#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 0.97 -0.10 2.46 1.01 0.21 -4.94 120.40 120.00 1a7t s VAL 5 Ca 0.00 -0.34 -0.28 0.00 0.00 0.00 0.00 61.98 61.36 1a7t s VAL 5 Cb 0.00 -0.93 -0.02 0.00 0.00 0.00 0.00 36.38 35.43 1a7t s VAL 5 CO 0.00 0.33 0.94 -0.54 0.00 0.00 0.00 175.10 175.83 1a7t s LYS 6 N 1.03 4.42 0.00 2.72 1.02 -1.26 -0.55 119.74 127.12 1a7t s LYS 6 Ca -0.08 1.27 0.20 0.00 0.02 0.00 0.00 55.97 57.37 1a7t s LYS 6 Cb -0.15 -3.53 -0.19 0.00 -0.52 0.00 0.00 37.83 33.45 1a7t s LYS 6 CO -0.00 -0.25 0.86 0.44 -0.92 0.00 0.00 175.35 175.48 1a7t n ILE 7 N 4.43 0.00 -3.83 2.17 -5.35 -0.78 -4.97 119.36 111.02 1a7t n ILE 7 Ca 0.06 -0.07 -0.08 0.00 -0.27 0.00 0.00 62.75 62.40 1a7t n ILE 7 Cb 0.49 1.03 0.01 0.00 -1.74 0.00 0.00 39.64 39.43 1a7t n ILE 7 CO 0.00 0.00 0.00 -0.94 -1.76 0.00 0.00 176.55 173.85 1a7t s SER 8 N -2.79 -0.11 0.48 7.28 1.04 -1.14 -4.98 113.70 113.48 1a7t s SER 8 Ca 0.09 -0.91 0.22 0.00 0.48 0.00 0.00 55.95 55.83 1a7t s SER 8 Cb 0.15 0.80 1.23 0.00 0.10 0.00 0.00 66.02 68.29 1a7t s SER 8 CO 0.77 -1.54 2.01 0.44 0.98 0.00 0.00 173.24 175.90 1a7t h ASP 9 N 2.00 0.00 -0.03 7.02 5.19 -2.03 -3.21 116.42 125.37 1a7t h ASP 9 Ca -0.27 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.14 1a7t h ASP 9 Cb 1.25 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.76 1a7t h ASP 9 CO 0.33 0.17 0.00 -0.90 -3.12 0.00 0.00 179.24 175.72 1a7t n ASP 10 N -3.85 1.76 -4.00 6.45 5.68 -1.26 -5.00 116.55 116.33 1a7t n ASP 10 Ca -0.02 -1.66 -0.22 0.00 -0.50 0.00 0.00 54.79 52.39 1a7t n ASP 10 Cb 0.27 -0.02 -0.16 0.00 -1.14 0.00 0.00 41.12 40.07 1a7t n ASP 10 CO 0.00 0.00 0.00 -0.63 -1.33 0.00 0.00 177.20 175.24 1a7t s ILE 11 N -0.68 0.89 0.12 2.12 1.01 -1.21 -0.77 121.20 122.68 1a7t s ILE 11 Ca 0.03 -0.38 0.06 0.00 0.00 0.00 0.00 60.65 60.36 1a7t s ILE 11 Cb 0.01 -0.81 -0.04 0.00 0.01 0.00 0.00 42.46 41.64 1a7t s ILE 11 CO 0.02 0.29 -0.15 -0.94 0.00 0.00 0.00 174.94 174.15 1a7t s SER 12 N 0.45 2.13 0.01 3.58 1.04 -0.55 -1.86 113.70 118.49 1a7t s SER 12 Ca -0.08 -0.80 0.05 0.00 0.48 0.00 0.00 55.95 55.60 1a7t s SER 12 Cb -0.12 -0.09 -0.02 0.00 0.10 0.00 0.00 66.02 65.90 1a7t s SER 12 CO 0.02 -0.11 -0.16 -0.63 0.98 0.00 0.00 173.24 173.34 1a7t s ILE 13 N -2.00 1.23 -0.09 -1.02 -1.09 0.29 -0.76 121.20 117.77 1a7t s ILE 13 Ca 0.09 -0.80 0.02 0.00 -2.23 0.00 0.00 60.65 57.73 1a7t s ILE 13 Cb -0.06 -1.05 0.01 0.00 -1.58 0.00 0.00 42.46 39.78 1a7t s ILE 13 CO 0.04 0.24 -0.15 -0.89 -1.23 0.00 0.00 174.94 172.95 1a7t s THR 14 N -0.53 1.41 -0.13 2.92 2.01 -0.56 -0.62 115.64 120.14 1a7t s THR 14 Ca 0.05 -0.61 -0.26 0.00 0.31 0.00 0.00 61.69 61.18 1a7t s THR 14 Cb -0.07 -1.29 -0.02 0.00 0.01 0.00 0.00 72.50 71.14 1a7t s THR 14 CO 0.00 0.42 0.85 -1.58 -0.69 0.00 0.00 174.62 173.62 1a7t s GLN 15 N 0.84 4.36 -0.19 4.92 0.74 -1.26 -1.02 119.66 128.05 1a7t s GLN 15 Ca -0.10 1.08 0.17 0.00 0.05 0.00 0.00 55.36 56.56 1a7t s GLN 15 Cb -0.15 -3.54 -0.24 0.00 1.10 0.00 0.00 33.01 30.18 1a7t s GLN 15 CO 0.01 -0.24 0.06 1.28 -0.55 0.00 0.00 175.29 175.85 1a7t n LEU 16 N 4.86 0.09 -3.93 3.68 4.77 -0.53 -4.97 117.00 120.96 1a7t n LEU 16 Ca 0.04 -0.00 -0.12 0.00 -0.03 0.00 0.00 56.01 55.90 1a7t n LEU 16 Cb 0.49 0.44 -0.00 0.00 -2.33 0.00 0.00 43.42 42.02 1a7t n LEU 16 CO 0.49 0.49 0.37 -0.94 -1.33 0.00 0.00 177.39 176.47 1a7t s SER 17 N -5.43 0.48 0.35 -1.43 1.04 -0.98 -4.95 113.70 102.79 1a7t s SER 17 Ca -0.10 -1.35 0.27 0.00 0.48 0.00 0.00 55.95 55.24 1a7t s SER 17 Cb 0.06 0.78 1.14 0.00 0.10 0.00 0.00 66.02 68.10 1a7t s SER 17 CO 0.79 -1.55 1.80 -2.24 0.98 0.00 0.00 173.24 173.02 1a7t h ASP 18 N 2.03 0.00 -0.00 7.02 2.03 -2.00 -3.12 116.42 122.38 1a7t h ASP 18 Ca -0.31 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 55.99 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 0.41 0.00 -0.05 0.29 -1.03 0.00 0.00 179.24 178.86 1a7t n LYS 19 N -2.47 1.01 -4.63 4.15 5.02 -1.26 -4.97 118.16 115.01 1a7t n LYS 19 Ca 0.01 -0.62 -0.24 0.00 -2.02 0.00 0.00 58.31 55.45 1a7t n LYS 19 Cb 0.23 -1.01 -0.16 0.00 -0.02 0.00 0.00 35.03 34.07 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 -0.64 1.14 0.05 -0.18 1.01 -1.18 -1.22 120.40 119.38 1a7t s VAL 20 Ca 0.05 -0.55 0.06 0.00 0.00 0.00 0.00 61.98 61.54 1a7t s VAL 20 Cb 0.04 -0.99 -0.03 0.00 0.00 0.00 0.00 36.38 35.40 1a7t s VAL 20 CO 0.09 0.34 -0.17 -0.31 0.00 0.00 0.00 175.10 175.05 1a7t s TYR 21 N 0.14 1.48 -0.02 5.22 1.51 -0.08 -1.46 117.35 124.15 1a7t s TYR 21 Ca -0.04 -0.38 0.04 0.00 -1.01 0.00 0.00 57.07 55.68 1a7t s TYR 21 Cb -0.10 -0.87 -0.03 0.00 -0.11 0.00 0.00 41.96 40.85 1a7t s TYR 21 CO 0.01 0.08 -0.13 -0.08 -1.11 0.00 0.00 175.55 174.33 1a7t s THR 22 N -0.91 3.20 0.25 -0.71 -1.32 -0.19 0.52 115.64 116.49 1a7t s THR 22 Ca 0.04 -0.82 0.10 0.00 -1.21 0.00 0.00 61.69 59.80 1a7t s THR 22 Cb -0.09 -2.32 -0.05 0.00 -1.51 0.00 0.00 72.50 68.54 1a7t s THR 22 CO 0.02 0.48 -0.11 -0.72 -2.21 0.00 0.00 174.62 172.09 1a7t s TYR 23 N -0.85 2.51 -0.16 9.09 -0.85 -0.48 -1.50 117.35 125.10 1a7t s TYR 23 Ca 0.14 -0.27 0.01 0.00 -0.52 0.00 0.00 57.07 56.43 1a7t s TYR 23 Cb -0.11 -1.13 0.02 0.00 0.38 0.00 0.00 41.96 41.12 1a7t s TYR 23 CO 0.03 0.63 -0.18 0.08 -1.52 0.00 0.00 175.55 174.60 1a7t s VAL 24 N -2.25 1.85 -0.13 -3.49 1.01 0.07 -2.05 120.40 115.40 1a7t s VAL 24 Ca 0.29 -0.82 0.03 0.00 0.00 0.00 0.00 61.98 61.48 1a7t s VAL 24 Cb -0.06 -1.68 0.00 0.00 0.00 0.00 0.00 36.38 34.64 1a7t s VAL 24 CO 0.17 0.51 -0.22 -0.94 0.00 0.00 0.00 175.10 174.61 1a7t s SER 25 N 1.26 3.18 -0.15 3.32 1.04 0.27 -1.49 113.70 121.13 1a7t s SER 25 Ca 0.02 -0.57 -0.11 0.00 0.48 0.00 0.00 55.95 55.77 1a7t s SER 25 Cb -0.13 -1.45 -0.05 0.00 0.10 0.00 0.00 66.02 64.49 1a7t s SER 25 CO -0.10 0.11 0.21 -0.76 0.98 0.00 0.00 173.24 173.68 1a7t s LEU 26 N 0.63 4.28 -0.01 2.42 1.43 0.06 -0.51 118.68 126.99 1a7t s LEU 26 Ca -0.11 0.43 -0.07 0.00 -1.03 0.00 0.00 54.13 53.36 1a7t s LEU 26 Cb -0.16 -2.22 0.00 0.00 0.03 0.00 0.00 46.19 43.84 1a7t s LEU 26 CO 0.02 0.22 0.13 0.00 0.23 0.00 0.00 176.35 176.95 1a7t s ALA 27 N -0.03 -0.31 -0.24 4.21 0.00 -0.87 -4.88 121.76 119.63 1a7t s ALA 27 Ca 0.14 -0.07 -0.23 0.00 0.00 0.00 0.00 51.96 51.80 1a7t s ALA 27 Cb -0.12 0.06 -0.01 0.00 0.00 0.00 0.00 23.12 23.04 1a7t s ALA 27 CO 0.02 -0.18 0.73 -2.00 0.00 0.00 0.00 175.76 174.33 1a7t s GLU 28 N -1.16 4.16 -0.22 0.00 2.56 -1.26 -0.59 118.70 122.18 1a7t s GLU 28 Ca -0.12 0.76 -0.03 0.00 0.00 0.00 0.00 54.97 55.58 1a7t s GLU 28 Cb -0.07 -3.64 0.00 0.00 2.00 0.00 0.00 34.13 32.42 1a7t s GLU 28 CO 0.01 -0.45 -0.07 0.42 -0.56 0.00 0.00 175.26 174.61 1a7t s ILE 29 N 2.64 3.07 0.13 -3.70 1.01 0.28 -4.96 121.20 119.66 1a7t s ILE 29 Ca 0.31 -0.68 -0.34 0.00 0.00 0.00 0.00 60.65 59.94 1a7t s ILE 29 Cb -0.15 -2.42 -0.14 0.00 0.01 0.00 0.00 42.46 39.76 1a7t s ILE 29 CO 0.08 0.39 1.60 1.21 0.00 0.00 0.00 174.94 178.22 1a7t n GLU 30 N 4.74 2.10 -0.31 2.79 4.07 -1.26 -0.02 120.64 132.76 1a7t n GLU 30 Ca -0.18 0.76 0.00 0.00 -0.06 0.00 0.00 57.16 57.68 1a7t n GLU 30 Cb 0.50 -2.53 0.00 0.00 -0.06 0.00 0.00 31.44 29.35 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 3.49 1.35 0.00 8.31 0.00 -1.26 -4.72 105.19 112.36 1a7t n GLY 31 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.20 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 -0.08 -5.14 117.44 118.85 