#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2c7h s PRO 2 N 0.00 2.47 0.30 1.61 0.04 -1.26 -4.99 135.00 133.17 2c7h s PRO 2 Ca 0.00 -0.21 0.06 0.00 0.04 0.00 0.00 61.00 60.89 2c7h s PRO 2 Cb 0.00 -2.23 0.46 0.00 0.04 0.00 0.00 34.50 32.77 2c7h s PRO 2 CO 0.00 -1.01 1.71 1.25 0.04 0.00 0.00 177.00 178.99 2c7h h LEU 3 N -0.40 0.27 -3.12 -3.56 5.85 -2.08 -3.01 115.31 109.27 2c7h h LEU 3 Ca -0.45 -0.11 -0.16 0.00 0.84 0.00 0.00 57.88 58.01 2c7h h LEU 3 Cb 1.29 -0.08 -0.07 0.00 0.37 0.00 0.00 40.66 42.18 2c7h h LEU 3 CO 0.60 0.64 0.20 0.61 -0.34 0.00 0.00 178.44 180.15 2c7h n GLY 4 N -0.23 3.19 0.17 3.75 0.00 -1.26 -4.32 105.19 106.50 2c7h n GLY 4 Ca -0.01 -0.50 -0.12 0.00 0.00 0.00 0.00 46.02 45.39 2c7h n GLY 4 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 2c7h h SER 5 N 1.08 0.52 -5.50 1.61 0.87 -1.93 -3.44 113.55 106.76 2c7h h SER 5 Ca 0.15 -0.35 -0.47 0.00 -1.23 0.00 0.00 61.79 59.88 2c7h h SER 5 Cb 1.03 -0.14 0.09 0.00 -0.44 0.00 0.00 62.40 62.94 2c7h h SER 5 CO 0.36 0.75 0.13 0.23 -0.53 0.00 0.00 176.83 177.77 2c7h n MET 6 N -4.54 -0.17 -3.50 2.24 2.81 -1.26 -5.04 117.12 107.66 2c7h n MET 6 Ca -0.03 -2.72 -0.37 0.00 -1.81 0.00 0.00 57.70 52.76 2c7h n MET 6 Cb 0.30 -0.70 -0.08 0.00 -0.71 0.00 0.00 33.22 32.03 2c7h n MET 6 CO 0.00 0.00 0.00 -1.12 1.51 0.00 0.00 175.97 176.36 2c7h s SER 7 N -5.15 6.37 -0.12 7.83 0.01 -1.26 -5.03 113.70 116.35 2c7h s SER 7 Ca 0.67 0.43 -0.09 0.00 1.31 0.00 0.00 55.95 58.27 2c7h s SER 7 Cb -0.04 -2.19 0.04 0.00 0.21 0.00 0.00 66.02 64.05 2c7h s SER 7 CO 0.45 0.02 0.31 0.00 0.41 0.00 0.00 173.24 174.43 2c7h s VAL 9 N 0.72 4.25 -0.47 0.00 1.01 -0.58 -4.46 120.40 120.86 2c7h s VAL 9 Ca -0.05 -0.25 -0.26 0.00 0.00 0.00 0.00 61.98 61.43 2c7h s VAL 9 Cb -0.06 -2.84 0.03 0.00 0.00 0.00 0.00 36.38 33.51 2c7h s VAL 9 CO -0.05 0.54 0.98 -1.00 0.00 0.00 0.00 175.10 175.57 2c7h s HIS 10 N -0.19 2.88 -0.02 5.22 0.09 -1.23 -1.95 115.29 120.09 2c7h s HIS 10 Ca 0.05 0.43 0.05 0.00 -0.00 0.00 0.00 55.06 55.58 2c7h s HIS 10 Cb -0.13 -4.09 -0.01 0.00 -0.00 0.00 0.00 32.58 28.35 2c7h s HIS 10 CO 0.02 -1.17 -0.16 1.52 -0.00 0.00 0.00 174.74 174.96 2c7h s TYR 11 N 3.95 1.43 -0.04 1.40 1.13 -0.38 -0.91 117.35 123.92 2c7h s TYR 11 Ca 0.39 -0.30 0.07 0.00 -1.41 0.00 0.00 57.07 55.82 2c7h s TYR 11 Cb -0.09 -0.94 -0.01 0.00 -1.10 0.00 0.00 41.96 39.81 2c7h s TYR 11 CO 0.27 -0.05 -0.24 -1.59 -2.51 0.00 0.00 175.55 171.43 2c7h s LYS 12 N -0.27 2.22 0.36 -3.49 -2.85 -0.67 0.18 119.74 115.22 2c7h s LYS 12 Ca 0.04 -0.87 -0.05 0.00 -1.00 0.00 0.00 55.97 54.09 2c7h s LYS 12 Cb -0.07 -2.00 -0.05 0.00 -2.06 0.00 0.00 37.83 33.65 2c7h s LYS 12 CO -0.00 0.44 0.64 0.12 0.10 0.00 0.00 175.35 176.65 2c7h s PHE 13 N -0.34 3.50 0.54 1.78 2.19 -1.26 -0.65 117.98 123.74 2c7h s PHE 13 Ca 0.03 0.70 0.23 0.00 0.33 0.00 0.00 56.93 58.22 2c7h s PHE 13 Cb -0.12 -2.17 1.40 0.00 -1.31 0.00 0.00 43.02 40.82 2c7h s PHE 13 CO 0.01 0.01 2.07 0.77 1.83 0.00 0.00 175.22 179.92 2c7h h SER 14 N 1.12 0.00 0.89 6.13 0.02 -1.78 0.11 113.55 120.03 2c7h h SER 14 Ca -0.48 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.47 2c7h h SER 14 Cb 1.20 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.74 2c7h h SER 14 CO 0.64 0.00 -0.21 -1.20 -1.14 0.00 0.00 176.83 174.92 2c7h n SER 15 N -4.33 0.30 -4.92 3.07 7.64 -1.26 -4.87 113.62 109.25 2c7h n SER 15 Ca 0.04 0.25 -0.24 0.00 1.01 0.00 0.00 58.87 59.93 2c7h n SER 15 Cb 0.38 -0.25 -0.03 0.00 -1.01 0.00 0.00 64.21 63.30 2c7h n SER 15 CO 0.00 0.00 0.00 -0.54 -3.01 0.00 0.00 175.04 171.49 2c7h s LYS 16 N -3.03 3.33 -0.24 1.43 3.01 0.36 -5.02 119.74 119.59 2c7h s LYS 16 Ca 0.12 -0.72 -0.05 0.00 -1.01 0.00 0.00 55.97 54.31 2c7h s LYS 16 Cb 0.17 -2.87 -0.18 0.00 -1.01 0.00 0.00 37.83 33.95 2c7h s LYS 16 CO 0.61 0.48 -0.13 1.28 0.51 0.00 0.00 175.35 178.10 2c7h n LEU 17 N -0.85 2.59 -4.70 3.17 4.77 -1.26 -4.65 117.00 116.06 2c7h n LEU 17 Ca -0.08 0.08 -0.25 0.00 -0.03 0.00 0.00 56.01 55.74 2c7h n LEU 17 Cb 0.55 -0.93 -0.08 0.00 -2.33 0.00 0.00 43.42 40.64 2c7h n LEU 17 CO 0.46 0.79 -0.21 0.54 -1.33 0.00 0.00 177.39 177.63 2c7h s ASN 18 N -6.88 4.36 0.45 -1.43 2.20 -1.26 -5.06 114.94 107.33 2c7h s ASN 18 Ca -0.33 -1.02 -0.21 0.00 -0.94 0.00 0.00 52.86 50.35 2c7h s ASN 18 Cb 0.10 -0.53 -0.09 0.00 -2.00 0.00 0.00 41.25 38.73 2c7h s ASN 18 CO 0.60 -0.41 1.02 -0.31 -2.94 0.00 0.00 177.10 175.07 2c7h s TYR 19 N -2.55 3.13 0.52 1.54 1.51 -1.26 -4.68 117.35 115.55 2c7h s TYR 19 Ca 0.38 1.60 0.05 0.00 -1.01 0.00 0.00 57.07 58.09 2c7h s TYR 19 Cb 0.02 -3.03 0.01 0.00 -0.11 0.00 0.00 41.96 38.85 2c7h s TYR 19 CO 0.21 -0.63 0.30 0.34 -1.11 0.00 0.00 175.55 174.67 2c7h s ASP 20 N -1.93 4.53 -0.13 2.29 -1.08 0.13 -4.90 116.67 115.58 2c7h s ASP 20 Ca 0.64 -1.28 -0.04 0.00 -0.52 0.00 0.00 52.55 51.35 2c7h s ASP 20 Cb -0.16 0.29 0.05 0.00 -1.46 0.00 0.00 42.92 41.64 2c7h s ASP 20 CO 0.20 -0.97 0.08 0.42 0.52 0.00 0.00 175.17 175.43 2c7h s THR 21 N -2.76 -0.11 -0.23 1.71 -4.23 -1.25 -1.25 115.64 107.52 2c7h s THR 21 Ca 0.30 0.05 -0.14 0.00 -1.18 0.00 0.00 61.69 60.72 2c7h s THR 21 Cb -0.01 -0.43 -0.04 0.00 1.34 0.00 0.00 72.50 73.36 2c7h s THR 21 CO 0.18 -0.12 0.32 0.54 -0.54 0.00 0.00 174.62 175.01 2c7h s VAL 22 N 2.16 5.24 0.11 2.29 0.11 -0.82 -4.85 120.40 124.64 2c7h s VAL 22 Ca 0.03 0.52 -0.22 0.00 -2.93 0.00 0.00 61.98 59.39 2c7h s VAL 22 Cb -0.15 -3.66 -0.07 0.00 -1.53 0.00 0.00 36.38 30.98 2c7h s VAL 22 CO -0.07 0.26 0.65 0.42 -3.33 0.00 0.00 175.10 173.03 2c7h s THR 23 N 1.40 