#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 5.20 0.30 1.61 1.04 -1.26 -4.89 113.70 115.69 1v87 s SER 2 Ca 0.00 -0.18 -0.02 0.00 0.48 0.00 0.00 55.95 56.24 1v87 s SER 2 Cb 0.00 -2.54 -0.01 0.00 0.10 0.00 0.00 66.02 63.56 1v87 s SER 2 CO 0.00 -2.57 0.36 -0.44 0.98 0.00 0.00 173.24 171.57 1v87 s SER 3 N 8.09 0.76 0.00 7.02 0.01 -1.26 -5.08 113.70 123.24 1v87 s SER 3 Ca 0.69 -1.44 0.00 0.00 1.31 0.00 0.00 55.95 56.51 1v87 s SER 3 Cb -0.10 0.57 0.00 0.00 0.21 0.00 0.00 66.02 66.70 1v87 s SER 3 CO 0.10 -1.13 0.00 0.61 0.41 0.00 0.00 173.24 173.23 1v87 n GLY 4 N -0.49 -0.25 3.35 3.44 0.00 -1.26 -5.16 105.19 104.82 1v87 n GLY 4 Ca 0.02 -0.13 -0.32 0.00 0.00 0.00 0.00 46.02 45.60 1v87 n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1v87 s SER 5 N 0.00 3.41 -0.11 1.61 0.01 -1.26 -5.05 113.70 112.31 1v87 s SER 5 Ca 0.00 -0.39 -0.21 0.00 1.31 0.00 0.00 55.95 56.66 1v87 s SER 5 Cb 0.00 -0.73 -0.18 0.00 0.21 0.00 0.00 66.02 65.32 1v87 s SER 5 CO 0.00 0.29 0.62 0.28 0.41 0.00 0.00 173.24 174.84 1v87 h SER 6 N 5.71 -0.02 0.00 2.44 0.02 -2.01 -3.49 113.55 116.19 1v87 h SER 6 Ca -0.39 -0.65 0.00 0.00 -0.84 0.00 0.00 61.79 59.91 1v87 h SER 6 Cb 1.15 0.01 0.00 0.00 0.14 0.00 0.00 62.40 63.70 1v87 h SER 6 CO 0.49 0.77 0.00 0.61 -1.14 0.00 0.00 176.83 177.56 1v87 n GLY 7 N 1.46 2.85 3.80 -3.77 0.00 -1.26 -5.12 105.19 103.15 1v87 n GLY 7 Ca -0.07 -0.41 -0.31 0.00 0.00 0.00 0.00 46.02 45.23 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 2.99 0.17 1.61 2.02 -1.26 -5.03 118.70 119.20 1v87 s GLU 8 Ca 0.00 -0.63 -0.07 0.00 0.02 0.00 0.00 54.97 54.29 1v87 s GLU 8 Cb 0.00 -2.79 0.06 0.00 0.10 0.00 0.00 34.13 31.50 1v87 s GLU 8 CO 0.00 0.58 1.52 -1.00 0.02 0.00 0.00 175.26 176.38 1v87 h PRO 9 N 3.36 0.79 -1.27 0.39 0.13 -2.00 -3.07 132.00 130.33 1v87 h PRO 9 Ca -0.47 -0.42 0.37 0.00 -0.87 0.00 0.00 66.00 64.61 1v87 h PRO 9 Cb 1.16 0.01 -0.06 0.00 0.13 0.00 0.00 31.00 32.24 1v87 h PRO 9 CO 0.67 1.05 0.90 0.93 -0.23 0.00 0.00 178.00 181.31 1v87 h GLU 10 N 0.65 0.06 0.21 0.86 5.08 -2.00 0.56 114.58 119.99 1v87 h GLU 10 Ca 0.05 -0.00 -0.31 0.00 -1.00 0.00 0.00 59.36 58.09 1v87 h GLU 10 Cb 0.96 -0.01 0.03 0.00 0.50 0.00 0.00 28.75 30.22 1v87 h GLU 10 CO 0.09 0.04 -1.39 1.96 -1.00 0.00 0.00 179.01 178.71 1v87 h GLN 11 N 0.06 0.44 -0.56 2.33 4.20 -1.97 -3.16 115.11 116.45 1v87 h GLN 11 Ca 0.63 -0.75 -0.01 0.00 0.06 0.00 0.00 58.65 58.58 1v87 h GLN 11 Cb 2.37 0.28 -0.03 0.00 0.30 0.00 0.00 27.48 30.40 1v87 h GLN 11 CO -0.08 1.36 0.32 0.28 -0.67 0.00 0.00 178.83 180.04 1v87 h VAL 12 N 0.12 1.18 0.88 -0.54 2.07 0.02 0.29 116.25 120.26 1v87 h VAL 12 Ca -0.21 -0.44 -0.04 0.00 0.82 0.00 0.00 66.70 66.82 1v87 h VAL 12 Cb 2.10 0.45 0.01 0.00 -1.52 0.00 0.00 31.29 32.33 1v87 h VAL 12 CO 0.25 0.19 -0.42 0.40 0.02 0.00 0.00 177.57 178.01 1v87 h ILE 13 N 0.76 0.00 -0.74 4.57 1.08 -1.33 -2.83 117.51 119.00 1v87 h ILE 13 Ca 0.20 -0.03 0.04 0.00 -0.39 0.00 0.00 64.86 64.67 1v87 h ILE 13 Cb 0.03 0.00 -0.05 0.00 -3.07 0.00 0.00 36.82 33.73 1v87 h ILE 13 CO -0.03 0.00 0.46 0.03 -0.69 0.00 0.00 178.15 177.92 1v87 h ARG 14 N -1.21 0.86 -0.41 2.37 2.47 -1.54 0.44 114.38 117.36 1v87 h ARG 14 Ca -0.12 -0.05 0.12 0.00 -1.26 0.00 0.00 59.98 58.67 1v87 h ARG 14 Cb 0.90 -0.19 -0.02 0.00 -1.65 0.00 0.00 29.97 29.01 1v87 h ARG 14 CO 0.20 0.57 0.53 -0.22 0.56 0.00 0.00 179.97 181.60 1v87 h LYS 15 N 0.88 0.00 0.00 0.04 3.64 -0.36 0.63 116.57 121.40 1v87 h LYS 15 Ca 0.31 0.00 -0.07 0.00 -1.27 0.00 0.00 60.65 