#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 3.12 0.57 4.38 0.01 -1.26 -4.90 113.70 115.63 2opu s SER 6 Ca 0.00 -1.10 0.00 0.00 1.31 0.00 0.00 55.95 56.16 2opu s SER 6 Cb 0.00 -0.23 0.00 0.00 0.21 0.00 0.00 66.02 66.00 2opu s SER 6 CO 0.00 -0.15 0.00 -1.20 0.41 0.00 0.00 173.24 172.30 2opu n SER 7 N -0.57 -2.32 0.00 2.44 7.64 -0.62 -4.87 113.62 115.32 2opu n SER 7 Ca -0.06 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.82 2opu n SER 7 Cb 0.62 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.82 2opu n SER 7 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2opu n GLN 8 N -0.40 0.00 0.00 1.43 1.13 -0.67 -2.78 117.38 116.10 2opu n GLN 8 Ca 0.00 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.06 2opu n GLN 8 Cb 0.00 0.00 0.00 0.00 0.11 0.00 0.00 30.24 30.35 2opu n GLN 8 CO 0.00 0.00 0.00 1.28 -1.44 0.00 0.00 177.06 176.90 2opu n LEU 9 N -1.09 0.00 0.00 1.08 4.77 0.25 -4.85 117.00 117.16 2opu n LEU 9 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.98 2opu n LEU 9 Cb 0.00 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.09 2opu n LEU 9 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 176.67 2opu n GLY 10 N 0.00 3.47 0.00 -0.72 0.00 -1.24 -0.33 105.19 106.37 2opu n GLY 10 Ca 0.00 -0.41 0.12 0.00 0.00 0.00 0.00 46.02 45.74 2opu n GLY 10 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2opu n PRO 11 N 0.00 0.26 -3.15 1.61 -0.02 -1.26 -4.50 135.00 127.94 2opu n PRO 11 Ca 0.00 0.05 -0.42 0.00 -2.02 0.00 0.00 63.50 61.11 2opu n PRO 11 Cb 0.00 -1.50 -0.07 0.00 -0.02 0.00 0.00 33.50 31.91 2opu n PRO 11 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 2opu s ILE 12 N -2.69 4.92 -0.89 4.25 1.01 -1.26 -4.98 121.20 121.55 2opu s ILE 12 Ca 0.21 0.38 0.27 0.00 0.00 0.00 0.00 60.65 61.51 2opu s ILE 12 Cb 0.17 -4.07 0.20 0.00 0.01 0.00 0.00 42.46 38.77 2opu s ILE 12 CO 0.40 -0.36 1.76 1.41 0.00 0.00 0.00 174.94 178.16 2opu n HIS 13 N 6.00 0.30 -1.17 3.97 8.25 -1.26 -1.78 115.22 129.53 2opu n HIS 13 Ca -0.02 0.09 -0.46 0.00 -0.26 0.00 0.00 57.72 57.07 2opu n HIS 13 Cb 0.48 -0.60 -0.06 0.00 1.12 0.00 0.00 29.99 30.93 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 -1.76 0.00 -1.25 -0.41 -0.02 -1.26 -4.70 135.00 125.60 2opu n PRO 14 Ca 0.06 0.00 -0.48 0.00 -2.02 0.00 0.00 63.50 61.06 2opu n PRO 14 Cb 0.37 -1.13 -0.06 0.00 -0.02 0.00 0.00 33.50 32.67 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 1.53 0.00 -0.16 0.52 -0.02 -1.26 -3.34 135.00 132.28 2opu n PRO 15 Ca 0.17 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.65 2opu n PRO 15 Cb 0.04 -1.17 0.00 0.00 -0.02 0.00 0.00 33.50 32.35 2opu n PRO 15 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 2opu n PRO 16 N 1.17 0.00 -0.00 0.52 -0.01 -1.26 -4.47 135.00 130.95 2opu n PRO 16 Ca 0.17 0.00 0.00 0.00 -0.01 0.00 0.00 63.50 63.66 2opu n PRO 16 Cb 0.10 -0.26 0.00 0.00 -0.01 0.00 0.00 33.50 33.34 2opu n PRO 16 CO 0.00 0.00 0.00 2.89 -0.01 0.00 0.00 175.50 178.38 2opu n ARG 17 N 0.71 2.62 0.00 -0.52 1.85 -1.21 -0.28 116.66 119.83 2opu n ARG 17 Ca 0.00 -1.42 0.00 0.00 -1.00 0.00 0.00 57.85 55.43 2opu n ARG 17 Cb 0.01 -0.96 0.00 0.00 -1.05 0.00 0.00 32.46 30.46 2opu n ARG 17 CO 0.00 0.00 0.00 -2.37 -0.01 0.00 0.00 177.63 175.25 2opu n THR 18 N -0.47 0.00 0.16 8.89 5.66 -1.26 -4.89 114.28 122.36 2opu n THR 18 Ca 0.00 0.00 0.05 0.00 -3.05 0.00 0.00 64.05 61.05 2opu n THR 18 Cb 0.29 0.00 0.07 0.00 -1.55 0.00 0.00 70.33 69.14 2opu n THR 18 CO 0.00 0.00 0.00 -1.28 -3.05 0.00 0.00 175.07 170.74 2opu h SER 19 N 0.00 0.00 -0.49 1.09 0.87 -1.37 -3.34 113.55 110.31 2opu h SER 19 Ca 0.00 0.00 -0.30 0.00 -1.23 0.00 0.00 61.79 60.26 2opu h SER 19 Cb 0.00 0.00 -0.20 0.00 -0.44 0.00 0.00 62.40 61.76 2opu h SER 19 CO 0.00 0.40 -0.64 1.15 -0.53 0.00 0.00 176.83 177.21 2opu n MET 20 N -3.21 0.76 -2.60 2.24 0.00 -1.20 -3.74 117.12 109.37 2opu n MET 20 Ca 0.02 -2.09 -0.43 0.00 0.00 0.00 0.00 57.70 55.21 2opu n MET 20 Cb 0.68 -1.41 -0.02 0.00 0.00 0.00 0.00 33.22 32.47 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 0.26 4.59 -0.29 3.17 2.01 0.56 -4.80 115.64 121.14 2opu s THR 21 Ca 0.33 1.91 -0.10 0.00 0.31 0.00 0.00 61.69 64.14 2opu s THR 21 Cb 0.21 -4.23 -0.03 0.00 0.01 0.00 0.00 72.50 68.46 2opu s THR 21 CO -0.21 -0.15 0.16 -0.70 -0.69 0.00 0.00 174.62 173.02 2opu s GLU 22 N 3.12 3.68 -0.50 4.92 2.56 -0.63 -0.58 118.70 131.27 2opu s GLU 22 Ca 0.47 -0.49 -0.19 0.00 0.00 0.00 0.00 54.97 54.76 2opu s GLU 22 Cb -0.17 -3.57 0.06 0.00 2.00 0.00 0.00 34.13 32.45 2opu s GLU 22 CO 0.10 -0.27 0.62 -2.00 -0.56 0.00 0.00 175.26 173.15 2opu s GLU 23 N 1.68 3.13 -0.35 4.30 2.56 -1.12 -0.25 118.70 128.66 2opu s GLU 23 Ca 0.06 -0.85 -0.19 0.00 0.00 0.00 0.00 54.97 53.99 2opu s GLU 23 Cb -0.16 -4.09 -0.00 0.00 2.00 0.00 0.00 34.13 31.88 2opu s GLU 23 CO 0.08 -1.20 0.57 0.71 -0.56 0.00 0.00 175.26 174.86 2opu s TYR 24 N 2.64 3.17 -0.76 5.30 2.02 0.63 -1.59 117.35 128.77 2opu s TYR 24 Ca 0.16 0.28 -0.26 0.00 -0.37 0.00 0.00 57.07 56.88 2opu s TYR 24 Cb -0.19 -3.01 0.04 0.00 -0.40 0.00 0.00 41.96 38.40 2opu s TYR 24 CO 0.12 -0.57 1.24 1.03 -1.57 0.00 0.00 175.55 175.81 2opu s ARG 25 N 2.53 3.23 -0.28 -0.62 0.52 -1.26 -1.09 118.95 121.99 2opu s ARG 25 Ca 0.21 -0.46 -0.07 0.00 -0.52 0.00 0.00 55.73 54.90 2opu s ARG 25 Cb -0.15 -4.32 -0.00 0.00 0.52 0.00 0.00 34.95 30.99 2opu s ARG 25 CO 0.14 -2.10 0.07 0.54 0.02 0.00 0.00 175.30 173.97 2opu s VAL 26 N 5.33 4.00 0.28 3.52 0.11 -0.20 -4.93 120.40 128.51 2opu s VAL 26 Ca 0.34 -0.54 -0.29 0.00 -2.93 0.00 0.00 61.98 58.57 2opu s VAL 26 Cb -0.09 -2.99 -0.14 0.00 -1.53 0.00 0.00 36.38 31.64 2opu s