#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 4.21 -0.96 1.61 0.04 -1.26 -4.93 135.00 133.71 2c7h s PRO 2 Ca 0.00 2.17 -0.24 0.00 0.04 0.00 0.00 61.00 62.97 2c7h s PRO 2 Cb 0.00 -3.81 0.04 0.00 0.04 0.00 0.00 34.50 30.78 2c7h s PRO 2 CO 0.00 -0.76 1.43 -0.51 0.04 0.00 0.00 177.00 177.20 2c7h s LEU 3 N 3.37 3.42 0.17 -3.56 1.43 -1.26 -4.91 118.68 117.34 2c7h s LEU 3 Ca 0.71 -1.22 0.00 0.00 -1.03 0.00 0.00 54.13 52.60 2c7h s LEU 3 Cb -0.34 -2.57 -0.04 0.00 0.03 0.00 0.00 46.19 43.27 2c7h s LEU 3 CO 0.29 -1.61 0.05 -0.83 0.23 0.00 0.00 176.35 174.48 2c7h s GLY 4 N 4.82 1.20 -0.66 -3.19 0.00 -1.26 -4.83 107.32 103.41 2c7h s GLY 4 Ca 0.44 -1.58 0.00 0.00 0.00 0.00 0.00 44.72 43.58 2c7h s GLY 4 CO -0.04 -1.45 0.00 -1.26 0.00 0.00 0.00 173.10 170.34 2c7h n SER 5 N -0.21 -4.24 -0.41 1.64 2.88 -1.26 -4.84 113.62 107.18 2c7h n SER 5 Ca -0.05 0.15 0.00 0.00 -1.33 0.00 0.00 58.87 57.65 2c7h n SER 5 Cb 0.64 -2.29 0.00 0.00 -0.75 0.00 0.00 64.21 61.81 2c7h n SER 5 CO 0.00 0.00 0.00 0.23 -1.23 0.00 0.00 175.04 174.04 2c7h n MET 6 N -2.15 0.00 -3.83 -1.46 0.00 -1.26 -4.73 117.12 103.69 2c7h n MET 6 Ca -0.06 0.00 -0.26 0.00 0.00 0.00 0.00 57.70 57.38 2c7h n MET 6 Cb 0.29 0.00 -0.17 0.00 0.00 0.00 0.00 33.22 33.34 2c7h n MET 6 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 175.97 174.85 2c7h s SER 7 N -4.00 2.19 -0.03 7.83 0.01 -1.21 -5.05 113.70 113.44 2c7h s SER 7 Ca 0.00 -0.36 0.02 0.00 1.31 0.00 0.00 55.95 56.92 2c7h s SER 7 Cb 0.00 -0.68 0.01 0.00 0.21 0.00 0.00 66.02 65.56 2c7h s SER 7 CO 0.00 -0.18 -0.08 0.00 0.41 0.00 0.00 173.24 173.39 2c7h s VAL 9 N 0.32 4.34 -0.18 0.00 1.01 -0.70 -4.50 120.40 120.69 2c7h s VAL 9 Ca -0.05 -0.21 -0.25 0.00 0.00 0.00 0.00 61.98 61.47 2c7h s VAL 9 Cb -0.09 -2.88 -0.01 0.00 0.00 0.00 0.00 36.38 33.39 2c7h s VAL 9 CO 0.00 0.54 0.84 -1.00 0.00 0.00 0.00 175.10 175.48 2c7h s HIS 10 N -0.20 3.40 0.01 5.22 3.76 -1.24 -1.51 115.29 124.73 2c7h s HIS 10 Ca 0.06 1.25 0.01 0.00 -0.15 0.00 0.00 55.06 56.23 2c7h s HIS 10 Cb -0.12 -3.03 -0.01 0.00 1.11 0.00 0.00 32.58 30.53 2c7h s HIS 10 CO 0.02 -0.27 -0.05 1.52 -0.85 0.00 0.00 174.74 175.11 2c7h s TYR 11 N 2.28 0.44 -0.19 1.40 1.13 0.04 -0.35 117.35 122.10 2c7h s TYR 11 Ca 0.38 -0.17 0.01 0.00 -1.41 0.00 0.00 57.07 55.88 2c7h s TYR 11 Cb -0.16 -0.28 0.04 0.00 -1.10 0.00 0.00 41.96 40.45 2c7h s TYR 11 CO 0.12 -0.03 -0.12 -1.59 -2.51 0.00 0.00 175.55 171.41 2c7h s LYS 12 N -0.43 2.21 0.93 -3.49 -2.85 -0.57 0.11 119.74 115.64 2c7h s LYS 12 Ca -0.01 -0.80 -0.12 0.00 -1.00 0.00 0.00 55.97 54.04 2c7h s LYS 12 Cb -0.04 -2.38 0.15 0.00 -2.06 0.00 0.00 37.83 33.50 2c7h s LYS 12 CO -0.00 -0.37 1.09 0.12 0.10 0.00 0.00 175.35 176.29 