59.62 1v87 h LYS 15 Cb 0.06 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 31.87 1v87 h LYS 15 CO -0.13 0.00 -1.66 0.66 -2.27 0.00 0.00 179.45 176.05 1v87 n TYR 16 N -3.50 0.00 -4.96 1.91 4.01 -0.34 -4.96 117.16 109.32 1v87 n TYR 16 Ca 0.07 0.00 -0.31 0.00 -0.16 0.00 0.00 57.90 57.50 1v87 n TYR 16 Cb 0.69 -0.38 -0.17 0.00 -0.31 0.00 0.00 39.34 39.17 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 -2.71 1.92 -0.38 -0.72 -4.23 0.14 -0.65 115.64 109.00 1v87 s THR 17 Ca -0.05 -0.93 -0.13 0.00 -1.18 0.00 0.00 61.69 59.40 1v87 s THR 17 Cb 0.07 -1.68 0.01 0.00 1.34 0.00 0.00 72.50 72.24 1v87 s THR 17 CO 0.52 0.53 0.26 -0.70 -0.54 0.00 0.00 174.62 174.69 1v87 s GLU 18 N 0.54 3.05 0.09 3.99 2.12 -0.29 -4.16 118.70 124.03 1v87 s GLU 18 Ca -0.15 -0.95 -0.34 0.00 0.36 0.00 0.00 54.97 53.89 1v87 s GLU 18 Cb -0.17 -3.87 -0.14 0.00 0.26 0.00 0.00 34.13 30.22 1v87 s GLU 18 CO 0.05 -0.67 1.64 -1.91 -0.54 0.00 0.00 175.26 173.83 1v87 n GLU 19 N 5.10 2.07 -3.35 4.30 2.13 -1.26 -2.01 120.64 127.62 1v87 n GLU 19 Ca -0.12 0.75 -0.36 0.00 0.66 0.00 0.00 57.16 58.10 1v87 n GLU 19 Cb 0.47 -2.53 -0.06 0.00 0.27 0.00 0.00 31.44 29.60 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 1.71 4.35 0.61 4.31 1.43 -0.94 -4.92 118.68 125.24 1v87 s LEU 20 Ca 0.83 1.09 0.33 0.00 -1.03 0.00 0.00 54.13 55.34 1v87 s LEU 20 Cb -0.71 -3.23 1.90 0.00 0.03 0.00 0.00 46.19 44.18 1v87 s LEU 20 CO 0.42 0.12 2.22 0.50 0.23 0.00 0.00 176.35 179.84 1v87 h LYS 21 N 3.65 0.00 -2.88 1.70 1.63 -1.92 -3.41 116.57 115.34 1v87 h LYS 21 Ca -0.49 0.00 -0.16 0.00 -0.85 0.00 0.00 60.65 59.15 1v87 h LYS 21 Cb 1.19 0.00 -0.29 0.00 -0.60 0.00 0.00 32.23 32.54 1v87 h LYS 21 CO 0.65 0.00 -0.41 0.08 -3.45 0.00 0.00 179.45 176.32 1v87 s VAL 22 N -4.50 -0.04 0.18 2.00 1.01 -1.26 -5.13 120.40 112.66 1v87 s VAL 22 Ca -0.05 0.13 -0.33 0.00 0.00 0.00 0.00 61.98 61.73 1v87 s VAL 22 Cb 0.14 -0.47 -0.14 0.00 0.00 0.00 0.00 36.38 35.91 1v87 s VAL 22 CO 0.50 0.05 1.53 0.00 0.00 0.00 0.00 175.10 177.18 1v87 n ALA 23 N 4.26 1.24 -1.01 5.51 0.00 -1.26 -4.98 120.51 124.27 1v87 n ALA 23 Ca -0.24 0.44 -0.02 0.00 0.00 0.00 0.00 53.44 53.62 1v87 n ALA 23 Cb 0.54 -2.32 0.02 0.00 0.00 0.00 0.00 19.45 17.69 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 3.05 -1.21 -1.14 0.00 -0.04 -1.26 -4.94 135.00 129.46 1v87 n PRO 24 Ca 0.16 -0.16 -0.21 0.00 -0.04 0.00 0.00 63.50 63.25 1v87 n PRO 24 Cb 0.29 -0.15 0.18 0.00 -0.04 0.00 0.00 33.50 33.79 1v87 n PRO 24 CO 0.00 0.00 0.00 -0.85 -0.04 0.00 0.00 175.50 174.61 1v87 n GLU 25 N -1.81 2.34 -2.82 0.54 0.28 -1.26 -4.85 120.64 113.06 1v87 n GLU 25 Ca 0.01 -2.85 -0.21 0.00 -0.16 0.00 0.00 57.16 53.95 1v87 n GLU 25 Cb 0.05 -2.12 0.08 0.00 1.43 0.00 0.00 31.44 30.89 1v87 n GLU 25 CO 0.00 0.00 0.00 -2.00 -0.16 0.00 0.00 177.13 174.97 1v87 s GLU 26 N -3.08 2.01 -0.02 3.44 2.12 -1.26 -5.10 118.70 116.81 1v87 s GLU 26 Ca 0.54 -1.38 0.02 0.00 0.36 0.00 0.00 54.97 54.51 1v87 s GLU 26 Cb 0.45 -2.50 0.00 0.00 0.26 0.00 0.00 34.13 32.34 1v87 s GLU 26 CO 0.11 -1.13 -0.08 -0.51 -0.54 0.00 0.00 175.26 173.10 1v87 s ASP 27 N -4.69 1.10 -0.01 -1.70 1.01 -1.26 -4.02 116.67 107.09 1v87 s ASP 27 Ca 0.64 -0.17 -0.29 0.00 0.71 0.00 0.00 52.55 53.44 1v87 s ASP 27 Cb -0.06 -0.26 -0.03 0.00 1.01 0.00 0.00 42.92 43.58 1v87 s ASP 27 CO 0.41 0.07 0.94 0.00 0.21 0.00 0.00 175.17 176.80 1v87 n ILE 29 N 3.86 0.34 -0.27 0.00 -5.35 -1.26 -1.46 119.36 115.22 1v87 n ILE 29 Ca 0.05 -0.52 -0.04 0.00 -0.27 0.00 0.00 62.75 61.96 