VAL 26 CO 0.11 0.18 1.08 -2.65 -3.33 0.00 0.00 175.10 170.49 2opu n PRO 27 N 4.88 1.45 -0.18 1.54 -0.02 -1.26 -0.38 135.00 141.01 2opu n PRO 27 Ca -0.15 0.51 -0.01 0.00 -2.02 0.00 0.00 63.50 61.83 2opu n PRO 27 Cb 0.49 -1.93 0.08 0.00 -0.02 0.00 0.00 33.50 32.12 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 2.32 -0.27 0.34 2.55 1.82 -1.90 0.50 116.42 121.78 2opu h ASP 28 Ca -0.41 0.14 -0.05 0.00 -0.39 0.00 0.00 57.03 56.32 2opu h ASP 28 Cb 1.33 0.25 -0.01 0.00 0.68 0.00 0.00 39.33 41.59 2opu h ASP 28 CO 0.63 -0.10 -0.24 1.23 -1.61 0.00 0.00 179.24 179.14 2opu h GLY 29 N 0.11 0.00 2.00 -0.78 0.00 -2.01 -0.47 103.07 101.92 2opu h GLY 29 Ca 0.29 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.62 2opu h GLY 29 CO -0.48 0.00 0.00 1.03 0.00 0.00 0.00 176.54 177.09 2opu n MET 30 N -4.01 0.01 0.06 4.80 2.81 0.16 -2.28 117.12 118.67 2opu n MET 30 Ca -0.02 0.04 -0.21 0.00 -1.81 0.00 0.00 57.70 55.71 2opu n MET 30 Cb 0.32 -1.52 -0.12 0.00 -0.71 0.00 0.00 33.22 31.19 2opu n MET 30 CO 0.00 0.00 0.00 0.28 1.51 0.00 0.00 175.97 177.76 2opu h VAL 31 N 0.00 1.33 0.00 2.03 2.07 0.52 0.22 116.25 122.43 2opu h VAL 31 Ca 0.00 -2.33 -0.00 0.00 0.82 0.00 0.00 66.70 65.19 2opu h VAL 31 Cb 0.48 2.64 -0.00 0.00 -1.52 0.00 0.00 31.29 32.89 2opu h VAL 31 CO 0.00 0.70 -0.00 1.23 0.02 0.00 0.00 177.57 179.52 2opu h GLY 32 N 0.18 0.00 1.10 2.17 0.00 -1.24 -1.98 103.07 103.29 2opu h GLY 32 Ca -0.15 0.00 -0.17 0.00 0.00 0.00 0.00 47.33 47.01 2opu h GLY 32 CO 0.20 0.00 -1.35 1.41 0.00 0.00 0.00 176.54 176.80 2opu h LEU 33 N 0.00 0.00 -0.85 3.11 3.38 -1.33 -3.15 115.31 116.47 2opu h LEU 33 Ca -0.00 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 57.87 2opu h LEU 33 Cb 0.01 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.74 2opu h LEU 33 CO 0.00 0.61 -0.47 -0.29 0.09 0.00 0.00 178.44 178.39 2opu h ILE 34 N 0.00 1.08 0.00 1.22 6.09 0.16 -1.06 117.51 125.00 2opu h ILE 34 Ca -0.16 -1.76 0.00 0.00 -1.37 0.00 0.00 64.86 61.58 2opu h ILE 34 Cb 1.60 2.02 0.00 0.00 0.47 0.00 0.00 36.82 40.91 2opu h ILE 34 CO 0.05 0.46 -0.32 2.30 -3.07 0.00 0.00 178.15 177.57 2opu n ILE 35 N -3.62 0.48 0.00 2.19 -5.35 -0.87 -4.05 119.36 108.14 2opu n ILE 35 Ca -0.00 -0.28 0.00 0.00 -0.27 0.00 0.00 62.75 62.19 2opu n ILE 35 Cb 0.55 -0.35 0.00 0.00 -1.74 0.00 0.00 39.64 38.10 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 1.32 0.47 0.02 3.28 0.00 -0.41 -2.28 105.19 107.59 2opu n GLY 36 Ca 0.04 0.60 0.00 0.00 0.00 0.00 0.00 46.02 46.67 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 0.75 0.00 1.61 0.00 -1.26 -4.72 116.66 113.04 2opu n ARG 37 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.85 2opu n ARG 37 Cb 0.00 -1.02 0.00 0.00 -0.00 0.00 0.00 32.46 31.44 2opu n ARG 37 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 2opu