#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2pn0 n PRO 5 N 0.00 1.40 -3.56 1.64 -0.02 -1.26 -5.01 135.00 128.19 2pn0 n PRO 5 Ca 0.00 0.53 -0.32 0.00 -2.02 0.00 0.00 63.50 61.69 2pn0 n PRO 5 Cb 0.00 -2.55 -0.05 0.00 -0.02 0.00 0.00 33.50 30.88 2pn0 n PRO 5 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 2pn0 s LYS 6 N -3.13 3.70 0.00 -0.52 1.02 -1.26 -5.11 119.74 114.44 2pn0 s LYS 6 Ca 0.77 0.08 0.00 0.00 0.02 0.00 0.00 55.97 56.84 2pn0 s LYS 6 Cb -0.40 -2.77 0.00 0.00 -0.52 0.00 0.00 37.83 34.14 2pn0 s LYS 6 CO 0.45 0.41 0.00 0.44 -0.92 0.00 0.00 175.35 175.73 2pn0 n ILE 7 N 0.03 0.00 0.00 2.17 -5.35 -1.26 -4.83 119.36 110.12 2pn0 n ILE 7 Ca -0.01 0.00 0.00 0.00 -0.27 0.00 0.00 62.75 62.47 2pn0 n ILE 7 Cb 0.52 0.00 0.00 0.00 -1.74 0.00 0.00 39.64 38.42 2pn0 n ILE 7 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2pn0 n ILE 9 N 0.00 0.00 -1.52 7.28 3.06 -0.54 -0.35 119.36 127.29 2pn0 n ILE 9 Ca 0.00 0.00 -0.31 0.00 -2.50 0.00 0.00 62.75 59.94 2pn0 n ILE 9 Cb 0.00 0.00 0.06 0.00 0.54 0.00 0.00 39.64 40.24 2pn0 n ILE 9 CO 0.00 0.00 0.00 -0.94 -2.50 0.00 0.00 176.55 173.11 2pn0 s SER 10 N 0.00 5.08 0.22 9.51 1.04 -1.26 -1.27 113.70 127.02 2pn0 s SER 10 Ca 0.00 1.74 -0.08 0.00 0.48 0.00 0.00 55.95 58.08 2pn0 s SER 10 Cb 0.00 -2.51 0.22 0.00 0.10 0.00 0.00 66.02 63.83 2pn0 s SER 10 CO 0.00 -1.64 1.88 0.28 0.98 0.00 0.00 173.24 174.73 2pn0 h SER 11 N -0.70 0.88 -0.51 7.02 0.02 -1.87 -0.66 113.55 117.72 2pn0 h SER 11 Ca -0.44 -0.01 -0.04 0.00 -0.84 0.00 0.00 61.79 60.45 2pn0 h SER 11 Cb 1.22 -0.20 -0.02 0.00 0.14 0.00 0.00 62.40 63.53 2pn0 h SER 11 CO 0.55 0.62 0.15 0.25 -1.14 0.00 0.00 176.83 177.26 2pn0 h LEU 12 N 1.04 0.75 -0.48 5.07 5.85 -1.92 -0.56 115.31 125.06 2pn0 h LEU 12 Ca 0.31 -0.21 -0.17 0.00 0.84 0.00 0.00 57.88 58.65 2pn0 h LEU 12 Cb -0.04 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 40.79 2pn0 h LEU 12 CO -0.10 0.77 -0.65 0.44 -0.34 0.00 0.00 178.44 178.56 2pn0 h ASP 13 N 0.70 0.49 -0.48 1.25 3.32 -1.88 0.12 116.42 119.95 2pn0 h ASP 13 Ca 0.16 -0.30 -0.01 0.00 0.02 0.00 0.00 57.03 56.91 2pn0 h ASP 13 Cb 0.29 -0.14 -0.02 0.00 0.22 0.00 0.00 39.33 39.67 2pn0 h ASP 13 CO -0.00 1.01 0.27 0.00 -1.72 0.00 0.00 179.24 178.80 2pn0 h ALA 14 N 0.99 0.61 0.19 3.45 0.00 -0.90 -0.07 119.26 123.53 2pn0 h ALA 14 Ca -0.02 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.81 2pn0 h ALA 14 Cb 1.21 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.81 2pn0 h ALA 14 CO 0.11 0.12 -0.09 1.49 0.00 0.00 0.00 179.25 180.88 2pn0 h GLU 15 N 0.63 -0.24 -0.63 0.00 4.81 -0.71 -0.86 114.58 117.58 2pn0 h GLU 15 Ca 0.17 0.02 0.02 0.00 -0.13 0.00 0.00 59.36 59.44 2pn0 h GLU 15 Cb 0.03 0.05 -0.04 0.00 0.63 0.00 0.00 28.75 29.42 2pn0 h GLU 15 CO -0.03 0.06 0.39 -0.09 -0.73 0.00 0.00 179.01 178.61 2pn0 h ARG 16 N -0.54 0.76 -0.51 1.92 2.43 -0.90 -1.63 114.38 115.91 2pn0 h ARG 16 Ca -0.03 -0.05 -0.07 0.00 -0.81 0.00 0.00 59.98 59.03 2pn0 h ARG 16 Cb 0.41 -0.17 -0.02 0.00 -0.42 0.00 0.00 29.97 29.77 2pn0 h ARG 16 CO 0.04 0.50 0.04 -0.07 -1.51 0.00 0.00 179.97 178.97 2pn0 h LEU 17 N 0.78 0.84 -0.87 3.80 3.38 -0.95 -1.20 115.31 121.10 2pn0 h LEU 17 Ca 0.25 -0.29 0.01 0.00 0.09 0.00 0.00 57.88 57.93 2pn0 h LEU 17 Cb -0.01 -0.23 -0.04 0.00 0.09 0.00 0.00 40.66 40.47 2pn0 h LEU 17 CO -0.09 0.92 0.57 -0.33 0.09 0.00 0.00 178.44 179.60 2pn0 h GLU 18 N 0.74 1.16 -0.22 1.13 4.39 -0.82 0.67 114.58 121.63 2pn0 h GLU 18 Ca 0.15 -0.08 -0.06 0.00 0.34 0.00 0.00 59.36 59.71 2pn0 h GLU 18 Cb 0.47 -0.26 -0.01 0.00 -0.10 0.00 0.00 28.75 28.85 2pn0 h GLU 18 CO 0.02 0.78 -0.09 0.82 -1.16 0.00 0.00 179.01 179.38 2pn0 h ILE 19 N 1.19 1.30 -0.49 3.13 2.04 -1.14 -0.79 117.51 122.74 2pn0 h ILE 19 Ca 0.32 -1.13 0.06 0.00 1.00 0.00 0.00 64.86 65.11 2pn0 h ILE 19 Cb -0.12 1.58 -0.05 0.00 -0.74 0.00 0.00 36.82 37.49 2pn0 h ILE 19 CO -0.07 0.35 0.19 0.25 0.00 0.00 0.00 178.15 178.87 2pn0 h LEU 20 N 0.16 0.22 -0.76 1.44 5.85 -0.92 -2.69 115.31 118.61 2pn0 h LEU 20 Ca 0.05 0.05 -0.12 0.00 0.84 0.00 0.00 57.88 58.70 2pn0 h LEU 20 Cb 0.57 0.02 -0.01 0.00 0.37 0.00 0.00 40.66 41.61 2pn0 h LEU 20 CO 0.03 0.16 -0.39 -0.07 -0.34 0.00 0.00 178.44 177.82 2pn0 h LEU 21 N 0.38 0.50 -1.34 2.25 3.38 -0.73 -2.89 115.31 116.86 2pn0 h LEU 21 Ca 0.23 -0.21 0.08 0.00 0.09 0.00 0.00 57.88 58.07 2pn0 h LEU 21 Cb 0.22 -0.14 -0.05 0.00 0.09 0.00 0.00 40.66 40.78 2pn0 h LEU 21 CO -0.22 0.84 0.50 -0.08 0.09 0.00 0.00 178.44 179.57 2pn0 h GLU 22 N 0.39 0.75 -0.01 1.13 4.81 -0.81 -2.92 114.58 117.93 2pn0 h GLU 22 Ca 0.04 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.22 2pn0 h GLU 22 Cb 0.86 -0.17 0.00 0.00 0.63 0.00 0.00 28.75 30.07 2pn0 h GLU 22 CO 0.07 0.50 -0.02 0.25 -0.73 0.00 0.00 179.01 179.08 2pn0 n THR 23 N -4.49 0.00 -2.95 0.32 -2.24 -1.09 -4.94 114.28 98.89 2pn0 n THR 23 Ca 0.12 -0.14 -0.34 0.00 -2.27 0.00 0.00 64.05 61.42 2pn0 n THR 23 Cb 0.26 0.10 -0.07 0.00 -2.10 0.00 0.00 70.33 68.53 2pn0 n THR 23 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 2pn0 s LEU 24 N -2.07 4.09 0.00 3.22 1.43 -1.10 -5.13 118.68 119.12 2pn0 s LEU 24 Ca 0.40 1.55 0.00 0.00 -1.03 0.00 0.00 54.13 55.05 2pn0 s LEU 24 Cb 0.21 -4.19 0.00 0.00 0.03 0.00 0.00 46.19 42.24 2pn0 s LEU 24 CO 0.37 -0.22 0.00 -1.20 0.23 0.00 0.00 176.35 175.53 2pn0 n SER 25 N -0.19 0.00 -4.55 2.29 7.64 -1.26 -5.10 113.62 112.45 2pn0 n SER 25 Ca 0.04 0.00 -0.32 0.00 1.01 0.00 0.00 58.87 59.60 2pn0 n SER 25 Cb 0.53 0.00 -0.11 0.00 -1.01 0.00 0.00 64.21 63.62 2pn0 n SER 25 CO 0.00 0.00 0.00 0.72 -3.01 0.00 0.00 175.04 172.75 2pn0 s PHE 29 N 0.00 2.78 0.32 1.43 -0.71 -1.26 -5.33 117.98 115.21 2pn0 s PHE 29 Ca 0.00 -0.11 0.06 0.00 -1.04 0.00 0.00 56.93 55.84 2pn0 s PHE 29 Cb 0.00 -1.57 0.73 0.00 -1.21 0.00 0.00 43.02 40.97 2pn0 s PHE 29 CO 0.00 0.33 1.82 -1.00 -1.34 0.00 0.00 175.22 175.03 2pn0 h PRO 30 N 4.57 0.77 -0.08 1.99 0.13 -2.01 -1.80 132.00 135.57 2pn0 h PRO 30 Ca -0.48 -0.05 0.00 0.00 -0.87 0.00 0.00 66.00 64.60 2pn0 h PRO 30 Cb 1.16 -0.17 0.00 0.00 0.13 0.00 0.00 31.00 32.12 2pn0 h PRO 30 CO 0.52 0.51 0.00 0.41 -0.23 0.00 0.00 178.00 179.21 2pn0 n GLY 31 N -1.37 -0.46 0.20 1.56 0.00 -1.26 -4.42 105.19 99.44 2pn0 n GLY 31 Ca 0.21 -0.21 -0.11 0.00 0.00 0.00 0.00 46.02 45.90 2pn0 n GLY 31 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 2pn0 h ARG 32 N 0.86 -0.25 -0.66 1.61 2.43 -1.73 0.39 114.38 117.03 2pn0 h ARG 32 Ca 0.00 0.02 -0.06 0.00 -0.81 0.00 0.00 59.98 59.12 2pn0 h ARG 32 Cb 0.19 0.06 -0.03 0.00 -0.42 0.00 0.00 29.97 29.77 2pn0 h ARG 32 CO 0.00 -0.17 0.16 -0.44 -1.51 0.00 0.00 179.97 178.01 2pn0 h ASP 33 N -0.26 0.99 -0.52 -3.80 3.32 -1.82 0.24 116.42 114.57 2pn0 h ASP 33 Ca 0.05 -0.23 -0.06 0.00 0.02 0.00 0.00 57.03 56.82 2pn0 h ASP 33 Cb 0.33 -0.26 -0.02 0.00 0.22 0.00 0.00 39.33 39.60 2pn0 h ASP 33 CO -0.16 0.97 0.11 0.44 -1.72 0.00 0.00 179.24 178.87 2pn0 h ASP 34 N 0.97 0.80 -0.17 6.45 3.32 -1.81 -0.93 116.42 125.05 2pn0 h ASP 34 Ca 0.21 -0.25 -0.01 0.00 0.02 0.00 0.00 57.03 57.00 2pn0 h ASP 34 Cb 0.36 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 39.69 2pn0 h ASP 34 CO 0.00 0.84 0.05 0.25 -1.72 0.00 0.00 179.24 178.66 2pn0 h LEU 35 N 0.73 0.24 -1.04 1.55 5.85 -0.53 -1.92 115.31 120.18 2pn0 h LEU 35 Ca 0.16 -0.20 0.14 0.00 0.84 0.00 0.00 57.88 58.82 2pn0 h LEU 35 Cb 0.37 -0.06 -0.09 0.00 0.37 0.00 0.00 40.66 41.25 2pn0 h LEU 35 CO 0.01 0.38 0.62 -0.33 -0.34 0.00 0.00 178.44 178.77 2pn0 h GLU 36 N 0.09 0.89 -0.49 1.25 5.08 -0.81 -0.63 114.58 119.95 2pn0 h GLU 36 Ca 0.05 -0.05 -0.11 0.00 -1.00 0.00 0.00 59.36 58.25 2pn0 h GLU 36 Cb 0.22 -0.20 -0.02 0.00 0.50 0.00 0.00 28.75 29.26 2pn0 h GLU 36 CO -0.00 0.59 -0.12 0.00 -1.00 0.00 0.00 179.01 178.48 2pn0 h ALA 37 N 1.57 0.68 -0.38 3.43 0.00 -0.79 0.80 119.26 124.57 2pn0 h ALA 37 Ca 0.51 -0.35 0.01 0.00 0.00 0.00 0.00 54.91 55.08 2pn0 h ALA 37 Cb 0.60 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.20 