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 2.23 0.15 3.49 6.99 0.00 0.98 -4.84 105.19 114.19 1a7t n GLY 33 Ca 0.00 -1.80 -0.42 0.00 0.00 0.00 0.00 46.02 43.79 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 3.17 -0.21 1.61 -2.45 -1.26 0.99 119.30 121.15 1a7t s MET 34 Ca 0.00 -0.58 -0.08 0.00 -1.25 0.00 0.00 55.69 53.78 1a7t s MET 34 Cb 0.00 -4.19 -0.04 0.00 1.25 0.00 0.00 34.83 31.85 1a7t s MET 34 CO 0.00 -1.87 0.09 0.08 1.05 0.00 0.00 175.02 174.37 1a7t s VAL 35 N 4.54 4.80 -0.17 10.11 1.01 0.24 -4.92 120.40 136.01 1a7t s VAL 35 Ca 0.27 -0.02 -0.22 0.00 0.00 0.00 0.00 61.98 62.01 1a7t s VAL 35 Cb -0.14 -3.20 -0.02 0.00 0.00 0.00 0.00 36.38 33.02 1a7t s VAL 35 CO 0.13 0.40 0.70 -2.16 0.00 0.00 0.00 175.10 174.17 1a7t s PRO 36 N 0.83 4.27 -0.08 2.72 0.04 -1.26 -2.05 135.00 139.46 1a7t s PRO 36 Ca 0.05 0.77 0.03 0.00 0.04 0.00 0.00 61.00 61.88 1a7t s PRO 36 Cb -0.13 -3.56 -0.02 0.00 0.04 0.00 0.00 34.50 30.83 1a7t s PRO 36 CO 0.02 -0.22 -0.16 -1.12 0.04 0.00 0.00 177.00 175.56 1a7t s SER 37 N 1.12 3.80 0.13 6.66 0.01 0.33 -4.44 113.70 121.32 1a7t s SER 37 Ca 0.33 -0.32 0.05 0.00 1.31 0.00 0.00 55.95 57.31 1a7t s SER 37 Cb -0.16 -1.17 -0.04 0.00 0.21 0.00 0.00 66.02 64.86 1a7t s SER 37 CO 0.12 0.25 0.06 0.20 0.41 0.00 0.00 173.24 174.28 1a7t s ASN 38 N -0.16 5.26 0.21 2.44 0.01 -0.27 -0.56 114.94 121.86 1a7t s ASN 38 Ca -0.01 -0.16 -0.02 0.00 -0.71 0.00 0.00 52.86 51.95 1a7t s ASN 38 Cb -0.14 -1.31 0.01 0.00 0.41 0.00 0.00 41.25 40.22 1a7t s ASN 38 CO 0.03 0.12 0.31 0.61 -1.51 0.00 0.00 177.10 176.67 1a7t n GLY 39 N 0.10 2.33 3.05 0.66 0.00 -0.87 -4.88 105.19 105.57 1a7t n GLY 39 Ca -0.09 -1.44 -0.11 0.00 0.00 0.00 0.00 46.02 44.38 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 -2.38 0.50 -0.11 1.61 -1.94 -0.60 -1.39 119.30 114.99 1a7t s MET 40 Ca 0.15 -0.82 0.01 0.00 -1.71 0.00 0.00 55.69 53.32 1a7t s MET 40 Cb -0.01 -0.10 0.02 0.00 2.01 0.00 0.00 34.83 36.75 1a7t s MET 40 CO 0.11 -0.01 -0.14 0.42 -0.01 0.00 0.00 175.02 175.39 1a7t s ILE 41 N -1.93 1.43 -0.09 2.53 1.01 0.19 -0.39 121.20 123.95 1a7t s ILE 41 Ca -0.08 -0.60 0.04 0.00 0.00 0.00 0.00 60.65 60.01 1a7t s ILE 41 Cb -0.06 -1.32 -0.01 0.00 0.01 0.00 0.00 42.46 41.07 1a7t s ILE 41 CO -0.02 0.43 -0.20 -0.69 0.00 0.00 0.00 174.94 174.46 1a7t s VAL 42 N 1.07 2.47 -0.05 2.92 1.01 -0.16 -0.90 120.40 126.75 1a7t s VAL 42 Ca -0.05 -0.90 0.04 0.00 0.00 0.00 0.00 61.98 61.07 1a7t s VAL 42 Cb -0.15 -1.96 -0.00 0.00 0.00 0.00 0.00 36.38 34.28 1a7t s VAL 42 CO -0.03 0.56 -0.17 -0.63 0.00 0.00 0.00 175.10 174.83 1a7t s ILE 43 N 0.01 1.44 -0.18 2.22 1.01 -0.36 -0.60 121.20 124.73 1a7t s ILE 43 Ca -0.07 -0.70 -0.07 0.00 0.00 0.00 0.00 60.65 59.80 1a7t s ILE 43 Cb -0.15 -1.25 0.08 0.00 0.01 0.00 0.00 42.46 41.15 1a7t s ILE 43 CO 0.05 0.42 0.39 0.21 0.00 0.00 0.00 174.94 176.01 1a7t s ASN 44 N 0.17 -0.27 -1.32 3.58 3.04 -0.42 -4.72 114.94 115.00 1a7t s ASN 44 Ca -0.07 0.90 -0.11 0.00 0.04 0.00 0.00 52.86 53.62 1a7t s ASN 44 Cb -0.13 1.05 0.01 0.00 -1.54 0.00 0.00 41.25 40.63 1a7t s ASN 44 CO 0.03 -0.22 0.50 -3.20 -3.04 0.00 0.00 177.10 171.17 1a7t n ASN 45 N 4.97 -2.06 -0.55 -4.21 5.15 -1.26 -1.05 115.26 116.25 1a7t n ASN 45 Ca -0.14 -1.10 -0.07 0.00 -0.60 0.00 0.00 54.58 52.68 1a7t n ASN 45 Cb 0.52 -2.72 -0.03 0.00 -0.53 0.00 0.00 39.78 37.02 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 -4.48 0.00 -4.76 1.20 8.25 -1.26 -4.99 115.22 109.18 1a7t n HIS 46 Ca -0.22 0.00 -0.31 0.00 -0.26 0.00 0.00 57.72 56.93 1a7t n HIS 46 Cb 0.64 -2.22 -0.13 0.00 1.12 0.00 0.00 29.99 29.40 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 -2.41 1.98 0.06 -0.41 -0.21 -0.21 -1.77 119.66 116.69 1a7t s GLN 47 Ca 0.00 -1.02 0.05 0.00 0.02 0.00 0.00 55.36 54.41 1a7t s GLN 47 Cb 0.00 -2.11 -0.03 0.00 1.00 0.00 0.00 33.01 31.87 1a7t s GLN 47 CO 0.00 0.53 -0.14 0.00 -2.12 0.00 0.00 175.29 173.56 1a7t s ALA 48 N -0.87 1.15 -0.02 6.09 0.00 0.27 -1.29 121.76 127.08 1a7t s ALA 48 Ca 0.13 -0.91 0.06 0.00 0.00 0.00 0.00 51.96 51.25 1a7t s ALA 48 Cb -0.10 -0.13 -0.02 0.00 0.00 0.00 0.00 23.12 22.86 1a7t s ALA 48 CO 0.04 0.19 -0.21 0.00 0.00 0.00 0.00 175.76 175.78 1a7t s ALA 49 N -1.08 2.39 -0.17 0.00 0.00 0.23 -1.31 121.76 121.82 1a7t s ALA 49 Ca -0.01 -1.09 -0.04 0.00 0.00 0.00 0.00 51.96 50.83 1a7t s ALA 49 Cb -0.09 -0.72 -0.02 0.00 0.00 0.00 0.00 23.12 22.29 1a7t s ALA 49 CO 0.02 0.54 -0.04 -1.17 0.00 0.00 0.00 175.76 175.12 1a7t s LEU 50 N -0.78 3.18 -0.35 0.00 2.96 -0.09 -0.99 118.68 122.62 1a7t s LEU 50 Ca 0.11 -0.18 -0.06 0.00 -0.22 0.00 0.00 54.13 53.78 1a7t s LEU 50 Cb -0.10 -1.78 0.05 0.00 0.50 0.00 0.00 46.19 44.87 1a7t s LEU 50 CO 0.00 0.13 0.13 -0.76 -1.32 0.00 0.00 176.35 174.53 1a7t s LEU 51 N 0.61 4.50 0.16 -0.68 1.43 0.47 -2.09 118.68 123.09 1a7t s LEU 51 Ca -0.02 -1.31 0.00 0.00 -1.03 0.00 0.00 54.13 51.76 1a7t s LEU 51 Cb -0.14 -1.86 0.00 0.00 0.03 0.00 0.00 46.19 44.21 1a7t s LEU 51 CO 0.02 -0.38 0.00 0.47 0.23 0.00 0.00 176.35 176.70 1a7t n ASP 52 N 4.78 -3.15 -4.75 2.29 9.92 -0.74 -1.56 116.55 123.33 1a7t n ASP 52 Ca -0.11 0.39 -0.23 0.00 -0.53 0.00 0.00 54.79 54.32 1a7t n ASP 52 Cb 0.44 -0.73 -0.06 0.00 -0.64 0.00 0.00 41.12 40.13 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 -2.69 3.31 1.26 -3.53 -4.23 -0.42 -4.64 115.64 104.69 1a7t s THR 53 Ca 0.00 -1.63 -0.17 0.00 -1.18 0.00 0.00 61.69 58.71 1a7t s THR 53 Cb 0.00 -3.04 0.29 0.00 1.34 0.00 0.00 72.50 71.09 1a7t s THR 53 CO 0.00 -0.22 0.79 -2.65 -0.54 0.00 0.00 174.62 172.00 1a7t n PRO 54 N -1.17 -3.09 0.26 3.99 -0.02 -1.26 -3.90 135.00 129.81 1a7t n PRO 54 Ca -0.04 -0.89 0.18 0.00 -2.02 0.00 0.00 63.50 60.73 1a7t n PRO 54 Cb 0.60 -1.99 0.80 0.00 -0.02 0.00 0.00 33.50 32.89 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 -2.91 0.00 -4.36 4.25 2.10 -1.88 -3.05 117.51 111.66 1a7t h ILE 55 Ca -0.55 -0.28 -0.30 0.00 1.08 0.00 0.00 64.86 64.82 1a7t h ILE 55 Cb 1.31 1.19 -0.11 0.00 -1.09 0.00 0.00 36.82 38.13 1a7t h ILE 55 CO 0.40 0.00 -0.33 0.54 -1.08 0.00 0.00 178.15 177.68 1a7t s ASN 56 N -5.17 0.90 0.19 2.19 2.20 -1.26 -4.44 114.94 109.55 1a7t s ASN 56 Ca -0.00 -1.49 -0.02 0.00 -0.94 0.00 0.00 52.86 50.41 1a7t s ASN 56 Cb 0.10 0.58 0.11 0.00 -2.00 0.00 0.00 41.25 40.05 1a7t s ASN 56 CO 0.45 -1.15 1.49 0.44 -2.94 0.00 0.00 177.10 175.40 1a7t h ASP 57 N 2.21 0.55 -0.69 3.54 3.32 -1.88 -2.82 116.42 120.66 1a7t h ASP 57 Ca -0.28 -0.31 -0.06 0.00 0.02 0.00 0.00 57.03 56.39 1a7t h ASP 57 Cb 1.24 -0.16 -0.03 0.00 0.22 0.00 0.00 39.33 40.60 1a7t h ASP 57 CO 0.40 1.02 0.18 0.00 -1.72 0.00 0.00 179.24 179.13 1a7t h ALA 58 N 0.98 0.90 0.00 3.45 0.00 -1.97 0.37 119.26 123.00 1a7t h ALA 58 Ca -0.00 -0.23 -0.13 0.00 0.00 0.00 0.00 54.91 54.54 1a7t h ALA 58 Cb 1.14 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 18.65 1a7t h ALA 58 CO 0.11 0.61 -0.63 1.96 0.00 0.00 0.00 179.25 181.30 1a7t h GLN 59 N 1.02 0.00 -0.47 0.00 4.20 -1.97 -2.39 115.11 115.51 1a7t h GLN 59 Ca 0.22 0.00 -0.12 0.00 0.06 0.00 0.00 58.65 58.80 1a7t h GLN 59 Cb 0.34 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.11 1a7t h GLN 59 CO -0.00 0.63 -0.20 1.15 -0.67 0.00 0.00 178.83 179.74 1a7t h THR 60 N 0.00 1.27 -0.32 -0.54 2.02 -1.20 -2.27 112.91 111.86 1a7t h THR 60 Ca -0.01 -1.34 -0.04 0.00 0.77 0.00 0.00 66.41 65.79 1a7t h THR 60 Cb 1.13 1.12 -0.01 0.00 -1.74 0.00 0.00 68.15 68.64 1a7t h THR 