#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2c7h n PRO 2 N 0.00 0.69 -3.85 1.61 -0.02 -1.26 -4.62 135.00 127.54 2c7h n PRO 2 Ca 0.00 0.00 -0.10 0.00 -2.02 0.00 0.00 63.50 61.38 2c7h n PRO 2 Cb 0.00 -1.36 -0.08 0.00 -0.02 0.00 0.00 33.50 32.04 2c7h n PRO 2 CO 0.00 0.00 0.00 -0.48 1.98 0.00 0.00 175.50 177.00 2c7h s LEU 3 N -1.72 1.38 -0.19 2.45 0.05 -1.26 -5.04 118.68 114.36 2c7h s LEU 3 Ca 0.24 -0.42 0.15 0.00 0.05 0.00 0.00 54.13 54.14 2c7h s LEU 3 Cb 0.11 0.97 0.40 0.00 -2.05 0.00 0.00 46.19 45.62 2c7h s LEU 3 CO 0.18 -0.59 1.26 0.61 -0.55 0.00 0.00 176.35 177.27 2c7h n GLY 4 N 0.56 4.84 0.00 -3.48 0.00 -1.26 -4.70 105.19 101.14 2c7h n GLY 4 Ca -0.18 -1.19 0.15 0.00 0.00 0.00 0.00 46.02 44.80 2c7h n GLY 4 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2c7h n SER 5 N -1.15 0.00 -4.43 1.61 7.64 -1.26 -4.67 113.62 111.36 2c7h n SER 5 Ca 0.21 -0.55 -0.28 0.00 1.01 0.00 0.00 58.87 59.25 2c7h n SER 5 Cb 0.76 -0.15 -0.12 0.00 -1.01 0.00 0.00 64.21 63.69 2c7h n SER 5 CO 0.00 0.00 0.00 -0.04 -3.01 0.00 0.00 175.04 171.99 2c7h s MET 6 N -2.29 1.53 -0.03 1.43 -1.94 -1.26 -4.92 119.30 111.82 2c7h s MET 6 Ca 0.38 -1.40 0.01 0.00 -1.71 0.00 0.00 55.69 52.97 2c7h s MET 6 Cb 0.21 -1.92 0.01 0.00 2.01 0.00 0.00 34.83 35.15 2c7h s MET 6 CO 0.41 0.43 -0.05 -1.12 -0.01 0.00 0.00 175.02 174.68 2c7h s SER 7 N -2.37 0.86 -0.06 3.03 0.01 -1.21 -5.02 113.70 108.94 2c7h s SER 7 Ca 0.18 -0.12 -0.07 0.00 1.31 0.00 0.00 55.95 57.25 2c7h s SER 7 Cb -0.09 -0.32 0.01 0.00 0.21 0.00 0.00 66.02 65.83 2c7h s SER 7 CO 0.09 -0.01 0.17 0.00 0.41 0.00 0.00 173.24 173.90 2c7h s VAL 9 N -0.17 4.23 -0.46 0.00 1.01 -0.71 -4.45 120.40 119.85 2c7h s VAL 9 Ca -0.03 -0.23 -0.29 0.00 0.00 0.00 0.00 61.98 61.43 2c7h s VAL 9 Cb -0.02 -2.88 0.03 0.00 0.00 0.00 0.00 36.38 33.51 2c7h s VAL 9 CO 0.01 0.48 1.11 -1.00 0.00 0.00 0.00 175.10 175.69 2c7h s HIS 10 N 0.37 2.87 0.04 5.22 3.76 -1.24 -2.52 115.29 123.78 2c7h s HIS 10 Ca -0.01 0.73 0.04 0.00 -0.15 0.00 0.00 55.06 55.67 2c7h s HIS 10 Cb -0.13 -4.30 -0.02 0.00 1.11 0.00 0.00 32.58 29.24 2c7h s HIS 10 CO 0.02 -1.19 -0.12 1.52 -0.85 0.00 0.00 174.74 174.12 2c7h s TYR 11 N 4.28 1.04 0.01 1.40 1.13 -0.64 -0.70 117.35 123.86 2c7h s TYR 11 Ca 0.46 -0.36 0.04 0.00 -1.41 0.00 0.00 57.07 55.80 2c7h s TYR 11 Cb -0.08 -0.62 -0.01 0.00 -1.10 0.00 0.00 41.96 40.15 2c7h s TYR 11 CO 0.29 0.01 -0.13 -1.59 -2.51 0.00 0.00 175.55 171.62 2c7h s LYS 12 N -1.17 0.96 0.61 -3.49 -2.85 -0.82 0.09 119.74 113.06 2c7h s LYS 12 Ca -0.01 -0.54 -0.02 0.00 -1.00 0.00 0.00 55.97 54.40 2c7h s LYS 12 Cb -0.08 -0.94 0.04 0.00 -2.06 0.00 0.00 37.83 34.79 2c7h s LYS 12 CO 0.01 0.25 0.87 0.12 0.10 0.00 0.00 175.35 176.70 