2pn0 h ALA 37 CO -0.28 0.59 0.24 0.93 0.00 0.00 0.00 179.25 180.73 2pn0 h GLU 38 N 0.80 0.48 -0.48 0.00 5.08 -0.74 -3.00 114.58 116.72 2pn0 h GLU 38 Ca 0.12 -0.03 -0.08 0.00 -1.00 0.00 0.00 59.36 58.38 2pn0 h GLU 38 Cb 0.68 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.80 2pn0 h GLU 38 CO 0.05 0.32 -0.02 -0.07 -1.00 0.00 0.00 179.01 178.28 2pn0 h LEU 39 N 0.49 0.79 -1.97 1.33 3.38 -0.64 -1.83 115.31 116.87 2pn0 h LEU 39 Ca 0.14 -0.21 0.02 0.00 0.09 0.00 0.00 57.88 57.93 2pn0 h LEU 39 Cb -0.04 -0.21 -0.00 0.00 0.09 0.00 0.00 40.66 40.50 2pn0 h LEU 39 CO -0.04 0.87 0.07 0.00 0.09 0.00 0.00 178.44 179.44 2pn0 h ALA 40 N 1.21 2.05 -0.22 1.53 0.00 -0.72 -2.55 119.26 120.57 2pn0 h ALA 40 Ca 0.14 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.05 2pn0 h ALA 40 Cb 0.49 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.28 2pn0 h ALA 40 CO 0.02 -0.08 0.00 2.89 0.00 0.00 0.00 179.25 182.09 2pn0 n ARG 41 N -4.51 2.80 -1.03 0.00 1.85 -1.03 -5.06 116.66 109.67 2pn0 n ARG 41 Ca -0.01 -1.83 -0.32 0.00 -1.00 0.00 0.00 57.85 54.70 2pn0 n ARG 41 Cb 0.16 -1.18 0.13 0.00 -1.05 0.00 0.00 32.46 30.52 2pn0 n ARG 41 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 2pn0 s ALA 42 N -0.98 1.86 -0.57 2.89 0.00 -0.72 -4.76 121.76 119.49 2pn0 s ALA 42 Ca 0.15 0.53 -0.22 0.00 0.00 0.00 0.00 51.96 52.42 2pn0 s ALA 42 Cb 0.08 -3.39 0.06 0.00 0.00 0.00 0.00 23.12 19.86 2pn0 s ALA 42 CO 0.11 -2.25 0.86 -1.21 0.00 0.00 0.00 175.76 173.27 2pn0 s GLU 43 N -4.59 3.21 -0.34 0.00 2.02 0.52 -4.98 118.70 114.54 2pn0 s GLU 43 Ca 0.66 -0.60 -0.18 0.00 0.02 0.00 0.00 54.97 54.87 2pn0 s GLU 43 Cb -0.22 -4.12 -0.00 0.00 0.10 0.00 0.00 34.13 29.89 2pn0 s GLU 43 CO 0.55 -1.51 0.53 0.08 0.02 0.00 0.00 175.26 174.93 2pn0 s VAL 44 N 3.62 5.00 0.31 2.63 1.01 -1.26 -1.47 120.40 130.25 2pn0 s VAL 44 Ca 0.24 0.42 0.04 0.00 0.00 0.00 0.00 61.98 62.68 2pn0 s VAL 44 Cb -0.16 -3.97 -0.03 0.00 0.00 0.00 0.00 36.38 32.22 2pn0 s VAL 44 CO 0.15 -0.21 0.19 0.68 0.00 0.00 0.00 175.10 175.91 2pn0 s VAL 45 N 2.43 0.22 0.50 2.92 -7.23 -0.40 -4.86 120.40 113.97 2pn0 s VAL 45 Ca 0.20 -2.00 -0.22 0.00 -1.81 0.00 0.00 61.98 58.14 2pn0 s VAL 45 Cb -0.15 -2.49 -0.06 0.00 0.56 0.00 0.00 36.38 34.24 2pn0 s VAL 45 CO 0.13 0.00 1.24 -1.81 -0.31 0.00 0.00 175.10 174.36 2pn0 s ASP 46 N -3.37 5.79 0.49 4.85 1.01 -1.26 -3.05 116.67 121.13 2pn0 s ASP 46 Ca 0.36 2.49 0.21 0.00 0.71 0.00 0.00 52.55 56.33 2pn0 s ASP 46 Cb 0.04 -2.62 1.26 0.00 1.01 0.00 0.00 42.92 42.62 2pn0 s ASP 46 CO 0.20 -1.19 1.98 -0.65 0.21 0.00 0.00 175.17 175.72 2pn0 h PRO 47 N 1.79 0.15 0.00 8.23 0.11 -1.96 -0.29 132.00 140.02 2pn0 h PRO 47 Ca -0.50 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.60 2pn0 h PRO 47 Cb 1.27 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.35 2pn0 h PRO 47 CO 0.59 0.10 0.00 0.93 -0.21 0.00 0.00 178.00 179.41 2pn0 h GLU 48 N 0.15 0.00 -0.00 1.05 3.07 -2.02 -2.11 114.58 114.71 2pn0 h GLU 48 Ca 0.27 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.13 2pn0 h GLU 48 Cb 0.86 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.77 2pn0 h GLU 48 CO -0.04 0.00 -0.28 0.39 -1.40 0.00 0.00 179.01 177.68 2pn0 n GLU 49 N -2.88 0.28 -3.41 2.33 1.02 -0.12 -4.81 120.64 113.05 2pn0 n GLU 49 Ca 0.00 -0.13 -0.38 0.00 -0.02 0.00 0.00 57.16 56.63 2pn0 n GLU 49 Cb 0.24 -1.50 -0.08 0.00 -0.02 0.00 0.00 31.44 30.08 2pn0 n GLU 49 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 2pn0 s ILE 50 N -2.81 5.20 0.67 -3.67 1.01 -0.80 -5.02 121.20 115.79 2pn0 s ILE 50 Ca 0.17 0.61 -0.17 0.00 0.00 0.00 0.00 60.65 61.26 2pn0 s ILE 50 Cb 0.19 -3.70 0.00 0.00 0.01 0.00 0.00 42.46 38.96 2pn0 s ILE 50 CO 0.59 0.21 1.28 -2.84 0.00 0.00 0.00 174.94 174.19 2pn0 s PRO 51 N 1.65 2.39 0.00 2.79 0.02 -1.26 -4.86 135.00 135.73 2pn0 s PRO 51 Ca 0.16 2.02 0.17 0.00 0.02 0.00 0.00 61.00 63.38 2pn0 s PRO 51 Cb -0.15 -1.83 0.91 0.00 0.02 0.00 0.00 34.50 33.44 2pn0 s PRO 51 CO 0.08 -1.71 1.47 -0.35 -0.33 0.00 0.00 177.00 176.17 2pn0 n PRO 52 N -2.14 0.34 0.00 5.54 -0.04 -1.26 -1.97 135.00 135.48 2pn0 n PRO 52 Ca 0.16 0.09 0.14 0.00 -0.04 0.00 0.00 63.50 63.84 2pn0 n PRO 52 Cb 0.48 -1.50 0.51 0.00 -0.04 0.00 0.00 33.50 32.96 2pn0 n PRO 52 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 2pn0 n THR 53 N -1.19 0.00 -3.54 0.52 -2.24 -1.26 -4.45 114.28 102.12 2pn0 n THR 53 Ca 0.10 -0.06 -0.37 0.00 -2.27 0.00 0.00 64.05 61.45 2pn0 n THR 53 Cb 0.11 -0.00 -0.06 0.00 -2.10 0.00 0.00 70.33 68.27 2pn0 n THR 53 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 2pn0 s VAL 54 N -2.62 5.21 -0.27 2.28 1.01 -0.83 -0.70 120.40 124.48 2pn0 s VAL 54 Ca 0.24 0.67 -0.29 0.00 0.00 0.00 0.00 61.98 62.59 2pn0 s VAL 54 Cb 0.19 -3.66 -0.01 0.00 0.00 0.00 0.00 36.38 32.91 2pn0 s VAL 54 CO 0.52 0.48 1.43 -0.69 0.00 0.00 0.00 175.10 176.85 2pn0 s VAL 55 N -0.29 3.95 0.00 2.92 1.01 0.57 -4.97 120.40 123.60 2pn0 s VAL 55 Ca 0.20 1.07 0.00 0.00 0.00 0.00 0.00 61.98 63.26 2pn0 s VAL 55 Cb -0.15 -3.97 0.00 0.00 0.00 0.00 0.00 36.38 32.26 2pn0 s VAL 55 CO 0.08 -0.41 0.00 0.35 0.00 0.00 0.00 175.10 175.13 2pn0 n THR 56 N 6.31 0.00 0.00 3.92 -2.24 -1.26 -1.01 114.28 120.00 2pn0 n THR 56 Ca 0.16 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.94 2pn0 n THR 56 Cb 0.46 -0.04 0.00 0.00 -2.10 0.00 0.00 70.33 68.65 2pn0 n THR 56 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 2pn0 n ASN 58 N 0.00 0.00 -4.88 3.42 5.03 0.17 -4.80 115.26 114.20 2pn0 n ASN 58 Ca 0.00 0.00 -0.29 0.00 0.87 0.00 0.00 54.58 55.16 2pn0 n ASN 58 Cb 0.00 -0.05 -0.02 0.00 -1.02 0.00 0.00 39.78 38.69 2pn0 n ASN 58 CO 0.00 0.00 0.00 -0.94 -1.83 0.00 0.00 177.26 174.49 2pn0 s SER 59 N 0.00 6.42 -0.22 6.41 1.04 -1.25 -4.80 113.70 121.29 2pn0 s SER 59 Ca 0.00 1.10 -0.09 0.00 0.48 0.00 0.00 55.95 57.44 2pn0 s SER 59 Cb 0.00 -2.32 -0.04 0.00 0.10 0.00 0.00 66.02 63.76 2pn0 s SER 59 CO 0.00 -0.50 0.11 -0.89 0.98 0.00 0.00 173.24 172.94 2pn0 s THR 60 N -2.57 5.00 -0.20 2.02 2.01 0.60 -1.56 115.64 120.95 2pn0 s THR 60 Ca 0.50 0.05 -0.03 0.00 0.31 0.00 0.00 61.69 62.52 2pn0 s THR 60 Cb -0.10 -3.30 -0.01 0.00 0.01 0.00 0.00 72.50 69.09 2pn0 s THR 60 CO 0.38 0.39 -0.06 -0.69 -0.69 0.00 0.00 174.62 173.95 2pn0 s VAL 61 N 0.83 3.36 -0.19 3.82 1.01 0.50 -0.95 120.40 128.78 2pn0 s VAL 61 Ca 0.06 -0.51 -0.11 0.00 0.00 0.00 0.00 61.98 61.41 2pn0 s VAL 61 Cb -0.13 -2.50 -0.05 0.00 0.00 0.00 0.00 36.38 33.70 2pn0 s VAL 61 CO 0.02 0.45 0.19 -0.60 0.00 0.00 0.00 175.10 175.17 2pn0 s ARG 62 N 1.15 4.20 0.07 2.72 3.52 0.20 -0.98 118.95 129.82 2pn0 s ARG 62 Ca 0.02 -0.11 0.07 0.00 -0.13 0.00 0.00 55.73 55.57 2pn0 s ARG 62 Cb -0.14 -3.44 -0.04 0.00 -1.56 0.00 0.00 34.95 29.77 2pn0 s ARG 62 CO -0.01 0.25 -0.15 -0.06 -0.81 0.00 0.00 175.30 174.52 2pn0 s PHE 63 N 0.50 2.64 -0.08 5.12 0.08 0.56 -0.34 117.98 126.45 2pn0 s PHE 63 Ca 0.11 -0.21 0.03 0.00 0.12 0.00 0.00 56.93 56.99 2pn0 s PHE 63 Cb -0.12 -1.44 -0.01 0.00 -0.57 0.00 0.00 43.02 40.87 2pn0 s PHE 63 CO 0.01 0.34 -0.19 0.50 -0.10 0.00 0.00 175.22 175.78 2pn0 s ARG 64 N -1.80 2.87 0.01 0.44 3.52 0.12 -1.88 118.95 122.22 2pn0 s ARG 64 Ca 0.17 -0.79 -0.30 0.00 -0.13 0.00 0.00 55.73 54.68 2pn0 s ARG 64 Cb -0.11 -2.37 -0.05 0.00 -1.56 0.00 0.00 34.95 30.86 2pn0 s ARG 64 CO 0.09 0.35 1.33 0.08 -0.81 0.00 0.00 175.30 176.34 2pn0 s VAL 65 N -0.04 3.82 0.42 7.11 1.01 0.68 -1.26 120.40 132.14 2pn0 s VAL 65 Ca -0.05 1.23 0.11 0.00 0.00 0.00 0.00 61.98 63.26 2pn0 s VAL 65 Cb -0.14 -3.79 0.19 0.00 0.00 0.00 0.00 36.38 32.64 2pn0 s VAL 65 CO 0.04 0.02 1.98 -0.33 0.00 0.00 0.00 175.10 176.82 2pn0 h GLU 66 N 7.51 0.22 -0.15 2.72 5.08 -1.64 -2.38 114.58 125.94 2pn0 h GLU 66 Ca -0.38 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 57.94 2pn0 h GLU 66 Cb 1.18 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 30.40 2pn0 h GLU 66 CO 0.88 0.29 0.00 -1.13 -1.00 0.00 0.00 179.01 178.06 2pn0 n SER 67 N -4.35 1.15 -1.16 1.42 3.41 -1.26 -4.92 