2c7h s PHE 13 N 1.39 2.20 0.34 1.78 2.19 -1.26 -0.59 117.98 124.04 2c7h s PHE 13 Ca 0.00 1.24 0.05 0.00 0.33 0.00 0.00 56.93 58.56 2c7h s PHE 13 Cb -0.15 -3.18 0.71 0.00 -1.31 0.00 0.00 43.02 39.09 2c7h s PHE 13 CO -0.09 -2.57 1.92 0.77 1.83 0.00 0.00 175.22 177.08 2c7h h SER 14 N -1.68 0.72 -0.38 6.13 0.02 -1.75 -1.11 113.55 115.50 2c7h h SER 14 Ca -0.51 0.01 0.00 0.00 -0.84 0.00 0.00 61.79 60.46 2c7h h SER 14 Cb 1.29 -0.14 0.00 0.00 0.14 0.00 0.00 62.40 63.69 2c7h h SER 14 CO 0.54 0.44 0.00 -0.24 -1.14 0.00 0.00 176.83 176.43 2c7h n SER 15 N -4.50 4.59 -4.85 3.07 2.88 -1.26 -4.92 113.62 108.62 2c7h n SER 15 Ca 0.13 -2.97 -0.37 0.00 -1.33 0.00 0.00 58.87 54.33 2c7h n SER 15 Cb 0.28 -0.60 -0.06 0.00 -0.75 0.00 0.00 64.21 63.09 2c7h n SER 15 CO 0.00 0.00 0.00 -0.75 -1.23 0.00 0.00 175.04 173.06 2c7h s LYS 16 N -2.77 3.58 -0.06 -1.46 2.47 -0.42 -4.98 119.74 116.09 2c7h s LYS 16 Ca 0.47 -0.11 0.10 0.00 -1.56 0.00 0.00 55.97 54.86 2c7h s LYS 16 Cb 0.37 -3.23 -0.24 0.00 -1.46 0.00 0.00 37.83 33.27 2c7h s LYS 16 CO 0.12 0.70 0.58 1.28 0.16 0.00 0.00 175.35 178.19 2c7h n LEU 17 N 2.22 1.14 -4.50 5.43 4.77 -1.26 -4.61 117.00 120.19 2c7h n LEU 17 Ca -0.19 0.36 -0.25 0.00 -0.03 0.00 0.00 56.01 55.90 2c7h n LEU 17 Cb 0.54 -0.04 -0.08 0.00 -2.33 0.00 0.00 43.42 41.51 2c7h n LEU 17 CO 0.32 0.47 -0.20 0.20 -1.33 0.00 0.00 177.39 176.86 2c7h s ASN 18 N -6.22 2.72 0.31 -1.43 0.01 -1.26 -5.11 114.94 103.96 2c7h s ASN 18 Ca -0.08 -1.64 -0.20 0.00 -0.71 0.00 0.00 52.86 50.22 2c7h s ASN 18 Cb 0.08 0.45 -0.09 0.00 0.41 0.00 0.00 41.25 42.09 2c7h s ASN 18 CO 0.81 -0.90 0.82 -0.31 -1.51 0.00 0.00 177.10 176.01 2c7h s TYR 19 N -3.23 3.53 0.53 2.20 1.51 -1.26 -4.61 117.35 116.02 2c7h s TYR 19 Ca 0.25 1.48 0.03 0.00 -1.01 0.00 0.00 57.07 57.82 2c7h s TYR 19 Cb 0.03 -2.71 0.01 0.00 -0.11 0.00 0.00 41.96 39.18 2c7h s TYR 19 CO 0.15 0.17 0.19 0.34 -1.11 0.00 0.00 175.55 175.28 2c7h s ASP 20 N -1.89 4.37 -0.06 2.29 -1.08 0.12 -4.86 116.67 115.55 2c7h s ASP 20 Ca 0.51 -1.47 -0.01 0.00 -0.52 0.00 0.00 52.55 51.06 2c7h s ASP 20 Cb -0.14 0.49 0.03 0.00 -1.46 0.00 0.00 42.92 41.84 2c7h s ASP 20 CO 0.19 -0.98 0.01 0.42 0.52 0.00 0.00 175.17 175.33 2c7h s THR 21 N -2.83 0.27 -0.11 1.71 -4.23 -1.25 -0.78 115.64 108.42 2c7h s THR 21 Ca 0.18 0.16 -0.13 0.00 -1.18 0.00 0.00 61.69 60.73 2c7h s THR 21 Cb -0.00 -0.43 -0.05 0.00 1.34 0.00 0.00 72.50 73.36 2c7h s THR 21 CO 0.11 0.23 0.31 0.54 -0.54 0.00 0.00 174.62 175.27 2c7h s VAL 22 N 1.83 5.26 -0.21 2.29 0.11 -0.57 -4.85 120.40 124.25 2c7h s VAL 22 Ca 0.02 0.59 -0.09 0.00 -2.93 0.00 0.00 61.98 59.57 2c7h s VAL 22 Cb -0.12 -3.62 -0.04 0.00 -1.53 0.00 0.00 36.38 31.06 2c7h s VAL 22 CO -0.04 