#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2opu s SER 6 N 0.00 5.57 0.00 4.38 0.01 -1.26 -3.96 113.70 118.44 2opu s SER 6 Ca 0.00 -1.04 0.00 0.00 1.31 0.00 0.00 55.95 56.22 2opu s SER 6 Cb 0.00 -2.57 0.00 0.00 0.21 0.00 0.00 66.02 63.66 2opu s SER 6 CO 0.00 -2.37 0.00 -1.20 0.41 0.00 0.00 173.24 170.08 2opu n SER 7 N 12.38 0.00 -3.61 2.44 7.64 0.87 -4.77 113.62 128.58 2opu n SER 7 Ca 0.39 0.00 -0.02 0.00 1.01 0.00 0.00 58.87 60.25 2opu n SER 7 Cb 0.48 0.00 -0.02 0.00 -1.01 0.00 0.00 64.21 63.66 2opu n SER 7 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2opu s GLN 8 N 0.00 0.29 -0.21 1.43 -2.07 -1.25 -1.81 119.66 116.04 2opu s GLN 8 Ca 0.00 -0.13 -0.04 0.00 -1.82 0.00 0.00 55.36 53.37 2opu s GLN 8 Cb 0.00 0.12 0.07 0.00 -1.09 0.00 0.00 33.01 32.11 2opu s GLN 8 CO 0.00 -0.13 0.09 -0.51 -1.32 0.00 0.00 175.29 173.42 2opu s LEU 9 N -2.40 0.60 -0.49 2.60 1.43 0.10 -4.86 118.68 115.67 2opu s LEU 9 Ca 0.11 -0.84 0.08 0.00 -1.03 0.00 0.00 54.13 52.45 2opu s LEU 9 Cb 0.01 -0.35 0.36 0.00 0.03 0.00 0.00 46.19 46.24 2opu s LEU 9 CO -0.04 -0.37 0.92 0.61 0.23 0.00 0.00 176.35 177.70 2opu n GLY 10 N 5.22 4.89 0.49 -3.19 0.00 -1.26 -1.75 105.19 109.58 2opu n GLY 10 Ca -0.07 -2.41 0.13 0.00 0.00 0.00 0.00 46.02 43.67 2opu n GLY 10 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2opu n PRO 11 N -0.14 1.41 -4.31 1.61 -0.04 -1.26 -4.89 135.00 127.38 2opu n PRO 11 Ca 0.29 -0.98 -0.23 0.00 -0.04 0.00 0.00 63.50 62.54 2opu n PRO 11 Cb 0.53 -1.48 -0.13 0.00 -0.04 0.00 0.00 33.50 32.38 2opu n PRO 11 CO 0.00 0.00 0.00 0.96 -0.04 0.00 0.00 175.50 176.42 2opu s ILE 12 N -2.27 1.55 -0.25 0.52 -4.36 -1.26 -5.07 121.20 110.06 2opu s ILE 12 Ca 0.28 -1.42 0.23 0.00 -0.26 0.00 0.00 60.65 59.47 2opu s ILE 12 Cb 0.20 -1.41 -0.04 0.00 1.25 0.00 0.00 42.46 42.46 2opu s ILE 12 CO 0.44 -0.06 0.99 1.41 0.24 0.00 0.00 174.94 177.96 2opu n HIS 13 N 1.26 0.83 -0.94 1.37 8.25 -1.26 -4.62 115.22 120.10 2opu n HIS 13 Ca -0.20 0.24 -0.35 0.00 -0.26 0.00 0.00 57.72 57.16 2opu n HIS 13 Cb 0.54 -0.88 0.04 0.00 1.12 0.00 0.00 29.99 30.80 2opu n HIS 13 CO 0.00 0.00 0.00 -2.30 0.64 0.00 0.00 176.34 174.68 2opu n PRO 14 N -2.58 0.00 -1.33 -0.41 -0.02 -1.26 -4.90 135.00 124.50 2opu n PRO 14 Ca -0.00 0.00 -0.37 0.00 -2.02 0.00 0.00 63.50 61.11 2opu n PRO 14 Cb 0.54 -0.94 0.06 0.00 -0.02 0.00 0.00 33.50 33.14 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 2.35 0.37 0.00 0.52 -0.02 -1.26 -4.55 135.00 132.41 2opu n PRO 15 Ca -0.02 0.16 0.01 0.00 -2.02 0.00 0.00 63.50 61.64 2opu n PRO 15 Cb 0.57 -1.80 0.07 0.00 -0.02 0.00 0.00 33.50 32.33 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 -0.52 0.30 0.18 0.52 -0.04 -1.26 -2.75 135.00 131.42 2opu n PRO 16 Ca 0.10 0.00 0.13 0.00 -0.04 0.00 0.00 63.50 63.70 