#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 -8.85 -3.86 4.38 3.41 -1.26 -4.93 113.62 102.51 2opu n SER 6 Ca 0.00 1.27 -0.28 0.00 -0.26 0.00 0.00 58.87 59.60 2opu n SER 6 Cb 0.00 -4.90 -0.12 0.00 -0.26 0.00 0.00 64.21 58.93 2opu n SER 6 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 2opu s SER 7 N -3.14 4.53 -0.33 4.04 0.01 -0.75 -4.93 113.70 113.12 2opu s SER 7 Ca 0.00 -3.72 -0.28 0.00 1.31 0.00 0.00 55.95 53.26 2opu s SER 7 Cb 0.00 -1.54 -0.02 0.00 0.21 0.00 0.00 66.02 64.67 2opu s SER 7 CO 0.00 -0.10 1.82 -1.58 0.41 0.00 0.00 173.24 173.79 2opu s GLN 8 N -1.23 3.30 -0.54 12.44 0.74 -1.26 -1.94 119.66 131.17 2opu s GLN 8 Ca 0.25 1.43 -0.20 0.00 0.05 0.00 0.00 55.36 56.88 2opu s GLN 8 Cb -0.06 -4.21 0.06 0.00 1.10 0.00 0.00 33.01 29.90 2opu s GLN 8 CO -0.15 -1.90 0.72 -0.51 -0.55 0.00 0.00 175.29 172.89 2opu s LEU 9 N 7.05 4.83 -0.67 3.68 1.43 0.92 -4.93 118.68 130.99 2opu s LEU 9 Ca 0.80 -0.89 0.04 0.00 -1.03 0.00 0.00 54.13 53.05 2opu s LEU 9 Cb -0.22 -2.49 0.35 0.00 0.03 0.00 0.00 46.19 43.85 2opu s LEU 9 CO 0.33 -1.03 1.19 0.61 0.23 0.00 0.00 176.35 177.68 2opu n GLY 10 N 5.19 5.77 0.12 -3.19 0.00 -1.26 -1.44 105.19 110.38 2opu n GLY 10 Ca -0.05 -2.73 -0.21 0.00 0.00 0.00 0.00 46.02 43.02 2opu n GLY 10 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2opu h PRO 11 N 3.19 0.30 -6.27 1.61 0.14 -1.92 -3.46 132.00 125.59 2opu h PRO 11 Ca 0.25 -0.52 -0.56 0.00 0.14 0.00 0.00 66.00 65.31 2opu h PRO 11 Cb 0.49 0.19 -0.04 0.00 0.14 0.00 0.00 31.00 31.78 2opu h PRO 11 CO 0.92 1.25 0.03 0.96 0.14 0.00 0.00 178.00 181.30 2opu s ILE 12 N -2.46 4.69 0.15 -3.56 -0.00 -1.26 -5.00 121.20 113.76 2opu s ILE 12 Ca -0.16 1.36 0.08 0.00 -0.00 0.00 0.00 60.65 61.94 2opu s ILE 12 Cb 0.02 -3.97 -0.16 0.00 -0.00 0.00 0.00 42.46 38.35 2opu s ILE 12 CO 0.82 0.50 1.36 -0.74 -0.00 0.00 0.00 174.94 176.88 2opu h HIS 13 N 4.82 0.00 -1.26 1.37 2.76 -1.98 -3.43 115.15 117.43 2opu h HIS 13 Ca -0.48 0.00 -0.42 0.00 -2.20 0.00 0.00 60.37 57.28 2opu h HIS 13 Cb 1.21 0.00 0.20 0.00 1.55 0.00 0.00 27.41 30.37 2opu h HIS 13 CO 0.66 0.90 -1.78 -2.30 -1.30 0.00 0.00 177.93 174.11 2opu n PRO 14 N -3.44 0.00 -0.78 5.26 -0.02 -1.26 -4.93 135.00 129.83 2opu n PRO 14 Ca -0.00 0.00 -0.33 0.00 -2.02 0.00 0.00 63.50 61.15 2opu n PRO 14 Cb 0.86 -0.80 0.13 0.00 -0.02 0.00 0.00 33.50 33.67 2opu n PRO 14 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 2opu n PRO 15 N 1.99 -0.40 0.00 0.52 -0.04 -1.26 -4.48 135.00 131.32 2opu n PRO 15 Ca -0.02 -0.08 0.02 0.00 -0.04 0.00 0.00 63.50 63.39 2opu n PRO 15 Cb 0.51 -1.87 0.11 0.00 -0.04 0.00 0.00 33.50 32.22 2opu n PRO 15 CO 0.00 0.00 0.00 -0.35 -0.04 0.00 0.00 175.50 175.11 2opu n PRO 16 N -1.83 0.19 0.18 0.54 -0.04 -1.25 -2.66 135.00 130.13 2opu n PRO 16 Ca 0.06 0.00 0.12 0.00 -0.04 0.00 0.00 