0.48 0.10 0.42 -3.33 0.00 0.00 175.10 172.73 2c7h s THR 23 N -0.23 4.93 0.24 5.04 -4.23 -1.26 -1.72 115.64 118.40 2c7h s THR 23 Ca 0.19 0.03 -0.00 0.00 -1.18 0.00 0.00 61.69 60.72 2c7h s THR 23 Cb -0.14 -3.27 -0.03 0.00 1.34 0.00 0.00 72.50 70.40 2c7h s THR 23 CO 0.07 0.40 0.20 0.72 -0.54 0.00 0.00 174.62 175.47 2c7h s PHE 24 N 0.82 1.22 -0.11 3.99 -0.71 -0.13 -5.02 117.98 118.04 2c7h s PHE 24 Ca 0.05 -1.38 -0.03 0.00 -1.04 0.00 0.00 56.93 54.53 2c7h s PHE 24 Cb -0.13 -0.51 -0.03 0.00 -1.21 0.00 0.00 43.02 41.13 2c7h s PHE 24 CO 0.02 -0.74 0.00 -0.51 -1.34 0.00 0.00 175.22 172.66 2c7h s ASP 25 N -3.20 5.22 0.00 1.98 1.01 -1.26 -3.33 116.67 117.10 2c7h s ASP 25 Ca 0.38 0.10 0.00 0.00 0.71 0.00 0.00 52.55 53.74 2c7h s ASP 25 Cb 0.05 -1.57 0.00 0.00 1.01 0.00 0.00 42.92 42.41 2c7h s ASP 25 CO 0.15 0.33 0.00 0.61 0.21 0.00 0.00 175.17 176.47 2c7h n GLY 26 N 2.48 -0.10 0.10 0.21 0.00 -1.26 -4.76 105.19 101.86 2c7h n GLY 26 Ca -0.18 -2.25 -0.11 0.00 0.00 0.00 0.00 46.02 43.47 2c7h n GLY 26 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2c7h n LEU 27 N 0.00 0.62 -3.87 0.99 -0.00 -1.26 -4.77 117.00 108.71 2c7h n LEU 27 Ca 0.00 0.06 -0.11 0.00 -0.00 0.00 0.00 56.01 55.96 2c7h n LEU 27 Cb 0.00 0.21 -0.11 0.00 -0.00 0.00 0.00 43.42 43.52 2c7h n LEU 27 CO 0.00 0.55 -0.19 -1.38 -0.00 0.00 0.00 177.39 176.37 2c7h s HIS 28 N -2.51 0.01 -0.19 1.96 -3.43 -1.26 -1.37 115.29 108.50 2c7h s HIS 28 Ca -0.13 -0.05 -0.03 0.00 -0.80 0.00 0.00 55.06 54.06 2c7h s HIS 28 Cb 0.07 -0.04 -0.01 0.00 -1.43 0.00 0.00 32.58 31.17 2c7h s HIS 28 CO 0.80 -0.23 -0.07 -1.50 -2.00 0.00 0.00 174.74 171.74 2c7h s ILE 29 N -1.06 3.35 0.44 -5.38 2.07 0.63 -4.87 121.20 116.38 2c7h s ILE 29 Ca -0.11 -0.52 -0.25 0.00 -1.41 0.00 0.00 60.65 58.35 2c7h s ILE 29 Cb -0.06 -2.49 -0.08 0.00 0.13 0.00 0.00 42.46 39.96 2c7h s ILE 29 CO 0.01 0.46 1.34 -0.44 -1.91 0.00 0.00 174.94 174.40 2c7h s SER 30 N 1.03 6.07 0.27 4.50 0.01 -1.26 0.28 113.70 124.59 2c7h s SER 30 Ca 0.00 2.72 -0.01 0.00 1.31 0.00 0.00 55.95 59.97 2c7h s SER 30 Cb -0.15 -2.64 0.48 0.00 0.21 0.00 0.00 66.02 63.93 2c7h s SER 30 CO -0.00 -1.03 1.82 0.25 0.41 0.00 0.00 173.24 174.70 2c7h h LEU 31 N 2.41 0.82 -0.61 2.44 5.85 0.81 0.12 115.31 127.15 2c7h h LEU 31 Ca -0.50 0.05 0.10 0.00 0.84 0.00 0.00 57.88 58.37 2c7h h LEU 31 Cb 1.26 -0.11 -0.08 0.00 0.37 0.00 0.00 40.66 42.10 2c7h h LEU 31 CO 0.61 0.45 0.21 0.00 -0.34 0.00 0.00 178.44 179.37 2c7h h ASP 33 N 0.37 0.92 -0.33 0.00 3.58 -1.41 -2.63 116.42 116.92 2c7h h ASP 33 Ca 0.32 -0.67 0.02 0.00 0.42 0.00 0.00 57.03 57.11 2c7h h ASP 33 Cb 0.42 -0.28 -0.02 0.00 1.72 0.00 0.00 39.33 41.17 2c7h h ASP 33 CO -0.34 1.47 0.17 0.25 -2.88 0.00 