60 CO 0.08 0.46 0.04 -0.08 0.37 0.00 0.00 175.52 176.40 1a7t h GLU 61 N 0.81 0.54 -0.82 6.66 4.81 -0.85 0.19 114.58 125.92 1a7t h GLU 61 Ca 0.11 -0.15 0.06 0.00 -0.13 0.00 0.00 59.36 59.25 1a7t h GLU 61 Cb 0.75 -0.06 -0.06 0.00 0.63 0.00 0.00 28.75 30.01 1a7t h GLU 61 CO 0.06 0.64 0.51 1.98 -0.73 0.00 0.00 179.01 181.47 1a7t h MET 62 N 0.36 0.91 -0.30 1.92 4.05 -1.36 0.13 114.93 120.63 1a7t h MET 62 Ca 0.10 -0.05 -0.12 0.00 -0.28 0.00 0.00 59.70 59.35 1a7t h MET 62 Cb 0.37 -0.20 -0.01 0.00 -0.80 0.00 0.00 31.60 30.95 1a7t h MET 62 CO 0.01 0.60 -0.27 1.25 0.23 0.00 0.00 176.91 178.73 1a7t h LEU 63 N 0.94 0.76 -0.71 3.39 5.85 -1.13 -2.38 115.31 122.03 1a7t h LEU 63 Ca 0.36 -0.46 -0.08 0.00 0.84 0.00 0.00 57.88 58.54 1a7t h LEU 63 Cb 0.15 -0.21 -0.03 0.00 0.37 0.00 0.00 40.66 40.94 1a7t h LEU 63 CO -0.17 1.06 0.10 0.58 -0.34 0.00 0.00 178.44 179.68 1a7t h VAL 64 N 0.47 1.26 -0.48 1.05 2.07 0.04 -1.87 116.25 118.80 1a7t h VAL 64 Ca 0.05 -1.04 0.03 0.00 0.82 0.00 0.00 66.70 66.56 1a7t h VAL 64 Cb 0.83 0.64 -0.04 0.00 -1.52 0.00 0.00 31.29 31.21 1a7t h VAL 64 CO 0.07 0.39 0.27 0.78 0.02 0.00 0.00 177.57 179.10 1a7t h ASN 65 N 1.02 0.42 -0.41 0.57 2.35 -0.73 -1.65 115.58 117.15 1a7t h ASN 65 Ca 0.20 0.01 0.02 0.00 -0.55 0.00 0.00 56.30 55.98 1a7t h ASN 65 Cb 0.44 -0.07 -0.03 0.00 0.05 0.00 0.00 38.32 38.71 1a7t h ASN 65 CO 0.01 0.30 0.24 -0.25 -1.65 0.00 0.00 177.43 176.08 1a7t h TRP 66 N 0.53 0.44 -0.92 1.19 7.01 -1.10 0.30 115.95 123.40 1a7t h TRP 66 Ca 0.20 0.01 0.03 0.00 2.11 0.00 0.00 58.89 61.24 1a7t h TRP 66 Cb 0.05 -0.14 -0.05 0.00 -2.10 0.00 0.00 29.16 26.92 1a7t h TRP 66 CO -0.08 0.25 0.60 0.28 -2.79 0.00 0.00 178.44 176.71 1a7t h VAL 67 N 0.48 1.19 -0.04 2.65 2.07 -0.75 0.69 116.25 122.54 1a7t h VAL 67 Ca 0.16 -0.41 -0.02 0.00 0.82 0.00 0.00 66.70 67.26 1a7t h VAL 67 Cb 0.02 -0.12 -0.00 0.00 -1.52 0.00 0.00 31.29 29.67 1a7t h VAL 67 CO -0.08 0.22 -0.04 0.74 0.02 0.00 0.00 177.57 178.43 1a7t h THR 68 N 1.20 1.39 0.06 2.57 2.02 -0.80 -1.34 112.91 117.99 1a7t h THR 68 Ca 0.36 -1.22 -0.24 0.00 0.77 0.00 0.00 66.41 66.08 1a7t h THR 68 Cb -0.05 2.13 -0.00 0.00 -1.74 0.00 0.00 68.15 68.49 1a7t h THR 68 CO -0.10 0.33 -1.06 0.44 0.37 0.00 0.00 175.52 175.50 1a7t h ASP 69 N -0.38 0.41 0.03 4.18 3.32 -0.88 -1.56 116.42 121.53 1a7t h ASP 69 Ca 0.01 -0.37 -0.38 0.00 0.02 0.00 0.00 57.03 56.30 1a7t h ASP 69 Cb 0.55 -0.13 -0.07 0.00 0.22 0.00 0.00 39.33 39.91 1a7t h ASP 69 CO 0.01 1.22 -2.39 -1.20 -1.72 0.00 0.00 179.24 175.17 1a7t n SER 70 N -3.62 1.14 0.03 6.45 7.64 0.23 -4.43 113.62 121.05 1a7t n SER 70 Ca -0.06 -0.04 0.12 0.00 1.01 0.00 0.00 58.87 59.89 1a7t n SER 70 Cb 0.91 0.15 0.19 0.00 -1.01 0.00 0.00 64.21 64.46 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 -3.06 0.60 -3.78 -3.43 4.77 -0.73 -4.96 117.00 106.42 1a7t n LEU 71 Ca -0.39 0.12 -0.27 0.00 -0.03 0.00 0.00 56.01 55.44 1a7t n LEU 71 Cb 1.06 -0.21 0.04 0.00 -2.33 0.00 0.00 43.42 41.99 1a7t n LEU 71 CO 0.35 0.03 0.12 1.41 -1.33 0.00 0.00 177.39 177.96 1a7t n HIS 72 N -1.84 -2.39 -4.23 -1.77 8.25 -0.59 -4.96 115.22 107.69 1a7t n HIS 72 Ca 0.04 0.93 -0.17 0.00 -0.26 0.00 0.00 57.72 58.25 1a7t n HIS 72 Cb 0.40 -4.38 -0.11 0.00 1.12 0.00 0.00 29.99 27.02 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 -3.37 1.43 -0.19 -1.41 0.00 -1.12 -4.75 121.76 112.36 1a7t s ALA 73 Ca 0.51 -1.28 -0.07 0.00 0.00 0.00 0.00 51.96 51.13 1a7t s ALA 73 Cb -0.24 -0.06 -0.04 0.00 0.00 0.00 0.00 23.12 22.78 1a7t s ALA 73 CO 0.80 0.08 0.04 0.21 0.00 0.00 0.00 175.76 176.89 1a7t s LYS 74 N -2.69 3.86 -0.28 0.00 2.20 -0.73 -3.49 119.74 118.61 1a7t s LYS 74 Ca 0.08 -0.40 -0.29 0.00 -0.36 0.00 0.00 55.97 55.00 1a7t s LYS 74 Cb -0.05 -3.17 0.01 0.00 -1.51 0.00 0.00 37.83 33.11 1a7t s LYS 74 CO 0.03 0.19 1.18 0.08 -0.36 0.00 0.00 175.35 176.47 1a7t s VAL 75 N 0.56 4.36 -0.01 4.02 1.01 -1.26 -0.56 120.40 128.52 1a7t s VAL 75 Ca 0.02 1.58 0.07 0.00 0.00 0.00 0.00 61.98 63.65 1a7t s VAL 75 Cb -0.13 -4.25 -0.10 0.00 0.00 0.00 0.00 36.38 31.89 1a7t s VAL 75 CO 0.02 -0.40 0.14 0.35 0.00 0.00 0.00 175.10 175.21 1a7t n THR 76 N 5.86 0.04 -4.49 3.92 -2.24 -0.43 -4.75 114.28 112.19 1a7t n THR 76 Ca 0.13 -0.17 -0.20 0.00 -2.27 0.00 0.00 64.05 61.54 1a7t n THR 76 Cb 0.46 0.23 -0.15 0.00 -2.10 0.00 0.00 70.33 68.78 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 -2.45 0.93 0.00 4.28 2.01 -1.16 -0.65 115.64 118.60 1a7t s THR 77 Ca -0.03 -0.56 0.01 0.00 0.31 0.00 0.00 61.69 61.42 1a7t s THR 77 Cb 0.04 -0.79 -0.00 0.00 0.01 0.00 0.00 72.50 71.76 1a7t s THR 77 CO 0.28 0.22 -0.03 0.12 -0.69 0.00 0.00 174.62 174.53 1a7t s PHE 78 N -0.35 0.25 -0.06 4.92 5.36 -0.21 -0.91 117.98 126.97 1a7t s PHE 78 Ca 0.04 -0.08 -0.03 0.00 -0.96 0.00 0.00 56.93 55.91 1a7t s PHE 78 Cb -0.05 -0.16 0.04 0.00 -0.34 0.00 0.00 43.02 42.51 1a7t s PHE 78 CO -0.00 -0.01 0.10 0.42 -1.46 0.00 0.00 175.22 174.26 1a7t s ILE 79 N -0.16 -0.16 0.19 3.12 1.01 -0.89 -0.95 121.20 123.36 1a7t s ILE 79 Ca -0.00 0.38 -0.11 0.00 0.00 0.00 0.00 60.65 60.92 1a7t s ILE 79 Cb -0.02 -0.22 -0.07 0.00 0.01 0.00 0.00 42.46 42.16 1a7t s ILE 79 CO -0.00 0.15 0.53 -2.16 0.00 0.00 0.00 174.94 173.45 1a7t s PRO 80 N 2.21 3.84 0.19 2.79 0.04 -1.26 -1.80 135.00 141.02 1a7t s PRO 80 Ca 0.04 0.31 0.04 0.00 0.04 0.00 0.00 61.00 61.44 1a7t s PRO 80 Cb -0.12 -2.78 0.07 0.00 0.04 0.00 0.00 34.50 31.71 1a7t s PRO 80 CO -0.04 0.40 1.43 -0.97 0.04 0.00 0.00 177.00 177.86 1a7t h ASN 81 N 2.98 0.20 -0.64 6.66 -0.73 -1.93 -3.45 115.58 118.66 1a7t h ASN 81 Ca -0.48 -0.15 0.00 0.00 1.87 0.00 0.00 56.30 57.55 1a7t h ASN 81 Cb 1.18 -0.06 0.00 0.00 0.27 0.00 0.00 38.32 39.71 1a7t h ASN 81 CO 0.68 0.92 0.00 0.00 -0.37 0.00 0.00 177.43 178.66 1a7t n HIS 82 N -3.69 -0.64 1.41 0.67 1.44 -1.26 -2.06 115.22 111.09 1a7t n HIS 82 Ca -0.03 0.00 0.13 0.00 -2.01 0.00 0.00 57.72 55.81 1a7t n HIS 82 Cb 0.76 0.00 0.48 0.00 0.12 0.00 0.00 29.99 31.35 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 0.00 0.07 -1.32 -1.40 4.27 -1.26 -4.48 117.44 113.31 1a7t n TRP 83 Ca 0.00 -0.04 -0.32 0.00 -3.89 0.00 0.00 57.50 53.25 1a7t n TRP 83 Cb 0.00 0.00 0.09 0.00 -1.36 0.00 0.00 31.31 30.04 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 -1.93 2.30 0.47 -2.67 3.76 -1.26 -4.70 115.29 111.27 1a7t s HIS 84 Ca 0.36 1.61 0.17 0.00 -0.15 0.00 0.00 55.06 57.05 1a7t s HIS 84 Cb 0.20 -3.22 1.16 0.00 1.11 0.00 0.00 32.58 31.83 1a7t s HIS 84 CO 0.31 -2.12 2.02 0.78 -0.85 0.00 0.00 174.74 174.87 1a7t h GLY 85 N -0.78 0.32 0.04 -2.22 0.00 -1.93 -1.22 103.07 97.28 1a7t h GLY 85 Ca -0.45 -0.10 0.00 0.00 0.00 0.00 0.00 47.33 46.78 1a7t h GLY 85 CO 0.50 0.06 0.00 2.09 0.00 0.00 0.00 176.54 179.19 1a7t n ASP 86 N -4.46 0.00 0.00 0.19 5.75 -1.26 -0.74 116.55 116.03 1a7t n ASP 86 Ca 0.07 -1.93 0.00 0.00 -0.01 0.00 0.00 54.79 52.93 1a7t n ASP 86 Cb 0.38 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.47 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 -2.53 1.25 0.05 0.00 -5.35 -0.85 -1.31 119.36 110.62 1a7t n ILE 88 Ca 0.00 -1.49 0.13 0.00 -0.27 0.00 0.00 62.75 61.11 1a7t n ILE 88 Cb 0.48 0.05 0.59 0.00 -1.74 0.00 0.00 39.64 39.03 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 0.23 -2.16 3.28 0.00 -1.01 -2.04 103.07 101.37 1a7t h GLY 89 Ca 0.00 -0.07 0.00 0.00 0.00 0.00 0.00 47.33 47.26 1a7t h GLY 89 CO 0.00 0.05 0.00 0.61 0.00 0.00 