1v87 n ILE 29 Cb 0.51 -0.18 0.11 0.00 -1.74 0.00 0.00 39.64 38.34 1v87 n ILE 29 CO 0.00 0.00 0.00 0.40 -1.76 0.00 0.00 176.55 175.19 1v87 h ILE 30 N 0.00 1.25 -0.00 7.28 2.04 -1.96 -3.25 117.51 122.87 1v87 h ILE 30 Ca 0.00 -0.76 0.00 0.00 1.00 0.00 0.00 64.86 65.10 1v87 h ILE 30 Cb 0.99 0.30 0.00 0.00 -0.74 0.00 0.00 36.82 37.38 1v87 h ILE 30 CO 0.00 0.31 -0.06 0.00 0.00 0.00 0.00 178.15 178.40 1v87 n MET 32 N -0.97 -7.06 -4.31 0.00 2.81 -0.53 -4.85 117.12 102.21 1v87 n MET 32 Ca 0.00 0.77 -0.19 0.00 -1.81 0.00 0.00 57.70 56.47 1v87 n MET 32 Cb 0.02 -5.61 -0.15 0.00 -0.71 0.00 0.00 33.22 26.77 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 -6.00 0.81 0.08 0.03 0.41 -1.12 -4.98 118.70 107.93 1v87 s GLU 33 Ca 0.42 -0.25 -0.36 0.00 -0.41 0.00 0.00 54.97 54.37 1v87 s GLU 33 Cb -0.19 -0.78 -0.16 0.00 -1.78 0.00 0.00 34.13 31.23 1v87 s GLU 33 CO 0.67 0.09 1.41 1.63 -0.49 0.00 0.00 175.26 178.57 1v87 n LYS 34 N 3.31 1.34 -0.09 1.61 4.01 -1.26 -3.39 118.16 123.69 1v87 n LYS 34 Ca -0.18 0.49 0.26 0.00 -0.51 0.00 0.00 58.31 58.37 1v87 n LYS 34 Cb 0.55 -2.16 0.68 0.00 -0.51 0.00 0.00 35.03 33.59 1v87 n LYS 34 CO 0.00 0.00 0.00 -0.07 -1.11 0.00 0.00 177.40 176.22 1v87 h LEU 35 N 4.97 0.00 -0.74 -0.35 3.38 -1.91 0.32 115.31 120.97 1v87 h LEU 35 Ca -0.47 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.48 1v87 h LEU 35 Cb 1.32 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 42.03 1v87 h LEU 35 CO 0.81 0.00 0.40 0.00 0.09 0.00 0.00 178.44 179.74 1v87 h ALA 36 N 1.25 0.95 -2.22 1.53 0.00 -1.88 -3.44 119.26 115.45 1v87 h ALA 36 Ca 0.37 -0.12 -0.46 0.00 0.00 0.00 0.00 54.91 54.70 1v87 h ALA 36 Cb 1.84 -0.30 0.13 0.00 0.00 0.00 0.00 17.79 19.46 1v87 h ALA 36 CO -0.00 0.47 0.39 0.14 0.00 0.00 0.00 179.25 180.24 1v87 s VAL 37 N -5.84 2.03 0.75 0.00 -7.23 0.11 -5.03 120.40 105.20 1v87 s VAL 37 Ca -0.13 -0.06 -0.11 0.00 -1.81 0.00 0.00 61.98 59.88 1v87 s VAL 37 Cb 0.15 -2.97 0.04 0.00 0.56 0.00 0.00 36.38 34.16 1v87 s VAL 37 CO 0.80 0.00 1.08 0.00 -0.31 0.00 0.00 175.10 176.67 1v87 s ALA 38 N -3.69 2.37 0.61 1.32 0.00 -1.26 -4.76 121.76 116.35 1v87 s ALA 38 Ca 0.68 0.18 -0.17 0.00 0.00 0.00 0.00 51.96 52.66 1v87 s ALA 38 Cb -0.07 -3.23 -0.02 0.00 0.00 0.00 0.00 23.12 19.79 1v87 s ALA 38 CO 0.50 -1.61 1.11 0.45 0.00 0.00 0.00 175.76 176.22 1v87 s SER 39 N -3.54 5.39 0.46 0.00 0.15 -0.13 -4.93 113.70 111.10 1v87 s SER 39 Ca 0.60 2.05 0.26 0.00 0.70 0.00 0.00 55.95 59.56 1v87 s SER 39 Cb -0.16 -2.56 0.65 0.00 -1.71 0.00 0.00 66.02 62.24 1v87 s SER 39 CO 0.56 -1.44 1.72 1.23 1.20 0.00 0.00 173.24 176.51 1v87 h GLY 40 N 0.50 0.00 -0.52 9.45 0.00 -1.91 -2.97 103.07 107.61 1v87 h GLY 40 Ca -0.48 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.85 1v87 h GLY 40 CO 0.55 0.00 0.00 -1.72 0.00 0.00 0.00 176.54 175.37 1v87 n TYR 41 N -3.12 0.01 -0.58 5.60 4.02 -1.26 -4.35 117.16 117.48 1v87 n TYR 41 Ca 0.03 -0.00 0.44 0.00 -0.01 0.00 0.00 57.90 58.35 1v87 n TYR 41 Cb 0.47 0.00 0.68 0.00 -0.02 0.00 0.00 39.34 40.47 1v87 n TYR 41 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 176.86 176.30 1v87 n SER 42 N 0.22 0.00 -0.11 7.72 2.88 -1.12 0.61 113.62 123.82 1v87 n SER 42 Ca 0.19 0.82 -0.21 0.00 -1.33 0.00 0.00 58.87 58.33 1v87 n SER 42 Cb 0.36 -0.41 -0.11 0.00 -0.75 0.00 0.00 64.21 63.31 1v87 n SER 42 CO 0.00 0.00 0.00 -0.67 -1.23 0.00 0.00 175.04 173.14 1v87 n ASP 43 N -3.57 1.87 -0.29 -3.46 2.03 -1.26 -4.25 116.55 107.61 1v87 n ASP 43 Ca 0.37 0.43 0.18 0.00 0.52 0.00 0.00 