#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2opu n SER 6 N 0.00 -2.99 -0.76 9.51 3.41 -1.26 -4.99 113.62 116.54 2opu n SER 6 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 2opu n SER 6 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 2opu n SER 6 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 2opu n SER 7 N -3.20 -4.94 -4.60 4.04 7.64 -0.16 -4.53 113.62 107.88 2opu n SER 7 Ca 0.00 0.00 -0.43 0.00 1.01 0.00 0.00 58.87 59.45 2opu n SER 7 Cb 0.00 0.00 -0.03 0.00 -1.01 0.00 0.00 64.21 63.17 2opu n SER 7 CO 0.00 0.00 0.00 -1.10 -3.01 0.00 0.00 175.04 170.93 2opu s GLN 8 N 0.00 3.22 0.02 1.43 -0.21 -1.24 -0.97 119.66 121.91 2opu s GLN 8 Ca 0.00 1.63 -0.25 0.00 0.02 0.00 0.00 55.36 56.76 2opu s GLN 8 Cb 0.00 -4.27 -0.05 0.00 1.00 0.00 0.00 33.01 29.69 2opu s GLN 8 CO 0.00 -2.00 0.77 -0.51 -2.12 0.00 0.00 175.29 171.43 2opu s LEU 9 N 7.58 4.42 -0.68 2.90 1.43 0.11 -4.87 118.68 129.57 2opu s LEU 9 Ca 0.88 1.41 0.05 0.00 -1.03 0.00 0.00 54.13 55.44 2opu s LEU 9 Cb -0.26 -3.22 0.19 0.00 0.03 0.00 0.00 46.19 42.93 2opu s LEU 9 CO 0.34 -0.02 0.57 0.61 0.23 0.00 0.00 176.35 178.07 2opu n GLY 10 N 2.54 4.19 0.06 -3.19 0.00 -1.26 -2.20 105.19 105.32 2opu n GLY 10 Ca -0.02 -2.60 -0.04 0.00 0.00 0.00 0.00 46.02 43.37 2opu n GLY 10 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 2opu h PRO 11 N 5.02 0.00 -6.23 1.61 0.11 -1.90 -3.48 132.00 127.12 2opu h PRO 11 Ca 0.17 0.00 -0.55 0.00 0.11 0.00 0.00 66.00 65.72 2opu h PRO 11 Cb 0.73 0.00 -0.08 0.00 0.11 0.00 0.00 31.00 31.76 2opu h PRO 11 CO 0.74 0.22 -0.60 0.96 -0.21 0.00 0.00 178.00 179.11 2opu s ILE 12 N -1.75 4.00 -0.10 4.15 -0.00 -1.26 -5.06 121.20 121.17 2opu s ILE 12 Ca -0.05 -1.50 0.16 0.00 -0.00 0.00 0.00 60.65 59.25 2opu s ILE 12 Cb -0.00 -3.10 -0.17 0.00 -0.00 0.00 0.00 42.46 39.18 2opu s ILE 12 CO 0.16 -0.26 0.73 1.57 -0.00 0.00 0.00 174.94 177.14 2opu n HIS 13 N -0.71 0.90 -0.86 1.37 -0.00 -1.26 -4.57 115.22 110.10 2opu n HIS 13 Ca -0.08 0.31 -0.32 0.00 0.46 0.00 0.00 57.72 58.08 2opu n HIS 13 Cb 0.57 -1.09 0.03 0.00 -0.12 0.00 0.00 29.99 29.37 2opu n HIS 13 CO 0.00 0.00 0.00 -2.30 0.46 0.00 0.00 176.34 174.50 2opu n PRO 14 N -2.90 0.00 -1.19 1.57 -0.02 -1.26 -4.89 135.00 126.31 2opu n PRO 14 Ca -0.13 0.00 -0.37 0.00 -2.02 0.00 0.00 63.50 60.98 2opu n PRO 14 Cb 0.91 -0.86 0.04 0.00 -0.02 0.00 0.00 33.50 33.58 2opu n PRO 14 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 2opu n PRO 15 N 2.14 0.13 0.00 0.52 -0.02 -1.26 -4.42 135.00 132.08 2opu n PRO 15 Ca -0.02 0.06 0.00 0.00 -2.02 0.00 0.00 63.50 61.52 2opu n PRO 15 Cb 0.59 -1.38 0.00 0.00 -0.02 0.00 0.00 33.50 32.69 2opu n PRO 15 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 2opu n PRO 16 N 0.68 0.23 0.27 0.52 -0.04 -1.25 -3.03 135.00 132.37 2opu n PRO 16 Ca 0.07 0.00 0.13 0.00 -0.04 0.00 0.00 63.50 63.66 2opu n PRO 16 Cb 0.50 -1.03 0.74 0.00 -0.04 0.00 0.00 33.50 33.67 2opu n PRO 16 CO 0.00 0.00 0.00 0.07 -0.04 0.00 0.00 175.50 175.53 2opu h ARG 17 N 0.23 0.00 0.00 0.54 0.11 -1.61 -0.44 114.38 113.20 2opu h ARG 17 Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 2opu h ARG 17 Cb 0.03 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.11 2opu h ARG 17 CO 0.00 0.11 0.00 -2.37 0.10 0.00 0.00 179.97 177.81 2opu n THR 18 N -3.61 0.00 0.00 0.08 5.66 -1.17 -4.43 114.28 110.81 2opu n THR 18 Ca -0.02 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.98 2opu n THR 18 Cb 0.23 0.42 0.00 0.00 -1.55 0.00 0.00 70.33 69.44 2opu n THR 18 CO 0.00 0.00 0.00 -1.54 -3.05 0.00 0.00 175.07 170.48 2opu n SER 19 N 0.00 0.00 -4.21 1.09 3.41 -1.19 -4.51 113.62 108.21 2opu n SER 19 Ca 0.00 0.00 -0.35 0.00 -0.26 0.00 0.00 58.87 58.26 2opu n SER 19 Cb 0.11 0.00 -0.06 0.00 -0.26 0.00 0.00 64.21 64.00 2opu n SER 19 CO 0.00 0.00 0.00 1.15 -0.16 0.00 0.00 175.04 176.03 2opu n MET 20 N 0.00 1.63 -2.84 4.33 0.00 -1.24 -4.38 117.12 114.61 2opu n MET 20 Ca 0.00 -2.26 -0.42 0.00 0.00 0.00 0.00 57.70 55.01 2opu n MET 20 Cb 0.00 -3.41 -0.04 0.00 0.00 0.00 0.00 33.22 29.77 2opu n MET 20 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 175.97 176.96 2opu s THR 21 N 8.45 4.68 -0.29 3.17 2.01 -0.93 -4.78 115.64 127.94 2opu s THR 21 Ca 0.64 1.30 -0.18 0.00 0.31 0.00 0.00 61.69 63.75 2opu s THR 21 Cb 0.05 -4.26 -0.02 0.00 0.01 0.00 0.00 72.50 68.29 2opu s THR 21 CO 0.13 -0.38 0.52 -0.70 -0.69 0.00 0.00 174.62 173.50 2opu s GLU 22 N 3.24 3.92 -0.54 4.92 2.56 -0.60 0.04 118.70 132.23 2opu s GLU 22 Ca 0.37 0.16 -0.17 0.00 0.00 0.00 0.00 54.97 55.33 2opu s GLU 22 Cb -0.13 -3.71 0.10 0.00 2.00 0.00 0.00 34.13 32.39 2opu s GLU 22 CO 0.15 -0.46 0.57 -2.00 -0.56 0.00 0.00 175.26 172.96 2opu s GLU 23 N 2.36 3.03 -0.26 4.30 2.56 -0.15 -0.01 118.70 130.54 2opu s GLU 23 Ca 0.21 -1.37 -0.15 0.00 0.00 0.00 0.00 54.97 53.65 2opu s GLU 23 Cb -0.15 -4.22 -0.04 0.00 2.00 0.00 0.00 34.13 31.72 2opu s GLU 23 CO 0.11 -1.33 0.39 -0.47 -0.56 0.00 0.00 175.26 173.40 2opu s TYR 24 N 2.15 3.27 -0.15 5.30 6.14 0.55 -0.99 117.35 133.62 2opu s TYR 24 Ca 0.08 0.47 -0.28 0.00 0.64 0.00 0.00 57.07 57.99 2opu s TYR 24 Cb -0.25 -2.58 -0.01 0.00 0.42 0.00 0.00 41.96 39.54 2opu s TYR 24 CO 0.06 -0.19 0.93 1.03 0.64 0.00 0.00 175.55 178.03 2opu s ARG 25 N 1.94 4.34 -0.05 4.97 0.52 -1.26 -0.83 118.95 128.58 2opu s ARG 25 Ca 0.16 1.22 -0.01 0.00 -0.52 0.00 0.00 55.73 56.59 2opu s ARG 25 Cb -0.16 -3.57 0.03 0.00 0.52 0.00 0.00 34.95 31.77 2opu s ARG 25 CO 0.09 -0.37 0.00 0.54 0.02 0.00 0.00 175.30 175.58 2opu s VAL 26 N 2.26 0.29 0.73 3.52 0.11 0.54 -4.98 120.40 122.87 2opu s VAL 26 Ca 0.43 0.11 -0.16 0.00 -2.93 0.00 0.00 61.98 59.43 2opu s VAL 26 Cb -0.17 -0.42 0.03 0.00 -1.53 0.00 0.00 36.38 34.29 2opu s VAL 26 CO 0.14 0.21 1.21 -2.65 -3.33 0.00 0.00 