2c7h s PHE 13 N -0.48 2.92 0.35 1.78 2.19 -1.26 0.11 117.98 123.59 2c7h s PHE 13 Ca 0.03 0.22 0.05 0.00 0.33 0.00 0.00 56.93 57.56 2c7h s PHE 13 Cb -0.06 -2.90 0.70 0.00 -1.31 0.00 0.00 43.02 39.45 2c7h s PHE 13 CO 0.00 -1.05 1.93 0.77 1.83 0.00 0.00 175.22 178.70 2c7h h SER 14 N -0.18 0.72 -0.18 6.13 0.02 -1.76 -1.06 113.55 117.24 2c7h h SER 14 Ca -0.43 0.01 0.00 0.00 -0.84 0.00 0.00 61.79 60.53 2c7h h SER 14 Cb 1.30 -0.14 0.00 0.00 0.14 0.00 0.00 62.40 63.70 2c7h h SER 14 CO 0.56 0.45 0.00 -1.20 -1.14 0.00 0.00 176.83 175.50 2c7h n SER 15 N -4.49 1.87 -4.24 3.07 7.64 -1.26 -4.80 113.62 111.40 2c7h n SER 15 Ca 0.13 -1.73 -0.33 0.00 1.01 0.00 0.00 58.87 57.95 2c7h n SER 15 Cb 0.26 -0.11 -0.16 0.00 -1.01 0.00 0.00 64.21 63.19 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 -1.78 3.15 -0.05 1.43 1.02 -0.40 -4.99 119.74 118.13 2c7h s LYS 16 Ca 0.33 -0.79 -0.16 0.00 0.02 0.00 0.00 55.97 55.38 2c7h s LYS 16 Cb 0.18 -2.54 -0.31 0.00 -0.52 0.00 0.00 37.83 34.64 2c7h s LYS 16 CO 0.27 0.03 0.76 1.25 -0.92 0.00 0.00 175.35 176.74 2c7h h LEU 17 N 7.23 0.58-10.25 3.17 6.46 -1.87 -3.35 115.31 117.27 2c7h h LEU 17 Ca -0.31 -0.91 -0.49 0.00 -0.12 0.00 0.00 57.88 56.04 2c7h h LEU 17 Cb 1.20 -0.19 0.03 0.00 -0.73 0.00 0.00 40.66 40.96 2c7h h LEU 17 CO 0.56 1.64 0.18 0.20 -0.62 0.00 0.00 178.44 180.40 2c7h s ASN 18 N -7.23 6.37 0.21 1.25 0.02 -1.26 -5.01 114.94 109.30 2c7h s ASN 18 Ca -0.15 1.12 -0.15 0.00 -1.02 0.00 0.00 52.86 52.67 2c7h s ASN 18 Cb 0.04 -2.33 -0.08 0.00 0.02 0.00 0.00 41.25 38.90 2c7h s ASN 18 CO 0.85 -0.57 0.63 -0.31 0.02 0.00 0.00 177.10 177.72 2c7h s TYR 19 N -2.68 3.54 0.48 2.20 1.51 -1.26 -4.65 117.35 116.49 2c7h s TYR 19 Ca 0.51 1.13 0.06 0.00 -1.01 0.00 0.00 57.07 57.76 2c7h s TYR 19 Cb -0.10 -2.44 -0.00 0.00 -0.11 0.00 0.00 41.96 39.30 2c7h s TYR 19 CO 0.41 0.31 0.28 0.34 -1.11 0.00 0.00 175.55 175.78 2c7h s ASP 20 N -1.93 4.55 -0.10 2.29 2.15 0.11 -4.90 116.67 118.84 2c7h s ASP 20 Ca 0.44 -1.18 -0.03 0.00 0.43 0.00 0.00 52.55 52.20 2c7h s ASP 20 Cb -0.14 0.02 0.04 0.00 -0.30 0.00 0.00 42.92 42.55 2c7h s ASP 20 CO 0.20 -0.84 0.07 0.42 -0.17 0.00 0.00 175.17 174.84 2c7h s THR 21 N -2.69 -0.03 -0.26 1.71 -4.23 -1.26 -1.63 115.64 107.25 2c7h s THR 21 Ca 0.34 0.13 -0.15 0.00 -1.18 0.00 0.00 61.69 60.84 2c7h s THR 21 Cb 0.00 -0.38 -0.04 0.00 1.34 0.00 0.00 72.50 73.42 2c7h s THR 21 CO 0.20 -0.01 0.36 0.54 -0.54 0.00 0.00 174.62 175.17 2c7h s VAL 22 N 2.13 5.19 0.10 2.29 0.11 -1.05 -4.86 120.40 124.31 2c7h s VAL 22 Ca 0.04 0.56 -0.21 0.00 -2.93 0.00 0.00 61.98 59.44 2c7h s VAL 22 Cb -0.14 -3.69 -0.07 0.00 -1.53 0.00 0.00 36.38 30.95 2c7h s VAL 22 CO -0.06 0.18 0.62 0.42 -3.33 0.00 0.00 175.10 