0.00 179.24 177.92 2c7h h LEU 34 N 0.46 0.27 -0.17 2.28 7.12 -0.30 -1.35 115.31 123.61 2c7h h LEU 34 Ca -0.09 0.01 -0.09 0.00 0.13 0.00 0.00 57.88 57.84 2c7h h LEU 34 Cb 1.56 -0.04 -0.00 0.00 -0.53 0.00 0.00 40.66 41.64 2c7h h LEU 34 CO 0.18 0.20 -0.25 0.11 -0.13 0.00 0.00 178.44 178.55 2c7h h LYS 35 N 0.36 0.48 -0.72 1.25 1.57 -0.67 -2.71 116.57 116.13 2c7h h LYS 35 Ca 0.13 -0.28 -0.01 0.00 -1.87 0.00 0.00 60.65 58.62 2c7h h LYS 35 Cb 0.03 0.02 -0.03 0.00 0.08 0.00 0.00 32.23 32.33 2c7h h LYS 35 CO -0.08 0.87 0.39 0.87 -0.57 0.00 0.00 179.45 180.94 2c7h h LYS 36 N 0.12 0.99 -0.34 3.15 6.56 -1.19 0.54 116.57 126.40 2c7h h LYS 36 Ca 0.02 -0.10 -0.03 0.00 -1.06 0.00 0.00 60.65 59.47 2c7h h LYS 36 Cb 0.83 -0.20 -0.01 0.00 -0.57 0.00 0.00 32.23 32.27 2c7h h LYS 36 CO 0.06 0.72 0.08 1.96 -2.06 0.00 0.00 179.45 180.21 2c7h h GLN 37 N 1.00 0.55 -0.11 3.15 4.20 -1.25 -2.70 115.11 119.96 2c7h h GLN 37 Ca 0.25 -0.13 -0.20 0.00 0.06 0.00 0.00 58.65 58.63 2c7h h GLN 37 Cb 0.02 -0.07 0.01 0.00 0.30 0.00 0.00 27.48 27.74 2c7h h GLN 37 CO -0.04 0.61 -0.71 0.82 -0.67 0.00 0.00 178.83 178.83 2c7h h ILE 38 N 0.40 1.32 -0.66 2.54 2.04 -0.94 -1.72 117.51 120.48 2c7h h ILE 38 Ca 0.11 -1.97 -0.03 0.00 1.00 0.00 0.00 64.86 63.97 2c7h h ILE 38 Cb 0.30 2.15 -0.03 0.00 -0.74 0.00 0.00 36.82 38.50 2c7h h ILE 38 CO 0.00 0.61 0.30 0.24 0.00 0.00 0.00 178.15 179.30 2c7h h MET 39 N 0.34 0.95 -0.12 2.37 2.86 -0.01 0.21 114.93 121.53 2c7h h MET 39 Ca -0.06 -0.14 -0.17 0.00 -2.06 0.00 0.00 59.70 57.27 2c7h h MET 39 Cb 1.36 -0.17 0.01 0.00 0.06 0.00 0.00 31.60 32.85 2c7h h MET 39 CO 0.15 0.75 -0.60 0.78 1.06 0.00 0.00 176.91 179.05 2c7h h GLY 40 N 1.02 0.68 0.84 8.32 0.00 -1.50 0.35 103.07 112.78 2c7h h GLY 40 Ca 0.23 -0.96 -0.02 0.00 0.00 0.00 0.00 47.33 46.59 2c7h h GLY 40 CO -0.03 0.85 0.04 -0.09 0.00 0.00 0.00 176.54 177.31 2c7h h ARG 41 N 0.26 0.27 -0.40 4.80 2.43 -0.62 -2.92 114.38 118.20 2c7h h ARG 41 Ca -0.04 -0.07 0.00 0.00 -0.81 0.00 0.00 59.98 59.06 2c7h h ARG 41 Cb 1.24 -0.03 0.00 0.00 -0.42 0.00 0.00 29.97 30.75 2c7h h ARG 41 CO 0.12 0.42 0.00 0.39 -1.51 0.00 0.00 179.97 179.39 2c7h n GLU 42 N -4.80 1.90 -3.42 0.20 -0.58 0.68 -4.91 120.64 109.71 2c7h n GLU 42 Ca -0.05 -1.25 -0.20 0.00 -0.42 0.00 0.00 57.16 55.25 2c7h n GLU 42 Cb 0.17 -1.33 0.05 0.00 -0.57 0.00 0.00 31.44 29.75 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 0.47 -1.66 -3.44 3.49 4.01 -1.10 -4.98 118.16 114.95 2c7h n LYS 43 Ca 0.12 0.80 -0.34 0.00 -0.51 0.00 0.00 58.31 58.37 2c7h n LYS 43 Cb 0.33 -4.98 -0.06 0.00 -0.51 0.00 0.00 35.03 29.82 2c7h n LYS 43 CO 0.00 0.00 0.00 -0.51 -1.11 0.00 0.00 177.40 175.78 2c7h s LEU 44 N -5.57 4.31 -0.56 -0.35 1.02 