#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1v87 s SER 2 N 0.00 -0.65 0.18 1.61 0.15 -1.26 -5.18 113.70 108.54 1v87 s SER 2 Ca 0.00 0.75 -0.09 0.00 0.70 0.00 0.00 55.95 57.31 1v87 s SER 2 Cb 0.00 0.59 -0.01 0.00 -1.71 0.00 0.00 66.02 64.89 1v87 s SER 2 CO 0.00 -0.58 0.31 -0.55 1.20 0.00 0.00 173.24 173.61 1v87 s SER 3 N -1.10 0.02 -0.75 5.45 0.15 -1.26 -4.99 113.70 111.22 1v87 s SER 3 Ca -0.10 -0.91 -0.02 0.00 0.70 0.00 0.00 55.95 55.62 1v87 s SER 3 Cb -0.00 0.46 0.00 0.00 -1.71 0.00 0.00 66.02 64.76 1v87 s SER 3 CO 0.09 -0.93 0.66 0.61 1.20 0.00 0.00 173.24 174.87 1v87 n GLY 4 N -0.25 -1.23 0.38 9.45 0.00 -1.26 -4.84 105.19 107.44 1v87 n GLY 4 Ca -0.06 0.57 -0.03 0.00 0.00 0.00 0.00 46.02 46.50 1v87 n GLY 4 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1v87 n SER 5 N -1.99 -0.72 -0.07 1.61 2.88 -1.26 -2.12 113.62 111.95 1v87 n SER 5 Ca -0.12 1.68 -0.13 0.00 -1.33 0.00 0.00 58.87 58.98 1v87 n SER 5 Cb 0.58 -0.34 -0.11 0.00 -0.75 0.00 0.00 64.21 63.59 1v87 n SER 5 CO 0.00 0.00 0.00 0.28 -1.23 0.00 0.00 175.04 174.09 1v87 h SER 6 N 0.00 0.00 0.00 -3.46 0.02 -2.05 -3.50 113.55 104.56 1v87 h SER 6 Ca 0.29 -0.77 0.00 0.00 -0.84 0.00 0.00 61.79 60.47 1v87 h SER 6 Cb 0.53 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.07 1v87 h SER 6 CO -0.94 0.98 0.00 0.61 -1.14 0.00 0.00 176.83 176.34 1v87 n GLY 7 N 1.62 0.92 3.02 -3.77 0.00 -0.90 -5.02 105.19 101.06 1v87 n GLY 7 Ca -0.11 -1.10 -0.10 0.00 0.00 0.00 0.00 46.02 44.71 1v87 n GLY 7 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1v87 s GLU 8 N 0.00 0.42 0.37 1.61 2.02 -1.26 -4.99 118.70 116.88 1v87 s GLU 8 Ca 0.00 -0.76 0.16 0.00 0.02 0.00 0.00 54.97 54.39 1v87 s GLU 8 Cb 0.00 0.02 0.72 0.00 0.10 0.00 0.00 34.13 34.96 1v87 s GLU 8 CO 0.00 -0.03 1.78 -1.00 0.02 0.00 0.00 175.26 176.03 1v87 h PRO 9 N 4.34 0.00 -0.84 0.39 0.13 -2.00 -3.03 132.00 130.99 1v87 h PRO 9 Ca -0.33 0.00 0.03 0.00 -0.87 0.00 0.00 66.00 64.83 1v87 h PRO 9 Cb 1.20 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 32.28 1v87 h PRO 9 CO 0.45 0.39 0.55 0.93 -0.23 0.00 0.00 178.00 180.10 1v87 h GLU 10 N 0.00 1.04 -0.05 0.86 3.07 -1.99 -2.49 114.58 115.02 1v87 h GLU 10 Ca -0.00 -0.06 -0.11 0.00 -0.50 0.00 0.00 59.36 58.68 1v87 h GLU 10 Cb 0.79 -0.23 0.01 0.00 -0.84 0.00 0.00 28.75 28.47 1v87 h GLU 10 CO 0.05 0.69 -0.41 1.96 -1.40 0.00 0.00 179.01 179.90 1v87 h GLN 11 N 1.07 0.36 -0.84 2.33 4.20 -1.97 -3.27 115.11 116.99 1v87 h GLN 11 Ca 0.33 -0.33 0.19 0.00 0.06 0.00 0.00 58.65 58.90 1v87 h GLN 11 Cb -0.01 0.08 -0.12 0.00 0.30 0.00 0.00 27.48 27.73 1v87 h GLN 11 CO -0.09 0.98 0.33 0.28 -0.67 0.00 0.00 178.83 179.66 1v87 h VAL 12 N -0.15 0.52 0.42 -0.54 2.07 -1.42 0.66 116.25 117.80 1v87 h VAL 12 Ca -0.04 -0.13 -0.01 0.00 0.82 0.00 0.00 66.70 67.34 1v87 h VAL 12 Cb 1.09 0.10 -0.03 0.00 -1.52 0.00 0.00 31.29 30.93 1v87 h VAL 12 CO 0.08 0.07 -0.51 0.40 0.02 0.00 0.00 177.57 177.64 1v87 h ILE 13 N 0.39 0.02 -0.66 4.57 1.08 -1.51 -2.50 117.51 118.89 1v87 h ILE 13 Ca 0.50 0.00 0.04 0.00 -0.39 0.00 0.00 64.86 65.01 1v87 h ILE 13 Cb 0.90 0.02 -0.05 0.00 -3.07 0.00 0.00 36.82 34.61 1v87 h ILE 13 CO -0.50 0.00 0.39 0.03 -0.69 0.00 0.00 178.15 177.38 1v87 h ARG 14 N -0.95 0.73 -1.14 2.37 2.47 -1.43 0.61 114.38 117.03 1v87 h ARG 14 Ca -0.05 -0.04 0.32 0.00 -1.26 0.00 0.00 59.98 58.95 1v87 h ARG 14 Cb 0.85 -0.16 -0.09 0.00 -1.65 0.00 0.00 29.97 28.92 1v87 h ARG 14 CO -0.11 0.48 0.76 -0.22 0.56 0.00 0.00 179.97 181.44 1v87 h LYS 15 N 0.75 0.23 0.00 0.04 3.64 -0.54 