175.10 170.69 2opu n PRO 27 N 4.71 0.64 -0.11 1.54 -0.02 -1.26 0.34 135.00 140.83 2opu n PRO 27 Ca -0.15 0.28 -0.06 0.00 -2.02 0.00 0.00 63.50 61.56 2opu n PRO 27 Cb 0.50 -2.45 0.01 0.00 -0.02 0.00 0.00 33.50 31.53 2opu n PRO 27 CO 0.00 0.00 0.00 0.22 1.98 0.00 0.00 175.50 177.70 2opu h ASP 28 N -0.19 -0.71 0.56 2.55 3.58 -1.87 0.30 116.42 120.64 2opu h ASP 28 Ca -0.48 0.16 -0.10 0.00 0.42 0.00 0.00 57.03 57.02 2opu h ASP 28 Cb 1.32 0.37 -0.01 0.00 1.72 0.00 0.00 39.33 42.73 2opu h ASP 28 CO 0.49 -0.24 -0.47 1.23 -2.88 0.00 0.00 179.24 177.37 2opu h GLY 29 N -0.15 0.00 2.00 -0.78 0.00 -1.94 -2.74 103.07 99.46 2opu h GLY 29 Ca 0.19 0.00 -0.15 0.00 0.00 0.00 0.00 47.33 47.36 2opu h GLY 29 CO -0.48 0.00 -0.73 1.98 0.00 0.00 0.00 176.54 177.31 2opu h MET 30 N 0.00 0.00 0.00 4.80 1.85 -1.30 -2.18 114.93 118.09 2opu h MET 30 Ca -0.00 0.00 -0.08 0.00 -0.61 0.00 0.00 59.70 59.00 2opu h MET 30 Cb 0.88 0.00 -0.01 0.00 0.43 0.00 0.00 31.60 32.90 2opu h MET 30 CO 0.06 0.73 -0.39 -0.24 -0.40 0.00 0.00 176.91 176.67 2opu h VAL 31 N 0.00 0.82 0.00 -5.77 3.04 -0.42 0.47 116.25 114.39 2opu h VAL 31 Ca -0.01 -1.68 -0.04 0.00 -1.01 0.00 0.00 66.70 63.96 2opu h VAL 31 Cb 1.53 2.06 -0.01 0.00 -2.01 0.00 0.00 31.29 32.86 2opu h VAL 31 CO 0.10 0.38 -0.19 1.23 -1.01 0.00 0.00 177.57 178.08 2opu h GLY 32 N 2.53 0.00 1.22 3.17 0.00 -1.13 -2.68 103.07 106.18 2opu h GLY 32 Ca -0.00 0.00 -0.13 0.00 0.00 0.00 0.00 47.33 47.20 2opu h GLY 32 CO 0.05 0.00 -1.13 1.41 0.00 0.00 0.00 176.54 176.87 2opu h LEU 33 N 0.00 0.00 -0.75 3.11 3.38 -0.70 -2.42 115.31 117.93 2opu h LEU 33 Ca -0.00 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 57.84 2opu h LEU 33 Cb 0.52 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.26 2opu h LEU 33 CO 0.02 0.47 -0.54 -0.29 0.09 0.00 0.00 178.44 178.20 2opu h ILE 34 N 0.00 1.36 0.00 1.22 6.09 -0.70 -1.02 117.51 124.47 2opu h ILE 34 Ca -0.10 -1.82 0.00 0.00 -1.37 0.00 0.00 64.86 61.57 2opu h ILE 34 Cb 1.45 1.89 0.00 0.00 0.47 0.00 0.00 36.82 40.63 2opu h ILE 34 CO 0.04 0.54 -0.22 2.30 -3.07 0.00 0.00 178.15 177.75 2opu n ILE 35 N -3.93 0.49 0.00 2.19 -5.35 -1.03 -3.80 119.36 107.94 2opu n ILE 35 Ca -0.02 -0.27 0.00 0.00 -0.27 0.00 0.00 62.75 62.19 2opu n ILE 35 Cb 0.57 -0.42 0.00 0.00 -1.74 0.00 0.00 39.64 38.05 2opu n ILE 35 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2opu n GLY 36 N 1.33 0.30 0.01 3.28 0.00 -0.39 -1.18 105.19 108.54 2opu n GLY 36 Ca 0.05 0.61 0.03 0.00 0.00 0.00 0.00 46.02 46.71 2opu n GLY 36 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 2opu n ARG 37 N 0.00 0.01 0.00 1.61 1.85 -1.26 -4.72 116.66 114.15 2opu n ARG 37 Ca 0.00 0.43 0.00 0.00 -1.00 0.00 0.00 57.85 57.28 2opu n ARG 37 Cb 0.00 -1.53 0.00 0.00 -1.05 0.00 0.00 32.46 29.88 2opu n ARG 37 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 2opu n GLY 38 N -1.01 0.45 0.00 