63.50 63.65 2opu n PRO 16 Cb 0.54 -1.30 0.68 0.00 -0.04 0.00 0.00 33.50 33.37 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 0.00 0.00 0.00 0.54 0.11 -1.30 0.15 114.38 113.88 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 0.00 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.08 2opu h ARG 17 CO 0.00 0.00 0.00 -2.37 0.10 0.00 0.00 179.97 177.70 2opu n THR 18 N -4.43 0.00 0.00 0.08 5.66 -1.13 -3.95 114.28 110.51 2opu n THR 18 Ca 0.01 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.01 2opu n THR 18 Cb 0.25 0.96 0.00 0.00 -1.55 0.00 0.00 70.33 69.99 2opu n THR 18 CO 0.00 0.00 0.00 -0.24 -3.05 0.00 0.00 175.07 171.78 2opu n SER 19 N 0.00 0.00 -4.58 1.09 2.88 -1.09 -4.65 113.62 107.27 2opu n SER 19 Ca 0.00 0.00 -0.26 0.00 -1.33 0.00 0.00 58.87 57.28 2opu n SER 19 Cb 0.35 0.00 -0.07 0.00 -0.75 0.00 0.00 64.21 63.74 2opu n SER 19 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2opu s MET 20 N 0.15 2.25 -0.32 -1.46 0.23 -1.21 -4.47 119.30 114.46 2opu s MET 20 Ca 0.00 -1.05 -0.29 0.00 -1.03 0.00 0.00 55.69 53.32 2opu s MET 20 Cb 0.00 -5.20 0.02 0.00 -1.53 0.00 0.00 34.83 28.12 2opu s MET 20 CO 0.00 -4.29 1.10 0.99 -2.03 0.00 0.00 175.02 170.80 2opu s THR 21 N 12.17 4.46 -0.30 3.16 2.01 -0.52 -4.68 115.64 131.94 2opu s THR 21 Ca 0.71 1.68 -0.19 0.00 0.31 0.00 0.00 61.69 64.19 2opu s THR 21 Cb -0.01 -4.39 -0.01 0.00 0.01 0.00 0.00 72.50 68.09 2opu s THR 21 CO 0.14 -0.49 0.56 -0.70 -0.69 0.00 0.00 174.62 173.45 2opu s GLU 22 N 3.73 3.91 -0.58 4.92 2.56 -0.93 -0.06 118.70 132.24 2opu s GLU 22 Ca 0.47 0.21 -0.23 0.00 0.00 0.00 0.00 54.97 55.42 2opu s GLU 22 Cb -0.13 -3.72 0.05 0.00 2.00 0.00 0.00 34.13 32.34 2opu s GLU 22 CO 0.17 -0.50 0.92 -2.00 -0.56 0.00 0.00 175.26 173.28 2opu s GLU 23 N 2.45 3.24 -0.43 4.30 2.12 -0.82 -2.14 118.70 127.41 2opu s GLU 23 Ca 0.22 -0.51 -0.21 0.00 0.36 0.00 0.00 54.97 54.83 2opu s GLU 23 Cb -0.15 -4.11 0.02 0.00 0.26 0.00 0.00 34.13 30.15 2opu s GLU 23 CO 0.11 -1.57 0.66 0.71 -0.54 0.00 0.00 175.26 174.63 2opu s TYR 24 N 3.87 3.06 -0.65 5.30 1.51 0.51 -1.81 117.35 129.14 2opu s TYR 24 Ca 0.26 0.01 -0.28 0.00 -1.01 0.00 0.00 57.07 56.06 2opu s TYR 24 Cb -0.15 -3.38 0.03 0.00 -0.11 0.00 0.00 41.96 38.36 2opu s TYR 24 CO 0.16 -0.87 1.22 1.03 -1.11 0.00 0.00 175.55 175.98 2opu s ARG 25 N 2.88 3.37 -0.11 -0.62 0.52 -1.26 -1.32 118.95 122.42 2opu s ARG 25 Ca 0.24 0.02 0.03 0.00 -0.52 0.00 0.00 55.73 55.50 2opu s ARG 25 Cb -0.14 -4.09 0.01 0.00 0.52 0.00 0.00 34.95 31.25 2opu s ARG 25 CO 0.19 -1.87 -0.20 0.54 0.02 0.00 0.00 175.30 173.98 2opu s VAL 26 N 5.24 1.81 0.33 3.52 0.11 -0.49 -4.96 120.40 125.97 2opu s VAL 26 Ca 0.39 -0.85 -0.28 0.00 -2.93 0.00 0.00 61.98 58.31 2opu s VAL 26 Cb -0.08 -1.60 -0.12 0.00 -1.53 0.00 0.00 36.38 33.05 2opu s VAL 26 CO 0.21 0.50 1.36 -2.65 -3.33 