2opu n PRO 16 Cb 0.49 -1.12 0.60 0.00 -0.04 0.00 0.00 33.50 33.43 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 -0.00 -1.46 -1.86 114.38 111.60 2opu h ARG 17 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 59.98 59.98 2opu h ARG 17 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 29.97 29.97 2opu h ARG 17 CO 0.00 0.00 0.00 -2.37 -0.00 0.00 0.00 179.97 177.60 2opu n THR 18 N -2.43 0.00 0.00 0.08 5.66 -1.14 -4.46 114.28 111.99 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 0.17 0.05 0.00 0.00 -1.55 0.00 0.00 70.33 69.00 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 -3.98 1.09 2.88 -1.11 -4.75 113.62 107.75 2opu n SER 19 Ca 0.00 0.00 -0.34 0.00 -1.33 0.00 0.00 58.87 57.20 2opu n SER 19 Cb 0.43 0.00 -0.10 0.00 -0.75 0.00 0.00 64.21 63.79 2opu n SER 19 CO 0.00 0.00 0.00 1.15 -1.23 0.00 0.00 175.04 174.96 2opu n MET 20 N 0.00 0.62 -3.31 -1.46 0.00 -1.24 -4.48 117.12 107.26 2opu n MET 20 Ca 0.00 -1.61 -0.38 0.00 0.00 0.00 0.00 57.70 55.70 2opu n MET 20 Cb 0.00 -3.17 -0.06 0.00 0.00 0.00 0.00 33.22 29.99 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 9.91 4.83 0.13 3.17 2.01 -0.72 -4.85 115.64 130.12 2opu s THR 21 Ca 0.70 1.14 -0.06 0.00 0.31 0.00 0.00 61.69 63.78 2opu s THR 21 Cb 0.07 -3.87 -0.06 0.00 0.01 0.00 0.00 72.50 68.66 2opu s THR 21 CO 0.22 0.53 0.38 -1.61 -0.69 0.00 0.00 174.62 173.45 2opu s GLU 22 N -0.93 3.64 -0.36 4.92 0.41 -0.94 0.03 118.70 125.47 2opu s GLU 22 Ca 0.28 -0.04 0.04 0.00 -0.41 0.00 0.00 54.97 54.84 2opu s GLU 22 Cb -0.19 -2.88 0.10 0.00 -1.78 0.00 0.00 34.13 29.39 2opu s GLU 22 CO 0.17 0.49 0.08 -2.00 -0.49 0.00 0.00 175.26 173.51 2opu s GLU 23 N -2.49 1.52 -0.20 1.61 2.56 -0.75 -1.13 118.70 119.82 2opu s GLU 23 Ca 0.39 -1.95 -0.17 0.00 0.00 0.00 0.00 54.97 53.24 2opu s GLU 23 Cb -0.12 -3.19 -0.04 0.00 2.00 0.00 0.00 34.13 32.78 2opu s GLU 23 CO 0.23 -0.96 0.44 -0.47 -0.56 0.00 0.00 175.26 173.94 2opu s TYR 24 N 0.77 3.37 -0.44 5.30 6.14 0.80 -0.09 117.35 133.19 2opu s TYR 24 Ca 0.12 0.67 -0.28 0.00 0.64 0.00 0.00 57.07 58.22 2opu s TYR 24 Cb -0.20 -2.59 0.03 0.00 0.42 0.00 0.00 41.96 39.62 2opu s TYR 24 CO -0.07 -0.06 1.05 1.03 0.64 0.00 0.00 175.55 178.14 2opu s ARG 25 N 1.48 3.73 -0.08 4.97 0.52 -1.26 -1.43 118.95 126.88 2opu s ARG 25 Ca 0.21 0.53 0.01 0.00 -0.52 0.00 0.00 55.73 55.96 2opu s ARG 25 Cb -0.15 -3.88 0.02 0.00 0.52 0.00 0.00 34.95 31.46 2opu s ARG 25 CO 0.09 -1.23 -0.09 0.54 0.02 0.00 0.00 175.30 174.63 2opu s VAL 26 N 4.06 0.96 0.69 3.52 0.11 -0.64 -4.99 120.40 124.11 2opu s VAL 26 Ca 0.44 -0.33 -0.17 0.00 -2.93 0.00 0.00 61.98 58.99 2opu s VAL 26 Cb -0.09 -0.93 0.01 0.00 -1.53 0.00 0.00 36.38 33.84 2opu s VAL 26 CO 0.27 0.33 1.28 -2.84 -3.33 0.00 0.00 175.10 170.81 2opu s PRO 27 N 1.07 2.32 0.13 1.54 