4.60 0.20 5.04 -4.23 -1.26 -1.53 115.64 119.85 2c7h s THR 23 Ca 0.15 1.40 -0.09 0.00 -1.18 0.00 0.00 61.69 61.96 2c7h s THR 23 Cb -0.15 -3.99 -0.01 0.00 1.34 0.00 0.00 72.50 69.70 2c7h s THR 23 CO 0.07 0.54 0.33 0.72 -0.54 0.00 0.00 174.62 175.74 2c7h s PHE 24 N -1.13 0.48 -0.32 3.99 -0.71 -0.57 -4.98 117.98 114.74 2c7h s PHE 24 Ca 0.32 -0.82 -0.11 0.00 -1.04 0.00 0.00 56.93 55.27 2c7h s PHE 24 Cb -0.21 -0.04 -0.02 0.00 -1.21 0.00 0.00 43.02 41.55 2c7h s PHE 24 CO 0.22 -0.80 0.20 -0.51 -1.34 0.00 0.00 175.22 172.99 2c7h s ASP 25 N -3.01 5.86 0.00 1.98 1.11 -1.26 -4.02 116.67 117.33 2c7h s ASP 25 Ca 0.22 -0.40 0.00 0.00 0.18 0.00 0.00 52.55 52.55 2c7h s ASP 25 Cb 0.02 -2.08 0.00 0.00 1.07 0.00 0.00 42.92 41.93 2c7h s ASP 25 CO 0.04 -0.19 0.00 0.61 1.18 0.00 0.00 175.17 176.81 2c7h n GLY 26 N 5.05 1.39 0.09 0.21 0.00 -1.26 -4.81 105.19 105.87 2c7h n GLY 26 Ca -0.13 -2.25 -0.07 0.00 0.00 0.00 0.00 46.02 43.57 2c7h n GLY 26 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2c7h h LEU 27 N 0.00 0.09 -8.10 0.99 5.85 -1.97 -3.43 115.31 108.73 2c7h h LEU 27 Ca 0.00 -0.08 -0.12 0.00 0.84 0.00 0.00 57.88 58.52 2c7h h LEU 27 Cb 0.00 -0.03 -0.16 0.00 0.37 0.00 0.00 40.66 40.85 2c7h h LEU 27 CO 0.00 0.95 -0.60 -1.38 -0.34 0.00 0.00 178.44 177.06 2c7h s HIS 28 N -3.01 0.39 -0.09 1.25 -3.43 -1.26 -2.07 115.29 107.07 2c7h s HIS 28 Ca -0.01 -0.87 0.03 0.00 -0.80 0.00 0.00 55.06 53.40 2c7h s HIS 28 Cb 0.10 -0.28 0.01 0.00 -1.43 0.00 0.00 32.58 30.98 2c7h s HIS 28 CO 0.81 -0.40 -0.17 -1.50 -2.00 0.00 0.00 174.74 171.49 2c7h s ILE 29 N -3.59 1.58 0.43 -5.38 2.07 0.29 -4.91 121.20 111.68 2c7h s ILE 29 Ca 0.04 -0.72 -0.26 0.00 -1.41 0.00 0.00 60.65 58.30 2c7h s ILE 29 Cb 0.05 -1.41 -0.09 0.00 0.13 0.00 0.00 42.46 41.14 2c7h s ILE 29 CO -0.09 0.45 1.40 -0.44 -1.91 0.00 0.00 174.94 174.36 2c7h s SER 30 N 0.69 6.08 0.29 4.50 0.01 -1.26 0.23 113.70 124.24 2c7h s SER 30 Ca -0.13 2.86 0.02 0.00 1.31 0.00 0.00 55.95 60.02 2c7h s SER 30 Cb -0.16 -2.65 0.58 0.00 0.21 0.00 0.00 66.02 63.99 2c7h s SER 30 CO 0.03 -1.03 1.83 0.25 0.41 0.00 0.00 173.24 174.73 2c7h h LEU 31 N 2.54 0.91 -0.51 2.44 5.85 0.70 -0.31 115.31 126.92 2c7h h LEU 31 Ca -0.50 0.05 0.06 0.00 0.84 0.00 0.00 57.88 58.33 2c7h h LEU 31 Cb 1.26 -0.13 -0.05 0.00 0.37 0.00 0.00 40.66 42.10 2c7h h LEU 31 CO 0.62 0.48 0.21 0.00 -0.34 0.00 0.00 178.44 179.41 2c7h h ASP 33 N 0.41 0.87 -0.32 0.00 1.82 -1.43 -1.64 116.42 116.14 2c7h h ASP 33 Ca 0.24 -0.57 -0.01 0.00 -0.39 0.00 0.00 57.03 56.30 2c7h h ASP 33 Cb 0.22 -0.26 -0.01 0.00 0.68 0.00 0.00 39.33 39.96 2c7h h ASP 33 CO -0.22 1.36 0.14 0.25 -1.61 0.00 0.00 179.24 179.16 2c7h h LEU 34 N 0.50 0.43 -0.63 2.28 6.46 -0.79 -0.34 115.31 123.22 2c7h h LEU 34 Ca -0.05 -0.14 -0.10 0.00 -0.12 0.00 0.00 57.88 57.47 2c7h h LEU 34 Cb 1.38 -0.11 -0.02 0.00 -0.73 0.00 0.00 40.66 41.18 2c7h h LEU 34 CO 0.15 0.45 -0.02 0.11 -0.62 0.00 0.00 178.44 178.52 2c7h h LYS 35 N 0.37 1.06 -0.87 1.25 1.57 -0.76 -1.05 116.57 118.14 2c7h h LYS 35 Ca 0.11 -0.34 -0.02 0.00 -1.87 0.00 0.00 60.65 58.53 2c7h h LYS 35 Cb 0.15 -0.09 -0.04 0.00 0.08 0.00 0.00 32.23 32.32 2c7h h LYS 35 CO -0.01 1.04 0.47 0.87 -0.57 0.00 0.00 179.45 181.25 2c7h h LYS 36 N 0.96 1.22 0.02 3.15 6.56 -0.91 0.16 116.57 127.72 2c7h h LYS 36 Ca 0.17 -0.15 -0.00 0.00 -1.06 0.00 0.00 60.65 59.61 2c7h h LYS 36 Cb 0.58 -0.24 0.00 0.00 -0.57 0.00 0.00 32.23 32.00 2c7h h LYS 36 CO 0.03 0.90 -0.01 1.96 -2.06 0.00 0.00 179.45 180.27 2c7h h GLN 37 N 1.22 -0.03 -0.55 3.15 4.20 -0.75 -2.18 115.11 120.16 2c7h h GLN 37 Ca 0.31 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 59.00 2c7h h GLN 37 Cb 0.04 0.01 -0.03 0.00 0.30 0.00 0.00 27.48 27.80 2c7h h GLN 37 CO -0.05 0.32 0.30 0.82 -0.67 0.00 0.00 178.83 179.55 2c7h h ILE 38 N -0.37 1.19 -0.36 2.54 2.04 -0.97 0.18 117.51 121.75 2c7h h ILE 38 Ca -0.00 -0.48 -0.03 0.00 1.00 0.00 0.00 64.86 65.34 2c7h h ILE 38 Cb 0.36 0.50 -0.02 0.00 -0.74 0.00 0.00 36.82 36.92 2c7h h ILE 38 CO 0.00 0.20 0.10 0.24 0.00 0.00 0.00 178.15 178.70 2c7h h MET 39 N 0.74 0.57 -0.09 2.37 2.86 -0.71 0.13 114.93 120.81 2c7h h MET 39 Ca 0.19 -0.13 -0.16 0.00 -2.06 0.00 0.00 59.70 57.54 2c7h h MET 39 Cb 0.06 -0.08 -0.01 0.00 0.06 0.00 0.00 31.60 31.63 2c7h h MET 39 CO -0.03 0.60 -0.64 0.78 1.06 0.00 0.00 176.91 178.68 2c7h h GLY 40 N 0.44 0.36 0.56 8.32 0.00 -1.22 0.32 103.07 111.85 2c7h h GLY 40 Ca 0.12 -0.47 -0.08 0.00 0.00 0.00 0.00 47.33 46.90 2c7h h GLY 40 CO -0.00 0.42 -0.31 -0.09 0.00 0.00 0.00 176.54 176.55 2c7h h ARG 41 N 0.24 0.24 -0.59 4.80 2.43 -0.77 -3.29 114.38 117.44 2c7h h ARG 41 Ca -0.01 -0.24 0.00 0.00 -0.81 0.00 0.00 59.98 58.92 2c7h h ARG 41 Cb 1.17 0.06 0.00 0.00 -0.42 0.00 0.00 29.97 30.78 2c7h h ARG 41 CO 0.10 0.94 0.00 0.39 -1.51 0.00 0.00 179.97 179.89 2c7h n GLU 42 N -4.45 2.73 -2.61 0.20 -0.58 0.44 -4.91 120.64 111.46 2c7h n GLU 42 Ca -0.09 -2.02 -0.13 0.00 -0.42 0.00 0.00 57.16 54.49 2c7h n GLU 42 Cb 0.52 -1.61 0.02 0.00 -0.57 0.00 0.00 31.44 29.79 2c7h n GLU 42 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 2c7h n LYS 43 N 0.87 -2.51 -1.50 3.49 4.76 -0.94 -5.00 118.16 117.33 2c7h n LYS 43 Ca 0.18 0.56 -0.29 0.00 -2.87 0.00 0.00 58.31 55.89 2c7h n LYS 43 Cb 0.60 -4.68 0.18 0.00 -1.84 0.00 0.00 35.03 29.29 2c7h n LYS 43 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 2c7h s LEU 44 N -4.05 1.80 -0.35 -0.35 1.02 0.11 -5.02 118.68 111.83 2c7h s LEU 44 Ca 0.14 0.70 -0.06 0.00 0.02 0.00 0.00 54.13 54.93 2c7h s LEU 44 Cb -0.06 -2.78 0.05 0.00 0.02 0.00 0.00 46.19 43.42 2c7h s LEU 44 CO 0.17 -3.06 0.13 -1.59 0.02 0.00 0.00 176.35 172.03 2c7h s LYS 45 N -5.46 2.55 0.32 1.70 -2.85 -1.26 -4.83 119.74 109.91 2c7h s LYS 45 Ca 0.68 -1.29 0.22 0.00 -1.00 0.00 0.00 55.97 54.59 2c7h s LYS 45 Cb -0.11 -3.50 0.16 0.00 -2.06 0.00 0.00 37.83 32.33 2c7h s LYS 45 CO 0.54 -0.74 1.34 0.00 0.10 0.00 0.00 175.35 176.59 2c7h h ALA 46 N 8.22 0.76 0.00 0.59 0.00 -1.94 -3.14 119.26 123.74 2c7h h ALA 46 Ca -0.22 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.61 2c7h h ALA 46 Cb 1.08 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.88 2c7h h ALA 46 CO 0.63 0.10 -1.16 0.00 0.00 0.00 0.00 179.25 178.82 2c7h n ALA 47 N -2.16 3.14 -0.01 0.00 0.00 -1.26 -4.41 120.51 115.81 2c7h n ALA 47 Ca 0.02 -0.36 -0.04 0.00 0.00 0.00 0.00 53.44 53.05 2c7h n ALA 47 Cb 0.57 -0.49 -0.12 0.00 0.00 0.00 0.00 19.45 19.41 2c7h n ALA 47 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 2c7h n ASP 48 N -1.67 0.66 -4.01 0.00 2.03 -1.25 -4.96 116.55 107.35 2c7h n ASP 48 Ca -0.00 0.30 -0.10 0.00 0.52 0.00 0.00 54.79 55.51 2c7h n ASP 48 Cb 0.29 0.34 -0.07 0.00 -0.72 0.00 0.00 41.12 40.97 2c7h n ASP 48 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2c7h s ASP 50 N -3.01 4.70 -0.13 0.00 -1.08 0.25 -4.37 116.67 113.03 2c7h s ASP 50 Ca 0.22 -0.92 -0.00 0.00 -0.52 0.00 0.00 52.55 51.33 2c7h s ASP 50 Cb 0.02 -0.54 0.02 0.00 -1.46 0.00 0.00 42.92 40.97 2c7h s ASP 50 CO 0.05 -0.56 -0.10 -0.22 0.52 0.00 0.00 175.17 174.85 2c7h s LEU 51 N -3.99 1.40 -0.04 -1.34 2.96 -1.26 -0.72 118.68 115.69 2c7h s LEU 51 Ca 0.44 -0.39 0.06 0.00 -0.22 0.00 0.00 54.13 54.02 2c7h s LEU 51 Cb 0.00 -0.98 -0.01 0.00 0.50 0.00 0.00 46.19 45.70 2c7h s LEU 51 CO 0.25 -0.10 -0.23 -1.58 -1.32 0.00 0.00 176.35 173.37 2c7h s GLN 52 N 1.62 2.20 -0.08 1.98 0.74 0.66 -4.92 119.66 121.86 2c7h s GLN 52 Ca 0.05 -0.84 0.03 0.00 0.05 0.00 0.00 55.36 54.65 2c7h s GLN 52 Cb -0.13 -1.95 -0.02 0.00 1.10 0.00 0.00 33.01 32.01 2c7h s GLN 52 CO -0.09 0.40 -0.16 0.42 -0.55 0.00 0.00 175.29 175.31 2c7h s ILE 53 N -0.27 2.84 0.07 -2.34 1.09 -1.26 -0.54 121.20 120.79 2c7h s ILE 53 Ca 0.01 -0.78 0.09 0.00 -1.10 0.00 0.00 60.65 58.87 2c7h s ILE 53 Cb -0.12 -2.13 -0.03 0.00 -1.06 0.00 0.00 42.46 39.13 2c7h s ILE 53 CO 0.02 0.56 -0.25 -0.89 -0.10 0.00 0.00 174.94 174.28 2c7h s THR 54 N -0.25 2.02 0.22 2.92 2.01 0.26 -0.26 115.64 122.56 2c7h s THR 54 Ca 0.01 -1.43 -0.30 0.00 0.31 0.00 0.00 61.69 60.28 2c7h s THR 54 Cb -0.13 -1.75 -0.08 0.00 0.01 0.00 0.00 72.50 70.54 2c7h s THR 54 CO 0.03 0.24 1.12 0.21 -0.69 0.00 0.00 174.62 175.52 2c7h s ASN 55 N -1.44 7.24 0.35 3.53 3.84 0.13 0.82 114.94 129.41 2c7h s ASN 55 Ca 0.11 2.18 0.24 0.00 0.21 0.00 0.00 52.86 55.59 2c7h s