0.00 176.54 177.20 1a7t n GLY 90 N -1.56 3.32 0.27 4.60 0.00 -1.15 -4.04 105.19 106.62 1a7t n GLY 90 Ca 0.06 -0.84 0.05 0.00 0.00 0.00 0.00 46.02 45.28 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 2.72 0.21 -0.74 0.99 5.85 -1.71 -2.56 115.31 120.07 1a7t h LEU 91 Ca 0.00 -0.02 0.02 0.00 0.84 0.00 0.00 57.88 58.72 1a7t h LEU 91 Cb 1.37 -0.05 -0.04 0.00 0.37 0.00 0.00 40.66 42.31 1a7t h LEU 91 CO 0.22 0.23 0.48 1.23 -0.34 0.00 0.00 178.44 180.26 1a7t h GLY 92 N 0.43 1.05 0.94 3.75 0.00 -1.83 0.14 103.07 107.54 1a7t h GLY 92 Ca 0.06 -0.37 -0.00 0.00 0.00 0.00 0.00 47.33 47.01 1a7t h GLY 92 CO -0.00 0.35 -0.05 -1.82 0.00 0.00 0.00 176.54 175.02 1a7t h TYR 93 N 0.97 -0.13 -0.70 5.60 3.20 -1.83 -2.49 116.97 121.60 1a7t h TYR 93 Ca 0.28 -0.00 0.08 0.00 3.14 0.00 0.00 58.73 62.23 1a7t h TYR 93 Cb -0.06 0.04 -0.06 0.00 1.54 0.00 0.00 36.73 38.18 1a7t h TYR 93 CO -0.03 -0.02 0.37 -0.07 -1.64 0.00 0.00 178.16 176.77 1a7t h LEU 94 N -0.20 0.51 -0.88 2.82 3.38 -1.36 -2.71 115.31 116.85 1a7t h LEU 94 Ca -0.01 0.05 -0.10 0.00 0.09 0.00 0.00 57.88 57.91 1a7t h LEU 94 Cb 0.16 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 40.85 1a7t h LEU 94 CO 0.02 0.31 -0.22 1.56 0.09 0.00 0.00 178.44 180.20 1a7t h GLN 95 N 0.64 0.57 0.00 1.13 4.20 -0.79 -1.38 115.11 119.48 1a7t h GLN 95 Ca 0.33 -0.21 -0.02 0.00 0.06 0.00 0.00 58.65 58.81 1a7t h GLN 95 Cb 0.29 -0.04 -0.00 0.00 0.30 0.00 0.00 27.48 28.04 1a7t h GLN 95 CO -0.23 0.76 -0.07 0.00 -0.67 0.00 0.00 178.83 178.61 1a7t h ARG 96 N 0.51 0.00 -0.08 1.46 3.08 -1.25 -1.00 114.38 117.10 1a7t h ARG 96 Ca 0.08 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.13 1a7t h ARG 96 Cb 0.66 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.71 1a7t h ARG 96 CO 0.05 0.07 0.00 1.63 -1.07 0.00 0.00 179.97 180.65 1a7t n LYS 97 N -3.25 1.44 -1.00 0.04 4.76 -0.57 -4.94 118.16 114.63 1a7t n LYS 97 Ca -0.00 -0.66 -0.00 0.00 -2.87 0.00 0.00 58.31 54.78 1a7t n LYS 97 Cb 0.29 -1.39 -0.00 0.00 -1.84 0.00 0.00 35.03 32.09 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 1.03 0.47 3.77 0.72 0.00 -0.38 -5.02 105.19 105.78 1a7t n GLY 98 Ca 0.17 -0.11 -0.40 0.00 0.00 0.00 0.00 46.02 45.68 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 -1.96 2.87 -0.03 1.61 1.01 -0.90 -4.99 120.40 118.02 1a7t s VAL 99 Ca 0.00 0.82 -0.20 0.00 0.00 0.00 0.00 61.98 62.60 1a7t s VAL 99 Cb 0.00 -3.50 -0.05 0.00 0.00 0.00 0.00 36.38 32.83 1a7t s VAL 99 CO 0.00 0.16 0.57 -1.10 0.00 0.00 0.00 175.10 174.73 1a7t s GLN 100 N -1.95 4.31 -0.05 2.72 -1.52 0.17 -4.68 119.66 118.66 1a7t s GLN 100 Ca 0.52 0.68 0.03 0.00 -1.95 0.00 0.00 55.36 54.63 1a7t s GLN 100 Cb -0.37 -3.36 -0.03 0.00 -0.22 0.00 0.00 33.01 29.03 1a7t s GLN 100 CO 0.48 0.32 -0.12 -1.12 -0.25 0.00 0.00 175.29 174.60 1a7t s SER 101 N 0.00 4.23 -0.06 5.90 0.01 -1.26 -1.05 113.70 121.48 1a7t s SER 101 Ca 0.30 -0.15 0.04 0.00 1.31 0.00 0.00 55.95 57.45 1a7t s SER 101 Cb -0.17 -0.94 0.00 0.00 0.21 0.00 0.00 66.02 65.11 1a7t s SER 101 CO 0.16 0.34 -0.17 -0.31 0.41 0.00 0.00 173.24 173.67 1a7t s TYR 102 N -0.78 1.79 0.18 2.43 1.51 -0.12 -1.74 117.35 120.62 1a7t s TYR 102 Ca 0.12 -0.61 -0.20 0.00 -1.01 0.00 0.00 57.07 55.38 1a7t s TYR 102 Cb -0.11 -1.23 0.05 0.00 -0.11 0.00 0.00 41.96 40.56 1a7t s TYR 102 CO 0.01 -0.25 0.56 0.00 -1.11 0.00 0.00 175.55 174.77 1a7t s ALA 103 N 0.29 -1.24 0.41 3.71 0.00 -0.44 -4.05 121.76 120.44 1a7t s ALA 103 Ca -0.10 0.09 -0.26 0.00 0.00 0.00 0.00 51.96 51.68 1a7t s ALA 103 Cb -0.14 0.84 -0.10 0.00 0.00 0.00 0.00 23.12 23.72 1a7t s ALA 103 CO 0.04 -0.79 1.41 -1.71 0.00 0.00 0.00 175.76 174.70 1a7t n ASN 104 N -0.35 3.28 0.20 0.00 2.85 -1.26 -1.53 115.26 118.45 1a7t n ASN 104 Ca -0.13 1.16 0.13 0.00 -0.11 0.00 0.00 54.58 55.63 1a7t n ASN 104 Cb 0.63 -1.58 0.73 0.00 1.24 0.00 0.00 39.78 40.80 1a7t n ASN 104 CO 0.00 0.00 0.00 -0.61 -2.11 0.00 0.00 177.26 174.54 1a7t h GLN 105 N 2.49 0.00 -0.06 1.20 5.75 -1.09 -0.56 115.11 122.84 1a7t h GLN 105 Ca -0.50 0.00 -0.11 0.00 -0.15 0.00 0.00 58.65 57.90 1a7t h GLN 105 Cb 1.27 0.00 -0.01 0.00 1.07 0.00 0.00 27.48 29.80 1a7t h GLN 105 CO 0.62 0.00 -0.45 0.52 -2.65 0.00 0.00 178.83 176.87 1a7t h MET 106 N 0.00 0.14 -0.33 1.69 2.86 -1.88 -1.72 114.93 115.69 1a7t h MET 106 Ca 0.07 -0.07 -0.15 0.00 -2.06 0.00 0.00 59.70 57.49 1a7t h MET 106 Cb 0.30 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 31.96 1a7t h MET 106 CO -0.00 0.56 -0.39 1.15 1.06 0.00 0.00 176.91 179.29 1a7t h THR 107 N 0.11 1.28 -0.33 2.22 2.02 -1.41 -1.49 112.91 115.31 1a7t h THR 107 Ca 0.01 -1.57 -0.01 0.00 0.77 0.00 0.00 66.41 65.61 1a7t h THR 107 Cb 0.84 1.51 -0.02 0.00 -1.74 0.00 0.00 68.15 68.75 1a7t h THR 107 CO 0.06 0.51 0.17 0.40 0.37 0.00 0.00 175.52 177.04 1a7t h ILE 108 N 0.63 1.15 -0.88 3.11 2.04 -1.22 0.78 117.51 123.13 1a7t h ILE 108 Ca 0.04 -0.41 0.00 0.00 1.00 0.00 0.00 64.86 65.49 1a7t h ILE 108 Cb 0.98 0.81 -0.04 0.00 -0.74 0.00 0.00 36.82 37.84 1a7t h ILE 108 CO 0.09 0.16 0.56 0.44 0.00 0.00 0.00 178.15 179.40 1a7t h ASP 109 N 0.41 1.04 -0.35 1.72 3.32 -1.23 -1.96 116.42 119.37 1a7t h ASP 109 Ca 0.12 -0.05 -0.13 0.00 0.02 0.00 0.00 57.03 56.99 1a7t h ASP 109 Cb 0.09 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 39.37 1a7t h ASP 109 CO -0.02 0.78 -0.27 -0.07 -1.72 0.00 0.00 179.24 177.95 1a7t h LEU 110 N 1.21 0.89 -0.68 1.55 3.38 -0.98 -2.34 115.31 118.33 1a7t h LEU 110 Ca 0.32 -0.35 -0.03 0.00 0.09 0.00 0.00 57.88 57.91 1a7t h LEU 110 Cb -0.09 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 40.38 1a7t h LEU 110 CO -0.06 1.10 0.31 0.00 0.09 0.00 0.00 178.44 179.88 1a7t h ALA 111 N 0.95 0.89 -0.31 1.53 0.00 -0.55 0.34 119.26 122.11 1a7t h ALA 111 Ca 0.09 -0.16 -0.03 0.00 0.00 0.00 0.00 54.91 54.81 1a7t h ALA 111 Cb 0.82 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 18.32 1a7t h ALA 111 CO 0.07 0.47 0.08 0.87 0.00 0.00 0.00 179.25 180.74 1a7t h LYS 112 N 0.96 0.49 0.00 0.00 1.57 -1.32 -1.00 116.57 117.26 1a7t h LYS 112 Ca 0.23 -0.11 -0.07 0.00 -1.87 0.00 0.00 60.65 58.83 1a7t h LYS 112 Cb 0.16 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.39 1a7t h LYS 112 CO -0.03 0.55 -0.34 1.49 -0.57 0.00 0.00 179.45 180.56 1a7t h GLU 113 N 0.33 0.00 -0.61 3.15 4.81 -1.19 -3.20 114.58 117.87 1a7t h GLU 113 Ca 0.10 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.33 1a7t h GLU 113 Cb 0.28 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.66 1a7t h GLU 113 CO 0.00 0.34 0.00 1.63 -0.73 0.00 0.00 179.01 180.25 1a7t n LYS 114 N -3.98 3.81 -3.65 1.92 5.02 0.09 -4.96 118.16 116.41 1a7t n LYS 114 Ca -0.02 -2.89 -0.24 0.00 -2.02 0.00 0.00 58.31 53.14 1a7t n LYS 114 Cb 0.40 -1.91 0.07 0.00 -0.02 0.00 0.00 35.03 33.56 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 0.94 -0.47 3.77 0.72 0.00 -0.97 -5.03 105.19 104.14 1a7t n GLY 115 Ca 0.25 0.20 -0.23 0.00 0.00 0.00 0.00 46.02 46.24 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 -7.05 3.25 0.44 0.99 1.43 -0.42 -5.06 118.68 112.26 1a7t s LEU 116 Ca 0.42 -0.87 -0.25 0.00 -1.03 0.00 0.00 54.13 52.40 1a7t s LEU 116 Cb -0.20 -1.72 -0.08 0.00 0.03 0.00 0.00 46.19 44.22 1a7t s LEU 116 CO 0.76 -0.46 1.41 -2.84 0.23 0.00 0.00 176.35 175.45 1a7t s PRO 117 N -3.93 3.74 -0.18 1.29 0.02 -1.26 -4.54 135.00 130.14 1a7t s PRO 117 Ca 0.41 2.38 -0.02 0.00 0.02 0.00 0.00 61.00 63.80 1a7t s PRO 117 