54.79 56.29 1v87 n ASP 43 Cb 1.67 -0.94 0.46 0.00 -0.72 0.00 0.00 41.12 41.59 1v87 n ASP 43 CO 0.00 0.00 0.00 -0.03 -1.92 0.00 0.00 177.20 175.25 1v87 h MET 44 N -1.00 0.49 -6.88 -0.67 4.05 -0.11 -3.40 114.93 107.41 1v87 h MET 44 Ca -0.37 -0.03 -0.69 0.00 -0.28 0.00 0.00 59.70 58.34 1v87 h MET 44 Cb 1.28 -0.11 -0.22 0.00 -0.80 0.00 0.00 31.60 31.76 1v87 h MET 44 CO -0.22 0.32 -0.86 -0.08 0.23 0.00 0.00 176.91 176.30 1v87 s THR 45 N -5.56 2.34 -0.11 -0.77 -1.32 0.50 -5.04 115.64 105.68 1v87 s THR 45 Ca -0.09 -1.72 0.19 0.00 -1.21 0.00 0.00 61.69 58.86 1v87 s THR 45 Cb 0.24 -2.04 0.43 0.00 -1.51 0.00 0.00 72.50 69.62 1v87 s THR 45 CO 0.79 0.09 1.19 -0.90 -2.21 0.00 0.00 174.62 173.58 1v87 n ASP 46 N 0.90 1.50 -3.76 8.08 5.75 -1.26 -4.57 116.55 123.18 1v87 n ASP 46 Ca -0.18 -2.81 -0.39 0.00 -0.01 0.00 0.00 54.79 51.40 1v87 n ASP 46 Cb 0.53 -0.40 -0.01 0.00 -1.03 0.00 0.00 41.12 40.20 1v87 n ASP 46 CO 0.00 0.00 0.00 -0.24 -0.11 0.00 0.00 177.20 176.85 1v87 n SER 47 N -0.25 -1.84 -0.08 -1.12 2.88 -1.26 -4.92 113.62 107.04 1v87 n SER 47 Ca 0.13 0.83 -0.11 0.00 -1.33 0.00 0.00 58.87 58.39 1v87 n SER 47 Cb 0.94 -0.79 -0.07 0.00 -0.75 0.00 0.00 64.21 63.55 1v87 n SER 47 CO 0.00 0.00 0.00 0.50 -1.23 0.00 0.00 175.04 174.31 1v87 h LYS 48 N 0.55 0.00 -0.03 -1.46 3.11 -2.03 -3.40 116.57 113.31 1v87 h LYS 48 Ca -0.28 0.00 -0.01 0.00 -2.81 0.00 0.00 60.65 57.54 1v87 h LYS 48 Cb 1.25 0.00 -0.00 0.00 -1.00 0.00 0.00 32.23 32.48 1v87 h LYS 48 CO 0.45 0.50 -0.03 0.00 -2.81 0.00 0.00 179.45 177.56 1v87 h ALA 49 N -0.64 0.04 -2.44 5.00 0.00 -2.01 -3.45 119.26 115.76 1v87 h ALA 49 Ca -0.10 -0.28 -0.48 0.00 0.00 0.00 0.00 54.91 54.05 1v87 h ALA 49 Cb 0.74 -0.01 0.12 0.00 0.00 0.00 0.00 17.79 18.64 1v87 h ALA 49 CO -0.06 -0.17 0.32 -0.51 0.00 0.00 0.00 179.25 178.83 1v87 s LEU 50 N -9.13 2.35 0.11 0.00 1.43 -1.26 -5.09 118.68 107.08 1v87 s LEU 50 Ca -0.16 1.16 -0.09 0.00 -1.03 0.00 0.00 54.13 54.01 1v87 s LEU 50 Cb 0.02 -3.65 -0.00 0.00 0.03 0.00 0.00 46.19 42.59 1v87 s LEU 50 CO 0.69 -2.22 0.24 -0.83 0.23 0.00 0.00 176.35 174.45 1v87 s GLY 51 N -3.95 0.16 0.32 -3.19 0.00 -1.26 -4.68 107.32 94.71 1v87 s GLY 51 Ca 0.62 -0.64 0.11 0.00 0.00 0.00 0.00 44.72 44.81 1v87 s GLY 51 CO 0.54 -0.77 1.71 -0.56 0.00 0.00 0.00 173.10 174.03 1v87 h PRO 52 N 2.66 0.04 0.00 2.90 0.13 -1.94 -2.88 132.00 132.91 1v87 h PRO 52 Ca -0.33 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 64.77 1v87 h PRO 52 Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 1v87 h PRO 52 CO 0.53 0.52 -0.61 0.52 -0.23 0.00 0.00 178.00 178.73 1v87 h MET 53 N 0.04 0.00 -6.83 0.86 2.86 -1.93 -0.32 114.93 109.61 1v87 h MET 53 Ca -0.00 0.00 -0.52 0.00 -2.06 0.00 0.00 59.70 57.12 1v87 h MET 53 Cb 0.87 0.00 0.05 0.00 0.06 0.00 0.00 31.60 32.58 1v87 h MET 53 CO 0.06 0.00 0.59 0.08 1.06 0.00 0.00 176.91 178.71 1v87 s VAL 54 N -3.23 3.01 0.03 -2.22 1.01 -1.09 -4.97 120.40 112.95 1v87 s VAL 54 Ca 0.04 0.99 0.02 0.00 0.00 0.00 0.00 61.98 63.03 1v87 s VAL 54 Cb 0.11 -3.63 -0.02 0.00 0.00 0.00 0.00 36.38 32.84 1v87 s VAL 54 CO 0.73 0.22 -0.07 -0.69 0.00 0.00 0.00 175.10 175.29 1v87 s VAL 55 N -0.95 0.44 0.21 2.92 1.01 -1.26 -3.31 120.40 119.46 1v87 s VAL 55 Ca 0.49 -0.99 -0.15 0.00 0.00 0.00 0.00 61.98 61.32 1v87 s VAL 55 Cb -0.37 -0.52 0.01 0.00 0.00 0.00 0.00 36.38 35.51 1v87 s VAL 55 CO 0.47 -0.38 0.49 -0.83 0.00 0.00 0.00 175.10 174.85 1v87 s GLY 56 N -1.47 0.15 -0.08 4.51 0.00 -1.19 -2.21 107.32 107.04 1v87 s GLY 56 Ca -0.11 -0.50 