0.00 0.00 175.10 171.19 2opu n PRO 27 N 3.87 2.25 -0.19 1.54 -0.02 -1.26 -0.72 135.00 140.48 2opu n PRO 27 Ca -0.20 0.79 -0.07 0.00 -2.02 0.00 0.00 63.50 62.00 2opu n PRO 27 Cb 0.52 -2.42 -0.02 0.00 -0.02 0.00 0.00 33.50 31.56 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 2.93 -1.33 0.55 2.55 1.82 -1.90 0.22 116.42 121.25 2opu h ASP 28 Ca -0.47 0.23 -0.03 0.00 -0.39 0.00 0.00 57.03 56.37 2opu h ASP 28 Cb 1.27 0.62 -0.00 0.00 0.68 0.00 0.00 39.33 41.90 2opu h ASP 28 CO 0.65 -0.33 -0.14 1.23 -1.61 0.00 0.00 179.24 179.04 2opu h GLY 29 N -0.22 0.00 2.00 -0.78 0.00 -2.00 -1.38 103.07 100.68 2opu h GLY 29 Ca 0.19 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.52 2opu h GLY 29 CO -0.66 0.00 0.00 1.98 0.00 0.00 0.00 176.54 177.86 2opu h MET 30 N 0.00 0.00 -0.06 4.80 1.85 -0.97 -1.35 114.93 119.21 2opu h MET 30 Ca -0.00 0.00 -0.16 0.00 -0.61 0.00 0.00 59.70 58.93 2opu h MET 30 Cb 0.46 0.00 -0.01 0.00 0.43 0.00 0.00 31.60 32.48 2opu h MET 30 CO 0.02 0.00 -0.68 0.28 -0.40 0.00 0.00 176.91 176.13 2opu h VAL 31 N 0.00 1.41 -0.42 -5.77 2.07 -0.08 0.04 116.25 113.50 2opu h VAL 31 Ca 0.00 -2.14 0.12 0.00 0.82 0.00 0.00 66.70 65.50 2opu h VAL 31 Cb 0.88 2.11 -0.02 0.00 -1.52 0.00 0.00 31.29 32.75 2opu h VAL 31 CO 0.00 0.63 0.30 1.23 0.02 0.00 0.00 177.57 179.75 2opu h GLY 32 N 1.52 0.01 1.20 2.17 0.00 -1.01 -0.92 103.07 106.04 2opu h GLY 32 Ca -0.02 -0.00 -0.09 0.00 0.00 0.00 0.00 47.33 47.22 2opu h GLY 32 CO 0.11 0.00 -1.05 1.41 0.00 0.00 0.00 176.54 177.01 2opu h LEU 33 N 0.01 0.00 -0.91 3.11 3.38 -1.10 -2.95 115.31 116.84 2opu h LEU 33 Ca 0.20 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 58.07 2opu h LEU 33 Cb 0.79 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.52 2opu h LEU 33 CO -0.00 0.32 -0.48 -0.29 0.09 0.00 0.00 178.44 178.08 2opu h ILE 34 N 0.00 1.18 0.00 1.22 6.09 0.33 -1.27 117.51 125.06 2opu h ILE 34 Ca -0.07 -1.75 0.00 0.00 -1.37 0.00 0.00 64.86 61.67 2opu h ILE 34 Cb 1.31 1.99 0.00 0.00 0.47 0.00 0.00 36.82 40.59 2opu h ILE 34 CO 0.03 0.47 -0.43 0.16 -3.07 0.00 0.00 178.15 175.31 2opu h ILE 35 N 0.00 0.00 0.00 2.19 3.07 -1.47 -3.35 117.51 117.95 2opu h ILE 35 Ca -0.00 -0.53 0.00 0.00 1.55 0.00 0.00 64.86 65.88 2opu h ILE 35 Cb 0.95 1.25 0.00 0.00 -0.27 0.00 0.00 36.82 38.75 2opu h ILE 35 CO 0.06 0.00 0.00 0.61 -1.05 0.00 0.00 178.15 177.77 2opu n GLY 36 N 1.31 0.20 0.10 0.16 0.00 -0.48 -2.24 105.19 104.24 2opu n GLY 36 Ca 0.04 0.67 0.00 0.00 0.00 0.00 0.00 46.02 46.72 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 0.60 0.00 1.61 1.85 -1.26 -4.70 116.66 114.75 2opu n ARG 37 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.85 2opu n ARG 37 Cb 0.00 -1.06 0.00 0.00 -1.05 0.00 0.00 32.46 30.35 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 0.12 1.03 0.00 2.89 0.00 -1.04 -4.65 