113.62 107.90 2pn0 n SER 67 Ca -0.01 -1.72 -0.01 0.00 -0.26 0.00 0.00 58.87 56.87 2pn0 n SER 67 Cb 0.21 -0.09 0.00 0.00 -0.26 0.00 0.00 64.21 64.06 2pn0 n SER 67 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 2pn0 n SER 68 N 0.02 -0.16 -0.44 4.04 3.41 -0.90 -5.03 113.62 114.57 2pn0 n SER 68 Ca 0.13 -1.15 0.13 0.00 -0.26 0.00 0.00 58.87 57.73 2pn0 n SER 68 Cb 0.23 0.28 0.54 0.00 -0.26 0.00 0.00 64.21 64.99 2pn0 n SER 68 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2pn0 n ALA 69 N -2.80 2.58 -2.02 7.33 0.00 -1.26 -4.63 120.51 119.71 2pn0 n ALA 69 Ca -0.01 -0.43 -0.41 0.00 0.00 0.00 0.00 53.44 52.59 2pn0 n ALA 69 Cb 0.05 -1.19 -0.03 0.00 0.00 0.00 0.00 19.45 18.28 2pn0 n ALA 69 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 2pn0 s GLU 70 N -1.96 4.47 0.12 0.00 2.12 -1.26 -4.86 118.70 117.33 2pn0 s GLU 70 Ca 0.38 1.92 0.05 0.00 0.36 0.00 0.00 54.97 57.67 2pn0 s GLU 70 Cb 0.20 -3.22 -0.04 0.00 0.26 0.00 0.00 34.13 31.33 2pn0 s GLU 70 CO 0.32 -0.11 -0.13 -1.21 -0.54 0.00 0.00 175.26 173.60 2pn0 s GLU 71 N -0.32 0.97 0.00 4.30 2.02 -1.26 -0.23 118.70 124.18 2pn0 s GLU 71 Ca 0.53 -1.23 0.00 0.00 0.02 0.00 0.00 54.97 54.29 2pn0 s GLU 71 Cb -0.34 -0.77 0.00 0.00 0.10 0.00 0.00 34.13 33.12 2pn0 s GLU 71 CO 0.38 0.14 0.00 1.97 0.02 0.00 0.00 175.26 177.76 2pn0 n PHE 72 N 0.49 0.00 -3.64 1.61 1.16 -0.79 -4.99 117.46 111.30 2pn0 n PHE 72 Ca -0.15 0.00 -0.06 0.00 -1.87 0.00 0.00 57.45 55.37 2pn0 n PHE 72 Cb 0.57 0.00 -0.07 0.00 -1.61 0.00 0.00 39.48 38.38 2pn0 n PHE 72 CO 0.00 0.00 0.00 -0.51 -1.87 0.00 0.00 176.76 174.38 2pn0 s LEU 74 N 0.00 -0.35 -0.25 5.98 1.43 -0.15 -0.32 118.68 125.01 2pn0 s LEU 74 Ca 0.00 0.64 -0.09 0.00 -1.03 0.00 0.00 54.13 53.65 2pn0 s LEU 74 Cb 0.00 1.63 -0.04 0.00 0.03 0.00 0.00 46.19 47.81 2pn0 s LEU 74 CO 0.00 -0.11 0.11 -0.89 0.23 0.00 0.00 176.35 175.69 2pn0 s THR 75 N 0.47 4.74 -0.20 5.49 2.01 -0.04 -0.37 115.64 127.73 2pn0 s THR 75 Ca 0.01 -0.03 -0.27 0.00 0.31 0.00 0.00 61.69 61.71 2pn0 s THR 75 Cb -0.05 -3.22 -0.00 0.00 0.01 0.00 0.00 72.50 69.24 2pn0 s THR 75 CO -0.10 0.32 0.94 -0.22 -0.69 0.00 0.00 174.62 174.86 2pn0 s LEU 76 N 1.49 4.13 0.15 4.42 2.96 -0.60 -0.81 118.68 130.43 2pn0 s LEU 76 Ca 0.06 1.27 0.02 0.00 -0.22 0.00 0.00 54.13 55.25 2pn0 s LEU 76 Cb -0.15 -3.38 -0.04 0.00 0.50 0.00 0.00 46.19 43.11 2pn0 s LEU 76 CO 0.06 -0.54 -0.02 0.68 -1.32 0.00 0.00 176.35 175.21 2pn0 s VAL 77 N 2.72 0.67 0.59 1.68 -7.23 -0.14 0.43 120.40 119.12 2pn0 s VAL 77 Ca 0.41 -1.97 -0.17 0.00 -1.81 0.00 0.00 61.98 58.44 2pn0 s VAL 77 Cb -0.16 -1.98 -0.04 0.00 0.56 0.00 0.00 36.38 34.76 2pn0 s VAL 77 CO 0.09 -0.60 1.10 -0.31 -0.31 0.00 0.00 175.10 175.07 2pn0 s TYR 78 N -3.65 2.76 0.41 2.82 2.02 -1.26 -0.73 117.35 119.72 2pn0 s TYR 78 Ca 0.20 1.54 0.18 0.00 -0.37 0.00 0.00 57.07 58.63 2pn0 s TYR 78 Cb 0.06 -3.16 1.10 0.00 -0.40 0.00 0.00 41.96 39.55 2pn0 s TYR 78 CO 0.01 -1.42 1.82 -1.35 -1.57 0.00 0.00 175.55 173.04 2pn0 h PRO 79 N 0.69 0.39 0.00 -1.71 0.11 -1.96 -0.68 132.00 128.84 2pn0 h PRO 79 Ca -0.48 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.61 2pn0 h PRO 79 Cb 1.24 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 32.27 2pn0 h PRO 79 CO 0.56 0.26 0.00 0.87 -0.21 0.00 0.00 178.00 179.48 2pn0 h LYS 80 N 0.40 0.00 -0.21 1.05 1.57 -2.03 -3.24 116.57 114.10 2pn0 h LYS 80 Ca 0.52 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.30 2pn0 h LYS 80 Cb 1.32 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.63 2pn0 h LYS 80 CO -0.22 0.00 0.00 -0.25 -0.57 0.00 0.00 179.45 178.41 2pn0 n ASP 81 N -2.48 3.07 -4.77 0.86 8.00 -0.26 -4.96 116.55 116.00 2pn0 n ASP 81 Ca 0.04 -1.95 -0.39 0.00 0.71 0.00 0.00 54.79 53.19 2pn0 n ASP 81 Cb 0.38 -0.13 -0.00 0.00 -0.02 0.00 0.00 41.12 41.34 2pn0 n ASP 81 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 2pn0 s VAL 82 N -1.74 2.64 0.36 2.53 1.01 -1.23 -4.96 120.40 119.01 2pn0 s VAL 82 Ca 0.34 0.57 0.03 0.00 0.00 0.00 