0.12 -5.03 118.68 112.62 2c7h s LEU 44 Ca 0.37 0.96 -0.19 0.00 0.02 0.00 0.00 54.13 55.29 2c7h s LEU 44 Cb -0.09 -3.25 0.09 0.00 0.02 0.00 0.00 46.19 42.96 2c7h s LEU 44 CO 0.80 0.10 0.66 -1.59 0.02 0.00 0.00 176.35 176.33 2c7h s LYS 45 N -2.09 3.06 0.00 1.70 0.00 -1.26 -4.81 119.74 116.33 2c7h s LYS 45 Ca 0.38 -1.22 0.19 0.00 0.00 0.00 0.00 55.97 55.31 2c7h s LYS 45 Cb -0.14 -4.22 0.84 0.00 0.00 0.00 0.00 37.83 34.31 2c7h s LYS 45 CO 0.19 -1.42 1.59 0.00 0.00 0.00 0.00 175.35 175.71 2c7h n ALA 46 N 6.18 1.90 1.41 0.59 0.00 -1.26 -0.36 120.51 128.96 2c7h n ALA 46 Ca -0.09 -0.07 0.14 0.00 0.00 0.00 0.00 53.44 53.41 2c7h n ALA 46 Cb 0.43 -1.30 0.47 0.00 0.00 0.00 0.00 19.45 19.05 2c7h n ALA 46 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2c7h n ALA 47 N -1.43 2.75 0.00 0.00 0.00 -1.26 -4.30 120.51 116.27 2c7h n ALA 47 Ca 0.06 -0.43 0.00 0.00 0.00 0.00 0.00 53.44 53.07 2c7h n ALA 47 Cb 0.19 -1.15 0.00 0.00 0.00 0.00 0.00 19.45 18.49 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 -0.10 2.34 -4.38 0.00 2.03 -0.66 -4.96 116.55 110.82 2c7h n ASP 48 Ca 0.17 0.00 -0.19 0.00 0.52 0.00 0.00 54.79 55.28 2c7h n ASP 48 Cb 0.36 0.08 -0.10 0.00 -0.72 0.00 0.00 41.12 40.73 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 -3.38 2.85 -0.27 0.00 2.15 0.24 -4.15 116.67 114.10 2c7h s ASP 50 Ca 0.30 -1.35 0.01 0.00 0.43 0.00 0.00 52.55 51.94 2c7h s ASP 50 Cb 0.06 -0.18 0.05 0.00 -0.30 0.00 0.00 42.92 42.54 2c7h s ASP 50 CO 0.11 -0.53 -0.07 -0.22 -0.17 0.00 0.00 175.17 174.29 2c7h s LEU 51 N -3.55 3.50 -0.33 -1.34 2.96 -1.26 -1.19 118.68 117.48 2c7h s LEU 51 Ca 0.35 -1.24 -0.06 0.00 -0.22 0.00 0.00 54.13 52.96 2c7h s LEU 51 Cb 0.08 -1.62 0.03 0.00 0.50 0.00 0.00 46.19 45.19 2c7h s LEU 51 CO 0.16 -0.20 0.10 -1.58 -1.32 0.00 0.00 176.35 173.51 2c7h s GLN 52 N 1.20 2.74 -0.05 1.98 0.74 0.81 -4.95 119.66 122.13 2c7h s GLN 52 Ca -0.06 -1.10 -0.16 0.00 0.05 0.00 0.00 55.36 54.10 2c7h s GLN 52 Cb -0.19 -3.43 -0.05 0.00 1.10 0.00 0.00 33.01 30.44 2c7h s GLN 52 CO -0.04 -0.61 0.42 0.42 -0.55 0.00 0.00 175.29 174.94 2c7h s ILE 53 N 1.43 5.09 0.02 -2.34 -1.09 -1.24 -0.88 121.20 122.18 2c7h s ILE 53 Ca -0.01 0.86 0.07 0.00 -2.23 0.00 0.00 60.65 59.35 2c7h s ILE 53 Cb -0.19 -3.74 -0.02 0.00 -1.58 0.00 0.00 42.46 36.92 2c7h s ILE 53 CO 0.03 0.49 -0.22 -0.89 -1.23 0.00 0.00 174.94 173.11 2c7h s THR 54 N -0.44 1.77 0.24 2.92 2.01 0.19 0.54 115.64 122.86 2c7h s THR 54 Ca 0.24 -1.14 -0.30 0.00 0.31 0.00 0.00 61.69 60.80 2c7h s THR 54 Cb -0.16 -1.51 -0.09 0.00 0.01 0.00 0.00 72.50 70.75 2c7h s THR 54 CO 0.12 0.33 1.32 0.21 -0.69 0.00 0.00 174.62 175.90 2c7h s ASN 55 N -0.97 6.85 0.34 3.53 3.84 0.11 0.89 114.94 129.53 2c7h