n GLY 38 N 0.25 0.97 0.00 2.89 0.00 -1.12 -4.71 105.19 103.46 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 -1.34 2.30 0.38 -0.02 0.00 -0.97 -5.01 105.19 100.54 2opu n GLY 39 Ca 0.00 -0.24 0.21 0.00 0.00 0.00 0.00 46.02 45.99 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 0.44 -0.41 1.61 4.81 -1.85 -2.82 114.58 116.37 2opu h GLU 40 Ca 0.00 -0.03 -0.01 0.00 -0.13 0.00 0.00 59.36 59.20 2opu h GLU 40 Cb 0.00 -0.10 -0.02 0.00 0.63 0.00 0.00 28.75 29.26 2opu h GLU 40 CO 0.00 0.29 0.23 0.37 -0.73 0.00 0.00 179.01 179.18 2opu h GLN 41 N 0.46 0.57 -0.06 1.92 4.15 -1.82 -0.49 115.11 119.83 2opu h GLN 41 Ca 0.64 -0.06 0.01 0.00 0.77 0.00 0.00 58.65 60.00 2opu h GLN 41 Cb 1.44 -0.11 -0.01 0.00 0.21 0.00 0.00 27.48 29.01 2opu h GLN 41 CO -0.40 0.44 0.01 0.97 -1.93 0.00 0.00 178.83 177.93 2opu h ILE 42 N 0.53 0.98 -0.61 2.39 6.09 -1.64 -0.41 117.51 124.85 2opu h ILE 42 Ca 0.15 -0.01 -0.02 0.00 -1.37 0.00 0.00 64.86 63.60 2opu h ILE 42 Cb 0.03 0.93 -0.03 0.00 0.47 0.00 0.00 36.82 38.23 2opu h ILE 42 CO -0.02 0.01 0.31 0.78 -3.07 0.00 0.00 178.15 176.15 2opu h ASN 43 N 0.04 0.78 -0.94 2.19 2.35 -1.61 0.19 115.58 118.59 2opu h ASN 43 Ca 0.03 -0.12 0.04 0.00 -0.55 0.00 0.00 56.30 55.69 2opu h ASN 43 Cb 0.02 -0.20 -0.05 0.00 0.05 0.00 0.00 38.32 38.13 2opu h ASN 43 CO -0.03 0.68 0.62 0.50 -1.65 0.00 0.00 177.43 177.54 2opu h LYS 44 N 0.83 1.15 0.18 0.81 3.64 -0.73 0.14 116.57 122.60 2opu h LYS 44 Ca 0.21 -0.07 -0.27 0.00 -1.27 0.00 0.00 60.65 59.26 2opu h LYS 44 Cb 0.09 -0.26 0.02 0.00 -0.41 0.00 0.00 32.23 31.68 2opu h LYS 44 CO -0.03 0.76 -1.21 0.82 -2.27 0.00 0.00 179.45 177.53 2opu h ILE 45 N 1.19 1.32 0.00 2.00 5.03 -0.43 -1.91 117.51 124.70 2opu h ILE 45 Ca 0.37 -2.57 -0.10 0.00 -0.12 0.00 0.00 64.86 62.44 2opu h ILE 45 Cb 0.01 3.05 -0.01 0.00 -3.03 0.00 0.00 36.82 36.83 2opu h ILE 45 CO -0.11 0.76 -0.46 0.06 -0.68 0.00 0.00 178.15 177.72 2opu h GLN 46 N -0.14 0.00 -0.10 2.37 -0.00 -0.54 -0.55 115.11 116.15 2opu h GLN 46 Ca -0.22 0.00 -0.20 0.00 -0.00 0.00 0.00 58.65 58.23 2opu h GLN 46 Cb 1.88 0.00 0.01 0.00 -0.00 0.00 0.00 27.48 29.37 2opu h GLN 46 CO 0.19 0.46 -0.72 0.37 -0.00 0.00 0.00 178.83 179.13 2opu h GLN 47 N 0.00 0.67 0.05 0.06 -0.00 -0.81 -0.59 115.11 114.49 2opu h GLN 47 Ca -0.00 -0.58 0.01 0.00 -0.00 0.00 0.00 58.65 58.07 2opu h GLN 47 Cb 1.03 0.13 -0.01 0.00 0.00 0.00 0.00 27.48 28.63 2opu h GLN 47 CO 0.06 1.19 -0.09 0.22 0.00 0.00 0.00 178.83 180.21 2opu h ASP 48 N 0.34 -0.24 0.13 -0.69 3.58 -1.05 -3.15 116.42 115.32 2opu h ASP 48 Ca -0.06 0.03 -0.22 0.00 0.42 0.00 0.00 57.03 57.20 2opu h ASP 48 Cb 1.36 0.09 0.01 0.00 1.72 0.00 0.00 39.33 42.51 2opu h ASP 48 CO 0.15 -0.13 -0.84 0.77 -2.88 0.00 0.00 179.24 176.30 2opu h SER 49 N -0.18 0.69 0.00 2.28 4.64 -1.18 -3.47 113.55 116.33 2opu