#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1jj2 s ILE 2 N 0.00 1.98 0.11 -0.61 -4.36 -1.26 -5.11 121.20 111.95 1jj2 s ILE 2 Ca 0.00 0.00 0.02 0.00 -0.26 0.00 0.00 60.65 60.41 1jj2 s ILE 2 Cb 0.00 -2.97 -0.04 0.00 1.25 0.00 0.00 42.46 40.70 1jj2 s ILE 2 CO 0.00 0.00 -0.06 -0.44 0.24 0.00 0.00 174.94 174.68 1jj2 s SER 3 N -4.74 1.14 0.15 4.36 0.01 -1.26 -5.09 113.70 108.26 1jj2 s SER 3 Ca 0.71 -1.02 -0.31 0.00 1.31 0.00 0.00 55.95 56.63 1jj2 s SER 3 Cb -0.06 0.10 -0.11 0.00 0.21 0.00 0.00 66.02 66.16 1jj2 s SER 3 CO 0.52 -0.48 1.75 -0.31 0.41 0.00 0.00 173.24 175.14 1jj2 s TYR 4 N -3.63 2.53 -2.05 2.43 1.51 -1.26 -4.86 117.35 112.02 1jj2 s TYR 4 Ca 0.13 0.19 0.27 0.00 -1.01 0.00 0.00 57.07 56.66 1jj2 s TYR 4 Cb 0.05 -4.13 0.96 0.00 -0.11 0.00 0.00 41.96 38.74 1jj2 s TYR 4 CO -0.04 -4.46 1.69 -1.13 -1.11 0.00 0.00 175.55 170.50 1jj2 n SER 5 N 4.90 1.12 -4.21 2.29 3.41 -1.26 -4.85 113.62 115.02 1jj2 n SER 5 Ca 0.17 -1.10 -0.23 0.00 -0.26 0.00 0.00 58.87 57.44 1jj2 n SER 5 Cb 0.37 0.05 -0.14 0.00 -0.26 0.00 0.00 64.21 64.24 1jj2 n SER 5 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1jj2 s VAL 6 N -2.28 1.46 0.41 -3.33 1.01 -1.26 -5.13 120.40 111.27 1jj2 s VAL 6 Ca 0.31 -1.17 -0.23 0.00 0.00 0.00 0.00 61.98 60.88 1jj2 s VAL 6 Cb 0.20 -1.29 -0.09 0.00 0.00 0.00 0.00 36.38 35.20 1jj2 s VAL 6 CO 0.44 0.09 1.04 -1.61 0.00 0.00 0.00 175.10 175.06 1jj2 s GLU 7 N -1.27 4.12 -0.05 2.72 2.02 -1.26 -5.05 118.70 119.92 1jj2 s GLU 7 Ca 0.05 1.48 -0.02 0.00 0.02 0.00 0.00 54.97 56.50 1jj2 s GLU 7 Cb -0.09 -2.47 0.04 0.00 0.10 0.00 0.00 34.13 31.71 1jj2 s GLU 7 CO 0.02 -0.18 0.09 0.00 0.02 0.00 0.00 175.26 175.21 1jj2 s ALA 8 N -1.72 0.04 -0.26 5.21 0.00 -1.26 -5.11 121.76 118.66 1jj2 s ALA 8 Ca 0.59 0.37 -0.29 0.00 0.00 0.00 0.00 51.96 52.63 1jj2 s ALA 8 Cb -0.21 -0.58 -0.01 0.00 0.00 0.00 0.00 23.12 22.32 1jj2 s ALA 8 CO 0.26 -0.39 1.49 0.34 0.00 0.00 0.00 175.76 177.46 1jj2 s ASP 9 N 1.86 6.48 0.50 0.00 -1.08 -1.26 -4.90 116.67 118.26 1jj2 s ASP 9 Ca -0.00 1.43 0.25 0.00 -0.52 0.00 0.00 52.55 53.71 1jj2 s ASP 9 Cb -0.12 -2.54 1.33 0.00 -1.46 0.00 0.00 42.92 40.13 1jj2 s ASP 9 CO -0.04 -1.21 1.91 1.55 0.52 0.00 0.00 175.17 177.91 