172.94 2c7h s THR 23 N 1.93 4.65 0.26 5.04 -4.23 -1.26 -1.74 115.64 120.28 2c7h s THR 23 Ca 0.15 1.33 -0.12 0.00 -1.18 0.00 0.00 61.69 61.86 2c7h s THR 23 Cb -0.16 -3.95 -0.00 0.00 1.34 0.00 0.00 72.50 69.73 2c7h s THR 23 CO 0.09 0.53 0.49 0.72 -0.54 0.00 0.00 174.62 175.92 2c7h s PHE 24 N -1.14 0.40 -0.12 3.99 -0.71 0.25 -4.97 117.98 115.67 2c7h s PHE 24 Ca 0.31 -0.76 -0.06 0.00 -1.04 0.00 0.00 56.93 55.38 2c7h s PHE 24 Cb -0.20 0.20 -0.04 0.00 -1.21 0.00 0.00 43.02 41.77 2c7h s PHE 24 CO 0.21 -1.03 0.09 0.34 -1.34 0.00 0.00 175.22 173.49 2c7h s ASP 25 N -3.03 5.95 0.00 1.98 2.15 -1.26 -3.28 116.67 119.18 2c7h s ASP 25 Ca 0.23 0.32 0.00 0.00 0.43 0.00 0.00 52.55 53.52 2c7h s ASP 25 Cb -0.01 -1.88 0.00 0.00 -0.30 0.00 0.00 42.92 40.73 2c7h s ASP 25 CO 0.10 0.36 0.00 0.61 -0.17 0.00 0.00 175.17 176.07 2c7h n GLY 26 N 2.29 -1.12 0.09 2.66 0.00 -1.26 -4.73 105.19 103.12 2c7h n GLY 26 Ca -0.19 -2.20 -0.10 0.00 0.00 0.00 0.00 46.02 43.53 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 0.06 -7.72 0.99 7.12 -1.98 -3.43 115.31 110.35 2c7h h LEU 27 Ca 0.00 -0.13 -0.09 0.00 0.13 0.00 0.00 57.88 57.79 2c7h h LEU 27 Cb 0.00 -0.02 -0.15 0.00 -0.53 0.00 0.00 40.66 39.95 2c7h h LEU 27 CO 0.00 1.11 -0.34 -1.38 -0.13 0.00 0.00 178.44 177.70 2c7h s HIS 28 N -2.61 0.06 -0.10 1.25 -3.43 -1.26 -1.67 115.29 107.53 2c7h s HIS 28 Ca -0.06 -0.37 0.03 0.00 -0.80 0.00 0.00 55.06 53.86 2c7h s HIS 28 Cb 0.08 -0.01 0.01 0.00 -1.43 0.00 0.00 32.58 31.23 2c7h s HIS 28 CO 0.82 -0.51 -0.21 -1.50 -2.00 0.00 0.00 174.74 171.34 2c7h s ILE 29 N -3.23 1.88 0.53 -5.38 2.07 0.26 -4.92 121.20 112.41 2c7h s ILE 29 Ca -0.00 -0.90 -0.21 0.00 -1.41 0.00 0.00 60.65 58.13 2c7h s ILE 29 Cb 0.02 -1.64 -0.05 0.00 0.13 0.00 0.00 42.46 40.91 2c7h s ILE 29 CO -0.08 0.52 1.28 -0.44 -1.91 0.00 0.00 174.94 174.31 2c7h s SER 30 N 0.55 5.47 0.22 4.50 0.01 -1.26 0.19 113.70 123.38 2c7h s SER 30 Ca -0.15 2.58 -0.08 0.00 1.31 0.00 0.00 55.95 59.61 2c7h s SER 30 Cb -0.17 -2.62 0.25 0.00 0.21 0.00 0.00 66.02 63.69 2c7h s SER 30 CO 0.05 -1.42 1.84 0.25 0.41 0.00 0.00 173.24 174.38 2c7h h LEU 31 N 1.49 0.74 -0.63 2.44 5.85 0.78 0.38 115.31 126.36 2c7h h LEU 31 Ca -0.50 0.01 0.09 0.00 0.84 0.00 0.00 57.88 58.32 2c7h h LEU 31 Cb 1.29 -0.15 -0.07 0.00 0.37 0.00 0.00 40.66 42.10 2c7h h LEU 31 CO 0.57 0.50 0.27 0.00 -0.34 0.00 0.00 178.44 179.44 2c7h h ASP 33 N 0.47 0.03 -0.48 0.00 3.32 -1.49 -2.94 116.42 115.34 2c7h h ASP 33 Ca 0.32 -0.41 0.02 0.00 0.02 0.00 0.00 57.03 56.97 2c7h h ASP 33 Cb 0.37 -0.01 -0.03 0.00 0.22 0.00 0.00 39.33 39.88 2c7h h ASP 33 CO -0.29 0.44 0.30 0.25 -1.72 0.00 0.00 179.24 178.21 2c7h h LEU 34 N -0.37 0.49 -0.69 1.55 6.46 0.24 -0.96 115.31 