h SER 49 Ca 0.02 -0.49 0.00 0.00 -0.47 0.00 0.00 61.79 60.85 2opu h SER 49 Cb 0.19 -0.21 0.00 0.00 -0.31 0.00 0.00 62.40 62.08 2opu h SER 49 CO -0.05 1.27 0.00 0.61 -0.87 0.00 0.00 176.83 177.79 2opu n GLY 50 N 0.77 0.67 3.75 -0.77 0.00 -0.25 -4.32 105.19 105.04 2opu n GLY 50 Ca -0.07 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.55 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 1.48 3.21 -2.70 0.00 5.02 0.11 -4.67 118.16 120.60 2opu n LYS 52 Ca -0.02 -3.24 -0.43 0.00 -2.02 0.00 0.00 58.31 52.60 2opu n LYS 52 Cb 0.47 -3.26 -0.03 0.00 -0.02 0.00 0.00 35.03 32.19 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 2.78 4.35 -0.44 -0.18 1.01 -1.26 -3.73 120.40 122.93 2opu s VAL 53 Ca 0.47 1.08 -0.13 0.00 0.00 0.00 0.00 61.98 63.40 2opu s VAL 53 Cb 0.06 -4.51 0.06 0.00 0.00 0.00 0.00 36.38 31.99 2opu s VAL 53 CO 0.00 -0.88 0.32 -1.10 0.00 0.00 0.00 175.10 173.45 2opu s GLN 54 N 4.07 2.86 -0.58 2.72 -1.52 -0.44 -4.95 119.66 121.82 2opu s GLN 54 Ca 0.43 -1.30 -0.28 0.00 -1.95 0.00 0.00 55.36 52.27 2opu s GLN 54 Cb -0.09 -3.96 0.03 0.00 -0.22 0.00 0.00 33.01 28.77 2opu s GLN 54 CO 0.28 -0.93 1.15 0.42 -0.25 0.00 0.00 175.29 175.96 2opu s ILE 55 N 1.58 4.07 -0.45 1.08 -1.09 -1.26 -0.95 121.20 124.18 2opu s ILE 55 Ca 0.04 0.80 -0.16 0.00 -2.23 0.00 0.00 60.65 59.10 2opu s ILE 55 Cb -0.23 -4.70 0.05 0.00 -1.58 0.00 0.00 42.46 36.00 2opu s ILE 55 CO 0.06 -1.31 0.39 -0.44 -1.23 0.00 0.00 174.94 172.41 2opu s SER 56 N 2.94 6.15 0.30 3.58 0.01 -0.33 -4.94 113.70 121.40 2opu s SER 56 Ca 0.41 -1.05 -0.01 0.00 1.31 0.00 0.00 55.95 56.61 2opu s SER 56 Cb -0.08 -2.19 0.45 0.00 0.21 0.00 0.00 66.02 64.41 2opu s SER 56 CO 0.24 -0.60 1.89 1.55 0.41 0.00 0.00 173.24 176.74 2opu h PRO 57 N 8.73 0.90 -4.11 12.44 0.13 -1.94 -2.94 132.00 145.21 2opu h PRO 57 Ca -0.28 -0.12 -0.76 0.00 -0.87 0.00 0.00 66.00 63.97 2opu h PRO 57 Cb 1.11 -0.17 -0.24 0.00 0.13 0.00 0.00 31.00 31.84 2opu h PRO 57 CO 0.83 0.71 -0.07 0.34 -0.23 0.00 0.00 178.00 179.57 2opu s ASP 58 N -6.49 6.35 0.17 1.44 2.15 -1.26 -4.83 116.67 114.21 2opu s ASP 58 Ca -0.10 -1.99 -0.06 0.00 0.43 0.00 0.00 52.55 50.83 2opu s ASP 58 Cb 0.16 -2.23 0.06 0.00 -0.30 0.00 0.00 42.92 40.62 2opu s ASP 58 CO 0.79 -0.82 1.49 0.77 -0.17 0.00 0.00 175.17 177.23 2opu h SER 59 N 8.63 0.74 0.00 -0.34 4.64 -1.79 -3.47 113.55 121.96 2opu h SER 59 Ca -0.18 -0.38 0.00 0.00 -0.47 0.00 0.00 61.79 60.76 2opu h SER 59 Cb 1.08 -0.21 0.00 0.00 -0.31 0.00 0.00 62.40 62.96 2opu h SER 59 CO 0.97 1.12 0.00 0.61 -0.87 0.00 0.00 176.83 178.66 2opu n GLY 60 N 0.23 2.19 0.03 -0.77 0.00 -1.26 -4.13 105.19 101.49 2opu n GLY 60 Ca -0.03 -0.15 0.13 0.00 0.00 0.00 0.00 46.02 45.97 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 -1.20 3.54 -0.02 0.00 -1.26 -4.88 105.19 101.37 2opu n GLY 61 