0.00 61.98 62.92 2pn0 s VAL 82 Cb 0.21 -3.33 0.07 0.00 0.00 0.00 0.00 36.38 33.33 2pn0 s VAL 82 CO 0.31 0.08 0.49 -0.90 0.00 0.00 0.00 175.10 175.08 2pn0 n ASP 83 N 0.09 0.94 -0.22 3.32 5.75 -1.26 -5.06 116.55 120.10 2pn0 n ASP 83 Ca 0.04 -1.73 0.09 0.00 -0.01 0.00 0.00 54.79 53.18 2pn0 n ASP 83 Cb 0.44 -0.29 0.16 0.00 -1.03 0.00 0.00 41.12 40.40 2pn0 n ASP 83 CO 0.00 0.00 0.00 0.35 -0.11 0.00 0.00 177.20 177.44 2pn0 n THR 84 N -1.94 1.98 -0.92 2.12 -2.24 -1.26 -4.74 114.28 107.28 2pn0 n THR 84 Ca 0.09 -2.56 0.02 0.00 -2.27 0.00 0.00 64.05 59.34 2pn0 n THR 84 Cb 0.32 -0.24 0.03 0.00 -2.10 0.00 0.00 70.33 68.35 2pn0 n THR 84 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 2pn0 n SER 85 N -1.35 1.17 0.00 3.42 7.64 -1.26 -5.02 113.62 118.23 2pn0 n SER 85 Ca 0.17 -2.01 0.00 0.00 1.01 0.00 0.00 58.87 58.04 2pn0 n SER 85 Cb 0.65 -0.15 0.00 0.00 -1.01 0.00 0.00 64.21 63.71 2pn0 n SER 85 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2pn0 n GLY 86 N -0.50 0.76 0.01 0.23 0.00 -1.26 -4.94 105.19 99.49 2pn0 n GLY 86 Ca 0.04 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.14 2pn0 n GLY 86 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2pn0 n GLU 87 N -2.37 0.92 -4.28 1.61 2.13 -1.26 -4.95 120.64 112.44 2pn0 n GLU 87 Ca 0.00 -0.10 -0.29 0.00 0.66 0.00 0.00 57.16 57.43 2pn0 n GLU 87 Cb 0.00 -1.33 -0.11 0.00 0.27 0.00 0.00 31.44 30.27 2pn0 n GLU 87 CO 0.00 0.00 0.00 0.15 -0.41 0.00 0.00 177.13 176.87 2pn0 s LYS 88 N -2.90 1.90 -0.02 5.31 1.02 -1.26 -0.86 119.74 122.92 2pn0 s LYS 88 Ca -0.02 -1.14 0.00 0.00 0.02 0.00 0.00 55.97 54.83 2pn0 s LYS 88 Cb 0.11 -2.17 0.02 0.00 -0.52 0.00 0.00 37.83 35.27 2pn0 s LYS 88 CO 0.65 0.48 0.01 -1.50 -0.92 0.00 0.00 175.35 174.07 2pn0 s ILE 89 N -1.20 0.07 0.35 2.17 2.07 0.01 -4.76 121.20 119.90 2pn0 s ILE 89 Ca 0.19 0.12 -0.27 0.00 -1.41 0.00 0.00 60.65 59.28 2pn0 s ILE 89 Cb -0.11 -0.16 -0.09 0.00 0.13 0.00 0.00 42.46 42.23 2pn0 s ILE 89 CO 0.11 0.10 1.18 -0.55 -1.91 0.00 0.00 174.94 173.88 2pn0 s SER 90 N 0.87 6.78 0.56 4.50 0.15 -1.26 -0.97 113.70 124.33 2pn0 s SER 90 Ca -0.08 2.41 0.28 0.00 0.70 0.00 0.00 55.95 59.26 2pn0 s SER 90 Cb -0.11 -2.63 1.48 0.00 -1.71 0.00 0.00 66.02 63.05 2pn0 s SER 90 CO -0.02 -0.50 1.97 -0.29 1.20 0.00 0.00 173.24 175.61 2pn0 h ILE 91 N 2.70 0.54 -0.00 6.45 6.09 -1.20 -1.13 117.51 130.96 2pn0 h ILE 91 Ca -0.48 0.00 0.00 0.00 -1.37 0.00 0.00 64.86 63.01 2pn0 h ILE 91 Cb 1.23 0.70 0.00 0.00 0.47 0.00 0.00 36.82 39.22 2pn0 h ILE 91 CO 0.64 0.00 -0.14 0.18 -3.07 0.00 0.00 178.15 175.77 2pn0 n LEU 92 N -4.03 0.19 -4.86 2.19 4.77 -1.26 -2.66 117.00 111.34 2pn0 n LEU 92 Ca 0.08 0.29 -0.31 0.00 -0.03 0.00 0.00 56.01 56.04 2pn0 n LEU 92 Cb 0.60 -0.37 -0.03 0.00 -2.33 0.00 0.00 43.42 41.28 2pn0 n LEU 92 CO 0.32 0.04 0.59 0.00 -1.33 0.00 0.00 177.39 177.01 2pn0 s ALA 93 N -2.89 3.18 0.32 -1.18 0.00 -0.43 -4.80 121.76 115.98 2pn0 s ALA 93 Ca 0.17 0.02 -0.28 0.00 0.00 0.00 0.00 51.96 51.86 2pn0 s ALA 93 Cb 0.19 -2.95 -0.13 0.00 0.00 0.00 0.00 23.12 20.23 2pn0 s ALA 93 CO 0.56 -0.16 1.23 -2.30 0.00 0.00 0.00 175.76 175.08 2pn0 n PRO 94 N -1.51 1.94 0.00 0.00 -0.02 -1.26 -1.04 135.00 133.11 2pn0 n PRO 94 Ca 0.05 0.68 0.00 0.00 -2.02 0.00 0.00 63.50 62.21 2pn0 n PRO 94 Cb 0.54 -2.22 0.00 0.00 -0.02 0.00 0.00 33.50 31.80 2pn0 n PRO 94 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 2pn0 n VAL 95 N 0.39 0.00 -0.22 -1.45 0.31 -1.26 -4.62 118.33 111.48 2pn0 n VAL 95 Ca 0.06 0.00 0.02 0.00 -0.01 0.00 0.00 64.34 64.41 2pn0 n VAL 95 Cb 0.35 0.00 0.12 0.00 -0.91 0.00 0.00 33.84 33.40 2pn0 n VAL 95 CO 0.00 0.00 0.00 1.23 -1.32 0.00 0.00 176.83 176.74 2pn0 h GLY 96 N 0.00 0.75 1.88 2.92 0.00 -1.58 -0.52 103.07 106.53 2pn0 h GLY 96 Ca 0.00 0.05 -0.03 0.00 0.00 0.00 0.00 47.33 47.35 2pn0 h GLY 96 CO 0.00 -0.20 -0.09 1.48 0.00 0.00 0.00 176.54 177.74 2pn0 h SER 97 N 0.16 0.13 1.44 0.19 4.64 -0.85 -1.88 113.55 117.38 2pn0 h SER 97 Ca 0.35 -0.02 0.00 