s ASN 55 Ca 0.09 2.50 0.15 0.00 0.21 0.00 0.00 52.86 55.81 2c7h s ASN 55 Cb -0.09 -2.62 0.61 0.00 -0.55 0.00 0.00 41.25 38.60 2c7h s ASN 55 CO 0.01 -0.53 1.72 0.00 -2.79 0.00 0.00 177.10 175.51 2c7h h ALA 56 N 4.73 1.08 0.00 1.71 0.00 -1.75 -1.04 119.26 123.99 2c7h h ALA 56 Ca -0.46 -0.41 -0.05 0.00 0.00 0.00 0.00 54.91 53.99 2c7h h ALA 56 Cb 1.22 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.93 2c7h h ALA 56 CO 0.74 0.56 -0.72 1.04 0.00 0.00 0.00 179.25 180.87 2c7h n GLN 57 N -3.74 0.48 0.06 0.00 6.02 -1.26 -4.60 117.38 114.35 2c7h n GLN 57 Ca -0.01 0.50 0.11 0.00 -0.01 0.00 0.00 57.00 57.60 2c7h n GLN 57 Cb 0.52 -1.68 0.03 0.00 1.02 0.00 0.00 30.24 30.13 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 -4.57 0.39 -1.75 5.09 -2.24 -1.25 -4.93 114.28 105.02 2c7h n THR 58 Ca -0.13 -0.40 -0.16 0.00 -2.27 0.00 0.00 64.05 61.09 2c7h n THR 58 Cb 0.37 -0.11 -0.05 0.00 -2.10 0.00 0.00 70.33 68.44 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 -2.33 -1.16 -1.99 -0.78 4.01 -0.39 -4.96 118.16 110.57 2c7h n LYS 59 Ca 0.01 0.96 -0.43 0.00 -0.51 0.00 0.00 58.31 58.34 2c7h n LYS 59 Cb 0.50 -5.20 -0.03 0.00 -0.51 0.00 0.00 35.03 29.79 2c7h n LYS 59 CO 0.00 0.00 0.00 -2.00 -1.11 0.00 0.00 177.40 174.29 2c7h s GLU 60 N -3.84 3.83 -0.11 1.97 2.12 -1.26 -4.56 118.70 116.87 2c7h s GLU 60 Ca 0.00 1.91 -0.23 0.00 0.36 0.00 0.00 54.97 57.02 2c7h s GLU 60 Cb 0.00 -4.08 -0.03 0.00 0.26 0.00 0.00 34.13 30.28 2c7h s GLU 60 CO 0.00 -1.26 0.68 -1.21 -0.54 0.00 0.00 175.26 172.93 2c7h s GLU 61 N 4.71 4.37 -0.80 4.30 2.02 -1.26 0.04 118.70 132.08 2c7h s GLU 61 Ca 0.77 0.80 -0.18 0.00 0.02 0.00 0.00 54.97 56.37 2c7h s GLU 61 Cb -0.29 -3.48 0.13 0.00 0.10 0.00 0.00 34.13 30.59 2c7h s GLU 61 CO 0.31 -0.02 0.95 0.71 0.02 0.00 0.00 175.26 177.23 2c7h s TYR 62 N 1.12 3.14 -0.14 1.61 2.02 0.19 -4.75 117.35 120.54 2c7h s TYR 62 Ca 0.35 -1.29 0.19 0.00 -0.37 0.00 0.00 57.07 55.95 2c7h s TYR 62 Cb -0.17 -4.15 -0.26 0.00 -0.40 0.00 0.00 41.96 36.98 2c7h s TYR 62 CO 0.15 -1.39 0.30 0.25 -1.57 0.00 0.00 175.55 173.29 2c7h n THR 63 N 5.31 1.01 -3.28 -0.71 -2.24 -1.26 -3.74 114.28 109.37 2c7h n THR 63 Ca 0.11 -0.74 -0.38 0.00 -2.27 0.00 0.00 64.05 60.77 2c7h n THR 63 Cb 0.47 -0.40 -0.06 0.00 -2.10 0.00 0.00 70.33 68.24 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 -5.29 6.90 0.18 3.42 -1.08 -1.26 -4.94 116.67 114.59 2c7h s ASP 64 Ca -0.08 1.07 0.20 0.00 -0.52 0.00 0.00 52.55 53.22 2c7h s ASP 64 Cb 0.09 -2.33 0.85 0.00 -1.46 0.00 0.00 42.92 40.07 2c7h s ASP 64 CO 0.85 0.13 1.61 0.47 0.52 0.00 0.00 175.17 178.75 2c7h n ASP 65 N 2.69 0.44 -0.01 -0.34 9.92 -1.26 -1.22 116.55 126.77 2c7h n ASP 65 Ca -0.08 0.62 0.13 0.00 -0.53 0.00 0.00 54.79 54.93 2c7h n ASP 65 Cb 0.51 -0.71 0.51 0.00 -0.64 0.00 0.00 41.12 40.80 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 -2.00 0.21 -4.75 -2.24 3.02 -1.26 -1.98 115.26 106.25 2c7h n ASN 66 Ca 0.02 0.12 -0.41 0.00 -0.03 0.00 0.00 54.58 54.27 2c7h n ASN 66 Cb 0.19 -0.21 -0.02 0.00 -0.61 0.00 0.00 39.78 39.13 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 -2.92 3.65 -0.05 5.41 0.00 -0.36 -4.73 121.76 122.76 2c7h s ALA 67 Ca 0.15 1.44 0.05 0.00 0.00 0.00 0.00 51.96 53.61 2c7h s ALA 67 Cb 0.19 -3.59 -0.02 0.00 0.00 0.00 0.00 23.12 19.70 2c7h s ALA 67 CO 0.57 -0.86 -0.21 -0.48 0.00 0.00 0.00 175.76 174.78 2c7h s LEU 68 N -0.80 2.31 -0.21 0.00 0.05 -1.26 0.11 118.68 118.88 2c7h s LEU 68 Ca 0.59 -0.39 -0.01 0.00 0.05 0.00 0.00 54.13 54.37 2c7h s LEU 68 Cb -0.44 -1.43 0.01 0.00 -2.05 0.00 0.00 46.19 42.28 2c7h s LEU 68 CO 0.49 0.29 -0.13 -0.63 -0.55 0.00 0.00 176.35 175.82 2c7h s ILE 69 N -0.42 2.55 0.60 1.48 1.09 0.14 -4.89 121.20 121.75 2c7h s ILE 69 Ca 0.04 -0.86 -0.13 0.00 -1.10 0.00 0.00 60.65 58.60 2c7h s ILE 69 Cb -0.12 -2.16 -0.04 0.00 -1.06 0.00 0.00 42.46 39.08 2c7h s ILE 69 CO 0.01 0.43 1.02 -2.16 -0.10 0.00 0.00 174.94 174.15 2c7h s PRO 70 N 1.34 3.57 0.00 2.79 0.04 -1.26 -0.27 135.00 141.21 2c7h s PRO 70 Ca 0.04 0.88 0.15 0.00 0.04 0.00 0.00 61.00 62.12 2c7h s PRO 70 Cb -0.14 -2.08 0.79 0.00 0.04 0.00 0.00 34.50 33.11 2c7h s PRO 70 CO -0.09 -0.59 1.43 0.36 0.04 0.00 0.00 177.00 178.15 2c7h n LYS 71 N -2.41 0.23 0.00 4.56 2.85 -0.47 -1.73 118.16 121.19 2c7h n LYS 71 Ca 0.07 0.13 0.14 0.00 -1.05 0.00 0.00 58.31 57.60 2c7h n LYS 71 Cb 0.54 -1.50 0.49 0.00 -0.65 0.00 0.00 35.03 33.91 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 -1.27 0.84 -4.41 -5.58 3.02 -1.26 -4.70 115.26 101.90 2c7h n ASN 72 Ca 0.07 -0.83 -0.23 0.00 -0.03 0.00 0.00 54.58 53.56 2c7h n ASN 72 Cb 0.12 0.04 -0.11 0.00 -0.61 0.00 0.00 39.78 39.22 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 -2.43 3.16 -0.04 6.41 0.01 -0.70 -5.10 113.70 115.00 2c7h s SER 73 Ca 0.28 -0.96 0.06 0.00 1.31 0.00 0.00 55.95 56.64 2c7h s SER 73 Cb 0.20 -0.23 -0.02 0.00 0.21 0.00 0.00 66.02 66.18 2c7h s SER 73 CO 0.48 -0.00 -0.23 -0.44 0.41 0.00 0.00 173.24 173.45 2c7h s SER 74 N -3.14 3.25 0.21 2.44 0.01 -1.26 -3.64 113.70 111.57 2c7h s SER 74 Ca 0.24 -0.44 0.04 0.00 1.31 0.00 0.00 55.95 57.10 2c7h s SER 74 Cb -0.05 -0.66 -0.05 0.00 0.21 0.00 0.00 66.02 65.47 2c7h s SER 74 CO 0.11 0.29 -0.04 0.68 0.41 0.00 0.00 173.24 174.68 2c7h s VAL 75 N -0.42 1.16 -0.13 3.43 -7.23 0.52 -2.23 120.40 115.50 2c7h s VAL 75 Ca 0.04 -2.06 -0.03 0.00 -1.81 0.00 0.00 61.98 58.13 2c7h s VAL 75 Cb -0.12 -2.22 -0.03 0.00 0.56 0.00 