122.02 2c7h h LEU 34 Ca 0.00 -0.00 -0.04 0.00 -0.12 0.00 0.00 57.88 57.72 2c7h h LEU 34 Cb 0.42 -0.11 -0.03 0.00 -0.73 0.00 0.00 40.66 40.22 2c7h h LEU 34 CO 0.00 0.35 0.29 0.11 -0.62 0.00 0.00 178.44 178.57 2c7h h LYS 35 N 0.60 1.03 -0.77 1.25 1.57 -0.50 0.90 116.57 120.64 2c7h h LYS 35 Ca 0.19 -0.18 -0.02 0.00 -1.87 0.00 0.00 60.65 58.77 2c7h h LYS 35 Cb -0.01 -0.17 -0.04 0.00 0.08 0.00 0.00 32.23 32.09 2c7h h LYS 35 CO -0.07 0.85 0.41 0.87 -0.57 0.00 0.00 179.45 180.94 2c7h h LYS 36 N 0.98 1.08 0.01 3.15 6.56 -1.17 0.31 116.57 127.49 2c7h h LYS 36 Ca 0.23 -0.13 -0.00 0.00 -1.06 0.00 0.00 60.65 59.70 2c7h h LYS 36 Cb 0.19 -0.21 0.00 0.00 -0.57 0.00 0.00 32.23 31.64 2c7h h LYS 36 CO -0.02 0.80 -0.00 1.96 -2.06 0.00 0.00 179.45 180.12 2c7h h GLN 37 N 1.08 -0.01 -0.31 3.15 1.08 -0.62 -2.80 115.11 116.67 2c7h h GLN 37 Ca 0.27 0.00 -0.17 0.00 -1.45 0.00 0.00 58.65 57.30 2c7h h GLN 37 Cb 0.04 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 27.47 2c7h h GLN 37 CO -0.04 0.39 -0.47 0.82 -0.95 0.00 0.00 178.83 178.58 2c7h h ILE 38 N -0.42 1.28 -0.25 2.54 2.04 -0.54 0.01 117.51 122.16 2c7h h ILE 38 Ca -0.00 -1.65 -0.06 0.00 1.00 0.00 0.00 64.86 64.15 2c7h h ILE 38 Cb 0.41 1.53 -0.01 0.00 -0.74 0.00 0.00 36.82 38.01 2c7h h ILE 38 CO 0.00 0.54 -0.09 0.24 0.00 0.00 0.00 178.15 178.85 2c7h h MET 39 N 0.66 0.40 -0.09 2.37 2.86 -0.48 -1.00 114.93 119.66 2c7h h MET 39 Ca 0.04 -0.10 -0.19 0.00 -2.06 0.00 0.00 59.70 57.39 2c7h h MET 39 Cb 1.05 -0.05 -0.00 0.00 0.06 0.00 0.00 31.60 32.66 2c7h h MET 39 CO 0.10 0.50 -0.73 0.78 1.06 0.00 0.00 176.91 178.63 2c7h h GLY 40 N 0.83 0.49 0.95 8.32 0.00 -1.22 0.39 103.07 112.83 2c7h h GLY 40 Ca 0.08 -0.69 -0.01 0.00 0.00 0.00 0.00 47.33 46.71 2c7h h GLY 40 CO 0.02 0.62 -0.05 -0.09 0.00 0.00 0.00 176.54 177.03 2c7h h ARG 41 N 0.31 -0.15 -0.02 4.80 9.65 0.14 -3.02 114.38 126.09 2c7h h ARG 41 Ca -0.03 0.01 0.00 0.00 -1.10 0.00 0.00 59.98 58.86 2c7h h ARG 41 Cb 1.30 0.03 0.00 0.00 -1.39 0.00 0.00 29.97 29.92 2c7h h ARG 41 CO 0.13 -0.05 -0.08 0.39 2.80 0.00 0.00 179.97 183.16 2c7h n GLU 42 N -5.13 1.74 -2.59 0.20 -0.58 -0.49 -4.97 120.64 108.81 2c7h n GLU 42 Ca -0.08 -1.23 -0.02 0.00 -0.42 0.00 0.00 57.16 55.41 2c7h n GLU 42 Cb 0.11 -1.47 0.01 0.00 -0.57 0.00 0.00 31.44 29.51 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 0.44 -1.01 -3.53 3.49 4.76 -0.82 -5.04 118.16 116.46 2c7h n LYS 43 Ca 0.15 1.10 -0.25 0.00 -2.87 0.00 0.00 58.31 56.45 2c7h n LYS 43 Cb 0.45 -4.45 -0.02 0.00 -1.84 0.00 0.00 35.03 29.17 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 -3.57 4.11 -0.67 -0.35 1.02 0.13 -5.02 118.68 114.34 2c7h s LEU 44 Ca 0.05 0.41 -0.24 0.00 0.02 0.00 0.00 54.13 