0.37 116.57 121.06 1v87 h LYS 15 Ca 0.28 -0.01 -0.28 0.00 -1.27 0.00 0.00 60.65 59.37 1v87 h LYS 15 Cb 0.10 -0.05 -0.05 0.00 -0.41 0.00 0.00 32.23 31.81 1v87 h LYS 15 CO -0.14 0.15 -2.28 0.66 -2.27 0.00 0.00 179.45 175.57 1v87 n TYR 16 N -4.52 0.01 -4.47 1.91 4.01 -0.61 -4.91 117.16 108.59 1v87 n TYR 16 Ca 0.28 0.00 -0.34 0.00 -0.16 0.00 0.00 57.90 57.69 1v87 n TYR 16 Cb 1.09 -0.88 -0.14 0.00 -0.31 0.00 0.00 39.34 39.10 1v87 n TYR 16 CO 0.00 0.00 0.00 0.95 -0.46 0.00 0.00 176.86 177.35 1v87 s THR 17 N -2.75 3.13 -0.32 -0.72 -4.23 0.20 -2.06 115.64 108.90 1v87 s THR 17 Ca -0.09 -0.61 -0.14 0.00 -1.18 0.00 0.00 61.69 59.67 1v87 s THR 17 Cb 0.08 -2.35 -0.03 0.00 1.34 0.00 0.00 72.50 71.54 1v87 s THR 17 CO 0.85 0.50 0.30 -0.70 -0.54 0.00 0.00 174.62 175.02 1v87 s GLU 18 N 0.72 3.70 0.28 3.99 2.12 0.38 -4.09 118.70 125.80 1v87 s GLU 18 Ca -0.05 -0.38 -0.30 0.00 0.36 0.00 0.00 54.97 54.60 1v87 s GLU 18 Cb -0.15 -3.75 -0.13 0.00 0.26 0.00 0.00 34.13 30.36 1v87 s GLU 18 CO 0.02 -0.39 1.42 -1.91 -0.54 0.00 0.00 175.26 173.85 1v87 n GLU 19 N 5.24 2.22 -4.04 4.30 2.13 -1.26 -0.92 120.64 128.30 1v87 n GLU 19 Ca -0.11 0.79 -0.36 0.00 0.66 0.00 0.00 57.16 58.14 1v87 n GLU 19 Cb 0.50 -2.45 -0.07 0.00 0.27 0.00 0.00 31.44 29.69 1v87 n GLU 19 CO 0.00 0.00 0.00 -0.51 -0.41 0.00 0.00 177.13 176.21 1v87 s LEU 20 N -0.40 4.12 0.44 4.31 1.43 -0.85 -4.85 118.68 122.88 1v87 s LEU 20 Ca 0.63 0.35 0.29 0.00 -1.03 0.00 0.00 54.13 54.38 1v87 s LEU 20 Cb -0.59 -2.01 1.39 0.00 0.03 0.00 0.00 46.19 45.01 1v87 s LEU 20 CO 0.53 0.39 1.66 0.07 0.23 0.00 0.00 176.35 179.24 1v87 h LYS 21 N 4.98 0.13 -2.40 1.70 2.10 -1.94 -3.39 116.57 117.75 1v87 h LYS 21 Ca -0.53 -0.01 -0.07 0.00 -2.00 0.00 0.00 60.65 58.04 1v87 h LYS 21 Cb 1.22 -0.03 -0.24 0.00 -0.90 0.00 0.00 32.23 32.27 1v87 h LYS 21 CO 0.57 0.09 -0.17 0.54 -2.00 0.00 0.00 179.45 178.48 1v87 s VAL 22 N -5.29 -0.01 -0.09 0.07 0.11 -1.26 -5.12 120.40 108.81 1v87 s VAL 22 Ca -0.08 0.05 -0.40 0.00 -2.93 0.00 0.00 61.98 58.62 1v87 s VAL 22 Cb 0.28 -0.76 -0.19 0.00 -1.53 0.00 0.00 36.38 34.19 1v87 s VAL 22 CO 0.82 0.02 1.28 0.00 -3.33 0.00 0.00 175.10 173.89 1v87 n ALA 23 N 4.10 -2.33 -1.00 1.54 0.00 -1.26 -4.94 120.51 116.62 1v87 n ALA 23 Ca -0.21 0.55 0.00 0.00 0.00 0.00 0.00 53.44 53.77 1v87 n ALA 23 Cb 0.57 -1.90 0.00 0.00 0.00 0.00 0.00 19.45 18.11 1v87 n ALA 23 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1v87 n PRO 24 N 2.49 -0.27 -1.18 0.00 -0.04 -1.26 -4.92 135.00 129.83 1v87 n PRO 24 Ca 0.22 0.00 -0.25 0.00 -0.04 0.00 0.00 63.50 63.43 1v87 n PRO 24 Cb 0.09 0.00 0.13 0.00 -0.04 0.00 0.00 33.50 33.68 1v87 n PRO 24 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 1v87 n GLU 25 N -0.95 2.28 -2.85 0.54 -0.58 -1.26 -4.76 120.64 113.07 1v87 n GLU 25 Ca 0.00 -2.85 -0.21 0.00 -0.42 0.00 0.00 57.16 53.68 1v87 n GLU 25 Cb 0.00 -2.12 0.02 0.00 -0.57 0.00 0.00 31.44 28.77 1v87 n GLU 25 CO 0.00 0.00 0.00 -2.00 -0.48 0.00 0.00 177.13 174.65 1v87 s GLU 26 N -3.20 2.77 -0.13 3.49 2.56 -1.26 -5.08 118.70 117.85 1v87 s GLU 26 Ca 0.55 -0.78 0.01 0.00 0.00 0.00 0.00 54.97 54.75 1v87 s GLU 26 Cb 0.45 -2.57 0.02 0.00 2.00 0.00 0.00 34.13 34.03 1v87 s GLU 26 CO 0.06 -0.47 -0.17 -0.51 -0.56 0.00 0.00 175.26 173.62 1v87 s ASP 27 N -4.34 2.70 -0.20 -1.70 1.01 -1.26 -3.76 116.67 109.13 1v87 s ASP 27 Ca 0.54 -0.50 -0.29 0.00 0.71 0.00 0.00 52.55 53.00 1v87 s ASP 27 Cb -0.10 -1.22 -0.02 0.00 1.01 0.00 0.00 42.92 42.59 1v87 s ASP 27 CO 0.37 0.00 1.44 0.00 0.21 0.00 0.00 175.17 177.19 1v87 