105.19 103.54 2opu n GLY 38 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 -1.91 3.48 0.31 -0.02 0.00 -0.95 -4.99 105.19 101.10 2opu n GLY 39 Ca 0.00 -0.51 0.18 0.00 0.00 0.00 0.00 46.02 45.69 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 -0.13 1.61 4.57 -1.83 -3.02 114.58 115.78 2opu h GLU 40 Ca 0.00 0.00 -0.01 0.00 -1.18 0.00 0.00 59.36 58.17 2opu h GLU 40 Cb 0.00 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 28.58 2opu h GLU 40 CO 0.00 0.03 0.03 0.37 -1.18 0.00 0.00 179.01 178.26 2opu h GLN 41 N 0.00 0.22 -0.69 1.92 4.15 -1.84 -2.11 115.11 116.76 2opu h GLN 41 Ca -0.00 -0.05 -0.01 0.00 0.77 0.00 0.00 58.65 59.35 2opu h GLN 41 Cb 0.14 -0.03 -0.03 0.00 0.21 0.00 0.00 27.48 27.76 2opu h GLN 41 CO 0.00 0.38 0.38 0.97 -1.93 0.00 0.00 178.83 178.63 2opu h ILE 42 N 0.02 1.21 -0.21 2.39 6.09 -1.66 -0.36 117.51 124.98 2opu h ILE 42 Ca 0.04 -0.53 0.06 0.00 -1.37 0.00 0.00 64.86 63.06 2opu h ILE 42 Cb 0.26 0.31 -0.06 0.00 0.47 0.00 0.00 36.82 37.79 2opu h ILE 42 CO 0.00 0.23 -0.20 0.78 -3.07 0.00 0.00 178.15 175.89 2opu h ASN 43 N 0.95 -0.65 -0.26 2.19 2.35 -1.63 0.12 115.58 118.66 2opu h ASN 43 Ca 0.24 0.12 0.04 0.00 -0.55 0.00 0.00 56.30 56.15 2opu h ASN 43 Cb 0.03 0.31 -0.03 0.00 0.05 0.00 0.00 38.32 38.68 2opu h ASN 43 CO -0.04 -0.25 0.04 0.50 -1.65 0.00 0.00 177.43 176.04 2opu h LYS 44 N -0.22 0.13 -0.05 0.81 3.64 -0.80 0.72 116.57 120.80 2opu h LYS 44 Ca 0.13 -0.01 -0.00 0.00 -1.27 0.00 0.00 60.65 59.50 2opu h LYS 44 Cb 0.41 -0.03 -0.00 0.00 -0.41 0.00 0.00 32.23 32.20 2opu h LYS 44 CO -0.34 0.09 0.03 0.82 -2.27 0.00 0.00 179.45 177.78 2opu h ILE 45 N 0.14 1.10 0.00 2.00 1.08 -0.41 0.32 117.51 121.73 2opu h ILE 45 Ca 0.12 -0.29 -0.17 0.00 -0.39 0.00 0.00 64.86 64.13 2opu h ILE 45 Cb 0.13 1.20 -0.02 0.00 -3.07 0.00 0.00 36.82 35.05 2opu h ILE 45 CO -0.16 0.08 -0.79 0.06 -0.69 0.00 0.00 178.15 176.65 2opu h GLN 46 N -0.03 0.00 -0.24 2.37 -0.00 -0.90 -2.16 115.11 114.15 2opu h GLN 46 Ca 0.02 0.00 -0.15 0.00 -0.00 0.00 0.00 58.65 58.52 2opu h GLN 46 Cb 0.11 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 27.59 2opu h GLN 46 CO -0.00 0.79 -0.42 0.37 -0.00 0.00 0.00 178.83 179.57 2opu h GLN 47 N 0.00 0.71 -0.28 0.06 -0.00 -0.79 0.22 115.11 115.03 2opu h GLN 47 Ca -0.01 -0.44 0.02 0.00 -0.00 0.00 0.00 58.65 58.22 2opu h GLN 47 Cb 1.58 0.05 -0.02 0.00 0.00 0.00 0.00 27.48 29.08 2opu h GLN 47 CO 0.10 1.06 0.14 0.22 0.00 0.00 0.00 178.83 180.36 2opu h ASP 48 N 0.43 0.21 0.38 -0.69 3.58 -0.87 -3.20 116.42 116.25 2opu h ASP 48 Ca 0.02 0.01 -0.32 0.00 0.42 0.00 0.00 57.03 57.16 2opu h ASP 48 Cb 1.02 -0.03 0.03 0.00 1.72 0.00 0.00 39.33 42.07 2opu h ASP 48 CO 0.10 0.16 -1.43 0.77 -2.88 0.00 0.00 179.24 175.95 2opu h SER 49 N 0.29 0.69 0.00 2.28 4.64 -1.40 -3.48 113.55 116.58 2opu h SER 49 Ca 0.11 -0.76 