0.02 -1.26 -1.54 135.00 137.28 2opu s PRO 27 Ca -0.07 2.01 -0.23 0.00 0.02 0.00 0.00 61.00 62.73 2opu s PRO 27 Cb -0.14 -1.82 -0.04 0.00 0.02 0.00 0.00 34.50 32.52 2opu s PRO 27 CO -0.01 -1.76 1.67 0.22 -0.33 0.00 0.00 177.00 176.79 2opu h ASP 28 N 0.20 -0.45 0.63 2.53 3.58 -1.93 0.25 116.42 121.24 2opu h ASP 28 Ca -0.50 0.08 -0.04 0.00 0.42 0.00 0.00 57.03 56.99 2opu h ASP 28 Cb 1.33 0.21 -0.01 0.00 1.72 0.00 0.00 39.33 42.58 2opu h ASP 28 CO 0.51 -0.20 -0.21 1.23 -2.88 0.00 0.00 179.24 177.70 2opu h GLY 29 N -0.20 0.00 1.85 -0.78 0.00 -1.99 -2.47 103.07 99.48 2opu h GLY 29 Ca 0.08 0.00 -0.23 0.00 0.00 0.00 0.00 47.33 47.18 2opu h GLY 29 CO -0.21 0.00 -1.07 1.98 0.00 0.00 0.00 176.54 177.24 2opu h MET 30 N 0.00 0.12 0.00 4.80 1.85 -1.37 -2.27 114.93 118.05 2opu h MET 30 Ca -0.00 -0.19 -0.05 0.00 -0.61 0.00 0.00 59.70 58.85 2opu h MET 30 Cb 0.59 0.07 -0.01 0.00 0.43 0.00 0.00 31.60 32.68 2opu h MET 30 CO 0.03 1.07 -0.26 -0.24 -0.40 0.00 0.00 176.91 177.11 2opu h VAL 31 N 0.04 0.59 0.00 -5.77 3.04 -0.42 -0.10 116.25 113.62 2opu h VAL 31 Ca -0.06 -1.26 -0.04 0.00 -1.01 0.00 0.00 66.70 64.33 2opu h VAL 31 Cb 1.81 1.85 -0.01 0.00 -2.01 0.00 0.00 31.29 32.94 2opu h VAL 31 CO 0.16 0.25 -0.20 1.23 -1.01 0.00 0.00 177.57 178.00 2opu h GLY 32 N 2.28 0.00 1.26 3.17 0.00 -0.97 -2.51 103.07 106.30 2opu h GLY 32 Ca -0.00 0.00 -0.12 0.00 0.00 0.00 0.00 47.33 47.20 2opu h GLY 32 CO 0.03 0.00 -1.10 1.41 0.00 0.00 0.00 176.54 176.89 2opu h LEU 33 N 0.00 0.00 -0.78 3.11 3.38 -0.70 -3.01 115.31 117.31 2opu h LEU 33 Ca -0.00 0.00 -0.11 0.00 0.09 0.00 0.00 57.88 57.86 2opu h LEU 33 Cb 0.37 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.11 2opu h LEU 33 CO 0.03 0.45 -0.51 -0.29 0.09 0.00 0.00 178.44 178.21 2opu h ILE 34 N 0.00 1.16 0.00 1.22 6.09 -0.78 -1.67 117.51 123.53 2opu h ILE 34 Ca -0.10 -1.89 0.00 0.00 -1.37 0.00 0.00 64.86 61.50 2opu h ILE 34 Cb 1.43 2.08 0.00 0.00 0.47 0.00 0.00 36.82 40.80 2opu h ILE 34 CO 0.04 0.50 -0.34 2.30 -3.07 0.00 0.00 178.15 177.58 2opu n ILE 35 N -3.63 0.34 0.00 2.19 -5.35 -0.97 -3.59 119.36 108.34 2opu n ILE 35 Ca -0.01 -0.21 0.00 0.00 -0.27 0.00 0.00 62.75 62.27 2opu n ILE 35 Cb 0.58 -0.26 0.00 0.00 -1.74 0.00 0.00 39.64 38.22 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 1.37 0.25 2.11 3.28 0.00 -0.63 -1.94 105.19 109.63 2opu n GLY 36 Ca 0.05 0.64 -0.07 0.00 0.00 0.00 0.00 46.02 46.64 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 1.21 -1.64 1.61 1.85 -1.26 -4.58 116.66 113.85 2opu n ARG 37 Ca 0.00 -0.56 -0.20 0.00 -1.00 0.00 0.00 57.85 56.09 2opu n ARG 37 Cb 0.00 -1.74 -0.08 0.00 -1.05 0.00 0.00 32.46 29.59 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 2.54 1.72 0.00 2.89 0.00 -1.21 -3.60 105.19 107.54 2opu n GLY 38 Ca 0.24 -0.06 