54.36 2c7h s LEU 44 Cb -0.01 -3.24 0.05 0.00 0.02 0.00 0.00 46.19 43.02 2c7h s LEU 44 CO 0.52 -0.20 1.06 -1.59 0.02 0.00 0.00 176.35 176.17 2c7h s LYS 45 N -3.97 3.18 0.00 1.70 -2.85 -1.26 -4.85 119.74 111.69 2c7h s LYS 45 Ca 0.39 -0.53 0.29 0.00 -1.00 0.00 0.00 55.97 55.11 2c7h s LYS 45 Cb -0.10 -4.18 1.20 0.00 -2.06 0.00 0.00 37.83 32.69 2c7h s LYS 45 CO 0.33 -1.87 1.87 0.00 0.10 0.00 0.00 175.35 175.78 2c7h n ALA 46 N 8.21 2.66 0.63 0.59 0.00 -1.26 -2.91 120.51 128.43 2c7h n ALA 46 Ca -0.01 -0.19 0.09 0.00 0.00 0.00 0.00 53.44 53.33 2c7h n ALA 46 Cb 0.47 -1.39 -0.12 0.00 0.00 0.00 0.00 19.45 18.41 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 -1.29 3.97 0.24 0.00 0.00 -1.26 -4.43 120.51 117.73 2c7h n ALA 47 Ca 0.11 -0.51 0.07 0.00 0.00 0.00 0.00 53.44 53.11 2c7h n ALA 47 Cb 0.30 -0.68 -0.11 0.00 0.00 0.00 0.00 19.45 18.96 2c7h n ALA 47 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2c7h n ASP 48 N -1.65 1.21 -4.04 0.00 9.92 -1.18 -4.48 116.55 116.33 2c7h n ASP 48 Ca 0.02 -0.30 -0.10 0.00 -0.53 0.00 0.00 54.79 53.88 2c7h n ASP 48 Cb 0.35 1.46 -0.07 0.00 -0.64 0.00 0.00 41.12 42.22 2c7h n ASP 48 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2c7h s ASP 50 N -3.07 3.57 -0.26 0.00 2.15 0.48 -4.64 116.67 114.91 2c7h s ASP 50 Ca 0.28 -1.20 -0.01 0.00 0.43 0.00 0.00 52.55 52.06 2c7h s ASP 50 Cb 0.02 -0.32 0.04 0.00 -0.30 0.00 0.00 42.92 42.35 2c7h s ASP 50 CO 0.10 -0.22 -0.07 -0.22 -0.17 0.00 0.00 175.17 174.59 2c7h s LEU 51 N -3.58 3.30 -0.31 -1.34 2.96 -1.26 -0.50 118.68 117.94 2c7h s LEU 51 Ca 0.32 -1.03 -0.05 0.00 -0.22 0.00 0.00 54.13 53.16 2c7h s LEU 51 Cb 0.03 -1.64 0.03 0.00 0.50 0.00 0.00 46.19 45.11 2c7h s LEU 51 CO 0.16 -0.16 0.05 -1.58 -1.32 0.00 0.00 176.35 173.50 2c7h s GLN 52 N 1.27 2.73 -0.02 1.98 0.74 0.12 -4.93 119.66 121.56 2c7h s GLN 52 Ca -0.02 -1.08 -0.19 0.00 0.05 0.00 0.00 55.36 54.12 2c7h s GLN 52 Cb -0.18 -3.31 -0.05 0.00 1.10 0.00 0.00 33.01 30.57 2c7h s GLN 52 CO -0.04 -0.56 0.52 0.42 -0.55 0.00 0.00 175.29 175.08 2c7h s ILE 53 N 1.39 4.97 0.05 -2.34 -1.09 -1.22 -1.70 121.20 121.26 2c7h s ILE 53 Ca -0.01 1.09 0.08 0.00 -2.23 0.00 0.00 60.65 59.58 2c7h s ILE 53 Cb -0.19 -3.85 -0.03 0.00 -1.58 0.00 0.00 42.46 36.81 2c7h s ILE 53 CO 0.01 0.46 -0.22 -0.89 -1.23 0.00 0.00 174.94 173.07 2c7h s THR 54 N -0.35 2.51 0.32 2.92 2.01 0.11 0.43 115.64 123.58 2c7h s THR 54 Ca 0.28 -1.31 -0.28 0.00 0.31 0.00 0.00 61.69 60.69 2c7h s THR 54 Cb -0.17 -2.04 -0.09 0.00 0.01 0.00 0.00 72.50 70.21 2c7h s THR 54 CO 0.15 0.32 1.08 0.21 -0.69 0.00 0.00 174.62 175.69 2c7h s ASN 55 N -1.43 7.10 0.11 3.53 3.84 0.72 0.75 114.94 129.57 2c7h s ASN 55 Ca 0.14 2.19 0.13 0.00 0.21 0.00 0.00 52.86 