0.00 -0.47 0.00 0.00 61.79 61.65 2pn0 h SER 97 Cb 0.57 -0.03 0.00 0.00 -0.31 0.00 0.00 62.40 62.62 2pn0 h SER 97 CO -0.52 0.25 -0.24 0.00 -0.87 0.00 0.00 176.83 175.44 2pn0 h ALA 98 N 1.77 0.86 -0.16 5.18 0.00 -1.40 -3.35 119.26 122.16 2pn0 h ALA 98 Ca 0.03 0.00 -0.12 0.00 0.00 0.00 0.00 54.91 54.82 2pn0 h ALA 98 Cb 0.25 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 2pn0 h ALA 98 CO 0.01 0.00 -0.44 -0.07 0.00 0.00 0.00 179.25 178.75 2pn0 h LEU 99 N 0.00 0.41 -9.52 0.00 3.38 -0.45 -3.42 115.31 105.70 2pn0 h LEU 99 Ca 0.00 -0.19 -0.56 0.00 0.09 0.00 0.00 57.88 57.22 2pn0 h LEU 99 Cb 0.84 -0.11 0.05 0.00 0.09 0.00 0.00 40.66 41.53 2pn0 h LEU 99 CO 0.00 0.80 0.93 -0.11 0.09 0.00 0.00 178.44 180.14 2pn0 n LEU 100 N -4.00 3.49 0.00 1.67 7.94 -1.24 -1.83 117.00 123.02 2pn0 n LEU 100 Ca -0.02 1.05 0.00 0.00 -1.11 0.00 0.00 56.01 55.94 2pn0 n LEU 100 Cb 0.52 -1.47 0.00 0.00 0.53 0.00 0.00 43.42 42.99 2pn0 n LEU 100 CO 0.44 -0.08 0.00 0.61 -1.11 0.00 0.00 177.39 177.24 2pn0 n GLY 101 N 3.77 2.07 3.54 -3.96 0.00 -0.18 -5.01 105.19 105.42 2pn0 n GLY 101 Ca 0.17 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.90 2pn0 n GLY 101 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2pn0 s LEU 102 N 0.00 1.32 0.15 0.99 1.43 -0.76 -4.68 118.68 117.14 2pn0 s LEU 102 Ca 0.00 1.68 0.00 0.00 -1.03 0.00 0.00 54.13 54.78 2pn0 s LEU 102 Cb 0.00 -3.70 -0.04 0.00 0.03 0.00 0.00 46.19 42.48 2pn0 s LEU 102 CO 0.00 -3.93 0.03 0.00 0.23 0.00 0.00 176.35 172.68 2pn0 s ALA 103 N -2.52 1.11 0.01 4.21 0.00 -1.26 -0.31 121.76 123.00 2pn0 s ALA 103 Ca 0.68 -1.54 -0.38 0.00 0.00 0.00 0.00 51.96 50.72 2pn0 s ALA 103 Cb -0.24 0.73 -0.17 0.00 0.00 0.00 0.00 23.12 23.44 2pn0 s ALA 103 CO 0.63 -0.41 1.38 0.94 0.00 0.00 0.00 175.76 178.30 2pn0 n GLN 104 N -0.17 1.03 0.00 0.00 7.27 0.12 -0.95 117.38 124.68 2pn0 n GLN 104 Ca -0.06 0.37 0.00 0.00 0.07 0.00 0.00 57.00 57.38 2pn0 n GLN 104 Cb 0.64 -2.01 0.00 0.00 2.41 0.00 0.00 30.24 31.28 2pn0 n GLN 104 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 2pn0 n GLY 105 N 2.71 3.14 3.77 1.69 0.00 0.43 -5.02 105.19 111.91 2pn0 n GLY 105 Ca 0.20 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.86 2pn0 n GLY 105 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2pn0 s ASP 106 N -1.22 5.75 0.13 1.61 1.01 -0.12 -4.67 116.67 119.17 2pn0 s ASP 106 Ca 0.00 2.29 0.04 0.00 0.71 0.00 0.00 52.55 55.59 2pn0 s ASP 106 Cb 0.00 -2.59 -0.04 0.00 1.01 0.00 0.00 42.92 41.30 2pn0 s ASP 106 CO 0.00 -1.20 0.14 -1.61 0.21 0.00 0.00 175.17 172.70 2pn0 s GLU 107 N -3.07 2.97 0.04 8.23 2.02 -1.26 -0.54 118.70 127.10 2pn0 s GLU 107 Ca 0.70 -0.76 -0.19 0.00 0.02 0.00 0.00 54.97 54.75 2pn0 s GLU 107 Cb -0.28 -2.72 0.04 0.00 0.10 0.00 0.00 34.13 31.27 2pn0 s GLU 107 CO 0.32 0.52 0.42 -1.50 0.02 0.00 0.00 175.26 175.04 2pn0 s ILE 108 N -1.62 0.05 0.04 -1.63 2.07 -0.51 -4.99 121.20 114.62 2pn0 s ILE 108 Ca 0.31 -0.44 -0.08 0.00 -1.41 0.00 0.00 60.65 59.04 2pn0 s ILE 108 Cb -0.11 -0.95 -0.00 0.00 0.13 0.00 0.00 42.46 41.53 2pn0 s ILE 108 CO 0.24 -0.24 0.16 -1.83 -1.91 0.00 0.00 174.94 171.35 2pn0 s GLU 109 N -2.47 0.67 0.26 3.50 -1.05 -1.26 -0.97 118.70 117.38 2pn0 s GLU 109 Ca -0.05 -0.72 -0.19 0.00 -0.15 0.00 0.00 54.97 53.86 2pn0 s GLU 109 Cb -0.01 0.27 0.02 0.00 -0.44 0.00 0.00 34.13 33.97 2pn0 s GLU 109 CO -0.02 -0.19 0.64 1.67 0.95 0.00 0.00 175.26 178.31 2pn0 s TRP 110 N -2.74 -0.10 0.28 4.83 -2.14 -0.69 -4.97 118.94 113.41 2pn0 s TRP 110 Ca -0.04 -0.32 -0.30 0.00 2.66 0.00 0.00 56.10 58.10 2pn0 s TRP 110 Cb -0.00 0.56 -0.11 0.00 -3.10 0.00 0.00 33.47 30.82 2pn0 s TRP 110 CO -0.05 -1.13 1.61 -2.14 -2.66 0.00 0.00 176.95 172.58 2pn0 s PRO 111 N -3.92 4.12 0.01 3.25 0.02 -1.26 0.01 135.00 137.23 2pn0 s PRO 111 Ca 0.12 2.58 -0.20 0.00 0.02 0.00 0.00 61.00 63.53 2pn0 s PRO 111 Cb -0.04 -3.03 -0.06 0.00 0.02 0.00 0.00 34.50 31.39 2pn0 s PRO 111 CO 0.05 -0.65 0.57 0.21 -0.33 0.00 0.00 177.00 176.85 2pn0 s LYS 112 