0.00 36.38 34.58 2c7h s VAL 75 CO 0.01 -0.44 -0.05 -0.63 -0.31 0.00 0.00 175.10 173.69 2c7h s ILE 76 N -3.33 3.83 -0.35 -0.62 -1.09 0.26 -1.51 121.20 118.39 2c7h s ILE 76 Ca 0.25 -0.39 -0.03 0.00 -2.23 0.00 0.00 60.65 58.25 2c7h s ILE 76 Cb 0.04 -2.65 0.07 0.00 -1.58 0.00 0.00 42.46 38.34 2c7h s ILE 76 CO 0.07 0.52 0.10 0.54 -1.23 0.00 0.00 174.94 174.94 2c7h s VAL 77 N 0.08 3.30 -0.17 2.92 0.11 0.24 0.53 120.40 127.42 2c7h s VAL 77 Ca -0.01 -1.55 -0.07 0.00 -2.93 0.00 0.00 61.98 57.42 2c7h s VAL 77 Cb -0.14 -3.02 -0.04 0.00 -1.53 0.00 0.00 36.38 31.66 2c7h s VAL 77 CO 0.03 -0.33 0.07 -0.60 -3.33 0.00 0.00 175.10 170.94 2c7h s ARG 78 N 1.26 3.86 -0.30 1.54 3.52 -0.06 -1.81 118.95 126.96 2c7h s ARG 78 Ca 0.00 -0.32 -0.20 0.00 -0.13 0.00 0.00 55.73 55.09 2c7h s ARG 78 Cb -0.21 -3.20 -0.01 0.00 -1.56 0.00 0.00 34.95 29.98 2c7h s ARG 78 CO -0.01 0.36 0.62 0.50 -0.81 0.00 0.00 175.30 175.96 2c7h s ARG 79 N 0.12 3.91 0.14 5.12 3.52 -1.26 -0.13 118.95 130.37 2c7h s ARG 79 Ca 0.05 0.30 0.09 0.00 -0.13 0.00 0.00 55.73 56.04 2c7h s ARG 79 Cb -0.12 -3.72 -0.04 0.00 -1.56 0.00 0.00 34.95 29.51 2c7h s ARG 79 CO 0.00 -0.55 -0.18 0.96 -0.81 0.00 0.00 175.30 174.72 2c7h s ILE 80 N 2.58 2.82 0.23 4.11 -5.25 -0.34 -4.94 121.20 120.41 2c7h s ILE 80 Ca 0.25 -1.63 -0.30 0.00 -0.99 0.00 0.00 60.65 57.98 2c7h s ILE 80 Cb -0.15 -2.32 -0.09 0.00 2.95 0.00 0.00 42.46 42.85 2c7h s ILE 80 CO 0.11 0.02 1.09 -2.16 -1.79 0.00 0.00 174.94 172.21 2c7h s PRO 81 N -2.36 4.64 -0.01 0.37 0.04 -1.26 0.79 135.00 137.21 2c7h s PRO 81 Ca 0.20 1.74 -0.20 0.00 0.04 0.00 0.00 61.00 62.77 2c7h s PRO 81 Cb -0.10 -3.24 -0.25 0.00 0.04 0.00 0.00 34.50 30.95 2c7h s PRO 81 CO 0.11 0.18 1.05 -0.84 0.04 0.00 0.00 177.00 177.54 2c7h h ILE 82 N 3.39 1.44 0.00 0.56 3.07 -1.68 -3.44 117.51 120.85 2c7h h ILE 82 Ca -0.45 -2.20 -0.09 0.00 1.55 0.00 0.00 64.86 63.67 2c7h h ILE 82 Cb 1.21 2.74 -0.12 0.00 -0.27 0.00 0.00 36.82 40.38 2c7h h ILE 82 CO 0.70 0.64 0.01 0.61 -1.05 0.00 0.00 178.15 179.05 2c7h n GLY 83 N 1.21 -1.59 3.42 0.16 0.00 -1.26 -5.06 105.19 102.08 2c7h n GLY 83 Ca -0.11 0.92 -0.16 0.00 0.00 0.00 0.00 46.02 46.67 2c7h n GLY 83 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2c7h s GLY 84 N -0.24 -0.41 -0.41 -0.02 0.00 -1.26 -5.05 107.32 99.93 2c7h s GLY 84 Ca 0.23 1.06 -0.24 0.00 0.00 0.00 0.00 44.72 45.78 2c7h s GLY 84 CO -0.14 0.78 0.82 -1.34 0.00 0.00 0.00 173.10 173.21 2c7h s VAL 85 N -0.91 4.65 0.00 1.40 -7.23 -1.26 -4.88 120.40 112.17 2c7h s VAL 85 Ca -0.09 0.73 0.00 0.00 -1.81 0.00 0.00 61.98 60.81 2c7h s VAL 85 Cb -0.03 -4.29 0.00 0.00 0.56 0.00 0.00 36.38 32.62 2c7h s VAL 85 CO 0.06 -0.60 0.36 0.29 -0.31 0.00 0.00 175.10 174.91