1jj2 h PRO 10 N 10.22 0.13 0.00 4.34 0.13 -2.00 -1.74 132.00 143.09 1jj2 h PRO 10 Ca -0.31 -0.01 -0.03 0.00 -0.87 0.00 0.00 66.00 64.79 1jj2 h PRO 10 Cb 1.13 -0.03 -0.00 0.00 0.13 0.00 0.00 31.00 32.23 1jj2 h PRO 10 CO 1.02 0.08 -0.12 -0.44 -0.23 0.00 0.00 178.00 178.31 1jj2 h ASP 11 N 0.13 0.00 0.00 1.44 3.32 -2.03 -3.27 116.42 116.01 1jj2 h ASP 11 Ca 0.39 0.00 -0.05 0.00 0.02 0.00 0.00 57.03 57.39 1jj2 h ASP 11 Cb 1.33 0.00 -0.11 0.00 0.22 0.00 0.00 39.33 40.77 1jj2 h ASP 11 CO -0.06 0.12 -0.55 0.35 -1.72 0.00 0.00 179.24 177.39 1jj2 n THR 12 N -3.22 0.88 -3.95 0.35 -2.24 -0.89 -5.06 114.28 100.16 1jj2 n THR 12 Ca 0.01 -1.47 -0.10 0.00 -2.27 0.00 0.00 64.05 60.22 1jj2 n THR 12 Cb 0.42 0.32 -0.12 0.00 -2.10 0.00 0.00 70.33 68.86 1jj2 n THR 12 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 1jj2 s THR 13 N -1.31 0.08 -0.01 4.28 2.01 -0.71 -2.38 115.64 117.61 1jj2 s THR 13 Ca 0.25 -0.67 0.05 0.00 0.31 0.00 0.00 61.69 61.62 1jj2 s THR 13 Cb 0.25 -0.20 -0.01 0.00 0.01 0.00 0.00 72.50 72.55 1jj2 s THR 13 CO -0.06 -0.37 -0.15 0.00 -0.69 0.00 0.00 174.62 173.36 1jj2 s ALA 14 N -1.08 1.22 0.32 7.40 0.00 -0.43 -4.76 121.76 124.42 1jj2 s ALA 14 Ca -0.12 -0.65 0.08 0.00 0.00 0.00 0.00 51.96 51.27 1jj2 s ALA 14 Cb -0.07 -0.30 -0.06 0.00 0.00 0.00 0.00 23.12 22.69 1jj2 s ALA 14 CO -0.01 0.29 -0.07 0.15 0.00 0.00 0.00 175.76 176.12 1jj2 s LYS 15 N -0.42 1.70 -0.07 0.00 1.02 -1.26 0.30 119.74 121.02 1jj2 s LYS 15 Ca 0.05 -1.88 -0.30 0.00 0.02 0.00 0.00 55.97 53.87 1jj2 s LYS 15 Cb -0.06 -1.44 0.11 0.00 -0.52 0.00 0.00 37.83 35.92 1jj2 s LYS 15 CO -0.00 0.08 0.92 0.00 -0.92 0.00 0.00 175.35 175.43 1jj2 s ALA 16 N -2.80 -1.86 0.03 5.17 0.00 -0.63 -4.61 121.76 117.05 1jj2 s ALA 16 Ca 0.31 1.25 -0.17 0.00 0.00 0.00 0.00 51.96 53.36 1jj2 s ALA 16 Cb 0.03 -0.02 0.03 0.00 0.00 0.00 0.00 23.12 23.17 1jj2 s ALA 16 CO 0.15 -0.53 0.37 -1.64 0.00 0.00 0.00 175.76 174.10 1jj2 s MET 17 N -2.28 0.86 0.05 0.00 -1.94 -1.26 -1.39 119.30 113.33 1jj2 s MET 17 Ca 0.02 -0.37 0.06 0.00 -1.71 0.00 0.00 55.69 53.69 1jj2 s MET 17 Cb -0.01 0.38 -0.03 0.00 2.01 0.00 0.00 34.83 37.18 1jj2 s MET 17 CO -0.04 -0.28 -0.15 -0.51 -0.01 0.00 0.00 175.02 174.03 1jj2 s LEU 18 