h ILE 29 N 5.82 1.09 -0.73 0.00 3.07 -1.92 0.33 117.51 125.17 1v87 h ILE 29 Ca -0.31 -2.53 0.06 0.00 1.55 0.00 0.00 64.86 63.64 1v87 h ILE 29 Cb 1.13 2.53 -0.06 0.00 -0.27 0.00 0.00 36.82 40.15 1v87 h ILE 29 CO 0.99 0.62 0.43 0.40 -1.05 0.00 0.00 178.15 179.54 1v87 h ILE 30 N 0.00 0.99 -0.01 0.16 2.04 -1.95 -3.00 117.51 115.74 1v87 h ILE 30 Ca -0.01 -0.27 0.00 0.00 1.00 0.00 0.00 64.86 65.59 1v87 h ILE 30 Cb 1.48 0.14 0.00 0.00 -0.74 0.00 0.00 36.82 37.70 1v87 h ILE 30 CO 0.08 0.14 -0.06 0.00 0.00 0.00 0.00 178.15 178.31 1v87 n MET 32 N 0.05 -5.72 -4.22 0.00 2.81 0.11 -4.88 117.12 105.28 1v87 n MET 32 Ca 0.03 0.62 -0.18 0.00 -1.81 0.00 0.00 57.70 56.37 1v87 n MET 32 Cb 0.15 -5.50 -0.11 0.00 -0.71 0.00 0.00 33.22 27.05 1v87 n MET 32 CO 0.00 0.00 0.00 -1.21 1.51 0.00 0.00 175.97 176.27 1v87 s GLU 33 N -6.52 0.96 0.01 0.03 2.02 -0.89 -4.98 118.70 109.34 1v87 s GLU 33 Ca 0.58 -1.17 -0.30 0.00 0.02 0.00 0.00 54.97 54.10 1v87 s GLU 33 Cb -0.29 -0.87 -0.06 0.00 0.10 0.00 0.00 34.13 33.02 1v87 s GLU 33 CO 0.82 0.17 1.42 0.15 0.02 0.00 0.00 175.26 177.84 1v87 s LYS 34 N -2.46 4.27 0.42 1.61 3.01 -1.26 -2.32 119.74 123.02 1v87 s LYS 34 Ca 0.06 2.00 0.27 0.00 -1.01 0.00 0.00 55.97 57.29 1v87 s LYS 34 Cb -0.06 -3.58 1.34 0.00 -1.01 0.00 0.00 37.83 34.53 1v87 s LYS 34 CO 0.03 -0.59 1.65 -0.07 0.51 0.00 0.00 175.35 176.88 1v87 h LEU 35 N 8.37 0.30 -0.99 3.17 3.38 -1.90 0.60 115.31 128.24 1v87 h LEU 35 Ca -0.38 0.13 0.20 0.00 0.09 0.00 0.00 57.88 57.92 1v87 h LEU 35 Cb 1.18 0.11 -0.11 0.00 0.09 0.00 0.00 40.66 41.92 1v87 h LEU 35 CO 0.91 -0.13 0.59 0.00 0.09 0.00 0.00 178.44 179.89 1v87 h ALA 36 N 1.62 1.67 -2.23 1.53 0.00 -1.87 -3.41 119.26 116.57 1v87 h ALA 36 Ca 0.77 0.10 -0.46 0.00 0.00 0.00 0.00 54.91 55.31 1v87 h ALA 36 Cb 2.31 -0.04 0.06 0.00 0.00 0.00 0.00 17.79 20.12 1v87 h ALA 36 CO -0.41 -0.12 0.16 0.14 0.00 0.00 0.00 179.25 179.02 1v87 s VAL 37 N -5.84 3.03 1.22 0.00 -7.23 0.21 -5.07 120.40 106.72 1v87 s VAL 37 Ca -0.11 -0.19 -0.14 0.00 -1.81 0.00 0.00 61.98 59.73 1v87 s VAL 37 Cb 0.25 -3.23 0.31 0.00 0.56 0.00 0.00 36.38 34.27 1v87 s VAL 37 CO 0.80 -0.23 1.01 0.00 -0.31 0.00 0.00 175.10 176.36 1v87 s ALA 38 N -3.05 -0.75 0.41 1.32 0.00 -1.26 -4.85 121.76 113.58 1v87 s ALA 38 Ca 0.56 -0.21 -0.21 0.00 0.00 0.00 0.00 51.96 52.10 1v87 s ALA 38 Cb -0.11 -3.22 -0.11 0.00 0.00 0.00 0.00 23.12 19.69 1v87 s ALA 38 CO 0.44 -4.07 0.94 0.45 0.00 0.00 0.00 175.76 173.52 1v87 s SER 39 N -2.49 6.98 0.18 0.00 0.15 -1.08 -4.91 113.70 112.53 1v87 s SER 39 Ca 0.69 1.70 -0.05 0.00 0.70 0.00 0.00 55.95 58.98 1v87 s SER 39 Cb -0.25 -2.54 0.08 0.00 -1.71 0.00 0.00 66.02 61.61 1v87 s SER 39 CO 0.65 -0.32 1.51 1.23 1.20 0.00 0.00 173.24 177.50 1v87 h GLY 40 N 2.06 0.73 2.00 9.45 0.00 -1.92 -2.86 103.07 112.53 1v87 h GLY 40 Ca -0.49 -0.80 0.00 0.00 0.00 0.00 0.00 47.33 46.04 1v87 h GLY 40 CO 0.62 0.72 0.00 -1.72 0.00 0.00 0.00 176.54 176.16 1v87 n TYR 41 N -4.00 0.91 -0.39 5.60 4.02 -1.26 -3.66 117.16 118.38 1v87 n TYR 41 Ca -0.03 0.32 0.33 0.00 -0.01 0.00 0.00 57.90 58.51 1v87 n TYR 41 Cb 0.58 -1.02 0.56 0.00 -0.02 0.00 0.00 39.34 39.43 1v87 n TYR 41 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 176.86 174.72 1v87 n SER 42 N -2.29 0.18 0.02 7.72 3.41 -1.08 0.12 113.62 121.70 1v87 n SER 42 Ca 0.03 1.16 -0.12 0.00 -0.26 0.00 0.00 58.87 59.68 1v87 n SER 42 Cb 0.30 -0.57 -0.09 0.00 -0.26 0.00 0.00 64.21 63.59 1v87 n SER 42 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 1v87 h ASP 43 N 0.00 -0.12 0.36 4.04 