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.43 1a7t h SER 178 Cb 1.27 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.36 1a7t h SER 178 CO 0.21 0.10 -0.08 0.47 -0.87 0.00 0.00 176.83 176.65 1a7t n ASP 179 N -3.29 1.68 -4.89 4.97 8.00 -1.26 -5.08 116.55 116.68 1a7t n ASP 179 Ca -0.00 -2.44 -0.29 0.00 0.71 0.00 0.00 54.79 52.76 1a7t n ASP 179 Cb 0.31 -0.24 0.01 0.00 -0.02 0.00 0.00 41.12 41.18 1a7t n ASP 179 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1a7t s ALA 180 N -1.67 3.24 -0.74 2.24 0.00 -1.07 -1.76 121.76 122.00 1a7t s ALA 180 Ca 0.16 -0.30 0.04 0.00 0.00 0.00 0.00 51.96 51.86 1a7t s ALA 180 Cb 0.14 -2.84 0.18 0.00 0.00 0.00 0.00 23.12 20.60 1a7t s ALA 180 CO 0.01 -0.55 0.56 -3.47 0.00 0.00 0.00 175.76 172.32 1a7t n ASP 181 N -2.53 3.27 -0.28 0.00 -0.08 -0.03 -4.84 116.55 112.05 1a7t n ASP 181 Ca 0.03 -3.21 0.09 0.00 -1.51 0.00 0.00 54.79 50.19 1a7t n ASP 181 Cb 0.55 -0.81 0.32 0.00 2.34 0.00 0.00 41.12 43.52 1a7t n ASP 181 CO 0.00 0.00 0.00 0.58 0.12 0.00 0.00 177.20 177.90 1a7t h VAL 182 N 4.28 0.92 0.00 5.18 2.07 -1.94 -0.73 116.25 126.03 1a7t h VAL 182 Ca 0.15 -0.28 -0.05 0.00 0.82 0.00 0.00 66.70 67.34 1a7t h VAL 182 Cb 0.76 0.02 -0.01 0.00 -1.52 0.00 0.00 31.29 30.54 1a7t h VAL 182 CO 0.75 0.15 -0.23 0.71 0.02 0.00 0.00 177.57 178.97 1a7t h THR 183 N 0.83 0.47 0.00 2.57 1.35 -1.96 -2.97 112.91 113.20 1a7t h THR 183 Ca 0.43 -1.32 -0.02 0.00 -0.55 0.00 0.00 66.41 64.95 1a7t h THR 183 Cb 0.51 1.96 -0.00 0.00 -1.73 0.00 0.00 68.15 68.89 1a7t h THR 183 CO -0.19 0.23 -1.18 0.00 -0.25 0.00 0.00 175.52 174.12 1a7t n ALA 184 N -2.19 2.49 -0.06 6.62 0.00 -0.84 -4.49 120.51 122.05 1a7t n ALA 184 Ca 0.01 -0.31 -0.09 0.00 0.00 0.00 0.00 53.44 53.06 1a7t n ALA 184 Cb 0.52 -1.04 -0.03 0.00 0.00 0.00 0.00 19.45 18.90 1a7t n ALA 184 CO 0.00 0.00 0.00 2.35 0.00 0.00 0.00 177.50 179.85 1a7t h TRP 185 N 0.00 -0.89 -0.71 0.00 2.91 -0.98 -0.51 115.95 115.76 1a7t h TRP 185 Ca -0.02 0.05 0.07 0.00 1.13 0.00 0.00 58.89 60.12 1a7t h TRP 185 Cb 1.06 0.43 -0.04 0.00 -0.51 0.00 0.00 29.16 30.10 1a7t h TRP 185 CO 0.00 -0.39 0.47 -1.35 -1.03 0.00 0.00 178.44 176.14 1a7t h PRO 186 N -0.33 0.70 -0.19 2.65 0.11 -1.79 -1.63 132.00 131.53 1a7t h PRO 186 Ca 0.13 -0.04 -0.04 0.00 0.11 0.00 0.00 66.00 66.16 1a7t h PRO 186 Cb 0.54 -0.16 -0.01 0.00 0.11 0.00 0.00 31.00 31.48 1a7t h