55.52 2c7h s ASN 55 Cb -0.10 -2.61 -0.12 0.00 -0.55 0.00 0.00 41.25 37.86 2c7h s ASN 55 CO 0.04 -0.25 1.07 0.00 -2.79 0.00 0.00 177.10 175.16 2c7h h ALA 56 N 3.38 0.61 0.03 1.71 0.00 -1.49 -1.99 119.26 121.51 2c7h h ALA 56 Ca -0.47 -0.89 -0.15 0.00 0.00 0.00 0.00 54.91 53.40 2c7h h ALA 56 Cb 1.21 0.12 -0.01 0.00 0.00 0.00 0.00 17.79 19.11 2c7h h ALA 56 CO 0.65 1.06 -0.79 1.96 0.00 0.00 0.00 179.25 182.14 2c7h h GLN 57 N 0.00 0.05 0.00 0.00 4.20 -1.93 -3.38 115.11 114.06 2c7h h GLN 57 Ca -0.11 -0.09 -0.01 0.00 0.06 0.00 0.00 58.65 58.50 2c7h h GLN 57 Cb 1.67 0.03 -0.00 0.00 0.30 0.00 0.00 27.48 29.48 2c7h h GLN 57 CO 0.08 1.04 -1.82 0.25 -0.67 0.00 0.00 178.83 177.71 2c7h n THR 58 N -4.40 0.15 -3.20 -0.54 -2.24 -1.26 -4.97 114.28 97.82 2c7h n THR 58 Ca -0.22 -0.52 -0.22 0.00 -2.27 0.00 0.00 64.05 60.82 2c7h n THR 58 Cb 0.65 -0.08 0.05 0.00 -2.10 0.00 0.00 70.33 68.85 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 -2.35 -5.85 -3.86 -0.78 4.76 -0.75 -4.99 118.16 104.33 2c7h n LYS 59 Ca -0.04 0.85 -0.35 0.00 -2.87 0.00 0.00 58.31 55.90 2c7h n LYS 59 Cb 0.58 -5.71 -0.08 0.00 -1.84 0.00 0.00 35.03 27.98 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 -5.89 3.92 0.36 1.97 2.12 -1.25 -4.76 118.70 115.18 2c7h s GLU 60 Ca 0.39 -0.24 -0.21 0.00 0.36 0.00 0.00 54.97 55.27 2c7h s GLU 60 Cb -0.17 -3.29 -0.10 0.00 0.26 0.00 0.00 34.13 30.83 2c7h s GLU 60 CO 0.49 0.41 0.88 -1.21 -0.54 0.00 0.00 175.26 175.30 2c7h s GLU 61 N 0.01 4.27 -0.45 4.30 8.01 -1.26 -0.20 118.70 133.38 2c7h s GLU 61 Ca 0.08 1.06 -0.08 0.00 0.01 0.00 0.00 54.97 56.04 2c7h s GLU 61 Cb -0.12 -2.45 0.11 0.00 -4.31 0.00 0.00 34.13 27.37 2c7h s GLU 61 CO -0.00 0.12 0.30 0.71 0.01 0.00 0.00 175.26 176.40 2c7h s TYR 62 N -1.94 3.44 -0.14 1.61 2.02 0.17 -4.91 117.35 117.59 2c7h s TYR 62 Ca 0.56 -1.91 0.18 0.00 -0.37 0.00 0.00 57.07 55.53 2c7h s TYR 62 Cb -0.12 -3.32 -0.25 0.00 -0.40 0.00 0.00 41.96 37.86 2c7h s TYR 62 CO 0.17 -0.96 0.30 0.25 -1.57 0.00 0.00 175.55 173.74 2c7h n THR 63 N 4.85 1.08 -3.26 -0.71 -2.24 -1.26 -3.42 114.28 109.31 2c7h n THR 63 Ca -0.07 -0.75 -0.38 0.00 -2.27 0.00 0.00 64.05 60.57 2c7h n THR 63 Cb 0.41 -0.44 -0.06 0.00 -2.10 0.00 0.00 70.33 68.14 2c7h n THR 63 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 2c7h s ASP 64 N -5.36 6.70 0.00 3.42 1.01 -1.26 -4.93 116.67 116.24 2c7h s ASP 64 Ca -0.08 0.83 0.10 0.00 0.71 0.00 0.00 52.55 54.12 2c7h s ASP 64 Cb 0.08 -2.31 0.52 0.00 1.01 0.00 0.00 42.92 42.23 2c7h s ASP 64 CO 0.84 -0.07 1.24 -0.90 0.21 0.00 0.00 175.17 176.50 2c7h n ASP 65 N 3.99 0.00 -0.79 0.27 5.75 -1.26 -0.61 116.55 123.90 2c7h n ASP 65 Ca -0.06 0.18 0.12 0.00 -0.01 0.00 0.00 54.79 55.03 2c7h n