Ca 0.00 -0.31 -0.28 0.00 0.00 0.00 0.00 46.02 45.43 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 -2.92 2.86 0.12 0.99 1.43 -1.26 -5.00 118.68 114.89 2opu s LEU 62 Ca 0.14 -0.60 0.04 0.00 -1.03 0.00 0.00 54.13 52.68 2opu s LEU 62 Cb 0.18 -1.59 -0.20 0.00 0.03 0.00 0.00 46.19 44.61 2opu s LEU 62 CO 0.64 0.13 1.26 1.55 0.23 0.00 0.00 176.35 180.16 2opu h PRO 63 N 3.16 0.07 0.00 1.29 0.13 -1.97 -3.43 132.00 131.26 2opu h PRO 63 Ca -0.47 -0.12 0.00 0.00 -0.87 0.00 0.00 66.00 64.54 2opu h PRO 63 Cb 1.19 0.04 0.00 0.00 0.13 0.00 0.00 31.00 32.37 2opu h PRO 63 CO 0.52 1.04 0.00 -0.85 -0.23 0.00 0.00 178.00 178.48 2opu n GLU 64 N -3.42 2.15 -2.80 0.86 0.00 -1.26 -4.89 120.64 111.28 2opu n GLU 64 Ca -0.02 0.00 -0.33 0.00 0.00 0.00 0.00 57.16 56.81 2opu n GLU 64 Cb 0.95 0.00 -0.06 0.00 0.00 0.00 0.00 31.44 32.33 2opu n GLU 64 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.13 177.63 2opu s ARG 65 N 1.41 4.11 -0.24 3.44 6.06 0.48 -4.48 118.95 129.74 2opu s ARG 65 Ca 0.00 0.98 0.01 0.00 -2.50 0.00 0.00 55.73 54.21 2opu s ARG 65 Cb 0.00 -2.23 0.04 0.00 0.06 0.00 0.00 34.95 32.82 2opu s ARG 65 CO 0.00 -0.04 -0.11 -1.54 -2.50 0.00 0.00 175.30 171.11 2opu s SER 66 N -2.41 4.10 -0.23 -2.12 1.04 -1.11 -1.03 113.70 111.94 2opu s SER 66 Ca 0.59 -1.03 -0.07 0.00 0.48 0.00 0.00 55.95 55.93 2opu s SER 66 Cb -0.09 -1.58 -0.03 0.00 0.10 0.00 0.00 66.02 64.42 2opu s SER 66 CO 0.18 -0.13 0.06 -0.69 0.98 0.00 0.00 173.24 173.64 2opu s VAL 67 N 1.23 4.35 -0.16 5.02 1.01 -0.25 -1.19 120.40 130.42 2opu s VAL 67 Ca -0.02 -0.17 -0.21 0.00 0.00 0.00 0.00 61.98 61.58 2opu s VAL 67 Cb -0.17 -3.01 -0.03 0.00 0.00 0.00 0.00 36.38 33.17 2opu s VAL 67 CO -0.07 0.37 0.63 -0.44 0.00 0.00 0.00 175.10 175.60 2opu s SER 68 N 1.29 6.75 -0.38 3.32 0.01 -0.13 -0.27 113.70 124.30 2opu s SER 68 Ca 0.05 0.91 -0.10 0.00 1.31 0.00 0.00 55.95 58.11 2opu s SER 68 Cb -0.15 -2.36 0.03 0.00 0.21 0.00 0.00 66.02 63.76 2opu s SER 68 CO 0.03 -0.21 0.20 -0.76 0.41 0.00 0.00 173.24 172.91 2opu s LEU 69 N 1.54 4.74 -0.09 2.44 2.01 0.65 -1.33 118.68 128.64 2opu s LEU 69 Ca 0.30 -1.06 -0.16 0.00 0.01 0.00 0.00 54.13 53.23 2opu s LEU 69 Cb -0.16 -2.01 0.04 0.00 0.01 0.00 0.00 46.19 44.07 2opu s LEU 69 CO 0.12 -0.40 0.39 -0.89 1.01 0.00 0.00 176.35 176.58 2opu s THR 70 N 1.53 0.02 0.00 5.49 2.01 -1.24 -1.60 115.64 121.84 2opu s THR 70 Ca 0.02 -0.19 0.00 0.00 0.31 0.00 0.00 61.69 61.83 2opu s THR 70 Cb -0.20 -0.62 0.00 0.00 0.01 0.00 0.00 72.50 71.69 2opu s THR 70 CO 0.06 -0.10 0.00 0.61 -0.69 0.00 0.00 174.62 174.50 2opu n GLY 71 N 2.08 -1.01 3.30 4.40 0.00 0.62 0.04 105.19 114.62 2opu n GLY 71 Ca -0.17 0.60 -0.16 0.00 0.00 0.00 0.00 46.02 46.29 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 1.68 0.21 4.61 0.00 -1.25 -3.68 121.76 122.33 2opu s ALA 72 Ca 