2.89 0.00 -0.32 -4.88 105.19 102.31 2opu n GLY 38 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.03 2opu n GLY 38 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2opu n GLY 39 N 0.00 1.15 0.34 -0.02 0.00 -0.58 -4.99 105.19 101.10 2opu n GLY 39 Ca 0.00 -0.00 0.18 0.00 0.00 0.00 0.00 46.02 46.20 2opu n GLY 39 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2opu h GLU 40 N 0.00 0.00 0.26 1.61 4.81 -1.90 -2.24 114.58 117.12 2opu h GLU 40 Ca 0.00 0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 59.22 2opu h GLU 40 Cb 0.00 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 29.38 2opu h GLU 40 CO 0.00 0.00 -0.16 0.37 -0.73 0.00 0.00 179.01 178.49 2opu h GLN 41 N 0.00 -0.40 -0.41 1.92 -0.00 -1.84 0.28 115.11 114.66 2opu h GLN 41 Ca 0.02 0.03 -0.08 0.00 -0.00 0.00 0.00 58.65 58.61 2opu h GLN 41 Cb 0.49 0.09 -0.02 0.00 0.00 0.00 0.00 27.48 28.04 2opu h GLN 41 CO -0.00 -0.27 -0.07 0.97 0.00 0.00 0.00 178.83 179.46 2opu h ILE 42 N -0.41 1.24 -0.89 2.39 6.09 -1.50 0.95 117.51 125.39 2opu h ILE 42 Ca -0.03 -1.06 0.02 0.00 -1.37 0.00 0.00 64.86 62.42 2opu h ILE 42 Cb 0.34 1.00 -0.05 0.00 0.47 0.00 0.00 36.82 38.59 2opu h ILE 42 CO 0.03 0.36 0.58 0.78 -3.07 0.00 0.00 178.15 176.83 2opu h ASN 43 N 0.65 0.99 0.67 2.19 4.21 -1.47 0.19 115.58 123.01 2opu h ASN 43 Ca 0.12 -0.02 -0.03 0.00 1.21 0.00 0.00 56.30 57.58 2opu h ASN 43 Cb 0.51 -0.24 0.01 0.00 -1.12 0.00 0.00 38.32 37.48 2opu h ASN 43 CO 0.03 0.70 -0.32 0.50 -1.29 0.00 0.00 177.43 177.05 2opu h LYS 44 N 1.17 -0.86 0.22 0.81 1.63 0.43 -2.49 116.57 117.48 2opu h LYS 44 Ca 0.34 0.06 0.01 0.00 -0.85 0.00 0.00 60.65 60.21 2opu h LYS 44 Cb -0.08 0.20 -0.03 0.00 -0.60 0.00 0.00 32.23 31.71 2opu h LYS 44 CO -0.09 -0.57 -0.37 0.82 -3.45 0.00 0.00 179.45 175.80 2opu h ILE 45 N -0.93 0.25 -0.17 2.00 5.03 -0.30 0.85 117.51 124.23 2opu h ILE 45 Ca -0.09 0.00 -0.13 0.00 -0.12 0.00 0.00 64.86 64.52 2opu h ILE 45 Cb 0.70 0.25 -0.01 0.00 -3.03 0.00 0.00 36.82 34.72 2opu h ILE 45 CO 0.15 0.00 -0.46 0.06 -0.68 0.00 0.00 178.15 177.22 2opu h GLN 46 N -0.66 0.43 0.13 2.37 -0.00 -0.74 -2.18 115.11 114.46 2opu h GLN 46 Ca 0.00 -0.24 -0.28 0.00 -0.00 0.00 0.00 58.65 58.14 2opu h GLN 46 Cb 0.65 0.01 0.01 0.00 -0.00 0.00 0.00 27.48 28.15 2opu h GLN 46 CO -0.15 0.81 -1.24 0.37 -0.00 0.00 0.00 178.83 178.62 2opu h GLN 47 N 0.35 0.31 0.00 0.06 4.15 -1.34 0.16 115.11 118.80 2opu h GLN 47 Ca 0.02 -0.51 -0.06 0.00 0.77 0.00 0.00 58.65 58.88 2opu h GLN 47 Cb 0.95 0.19 -0.01 0.00 0.21 0.00 0.00 27.48 28.81 2opu h GLN 47 CO 0.08 1.23 -0.26 0.22 -1.93 0.00 0.00 178.83 178.17 2opu h ASP 48 N 0.10 0.00 0.06 -0.69 3.58 -0.69 -3.17 116.42 115.61 2opu h ASP 48 Ca -0.14 0.00 -0.38 0.00 0.42 0.00 0.00 57.03 56.93 2opu h ASP 48 Cb 1.96 0.00 -0.04 0.00 1.72 0.00 0.00 39.33 42.96 2opu h ASP 48 CO 0.21 0.26 -2.22 -1.54 -2.88 0.00 0.00 179.24 173.07 