PRO 186 CO -0.44 0.46 -0.04 0.87 -0.21 0.00 0.00 178.00 178.64 1a7t h LYS 187 N 0.72 0.36 -0.92 1.05 1.79 -1.57 -2.41 116.57 115.58 1a7t h LYS 187 Ca 0.31 -0.13 0.07 0.00 -2.18 0.00 0.00 60.65 58.71 1a7t h LYS 187 Cb 0.29 -0.02 -0.06 0.00 -1.58 0.00 0.00 32.23 30.86 1a7t h LYS 187 CO -0.10 0.61 0.60 1.15 -1.08 0.00 0.00 179.45 180.63 1a7t h THR 188 N 0.08 1.06 -0.49 -0.16 2.02 -0.57 -1.67 112.91 113.18 1a7t h THR 188 Ca 0.05 -0.36 -0.09 0.00 0.77 0.00 0.00 66.41 66.78 1a7t h THR 188 Cb 0.48 -0.07 -0.02 0.00 -1.74 0.00 0.00 68.15 66.79 1a7t h THR 188 CO 0.02 0.19 -0.04 -0.07 0.37 0.00 0.00 175.52 175.99 1a7t h LEU 189 N 1.05 0.82 -1.01 2.58 3.38 -1.19 -0.15 115.31 120.79 1a7t h LEU 189 Ca 0.40 -0.22 -0.07 0.00 0.09 0.00 0.00 57.88 58.08 1a7t h LEU 189 Cb 0.21 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.72 1a7t h LEU 189 CO -0.15 0.91 -0.03 0.44 0.09 0.00 0.00 178.44 179.69 1a7t h ASP 190 N 0.77 0.65 -0.07 -0.43 3.32 -0.89 0.58 116.42 120.35 1a7t h ASP 190 Ca 0.14 -0.15 -0.20 0.00 0.02 0.00 0.00 57.03 56.84 1a7t h ASP 190 Cb 0.52 -0.17 0.00 0.00 0.22 0.00 0.00 39.33 39.90 1a7t h ASP 190 CO 0.03 0.74 -0.68 0.11 -1.72 0.00 0.00 179.24 177.72 1a7t h LYS 191 N 0.63 0.70 -0.58 3.56 1.57 -0.85 -1.26 116.57 120.35 1a7t h LYS 191 Ca 0.12 -0.52 -0.03 0.00 -1.87 0.00 0.00 60.65 58.35 1a7t h LYS 191 Cb 0.45 0.09 -0.03 0.00 0.08 0.00 0.00 32.23 32.82 1a7t h LYS 191 CO 0.02 1.14 0.23 0.28 -0.57 0.00 0.00 179.45 180.55 1a7t h VAL 192 N 0.50 1.23 -0.52 0.50 2.07 -0.52 -1.09 116.25 118.43 1a7t h VAL 192 Ca -0.02 -0.71 -0.03 0.00 0.82 0.00 0.00 66.70 66.75 1a7t h VAL 192 Cb 1.28 0.62 -0.02 0.00 -1.52 0.00 0.00 31.29 31.64 1a7t h VAL 192 CO 0.14 0.27 0.20 0.50 0.02 0.00 0.00 177.57 178.70 1a7t h LYS 193 N 0.79 0.78 -0.11 1.57 3.64 0.34 -2.84 116.57 120.74 1a7t h LYS 193 Ca 0.19 -0.15 -0.13 0.00 -1.27 0.00 0.00 60.65 59.30 1a7t h LYS 193 Cb 0.21 -0.12 -0.01 0.00 -0.41 0.00 0.00 32.23 31.89 1a7t h LYS 193 CO -0.01 0.69 -0.50 0.00 -2.27 0.00 0.00 179.45 177.35 1a7t h ALA 194 N 1.05 0.95 0.00 5.00 0.00 -0.95 -3.33 119.26 121.97 1a7t h ALA 194 Ca 0.17 -0.48 -0.15 0.00 0.00 0.00 0.00 54.91 54.45 1a7t h ALA 194 Cb 0.21 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.89 1a7t h ALA 194 CO -0.01 0.66 -0.74 -0.22 0.00 0.00 0.00 179.25 178.94 1a7t h LYS 195 N 0.22 0.00 -1.85 0.00 3.64 -1.13 -3.39 