N -1.92 2.78 -0.08 -0.03 1.43 -0.67 -4.96 118.68 115.24 1jj2 s LEU 18 Ca -0.06 -0.38 0.03 0.00 -1.03 0.00 0.00 54.13 52.69 1jj2 s LEU 18 Cb -0.01 -1.62 0.01 0.00 0.03 0.00 0.00 46.19 44.59 1jj2 s LEU 18 CO -0.02 0.24 -0.18 -0.13 0.23 0.00 0.00 176.35 176.50 1jj2 s ARG 19 N -1.59 2.35 -1.51 1.70 1.81 -1.26 -2.30 118.95 118.15 1jj2 s ARG 19 Ca 0.16 -0.65 -0.01 0.00 -1.72 0.00 0.00 55.73 53.52 1jj2 s ARG 19 Cb -0.11 -1.84 0.00 0.00 -0.45 0.00 0.00 34.95 32.55 1jj2 s ARG 19 CO 0.07 0.11 0.11 0.39 -0.68 0.00 0.00 175.30 175.31 1jj2 n GLU 20 N 3.64 -1.51 -2.54 3.54 1.02 -1.08 -4.89 120.64 118.82 1jj2 n GLU 20 Ca -0.21 0.17 -0.41 0.00 -0.02 0.00 0.00 57.16 56.69 1jj2 n GLU 20 Cb 0.52 -3.80 -0.04 0.00 -0.02 0.00 0.00 31.44 28.10 1jj2 n GLU 20 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 1jj2 s ARG 21 N -7.18 4.61 -1.02 3.49 1.81 0.41 -4.51 118.95 116.55 1jj2 s ARG 21 Ca 0.01 1.69 -0.16 0.00 -1.72 0.00 0.00 55.73 55.55 1jj2 s ARG 21 Cb -0.00 -3.29 0.16 0.00 -0.45 0.00 0.00 34.95 31.37 1jj2 s ARG 21 CO 0.97 0.09 1.19 -0.65 -0.68 0.00 0.00 175.30 176.23 1jj2 s GLN 22 N -0.34 3.80 0.27 3.54 -0.21 -1.26 0.38 119.66 125.84 1jj2 s GLN 22 Ca 0.49 -2.21 -0.11 0.00 0.02 0.00 0.00 55.36 53.55 1jj2 s GLN 22 Cb -0.29 -4.89 -0.00 0.00 1.00 0.00 0.00 33.01 28.83 1jj2 s GLN 22 CO 0.34 -1.68 0.48 0.00 -2.12 0.00 0.00 175.29 172.31 1jj2 s MET 23 N 1.79 1.62 0.02 2.91 0.23 -1.23 -5.01 119.30 119.63 1jj2 s MET 23 Ca 0.34 -1.34 -0.30 0.00 -1.03 0.00 0.00 55.69 53.36 1jj2 s MET 23 Cb -0.05 0.47 -0.07 0.00 -1.53 0.00 0.00 34.83 33.64 1jj2 s MET 23 CO -0.06 -0.68 1.69 0.45 -2.03 0.00 0.00 175.02 174.40 1jj2 s SER 24 N -3.06 6.61 0.24 -1.18 0.15 -1.26 -4.52 113.70 110.69 1jj2 s SER 24 Ca 0.24 2.42 0.05 0.00 0.70 0.00 0.00 55.95 59.35 1jj2 s SER 24 Cb -0.01 -2.55 0.27 0.00 -1.71 0.00 0.00 66.02 62.03 1jj2 s SER 24 CO 0.11 -0.92 1.57 0.15 1.20 0.00 0.00 173.24 175.35 1jj2 h PHE 25 N 9.07 0.29 -0.30 3.44 3.57 -1.95 -2.42 116.94 128.64 1jj2 h PHE 25 Ca -0.42 -0.11 -0.16 0.00 3.53 0.00 0.00 57.97 60.81 1jj2 h PHE 25 Cb 1.20 -0.05 -0.01 0.00 2.79 0.00 0.00 35.95 39.88 1jj2 h PHE 25 CO 0.84 0.76 -0.44 0.87 -2.23 0.00 0.00 178.31 178.11 1jj2 h LYS 26 N 0.17 0.77 -0.02 1.11 1.57 -2.01 -2.03 116.57 116.14 1jj2 h LYS 26 Ca -0.00 -0.43 -0.09 0.00 -1.87 0.00 0.00 60.65 58.26 1jj2 h LYS 26 Cb 1.08 0.03 -0.01 0.00 0.08 0.00 0.00 32.23 33.40 1jj2 h LYS 26 CO 0.09 1.06 -0.39 0.45 -0.57 0.00 0.00 179.45 180.09 1jj2 h HIS 27 N 0.62 0.04 -0.37 -1.35 3.86 -1.94 -2.93 115.15 113.08 1jj2 h HIS 27 Ca 0.04 -0.01 -0.15 0.00 -1.16 0.00 0.00 60.37 59.09 1jj2 h HIS 27 Cb 1.01 -0.01 -0.01 0.00 1.06 0.00 0.00 27.41 29.46 1jj2 h HIS 27 CO 0.05 0.42 -0.37 0.77 0.86 0.00 0.00 177.93 179.67 1jj2 h SER 28 N 0.03 0.96 -0.55 2.45 0.02 -0.98 -1.81 113.55 113.67 1jj2 h SER 28 Ca 0.00 -0.47 -0.03 0.00 -0.84 0.00 0.00 61.79 60.46 1jj2 h SER 28 Cb 0.70 -0.27 -0.02 0.00 0.14 0.00 0.00 62.40 62.95 1jj2 h SER 28 CO 0.05 1.23 0.24 0.11 -1.14 0.00 0.00 176.83 177.32 1jj2 h LYS 29 N 0.71 0.81 -0.33 3.45 1.57 -1.28 -0.78 116.57 120.72 1jj2 h LYS 29 Ca 0.06 -0.13 -0.00 0.00 -1.87 0.00 0.00 60.65 58.70 1jj2 h LYS 29 Cb 0.96 -0.14 -0.02 0.00 0.08 0.00 0.00 32.23 33.12 1jj2 h LYS 29 CO 0.09 0.69 0.19 0.00 -0.57 0.00 0.00 179.45 179.85 1jj2 h ALA 30 N 1.08 0.42 -0.05 3.86 0.00 -1.45 -0.47 119.26 122.65 1jj2 h ALA 30 Ca 0.19 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 55.03 1jj2 h ALA 30 Cb 0.17 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 17.82 1jj2 h ALA 30 CO -0.02 -0.07 0.01 0.82 0.00 0.00 0.00 179.25 179.99 1jj2 h ILE 31 N 0.41 1.19 -0.00 0.00 2.04 -1.17 -1.98 117.51 118.00 1jj2 h ILE 31 Ca 0.12 -0.57 0.02 0.00 1.00 0.00 0.00 64.86 65.43 1jj2 h ILE 31 Cb 0.04 1.48 -0.03 0.00 -0.74 0.00 0.00 36.82 37.56 1jj2 h ILE 31 CO -0.02 0.16 -0.14 0.00 0.00 0.00 0.00 178.15 178.14 1jj2 h ALA 32 N 0.79 -0.17 -0.87 1.87 0.00 -1.06 -1.52 119.26 118.31 1jj2 h ALA 32 Ca 0.02 0.01 0.20 0.00 0.00 0.00 0.00 54.91 55.13 1jj2 h ALA 32 Cb 0.24 0.25 -0.12 0.00 0.00 0.00 0.00 17.79 18.16 1jj2 h ALA 32 CO 0.00 -0.64 0.37 -0.09 0.00 0.00 0.00 179.25 178.90 1jj2 h ARG 33 N -0.24 0.41 -0.07 0.00 2.43 -0.99 -1.99 114.38 113.92 1jj2 h ARG 33 Ca 0.05 -0.02 -0.22 0.00 -0.81 0.00 0.00 59.98 58.98 1jj2 h ARG 33 Cb 0.30 -0.09 0.01 0.00 -0.42 0.00 0.00 29.97 29.77 1jj2 h ARG 33 CO -0.14 0.27 -0.84 1.49 -1.51 0.00 0.00 179.97 179.24 1jj2 h GLU 34 