2opu n SER 49 N -3.74 2.05 0.00 2.28 3.41 -0.83 -5.02 113.62 111.77 2opu n SER 49 Ca -0.01 0.06 0.00 0.00 -0.26 0.00 0.00 58.87 58.66 2opu n SER 49 Cb 0.37 -0.66 0.00 0.00 -0.26 0.00 0.00 64.21 63.66 2opu n SER 49 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2opu n GLY 50 N 2.08 1.42 3.95 5.00 0.00 0.42 -4.40 105.19 113.66 2opu n GLY 50 Ca -0.39 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.40 2opu n GLY 50 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2opu n LYS 52 N -1.73 3.79 -3.04 0.00 5.02 0.30 -4.46 118.16 118.05 2opu n LYS 52 Ca -0.05 -4.50 -0.43 0.00 -2.02 0.00 0.00 58.31 51.31 2opu n LYS 52 Cb 0.57 -2.52 -0.06 0.00 -0.02 0.00 0.00 35.03 33.00 2opu n LYS 52 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 2opu s VAL 53 N -1.87 4.73 -0.07 -0.18 1.01 -1.26 -3.53 120.40 119.23 2opu s VAL 53 Ca 0.31 0.16 0.02 0.00 0.00 0.00 0.00 61.98 62.47 2opu s VAL 53 Cb -0.04 -4.29 -0.02 0.00 0.00 0.00 0.00 36.38 32.03 2opu s VAL 53 CO -0.02 -0.72 -0.12 -1.10 0.00 0.00 0.00 175.10 173.15 2opu s GLN 54 N 3.07 2.77 -0.33 2.72 -1.52 -0.92 -4.96 119.66 120.50 2opu s GLN 54 Ca 0.25 -0.65 -0.18 0.00 -1.95 0.00 0.00 55.36 52.83 2opu s GLN 54 Cb -0.14 -2.50 -0.01 0.00 -0.22 0.00 0.00 33.01 30.15 2opu s GLN 54 CO 0.19 0.55 0.51 0.42 -0.25 0.00 0.00 175.29 176.71 2opu s ILE 55 N -0.51 5.03 -0.47 1.08 -1.09 -1.26 -1.22 121.20 122.75 2opu s ILE 55 Ca 0.07 0.49 -0.19 0.00 -2.23 0.00 0.00 60.65 58.79 2opu s ILE 55 Cb -0.12 -3.93 0.05 0.00 -1.58 0.00 0.00 42.46 36.88 2opu s ILE 55 CO 0.02 -0.14 0.56 -0.44 -1.23 0.00 0.00 174.94 173.71 2opu s SER 56 N 1.71 6.22 0.15 3.58 0.01 0.70 -4.93 113.70 121.14 2opu s SER 56 Ca 0.19 -0.82 0.07 0.00 1.31 0.00 0.00 55.95 56.71 2opu s SER 56 Cb -0.15 -2.27 -0.11 0.00 0.21 0.00 0.00 66.02 63.70 2opu s SER 56 CO 0.12 -0.78 1.34 1.55 0.41 0.00 0.00 173.24 175.88 2opu h PRO 57 N 8.90 0.01 0.10 12.44 0.13 -1.96 -2.92 132.00 148.70 2opu h PRO 57 Ca -0.27 -0.01 -0.18 0.00 -0.87 0.00 0.00 66.00 64.67 2opu h PRO 57 Cb 1.10 0.00 0.02 0.00 0.13 0.00 0.00 31.00 32.25 2opu h PRO 57 CO 0.91 0.94 -0.75 -0.44 -0.23 0.00 0.00 178.00 178.42 2opu h ASP 58 N 0.00 0.49 0.00 1.44 5.19 -1.94 -3.47 116.42 118.13 2opu h ASP 58 Ca -0.01 -0.90 0.00 0.00 -0.62 0.00 0.00 57.03 55.50 2opu h ASP 58 Cb 1.65 -0.16 0.00 0.00 0.18 0.00 0.00 39.33 41.01 2opu h ASP 58 CO 0.12 1.34 0.00 -0.24 -3.12 0.00 0.00 179.24 177.34 2opu n SER 59 N -4.15 0.00 0.00 6.45 2.88 -1.25 -4.82 113.62 112.73 2opu n SER 59 Ca -0.13 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.41 2opu n SER 59 Cb 0.78 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.24 2opu n SER 59 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2opu n GLY 60 N 0.00 1.45 0.14 0.46 0.00 -1.26 -4.64 105.19 101.34 2opu n GLY 60 Ca 0.00 -0.70 0.15 0.00 0.00 0.00 0.00 46.02 45.47 2opu n GLY 60 