Cb -0.00 -2.68 -0.01 0.00 0.02 0.00 0.00 34.50 31.83 1a7t s PRO 117 CO 0.24 -0.76 -0.10 0.08 -0.33 0.00 0.00 177.00 176.13 1a7t s VAL 118 N -1.21 3.03 0.53 3.83 1.01 -1.26 -4.88 120.40 121.46 1a7t s VAL 118 Ca 0.60 -0.63 -0.22 0.00 0.00 0.00 0.00 61.98 61.73 1a7t s VAL 118 Cb -0.43 -2.33 -0.05 0.00 0.00 0.00 0.00 36.38 33.57 1a7t s VAL 118 CO 0.55 0.48 1.35 -2.65 0.00 0.00 0.00 175.10 174.83 1a7t n PRO 119 N 4.30 1.73 0.02 2.72 -0.02 -1.26 -4.98 135.00 137.51 1a7t n PRO 119 Ca -0.19 0.63 -0.10 0.00 -2.02 0.00 0.00 63.50 61.82 1a7t n PRO 119 Cb 0.51 -2.56 -0.13 0.00 -0.02 0.00 0.00 33.50 31.30 1a7t n PRO 119 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 1a7t h GLU 120 N 1.51 0.06 -5.21 -0.52 3.07 -1.97 -3.46 114.58 108.06 1a7t h GLU 120 Ca -0.51 -0.10 -0.65 0.00 -0.50 0.00 0.00 59.36 57.60 1a7t h GLU 120 Cb 1.30 0.04 -0.25 0.00 -0.84 0.00 0.00 28.75 29.00 1a7t h GLU 120 CO 0.57 0.81 -0.72 -1.01 -1.40 0.00 0.00 179.01 177.27 1a7t s HIS 121 N -2.64 2.93 0.27 4.33 3.76 -0.71 -5.05 115.29 118.18 1a7t s HIS 121 Ca -0.04 -0.60 0.11 0.00 -0.15 0.00 0.00 55.06 54.38 1a7t s HIS 121 Cb 0.08 -1.97 -0.05 0.00 1.11 0.00 0.00 32.58 31.76 1a7t s HIS 121 CO 0.83 -0.25 -0.12 0.20 -0.85 0.00 0.00 174.74 174.56 1a7t s GLY 122 N 0.70 1.78 0.00 -2.22 0.00 -1.26 -1.32 107.32 105.00 1a7t s GLY 122 Ca -0.03 -1.76 -0.04 0.00 0.00 0.00 0.00 44.72 42.89 1a7t s GLY 122 CO 0.02 -1.83 0.07 -0.11 0.00 0.00 0.00 173.10 171.24 1a7t s PHE 123 N -2.37 0.10 -0.23 1.90 -0.12 -0.59 -4.83 117.98 111.85 1a7t s PHE 123 Ca 0.30 -0.23 0.04 0.00 -0.05 0.00 0.00 56.93 56.99 1a7t s PHE 123 Cb -0.06 -0.09 -0.19 0.00 -0.63 0.00 0.00 43.02 42.05 1a7t s PHE 123 CO 0.17 -0.21 -0.09 0.25 -0.05 0.00 0.00 175.22 175.28 1a7t n THR 124 N 1.75 1.51 0.00 -4.49 -2.24 -1.26 -0.47 114.28 109.08 1a7t n THR 124 Ca -0.22 -0.63 0.00 0.00 -2.27 0.00 0.00 64.05 60.93 1a7t n THR 124 Cb 0.56 -1.29 0.00 0.00 -2.10 0.00 0.00 70.33 67.50 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 -3.20 3.70 -3.59 3.42 8.00 -1.26 -4.76 116.55 118.86 1a7t n ASP 125 Ca -0.42 0.00 -0.11 0.00 0.71 0.00 0.00 54.79 54.98 1a7t n ASP 125 Cb 1.03 0.00 -0.04 0.00 -0.02 0.00 0.00 41.12 42.09 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 -3.92 -0.34 -0.25 -2.24 1.04 -1.26 -0.78 113.70 105.95 1a7t s SER 126 Ca 0.00 -0.26 -0.21 0.00 0.48 0.00 0.00 55.95 55.96 1a7t s SER 126 Cb 0.00 0.54 0.07 0.00 0.10 0.00 0.00 66.02 66.72 1a7t s SER 126 CO 0.00 -0.93 0.65 -0.22 0.98 0.00 0.00 173.24 173.72 1a7t s LEU 127 N -2.80 -0.59 -0.24 2.42 2.96 0.08 -4.97 118.68 115.52 1a7t s LEU 127 Ca 0.04 1.35 -0.07 0.00 -0.22 0.00 0.00 54.13 55.22 1a7t s LEU 127 Cb 0.00 2.25 -0.03 0.00 0.50 0.00 0.00 46.19 48.91 1a7t s LEU 127 CO -0.10 -0.23 0.07 -0.89 -1.32 0.00 0.00 176.35 173.88 1a7t s THR 128 N 0.68 4.37 -0.20 3.68 2.01 -1.26 0.44 115.64 125.36 1a7t s THR 128 Ca -0.03 -0.15 -0.08 0.00 0.31 0.00 0.00 61.69 61.74 1a7t s THR 128 Cb -0.05 -3.04 -0.04 0.00 0.01 0.00 0.00 72.50 69.38 1a7t s THR 128 CO -0.04 0.35 0.08 -0.69 -0.69 0.00 0.00 174.62 173.62 1a7t s VAL 129 N 1.49 4.76 -0.24 3.82 1.01 -0.03 -4.93 120.40 126.28 1a7t s VAL 129 Ca 0.06 -0.04 -0.13 0.00 0.00 0.00 0.00 61.98 61.87 1a7t s VAL 129 Cb -0.15 -3.17 -0.04 0.00 0.00 0.00 0.00 36.38 33.01 1a7t s VAL 129 CO 0.04 0.42 0.27 -0.55 0.00 0.00 0.00 175.10 175.28 1a7t s SER 130 N 0.71 6.22 -0.91 3.32 0.15 -1.26 -0.85 113.70 121.08 1a7t s SER 130 Ca 0.04 0.24 -0.11 0.00 0.70 0.00 0.00 55.95 56.82 1a7t s SER 130 Cb -0.13 -2.16 0.23 0.00 -1.71 0.00 0.00 66.02 62.25 1a7t s SER 130 CO 0.02 -0.04 0.86 -0.22 1.20 0.00 0.00 173.24 175.05 1a7t s LEU 131 N 1.42 6.43 -1.44 3.45 2.96 0.55 -4.52 118.68 127.54 1a7t s LEU 131 Ca 0.12 -3.07 -0.09 0.00 -0.22 0.00 0.00 54.13 50.87 1a7t s LEU 131 Cb -0.15 -2.16 0.05 0.00 0.50 0.00 0.00 46.19 44.43 1a7t s LEU 131 CO 0.07 -0.44 0.69 -0.67 -1.32 0.00 0.00 176.35 174.69 1a7t n ASP 132 N 3.41 -4.96 0.00 3.68 2.03 -1.26 -2.44 116.55 117.01 1a7t n ASP 132 Ca 0.17 -0.46 0.00 0.00 0.52 0.00 0.00 54.79 55.03 1a7t n ASP 132 Cb 0.43 -4.02 0.00 0.00 -0.72 0.00 0.00 41.12 36.82 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 -1.47 1.64 3.66 0.27 0.00 -1.26 -4.92 105.19 103.12 1a7t n GLY 133 Ca -0.03 -0.33 -0.42 0.00 0.00 0.00 0.00 46.02 45.24 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 0.00 4.28 0.07 1.61 0.00 -1.02 -5.01 119.30 119.23 1a7t s MET 134 Ca 0.00 1.06 -0.29 0.00 0.00 0.00 0.00 55.69 56.46 1a7t s MET 134 Cb 0.00 -3.59 -0.05 0.00 0.00 0.00 0.00 34.83 31.19 1a7t s MET 134 CO 0.00 -0.39 0.92 -1.25 0.00 0.00 0.00 175.02 174.30 1a7t s PRO 135 N 2.37 4.62 -0.33 4.11 0.04 -1.26 -0.33 135.00 144.22 1a7t s PRO 135 Ca 0.39 1.35 -0.02 0.00 0.04 0.00 0.00 61.00 62.76 1a7t s PRO 135 Cb -0.16 -3.39 0.07 0.00 0.04 0.00 0.00 34.50 31.06 1a7t s PRO 135 CO 0.11 0.17 0.06 -0.51 0.04 0.00 0.00 177.00 176.88 1a7t s LEU 136 N 0.20 4.35 -0.30 -3.56 1.43 -0.03 -4.38 118.68 116.40 1a7t s LEU 136 Ca 0.46 -1.55 -0.16 0.00 -1.03 0.00 0.00 54.13 51.85 1a7t s LEU 136 Cb -0.22 -1.74 -0.02 0.00 0.03 0.00 0.00 46.19 44.23 1a7t s LEU 136 CO 0.28 -0.35 0.42 -1.10 0.23 0.00 0.00 176.35 175.83 1a7t s GLN 137 N 1.20 3.84 -0.09 1.70 -0.21 0.18 -0.85 119.66 125.43 1a7t s GLN 137 Ca -0.00 -0.06 -0.04 0.00 0.02 0.00 0.00 55.36 55.28 1a7t s GLN 137 Cb -0.21 -3.72 -0.04 0.00 1.00 0.00 0.00 33.01 30.05 1a7t s GLN 137 CO -0.02 -0.42 0.07 0.00 -2.12 0.00 0.00 175.29 172.80 1a7t s TYR 139 N -0.98 0.65 -0.28 0.00 2.02 -0.70 -0.75 117.35 117.31 1a7t s TYR 139 Ca 0.15 -0.36 -0.05 0.00 -0.37 0.00 0.00 57.07 56.44 1a7t s TYR 139 Cb -0.12 -0.39 0.02 0.00 -0.40 0.00 0.00 41.96 41.07 1a7t s TYR 139 CO 0.04 -0.05 0.02 -0.47 -1.57 0.00 0.00 175.55 173.53 1a7t s TYR 140 N -0.95 3.12 -0.62 2.71 5.04 0.04 -1.69 117.35 124.99 1a7t s TYR 140 Ca -0.05 -1.23 0.11 0.00 -2.44 0.00 0.00 57.07 53.45 1a7t s TYR 140 Cb -0.07 -2.18 0.31 0.00 0.35 0.00 0.00 41.96 40.37 1a7t s TYR 140 CO 0.00 -0.64 1.25 1.28 -1.34 0.00 0.00 175.55 176.10 1a7t n LEU 141 N 4.78 2.96 0.00 6.97 4.77 -1.26 -4.87 117.00 130.36 1a7t n LEU 141 Ca -0.15 -2.24 0.00 0.00 -0.03 0.00 0.00 56.01 53.59 1a7t n LEU 141 Cb 0.47 -0.27 0.00 0.00 -2.33 0.00 0.00 43.42 41.30 1a7t n LEU 141 CO 0.30 0.69 0.00 0.61 -1.33 0.00 0.00 177.39 177.65 1a7t n GLY 142 N 0.10 2.72 3.82 -0.72 0.00 -1.26 -4.65 105.19 105.20 1a7t n GLY 142 Ca 0.12 -2.03 -0.31 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 1.65 0.00 -0.02 0.00 -1.26 -4.70 107.32 102.99 1a7t s GLY 143 Ca 0.00 -0.07 0.00 0.00 0.00 0.00 0.00 44.72 44.65 1a7t s GLY 143 CO 0.00 0.29 0.00 0.61 0.00 0.00 0.00 173.10 174.00 1a7t n GLY 144 N -2.16 1.74 0.30 0.20 0.00 -1.26 -3.17 105.19 100.84 1a7t n GLY 144 Ca 0.07 0.30 0.07 0.00 0.00 0.00 0.00 46.02 46.46 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 0.29 -3.96 1.61 -0.00 -1.86 0.22 115.15 111.45 1a7t h HIS 145 Ca 0.00 0.01 -0.23 0.00 -0.00 0.00 0.00 60.37 60.15 1a7t h HIS 145 Cb 0.00 -0.10 -0.19 0.00 -0.00 0.00 0.00 27.41 27.12 1a7t h HIS 145 CO 0.00 0.17 -0.72 0.00 -0.00 0.00 0.00 177.93 177.39 1a7t s ALA 146 N -5.30 0.56 -0.39 5.26 0.00 -1.26 -2.47 121.76 118.15 1a7t s ALA 146 Ca -0.07 -0.88 0.26 0.00 0.00 0.00 0.00 51.96 51.27 1a7t s ALA 146 Cb 0.18 0.11 0.99 0.00 0.00 0.00 0.00 23.12 24.39 1a7t s ALA 146 CO 0.71 -0.12 1.78 1.79 0.00 0.00 0.00 175.76 179.92 1a7t h