ASP 65 Cb 0.51 -0.31 0.29 0.00 -1.03 0.00 0.00 41.12 40.58 2c7h n ASP 65 CO 0.00 0.00 0.00 0.59 -0.11 0.00 0.00 177.20 177.68 2c7h n ASN 66 N -1.31 2.43 -4.78 -1.12 3.02 -1.26 -0.10 115.26 112.15 2c7h n ASN 66 Ca 0.05 -1.81 -0.34 0.00 -0.03 0.00 0.00 54.58 52.45 2c7h n ASN 66 Cb 0.09 -0.07 0.02 0.00 -0.61 0.00 0.00 39.78 39.21 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 -1.86 2.61 -0.04 5.41 0.00 0.22 -4.75 121.76 123.35 2c7h s ALA 67 Ca 0.34 0.64 0.06 0.00 0.00 0.00 0.00 51.96 53.00 2c7h s ALA 67 Cb 0.20 -3.32 -0.02 0.00 0.00 0.00 0.00 23.12 19.98 2c7h s ALA 67 CO 0.31 -0.97 -0.23 -0.48 0.00 0.00 0.00 175.76 174.38 2c7h s LEU 68 N -4.33 2.19 -0.22 0.00 0.05 -1.26 0.11 118.68 115.22 2c7h s LEU 68 Ca 0.69 -0.43 -0.01 0.00 0.05 0.00 0.00 54.13 54.43 2c7h s LEU 68 Cb -0.21 -1.39 0.02 0.00 -2.05 0.00 0.00 46.19 42.56 2c7h s LEU 68 CO 0.34 0.30 -0.10 -0.63 -0.55 0.00 0.00 176.35 175.70 2c7h s ILE 69 N -0.47 2.65 0.64 1.48 1.09 0.13 -4.90 121.20 121.82 2c7h s ILE 69 Ca 0.06 -0.95 -0.11 0.00 -1.10 0.00 0.00 60.65 58.55 2c7h s ILE 69 Cb -0.11 -2.27 -0.03 0.00 -1.06 0.00 0.00 42.46 38.99 2c7h s ILE 69 CO 0.01 0.33 1.04 -2.16 -0.10 0.00 0.00 174.94 174.06 2c7h s PRO 70 N 1.32 3.41 0.37 2.79 0.04 -1.26 -0.57 135.00 141.10 2c7h s PRO 70 Ca 0.02 0.66 0.27 0.00 0.04 0.00 0.00 61.00 61.99 2c7h s PRO 70 Cb -0.15 -2.07 1.22 0.00 0.04 0.00 0.00 34.50 33.53 2c7h s PRO 70 CO -0.07 -0.68 1.82 1.57 0.04 0.00 0.00 177.00 179.68 2c7h h LYS 71 N -0.39 0.00 0.00 4.56 2.10 -1.54 -1.84 116.57 119.47 2c7h h LYS 71 Ca -0.44 0.00 -0.06 0.00 -2.00 0.00 0.00 60.65 58.14 2c7h h LYS 71 Cb 1.21 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 32.53 2c7h h LYS 71 CO 0.62 0.00 -0.31 -0.91 -2.00 0.00 0.00 179.45 176.86 2c7h h ASN 72 N 0.00 0.00 -2.39 7.07 2.35 -1.83 -3.43 115.58 117.35 2c7h h ASN 72 Ca 0.00 0.00 -0.47 0.00 -0.55 0.00 0.00 56.30 55.28 2c7h h ASN 72 Cb 0.31 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.68 2c7h h ASN 72 CO 0.00 0.31 -0.36 -0.44 -1.65 0.00 0.00 177.43 175.29 2c7h s SER 73 N -6.37 6.32 -0.10 5.81 0.01 -0.69 -5.05 113.70 113.62 2c7h s SER 73 Ca -0.00 0.19 0.03 0.00 1.31 0.00 0.00 55.95 57.47 2c7h s SER 73 Cb 0.11 -1.91 0.01 0.00 0.21 0.00 0.00 66.02 64.44 2c7h s SER 73 CO 0.66 -0.13 -0.18 -0.44 0.41 0.00 0.00 173.24 173.57 2c7h s SER 74 N -3.95 2.54 0.16 2.44 0.01 -1.26 -3.71 113.70 109.93 2c7h s SER 74 Ca 0.36 -0.45 0.08 0.00 1.31 0.00 0.00 55.95 57.25 2c7h s SER 74 Cb -0.09 -1.16 -0.04 0.00 0.21 0.00 0.00 66.02 64.94 2c7h s SER 74 CO 0.31 0.07 -0.18 0.68 0.41 0.00 0.00 173.24 174.53 2c7h s VAL 75 N 0.70 1.78 -0.20 3.43 -7.23 0.12 -1.27 120.40 117.73 2c7h s VAL 75 Ca -0.12 -1.89 -0.07 0.00 -1.81 0.00 0.00 61.98 58.08 2c7h s VAL 75 Cb -0.16 -1.81 -0.04 0.00 0.56 0.00 0.00 36.38 34.93 2c7h s VAL 75 CO 0.03 -0.31 0.07 -0.63 -0.31 0.00 0.00 175.10 173.94 2c7h s ILE 76 N -2.03 4.70 -0.39 -0.62 -1.09 0.23 -1.95 121.20 120.04 2c7h s ILE 76 Ca 0.15 -0.06 -0.15 0.00 -2.23 0.00 0.00 60.65 58.36 2c7h s ILE 76 Cb -0.06 -3.13 0.01 0.00 -1.58 0.00 0.00 42.46 37.70 2c7h s ILE 76 CO 0.06 0.43 0.31 -0.69 -1.23 0.00 0.00 174.94 173.82 2c7h s VAL 77 N 0.64 5.24 -0.14 2.92 1.01 0.12 0.07 120.40 130.26 2c7h s VAL 77 Ca 0.03 -0.48 -0.02 0.00 0.00 0.00 0.00 61.98 61.51 2c7h s VAL 77 Cb -0.13 -3.89 -0.02 0.00 0.00 0.00 0.00 36.38 32.34 2c7h s VAL 77 CO 0.02 -0.24 -0.07 -0.60 0.00 0.00 0.00 175.10 174.21 2c7h s ARG 78 N 1.76 3.51 -0.14 2.72 3.52 -0.69 -1.81 118.95 127.83 2c7h s ARG 78 Ca 0.06 -0.57 -0.20 0.00 -0.13 0.00 0.00 55.73 54.90 2c7h s ARG 78 Cb -0.18 -2.81 -0.03 0.00 -1.56 0.00 0.00 34.95 30.37 2c7h s ARG 78 CO 0.11 0.28 0.58 0.50 -0.81 0.00 0.00 175.30 175.95 2c7h s ARG 79 N 0.24 4.31 0.12 5.12 3.52 -1.26 0.10 118.95 131.11 2c7h s ARG 79 Ca -0.05 0.60 0.10 0.00 -0.13 0.00 0.00 55.73 56.26 2c7h s ARG 79 Cb -0.14 -3.49 -0.04 0.00 -1.56 0.00 0.00 34.95 29.72 2c7h s ARG 79 CO 0.04 -0.01 -0.25 0.96 -0.81 0.00 0.00 175.30 175.23 2c7h s ILE 80 N 1.14 2.06 0.22 4.11 -5.25 0.34 -4.90 121.20 118.92 2c7h s ILE 80 Ca 0.29 -1.69 -0.30 0.00 -0.99 0.00 0.00 60.65 57.97 2c7h s ILE 80 Cb -0.16 -1.84 -0.08 0.00 2.95 0.00 0.00 42.46 43.32 2c7h s ILE 80 CO 0.12 0.03 1.05 -2.16 -1.79 0.00 0.00 174.94 172.19 2c7h s PRO 81 N -2.02 4.68 0.18 0.37 0.04 -1.26 -0.39 135.00 136.60 2c7h s PRO 81 Ca 0.11 1.67 0.21 0.00 0.04 0.00 0.00 61.00 63.04 2c7h s PRO 81 Cb -0.10 -3.26 -0.02 0.00 0.04 0.00 0.00 34.50 31.17 2c7h s PRO 81 CO 0.05 0.23 1.02 -0.84 0.04 0.00 0.00 177.00 177.50 2c7h h ILE 82 N 3.43 0.10 0.00 0.56 3.07 -1.89 -3.45 117.51 119.33 2c7h h ILE 82 Ca -0.45 -1.19 0.00 0.00 1.55 0.00 0.00 64.86 64.77 2c7h h ILE 82 Cb 1.21 1.62 0.00 0.00 -0.27 0.00 0.00 36.82 39.38 2c7h h ILE 82 CO 0.70 0.06 0.00 0.61 -1.05 0.00 0.00 178.15 178.46 2c7h n GLY 83 N 1.22 3.22 0.00 0.16 0.00 -1.26 -4.73 105.19 103.80 2c7h n GLY 83 Ca -0.02 -0.76 0.00 0.00 0.00 0.00 0.00 46.02 45.24 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 0.00 -0.11 3.35 -0.02 0.00 -1.26 -5.10 105.19 102.06 2c7h n GLY 84 Ca 0.00 -0.03 -0.46 0.00 0.00 0.00 0.00 46.02 45.53 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 0.00 5.41 0.00 1.61 1.01 -1.26 -5.08 120.40 122.09 2c7h s VAL 85 Ca 0.00 -2.20 0.00 0.00 0.00 0.00 0.00 61.98 59.78 2c7h s VAL 85 Cb 0.00 -4.51 0.00 0.00 0.00 0.00 0.00 36.38 31.87 2c7h s VAL 85 CO 0.00 -1.10 0.00 2.29 0.00 0.00 0.00 175.10 176.29