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2opu n GLY 61 N 0.00 -0.76 3.29 -0.02 0.00 -1.26 -4.79 105.19 101.66 2opu n GLY 61 Ca 0.00 -0.27 -0.32 0.00 0.00 0.00 0.00 46.02 45.44 2opu n GLY 61 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2opu s LEU 62 N -2.11 2.16 0.36 0.99 1.43 -1.26 -4.99 118.68 115.25 2opu s LEU 62 Ca 0.41 -0.47 0.26 0.00 -1.03 0.00 0.00 54.13 53.30 2opu s LEU 62 Cb 0.21 -1.40 0.83 0.00 0.03 0.00 0.00 46.19 45.86 2opu s LEU 62 CO 0.38 0.26 1.76 1.55 0.23 0.00 0.00 176.35 180.53 2opu h PRO 63 N 5.99 0.00 0.00 1.29 0.13 -1.96 -3.45 132.00 134.00 2opu h PRO 63 Ca -0.34 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.79 2opu h PRO 63 Cb 1.17 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.30 2opu h PRO 63 CO 0.48 0.00 0.00 -0.85 -0.23 0.00 0.00 178.00 177.40 2opu n GLU 64 N -2.67 2.01 -3.92 0.86 0.28 -1.26 -4.82 120.64 111.11 2opu n GLU 64 Ca 0.03 0.00 -0.24 0.00 -0.16 0.00 0.00 57.16 56.79 2opu n GLU 64 Cb 0.39 0.00 -0.03 0.00 1.43 0.00 0.00 31.44 33.24 2opu n GLU 64 CO 0.00 0.00 0.00 0.50 -0.16 0.00 0.00 177.13 177.47 2opu s ARG 65 N 1.06 3.45 -0.03 3.44 6.06 0.15 -4.84 118.95 128.23 2opu s ARG 65 Ca 0.00 -0.62 0.04 0.00 -2.50 0.00 0.00 55.73 52.64 2opu s ARG 65 Cb 0.00 -2.93 -0.00 0.00 0.06 0.00 0.00 34.95 32.08 2opu s ARG 65 CO 0.00 0.47 -0.14 -1.54 -2.50 0.00 0.00 175.30 171.60 2opu s SER 66 N -3.49 1.75 -0.11 -2.12 1.04 -1.10 -0.34 113.70 109.34 2opu s SER 66 Ca 0.35 -0.28 0.03 0.00 0.48 0.00 0.00 55.95 56.52 2opu s SER 66 Cb -0.10 -0.46 -0.00 0.00 0.10 0.00 0.00 66.02 65.55 2opu s SER 66 CO 0.29 0.12 -0.20 -0.69 0.98 0.00 0.00 173.24 173.73 2opu s VAL 67 N 0.07 2.38 -0.15 5.02 1.01 -0.01 -0.21 120.40 128.50 2opu s VAL 67 Ca -0.03 -0.90 -0.18 0.00 0.00 0.00 0.00 61.98 60.87 2opu s VAL 67 Cb -0.10 -1.94 -0.04 0.00 0.00 0.00 0.00 36.38 34.30 2opu s VAL 67 CO 0.01 0.55 0.50 -0.44 0.00 0.00 0.00 175.10 175.72 2opu s SER 68 N 0.35 6.64 -0.27 3.32 0.01 -0.35 -0.33 113.70 123.07 2opu s SER 68 Ca -0.16 0.76 -0.07 0.00 1.31 0.00 0.00 55.95 57.79 2opu s SER 68 Cb -0.17 -2.29 -0.01 0.00 0.21 0.00 0.00 66.02 63.76 2opu s SER 68 CO 0.08 -0.07 0.06 -0.76 0.41 0.00 0.00 173.24 172.95 2opu s LEU 69 N 1.04 3.54 0.07 2.44 2.01 0.98 -2.16 118.68 126.59 2opu s LEU 69 Ca 0.25 -0.47 -0.14 0.00 0.01 0.00 0.00 54.13 53.79 2opu s LEU 69 Cb -0.15 -1.87 0.02 0.00 0.01 0.00 0.00 46.19 44.19 2opu s LEU 69 CO 0.10 -0.10 0.31 0.42 1.01 0.00 0.00 176.35 178.09 2opu s THR 70 N 1.54 0.09 -5.00 5.49 -4.23 -1.23 -1.56 115.64 110.74 2opu s THR 70 Ca 0.05 -0.73 0.00 0.00 -1.18 0.00 0.00 61.69 59.83 2opu s THR 70 Cb -0.16 -1.04 0.00 0.00 1.34 0.00 0.00 72.50 72.64 2opu s THR 70 CO 0.02 -0.40 0.00 0.61 -0.54 0.00 0.00 174.62 174.31 2opu n GLY 71 N 0.33 -0.25 3.87 3.99 0.00 -0.17 0.11 105.19 113.07 2opu n GLY 71 Ca -0.18 -1.01 -0.31 0.00 0.00 0.00 0.00 46.02 44.53 2opu