0.00 -1.69 -0.14 0.00 0.00 0.00 0.00 51.96 50.14 2opu s ALA 72 Cb 0.00 0.39 0.23 0.00 0.00 0.00 0.00 23.12 23.75 2opu s ALA 72 CO 0.00 -0.22 1.63 -1.00 0.00 0.00 0.00 175.76 176.17 2opu h PRO 73 N 2.56 -0.00 0.00 0.00 0.13 -1.87 0.55 132.00 133.39 2opu h PRO 73 Ca -0.38 0.00 -0.25 0.00 -0.87 0.00 0.00 66.00 64.50 2opu h PRO 73 Cb 1.21 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.31 2opu h PRO 73 CO 0.64 -0.00 -1.32 1.49 -0.23 0.00 0.00 178.00 178.58 2opu h GLU 74 N -0.00 0.01 -0.05 0.86 4.81 -1.97 -3.21 114.58 115.03 2opu h GLU 74 Ca 0.30 -0.02 -0.03 0.00 -0.13 0.00 0.00 59.36 59.48 2opu h GLU 74 Cb 0.46 0.01 0.00 0.00 0.63 0.00 0.00 28.75 29.85 2opu h GLU 74 CO -0.65 0.79 -0.10 0.77 -0.73 0.00 0.00 179.01 179.09 2opu h SER 75 N 0.00 0.17 0.77 1.04 0.02 -1.46 -2.37 113.55 111.73 2opu h SER 75 Ca -0.14 -0.57 -0.04 0.00 -0.84 0.00 0.00 61.79 60.20 2opu h SER 75 Cb 1.88 -0.05 -0.01 0.00 0.14 0.00 0.00 62.40 64.37 2opu h SER 75 CO 0.11 0.71 -0.19 1.62 -1.14 0.00 0.00 176.83 177.95 2opu h VAL 76 N -0.36 0.52 0.05 2.27 3.04 -0.09 -1.56 116.25 120.12 2opu h VAL 76 Ca 0.00 -0.93 -0.00 0.00 -1.01 0.00 0.00 66.70 64.76 2opu h VAL 76 Cb 0.69 1.63 0.00 0.00 -2.01 0.00 0.00 31.29 31.60 2opu h VAL 76 CO 0.02 0.18 -0.03 -0.61 -1.01 0.00 0.00 177.57 176.13 2opu h GLN 77 N 0.00 -0.07 -0.75 4.17 4.15 -1.53 -1.05 115.11 120.03 2opu h GLN 77 Ca -0.00 0.00 -0.03 0.00 0.77 0.00 0.00 58.65 59.39 2opu h GLN 77 Cb 0.62 0.02 -0.03 0.00 0.21 0.00 0.00 27.48 28.29 2opu h GLN 77 CO 0.02 0.39 0.34 -0.22 -1.93 0.00 0.00 178.83 177.43 2opu h LYS 78 N -0.56 1.09 -0.33 1.69 1.63 -1.20 0.18 116.57 119.08 2opu h LYS 78 Ca -0.01 -0.18 -0.01 0.00 -0.85 0.00 0.00 60.65 59.61 2opu h LYS 78 Cb 0.49 -0.19 -0.02 0.00 -0.60 0.00 0.00 32.23 31.92 2opu h LYS 78 CO 0.01 0.87 0.17 0.00 -3.45 0.00 0.00 179.45 177.05 2opu h ALA 79 N 1.17 0.43 0.00 5.00 0.00 -1.31 -2.58 119.26 121.97 2opu h ALA 79 Ca 0.25 -0.09 -0.02 0.00 0.00 0.00 0.00 54.91 55.06 2opu h ALA 79 Cb 0.15 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 17.81 2opu h ALA 79 CO -0.03 -0.03 -0.10 0.87 0.00 0.00 0.00 179.25 179.96 2opu h LYS 80 N 0.41 0.00 -0.36 0.00 1.57 -0.88 -2.17 116.57 115.14 2opu h LYS 80 Ca 0.12 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.90 2opu h LYS 80 Cb 0.09 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.38 2opu h LYS 80 CO -0.02 0.10 0.23 1.98 -0.57 0.00 0.00 179.45 181.17 2opu h MET 81 N 0.00 0.47 -0.30 3.15 1.85 -0.25 0.35 114.93 120.20 2opu h MET 81 Ca -0.00 -0.03 -0.18 0.00 -0.61 0.00 0.00 59.70 58.88 2opu h MET 81 Cb 0.82 -0.10 -0.00 0.00 0.43 0.00 0.00 31.60 32.75 2opu h MET 81 CO 0.01 0.32 -0.52 0.52 -0.40 0.00 0.00 176.91 176.85 2opu h MET 82 N 0.48 0.87 -0.10 0.39 2.86 -1.20 -1.16 114.93 117.06 2opu h MET 82 Ca 0.13 -0.54 -0.00 0.00 -2.06 0.00 0.00 59.70 57.23 2opu h MET 82 Cb -0.04 0.06 -0.00 0.00 0.06 0.00 0.00 31.60 31.67 2opu h MET 82 CO -0.03 1.17 0.06 -0.07 1.06 0.00 0.00 176.91 179.10 2opu h LEU 83 N 0.67 0.12 -0.41 1.22 -0.00 -1.28 -2.52 115.31 113.11 2opu h LEU 83 Ca 0.02 -0.07 0.04 0.00 -0.00 0.00 0.00 57.88 57.87 2opu h LEU 83 Cb 1.12 -0.03 -0.04 0.00 -0.00 0.00 0.00 40.66 41.72 2opu h LEU 83 CO 0.12 0.16 0.19 -0.78 -0.00 0.00 0.00 178.44 178.13 2opu h ASP 84 N 0.08 0.26 -0.37 -0.43 3.58 -0.28 0.19 116.42 119.45 2opu h ASP 84 Ca 0.04 0.03 0.06 0.00 0.42 0.00 0.00 57.03 57.57 2opu h ASP 84 Cb 0.06 -0.02 -0.08 0.00 1.72 0.00 0.00 39.33 41.01 2opu h ASP 84 CO -0.01 0.19 -0.48 -0.78 -2.88 0.00 0.00 179.24 175.29 2opu h ASP 85 N 0.39 -1.60 0.13 2.28 1.82 -0.95 0.17 116.42 118.66 2opu h ASP 85 Ca 0.18 0.22 -0.18 0.00 -0.39 0.00 0.00 57.03 56.86 2opu h ASP 85 Cb 0.11 0.67 0.02 0.00 0.68 0.00 0.00 39.33 40.81 2opu h ASP 85 CO -0.14 -0.40 -0.78 0.40 -1.61 0.00 0.00 179.24 176.71 2opu h ILE 86 N -0.38 1.51 0.00 2.25 5.03 -1.27 -2.70 117.51 121.95 2opu h ILE 86 Ca 0.11 -2.49 -0.07 0.00 -0.12 0.00 0.00 64.86 62.29 2opu h ILE 86 Cb 0.60 3.15 -0.01 0.00 -3.03 0.00 0.00 36.82 37.53 2opu h ILE 86 CO -0.56 0.71 -0.33 0.58 -0.68 0.00 0.00 178.15 177.87 2opu h VAL 87 N -0.35 0.98 0.11 1.67 2.07 -0.55 0.17 116.25 120.35 2opu h VAL 87 Ca -0.13 -1.22 -0.29 0.00 0.82 0.00 0.00 66.70 65.87 2opu h VAL 87 Cb 1.60 1.71 0.02 0.00 -1.52 0.00 0.00 31.29 33.11 2opu h VAL 87 CO 0.15 0.32 -1.21 -1.28 0.02 0.00 0.00 177.57 175.56 2opu h SER 88 N 0.00 0.76 1.14 0.57 0.87 -0.75 -1.76 113.55 114.39 2opu h SER 88 Ca -0.00 -0.71 -0.02 0.00 -1.23 0.00 0.00 61.79 59.83 2opu h SER 88 Cb 0.68 -0.24 -0.00 0.00 -0.44 0.00 0.00 62.40 62.40 2opu h SER 88 CO 0.04 1.52 -0.08 0.08 -0.53 0.00 0.00 176.83 177.86 2opu h ARG 89 N 0.24 0.00 0.00 2.24 0.11 -1.07 -3.15 114.38 112.75 2opu h ARG 89 Ca -0.17 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.91 2opu h ARG 89 Cb 1.89 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.97 2opu h ARG 89 CO 0.22 0.08 0.00 0.41 0.10 0.00 0.00 179.97 180.79 2opu n GLY 90 N 0.25 1.01 2.52 0.08 0.00 0.55 -4.65 105.19 104.94 2opu n GLY 90 Ca 0.01 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.63 2opu n GLY 90 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 2opu n ARG 91 N -0.60 4.59 -2.80 1.61 1.85 -0.67 -4.94 116.66 115.71 2opu n ARG 91 Ca 0.00 -3.55 -0.42 0.00 -1.00 0.00 0.00 57.85 52.88 2opu n ARG 91 Cb 0.00 -2.64 -0.03 0.00 -1.05 0.00 0.00 32.46 28.74 2opu n ARG 91 CO 0.00 0.00 0.00 0.20 -0.01 0.00 0.00 177.63 177.82 2opu s GLY 92 N 0.28 1.78 0.00 2.89 0.00 -1.19 -4.84 107.32 106.24 2opu s GLY 92 Ca 0.52 0.01 0.00 0.00 0.00 0.00 0.00 44.72 45.25 2opu s GLY 92 CO -0.09 1.94 0.00 0.61 0.00 0.00 0.00 173.10 175.56