116.57 114.05 1a7t h LYS 195 Ca 0.01 0.00 -0.51 0.00 -1.27 0.00 0.00 60.65 58.87 1a7t h LYS 195 Cb 0.97 0.00 -0.41 0.00 -0.41 0.00 0.00 32.23 32.38 1a7t h LYS 195 CO 0.08 0.67 -0.94 1.19 -2.27 0.00 0.00 179.45 178.18 1a7t n PHE 196 N -3.25 2.17 0.28 1.91 3.72 -1.08 -4.90 117.46 116.31 1a7t n PHE 196 Ca 0.00 -3.60 0.16 0.00 -0.05 0.00 0.00 57.45 53.97 1a7t n PHE 196 Cb 0.82 -0.38 0.84 0.00 -0.94 0.00 0.00 39.48 39.81 1a7t n PHE 196 CO 0.00 0.00 0.00 -1.00 -0.05 0.00 0.00 176.76 175.71 1a7t h PRO 197 N 2.93 0.00 -0.60 -1.08 0.13 -1.78 -3.03 132.00 128.57 1a7t h PRO 197 Ca 0.11 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.24 1a7t h PRO 197 Cb 0.84 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.97 1a7t h PRO 197 CO 0.66 0.07 0.00 -1.13 -0.23 0.00 0.00 178.00 177.37 1a7t n SER 198 N -3.44 3.44 -4.72 1.44 3.41 -1.26 -4.95 113.62 107.53 1a7t n SER 198 Ca -0.02 -2.27 -0.42 0.00 -0.26 0.00 0.00 58.87 55.90 1a7t n SER 198 Cb 0.20 -0.47 -0.03 0.00 -0.26 0.00 0.00 64.21 63.66 1a7t n SER 198 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1a7t s ALA 199 N -1.70 3.79 -0.04 7.33 0.00 -1.15 -4.86 121.76 125.13 1a7t s ALA 199 Ca 0.36 1.43 0.03 0.00 0.00 0.00 0.00 51.96 53.78 1a7t s ALA 199 Cb 0.23 -3.63 -0.25 0.00 0.00 0.00 0.00 23.12 19.47 1a7t s ALA 199 CO 0.18 -0.82 0.66 0.00 0.00 0.00 0.00 175.76 175.79 1a7t h ARG 200 N 6.42 0.13 -5.07 0.00 3.08 -0.27 -3.41 114.38 115.26 1a7t h ARG 200 Ca -0.43 -0.22 -0.52 0.00 0.07 0.00 0.00 59.98 58.87 1a7t h ARG 200 Cb 1.21 0.08 -0.31 0.00 0.08 0.00 0.00 29.97 31.03 1a7t h ARG 200 CO 0.90 0.86 -0.82 0.71 -1.07 0.00 0.00 179.97 180.54 1a7t s TYR 201 N -2.60 1.48 -0.14 3.04 2.02 -1.21 -4.52 117.35 115.42 1a7t s TYR 201 Ca -0.10 -0.42 0.00 0.00 -0.37 0.00 0.00 57.07 56.18 1a7t s TYR 201 Cb 0.07 -1.01 0.02 0.00 -0.40 0.00 0.00 41.96 40.64 1a7t s TYR 201 CO 0.82 -0.15 -0.14 0.08 -1.57 0.00 0.00 175.55 174.59 1a7t s VAL 202 N 0.11 1.51 -0.22 0.71 1.01 0.22 -1.96 120.40 121.78 1a7t s VAL 202 Ca -0.04 -0.60 -0.07 0.00 0.00 0.00 0.00 61.98 61.27 1a7t s VAL 202 Cb -0.11 -1.42 -0.03 0.00 0.00 0.00 0.00 36.38 34.82 1a7t s VAL 202 CO 0.02 0.45 0.06 -0.69 0.00 0.00 0.00 175.10 174.93 1a7t s VAL 203 N 1.47 4.44 0.81 2.92 1.01 -0.70 -1.89 120.40 128.46 1a7t s VAL 203 Ca 0.04 -0.14 -0.07 0.00 0.00 0.00 0.00 61.98 61.81 1a7t s VAL 203 Cb -0.13 -3.04 