N -0.26 4.26 0.29 5.54 2.20 -0.22 -4.63 119.74 126.93 2pn0 s LYS 112 Ca 0.65 0.71 -0.30 0.00 -0.36 0.00 0.00 55.97 56.66 2pn0 s LYS 112 Cb -0.48 -3.31 -0.12 0.00 -1.51 0.00 0.00 37.83 32.41 2pn0 s LYS 112 CO 0.46 0.45 1.55 -2.30 -0.36 0.00 0.00 175.35 175.15 2pn0 n PRO 113 N 2.43 2.56 -0.15 4.03 -0.02 -1.26 -1.42 135.00 141.16 2pn0 n PRO 113 Ca -0.08 0.91 0.00 0.00 -2.02 0.00 0.00 63.50 62.31 2pn0 n PRO 113 Cb 0.51 -2.66 0.00 0.00 -0.02 0.00 0.00 33.50 31.33 2pn0 n PRO 113 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2pn0 n GLY 114 N 2.03 0.89 0.00 -1.23 0.00 -1.26 -4.93 105.19 100.69 2pn0 n GLY 114 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.11 2pn0 n GLY 114 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2pn0 n GLY 115 N -2.00 3.24 4.31 -0.02 0.00 -0.51 -5.16 105.19 105.05 2pn0 n GLY 115 Ca 0.00 -1.88 0.00 0.00 0.00 0.00 0.00 46.02 44.14 2pn0 n GLY 115 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2pn0 n GLY 116 N -0.79 -2.08 3.10 -0.02 0.00 -1.26 -4.47 105.19 99.67 2pn0 n GLY 116 Ca 0.00 -1.63 -0.27 0.00 0.00 0.00 0.00 46.02 44.12 2pn0 n GLY 116 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2pn0 s VAL 117 N -0.11 1.45 -0.39 1.61 1.01 -1.26 -1.05 120.40 121.65 2pn0 s VAL 117 Ca 0.00 -0.68 -0.25 0.00 0.00 0.00 0.00 61.98 61.06 2pn0 s VAL 117 Cb 0.00 -1.28 0.02 0.00 0.00 0.00 0.00 36.38 35.12 2pn0 s VAL 117 CO 0.00 0.42 0.87 -0.22 0.00 0.00 0.00 175.10 176.17 2pn0 s LEU 118 N 0.42 4.06 -0.29 3.92 2.96 0.10 -4.73 118.68 125.12 2pn0 s LEU 118 Ca -0.13 0.38 -0.11 0.00 -0.22 0.00 0.00 54.13 54.05 2pn0 s LEU 118 Cb -0.15 -3.15 -0.03 0.00 0.50 0.00 0.00 46.19 43.35 2pn0 s LEU 118 CO 0.05 -0.85 0.18 -0.13 -1.32 0.00 0.00 176.35 174.27 2pn0 s ARG 119 N 3.38 3.74 0.19 1.98 0.52 -1.26 -1.70 118.95 125.80 2pn0 s ARG 119 Ca 0.35 -0.46 0.06 0.00 -0.52 0.00 0.00 55.73 55.16 2pn0 s ARG 119 Cb -0.12 -3.62 -0.05 0.00 0.52 0.00 0.00 34.95 31.68 2pn0 s ARG 119 CO 0.20 -0.26 -0.12 0.14 0.02 0.00 0.00 175.30 175.28 2pn0 s VAL 120 N 1.71 1.51 -0.01 3.52 -7.23 -0.15 -1.62 120.40 118.13 2pn0 s VAL 120 Ca 0.06 -2.15 0.06 0.00 -1.81 0.00 0.00 61.98 58.15 2pn0 s VAL 120 Cb -0.16 -2.03 -0.02 0.00 0.56 0.00 0.00 36.38 34.73 2pn0 s VAL 120 CO 0.09 -0.61 -0.20 -0.60 -0.31 0.00 0.00 175.10 173.48 2pn0 s ARG 121 N -3.70 1.60 -0.14 4.82 3.52 -0.39 -1.43 118.95 123.24 2pn0 s ARG 121 Ca 0.21 -0.71 -0.29 0.00 -0.13 0.00 0.00 55.73 54.81 2pn0 s ARG 121 Cb 0.01 -1.55 -0.02 0.00 -1.56 0.00 0.00 34.95 31.83 2pn0 s ARG 121 CO 0.05 0.42 1.33 0.42 -0.81 0.00 0.00 175.30 176.72 2pn0 s ILE 122 N -0.47 4.14 -0.15 4.11 1.01 0.30 -0.71 121.20 129.44 2pn0 s ILE 122 Ca 0.08 1.39 0.17 0.00 0.00 0.00 0.00 60.65 62.28 2pn0 s ILE 122 Cb -0.08 -3.90 -0.24 0.00 0.01 0.00 0.00 42.46 38.26 2pn0 s ILE 122 CO -0.01 -0.12 0.14 1.33 0.00 0.00 0.00 174.94 176.28 2pn0 n VAL 123 N 5.36 1.00 -3.64 2.92 0.24 0.54 -0.43 118.33 124.32 2pn0 n VAL 123 Ca 0.14 -0.71 -0.15 0.00 -2.04 0.00 0.00 64.34 61.58 2pn0 n VAL 123 Cb 0.44 -0.40 -0.07 0.00 -1.47 0.00 0.00 33.84 32.34 2pn0 n VAL 123 CO 0.00 0.00 0.00 -0.70 -2.14 0.00 0.00 176.83 173.99 2pn0 s GLU 124 N -2.63 0.83 -0.04 7.34 2.12 -1.11 -4.84 118.70 120.37 2pn0 s GLU 124 Ca -0.09 0.23 0.04 0.00 0.36 0.00 0.00 54.97 55.52 2pn0 s GLU 124 Cb 0.07 0.39 -0.00 0.00 0.26 0.00 0.00 34.13 34.84 2pn0 s GLU 124 CO 0.76 -0.22 -0.16 0.08 -0.54 0.00 0.00 175.26 175.18 2pn0 s VAL 125 N -0.88 1.35 0.21 3.70 1.01 -1.26 -0.63 120.40 123.89 2pn0 s VAL 125 Ca -0.09 -0.67 -0.02 0.00 0.00 0.00 0.00 61.98 61.19 2pn0 s VAL 125 Cb -0.03 -1.16 -0.04 0.00 0.00 0.00 0.00 36.38 35.15 2pn0 s VAL 125 CO 0.06 0.39 0.17 0.42 0.00 0.00 0.00 175.10 176.14 2pn0 s THR 126 N 0.08 0.00 -2.97 3.92 -4.23 -0.12 -4.71 115.64 107.61 2pn0 s THR 126 Ca -0.04 -1.93 0.24 0.00 -1.18 0.00 0.00 61.69 58.78 2pn0 s THR 126 Cb -0.11 -2.46 0.21 0.00 1.34 0.00 0.00 72.50 71.48 2pn0 s THR 126 CO 0.02 0.00 1.29 -1.22 -0.54 0.00 0.00 174.62 174.17