THR 147 N 4.12 0.00 -0.24 0.00 1.35 -1.79 -3.10 112.91 113.25 1a7t h THR 147 Ca -0.35 -0.41 0.00 0.00 -0.55 0.00 0.00 66.41 65.10 1a7t h THR 147 Cb 1.19 1.28 0.00 0.00 -1.73 0.00 0.00 68.15 68.89 1a7t h THR 147 CO 0.47 0.00 0.00 -0.90 -0.25 0.00 0.00 175.52 174.84 1a7t n ASP 148 N -2.51 2.65 -4.78 5.36 5.75 -1.26 -4.30 116.55 117.46 1a7t n ASP 148 Ca 0.03 -1.80 -0.41 0.00 -0.01 0.00 0.00 54.79 52.60 1a7t n ASP 148 Cb 0.31 -0.15 -0.00 0.00 -1.03 0.00 0.00 41.12 40.25 1a7t n ASP 148 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 1a7t s ASN 149 N -1.05 6.37 0.51 -1.12 6.03 -1.17 -4.76 114.94 119.75 1a7t s ASN 149 Ca 0.22 3.01 0.02 0.00 -1.03 0.00 0.00 52.86 55.08 1a7t s ASN 149 Cb 0.13 -2.67 -0.01 0.00 -3.03 0.00 0.00 41.25 35.67 1a7t s ASN 149 CO 0.18 -0.85 0.03 0.27 -2.03 0.00 0.00 177.10 174.70 1a7t s ILE 150 N -1.13 1.21 0.18 0.54 -4.36 -0.88 -4.59 121.20 112.18 1a7t s ILE 150 Ca 0.53 -1.96 0.07 0.00 -0.26 0.00 0.00 60.65 59.03 1a7t s ILE 150 Cb -0.46 -2.17 -0.04 0.00 1.25 0.00 0.00 42.46 41.04 1a7t s ILE 150 CO 0.62 0.00 -0.15 0.68 0.24 0.00 0.00 174.94 176.33 1a7t s VAL 151 N -2.87 1.67 -0.12 8.37 -7.23 -0.68 -4.75 120.40 114.79 1a7t s VAL 151 Ca 0.08 -2.07 0.01 0.00 -1.81 0.00 0.00 61.98 58.20 1a7t s VAL 151 Cb 0.01 -1.91 0.02 0.00 0.56 0.00 0.00 36.38 35.06 1a7t s VAL 151 CO 0.04 -0.51 -0.16 -0.69 -0.31 0.00 0.00 175.10 173.48 1a7t s VAL 152 N -2.66 1.57 -0.14 1.32 1.01 -0.70 -1.73 120.40 119.08 1a7t s VAL 152 Ca 0.19 -0.67 -0.03 0.00 0.00 0.00 0.00 61.98 61.47 1a7t s VAL 152 Cb -0.02 -1.44 -0.03 0.00 0.00 0.00 0.00 36.38 34.89 1a7t s VAL 152 CO 0.06 0.46 -0.06 0.86 0.00 0.00 0.00 175.10 176.42 1a7t s TRP 153 N 1.09 2.98 -0.62 5.22 -0.11 0.10 -0.81 118.94 126.81 1a7t s TRP 153 Ca -0.04 -0.31 -0.02 0.00 1.22 0.00 0.00 56.10 56.95 1a7t s TRP 153 Cb -0.14 -1.91 0.16 0.00 -1.50 0.00 0.00 33.47 30.08 1a7t s TRP 153 CO -0.04 -0.01 0.43 -0.51 -4.62 0.00 0.00 176.95 172.20 1a7t s LEU 154 N 0.20 5.18 0.35 5.86 1.43 -0.60 -0.64 118.68 130.45 1a7t s LEU 154 Ca -0.03 -2.87 0.08 0.00 -1.03 0.00 0.00 54.13 50.28 1a7t s LEU 154 Cb -0.14 -1.84 0.79 0.00 0.03 0.00 0.00 46.19 45.03 1a7t s LEU 154 CO 0.03 -0.36 1.88 1.55 0.23 0.00 0.00 176.35 179.68 1a7t h PRO 155 N 6.99 0.70 0.00 1.29 0.13 -1.86 -0.66 132.00 138.58 1a7t h PRO 155 Ca -0.02 -0.04 0.00 0.00 -0.87 0.00 0.00 66.00 65.07 1a7t h PRO 155 Cb 0.95 -0.16 0.00 0.00 0.13 0.00 0.00 31.00 31.92 1a7t h PRO 155 CO 0.71 0.46 0.00 1.79 -0.23 0.00 0.00 178.00 180.73 1a7t h THR 156 N 0.72 0.00 -0.00 1.56 1.35 -1.94 -3.24 112.91 111.36 1a7t h THR 156 Ca 0.43 -0.54 0.00 0.00 -0.55 0.00 0.00 66.41 65.75 1a7t h THR 156 Cb 0.65 1.51 0.00 0.00 -1.73 0.00 0.00 68.15 68.58 1a7t h THR 156 CO -0.19 0.00 -0.14 -0.62 -0.25 0.00 0.00 175.52 174.32 1a7t n GLU 157 N -2.98 2.45 -3.94 4.72 -0.58 -0.67 -4.99 120.64 114.64 1a7t n GLU 157 Ca 0.01 -0.46 -0.30 0.00 -0.42 0.00 0.00 57.16 56.00 1a7t n GLU 157 Cb 0.33 -0.95 0.02 0.00 -0.57 0.00 0.00 31.44 30.26 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 -0.37 -3.78 -4.35 1.62 4.13 -0.34 -4.84 115.26 107.33 1a7t n ASN 158 Ca 0.03 -0.84 -0.33 0.00 1.68 0.00 0.00 54.58 55.12 1a7t n ASN 158 Cb 0.13 -3.67 -0.15 0.00 -1.54 0.00 0.00 39.78 34.55 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 -3.39 2.91 -0.21 2.41 1.01 -1.17 -0.62 121.20 122.13 1a7t s ILE 159 Ca 0.54 -0.71 -0.04 0.00 0.00 0.00 0.00 60.65 60.44 1a7t s ILE 159 Cb -0.28 -2.21 -0.01 0.00 0.01 0.00 0.00 42.46 39.97 1a7t s ILE 159 CO 0.85 0.53 -0.04 -0.22 0.00 0.00 0.00 174.94 176.06 1a7t s LEU 160 N 0.35 2.95 -0.62 2.97 2.96 -0.73 -1.56 118.68 125.00 1a7t s LEU 160 Ca -0.12 -0.35 -0.18 0.00 -0.22 0.00 0.00 54.13 53.25 1a7t s LEU 160 Cb -0.16 -1.75 0.11 0.00 0.50 0.00 0.00 46.19 44.89 1a7t s LEU 160 CO 0.06 0.01 0.72 0.12 -1.32 0.00 0.00 176.35 175.93 1a7t s PHE 161 N 1.33 3.05 -0.07 5.38 5.36 0.01 -0.89 117.98 132.15 1a7t s PHE 161 Ca 0.04 -1.05 0.13 0.00 -0.96 0.00 0.00 56.93 55.08 1a7t s PHE 161 Cb -0.14 -4.01 -0.05 0.00 -0.34 0.00 0.00 43.02 38.48 1a7t s PHE 161 CO -0.02 -1.28 1.28 0.78 -1.46 0.00 0.00 175.22 174.53 1a7t h GLY 162 N 9.82 0.00 0.00 13.12 0.00 -1.38 -1.86 103.07 122.77 1a7t h GLY 162 Ca -0.25 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.08 1a7t h GLY 162 CO 1.08 0.00 0.00 0.61 0.00 0.00 0.00 176.54 178.23 1a7t n GLY 163 N 1.30 -1.46 0.00 4.60 0.00 -0.87 -4.09 105.19 104.66 1a7t n GLY 163 Ca -0.01 -1.30 0.10 0.00 0.00 0.00 0.00 46.02 44.81 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 -1.43 0.04 -4.76 0.00 0.00 -1.26 -4.64 117.12 105.07 1a7t n MET 165 Ca 0.07 0.26 -0.33 0.00 0.00 0.00 0.00 57.70 57.69 1a7t n MET 165 Cb 0.21 -1.57 -0.12 0.00 0.00 0.00 0.00 33.22 31.74 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 -3.27 2.94 -0.01 3.17 1.43 -1.00 -4.78 118.68 117.17 1a7t s LEU 166 Ca 0.07 -0.12 -0.02 0.00 -1.03 0.00 0.00 54.13 53.04 1a7t s LEU 166 Cb 0.10 -1.62 -0.04 0.00 0.03 0.00 0.00 46.19 44.66 1a7t s LEU 166 CO 0.31 0.35 0.13 -0.54 0.23 0.00 0.00 176.35 176.83 1a7t s LYS 167 N -0.72 3.25 0.93 1.70 -0.14 -1.26 -4.05 119.74 119.46 1a7t s LYS 167 Ca 0.11 -0.40 -0.14 0.00 -1.36 0.00 0.00 55.97 54.17 1a7t s LYS 167 Cb -0.11 -2.98 0.16 0.00 -1.68 0.00 0.00 37.83 33.22 1a7t s LYS 167 CO 0.01 0.66 1.21 0.16 -0.76 0.00 0.00 175.35 176.63 1a7t s ASP 168 N -1.86 3.37 0.22 2.83 -4.77 -1.26 -4.68 116.67 110.52 1a7t s ASP 168 Ca 0.25 0.64 0.23 0.00 -3.30 0.00 0.00 52.55 50.37 1a7t s ASP 168 Cb -0.12 -0.98 0.93 0.00 -1.09 0.00 0.00 42.92 41.66 1a7t s ASP 168 CO 0.17 -2.61 1.69 0.59 0.70 0.00 0.00 175.17 175.71 1a7t n ASN 169 N -3.75 0.60 -0.18 2.11 3.02 -1.26 -2.50 115.26 113.29 1a7t n ASN 169 Ca 0.11 0.64 0.11 0.00 -0.03 0.00 0.00 54.58 55.41 1a7t n ASN 169 Cb 0.60 -0.77 0.08 0.00 -0.61 0.00 0.00 39.78 39.08 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 -2.15 0.49 -3.03 3.52 6.02 -1.26 -4.91 117.38 116.05 1a7t n GLN 170 Ca 0.03 -0.37 -0.39 0.00 -0.01 0.00 0.00 57.00 56.25 1a7t n GLN 170 Cb 0.24 -1.49 -0.06 0.00 1.02 0.00 0.00 30.24 29.95 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 -2.76 4.52 0.00 5.09 2.01 -1.04 -4.97 115.64 118.49 1a7t s THR 171 Ca 0.15 1.60 0.00 0.00 0.31 0.00 0.00 61.69 63.75 1a7t s THR 171 Cb 0.17 -4.09 0.00 0.00 0.01 0.00 0.00 72.50 68.59 1a7t s THR 171 CO 0.69 0.49 0.03 0.35 -0.69 0.00 0.00 174.62 175.48 1a7t n THR 172 N 1.94 0.00 -4.37 -0.82 -2.24 -1.26 -4.86 114.28 102.67 1a7t n THR 172 Ca -0.06 -0.43 -0.24 0.00 -2.27 0.00 0.00 64.05 61.06 1a7t n THR 172 Cb 0.49 1.01 -0.09 0.00 -2.10 0.00 0.00 70.33 69.65 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 -0.80 4.10 0.36 3.42 0.15 -1.26 -4.99 113.70 114.67 1a7t s SER 173 Ca 0.00 -0.88 0.27 0.00 0.70 0.00 0.00 55.95 56.04 1a7t s SER 173 Cb 0.00 -0.56 0.89 0.00 -1.71 0.00 0.00 66.02 64.63 1a7t s SER 173 CO 0.00 -0.05 1.77 -0.29 1.20 0.00 0.00 173.24 175.87 1a7t h ILE 174 N 2.00 0.00 -0.01 6.45 2.10 -1.98 -3.49 117.51 122.58 1a7t h ILE 174 Ca -0.42 -0.54 0.00 0.00 1.08 0.00 0.00 64.86 64.98 1a7t h ILE 174 Cb 1.25 1.47 0.00 0.00 -1.09 0.00 0.00 36.82 38.45 1a7t h ILE 174 CO 0.62 0.00 0.00 0.61 -1.08 0.00 0.00 178.15 178.30 1a7t n GLY 175 N 0.60 0.24 3.59 8.18 0.00 -1.26 -4.72 105.19 111.83 1a7t n GLY 175 Ca 0.03 -0.88 -0.42 0.00 0.00 0.00 0.00 46.02 44.75 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 