0.15 0.00 0.00 0.00 0.00 36.38 33.37 1a7t s VAL 203 CO -0.10 0.39 1.12 -2.16 0.00 0.00 0.00 175.10 174.35 1a7t s PRO 204 N 1.09 1.29 0.27 2.72 0.04 -1.26 -1.07 135.00 138.07 1a7t s PRO 204 Ca 0.04 -0.84 0.07 0.00 0.04 0.00 0.00 61.00 60.30 1a7t s PRO 204 Cb -0.14 -2.15 0.35 0.00 0.04 0.00 0.00 34.50 32.60 1a7t s PRO 204 CO 0.03 -1.81 1.62 0.78 0.04 0.00 0.00 177.00 177.66 1a7t h GLY 205 N -0.95 0.19 -5.55 0.56 0.00 -1.47 -3.41 103.07 92.44 1a7t h GLY 205 Ca -0.39 -0.22 -0.19 0.00 0.00 0.00 0.00 47.33 46.53 1a7t h GLY 205 CO 0.40 0.20 -0.53 0.30 0.00 0.00 0.00 176.54 176.90 1a7t s HIS 206 N -3.84 -0.19 0.00 5.60 3.76 -1.26 -1.19 115.29 118.17 1a7t s HIS 206 Ca -0.03 0.47 0.00 0.00 -0.15 0.00 0.00 55.06 55.35 1a7t s HIS 206 Cb 0.13 0.05 0.00 0.00 1.11 0.00 0.00 32.58 33.86 1a7t s HIS 206 CO 0.78 -0.11 0.00 0.41 -0.85 0.00 0.00 174.74 174.97 1a7t n GLY 207 N 3.20 -3.79 3.77 -2.22 0.00 -1.26 -4.05 105.19 100.84 1a7t n GLY 207 Ca -0.15 -2.08 -0.38 0.00 0.00 0.00 0.00 46.02 43.41 1a7t n GLY 207 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1a7t s ASN 208 N -0.88 6.51 0.88 1.61 0.01 -1.26 -4.78 114.94 117.03 1a7t s ASN 208 Ca 0.00 2.28 -0.12 0.00 -0.71 0.00 0.00 52.86 54.31 1a7t s ASN 208 Cb 0.00 -2.61 0.12 0.00 0.41 0.00 0.00 41.25 39.17 1a7t s ASN 208 CO 0.00 -0.68 1.13 -0.72 -1.51 0.00 0.00 177.10 175.32 1a7t s TYR 209 N -1.48 2.60 0.00 2.20 1.13 -1.26 -4.58 117.35 115.95 1a7t s TYR 209 Ca 0.58 0.94 0.00 0.00 -1.41 0.00 0.00 57.07 57.18 1a7t s TYR 209 Cb -0.29 -3.31 0.00 0.00 -1.10 0.00 0.00 41.96 37.26 1a7t s TYR 209 CO 0.36 -2.21 0.00 0.41 -2.51 0.00 0.00 175.55 171.60 1a7t n GLY 210 N -2.16 3.30 0.00 5.49 0.00 -0.79 -4.98 105.19 106.04 1a7t n GLY 210 Ca 0.07 -0.35 0.00 0.00 0.00 0.00 0.00 46.02 45.73 1a7t n GLY 210 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1a7t n GLY 211 N 0.00 5.83 0.00 -0.02 0.00 -1.26 0.70 105.19 110.44 1a7t n GLY 211 Ca 0.00 -2.09 0.02 0.00 0.00 0.00 0.00 46.02 43.94 1a7t n GLY 211 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1a7t n THR 212 N -0.05 1.44 0.30 2.61 -2.24 -1.26 -2.28 114.28 112.80 1a7t n THR 212 Ca 0.00 0.36 0.19 0.00 -2.27 0.00 0.00 64.05 62.33 1a7t n THR 212 Cb 0.00 -1.31 0.91 0.00 -2.10 0.00 0.00 70.33 67.84 1a7t n THR 212 CO 0.00 0.00 0.00 1.05 -0.57 0.00 0.00 175.07 175.55 1a7t h GLU 213 N 0.00 0.00 -0.04 -0.78 9.09 -1.99 -1.71 114.58 119.15 1a7t h GLU 213 Ca 0.00 0.00 -0.05 0.00 0.05 0.00 0.00 59.36 59.36 1a7t h GLU 213 Cb 0.04 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 27.14 1a7t h GLU 213 CO 0.00 0.01 -0.20 -0.07 0.05 0.00 0.00 179.01 178.80 1a7t h LEU 214 N 0.00 0.06 0.07 3.06 3.38 -1.78 0.32 115.31 120.42 1a7t h LEU 214 Ca -0.00 -0.01 -0.00 0.00 0.09 0.00 0.00 57.88 57.95 1a7t h LEU 214 Cb 0.28 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.02 1a7t h LEU 214 CO 0.00 0.27 -0.03 0.40 0.09 0.00 0.00 178.44 179.16 1a7t h ILE 215 N 0.06 1.14 -0.77 1.22 2.04 -1.54 -0.73 117.51 118.93 1a7t h ILE 215 Ca 0.01 -0.78 -0.03 0.00 1.00 0.00 0.00 64.86 65.06 1a7t h ILE 215 Cb 0.39 1.65 -0.04 0.00 -0.74 0.00 0.00 36.82 38.09 1a7t h ILE 215 CO 0.03 0.19 0.38 -0.33 0.00 0.00 0.00 178.15 178.42 1a7t h GLU 216 N -0.45 1.10 -0.57 2.37 5.08 -1.52 -1.65 114.58 118.94 1a7t h GLU 216 Ca -0.01 -0.16 0.05 0.00 -1.00 0.00 0.00 59.36 58.24 1a7t h GLU 216 Cb 0.39 -0.20 -0.05 0.00 0.50 0.00 0.00 28.75 29.39 1a7t h GLU 216 CO 0.02 0.85 0.31 1.25 -1.00 0.00 0.00 179.01 180.43 1a7t h HIS 217 N 1.08 0.57 -0.35 4.33 2.76 -0.29 0.16 115.15 123.41 1a7t h HIS 217 Ca 0.27 0.02 -0.06 0.00 -2.20 0.00 0.00 60.37 58.40 1a7t h HIS 217 Cb 0.10 -0.17 -0.01 0.00 1.55 0.00 0.00 27.41 28.88 1a7t h HIS 217 CO 0.01 0.28 -0.03 1.15 -1.30 0.00 0.00 177.93 178.04 1a7t h THR 218 N 0.59 1.27 -0.81 6.26 2.02 -0.90 -2.77 112.91 118.56 1a7t h THR 218 Ca 0.25 -1.03 0.06 0.00 0.77 0.00 0.00 66.41 66.46 1a7t h THR 218 Cb 0.14 1.24 -0.05 0.00 -1.74 0.00 0.00 68.15 67.74 1a7t h THR 218 CO -0.16 0.34 0.53 0.50 0.37 0.00 0.00 175.52 177.10 1a7t h LYS 219 N 0.44 0.86 -0.48 6.66 3.64 -0.75 -1.03 116.57 125.91 1a7t h LYS 219 Ca 0.10 -0.05 -0.04 0.00 -1.27 0.00 0.00 60.65 59.38 1a7t h LYS 219 Cb 0.50 -0.20 -0.02 0.00 -0.41 0.00 0.00 32.23 32.10 1a7t h LYS 219 CO 0.02 0.57 0.12 1.96 -2.27 0.00 0.00 179.45 179.86 1a7t h GLN 220 N 0.89 0.76 -0.06 1.90 4.20 -0.75 -1.18 115.11 120.88 1a7t h GLN 220 Ca 0.35 -0.18 -0.00 0.00 0.06 0.00 0.00 58.65 58.88 1a7t h GLN 220 Cb 0.22 -0.10 -0.00 0.00 0.30 0.00 0.00 27.48 27.89 1a7t h GLN 220 CO -0.12 0.74 0.04 0.82 -0.67 0.00 0.00 178.83 179.63 1a7t h ILE 221 N 0.65 1.08 0.02 2.54 2.04 -1.08 0.22 117.51 122.97 1a7t h ILE 221 Ca 0.15 -0.22 -0.00 0.00 1.00 0.00 0.00 64.86 65.79 1a7t h ILE 221 Cb 0.31 1.11 0.00 