n GLY 71 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2opu s ALA 72 N -1.00 3.11 0.19 4.61 0.00 -1.26 -1.65 121.76 125.77 2opu s ALA 72 Ca 0.00 -0.09 -0.15 0.00 0.00 0.00 0.00 51.96 51.72 2opu s ALA 72 Cb 0.00 -3.06 0.18 0.00 0.00 0.00 0.00 23.12 20.25 2opu s ALA 72 CO 0.00 -0.63 1.64 -1.00 0.00 0.00 0.00 175.76 175.77 2opu h PRO 73 N -0.19 0.00 -0.32 0.00 0.13 -1.97 0.46 132.00 130.11 2opu h PRO 73 Ca -0.44 -0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 64.63 2opu h PRO 73 Cb 1.19 -0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.31 2opu h PRO 73 CO 0.62 0.00 -0.01 1.49 -0.23 0.00 0.00 178.00 179.87 2opu h GLU 74 N 0.00 0.56 0.42 0.86 4.81 -1.95 -3.01 114.58 116.27 2opu h GLU 74 Ca 0.26 -0.18 -0.02 0.00 -0.13 0.00 0.00 59.36 59.29 2opu h GLU 74 Cb 0.40 -0.05 0.00 0.00 0.63 0.00 0.00 28.75 29.73 2opu h GLU 74 CO -0.56 0.70 -0.20 0.77 -0.73 0.00 0.00 179.01 178.99 2opu h SER 75 N 0.36 -0.48 0.27 1.04 0.02 -1.45 -1.67 113.55 111.64 2opu h SER 75 Ca 0.09 -0.04 -0.02 0.00 -0.84 0.00 0.00 61.79 60.98 2opu h SER 75 Cb 0.45 0.12 -0.00 0.00 0.14 0.00 0.00 62.40 63.11 2opu h SER 75 CO 0.02 -0.27 -0.11 1.62 -1.14 0.00 0.00 176.83 176.95 2opu h VAL 76 N -0.67 0.67 0.03 2.27 3.04 -0.20 0.26 116.25 121.66 2opu h VAL 76 Ca -0.06 -0.47 -0.00 0.00 -1.01 0.00 0.00 66.70 65.16 2opu h VAL 76 Cb 0.49 1.29 0.00 0.00 -2.01 0.00 0.00 31.29 31.06 2opu h VAL 76 CO 0.10 0.11 -0.01 -0.61 -1.01 0.00 0.00 177.57 176.14 2opu h GLN 77 N 0.00 -0.03 -0.05 4.17 4.15 -1.39 -2.69 115.11 119.27 2opu h GLN 77 Ca -0.00 0.00 0.02 0.00 0.77 0.00 0.00 58.65 59.44 2opu h GLN 77 Cb 0.28 0.01 -0.02 0.00 0.21 0.00 0.00 27.48 27.96 2opu h GLN 77 CO 0.01 0.52 -0.06 -0.22 -1.93 0.00 0.00 178.83 177.15 2opu h LYS 78 N -0.61 -0.08 -0.41 1.69 1.63 -0.14 -0.63 116.57 118.02 2opu h LYS 78 Ca -0.00 0.01 0.07 0.00 -0.85 0.00 0.00 60.65 59.87 2opu h LYS 78 Cb 0.57 0.02 -0.06 0.00 -0.60 0.00 0.00 32.23 32.15 2opu h LYS 78 CO 0.01 -0.06 0.05 0.00 -3.45 0.00 0.00 179.45 176.00 2opu h ALA 79 N 0.95 0.42 0.00 5.00 0.00 -0.67 0.02 119.26 124.99 2opu h ALA 79 Ca 0.04 0.10 -0.01 0.00 0.00 0.00 0.00 54.91 55.04 2opu h ALA 79 Cb 0.15 0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.09 2opu h ALA 79 CO -0.10 -0.35 -0.05 0.87 0.00 0.00 0.00 179.25 179.61 2opu h LYS 80 N 0.16 0.00 -0.49 0.00 1.57 -1.10 -1.77 116.57 114.94 2opu h LYS 80 Ca 0.20 0.00 -0.09 0.00 -1.87 0.00 0.00 60.65 58.89 2opu h LYS 80 Cb 0.27 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.56 2opu h LYS 80 CO -0.30 0.05 -0.06 0.52 -0.57 0.00 0.00 179.45 179.10 2opu h MET 81 N 0.00 0.91 -0.16 3.15 2.86 0.60 0.36 114.93 122.65 2opu h MET 81 Ca -0.00 -0.32 -0.02 0.00 -2.06 0.00 0.00 59.70 57.29 2opu h MET 81 Cb 0.40 -0.07 -0.01 0.00 0.06 0.00 0.00 31.60 31.98 2opu h MET 81 CO 0.01 0.97 0.01 0.52 1.06 0.00 0.00 176.91 179.47 2opu h MET 