3.32 -1.81 -3.35 116.42 118.87 1v87 h ASP 43 Ca 0.73 -0.45 -0.02 0.00 0.02 0.00 0.00 57.03 57.31 1v87 h ASP 43 Cb 2.33 0.03 0.00 0.00 0.22 0.00 0.00 39.33 41.91 1v87 h ASP 43 CO -0.40 0.46 -0.17 -0.03 -1.72 0.00 0.00 179.24 177.37 1v87 h MET 44 N -0.76 -0.47 -6.84 3.56 4.05 0.61 -3.43 114.93 111.65 1v87 h MET 44 Ca -0.01 0.03 -0.48 0.00 -0.28 0.00 0.00 59.70 58.96 1v87 h MET 44 Cb 0.56 0.11 -0.02 0.00 -0.80 0.00 0.00 31.60 31.45 1v87 h MET 44 CO 0.02 -0.22 0.35 0.95 0.23 0.00 0.00 176.91 178.24 1v87 s THR 45 N -5.46 4.12 -0.27 -0.77 -4.23 0.13 -4.98 115.64 104.18 1v87 s THR 45 Ca -0.15 1.88 0.19 0.00 -1.18 0.00 0.00 61.69 62.42 1v87 s THR 45 Cb 0.03 -4.09 0.49 0.00 1.34 0.00 0.00 72.50 70.27 1v87 s THR 45 CO 0.60 0.26 1.12 -0.67 -0.54 0.00 0.00 174.62 175.38 1v87 n ASP 46 N 0.85 2.40 -4.77 3.99 2.03 -1.26 -4.59 116.55 115.19 1v87 n ASP 46 Ca 0.01 -2.49 -0.35 0.00 0.52 0.00 0.00 54.79 52.48 1v87 n ASP 46 Cb 0.49 -0.45 0.00 0.00 -0.72 0.00 0.00 41.12 40.44 1v87 n ASP 46 CO 0.00 0.00 0.00 -0.55 -1.92 0.00 0.00 177.20 174.73 1v87 s SER 47 N -3.72 5.73 -0.23 1.67 0.15 -1.26 -4.99 113.70 111.05 1v87 s SER 47 Ca 0.33 2.16 -0.15 0.00 0.70 0.00 0.00 55.95 58.99 1v87 s SER 47 Cb 0.35 -2.58 -0.17 0.00 -1.71 0.00 0.00 66.02 61.91 1v87 s SER 47 CO -0.02 -1.21 -0.03 0.29 1.20 0.00 0.00 173.24 173.47 1v87 n LYS 48 N -1.31 0.60 0.07 5.44 4.01 -1.26 -4.50 118.16 121.20 1v87 n LYS 48 Ca 0.12 0.39 -0.11 0.00 -0.51 0.00 0.00 58.31 58.19 1v87 n LYS 48 Cb 0.51 -1.62 -0.05 0.00 -0.51 0.00 0.00 35.03 33.35 1v87 n LYS 48 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 1v87 h ALA 49 N -0.59 -0.17 -2.25 7.82 0.00 -2.03 -3.43 119.26 118.61 1v87 h ALA 49 Ca -0.52 -0.00 -0.46 0.00 0.00 0.00 0.00 54.91 53.93 1v87 h ALA 49 Cb 1.55 0.22 0.09 0.00 0.00 0.00 0.00 17.79 19.65 1v87 h ALA 49 CO -0.26 -0.63 0.25 -0.51 0.00 0.00 0.00 179.25 178.11 1v87 s LEU 50 N -10.29 2.79 0.06 0.00 1.43 -1.26 -5.11 118.68 106.30 1v87 s LEU 50 Ca -0.14 0.42 -0.09 0.00 -1.03 0.00 0.00 54.13 53.28 1v87 s LEU 50 Cb 0.08 -2.99 0.00 0.00 0.03 0.00 0.00 46.19 43.31 1v87 s LEU 50 CO 0.66 -1.73 0.19 -0.83 0.23 0.00 0.00 176.35 174.88 1v87 s GLY 51 N -4.57 0.06 0.20 -3.19 0.00 -1.26 -4.79 107.32 93.77 1v87 s GLY 51 Ca 0.62 -0.43 -0.04 0.00 0.00 0.00 0.00 44.72 44.86 1v87 s GLY 51 CO 0.46 -0.62 1.55 -0.56 0.00 0.00 0.00 173.10 173.93 1v87 h PRO 52 N 3.12 0.67 -0.07 2.90 0.13 -1.94 -3.18 132.00 133.62 1v87 h PRO 52 Ca -0.33 -0.35 -0.22 0.00 -0.87 0.00 0.00 66.00 64.23 1v87 h PRO 52 Cb 1.19 0.01 0.01 0.00 0.13 0.00 0.00 31.00 32.34 1v87 h PRO 52 CO 0.52 0.96 -0.85 0.52 -0.23 0.00 0.00 178.00 178.92 1v87 h MET 53 N 0.54 0.59 -6.33 0.86 2.86 -1.93 -2.87 114.93 108.66 1v87 h MET 53 Ca 0.04 -0.54 -0.65 0.00 -2.06 0.00 0.00 59.70 56.50 1v87 h MET 53 Cb 0.95 0.13 0.08 0.00 0.06 0.00 0.00 31.60 32.82 1v87 h MET 53 CO 0.09 1.16 0.21 0.28 1.06 0.00 0.00 176.91 179.71 1v87 n VAL 54 N -3.85 1.09 -3.85 -2.22 0.31 -1.20 -4.96 118.33 103.64 1v87 n VAL 54 Ca -0.07 -0.27 -0.12 0.00 -0.01 0.00 0.00 64.34 63.87 1v87 n VAL 54 Cb 0.78 -0.82 -0.13 0.00 -0.91 0.00 0.00 33.84 32.76 1v87 n VAL 54 CO 0.00 0.00 0.00 -0.69 -1.32 0.00 0.00 176.83 174.82 1v87 s VAL 55 N -0.35 0.01 0.15 2.52 1.01 -1.26 -3.65 120.40 118.83 1v87 s VAL 55 Ca 0.71 -0.09 -0.09 0.00 0.00 0.00 0.00 61.98 62.51 1v87 s VAL 55 Cb -0.84 -0.15 -0.01 0.00 0.00 0.00 0.00 36.38 35.39 1v87 s VAL 55 CO 0.54 -0.05 0.26 -0.83 0.00 0.00 0.00 175.10 175.02 1v87 s GLY 56 N -0.12 0.43 -0.07 4.51 0.00 -1.24 -2.01 107.32 