0.00 -0.74 0.00 0.00 36.82 37.50 1a7t h ILE 221 CO 0.00 0.07 -0.01 0.58 0.00 0.00 0.00 178.15 178.79 1a7t h VAL 222 N 0.02 1.13 -0.38 1.67 2.07 -1.15 -2.39 116.25 117.22 1a7t h VAL 222 Ca 0.02 -0.45 -0.01 0.00 0.82 0.00 0.00 66.70 67.08 1a7t h VAL 222 Cb 0.08 1.44 -0.02 0.00 -1.52 0.00 0.00 31.29 31.27 1a7t h VAL 222 CO -0.00 0.12 0.19 0.78 0.02 0.00 0.00 177.57 178.68 1a7t h ASN 223 N -0.22 0.48 -0.47 0.57 2.35 -1.18 -0.19 115.58 116.92 1a7t h ASN 223 Ca -0.00 -0.11 -0.00 0.00 -0.55 0.00 0.00 56.30 55.64 1a7t h ASN 223 Cb 0.21 -0.12 -0.02 0.00 0.05 0.00 0.00 38.32 38.43 1a7t h ASN 223 CO 0.00 0.45 0.29 1.56 -1.65 0.00 0.00 177.43 178.08 1a7t h GLN 224 N 0.47 0.66 -0.14 0.81 4.20 -0.56 0.18 115.11 120.74 1a7t h GLN 224 Ca 0.13 -0.05 -0.10 0.00 0.06 0.00 0.00 58.65 58.69 1a7t h GLN 224 Cb 0.09 -0.14 0.00 0.00 0.30 0.00 0.00 27.48 27.73 1a7t h GLN 224 CO -0.02 0.47 -0.30 -0.92 -0.67 0.00 0.00 178.83 177.39 1a7t h TYR 225 N 0.67 0.57 -0.46 2.96 3.20 -1.02 -1.84 116.97 121.05 1a7t h TYR 225 Ca 0.18 -0.21 0.02 0.00 3.14 0.00 0.00 58.73 61.86 1a7t h TYR 225 Cb -0.02 -0.10 -0.03 0.00 1.54 0.00 0.00 36.73 38.12 1a7t h TYR 225 CO 0.00 0.92 0.26 0.82 -1.64 0.00 0.00 178.16 178.53 1a7t h ILE 226 N 0.06 1.03 0.02 1.81 2.04 -0.68 -0.76 117.51 121.02 1a7t h ILE 226 Ca 0.00 -0.18 0.00 0.00 1.00 0.00 0.00 64.86 65.69 1a7t h ILE 226 Cb 0.90 0.45 -0.01 0.00 -0.74 0.00 0.00 36.82 37.43 1a7t h ILE 226 CO 0.07 0.10 -0.04 -0.33 0.00 0.00 0.00 178.15 177.95 1a7t h GLU 227 N 0.53 -0.07 0.00 2.37 5.08 -0.58 -2.67 114.58 119.24 1a7t h GLU 227 Ca 0.19 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.55 1a7t h GLU 227 Cb 0.04 0.02 -0.00 0.00 0.50 0.00 0.00 28.75 29.30 1a7t h GLU 227 CO -0.10 -0.05 -0.03 0.77 -1.00 0.00 0.00 179.01 178.60 1a7t h SER 228 N -0.07 0.00 -0.09 1.42 0.02 -1.21 -3.14 113.55 110.48 1a7t h SER 228 Ca 0.01 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.96 1a7t h SER 228 Cb 0.08 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.62 1a7t h SER 228 CO -0.02 0.03 0.00 0.35 -1.14 0.00 0.00 176.83 176.05 1a7t n THR 229 N -3.11 0.09 0.09 -2.27 -2.24 -0.30 -5.09 114.28 101.45 1a7t n THR 229 Ca 0.03 -0.41 0.01 0.00 -2.27 0.00 0.00 64.05 61.41 1a7t n THR 229 Cb 0.50 0.88 0.01 0.00 -2.10 0.00 0.00 70.33 69.62 1a7t n THR 229 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30