0.00 0.00 0.00 0.00 0.00 46.02 46.20 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 -0.58 2.86 0.38 -0.02 0.00 -0.87 -5.00 105.19 101.96 2opu n GLY 39 Ca -0.20 -0.39 0.16 0.00 0.00 0.00 0.00 46.02 45.59 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 0.34 -0.16 1.61 4.81 -1.64 -2.92 114.58 116.62 2opu h GLU 40 Ca 0.00 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.21 2opu h GLU 40 Cb 0.00 -0.08 -0.01 0.00 0.63 0.00 0.00 28.75 29.30 2opu h GLU 40 CO 0.00 0.22 0.11 0.37 -0.73 0.00 0.00 179.01 178.98 2opu h GLN 41 N 0.35 0.21 -0.82 1.92 4.15 -1.67 0.13 115.11 119.38 2opu h GLN 41 Ca 0.34 -0.01 -0.00 0.00 0.77 0.00 0.00 58.65 59.75 2opu h GLN 41 Cb 0.84 -0.05 -0.04 0.00 0.21 0.00 0.00 27.48 28.44 2opu h GLN 41 CO -0.09 0.14 0.51 0.97 -1.93 0.00 0.00 178.83 178.43 2opu h ILE 42 N 0.22 1.22 -0.36 2.39 6.09 -1.57 0.12 117.51 125.63 2opu h ILE 42 Ca 0.06 -0.47 -0.04 0.00 -1.37 0.00 0.00 64.86 63.03 2opu h ILE 42 Cb -0.02 0.05 -0.01 0.00 0.47 0.00 0.00 36.82 37.30 2opu h ILE 42 CO -0.01 0.23 0.05 0.78 -3.07 0.00 0.00 178.15 176.13 2opu h ASN 43 N 1.13 0.57 -0.23 2.19 2.35 -1.45 0.20 115.58 120.35 2opu h ASN 43 Ca 0.30 -0.27 0.01 0.00 -0.55 0.00 0.00 56.30 55.79 2opu h ASN 43 Cb -0.07 -0.15 -0.01 0.00 0.05 0.00 0.00 38.32 38.14 2opu h ASN 43 CO -0.06 0.70 0.15 0.11 -1.65 0.00 0.00 177.43 176.68 2opu h LYS 44 N 0.43 0.25 0.02 0.81 1.79 0.38 0.51 116.57 120.76 2opu h LYS 44 Ca 0.11 -0.02 -0.00 0.00 -2.18 0.00 0.00 60.65 58.56 2opu h LYS 44 Cb 0.37 -0.06 0.00 0.00 -1.58 0.00 0.00 32.23 30.96 2opu h LYS 44 CO 0.01 0.17 -0.01 0.82 -1.08 0.00 0.00 179.45 179.36 2opu h ILE 45 N 0.26 1.50 0.00 1.86 1.08 -0.26 -2.29 117.51 119.66 2opu h ILE 45 Ca 0.09 -1.81 -0.08 0.00 -0.39 0.00 0.00 64.86 62.67 2opu h ILE 45 Cb 0.04 2.68 -0.01 0.00 -3.07 0.00 0.00 36.82 36.46 2opu h ILE 45 CO -0.02 0.45 -0.36 0.06 -0.69 0.00 0.00 178.15 177.59 2opu h GLN 46 N -0.84 0.00 0.10 2.37 -0.00 -0.31 -0.96 115.11 115.48 2opu h GLN 46 Ca -0.00 0.00 -0.28 0.00 -0.00 0.00 0.00 58.65 58.36 2opu h GLN 46 Cb 0.76 0.00 -0.01 0.00 -0.00 0.00 0.00 27.48 28.23 2opu h GLN 46 CO 0.00 0.36 -1.40 0.37 -0.00 0.00 0.00 178.83 178.17 2opu h GLN 47 N 0.00 0.21 -0.23 0.06 4.15 -0.11 0.10 115.11 119.30 2opu h GLN 47 Ca -0.00 -0.36 -0.04 0.00 0.77 0.00 0.00 58.65 59.01 2opu h GLN 47 Cb 1.07 0.13 -0.01 0.00 0.21 0.00 0.00 27.48 28.88 2opu h GLN 47 CO 0.05 1.09 -0.03 0.22 -1.93 0.00 0.00 178.83 178.23 2opu h ASP 48 N 0.06 0.42 -0.04 -0.69 1.82 -1.27 -3.29 116.42 113.43 2opu h ASP 48 Ca -0.19 -0.34 -0.04 0.00 -0.39 0.00 0.00 57.03 56.07 2opu h ASP 48 Cb 1.97 -0.11 0.00 0.00 0.68 0.00 0.00 39.33 41.87 2opu h ASP 48 CO 0.16 0.66 -0.14 0.77 -1.61 0.00 0.00 179.24 179.08 2opu h SER 49 N 0.18 0.19 0.00 2.28 4.64 -1.25 -3.48 113.55 