0.00 0.00 -0.47 0.00 0.00 61.79 60.67 2opu h SER 49 Cb 0.03 -0.23 0.00 0.00 -0.31 0.00 0.00 62.40 61.89 2opu h SER 49 CO -0.08 1.60 0.00 0.61 -0.87 0.00 0.00 176.83 178.10 2opu n GLY 50 N 1.67 1.02 3.75 -0.77 0.00 0.71 -4.41 105.19 107.16 2opu n GLY 50 Ca -0.15 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.47 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 1.50 3.34 -2.82 0.00 4.76 0.38 -4.64 118.16 120.68 2opu n LYS 52 Ca -0.02 -3.76 -0.41 0.00 -2.87 0.00 0.00 58.31 51.25 2opu n LYS 52 Cb 0.47 -3.11 -0.04 0.00 -1.84 0.00 0.00 35.03 30.51 2opu n LYS 52 CO 0.00 0.00 0.00 0.54 -1.37 0.00 0.00 177.40 176.57 2opu s VAL 53 N 1.96 4.85 -0.32 -0.18 0.11 -1.26 -2.68 120.40 122.87 2opu s VAL 53 Ca 0.45 1.87 -0.02 0.00 -2.93 0.00 0.00 61.98 61.35 2opu s VAL 53 Cb -0.02 -4.23 0.06 0.00 -1.53 0.00 0.00 36.38 30.66 2opu s VAL 53 CO 0.01 0.22 0.04 -1.10 -3.33 0.00 0.00 175.10 170.95 2opu s GLN 54 N 0.71 2.31 -0.58 1.54 -1.52 0.53 -4.99 119.66 117.66 2opu s GLN 54 Ca 0.46 -1.40 -0.28 0.00 -1.95 0.00 0.00 55.36 52.20 2opu s GLN 54 Cb -0.20 -3.27 0.03 0.00 -0.22 0.00 0.00 33.01 29.35 2opu s GLN 54 CO 0.25 -0.72 1.16 0.42 -0.25 0.00 0.00 175.29 176.15 2opu s ILE 55 N 1.22 4.07 -0.44 1.08 -1.09 -1.26 -1.86 121.20 122.91 2opu s ILE 55 Ca -0.02 0.83 -0.06 0.00 -2.23 0.00 0.00 60.65 59.17 2opu s ILE 55 Cb -0.20 -4.70 0.11 0.00 -1.58 0.00 0.00 42.46 36.09 2opu s ILE 55 CO -0.02 -1.31 0.27 -0.44 -1.23 0.00 0.00 174.94 172.21 2opu s SER 56 N 2.94 5.48 -0.11 3.58 0.01 -0.64 -4.91 113.70 120.04 2opu s SER 56 Ca 0.41 -1.96 0.03 0.00 1.31 0.00 0.00 55.95 55.75 2opu s SER 56 Cb -0.08 -1.92 0.26 0.00 0.21 0.00 0.00 66.02 64.48 2opu s SER 56 CO 0.25 -0.62 1.10 -0.81 0.41 0.00 0.00 173.24 173.57 2opu n PRO 57 N 4.76 1.91 0.08 12.44 -0.04 -1.26 -2.68 135.00 150.21 2opu n PRO 57 Ca -0.05 -1.05 -0.08 0.00 -0.04 0.00 0.00 63.50 62.28 2opu n PRO 57 Cb 0.41 -1.59 -0.07 0.00 -0.04 0.00 0.00 33.50 32.21 2opu n PRO 57 CO 0.00 0.00 0.00 -0.44 -0.04 0.00 0.00 175.50 175.02 2opu h ASP 58 N 0.89 0.09 -6.48 3.54 5.19 -1.91 -3.48 116.42 114.26 2opu h ASP 58 Ca 0.10 -0.09 -0.44 0.00 -0.62 0.00 0.00 57.03 55.98 2opu h ASP 58 Cb 1.30 -0.03 0.02 0.00 0.18 0.00 0.00 39.33 40.80 2opu h ASP 58 CO 0.26 1.00 -0.89 -1.54 -3.12 0.00 0.00 179.24 174.95 2opu n SER 59 N -3.48 -5.20 -4.38 6.45 3.41 -1.26 -4.95 113.62 104.21 2opu n SER 59 Ca -0.02 -0.95 -0.37 0.00 -0.26 0.00 0.00 58.87 57.27 2opu n SER 59 Cb 0.89 -2.60 -0.12 0.00 -0.26 0.00 0.00 64.21 62.11 2opu n SER 59 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 2opu s GLY 60 N -3.25 1.79 0.00 5.00 0.00 -1.26 -4.51 107.32 105.10 2opu s GLY 60 Ca 0.25 -1.36 0.00 0.00 0.00 0.00 0.00 44.72 43.61 2opu s GLY 60 CO 0.89 0.63 0.00 0.61 0.00 0.00 0.00 173.10 175.22 2opu n GLY 61 N 4.90 1.36 3.70 0.20 0.00 -1.26 -4.89 105.19 109.21 2opu n GLY 61 Ca -0.15 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.48 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 0.00 4.26 0.13 0.99 1.02 -1.26 -4.95 118.68 118.86 2opu s LEU 62 Ca 0.00 1.01 0.27 0.00 0.02 0.00 0.00 54.13 55.42 2opu s LEU 62 Cb 0.00 -2.95 0.84 0.00 0.02 0.00 0.00 46.19 44.10 2opu s LEU 62 CO 0.00 -0.14 1.74 -0.81 0.02 0.00 0.00 176.35 177.16 2opu n PRO 63 N 4.15 0.19 0.00 1.29 -0.04 -1.26 -4.41 135.00 134.92 2opu n PRO 63 Ca -0.02 0.13 0.00 0.00 -0.04 0.00 0.00 63.50 63.57 2opu n PRO 63 Cb 0.51 -1.70 0.00 0.00 -0.04 0.00 0.00 33.50 32.27 2opu n PRO 63 CO 0.00 0.00 0.00 -0.85 -0.04 0.00 0.00 175.50 174.61 2opu n GLU 64 N -2.01 3.39 -3.29 0.54 0.28 -1.26 -4.94 120.64 113.34 2opu n GLU 64 Ca 0.06 0.00 -0.39 0.00 -0.16 0.00 0.00 57.16 56.67 2opu n GLU 64 Cb 0.40 0.00 -0.06 0.00 1.43 0.00 0.00 31.44 33.22 2opu n GLU 64 CO 0.00 0.00 0.00 1.03 -0.16 0.00 0.00 177.13 178.00 2opu s ARG 65 N 3.32 4.20 -0.16 3.44 1.81 0.11 -4.32 118.95 127.36 2opu s ARG 65 Ca 0.00 0.69 -0.03 0.00 -1.72 0.00 0.00 55.73 54.67 2opu s ARG 65 Cb 0.00 -3.27 -0.02 0.00 -0.45 0.00 0.00 34.95 31.21 2opu s ARG 65 CO 0.00 0.56 -0.05 -1.54 -0.68 0.00 0.00 175.30 173.59 2opu s SER 66 N -0.81 4.63 -0.21 0.23 1.04 -1.09 -1.40 113.70 116.09 2opu s SER 66 Ca 0.29 -0.18 0.01 0.00 0.48 0.00 0.00 55.95 56.55 2opu s SER 66 Cb -0.19 -1.75 0.03 0.00 0.10 0.00 0.00 66.02 64.21 2opu s SER 66 CO 0.18 0.15 -0.16 -0.69 0.98 0.00 0.00 173.24 173.70 2opu s VAL 67 N 0.45 2.22 -0.07 5.02 1.01 -0.43 -1.62 120.40 126.97 2opu s VAL 67 Ca -0.05 -1.13 -0.15 0.00 0.00 0.00 0.00 61.98 60.66 2opu s VAL 67 Cb -0.15 -2.06 -0.05 0.00 0.00 0.00 0.00 36.38 34.12 2opu s VAL 67 CO 0.03 0.34 0.40 -0.44 0.00 0.00 0.00 175.10 175.43 2opu s SER 68 N 1.25 6.69 -0.12 3.32 0.01 -0.78 -0.36 113.70 123.70 2opu s SER 68 Ca 0.01 0.82 0.03 0.00 1.31 0.00 0.00 55.95 58.11 2opu s SER 68 Cb -0.15 -2.24 0.00 0.00 0.21 0.00 0.00 66.02 63.84 2opu s SER 68 CO -0.10 0.19 -0.21 -0.76 0.41 0.00 0.00 173.24 172.78 2opu s LEU 69 N -0.29 2.22 0.08 2.44 1.43 -0.91 -0.34 118.68 123.30 2opu s LEU 69 Ca 0.23 -0.54 -0.14 0.00 -1.03 0.00 0.00 54.13 52.65 2opu s LEU 69 Cb -0.15 -1.46 0.02 0.00 0.03 0.00 0.00 46.19 44.63 2opu s LEU 69 CO 0.10 0.13 0.32 0.42 0.23 0.00 0.00 176.35 177.55 2opu s THR 70 N 0.54 0.09 -5.00 5.49 -4.23 -1.09 -2.19 115.64 109.24 2opu s THR 70 Ca -0.13 -0.74 0.00 0.00 -1.18 0.00 0.00 61.69 59.64 2opu s THR 70 Cb -0.17 -1.10 0.00 0.00 1.34 0.00 0.00 72.50 72.58 2opu s THR 70 CO 0.04 -0.41 0.00 0.61 -0.54 0.00 0.00 174.62 174.33 2opu n GLY 71 N 0.19 0.24 3.82 3.99 0.00 0.53 0.14 105.19 114.09 2opu n GLY 71 Ca -0.17 -1.32 -0.33 0.00 0.00 0.00 0.00 46.02 44.20 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 2.96 0.25 4.61 0.00 -1.26 -0.85 