0.05 0.00 0.00 0.00 0.00 44.72 44.16 1v87 s GLY 56 CO 0.00 -0.43 -0.23 0.50 0.00 0.00 0.00 173.10 172.94 1v87 s ARG 57 N -3.93 2.84 1.08 2.90 0.52 -0.85 -0.97 118.95 120.54 1v87 s ARG 57 Ca 0.14 -0.87 -0.16 0.00 -0.52 0.00 0.00 55.73 54.32 1v87 s ARG 57 Cb -0.01 -2.27 0.12 0.00 0.52 0.00 0.00 34.95 33.31 1v87 s ARG 57 CO 0.01 0.29 0.34 1.28 0.02 0.00 0.00 175.30 177.24 1v87 n LEU 58 N 3.22 -1.37 -0.32 2.53 4.77 -1.16 -1.14 117.00 123.53 1v87 n LEU 58 Ca -0.18 0.01 0.06 0.00 -0.03 0.00 0.00 56.01 55.87 1v87 n LEU 58 Cb 0.52 -1.10 0.01 0.00 -2.33 0.00 0.00 43.42 40.53 1v87 n LEU 58 CO 0.27 -3.21 0.27 0.35 -1.33 0.00 0.00 177.39 173.74 1v87 n THR 59 N -4.32 0.00 -0.10 -5.08 -2.24 0.17 -3.41 114.28 99.30 1v87 n THR 59 Ca 0.03 -0.39 -0.13 0.00 -2.27 0.00 0.00 64.05 61.29 1v87 n THR 59 Cb 0.58 1.17 -0.05 0.00 -2.10 0.00 0.00 70.33 69.94 1v87 n THR 59 CO 0.00 0.00 0.00 1.17 -0.57 0.00 0.00 175.07 175.67 1v87 n LYS 60 N -0.05 0.54 0.00 -0.78 4.81 -1.26 -4.68 118.16 116.73 1v87 n LYS 60 Ca 0.06 0.26 0.08 0.00 -0.87 0.00 0.00 58.31 57.83 1v87 n LYS 60 Cb 0.28 -1.47 -0.02 0.00 0.02 0.00 0.00 35.03 33.83 1v87 n LYS 60 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1v87 n SER 62 N -0.34 -3.47 -4.41 0.00 7.64 -1.22 -4.96 113.62 106.85 1v87 n SER 62 Ca 0.06 -0.68 -0.39 0.00 1.01 0.00 0.00 58.87 58.86 1v87 n SER 62 Cb 0.33 -4.58 -0.11 0.00 -1.01 0.00 0.00 64.21 58.84 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 -3.42 3.21 0.41 1.43 3.76 -1.26 -4.71 115.29 114.71 1v87 s HIS 63 Ca 0.28 -0.73 -0.27 0.00 -0.15 0.00 0.00 55.06 54.20 1v87 s HIS 63 Cb -0.13 -2.39 -0.10 0.00 1.11 0.00 0.00 32.58 31.06 1v87 s HIS 63 CO 0.77 -0.53 1.39 0.00 -0.85 0.00 0.00 174.74 175.52 1v87 n ALA 64 N 4.99 1.87 -3.63 -1.40 0.00 -1.26 -3.00 120.51 118.08 1v87 n ALA 64 Ca -0.13 0.30 -0.11 0.00 0.00 0.00 0.00 53.44 53.50 1v87 n ALA 64 Cb 0.48 -2.35 -0.07 0.00 0.00 0.00 0.00 19.45 17.51 1v87 n ALA 64 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 1v87 s PHE 65 N -1.16 -0.55 -0.46 0.00 0.08 -0.14 -4.85 117.98 110.89 1v87 s PHE 65 Ca 0.58 1.32 -0.31 0.00 0.12 0.00 0.00 56.93 58.64 1v87 s PHE 65 Cb -0.49 0.35 -0.11 0.00 -0.57 0.00 0.00 43.02 42.20 1v87 s PHE 65 CO 0.60 -0.28 2.33 0.72 -0.10 0.00 0.00 175.22 178.49 1v87 n HIS 66 N 2.21 1.45 -0.06 0.36 8.25 -1.26 -3.14 115.22 123.03 1v87 n HIS 66 Ca -0.13 0.20 0.21 0.00 -0.26 0.00 0.00 57.72 57.75 1v87 n HIS 66 Cb 0.56 -2.56 0.39 0.00 1.12 0.00 0.00 29.99 29.50 1v87 n HIS 66 CO 0.00 0.00 0.00 -0.07 0.64 0.00 0.00 176.34 176.91 1v87 h LEU 67 N 14.55 0.00 0.00 2.41 3.38 -1.84 0.43 115.31 134.24 1v87 h LEU 67 Ca -0.25 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 57.66 1v87 h LEU 67 Cb 1.30 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.04 1v87 h LEU 67 CO 1.10 0.00 -0.37 0.25 0.09 0.00 0.00 178.44 179.51 1v87 h LEU 68 N 0.00 0.00 -0.83 1.67 5.85 -1.79 -3.29 115.31 116.92 1v87 h LEU 68 Ca 0.35 -0.58 0.18 0.00 0.84 0.00 0.00 57.88 58.67 1v87 h LEU 68 Cb 2.50 0.00 -0.11 0.00 0.37 0.00 0.00 40.66 43.41 1v87 h LEU 68 CO -0.00 1.00 0.34 0.00 -0.34 0.00 0.00 178.44 179.44 1v87 h LEU 70 N 0.42 0.71 -0.00 0.00 3.38 -1.49 -0.19 115.31 118.14 1v87 h LEU 70 Ca 0.49 -0.01 -0.00 0.00 0.09 0.00 0.00 57.88 58.45 1v87 h LEU 70 Cb 0.85 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 41.43 1v87 h LEU 70 CO -0.48 0.49 -0.01 0.25 0.09 0.00 0.00 178.44 178.79 1v87 h LEU 71 N 0.83 0.01 -1.18 1.67 5.85 -0.56 -1.90 115.31 120.03 1v87 h LEU 71 Ca 