116.10 2opu h SER 49 Ca 0.06 -0.64 0.00 0.00 -0.47 0.00 0.00 61.79 60.74 2opu h SER 49 Cb 0.46 -0.06 0.00 0.00 -0.31 0.00 0.00 62.40 62.49 2opu h SER 49 CO 0.02 0.80 0.00 0.61 -0.87 0.00 0.00 176.83 177.39 2opu n GLY 50 N 0.67 1.16 3.85 -0.77 0.00 0.28 -4.21 105.19 106.16 2opu n GLY 50 Ca -0.09 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.58 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 1.18 3.03 -2.71 0.00 5.02 0.19 -4.60 118.16 120.28 2opu n LYS 52 Ca -0.09 -2.89 -0.43 0.00 -2.02 0.00 0.00 58.31 52.88 2opu n LYS 52 Cb 0.52 -3.27 -0.03 0.00 -0.02 0.00 0.00 35.03 32.23 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 2.94 4.36 -0.21 -0.18 1.01 -1.26 -3.62 120.40 123.45 2opu s VAL 53 Ca 0.47 1.06 -0.04 0.00 0.00 0.00 0.00 61.98 63.48 2opu s VAL 53 Cb 0.11 -4.50 -0.01 0.00 0.00 0.00 0.00 36.38 31.97 2opu s VAL 53 CO -0.04 -0.87 -0.04 -1.10 0.00 0.00 0.00 175.10 173.05 2opu s GLN 54 N 4.04 3.46 -0.67 2.72 -1.52 -0.64 -4.94 119.66 122.10 2opu s GLN 54 Ca 0.43 -0.60 -0.22 0.00 -1.95 0.00 0.00 55.36 53.02 2opu s GLN 54 Cb -0.09 -3.00 0.08 0.00 -0.22 0.00 0.00 33.01 29.78 2opu s GLN 54 CO 0.27 -0.09 0.95 0.42 -0.25 0.00 0.00 175.29 176.59 2opu s ILE 55 N 1.22 4.41 -0.35 1.08 -1.09 -1.26 -0.64 121.20 124.56 2opu s ILE 55 Ca 0.03 -0.53 -0.28 0.00 -2.23 0.00 0.00 60.65 57.64 2opu s ILE 55 Cb -0.14 -4.67 0.02 0.00 -1.58 0.00 0.00 42.46 36.08 2opu s ILE 55 CO -0.01 -1.43 1.04 -0.55 -1.23 0.00 0.00 174.94 172.77 2opu s SER 56 N 3.68 6.83 0.21 3.58 0.15 0.62 -4.90 113.70 123.87 2opu s SER 56 Ca 0.22 0.86 0.11 0.00 0.70 0.00 0.00 55.95 57.84 2opu s SER 56 Cb -0.17 -2.52 -0.05 0.00 -1.71 0.00 0.00 66.02 61.57 2opu s SER 56 CO 0.08 -0.92 1.38 1.55 1.20 0.00 0.00 173.24 176.53 2opu h PRO 57 N 8.33 0.00 0.23 5.44 0.13 -1.94 -2.99 132.00 141.20 2opu h PRO 57 Ca -0.21 0.00 -0.32 0.00 -0.87 0.00 0.00 66.00 64.59 2opu h PRO 57 Cb 1.07 0.00 0.04 0.00 0.13 0.00 0.00 31.00 32.23 2opu h PRO 57 CO 1.03 0.74 -1.41 0.22 -0.23 0.00 0.00 178.00 178.36 2opu h ASP 58 N 0.00 0.84 0.00 1.44 3.58 -1.92 -3.47 116.42 116.88 2opu h ASP 58 Ca -0.01 -0.91 0.00 0.00 0.42 0.00 0.00 57.03 56.54 2opu h ASP 58 Cb 1.55 -0.27 0.00 0.00 1.72 0.00 0.00 39.33 42.33 2opu h ASP 58 CO 0.10 1.68 0.00 -0.24 -2.88 0.00 0.00 179.24 177.90 2opu n SER 59 N -3.76 0.00 0.00 2.28 2.88 -1.24 -4.81 113.62 108.97 2opu n SER 59 Ca -0.16 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.38 2opu n SER 59 Cb 1.07 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.53 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 1.60 0.05 0.46 0.00 -1.26 -4.72 105.19 101.31 2opu n GLY 60 Ca 0.00 -0.72 0.13 0.00 0.00 0.00 0.00 46.02 45.43 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 -1.52 3.85 -0.02 0.00 -1.26 -4.83 