ASN 55 Cb -0.10 -2.61 0.39 0.00 -0.55 0.00 0.00 41.25 38.38 2c7h s ASN 55 CO 0.03 -0.22 1.56 0.00 -2.79 0.00 0.00 177.10 175.68 2c7h h ALA 56 N 4.66 0.92 0.00 1.71 0.00 -1.43 -2.07 119.26 123.05 2c7h h ALA 56 Ca -0.45 0.00 -0.34 0.00 0.00 0.00 0.00 54.91 54.12 2c7h h ALA 56 Cb 1.21 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.95 2c7h h ALA 56 CO 0.71 0.00 -2.11 1.04 0.00 0.00 0.00 179.25 178.88 2c7h n GLN 57 N -2.84 0.57 0.05 0.00 6.02 -1.25 -4.60 117.38 115.33 2c7h n GLN 57 Ca 0.04 0.25 0.11 0.00 -0.01 0.00 0.00 57.00 57.39 2c7h n GLN 57 Cb 0.51 -1.47 0.03 0.00 1.02 0.00 0.00 30.24 30.33 2c7h n GLN 57 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 177.06 176.30 2c7h n THR 58 N -4.31 0.32 -1.25 5.09 -2.24 -1.26 -4.93 114.28 105.70 2c7h n THR 58 Ca -0.43 -0.36 -0.09 0.00 -2.27 0.00 0.00 64.05 60.91 2c7h n THR 58 Cb 0.78 -0.03 -0.04 0.00 -2.10 0.00 0.00 70.33 68.94 2c7h n THR 58 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 2c7h n LYS 59 N -2.22 -0.94 -2.79 -0.78 4.76 -0.78 -4.98 118.16 110.44 2c7h n LYS 59 Ca 0.01 0.75 -0.41 0.00 -2.87 0.00 0.00 58.31 55.79 2c7h n LYS 59 Cb 0.48 -4.72 -0.04 0.00 -1.84 0.00 0.00 35.03 28.91 2c7h n LYS 59 CO 0.00 0.00 0.00 -2.00 -1.37 0.00 0.00 177.40 174.03 2c7h s GLU 60 N -2.49 4.59 0.30 1.97 2.56 -1.26 -4.60 118.70 119.77 2c7h s GLU 60 Ca 0.00 1.32 -0.20 0.00 0.00 0.00 0.00 54.97 56.09 2c7h s GLU 60 Cb 0.00 -3.41 -0.09 0.00 2.00 0.00 0.00 34.13 32.63 2c7h s GLU 60 CO 0.00 0.11 0.80 -1.21 -0.56 0.00 0.00 175.26 174.40 2c7h s GLU 61 N 0.45 4.25 -0.42 4.30 2.02 -1.26 0.23 118.70 128.25 2c7h s GLU 61 Ca 0.47 0.94 -0.09 0.00 0.02 0.00 0.00 54.97 56.31 2c7h s GLU 61 Cb -0.21 -2.65 0.09 0.00 0.10 0.00 0.00 34.13 31.46 2c7h s GLU 61 CO 0.27 0.25 0.27 0.71 0.02 0.00 0.00 175.26 176.78 2c7h s TYR 62 N -1.75 3.37 -0.24 1.61 1.51 0.65 -4.92 117.35 117.57 2c7h s TYR 62 Ca 0.50 -1.65 0.07 0.00 -1.01 0.00 0.00 57.07 54.98 2c7h s TYR 62 Cb -0.14 -3.05 -0.19 0.00 -0.11 0.00 0.00 41.96 38.47 2c7h s TYR 62 CO 0.19 -0.88 -0.14 0.25 -1.11 0.00 0.00 175.55 173.87 2c7h n THR 63 N 4.89 1.43 -3.24 -0.71 -2.24 -1.26 -3.99 114.28 109.16 2c7h n THR 63 Ca -0.09 -0.64 -0.39 0.00 -2.27 0.00 0.00 64.05 60.66 2c7h n THR 63 Cb 0.42 -1.12 -0.06 0.00 -2.10 0.00 0.00 70.33 67.47 2c7h n THR 63 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2c7h s ASP 64 N -6.16 7.11 0.05 3.42 -1.08 -1.26 -4.94 116.67 113.80 2c7h s ASP 64 Ca -0.27 1.31 0.14 0.00 -0.52 0.00 0.00 52.55 53.22 2c7h s ASP 64 Cb 0.08 -2.38 0.61 0.00 -1.46 0.00 0.00 42.92 39.78 2c7h s ASP 64 CO 0.66 0.27 1.45 0.47 0.52 0.00 0.00 175.17 178.54 2c7h n ASP 65 N 1.70 0.11 -0.24 -0.34 9.92 -1.26 -1.02 116.55 125.42 2c7h n ASP 65 Ca -0.10 0.53 0.13 0.00 -0.53 0.00 0.00 