121.76 126.47 2opu s ALA 72 Ca 0.00 0.37 -0.04 0.00 0.00 0.00 0.00 51.96 52.28 2opu s ALA 72 Cb 0.00 -3.18 0.51 0.00 0.00 0.00 0.00 23.12 20.45 2opu s ALA 72 CO 0.00 -0.26 1.65 -1.35 0.00 0.00 0.00 175.76 175.80 2opu h PRO 73 N 1.22 0.17 -0.00 0.00 0.11 -1.99 0.56 132.00 132.07 2opu h PRO 73 Ca -0.48 -0.01 -0.19 0.00 0.11 0.00 0.00 66.00 65.43 2opu h PRO 73 Cb 1.20 -0.04 -0.01 0.00 0.11 0.00 0.00 31.00 32.26 2opu h PRO 73 CO 0.60 0.11 -0.84 1.49 -0.21 0.00 0.00 178.00 179.16 2opu h GLU 74 N 0.18 0.17 -0.01 1.05 4.81 -1.96 -2.69 114.58 116.12 2opu h GLU 74 Ca 0.45 -0.17 -0.00 0.00 -0.13 0.00 0.00 59.36 59.50 2opu h GLU 74 Cb 0.81 0.05 0.00 0.00 0.63 0.00 0.00 28.75 30.24 2opu h GLU 74 CO -0.62 0.91 -0.01 0.77 -0.73 0.00 0.00 179.01 179.33 2opu h SER 75 N 0.10 0.03 0.45 1.04 0.02 -0.96 -2.16 113.55 112.07 2opu h SER 75 Ca -0.03 -0.56 -0.05 0.00 -0.84 0.00 0.00 61.79 60.31 2opu h SER 75 Cb 1.45 -0.01 -0.01 0.00 0.14 0.00 0.00 62.40 63.97 2opu h SER 75 CO 0.12 0.58 -0.25 1.62 -1.14 0.00 0.00 176.83 177.76 2opu h VAL 76 N -0.53 0.89 -0.17 2.27 3.04 -0.11 -1.85 116.25 119.79 2opu h VAL 76 Ca 0.00 -0.95 -0.17 0.00 -1.01 0.00 0.00 66.70 64.57 2opu h VAL 76 Cb 0.57 1.56 0.01 0.00 -2.01 0.00 0.00 31.29 31.42 2opu h VAL 76 CO 0.00 0.24 -0.55 -0.61 -1.01 0.00 0.00 177.57 175.65 2opu h GLN 77 N 0.00 0.68 -0.69 4.17 4.15 -1.44 -2.20 115.11 119.78 2opu h GLN 77 Ca -0.00 -0.50 -0.07 0.00 0.77 0.00 0.00 58.65 58.85 2opu h GLN 77 Cb 0.54 0.09 -0.03 0.00 0.21 0.00 0.00 27.48 28.29 2opu h GLN 77 CO 0.03 1.12 0.15 -0.22 -1.93 0.00 0.00 178.83 177.98 2opu h LYS 78 N 0.36 1.12 -0.39 1.69 3.11 -0.86 0.60 116.57 122.20 2opu h LYS 78 Ca -0.02 -0.28 0.01 0.00 -2.81 0.00 0.00 60.65 57.55 2opu h LYS 78 Cb 1.17 -0.14 -0.02 0.00 -1.00 0.00 0.00 32.23 32.24 2opu h LYS 78 CO 0.12 1.00 0.24 0.00 -2.81 0.00 0.00 179.45 178.00 2opu h ALA 79 N 1.07 0.49 0.00 5.00 0.00 -1.37 -1.50 119.26 122.96 2opu h ALA 79 Ca 0.21 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.09 2opu h ALA 79 Cb 0.40 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.06 2opu h ALA 79 CO 0.01 -0.09 -0.08 0.87 0.00 0.00 0.00 179.25 179.96 2opu h LYS 80 N 0.49 0.00 0.25 0.00 1.57 -0.81 -0.13 116.57 117.93 2opu h LYS 80 Ca 0.15 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.92 2opu h LYS 80 Cb -0.01 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.30 2opu h LYS 80 CO -0.06 0.08 -0.12 0.52 -0.57 0.00 0.00 179.45 179.30 2opu h MET 81 N 0.00 -0.32 -0.20 3.15 2.86 0.19 0.21 114.93 120.82 2opu h MET 81 Ca -0.00 0.02 -0.15 0.00 -2.06 0.00 0.00 59.70 57.51 2opu h MET 81 Cb 0.30 0.07 -0.01 0.00 0.06 0.00 0.00 31.60 32.03 2opu h MET 81 CO 0.01 -0.20 -0.52 0.52 1.06 0.00 0.00 176.91 177.79 2opu h MET 82 N -0.35 0.56 0.93 1.72 2.86 -1.28 -2.42 114.93 116.95 2opu h MET 82 Ca -0.03 -0.34 -0.05 0.00 -2.06 0.00 0.00 59.70 57.22 2opu h MET 82 Cb 0.27 0.03 0.01 0.00 0.06 0.00 0.00 31.60 31.97 2opu h MET 82 CO 0.06 0.94 -0.45 -0.07 1.06 0.00 0.00 176.91 178.45 2opu h LEU 83 N 0.44 -1.06 -1.83 1.22 -0.00 -0.86 -2.26 115.31 110.95 2opu h LEU 83 Ca 0.02 0.04 -0.02 0.00 -0.00 0.00 0.00 57.88 57.91 2opu h LEU 83 Cb 1.05 0.27 -0.00 0.00 -0.00 0.00 0.00 40.66 41.98 2opu h LEU 83 CO 0.10 -0.73 -0.11 -0.78 -0.00 0.00 0.00 178.44 176.92 2opu h ASP 84 N -1.29 0.00 0.96 -0.43 3.58 -0.65 0.19 116.42 118.78 2opu h ASP 84 Ca -0.13 0.00 -0.05 0.00 0.42 0.00 0.00 57.03 57.28 2opu h ASP 84 Cb 0.96 0.00 0.01 0.00 1.72 0.00 0.00 39.33 42.02 2opu h ASP 84 CO 0.21 0.11 -0.46 -0.78 -2.88 0.00 0.00 179.24 175.43 2opu h ASP 85 N 0.00 -1.09 0.01 2.28 1.82 -1.29 0.18 116.42 118.33 2opu h ASP 85 Ca -0.00 0.04 -0.18 0.00 -0.39 0.00 0.00 57.03 56.50 2opu h ASP 85 Cb 0.20 0.28 -0.00 0.00 0.68 0.00 0.00 39.33 40.49 2opu h ASP 85 CO 0.01 -0.76 -0.62 0.40 -1.61 0.00 0.00 179.24 176.66 2opu h ILE 86 N -1.32 1.32 -0.22 2.25 5.03 -1.10 -2.65 117.51 120.82 2opu h ILE 86 Ca -0.13 -1.89 -0.03 0.00 -0.12 0.00 0.00 64.86 62.69 2opu h ILE 86 Cb 0.99 1.85 -0.01 0.00 -3.03 0.00 0.00 36.82 36.62 2opu h ILE 86 CO 0.22 0.59 0.01 0.58 -0.68 0.00 0.00 178.15 178.86 2opu h VAL 87 N 0.45 1.14 -0.28 1.67 2.07 -0.66 -2.08 116.25 118.55 2opu h VAL 87 Ca -0.01 -0.52 -0.19 0.00 0.82 0.00 0.00 66.70 66.81 2opu h VAL 87 Cb 1.19 0.96 0.00 0.00 -1.52 0.00 0.00 31.29 31.92 2opu h VAL 87 CO 0.12 0.18 -0.57 -1.28 0.02 0.00 0.00 177.57 176.04 2opu h SER 88 N 0.32 0.99 1.21 0.57 0.87 -0.67 0.41 113.55 117.23 2opu h SER 88 Ca 0.07 -0.54 0.00 0.00 -1.23 0.00 0.00 61.79 60.10 2opu h SER 88 Cb 0.20 -0.28 0.00 0.00 -0.44 0.00 0.00 62.40 61.88 2opu h SER 88 CO 0.00 1.34 0.00 0.08 -0.53 0.00 0.00 176.83 177.73 2opu h ARG 89 N 0.67 0.00 0.00 2.24 0.11 -1.11 -2.81 114.38 113.48 2opu h ARG 89 Ca 0.01 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.09 2opu h ARG 89 Cb 1.18 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.26 2opu h ARG 89 CO 0.13 0.00 -0.40 0.41 0.10 0.00 0.00 179.97 180.21 2opu n GLY 90 N 0.35 -0.40 0.06 0.08 0.00 -0.82 -4.87 105.19 99.58 2opu n GLY 90 Ca 0.02 -0.13 -0.06 0.00 0.00 0.00 0.00 46.02 45.85 2opu n GLY 90 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 2opu h ARG 91 N -0.40 0.00 0.00 1.61 2.43 -0.53 -3.50 114.38 113.99 2opu h ARG 91 Ca 0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 2opu h ARG 91 Cb 0.40 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.95 2opu h ARG 91 CO 0.00 0.37 0.00 0.41 -1.51 0.00 0.00 179.97 179.24 2opu n GLY 92 N 1.70 0.52 0.00 2.80 0.00 0.66 -4.96 105.19 105.92 2opu n GLY 92 Ca -0.05 -2.26 0.00 0.00 0.00 0.00 0.00 46.02 43.71 2opu n GLY 92 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93