5.63 -0.17 1.61 2.47 -1.26 -4.84 114.94 114.38 1a7t s ASN 176 Ca 0.00 1.18 0.17 0.00 0.42 0.00 0.00 52.86 54.63 1a7t s ASN 176 Cb 0.00 -2.52 0.48 0.00 -1.45 0.00 0.00 41.25 37.76 1a7t s ASN 176 CO 0.00 -1.94 1.37 2.30 -3.72 0.00 0.00 177.10 175.10 1a7t n ILE 177 N 7.46 2.22 0.20 -5.21 -5.35 -1.26 -4.67 119.36 112.74 1a7t n ILE 177 Ca 0.24 -2.00 0.13 0.00 -0.27 0.00 0.00 62.75 60.85 1a7t n ILE 177 Cb 0.48 -0.26 0.71 0.00 -1.74 0.00 0.00 39.64 38.84 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 1.39 0.00 0.00 7.28 4.64 -1.89 -2.28 113.55 122.68 1a7t h SER 178 Ca 0.01 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.33 1a7t h SER 178 Cb 1.36 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.45 1a7t h SER 178 CO 0.18 0.00 -0.05 0.47 -0.87 0.00 0.00 176.83 176.56 1a7t n ASP 179 N -4.31 1.99 -4.86 4.97 8.00 -1.26 -5.06 116.55 116.01 1a7t n ASP 179 Ca 0.01 -2.76 -0.31 0.00 0.71 0.00 0.00 54.79 52.43 1a7t n ASP 179 Cb 0.25 -0.33 -0.02 0.00 -0.02 0.00 0.00 41.12 40.99 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 -2.22 3.13 -0.72 2.24 0.00 -0.86 -2.87 121.76 120.47 1a7t s ALA 180 Ca 0.23 0.03 0.03 0.00 0.00 0.00 0.00 51.96 52.24 1a7t s ALA 180 Cb 0.20 -3.02 0.18 0.00 0.00 0.00 0.00 23.12 20.48 1a7t s ALA 180 CO 0.02 -0.32 0.53 0.34 0.00 0.00 0.00 175.76 176.34 1a7t s ASP 181 N -3.40 5.08 0.25 0.00 -1.08 0.78 -4.87 116.67 113.43 1a7t s ASP 181 Ca 0.56 -3.64 -0.05 0.00 -0.52 0.00 0.00 52.55 48.91 1a7t s ASP 181 Cb -0.10 -1.72 0.33 0.00 -1.46 0.00 0.00 42.92 39.96 1a7t s ASP 181 CO 0.37 -0.15 1.88 0.58 0.52 0.00 0.00 175.17 178.37 1a7t h VAL 182 N 4.53 1.11 -0.14 1.11 2.07 -1.94 -1.67 116.25 121.32 1a7t h VAL 182 Ca 0.11 -0.38 -0.08 0.00 0.82 0.00 0.00 66.70 67.17 1a7t h VAL 182 Cb 0.80 -0.10 -0.01 0.00 -1.52 0.00 0.00 31.29 30.46 1a7t h VAL 182 CO 0.75 0.20 -0.25 0.71 0.02 0.00 0.00 177.57 179.00 1a7t h THR 183 N 1.11 1.24 0.00 2.57 1.35 -1.96 -3.08 112.91 114.15 1a7t h THR 183 Ca 0.38 -1.13 -0.11 0.00 -0.55 0.00 0.00 66.41 65.00 1a7t h THR 183 Cb 0.09 1.42 -0.02 0.00 -1.73 0.00 0.00 68.15 67.91 1a7t h THR 183 CO -0.15 0.34 -0.72 0.00 -0.25 0.00 0.00 175.52 174.75 1a7t h ALA 184 N 1.51 0.67 -0.40 6.62 0.00 -1.76 -3.39 119.26 122.51 1a7t h ALA 184 Ca 0.04 -0.51 0.09 0.00 0.00 0.00 0.00 54.91 54.52 1a7t h ALA 184 Cb 0.58 0.01 -0.09 0.00 0.00 0.00 0.00 17.79 18.29 1a7t h ALA 184 CO 0.04 0.65 -0.21 2.35 0.00 0.00 0.00 179.25 182.07 1a7t h TRP 185 N 0.00 -0.55 -0.65 0.00 2.91 -1.21 -1.45 115.95 115.01 1a7t h TRP 185 Ca -0.04 0.05 -0.01 0.00 1.13 0.00 0.00 58.89 60.01 1a7t h TRP 185 Cb 1.40 0.30 -0.03 0.00 -0.51 0.00 0.00 29.16 30.32 1a7t h TRP 185 CO 0.00 -0.29 0.35 -1.00 -1.03 0.00 0.00 178.44 176.47 1a7t h PRO 186 N -0.14 0.90 -0.23 2.65 0.13 -1.75 -2.20 132.00 131.35 1a7t h PRO 186 Ca 0.20 -0.10 -0.12 0.00 -0.87 0.00 0.00 66.00 65.11 1a7t h PRO 186 Cb 0.45 -0.18 -0.01 0.00 0.13 0.00 0.00 31.00 31.38 1a7t h PRO 186 CO -0.49 0.66 -0.37 0.87 -0.23 0.00 0.00 178.00 178.45 1a7t h LYS 187 N 0.91 0.52 -0.64 0.86 1.79 -1.56 -2.42 116.57 116.02 1a7t h LYS 187 Ca 0.23 -0.24 -0.08 0.00 -2.18 0.00 0.00 60.65 58.38 1a7t h LYS 187 Cb 0.03 -0.01 -0.03 0.00 -1.58 0.00 0.00 32.23 30.65 1a7t h LYS 187 CO -0.04 0.81 0.10 1.15 -1.08 0.00 0.00 179.45 180.39 1a7t h THR 188 N 0.43 1.26 -0.61 -0.16 2.02 -1.02 -2.29 112.91 112.55 1a7t h THR 188 Ca 0.04 -1.02 -0.07 0.00 0.77 0.00 0.00 66.41 66.13 1a7t h THR 188 Cb 0.84 0.66 -0.02 0.00 -1.74 0.00 0.00 68.15 67.89 1a7t h THR 188 CO 0.07 0.38 0.09 -0.07 0.37 0.00 0.00 175.52 176.36 1a7t h LEU 189 N 0.98 0.98 -0.98 2.58 3.38 -1.26 -0.04 115.31 120.94 1a7t h LEU 189 Ca 0.19 -0.27 -0.06 0.00 0.09 0.00 0.00 57.88 57.84 1a7t h LEU 189 Cb 0.43 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.90 1a7t h LEU 189 CO 0.01 1.00 0.11 0.44 0.09 0.00 0.00 178.44 180.08 1a7t h ASP 190 N 0.92 0.79 -0.27 -0.43 3.32 -1.10 -1.66 116.42 117.99 1a7t h ASP 190 Ca 0.18 -0.15 -0.05 0.00 0.02 0.00 0.00 57.03 57.03 1a7t h ASP 190 Cb 0.44 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 39.77 1a7t h ASP 190 CO 0.01 0.79 -0.03 0.11 -1.72 0.00 0.00 179.24 178.41 1a7t h LYS 191 N 0.81 0.49 -0.34 3.56 1.57 -1.02 -0.24 116.57 121.40 1a7t h LYS 191 Ca 0.17 -0.17 0.02 0.00 -1.87 0.00 0.00 60.65 58.80 1a7t h LYS 191 Cb 0.33 -0.04 -0.03 0.00 0.08 0.00 0.00 32.23 32.58 1a7t h LYS 191 CO 0.00 0.68 0.17 0.28 -0.57 0.00 0.00 179.45 180.02 1a7t h VAL 192 N 0.26 0.99 -0.46 0.50 2.07 -0.81 -0.95 116.25 117.85 1a7t h VAL 192 Ca 0.07 -0.12 0.03 0.00 0.82 0.00 0.00 66.70 67.49 1a7t h VAL 192 Cb 0.48 0.60 -0.03 0.00 -1.52 0.00 0.00 31.29 30.81 1a7t h VAL 192 CO 0.02 0.07 0.26 0.50 0.02 0.00 0.00 177.57 178.43 1a7t h LYS 193 N 0.36 0.50 -0.20 1.57 3.64 -1.22 -2.24 116.57 118.97 1a7t h LYS 193 Ca 0.14 -0.03 -0.10 0.00 -1.27 0.00 0.00 60.65 59.39 1a7t h LYS 193 Cb 0.05 -0.11 -0.01 0.00 -0.41 0.00 0.00 32.23 31.74 1a7t h LYS 193 CO -0.10 0.33 -0.31 0.00 -2.27 0.00 0.00 179.45 177.11 1a7t h ALA 194 N 1.21 1.10 0.00 5.00 0.00 -0.73 -3.23 119.26 122.61 1a7t h ALA 194 Ca 0.19 -0.36 -0.15 0.00 0.00 0.00 0.00 54.91 54.58 1a7t h ALA 194 Cb 0.04 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.70 1a7t h ALA 194 CO -0.10 0.56 -0.72 -0.22 0.00 0.00 0.00 179.25 178.78 1a7t h LYS 195 N 0.35 0.00 -2.18 0.00 3.64 -0.92 -3.38 116.57 114.08 1a7t h LYS 195 Ca 0.05 0.00 -0.56 0.00 -1.27 0.00 0.00 60.65 58.87 1a7t h LYS 195 Cb 0.72 0.00 -0.41 0.00 -0.41 0.00 0.00 32.23 32.12 1a7t h LYS 195 CO 0.05 0.72 -0.82 1.19 -2.27 0.00 0.00 179.45 178.32 1a7t n PHE 196 N -3.29 2.64 0.30 1.91 3.72 -0.87 -4.88 117.46 117.00 1a7t n PHE 196 Ca 0.01 -3.94 0.17 0.00 -0.05 0.00 0.00 57.45 53.64 1a7t n PHE 196 Cb 0.82 -0.47 0.78 0.00 -0.94 0.00 0.00 39.48 39.67 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 3.21 0.00 -0.13 -1.08 0.13 -1.75 -2.94 132.00 129.44 1a7t h PRO 197 Ca 0.13 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.26 1a7t h PRO 197 Cb 0.68 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.81 1a7t h PRO 197 CO 0.71 0.00 0.00 -1.13 -0.23 0.00 0.00 178.00 177.35 1a7t n SER 198 N -2.79 2.28 -4.66 1.44 3.41 -1.26 -4.94 113.62 107.10 1a7t n SER 198 Ca -0.00 -1.77 -0.47 0.00 -0.26 0.00 0.00 58.87 56.37 1a7t n SER 198 Cb 0.19 -0.07 -0.04 0.00 -0.26 0.00 0.00 64.21 64.02 1a7t n SER 198 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1a7t n ALA 199 N 0.75 1.04 -0.10 7.33 0.00 -1.11 -4.87 120.51 123.55 1a7t n ALA 199 Ca 0.17 0.43 -0.15 0.00 0.00 0.00 0.00 53.44 53.90 1a7t n ALA 199 Cb 0.46 -2.34 -0.06 0.00 0.00 0.00 0.00 19.45 17.51 1a7t n ALA 199 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1a7t n ARG 200 N 3.76 0.53 -4.14 0.00 1.74 0.21 -4.71 116.66 114.05 1a7t n ARG 200 Ca 0.18 0.35 -0.36 0.00 -0.77 0.00 0.00 57.85 57.25 1a7t n ARG 200 Cb 0.28 -1.55 -0.08 0.00 -1.02 0.00 0.00 32.46 30.09 1a7t n ARG 200 CO 0.00 0.00 0.00 0.71 -1.52 0.00 0.00 177.63 176.82 1a7t s TYR 201 N -2.58 3.37 -0.12 -1.55 2.02 -1.20 -4.38 117.35 112.90 1a7t s TYR 201 Ca -0.28 0.35 0.00 0.00 -0.37 0.00 0.00 57.07 56.77 1a7t s TYR 201 Cb 0.06 -1.87 0.02 0.00 -0.40 0.00 0.00 41.96 39.78 1a7t s TYR 201 CO 0.42 0.59 -0.11 0.08 -1.57 0.00 0.00 175.55 174.95 1a7t s VAL 202 N -0.92 1.31 -0.20 0.71 1.01 0.34 -1.77 120.40 120.88 1a7t s VAL 202 Ca 0.14 -0.48 -0.04 0.00 0.00 0.00 0.00 61.98 61.60 1a7t s