54.79 54.83 2c7h n ASP 65 Cb 0.50 -0.55 0.45 0.00 -0.64 0.00 0.00 41.12 40.88 2c7h n ASP 65 CO 0.00 0.00 0.00 0.59 0.13 0.00 0.00 177.20 177.92 2c7h n ASN 66 N -1.63 0.93 -4.77 -2.24 3.02 -1.26 -1.08 115.26 108.24 2c7h n ASN 66 Ca 0.03 -0.87 -0.39 0.00 -0.03 0.00 0.00 54.58 53.31 2c7h n ASN 66 Cb 0.16 0.07 0.00 0.00 -0.61 0.00 0.00 39.78 39.40 2c7h n ASN 66 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2c7h s ALA 67 N -2.44 3.24 -0.05 5.41 0.00 -0.19 -4.70 121.76 123.02 2c7h s ALA 67 Ca 0.27 1.32 0.05 0.00 0.00 0.00 0.00 51.96 53.60 2c7h s ALA 67 Cb 0.20 -3.53 -0.02 0.00 0.00 0.00 0.00 23.12 19.77 2c7h s ALA 67 CO 0.49 -0.98 -0.20 -0.48 0.00 0.00 0.00 175.76 174.60 2c7h s LEU 68 N -2.58 2.39 -0.22 0.00 0.05 -1.26 0.91 118.68 117.97 2c7h s LEU 68 Ca 0.59 -0.36 -0.01 0.00 0.05 0.00 0.00 54.13 54.40 2c7h s LEU 68 Cb -0.40 -1.46 0.02 0.00 -2.05 0.00 0.00 46.19 42.30 2c7h s LEU 68 CO 0.51 0.30 -0.11 -0.63 -0.55 0.00 0.00 176.35 175.86 2c7h s ILE 69 N -0.45 2.63 0.60 1.48 1.09 0.14 -4.90 121.20 121.78 2c7h s ILE 69 Ca 0.05 -0.91 -0.10 0.00 -1.10 0.00 0.00 60.65 58.59 2c7h s ILE 69 Cb -0.12 -2.23 -0.04 0.00 -1.06 0.00 0.00 42.46 39.01 2c7h s ILE 69 CO 0.01 0.37 0.99 -2.16 -0.10 0.00 0.00 174.94 174.05 2c7h s PRO 70 N 1.33 3.56 0.00 2.79 0.04 -1.26 -0.55 135.00 140.91 2c7h s PRO 70 Ca 0.03 0.64 0.12 0.00 0.04 0.00 0.00 61.00 61.82 2c7h s PRO 70 Cb -0.15 -2.13 0.52 0.00 0.04 0.00 0.00 34.50 32.78 2c7h s PRO 70 CO -0.08 -0.53 1.36 0.36 0.04 0.00 0.00 177.00 178.15 2c7h n LYS 71 N -2.68 0.03 0.00 4.56 2.85 -0.88 -1.82 118.16 120.23 2c7h n LYS 71 Ca 0.05 0.28 0.14 0.00 -1.05 0.00 0.00 58.31 57.73 2c7h n LYS 71 Cb 0.54 -1.50 0.57 0.00 -0.65 0.00 0.00 35.03 33.99 2c7h n LYS 71 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 177.40 177.44 2c7h n ASN 72 N -1.46 1.06 -4.43 -5.58 3.02 -1.26 -4.68 115.26 101.93 2c7h n ASN 72 Ca 0.03 -1.19 -0.24 0.00 -0.03 0.00 0.00 54.58 53.15 2c7h n ASN 72 Cb 0.13 0.01 -0.11 0.00 -0.61 0.00 0.00 39.78 39.20 2c7h n ASN 72 CO 0.00 0.00 0.00 -0.44 -2.62 0.00 0.00 177.26 174.20 2c7h s SER 73 N -2.16 3.36 -0.12 6.41 0.01 -0.75 -5.10 113.70 115.35 2c7h s SER 73 Ca 0.36 -0.95 0.01 0.00 1.31 0.00 0.00 55.95 56.67 2c7h s SER 73 Cb 0.21 -0.26 -0.01 0.00 0.21 0.00 0.00 66.02 66.17 2c7h s SER 73 CO 0.39 0.05 -0.15 -0.44 0.41 0.00 0.00 173.24 173.50 2c7h s SER 74 N -3.09 3.86 0.20 2.44 0.01 -1.26 -3.53 113.70 112.33 2c7h s SER 74 Ca 0.24 -0.35 0.07 0.00 1.31 0.00 0.00 55.95 57.22 2c7h s SER 74 Cb -0.06 -1.51 -0.05 0.00 0.21 0.00 0.00 66.02 64.61 2c7h s SER 74 CO 0.12 0.18 -0.13 0.68 0.41 0.00 0.00 173.24 174.49 2c7h s VAL 75 N 0.26 1.65 -0.23 3.43 -7.23 -0.09 -1.17 120.40 117.02 2c7h s VAL 75 Ca -0.10 -2.19 -0.08 0.00 -1.81 0.00 0.00 