108.81 1v87 s GLY 56 Ca -0.02 -0.86 0.02 0.00 0.00 0.00 0.00 44.72 43.87 1v87 s GLY 56 CO 0.00 -0.85 -0.13 0.50 0.00 0.00 0.00 173.10 172.62 1v87 s ARG 57 N -3.95 2.77 1.32 2.90 0.52 -0.10 -1.77 118.95 120.63 1v87 s ARG 57 Ca 0.15 -0.68 -0.19 0.00 -0.52 0.00 0.00 55.73 54.49 1v87 s ARG 57 Cb 0.04 -2.47 0.32 0.00 0.52 0.00 0.00 34.95 33.36 1v87 s ARG 57 CO -0.02 0.52 0.80 1.28 0.02 0.00 0.00 175.30 177.90 1v87 n LEU 58 N 2.63 -1.08 -0.12 2.53 4.77 -1.13 -0.47 117.00 124.14 1v87 n LEU 58 Ca -0.17 -0.57 0.04 0.00 -0.03 0.00 0.00 56.01 55.28 1v87 n LEU 58 Cb 0.52 -1.05 -0.02 0.00 -2.33 0.00 0.00 43.42 40.54 1v87 n LEU 58 CO 0.27 -4.00 0.10 0.35 -1.33 0.00 0.00 177.39 172.79 1v87 n THR 59 N -5.37 0.00 0.00 -5.08 -2.24 -0.88 -3.97 114.28 96.75 1v87 n THR 59 Ca 0.08 -0.35 0.00 0.00 -2.27 0.00 0.00 64.05 61.51 1v87 n THR 59 Cb 0.56 1.06 0.00 0.00 -2.10 0.00 0.00 70.33 69.85 1v87 n THR 59 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1v87 n LYS 60 N -0.69 0.00 0.00 -0.78 4.01 -1.26 -4.66 118.16 114.77 1v87 n LYS 60 Ca 0.03 0.08 0.13 0.00 -0.51 0.00 0.00 58.31 58.03 1v87 n LYS 60 Cb 0.17 -0.44 0.33 0.00 -0.51 0.00 0.00 35.03 34.58 1v87 n LYS 60 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 1v87 n SER 62 N -1.02 -3.30 -4.52 0.00 7.64 -1.25 -4.98 113.62 106.18 1v87 n SER 62 Ca 0.09 -0.63 -0.37 0.00 1.01 0.00 0.00 58.87 58.98 1v87 n SER 62 Cb 0.34 -4.93 -0.12 0.00 -1.01 0.00 0.00 64.21 58.49 1v87 n SER 62 CO 0.00 0.00 0.00 -1.00 -3.01 0.00 0.00 175.04 171.03 1v87 s HIS 63 N -3.38 3.16 0.28 1.43 3.76 -1.26 -4.71 115.29 114.56 1v87 s HIS 63 Ca 0.20 -0.17 -0.29 0.00 -0.15 0.00 0.00 55.06 54.64 1v87 s HIS 63 Cb -0.09 -2.25 -0.10 0.00 1.11 0.00 0.00 32.58 31.25 1v87 s HIS 63 CO 0.74 -0.20 1.35 0.00 -0.85 0.00 0.00 174.74 175.78 1v87 s ALA 64 N 1.41 3.55 -0.25 -1.40 0.00 -1.26 -2.83 121.76 120.97 1v87 s ALA 64 Ca 0.06 1.25 -0.18 0.00 0.00 0.00 0.00 51.96 53.09 1v87 s ALA 64 Cb -0.15 -3.50 0.07 0.00 0.00 0.00 0.00 23.12 19.54 1v87 s ALA 64 CO 0.05 -0.65 0.64 -0.06 0.00 0.00 0.00 175.76 175.74 1v87 s PHE 65 N -0.52 -0.87 -0.70 0.00 0.08 -0.73 -4.76 117.98 110.48 1v87 s PHE 65 Ca 0.54 1.88 -0.29 0.00 0.12 0.00 0.00 56.93 59.17 1v87 s PHE 65 Cb -0.40 0.44 -0.14 0.00 -0.57 0.00 0.00 43.02 42.35 1v87 s PHE 65 CO 0.47 -0.43 2.52 0.72 -0.10 0.00 0.00 175.22 178.39 1v87 n HIS 66 N 3.70 1.07 -0.48 0.36 8.25 -1.26 -3.68 115.22 123.18 1v87 n HIS 66 Ca -0.18 0.25 0.38 0.00 -0.26 0.00 0.00 57.72 57.91 1v87 n HIS 66 Cb 0.57 -2.51 0.61 0.00 1.12 0.00 0.00 29.99 29.78 1v87 n HIS 66 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 1v87 n LEU 67 N 12.99 0.09 -0.02 2.41 4.77 -1.24 0.16 117.00 136.16 1v87 n LEU 67 Ca 0.50 0.97 -0.13 0.00 -0.03 0.00 0.00 56.01 57.33 1v87 n LEU 67 Cb 0.29 -0.48 -0.10 0.00 -2.33 0.00 0.00 43.42 40.79 1v87 n LEU 67 CO 0.82 -1.02 0.53 0.25 -1.33 0.00 0.00 177.39 176.64 1v87 h LEU 68 N 0.00 -0.03 -0.92 2.23 5.85 -1.80 -3.04 115.31 117.60 1v87 h LEU 68 Ca 0.74 -0.61 0.17 0.00 0.84 0.00 0.00 57.88 59.03 1v87 h LEU 68 Cb 2.70 0.01 -0.10 0.00 0.37 0.00 0.00 40.66 43.63 1v87 h LEU 68 CO -0.20 0.61 0.50 0.00 -0.34 0.00 0.00 178.44 179.01 1v87 h LEU 70 N 0.65 0.84 -0.82 0.00 3.38 -1.42 -2.03 115.31 115.90 1v87 h LEU 70 Ca 0.52 -0.08 -0.06 0.00 0.09 0.00 0.00 57.88 58.35 1v87 h LEU 70 Cb 0.80 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 41.31 1v87 h LEU 70 CO -0.39 0.68 0.20 0.25 0.09 0.00 0.00 178.44 179.26 1v87 h LEU 71 N 0.93 1.01 -0.52 1.67 5.85 -0.88 -0.80 115.31 122.56 1v87 