VAL 202 Cb -0.12 -1.26 -0.02 0.00 0.00 0.00 0.00 36.38 34.99 1a7t s VAL 202 CO 0.03 0.41 -0.03 -0.69 0.00 0.00 0.00 175.10 174.82 1a7t s VAL 203 N 1.47 3.60 0.84 2.92 1.01 -0.07 -2.04 120.40 128.13 1a7t s VAL 203 Ca 0.02 -0.43 -0.11 0.00 0.00 0.00 0.00 61.98 61.47 1a7t s VAL 203 Cb -0.13 -2.62 0.14 0.00 0.00 0.00 0.00 36.38 33.77 1a7t s VAL 203 CO -0.08 0.44 1.18 -2.16 0.00 0.00 0.00 175.10 174.48 1a7t s PRO 204 N 1.13 1.32 0.37 2.72 0.04 -1.26 -1.07 135.00 138.26 1a7t s PRO 204 Ca 0.02 -0.44 0.21 0.00 0.04 0.00 0.00 61.00 60.83 1a7t s PRO 204 Cb -0.15 -2.02 0.24 0.00 0.04 0.00 0.00 34.50 32.61 1a7t s PRO 204 CO 0.00 -1.89 1.50 0.78 0.04 0.00 0.00 177.00 177.43 1a7t h GLY 205 N -1.15 0.00 -5.37 0.56 0.00 -1.18 -3.41 103.07 92.52 1a7t h GLY 205 Ca -0.43 0.00 -0.21 0.00 0.00 0.00 0.00 47.33 46.69 1a7t h GLY 205 CO 0.47 0.00 -0.68 0.30 0.00 0.00 0.00 176.54 176.62 1a7t s HIS 206 N -3.16 0.04 0.00 5.60 3.76 -1.26 -1.12 115.29 119.15 1a7t s HIS 206 Ca 0.05 -0.08 0.00 0.00 -0.15 0.00 0.00 55.06 54.88 1a7t s HIS 206 Cb 0.06 -0.04 0.00 0.00 1.11 0.00 0.00 32.58 33.71 1a7t s HIS 206 CO 0.70 -0.07 0.00 0.41 -0.85 0.00 0.00 174.74 174.94 1a7t n GLY 207 N 2.65 -3.16 3.78 -2.22 0.00 -1.26 -4.10 105.19 100.89 1a7t n GLY 207 Ca -0.15 -1.97 -0.34 0.00 0.00 0.00 0.00 46.02 43.55 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 -1.73 5.85 0.64 1.61 0.01 -1.26 -4.78 114.94 115.28 1a7t s ASN 208 Ca 0.00 2.07 -0.06 0.00 -0.71 0.00 0.00 52.86 54.16 1a7t s ASN 208 Cb 0.00 -2.57 0.03 0.00 0.41 0.00 0.00 41.25 39.13 1a7t s ASN 208 CO 0.00 -1.12 0.94 -0.72 -1.51 0.00 0.00 177.10 174.69 1a7t s TYR 209 N -1.92 3.06 0.00 2.20 -0.85 -1.26 -4.62 117.35 113.96 1a7t s TYR 209 Ca 0.70 0.49 0.00 0.00 -0.52 0.00 0.00 57.07 57.74 1a7t s TYR 209 Cb -0.21 -2.95 0.00 0.00 0.38 0.00 0.00 41.96 39.18 1a7t s TYR 209 CO 0.27 -1.10 0.00 0.41 -1.52 0.00 0.00 175.55 173.61 1a7t n GLY 210 N -2.71 3.23 0.00 5.49 0.00 -0.87 -4.99 105.19 105.33 1a7t n GLY 210 Ca 0.06 -0.11 0.00 0.00 0.00 0.00 0.00 46.02 45.97 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 5.54 0.18 -0.02 0.00 -1.26 -0.51 105.19 109.12 1a7t n GLY 211 Ca 0.00 -1.84 0.13 0.00 0.00 0.00 0.00 46.02 44.31 1a7t n GLY 211 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 1a7t h THR 212 N 0.00 0.00 0.00 2.61 1.35 -1.84 -2.29 112.91 112.74 1a7t h THR 212 Ca 0.00 -0.17 -0.00 0.00 -0.55 0.00 0.00 66.41 65.69 1a7t h THR 212 Cb 0.00 0.87 -0.00 0.00 -1.73 0.00 0.00 68.15 67.29 1a7t h THR 212 CO 0.00 0.00 -0.00 1.05 -0.25 0.00 0.00 175.52 176.32 1a7t h GLU 213 N 0.00 0.00 -0.32 4.72 9.09 -1.98 -1.26 114.58 124.83 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 0.23 0.00 -0.02 0.00 -1.65 0.00 0.00 28.75 27.31 1a7t h GLU 213 CO 0.00 0.00 -0.02 -0.07 0.05 0.00 0.00 179.01 178.97 1a7t h LEU 214 N 0.00 0.47 0.05 3.06 3.38 -1.73 -0.51 115.31 120.02 1a7t h LEU 214 Ca -0.00 -0.09 -0.00 0.00 0.09 0.00 0.00 57.88 57.88 1a7t h LEU 214 Cb 0.08 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 40.71 1a7t h LEU 214 CO 0.00 0.55 -0.02 0.40 0.09 0.00 0.00 178.44 179.46 1a7t h ILE 215 N 0.47 1.17 -0.50 1.22 2.04 -1.45 -1.10 117.51 119.37 1a7t h ILE 215 Ca 0.10 -0.71 -0.07 0.00 1.00 0.00 0.00 64.86 65.17 1a7t h ILE 215 Cb 0.35 1.64 -0.02 0.00 -0.74 0.00 0.00 36.82 38.04 1a7t h ILE 215 CO 0.01 0.18 0.01 -0.33 0.00 0.00 0.00 178.15 178.02 1a7t h GLU 216 N -0.38 0.82 -0.61 2.37 5.08 -1.49 -1.72 114.58 118.65 1a7t h GLU 216 Ca -0.01 -0.22 -0.08 0.00 -1.00 0.00 0.00 59.36 58.05 1a7t h GLU 216 Cb 0.34 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.47 1a7t h GLU 216 CO 0.01 0.82 0.07 1.25 -1.00 0.00 0.00 179.01 180.17 1a7t h HIS 217 N 0.77 1.10 -0.22 4.33 2.76 -1.10 -1.30 115.15 121.49 1a7t h HIS 217 Ca 0.15 -0.16 -0.14 0.00 -2.20 0.00 0.00 60.37 58.02 1a7t h HIS 217 Cb 0.45 -0.30 -0.01 0.00 1.55 0.00 0.00 27.41 29.10 1a7t h HIS 217 CO 0.02 0.95 -0.43 1.15 -1.30 0.00 0.00 177.93 178.32 1a7t h THR 218 N 0.93 1.31 -0.46 6.26 2.02 -1.02 -1.55 112.91 120.40 1a7t h THR 218 Ca 0.18 -1.62 -0.06 0.00 0.77 0.00 0.00 66.41 65.69 1a7t h THR 218 Cb 0.46 1.60 -0.02 0.00 -1.74 0.00 0.00 68.15 68.45 1a7t h THR 218 CO 0.02 0.51 0.06 0.50 0.37 0.00 0.00 175.52 176.97 1a7t h LYS 219 N 0.45 0.72 -0.39 6.66 3.64 -1.06 -1.12 116.57 125.47 1a7t h LYS 219 Ca 0.03 -0.16 -0.06 0.00 -1.27 0.00 0.00 60.65 59.19 1a7t h LYS 219 Cb 0.94 -0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 32.65 1a7t h LYS 219 CO 0.08 0.69 -0.01 0.37 -2.27 0.00 0.00 179.45 178.32 1a7t h GLN 220 N 0.69 0.69 -0.77 1.90 4.15 -0.62 0.06 115.11 121.21 1a7t h GLN 220 Ca 0.15 -0.22 -0.03 0.00 0.77 0.00 0.00 58.65 59.31 1a7t h GLN 220 Cb 0.34 -0.06 -0.04 0.00 0.21 0.00 0.00 27.48 27.93 1a7t h GLN 220 CO 0.01 0.79 0.38 0.82 -1.93 0.00 0.00 178.83 178.89 1a7t h ILE 221 N 0.51 1.24 -0.12 2.39 2.04 -0.83 0.39 117.51 123.14 1a7t h ILE 221 Ca 0.11 -0.68 -0.06 0.00 1.00 0.00 0.00 64.86 65.22 1a7t h ILE 221 Cb 0.48 0.27 -0.00 0.00 -0.74 0.00 0.00 36.82 36.83 1a7t h ILE 221 CO 0.02 0.29 -0.17 0.58 0.00 0.00 0.00 178.15 178.87 1a7t h VAL 222 N 1.09 1.37 -0.59 1.67 2.07 -1.06 -2.29 116.25 118.51 1a7t h VAL 222 Ca 0.27 -1.40 -0.04 0.00 0.82 0.00 0.00 66.70 66.34 1a7t h VAL 222 Cb 0.11 2.02 -0.03 0.00 -1.52 0.00 0.00 31.29 31.87 1a7t h VAL 222 CO -0.03 0.41 0.21 0.78 0.02 0.00 0.00 177.57 178.95 1a7t h ASN 223 N -0.09 0.81 0.33 0.57 2.35 -0.90 -1.52 115.58 117.12 1a7t h ASN 223 Ca 0.01 -0.12 -0.12 0.00 -0.55 0.00 0.00 56.30 55.53 1a7t h ASN 223 Cb 0.73 -0.21 -0.01 0.00 0.05 0.00 0.00 38.32 38.88 1a7t h ASN 223 CO 0.04 0.75 -0.48 1.56 -1.65 0.00 0.00 177.43 177.65 1a7t h GLN 224 N 0.86 0.19 -0.31 0.81 4.20 -0.85 -1.77 115.11 118.24 1a7t h GLN 224 Ca 0.20 -0.10 -0.09 0.00 0.06 0.00 0.00 58.65 58.71 1a7t h GLN 224 Cb 0.22 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 27.99 1a7t h GLN 224 CO -0.01 0.63 -0.17 -0.92 -0.67 0.00 0.00 178.83 177.69 1a7t h TYR 225 N 0.15 0.78 -0.39 2.96 3.20 -1.11 -1.49 116.97 121.07 1a7t h TYR 225 Ca 0.01 -0.20 -0.02 0.00 3.14 0.00 0.00 58.73 61.66 1a7t h TYR 225 Cb 0.91 -0.18 -0.02 0.00 1.54 0.00 0.00 36.73 38.98 1a7t h TYR 225 CO 0.01 0.90 0.18 0.82 -1.64 0.00 0.00 178.16 178.43 1a7t h ILE 226 N 0.43 1.18 -0.48 1.81 2.04 -1.13 -1.68 117.51 119.68 1a7t h ILE 226 Ca 0.07 -0.53 0.00 0.00 1.00 0.00 0.00 64.86 65.40 1a7t h ILE 226 Cb 0.70 0.81 -0.02 0.00 -0.74 0.00 0.00 36.82 37.57 1a7t h ILE 226 CO 0.05 0.20 0.30 -0.33 0.00 0.00 0.00 178.15 178.37 1a7t h GLU 227 N 0.49 0.64 0.00 2.37 5.08 -1.37 -2.63 114.58 119.17 1a7t h GLU 227 Ca 0.13 -0.05 -0.10 0.00 -1.00 0.00 0.00 59.36 58.34 1a7t h GLU 227 Cb 0.15 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.24 1a7t h GLU 227 CO -0.01 0.45 -0.50 0.77 -1.00 0.00 0.00 179.01 178.71 1a7t h SER 228 N 0.64 0.00 -0.03 1.42 0.02 -1.09 -3.25 113.55 111.26 1a7t h SER 228 Ca 0.17 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.12 1a7t h SER 228 Cb -0.04 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.50 1a7t h SER 228 CO -0.04 0.50 0.00 0.35 -1.14 0.00 0.00 176.83 176.50 1a7t n THR 229 N -3.50 0.01 1.71 -2.27 -2.24 -0.65 -5.09 114.28 102.25 1a7t n THR 229 Ca 0.00 -0.43 0.15 0.00 -2.27 0.00 0.00 64.05 61.50 1a7t n THR 229 Cb 0.61 1.19 0.70 0.00 -2.10 0.00 0.00 70.33 70.73 1a7t n THR 229 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30