61.98 57.80 2c7h s VAL 75 Cb -0.16 -2.03 -0.04 0.00 0.56 0.00 0.00 36.38 34.71 2c7h s VAL 75 CO 0.06 -0.60 0.09 -0.63 -0.31 0.00 0.00 175.10 173.70 2c7h s ILE 76 N -3.03 4.69 -0.26 -0.62 -1.09 0.24 -1.67 121.20 119.46 2c7h s ILE 76 Ca 0.22 -0.05 -0.08 0.00 -2.23 0.00 0.00 60.65 58.50 2c7h s ILE 76 Cb -0.00 -3.17 -0.03 0.00 -1.58 0.00 0.00 42.46 37.67 2c7h s ILE 76 CO 0.06 0.37 0.10 -0.69 -1.23 0.00 0.00 174.94 173.55 2c7h s VAL 77 N 1.16 4.59 -0.07 2.92 1.01 0.18 -0.58 120.40 129.62 2c7h s VAL 77 Ca 0.05 -0.08 0.03 0.00 0.00 0.00 0.00 61.98 61.98 2c7h s VAL 77 Cb -0.14 -3.16 0.01 0.00 0.00 0.00 0.00 36.38 33.09 2c7h s VAL 77 CO 0.04 0.32 -0.14 -0.60 0.00 0.00 0.00 175.10 174.71 2c7h s ARG 78 N 1.64 1.92 -0.22 2.72 3.52 0.30 -1.91 118.95 126.92 2c7h s ARG 78 Ca 0.06 -0.50 -0.26 0.00 -0.13 0.00 0.00 55.73 54.90 2c7h s ARG 78 Cb -0.15 -1.56 -0.00 0.00 -1.56 0.00 0.00 34.95 31.68 2c7h s ARG 78 CO 0.06 0.07 0.88 0.50 -0.81 0.00 0.00 175.30 176.00 2c7h s ARG 79 N 0.55 4.23 0.22 5.12 3.52 -1.26 -0.24 118.95 131.09 2c7h s ARG 79 Ca -0.14 1.07 0.11 0.00 -0.13 0.00 0.00 55.73 56.63 2c7h s ARG 79 Cb -0.16 -3.63 -0.05 0.00 -1.56 0.00 0.00 34.95 29.56 2c7h s ARG 79 CO 0.04 -0.50 -0.16 0.96 -0.81 0.00 0.00 175.30 174.84 2c7h s ILE 80 N 2.76 2.75 0.18 4.11 -5.25 0.10 -4.93 121.20 120.93 2c7h s ILE 80 Ca 0.38 -2.02 -0.31 0.00 -0.99 0.00 0.00 60.65 57.71 2c7h s ILE 80 Cb -0.16 -2.39 -0.10 0.00 2.95 0.00 0.00 42.46 42.76 2c7h s ILE 80 CO 0.08 -0.23 1.55 -2.16 -1.79 0.00 0.00 174.94 172.39 2c7h s PRO 81 N -3.08 4.22 0.54 0.37 0.04 -1.26 -0.58 135.00 135.25 2c7h s PRO 81 Ca 0.26 2.36 0.29 0.00 0.04 0.00 0.00 61.00 63.94 2c7h s PRO 81 Cb -0.07 -3.14 1.55 0.00 0.04 0.00 0.00 34.50 32.87 2c7h s PRO 81 CO 0.14 -0.58 2.11 -0.84 0.04 0.00 0.00 177.00 177.87 2c7h h ILE 82 N 3.91 0.52 0.00 0.56 3.07 -1.70 -3.43 117.51 120.44 2c7h h ILE 82 Ca -0.43 -0.42 0.00 0.00 1.55 0.00 0.00 64.86 65.55 2c7h h ILE 82 Cb 1.21 1.28 0.00 0.00 -0.27 0.00 0.00 36.82 39.04 2c7h h ILE 82 CO 0.89 0.09 0.00 0.61 -1.05 0.00 0.00 178.15 178.69 2c7h n GLY 83 N -0.79 -1.65 0.00 0.16 0.00 -1.26 -4.96 105.19 96.70 2c7h n GLY 83 Ca -0.02 0.35 0.00 0.00 0.00 0.00 0.00 46.02 46.35 2c7h n GLY 83 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2c7h n GLY 84 N -1.45 0.00 3.63 -0.02 0.00 -1.26 -5.04 105.19 101.06 2c7h n GLY 84 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 2c7h n GLY 84 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2c7h s VAL 85 N -0.81 3.70 0.00 1.61 1.01 -1.26 -4.87 120.40 119.78 2c7h s VAL 85 Ca 0.00 0.80 0.00 0.00 0.00 0.00 0.00 61.98 62.78 2c7h s VAL 85 Cb 0.00 -3.68 0.00 0.00 0.00 0.00 0.00 36.38 32.70 2c7h s VAL 85 CO 0.00 -0.25 0.00 2.29 0.00 0.00 0.00 175.10 177.14