h LEU 71 Ca 0.24 -0.19 -0.01 0.00 0.84 0.00 0.00 57.88 58.75 1v87 h LEU 71 Cb 0.01 -0.27 -0.02 0.00 0.37 0.00 0.00 40.66 40.76 1v87 h LEU 71 CO -0.04 0.95 0.27 0.00 -0.34 0.00 0.00 178.44 179.28 1v87 h ALA 72 N 1.18 0.67 -0.44 1.25 0.00 -0.81 0.16 119.26 121.27 1v87 h ALA 72 Ca 0.22 -0.11 -0.14 0.00 0.00 0.00 0.00 54.91 54.88 1v87 h ALA 72 Cb 0.32 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 1v87 h ALA 72 CO -0.00 0.21 -0.28 1.98 0.00 0.00 0.00 179.25 181.16 1v87 h MET 73 N 0.70 0.96 -0.27 0.00 1.85 -1.16 0.46 114.93 117.46 1v87 h MET 73 Ca 0.18 -0.45 -0.05 0.00 -0.61 0.00 0.00 59.70 58.77 1v87 h MET 73 Cb 0.08 -0.01 -0.01 0.00 0.43 0.00 0.00 31.60 32.09 1v87 h MET 73 CO -0.03 1.11 -0.02 -0.92 -0.40 0.00 0.00 176.91 176.66 1v87 h TYR 74 N 0.80 0.55 -0.41 1.39 5.03 -0.92 -3.14 116.97 120.27 1v87 h TYR 74 Ca 0.09 -0.10 -0.14 0.00 2.58 0.00 0.00 58.73 61.15 1v87 h TYR 74 Cb 0.86 -0.14 -0.01 0.00 1.55 0.00 0.00 36.73 38.99 1v87 h TYR 74 CO 0.06 0.67 -0.31 0.00 -1.32 0.00 0.00 178.16 177.25 1v87 n ASN 76 N -4.08 0.17 0.00 0.00 5.15 0.15 -4.51 115.26 112.14 1v87 n ASN 76 Ca -0.01 1.45 0.00 0.00 -0.60 0.00 0.00 54.58 55.42 1v87 n ASN 76 Cb 0.50 -0.65 0.00 0.00 -0.53 0.00 0.00 39.78 39.11 1v87 n ASN 76 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1v87 n GLY 77 N -1.29 -0.11 3.58 8.20 0.00 -1.19 -5.04 105.19 109.34 1v87 n GLY 77 Ca 0.29 -0.03 -0.28 0.00 0.00 0.00 0.00 46.02 46.00 1v87 n GLY 77 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1v87 s ASN 78 N -1.49 4.99 -0.62 1.61 3.84 -0.83 -4.77 114.94 117.67 1v87 s ASN 78 Ca 0.00 -1.64 0.06 0.00 0.21 0.00 0.00 52.86 51.50 1v87 s ASN 78 Cb 0.00 -2.59 0.25 0.00 -0.55 0.00 0.00 41.25 38.36 1v87 s ASN 78 CO 0.00 -3.12 0.72 0.29 -2.79 0.00 0.00 177.10 172.20 1v87 n LYS 79 N 8.29 2.34 -2.31 0.43 5.02 -1.15 -4.34 118.16 126.43 1v87 n LYS 79 Ca 0.45 -4.54 -0.20 0.00 -2.02 0.00 0.00 58.31 52.00 1v87 n LYS 79 Cb 0.47 -2.16 0.02 0.00 -0.02 0.00 0.00 35.03 33.33 1v87 n LYS 79 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 1v87 n ASP 80 N 0.94 4.12 -3.80 4.39 8.00 -1.26 -4.95 116.55 123.99 1v87 n ASP 80 Ca 0.29 -3.41 -0.26 0.00 0.71 0.00 0.00 54.79 52.11 1v87 n ASP 80 Cb 0.42 -0.41 0.03 0.00 -0.02 0.00 0.00 41.12 41.15 1v87 n ASP 80 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1v87 n GLY 81 N -0.58 -0.42 3.61 0.44 0.00 -1.26 -4.85 105.19 102.13 1v87 n GLY 81 Ca 0.35 0.17 -0.12 0.00 0.00 0.00 0.00 46.02 46.42 1v87 n GLY 81 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1v87 s SER 82 N -3.72 0.54 -0.26 1.61 1.04 -1.26 -4.69 113.70 106.96 1v87 s SER 82 Ca 0.40 -1.33 -0.16 0.00 0.48 0.00 0.00 55.95 55.34 1v87 s SER 82 Cb -0.20 0.73 0.07 0.00 0.10 0.00 0.00 66.02 66.72 1v87 s SER 82 CO 0.81 -1.43 0.64 -0.22 0.98 0.00 0.00 173.24 174.03 1v87 s LEU 83 N -3.16 -0.74 -0.03 2.42 1.98 -1.26 -4.88 118.68 113.01 1v87 s LEU 83 Ca 0.25 1.39 0.07 0.00 -2.89 0.00 0.00 54.13 52.94 1v87 s LEU 83 Cb -0.02 2.21 -0.02 0.00 0.66 0.00 0.00 46.19 49.02 1v87 s LEU 83 CO 0.16 -0.23 -0.23 -1.58 -1.89 0.00 0.00 176.35 172.58 1v87 s GLN 84 N 1.34 1.99 -0.20 1.98 0.74 -1.26 -1.12 119.66 123.13 1v87 s GLN 84 Ca -0.08 -0.83 -0.29 0.00 0.05 0.00 0.00 55.36 54.21 1v87 s GLN 84 Cb -0.05 -1.87 -0.00 0.00 1.10 0.00 0.00 33.01 32.19 1v87 s GLN 84 CO -0.15 0.47 1.14 0.00 -0.55 0.00 0.00 175.29 176.20 1v87 n PRO 86 N 6.47 0.49 -0.00 0.00 -0.04 -1.26 0.06 135.00 140.71 1v87 n PRO 86 Ca 0.13 0.00 -0.00 0.00 -0.04 0.00 0.00 63.50 63.58 1v87 n PRO 86 Cb 0.45 -1.12 -0.00 0.00 -0.04 0.00 0.00 33.50 32.79 1v87 n PRO 86 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1v87 n SER 87 N -0.62 0.12 -0.17 3.54 2.88 -1.26 -4.74 113.62 113.37 1v87 n SER 87 Ca 0.03 0.02 0.13 0.00 -1.33 0.00 0.00 58.87 57.71 1v87 n SER 87 Cb 0.01 -0.35 0.32 0.00 -0.75 0.00 0.00 64.21 63.44 1v87 n SER 87 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1v87 n LYS 89 N -0.93 -6.07 -3.62 0.00 4.76 0.11 -4.99 118.16 107.42 1v87 n LYS 89 Ca 0.10 0.73 -0.38 0.00 -2.87 0.00 0.00 58.31 55.89 1v87 n LYS 89 Cb 0.35 -5.42 -0.11 0.00 -1.84 0.00 0.00 35.03 28.00 1v87 n LYS 89 CO 0.00 0.00 0.00 0.99 -1.37 0.00 0.00 177.40 177.02 1v87 s THR 90 N -3.30 5.14 0.27 -0.18 2.01 -1.24 -4.81 115.64 113.53 1v87 s THR 90 Ca 0.14 0.11 -0.22 0.00 0.31 0.00 0.00 61.69 62.04 1v87 s THR 90 Cb -0.06 -3.44 -0.09 0.00 0.01 0.00 0.00 72.50 68.92 1v87 s THR 90 CO 0.63 0.27 0.81 -0.63 -0.69 0.00 0.00 174.62 175.01 1v87 s ILE 91 N 1.71 4.44 -0.04 1.82 1.01 -1.26 -1.87 121.20 127.00 1v87 s ILE 91 Ca 0.07 1.47 0.05 0.00 0.00 0.00 0.00 60.65 62.24 1v87 s ILE 91 Cb -0.16 -3.90 -0.08 0.00 0.01 0.00 0.00 42.46 38.34 1v87 s ILE 91 CO 0.10 0.16 0.05 -1.22 0.00 0.00 0.00 174.94 174.03 1v87 n TYR 92 N 0.60 0.00 0.00 3.97 4.02 -0.27 -3.94 117.16 121.53 1v87 n TYR 92 Ca -0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.89 1v87 n TYR 92 Cb 0.51 -0.24 0.00 0.00 -0.02 0.00 0.00 39.34 39.59 1v87 n TYR 92 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1v87 n GLY 93 N 2.50 -0.13 0.00 2.72 0.00 -1.26 -4.62 105.19 104.40 1v87 n GLY 93 Ca -0.07 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.95 1v87 n GLY 93 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1v87 n GLU 94 N -1.26 0.00 -3.60 1.61 4.07 -1.26 -4.46 120.64 115.74 1v87 n GLU 94 Ca 0.00 0.44 -0.16 0.00 -0.06 0.00 0.00 57.16 57.38 1v87 n GLU 94 Cb 0.00 -0.75 -0.14 0.00 -0.06 0.00 0.00 31.44 30.49 1v87 n GLU 94 CO 0.00 0.00 0.00 0.21 -0.06 0.00 0.00 177.13 177.28 1v87 s LYS 95 N -1.80 0.14 -0.85 5.31 2.47 -1.26 -5.09 119.74 118.66 1v87 s LYS 95 Ca 0.00 0.53 -0.25 0.00 -1.56 0.00 0.00 55.97 54.69 1v87 s LYS 95 Cb 0.00 -0.48 0.00 0.00 -1.46 0.00 0.00 37.83 35.90 1v87 s LYS 95 CO 0.00 -0.42 1.65 0.99 0.16 0.00 0.00 175.35 177.73 1v87 s THR 96 N 2.36 3.62 0.00 3.43 2.01 -1.25 -4.39 115.64 121.42 1v87 s THR 96 Ca 0.04 -0.22 0.00 0.00 0.31 0.00 0.00 61.69 61.81 1v87 s THR 96 Cb -0.13 -4.49 0.00 0.00 0.01 0.00 0.00 72.50 67.89 1v87 s THR 96 CO -0.09 -1.42 0.00 0.61 -0.69 0.00 0.00 174.62 173.03 1v87 n GLY 97 N 6.35 0.63 3.04 4.40 0.00 -1.26 -5.05 105.19 113.31 1v87 n GLY 97 Ca 0.27 -0.52 -0.37 0.00 0.00 0.00 0.00 46.02 45.41 1v87 n GLY 97 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1v87 n THR 98 N 0.00 0.00 -1.18 2.61 -2.24 -1.26 -4.69 114.28 107.52 1v87 n THR 98 Ca 0.00 -0.32 -0.31 0.00 -2.27 0.00 0.00 64.05 61.15 1v87 n THR 98 Cb 0.00 -0.07 0.10 0.00 -2.10 0.00 0.00 70.33 68.27 1v87 n THR 98 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 1v87 s GLN 99 N -2.18 2.02 -0.11 -0.78 -0.21 -1.26 -4.85 119.66 112.29 1v87 s GLN 99 Ca 0.41 1.19 -0.29 0.00 0.02 0.00 0.00 55.36 56.68 1v87 s GLN 99 Cb -0.09 -1.87 -0.04 0.00 1.00 0.00 0.00 33.01 32.01 1v87 s GLN 99 CO 0.76 -1.82 1.54 -1.25 -2.12 0.00 0.00 175.29 172.40 1v87 s PRO 100 N -4.87 4.13 -1.50 2.91 0.04 -1.26 -3.10 135.00 131.35 1v87 s PRO 100 Ca 0.62 1.95 -0.12 0.00 0.04 0.00 0.00 61.00 63.49 1v87 s PRO 100 Cb -0.18 -3.93 0.07 0.00 0.04 0.00 0.00 34.50 30.50 1v87 s PRO 100 CO 0.56 -0.89 0.97 