82 N 0.76 0.28 0.41 1.72 2.86 -1.16 -1.56 114.93 118.24 2opu h MET 82 Ca 0.13 -0.09 -0.01 0.00 -2.06 0.00 0.00 59.70 57.68 2opu h MET 82 Cb 0.60 -0.03 -0.01 0.00 0.06 0.00 0.00 31.60 32.22 2opu h MET 82 CO 0.04 0.49 -0.29 -0.07 1.06 0.00 0.00 176.91 178.14 2opu h LEU 83 N 0.04 -0.74 -0.63 1.22 -0.00 -1.19 -1.77 115.31 112.23 2opu h LEU 83 Ca 0.05 0.05 0.07 0.00 -0.00 0.00 0.00 57.88 58.05 2opu h LEU 83 Cb 0.36 0.23 -0.06 0.00 -0.00 0.00 0.00 40.66 41.19 2opu h LEU 83 CO 0.01 -0.44 0.31 -0.78 -0.00 0.00 0.00 178.44 177.54 2opu h ASP 84 N -0.68 0.42 -0.05 -0.43 3.58 -0.36 0.19 116.42 119.09 2opu h ASP 84 Ca -0.04 0.05 0.04 0.00 0.42 0.00 0.00 57.03 57.49 2opu h ASP 84 Cb 0.58 -0.03 -0.05 0.00 1.72 0.00 0.00 39.33 41.56 2opu h ASP 84 CO 0.01 0.27 -0.22 -0.78 -2.88 0.00 0.00 179.24 175.64 2opu h ASP 85 N 0.57 -0.66 -0.02 2.28 3.58 -0.88 0.14 116.42 121.43 2opu h ASP 85 Ca 0.30 0.10 -0.12 0.00 0.42 0.00 0.00 57.03 57.73 2opu h ASP 85 Cb 0.26 0.28 0.01 0.00 1.72 0.00 0.00 39.33 41.60 2opu h ASP 85 CO -0.23 -0.28 -0.47 0.40 -2.88 0.00 0.00 179.24 175.79 2opu h ILE 86 N -0.32 1.45 -0.88 2.25 5.03 -1.08 -2.19 117.51 121.78 2opu h ILE 86 Ca 0.07 -1.98 -0.02 0.00 -0.12 0.00 0.00 64.86 62.82 2opu h ILE 86 Cb 0.43 2.57 -0.04 0.00 -3.03 0.00 0.00 36.82 36.75 2opu h ILE 86 CO -0.23 0.57 0.46 0.58 -0.68 0.00 0.00 178.15 178.85 2opu h VAL 87 N -0.19 1.26 0.00 1.67 2.07 -0.89 -2.21 116.25 117.95 2opu h VAL 87 Ca -0.05 -0.66 -0.11 0.00 0.82 0.00 0.00 66.70 66.69 2opu h VAL 87 Cb 1.17 0.09 -0.02 0.00 -1.52 0.00 0.00 31.29 31.02 2opu h VAL 87 CO 0.09 0.30 -0.54 0.28 0.02 0.00 0.00 177.57 177.71 2opu h SER 88 N 1.23 0.00 1.20 0.57 0.02 -0.75 0.21 113.55 116.04 2opu h SER 88 Ca 0.31 0.00 -0.03 0.00 -0.84 0.00 0.00 61.79 61.23 2opu h SER 88 Cb 0.05 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 62.59 2opu h SER 88 CO -0.05 0.54 -0.13 0.08 -1.14 0.00 0.00 176.83 176.14 2opu h ARG 89 N 0.00 0.00 0.00 3.45 -0.00 -0.77 -3.39 114.38 113.67 2opu h ARG 89 Ca -0.01 0.00 -0.17 0.00 -0.00 0.00 0.00 59.98 59.81 2opu h ARG 89 Cb 1.06 0.00 -0.13 0.00 -0.00 0.00 0.00 29.97 30.90 2opu h ARG 89 CO 0.07 0.13 -0.22 0.41 -0.00 0.00 0.00 179.97 180.36 2opu n GLY 90 N 0.37 -0.53 3.34 0.08 0.00 -1.06 -5.03 105.19 102.36 2opu n GLY 90 Ca 0.01 0.46 -0.43 0.00 0.00 0.00 0.00 46.02 46.06 2opu n GLY 90 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 2opu n ARG 91 N 0.80 3.27 -3.15 1.61 0.63 0.72 -4.81 116.66 115.73 2opu n ARG 91 Ca 0.02 -3.43 0.04 0.00 -0.92 0.00 0.00 57.85 53.56 2opu n ARG 91 Cb 0.71 -3.24 -0.01 0.00 0.45 0.00 0.00 32.46 30.38 2opu n ARG 91 CO 0.00 0.00 0.00 0.20 -2.51 0.00 0.00 177.63 175.32 2opu s GLY 92 N 3.17 -1.06 0.00 5.14 0.00 -1.26 -5.00 107.32 108.30 2opu s GLY 92 Ca 0.47 1.60 0.00 0.00 0.00 0.00 0.00 44.72 46.79 2opu s GLY 92 CO 0.02 3.58 0.00 0.61 0.00 0.00 0.00 173.10 177.31