0.27 -0.74 0.09 0.00 0.84 0.00 0.00 57.88 58.34 1v87 h LEU 71 Cb 0.04 -0.00 -0.07 0.00 0.37 0.00 0.00 40.66 41.00 1v87 h LEU 71 CO -0.07 0.74 0.58 0.00 -0.34 0.00 0.00 178.44 179.35 1v87 h ALA 72 N 0.26 1.61 -0.10 1.25 0.00 -0.66 -0.57 119.26 121.05 1v87 h ALA 72 Ca -0.00 -0.00 -0.21 0.00 0.00 0.00 0.00 54.91 54.69 1v87 h ALA 72 Cb 0.74 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.32 1v87 h ALA 72 CO 0.00 0.20 -0.79 1.98 0.00 0.00 0.00 179.25 180.65 1v87 h MET 73 N 0.91 0.61 -0.58 0.00 1.85 -1.09 -2.93 114.93 113.69 1v87 h MET 73 Ca 0.42 -0.51 -0.05 0.00 -0.61 0.00 0.00 59.70 58.94 1v87 h MET 73 Cb 0.39 0.11 -0.03 0.00 0.43 0.00 0.00 31.60 32.51 1v87 h MET 73 CO -0.18 1.14 0.14 -0.92 -0.40 0.00 0.00 176.91 176.69 1v87 h TYR 74 N 0.41 0.93 0.67 1.39 3.20 -0.43 -2.40 116.97 120.73 1v87 h TYR 74 Ca -0.05 -0.09 -0.03 0.00 3.14 0.00 0.00 58.73 61.70 1v87 h TYR 74 Cb 1.40 -0.27 0.01 0.00 1.54 0.00 0.00 36.73 39.40 1v87 h TYR 74 CO 0.07 0.77 -0.32 0.00 -1.64 0.00 0.00 178.16 177.04 1v87 h ASN 76 N -1.16 0.14 0.00 0.00 -1.24 -1.50 -3.41 115.58 108.41 1v87 h ASN 76 Ca -0.09 0.02 0.00 0.00 0.71 0.00 0.00 56.30 56.94 1v87 h ASN 76 Cb 0.71 -0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.76 1v87 h ASN 76 CO 0.15 0.04 0.00 0.61 -1.29 0.00 0.00 177.43 176.94 1v87 n GLY 77 N -1.65 0.99 3.24 1.57 0.00 -0.91 -4.99 105.19 103.44 1v87 n GLY 77 Ca 0.21 -1.39 -0.42 0.00 0.00 0.00 0.00 46.02 44.42 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 -1.00 5.81 -0.85 1.61 3.04 -1.25 -4.99 114.94 117.31 1v87 s ASN 78 Ca 0.00 -1.87 -0.18 0.00 0.04 0.00 0.00 52.86 50.85 1v87 s ASN 78 Cb 0.00 -2.05 -0.12 0.00 -1.54 0.00 0.00 41.25 37.53 1v87 s ASN 78 CO 0.00 -0.73 1.99 0.29 -3.04 0.00 0.00 177.10 175.62 1v87 n LYS 79 N 4.98 1.73 -1.24 0.43 5.02 -1.25 -4.62 118.16 123.21 1v87 n LYS 79 Ca -0.09 -1.80 -0.31 0.00 -2.02 0.00 0.00 58.31 54.09 1v87 n LYS 79 Cb 0.41 -2.83 0.09 0.00 -0.02 0.00 0.00 35.03 32.67 1v87 n LYS 79 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 1v87 n ASP 80 N 6.62 6.97 -3.41 4.39 2.03 -1.26 -4.86 116.55 127.01 1v87 n ASP 80 Ca 0.49 -3.65 -0.17 0.00 0.52 0.00 0.00 54.79 51.98 1v87 n ASP 80 Cb 0.34 -0.97 0.08 0.00 -0.72 0.00 0.00 41.12 39.85 1v87 n ASP 80 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1v87 n GLY 81 N -0.76 -0.58 3.48 0.27 0.00 -1.26 -5.01 105.19 101.33 1v87 n GLY 81 Ca 0.57 0.24 -0.12 0.00 0.00 0.00 0.00 46.02 46.71 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 -4.09 -0.50 -0.08 1.61 1.04 -1.26 -4.78 113.70 105.64 1v87 s SER 82 Ca 0.13 0.18 -0.01 0.00 0.48 0.00 0.00 55.95 56.73 1v87 s SER 82 Cb -0.02 0.49 0.03 0.00 0.10 0.00 0.00 66.02 66.62 1v87 s SER 82 CO 0.74 -0.72 -0.02 -0.22 0.98 0.00 0.00 173.24 174.00 1v87 s LEU 83 N -2.20 0.75 -0.05 2.42 1.98 -1.25 -4.95 118.68 115.38 1v87 s LEU 83 Ca -0.00 -0.14 -0.01 0.00 -2.89 0.00 0.00 54.13 51.09 1v87 s LEU 83 Cb -0.01 -0.54 -0.03 0.00 0.66 0.00 0.00 46.19 46.27 1v87 s LEU 83 CO -0.06 -0.17 0.02 -1.58 -1.89 0.00 0.00 176.35 172.67 1v87 s GLN 84 N 1.88 2.96 0.01 1.98 0.74 -1.26 -1.77 119.66 124.21 1v87 s GLN 84 Ca 0.05 -0.46 -0.30 0.00 0.05 0.00 0.00 55.36 54.69 1v87 s GLN 84 Cb -0.12 -2.78 -0.04 0.00 1.10 0.00 0.00 33.01 31.16 1v87 s GLN 84 CO -0.06 0.68 1.14 0.00 -0.55 0.00 0.00 175.29 176.50 1v87 n PRO 86 N 4.28 0.49 0.00 0.00 -0.04 -1.26 -1.11 135.00 137.36 1v87 n PRO 86 Ca 0.09 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.55 1v87 n PRO 86 Cb 0.48 -1.40 0.00 0.00 -0.04 0.00 0.00 33.50 32.54 1v87 n PRO 86 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 1v87 n SER 87 N -0.90 0.00 -0.16 3.54 3.41 -1.26 -4.75 113.62 113.50 1v87 n SER 87 Ca 0.09 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.70 1v87 n SER 87 Cb 0.04 -0.02 0.00 0.00 -0.26 0.00 0.00 64.21 63.97 1v87 n SER 87 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1v87 n LYS 89 N -0.34 -0.84 -2.86 0.00 4.76 -0.26 -4.81 118.16 113.82 1v87 n LYS 89 Ca 0.00 0.10 -0.42 0.00 -2.87 0.00 0.00 58.31 55.12 1v87 n LYS 89 Cb 0.08 -3.40 -0.04 0.00 -1.84 0.00 0.00 35.03 29.83 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 -2.59 4.73 -0.02 -0.18 2.01 -1.25 -4.73 115.64 113.61 1v87 s THR 90 Ca 0.59 1.40 -0.28 0.00 0.31 0.00 0.00 61.69 63.70 1v87 s THR 90 Cb -0.34 -4.21 -0.03 0.00 0.01 0.00 0.00 72.50 67.93 1v87 s THR 90 CO 0.72 -0.27 0.92 -0.63 -0.69 0.00 0.00 174.62 174.67 1v87 s ILE 91 N 3.10 4.91 0.12 1.82 1.01 -1.26 -1.75 121.20 129.15 1v87 s ILE 91 Ca 0.36 1.92 0.04 0.00 0.00 0.00 0.00 60.65 62.97 1v87 s ILE 91 Cb -0.14 -4.25 -0.04 0.00 0.01 0.00 0.00 42.46 38.04 1v87 s ILE 91 CO 0.12 0.17 0.10 -0.31 0.00 0.00 0.00 174.94 175.02 1v87 s TYR 92 N 1.03 3.15 -0.74 3.97 1.51 -0.73 -4.65 117.35 120.89 1v87 s TYR 92 Ca 0.48 0.02 -0.15 0.00 -1.01 0.00 0.00 57.07 56.42 1v87 s TYR 92 Cb -0.20 -1.56 0.02 0.00 -0.11 0.00 0.00 41.96 40.11 1v87 s TYR 92 CO 0.25 0.52 0.29 0.41 -1.11 0.00 0.00 175.55 175.90 1v87 n GLY 93 N 0.07 -0.37 3.63 0.71 0.00 -1.26 -3.78 105.19 104.19 1v87 n GLY 93 Ca -0.09 0.17 -0.05 0.00 0.00 0.00 0.00 46.02 46.05 1v87 n GLY 93 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1v87 s GLU 94 N -6.19 0.22 -0.06 1.61 2.56 -1.26 -4.53 118.70 111.05 1v87 s GLU 94 Ca 0.21 0.10 -0.01 0.00 0.00 0.00 0.00 54.97 55.27 1v87 s GLU 94 Cb -0.12 0.11 0.01 0.00 2.00 0.00 0.00 34.13 36.13 1v87 s GLU 94 CO 0.56 -0.06 0.02 0.36 -0.56 0.00 0.00 175.26 175.58 1v87 n LYS 95 N 0.88 -2.29 -2.04 4.30 -0.00 -1.26 -4.68 118.16 113.07 1v87 n LYS 95 Ca -0.05 0.00 -0.27 0.00 -0.00 0.00 0.00 58.31 57.99 1v87 n LYS 95 Cb 0.58 -3.07 -0.06 0.00 -0.00 0.00 0.00 35.03 32.48 1v87 n LYS 95 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.40 178.39 1v87 s THR 96 N -1.41 3.47 0.00 0.58 2.01 -1.26 -3.84 115.64 115.19 1v87 s THR 96 Ca 0.03 -0.58 0.00 0.00 0.31 0.00 0.00 61.69 61.44 1v87 s THR 96 Cb -0.01 -4.21 0.00 0.00 0.01 0.00 0.00 72.50 68.28 1v87 s THR 96 CO 0.03 -0.93 0.00 0.61 -0.69 0.00 0.00 174.62 173.64 1v87 n GLY 97 N 6.41 2.80 3.74 4.40 0.00 -1.26 -5.03 105.19 116.26 1v87 n GLY 97 Ca 0.42 -0.70 -0.33 0.00 0.00 0.00 0.00 46.02 45.41 1v87 n GLY 97 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1v87 s THR 98 N 0.00 2.78 -0.08 2.61 -1.32 -1.25 -4.90 115.64 113.48 1v87 s THR 98 Ca 0.00 0.35 -0.29 0.00 -1.21 0.00 0.00 61.69 60.54 1v87 s THR 98 Cb 0.00 -2.85 -0.07 0.00 -1.51 0.00 0.00 72.50 68.08 1v87 s THR 98 CO 0.00 -0.23 2.00 -1.58 -2.21 0.00 0.00 174.62 172.60 1v87 s GLN 99 N -4.13 3.77 -0.13 7.08 -0.44 -1.26 -4.77 119.66 119.78 1v87 s GLN 99 Ca 0.69 2.30 -0.29 0.00 -2.50 0.00 0.00 55.36 55.56 1v87 s GLN 99 Cb -0.24 -4.21 -0.04 0.00 -1.64 0.00 0.00 33.01 26.88 1v87 s GLN 99 CO 0.45 -1.37 1.55 -1.25 0.50 0.00 0.00 175.29 175.17 1v87 s PRO 100 N 5.10 4.08 -0.59 1.67 0.04 -1.26 -4.91 135.00 139.13 1v87 s PRO 100 Ca 0.90 1.90 -0.02 0.00 0.04 0.00 0.00 61.00 63.82 1v87 s PRO 100 Cb -0.37 -3.95 0.38 0.00 0.04 0.00 0.00 34.50 30.60 1v87 s PRO 100 CO 0.38 -0.95 2.05 -2.67 