105.19 101.41 2opu n GLY 61 Ca 0.00 -0.14 -0.38 0.00 0.00 0.00 0.00 46.02 45.50 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 -3.73 4.46 0.00 0.99 1.02 -1.26 -4.97 118.68 115.19 2opu s LEU 62 Ca 0.11 0.85 0.29 0.00 0.02 0.00 0.00 54.13 55.41 2opu s LEU 62 Cb 0.16 -2.47 1.32 0.00 0.02 0.00 0.00 46.19 45.22 2opu s LEU 62 CO 0.61 0.34 1.91 -0.81 0.02 0.00 0.00 176.35 178.42 2opu n PRO 63 N 1.86 1.01 0.00 1.29 -0.04 -1.26 -4.74 135.00 133.12 2opu n PRO 63 Ca -0.15 -0.37 0.00 0.00 -0.04 0.00 0.00 63.50 62.94 2opu n PRO 63 Cb 0.53 -1.49 0.00 0.00 -0.04 0.00 0.00 33.50 32.50 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 -0.67 0.00 -3.91 0.54 0.28 -1.26 -4.96 120.64 110.66 2opu n GLU 64 Ca 0.18 0.00 -0.09 0.00 -0.16 0.00 0.00 57.16 57.08 2opu n GLU 64 Cb 0.26 0.00 -0.09 0.00 1.43 0.00 0.00 31.44 33.04 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 1.41 0.63 0.02 3.44 6.06 -0.59 -4.79 118.95 125.13 2opu s ARG 65 Ca 0.00 -0.76 0.02 0.00 -2.50 0.00 0.00 55.73 52.49 2opu s ARG 65 Cb 0.00 0.25 -0.02 0.00 0.06 0.00 0.00 34.95 35.24 2opu s ARG 65 CO 0.00 -0.17 -0.06 -1.54 -2.50 0.00 0.00 175.30 171.03 2opu s SER 66 N -2.20 0.64 -0.08 -2.12 1.04 -1.13 -1.62 113.70 108.23 2opu s SER 66 Ca -0.04 -0.40 0.04 0.00 0.48 0.00 0.00 55.95 56.03 2opu s SER 66 Cb -0.00 0.02 0.00 0.00 0.10 0.00 0.00 66.02 66.14 2opu s SER 66 CO -0.05 -0.14 -0.20 -0.69 0.98 0.00 0.00 173.24 173.14 2opu s VAL 67 N -1.00 1.71 -0.10 5.02 1.01 -0.51 -0.27 120.40 126.25 2opu s VAL 67 Ca -0.07 -0.83 -0.18 0.00 0.00 0.00 0.00 61.98 60.89 2opu s VAL 67 Cb -0.07 -1.49 -0.04 0.00 0.00 0.00 0.00 36.38 34.77 2opu s VAL 67 CO 0.00 0.48 0.49 -0.44 0.00 0.00 0.00 175.10 175.63 2opu s SER 68 N 0.36 6.73 -0.36 3.32 0.01 0.18 -0.14 113.70 123.80 2opu s SER 68 Ca -0.15 0.87 -0.02 0.00 1.31 0.00 0.00 55.95 57.96 2opu s SER 68 Cb -0.16 -2.30 0.08 0.00 0.21 0.00 0.00 66.02 63.86 2opu s SER 68 CO 0.06 0.03 0.11 -0.76 0.41 0.00 0.00 173.24 173.10 2opu s LEU 69 N 0.42 4.69 -0.13 2.44 2.01 -0.28 -1.62 118.68 126.22 2opu s LEU 69 Ca 0.27 -1.73 -0.05 0.00 0.01 0.00 0.00 54.13 52.63 2opu s LEU 69 Cb -0.16 -1.77 0.06 0.00 0.01 0.00 0.00 46.19 44.33 2opu s LEU 69 CO 0.11 -0.42 0.27 -0.89 1.01 0.00 0.00 176.35 176.44 2opu s THR 70 N 1.17 -0.27 0.00 5.49 2.01 -1.24 -2.21 115.64 120.59 2opu s THR 70 Ca 0.03 0.22 0.00 0.00 0.31 0.00 0.00 61.69 62.25 2opu s THR 70 Cb -0.21 -0.44 0.00 0.00 0.01 0.00 0.00 72.50 71.86 2opu s THR 70 CO -0.03 0.09 0.00 0.61 -0.69 0.00 0.00 174.62 174.60 2opu n GLY 71 N 4.89 1.13 3.85 4.40 0.00 -0.70 0.56 105.19 119.32 2opu n GLY 71 Ca -0.14 -0.55 -0.31 0.00 0.00 0.00 0.00 46.02 45.02 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 2.83 0.20 4.61 0.00 -1.26 -1.19 121.76 125.95 2opu s ALA 72 Ca 0.00 -0.13 -0.17 0.00 0.00 0.00 0.00 51.96 51.66 2opu s ALA 72 Cb 0.00 -3.09 0.20 0.00 0.00 0.00 0.00 23.12 20.23 2opu s ALA 72 CO 0.00 -1.08 1.60 -1.35 0.00 0.00 0.00 175.76 174.92 2opu h PRO 73 N -0.61 -0.08 -0.36 0.00 0.11 -1.98 0.65 132.00 129.73 2opu h PRO 73 Ca -0.45 0.01 -0.08 0.00 0.11 0.00 0.00 66.00 65.59 2opu h PRO 73 Cb 1.22 0.02 -0.01 0.00 0.11 0.00 0.00 31.00 32.34 2opu h PRO 73 CO 0.61 -0.06 -0.09 1.49 -0.21 0.00 0.00 178.00 179.74 2opu h GLU 74 N -0.09 0.69 -0.03 1.05 4.81 -1.94 -2.86 114.58 116.22 2opu h GLU 74 Ca 0.28 -0.27 -0.00 0.00 -0.13 0.00 0.00 59.36 59.24 2opu h GLU 74 Cb 0.54 -0.04 -0.00 0.00 0.63 0.00 0.00 28.75 29.88 2opu h GLU 74 CO -0.71 0.85 0.01 0.77 -0.73 0.00 0.00 179.01 179.20 2opu h SER 75 N 0.48 0.04 0.88 1.04 0.02 -1.23 -1.21 113.55 113.57 2opu h SER 75 Ca 0.09 -0.25 -0.04 0.00 -0.84 0.00 0.00 61.79 60.76 2opu h SER 75 Cb 0.60 -0.01 -0.01 0.00 0.14 0.00 0.00 62.40 63.13 2opu h SER 75 CO 0.04 0.28 -0.18 1.62 -1.14 0.00 0.00 176.83 177.45 2opu h VAL 76 N -0.20 0.46 0.09 2.27 3.04 0.14 -0.93 116.25 121.13 2opu h VAL 76 Ca 0.01 -0.95 -0.00 0.00 -1.01 0.00 0.00 66.70 64.74 2opu h VAL 76 Cb 0.25 1.68 0.00 0.00 -2.01 0.00 0.00 31.29 31.21 2opu h VAL 76 CO 0.00 0.17 -0.04 -0.61 -1.01 0.00 0.00 177.57 176.08 2opu h GLN 77 N 0.00 -0.12 -0.74 4.17 4.15 -1.25 -1.62 115.11 119.70 2opu h GLN 77 Ca -0.00 0.01 0.09 0.00 0.77 0.00 0.00 58.65 59.52 2opu h GLN 77 Cb 0.66 0.03 -0.07 0.00 0.21 0.00 0.00 27.48 28.31 2opu h GLN 77 CO 0.02 0.40 0.40 -0.22 -1.93 0.00 0.00 178.83 177.50 2opu h LYS 78 N -0.75 0.65 0.14 1.69 1.63 -0.99 0.18 116.57 119.12 2opu h LYS 78 Ca -0.01 -0.04 0.01 0.00 -0.85 0.00 0.00 60.65 59.76 2opu h LYS 78 Cb 0.57 -0.15 -0.02 0.00 -0.60 0.00 0.00 32.23 32.04 2opu h LYS 78 CO 0.02 0.43 -0.17 0.00 -3.45 0.00 0.00 179.45 176.28 2opu h ALA 79 N 1.43 -0.31 0.00 5.00 0.00 -1.21 -2.21 119.26 121.96 2opu h ALA 79 Ca 0.36 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 55.21 2opu h ALA 79 Cb 0.35 0.26 -0.00 0.00 0.00 0.00 0.00 17.79 18.39 2opu h ALA 79 CO -0.25 -0.70 -0.11 0.87 0.00 0.00 0.00 179.25 179.06 2opu h LYS 80 N -0.35 0.00 0.26 0.00 1.57 -0.64 -2.04 116.57 115.37 2opu h LYS 80 Ca 0.01 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.78 2opu h LYS 80 Cb 0.35 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.66 2opu h LYS 80 CO -0.07 0.11 -0.14 0.52 -0.57 0.00 0.00 179.45 179.30 2opu h MET 81 N 0.00 -0.35 -0.37 3.15 2.86 -0.03 0.19 114.93 120.38 2opu h MET 81 Ca -0.00 0.02 -0.13 0.00 -2.06 0.00 0.00 59.70 57.54 2opu h MET 81 Cb 0.43 0.08 -0.01 0.00 0.06 0.00 0.00 31.60 32.16 2opu h MET 81 CO 0.01 -0.24 -0.28 0.52 1.06 0.00 0.00 176.91 177.99 2opu h MET 82 N -0.37 0.77 0.50 1.72 2.86 -1.31 -2.44 114.93 116.66 2opu h MET 82 Ca -0.03 -0.34 -0.02 0.00 -2.06 0.00 0.00 59.70 57.24 2opu h MET 82 Cb 0.29 -0.02 0.00 0.00 0.06 0.00 0.00 31.60 31.93 2opu h MET 82 CO 0.05 0.96 -0.24 -0.07 1.06 0.00 0.00 176.91 178.67 2opu h LEU 83 N 0.66 -0.57 -1.49 1.22 -0.00 -1.16 -0.77 115.31 113.21 2opu h LEU 83 Ca 0.08 0.01 0.00 0.00 -0.00 0.00 0.00 57.88 57.97 2opu h LEU 83 Cb 0.80 0.15 -0.02 0.00 -0.00 0.00 0.00 40.66 41.58 2opu h LEU 83 CO 0.07 -0.39 0.30 -0.78 -0.00 0.00 0.00 178.44 177.64 2opu h ASP 84 N -0.69 0.56 0.48 -0.43 3.58 -0.65 0.88 116.42 120.15 2opu h ASP 84 Ca -0.07 -0.02 -0.02 0.00 0.42 0.00 0.00 57.03 57.34 2opu h ASP 84 Cb 0.52 -0.14 0.00 0.00 1.72 0.00 0.00 39.33 41.44 2opu h ASP 84 CO 0.11 0.42 -0.23 -0.78 -2.88 0.00 0.00 179.24 175.89 2opu h ASP 85 N 0.66 -0.54 -0.10 2.28 1.82 -1.07 -1.21 116.42 118.26 2opu h ASP 85 Ca 0.18 -0.07 -0.20 0.00 -0.39 0.00 0.00 57.03 56.54 2opu h ASP 85 Cb -0.05 0.14 0.01 0.00 0.68 0.00 0.00 39.33 40.11 2opu h ASP 85 CO -0.04 -0.23 -0.73 0.40 -1.61 0.00 0.00 179.24 177.04 2opu h ILE 86 N -0.86 1.32 0.00 2.25 5.03 -0.97 -2.19 117.51 122.08 2opu h ILE 86 Ca -0.07 -1.98 -0.04 0.00 -0.12 0.00 0.00 64.86 62.66 2opu h ILE 86 Cb 0.58 2.17 -0.01 0.00 -3.03 0.00 0.00 36.82 36.53 2opu h ILE 86 CO 0.11 0.61 -0.17 0.58 -0.68 0.00 0.00 178.15 178.60 2opu h VAL 87 N 0.33 0.93 -0.00 1.67 2.07 -0.91 -1.38 116.25 118.96 2opu h VAL 87 Ca -0.06 -0.62 -0.18 0.00 0.82 0.00 0.00 66.70 66.66 2opu h VAL 87 Cb 1.37 1.35 -0.02 0.00 -1.52 0.00 0.00 31.29 32.48 2opu h VAL 87 CO 0.15 0.17 -0.83 -1.28 0.02 0.00 0.00 177.57 175.80 2opu h SER 88 N 0.00 0.15 1.10 0.57 0.87 -1.03 0.43 113.55 115.64 2opu h SER 88 Ca -0.00 -0.12 0.00 0.00 -1.23 0.00 0.00 61.79 60.44 2opu h SER 88 Cb 0.34 -0.05 0.00 0.00 -0.44 0.00 0.00 62.40 62.25 2opu h SER 88 CO 0.02 0.91 0.00 -2.11 -0.53 0.00 0.00 176.83 175.12 2opu n ARG 89 N -3.65 0.13 -0.10 2.24 1.85 -0.59 -2.08 116.66 114.47 2opu n ARG 89 Ca -0.02 0.16 -0.20 0.00 -1.00 0.00 0.00 57.85 56.78 2opu n ARG 89 Cb 0.78 -1.66 -0.07 0.00 -1.05 0.00 0.00 32.46 30.45 2opu n ARG 89 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 2opu n GLY 90 N 1.09 -0.31 0.00 2.89 0.00 -0.80 -4.84 105.19 103.22 2opu n GLY 90 Ca 0.05 -0.10 0.00 0.00 0.00 0.00 0.00 46.02 45.98 2opu n GLY 90 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2opu n ARG 91 N -3.86 0.00 -1.83 1.61 5.12 0.15 -4.67 116.66 113.18 2opu n ARG 91 Ca -0.37 0.04 -0.42 0.00 -1.93 0.00 0.00 57.85 55.17 2opu n ARG 91 Cb 0.76 -0.30 0.00 0.00 -1.16 0.00 0.00 32.46 31.77 2opu n ARG 91 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2opu n GLY 92 N 2.33 4.48 0.00 -0.13 0.00 -1.19 -4.98 105.19 105.70 2opu n GLY 92 Ca 0.00 -1.68 0.00 0.00 0.00 0.00 0.00 46.02 44.34 2opu n GLY 92 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93