0.91 0.04 0.00 0.00 177.00 178.60 1v87 n TRP 101 N 7.22 -2.31 0.00 0.56 8.01 -1.26 -3.59 117.44 126.08 1v87 n TRP 101 Ca 0.17 0.91 0.00 0.00 -1.31 0.00 0.00 57.50 57.26 1v87 n TRP 101 Cb 0.44 -4.10 0.00 0.00 -2.01 0.00 0.00 31.31 25.64 1v87 n TRP 101 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 1v87 n GLY 102 N -1.71 1.73 3.04 6.99 0.00 -1.18 -4.45 105.19 109.61 1v87 n GLY 102 Ca 0.00 0.10 -0.32 0.00 0.00 0.00 0.00 46.02 45.80 1v87 n GLY 102 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1v87 s LYS 103 N 0.00 1.76 0.41 1.61 2.47 -1.26 -4.45 119.74 120.29 1v87 s LYS 103 Ca 0.00 -2.05 -0.21 0.00 -1.56 0.00 0.00 55.97 52.15 1v87 s LYS 103 Cb 0.00 -3.35 -0.15 0.00 -1.46 0.00 0.00 37.83 32.87 1v87 s LYS 103 CO 0.00 -1.02 0.15 0.00 0.16 0.00 0.00 175.35 174.64 1v87 n MET 104 N 4.07 0.08 -3.76 4.03 0.00 -1.24 -4.92 117.12 115.38 1v87 n MET 104 Ca 0.03 0.03 -0.36 0.00 0.00 0.00 0.00 57.70 57.40 1v87 n MET 104 Cb 0.40 -1.08 -0.11 0.00 0.00 0.00 0.00 33.22 32.43 1v87 n MET 104 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 175.97 174.76 1v87 s GLU 105 N -1.10 2.11 -0.37 3.17 0.41 -1.26 -5.06 118.70 116.60 1v87 s GLU 105 Ca 0.60 -1.94 -0.18 0.00 -0.41 0.00 0.00 54.97 53.05 1v87 s GLU 105 Cb -0.63 -3.62 0.00 0.00 -1.78 0.00 0.00 34.13 28.10 1v87 s GLU 105 CO 0.62 -1.10 0.48 0.14 -0.49 0.00 0.00 175.26 174.91 1v87 s VAL 106 N 0.95 5.04 -0.21 2.63 -7.23 -1.26 -4.91 120.40 115.41 1v87 s VAL 106 Ca 0.10 0.12 -0.07 0.00 -1.81 0.00 0.00 61.98 60.32 1v87 s VAL 106 Cb -0.23 -3.97 -0.10 0.00 0.56 0.00 0.00 36.38 32.64 1v87 s VAL 106 CO -0.04 -0.27 -0.25 2.22 -0.31 0.00 0.00 175.10 176.45 1v87 n PHE 107 N 5.69 0.00 -0.03 2.82 -1.74 -1.26 -4.84 117.46 118.10 1v87 n PHE 107 Ca -0.06 0.00 -0.03 0.00 -0.56 0.00 0.00 57.45 56.80 1v87 n PHE 107 Cb 0.49 -0.77 -0.03 0.00 1.52 0.00 0.00 39.48 40.68 1v87 n PHE 107 CO 0.00 0.00 0.00 2.89 -0.56 0.00 0.00 176.76 179.09 1v87 n ARG 108 N -3.72 1.37 -3.46 3.97 -4.01 -1.26 -4.93 116.66 104.62 1v87 n ARG 108 Ca -0.41 0.02 -0.43 0.00 -1.04 0.00 0.00 57.85 56.00 1v87 n ARG 108 Cb 0.82 -1.12 -0.08 0.00 -3.04 0.00 0.00 32.46 29.04 1v87 n ARG 108 CO 0.00 0.00 0.00 0.45 -3.04 0.00 0.00 177.63 175.04 1v87 s SER 109 N -4.19 5.94 -0.30 2.89 0.15 -1.26 -5.02 113.70 111.90 1v87 s SER 109 Ca -0.06 -1.57 -0.01 0.00 0.70 0.00 0.00 55.95 55.01 1v87 s SER 109 Cb 0.02 -2.11 0.10 0.00 -1.71 0.00 0.00 66.02 62.32 1v87 s SER 109 CO 0.16 -0.67 0.10 -0.83 1.20 0.00 0.00 173.24 173.20 1v87 s GLY 110 N 2.69 1.00 0.13 9.45 0.00 -1.26 -4.68 107.32 114.65 1v87 s GLY 110 Ca 0.04 -1.58 -0.31 0.00 0.00 0.00 0.00 44.72 42.87 1v87 s GLY 110 CO 0.03 1.66 1.35 2.56 0.00 0.00 0.00 173.10 178.70 1v87 s PRO 111 N 1.68 4.35 -0.70 2.90 0.04 -1.26 -4.99 135.00 137.01 1v87 s PRO 111 Ca 0.09 2.04 0.02 0.00 0.04 0.00 0.00 61.00 63.19 1v87 s PRO 111 Cb -0.17 -3.25 0.17 0.00 0.04 0.00 0.00 34.50 31.30 1v87 s PRO 111 CO -0.26 -0.37 0.51 0.45 0.04 0.00 0.00 177.00 177.36 1v87 s SER 112 N 0.92 5.05 -0.07 6.66 0.15 -1.26 -5.04 113.70 120.10 1v87 s SER 112 Ca 0.62 -3.54 0.00 0.00 0.70 0.00 0.00 55.95 53.73 1v87 s SER 112 Cb -0.36 -1.73 0.02 0.00 -1.71 0.00 0.00 66.02 62.24 1v87 s SER 112 CO 0.32 -0.17 -0.06 -0.44 1.20 0.00 0.00 173.24 174.09 1v87 s SER 113 N -0.67 1.62 0.00 5.45 0.01 -1.26 -5.23 113.70 113.61 1v87 s SER 113 Ca 0.23 -0.21 0.19 0.00 1.31 0.00 0.00 55.95 57.47 1v87 s SER 113 Cb -0.11 -0.64 0.15 0.00 0.21 0.00 0.00 66.02 65.62 1v87 s SER 113 CO -0.11 -0.08 1.09 0.61 0.41 0.00 0.00 173.24 175.16