0.04 0.00 0.00 177.00 175.85 1v87 n TRP 101 N 7.41 2.77 -0.02 0.56 2.14 -1.26 -4.25 117.44 124.78 1v87 n TRP 101 Ca 0.17 -2.72 -0.02 0.00 2.07 0.00 0.00 57.50 57.00 1v87 n TRP 101 Cb 0.44 -1.32 -0.02 0.00 -0.81 0.00 0.00 31.31 29.60 1v87 n TRP 101 CO 0.00 0.00 0.00 0.41 2.07 0.00 0.00 177.69 180.17 1v87 n GLY 102 N -0.55 -0.08 2.60 -1.67 0.00 -1.26 -5.04 105.19 99.19 1v87 n GLY 102 Ca 0.54 -0.03 -0.45 0.00 0.00 0.00 0.00 46.02 46.08 1v87 n GLY 102 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1v87 n LYS 103 N -2.47 0.00 -0.02 1.61 3.00 -1.26 -4.87 118.16 114.15 1v87 n LYS 103 Ca -0.06 0.00 -0.06 0.00 -0.00 0.00 0.00 58.31 58.19 1v87 n LYS 103 Cb 0.58 -1.08 -0.02 0.00 0.00 0.00 0.00 35.03 34.51 1v87 n LYS 103 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 177.40 177.28 1v87 n MET 104 N 1.80 0.20 -4.14 1.64 0.00 -1.26 -5.10 117.12 110.26 1v87 n MET 104 Ca 0.18 0.08 -0.09 0.00 -0.00 0.00 0.00 57.70 57.87 1v87 n MET 104 Cb 0.02 -0.85 -0.10 0.00 0.00 0.00 0.00 33.22 32.29 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 -2.27 0.80 -0.16 2.12 0.41 -1.26 -5.15 118.70 113.18 1v87 s GLU 105 Ca -0.12 -1.34 -0.08 0.00 -0.41 0.00 0.00 54.97 53.03 1v87 s GLU 105 Cb 0.03 0.05 -0.04 0.00 -1.78 0.00 0.00 34.13 32.39 1v87 s GLU 105 CO 0.16 -0.12 0.11 0.54 -0.49 0.00 0.00 175.26 175.46 1v87 s VAL 106 N -3.84 5.21 -0.07 2.63 0.11 -1.26 -4.99 120.40 118.19 1v87 s VAL 106 Ca 0.14 0.11 -0.05 0.00 -2.93 0.00 0.00 61.98 59.26 1v87 s VAL 106 Cb 0.07 -3.32 -0.03 0.00 -1.53 0.00 0.00 36.38 31.57 1v87 s VAL 106 CO -0.04 0.52 -0.11 0.49 -3.33 0.00 0.00 175.10 172.62 1v87 n PHE 107 N 2.91 0.00 -3.90 1.54 3.72 -1.26 -5.03 117.46 115.44 1v87 n PHE 107 Ca -0.18 0.00 -0.29 0.00 -0.05 0.00 0.00 57.45 56.94 1v87 n PHE 107 Cb 0.53 -0.28 0.02 0.00 -0.94 0.00 0.00 39.48 38.81 1v87 n PHE 107 CO 0.00 0.00 0.00 -2.13 -0.05 0.00 0.00 176.76 174.58 1v87 n ARG 108 N -3.46 -5.05 -3.79 -1.08 3.00 -1.26 -4.96 116.66 100.05 1v87 n ARG 108 Ca -0.15 0.57 -0.28 0.00 -0.00 0.00 0.00 57.85 57.99 1v87 n ARG 108 Cb 0.54 -5.32 -0.16 0.00 0.00 0.00 0.00 32.46 27.51 1v87 n ARG 108 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.63 178.08 1v87 s SER 109 N -3.61 2.99 0.00 6.15 0.15 -1.26 -5.07 113.70 113.05 1v87 s SER 109 Ca 0.48 -0.82 0.00 0.00 0.70 0.00 0.00 55.95 56.31 1v87 s SER 109 Cb -0.25 -0.72 0.00 0.00 -1.71 0.00 0.00 66.02 63.34 1v87 s SER 109 CO 0.84 -0.27 0.00 0.61 1.20 0.00 0.00 173.24 175.61 1v87 n GLY 110 N 4.97 2.57 3.77 9.45 0.00 -1.26 -5.15 105.19 119.54 1v87 n GLY 110 Ca -0.10 0.23 -0.38 0.00 0.00 0.00 0.00 46.02 45.77 1v87 n GLY 110 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1v87 s PRO 111 N -0.27 3.99 0.07 1.61 0.04 -1.26 -5.05 135.00 134.13 1v87 s PRO 111 Ca 0.00 1.87 0.08 0.00 0.04 0.00 0.00 61.00 62.99 1v87 s PRO 111 Cb 0.00 -2.64 -0.03 0.00 0.04 0.00 0.00 34.50 31.87 1v87 s PRO 111 CO 0.00 -0.38 -0.20 -1.12 0.04 0.00 0.00 177.00 175.33 1v87 s SER 112 N -1.12 3.67 -0.92 6.66 0.01 -1.26 -5.08 113.70 115.66 1v87 s SER 112 Ca 0.58 -0.53 -0.11 0.00 1.31 0.00 0.00 55.95 57.21 1v87 s SER 112 Cb -0.31 -0.50 0.24 0.00 0.21 0.00 0.00 66.02 65.66 1v87 s SER 112 CO 0.39 0.23 0.86 -0.55 0.41 0.00 0.00 173.24 174.58 1v87 s SER 113 N -1.67 6.81 0.00 2.44 0.15 -1.26 -5.29 113.70 114.88 1v87 s SER 113 Ca 0.15 -3.07 0.00 0.00 0.70 0.00 0.00 55.95 53.73 1v87 s SER 113 Cb -0.10 -2.17 0.00 0.00 -1.71 0.00 0.00 66.02 62.04 1v87 s SER 113 CO 0.06 -0.44 0.45 0.61 1.20 0.00 0.00 173.24 175.13