N 0.42 0.58 0.00 0.20 4.57 -0.68 -3.33 114.58 116.35 1jj2 h GLU 34 Ca 0.52 -0.53 0.00 0.00 -1.18 0.00 0.00 59.36 58.17 1jj2 h GLU 34 Cb 0.94 0.13 0.00 0.00 -0.16 0.00 0.00 28.75 29.66 1jj2 h GLU 34 CO -0.50 1.15 -0.50 0.44 -1.18 0.00 0.00 179.01 178.42 1jj2 n ILE 35 N -3.85 0.31 -1.68 2.32 -5.35 -0.64 -4.87 119.36 105.60 1jj2 n ILE 35 Ca -0.07 -0.22 -0.40 0.00 -0.27 0.00 0.00 62.75 61.79 1jj2 n ILE 35 Cb 0.78 -0.14 0.02 0.00 -1.74 0.00 0.00 39.64 38.56 1jj2 n ILE 35 CO 0.00 0.00 0.00 1.17 -1.76 0.00 0.00 176.55 175.96 1jj2 n LYS 36 N -2.01 1.61 0.00 6.28 4.81 -0.79 -1.27 118.16 126.79 1jj2 n LYS 36 Ca 0.04 0.58 0.00 0.00 -0.87 0.00 0.00 58.31 58.06 1jj2 n LYS 36 Cb 0.42 -2.33 0.00 0.00 0.02 0.00 0.00 35.03 33.14 1jj2 n LYS 36 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1jj2 n GLY 37 N 0.94 2.65 3.91 3.14 0.00 -0.67 -5.01 105.19 110.15 1jj2 n GLY 37 Ca 0.09 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.84 1jj2 n GLY 37 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1jj2 s LYS 38 N -0.26 2.62 0.32 1.61 1.02 -0.39 -4.67 119.74 120.00 1jj2 s LYS 38 Ca 0.00 0.05 -0.20 0.00 0.02 0.00 0.00 55.97 55.83 1jj2 s LYS 38 Cb 0.00 -2.16 -0.09 0.00 -0.52 0.00 0.00 37.83 35.06 1jj2 s LYS 38 CO 0.00 -1.00 0.84 0.99 -0.92 0.00 0.00 175.35 175.25 1jj2 s THR 39 N -3.20 4.46 0.18 2.17 2.01 -1.26 -0.70 115.64 119.30 1jj2 s THR 39 Ca 0.57 1.39 -0.17 0.00 0.31 0.00 0.00 61.69 63.80 1jj2 s THR 39 Cb -0.11 -3.77 0.15 0.00 0.01 0.00 0.00 72.50 68.78 1jj2 s THR 39 CO 0.47 -0.03 1.64 0.00 -0.69 0.00 0.00 174.62 176.01 1jj2 h ALA 40 N 2.71 0.25 -0.88 7.40 0.00 -0.77 0.29 119.26 128.26 1jj2 h ALA 40 Ca -0.48 0.18 -0.00 0.00 0.00 0.00 0.00 54.91 54.61 1jj2 h ALA 40 Cb 1.18 0.45 -0.04 0.00 0.00 0.00 0.00 17.79 19.38 1jj2 h ALA 40 CO 0.64 -0.49 0.53 0.78 0.00 0.00 0.00 179.25 180.71 1jj2 h GLY 41 N -0.05 1.27 0.92 0.00 0.00 -1.42 -1.18 103.07 102.61 1jj2 h GLY 41 Ca 0.24 -0.52 -0.02 0.00 0.00 0.00 0.00 47.33 47.02 1jj2 h GLY 41 CO -0.53 0.50 0.12 0.83 0.00 0.00 0.00 176.54 177.46 1jj2 h GLU 42 N 1.20 0.53 -0.43 4.80 5.08 -1.33 -2.14 114.58 122.30 1jj2 h GLU 42 Ca 0.32 -0.11 0.05 0.00 -1.00 0.00 0.00 59.36 58.62 1jj2 h GLU 42 Cb -0.06 -0.08 -0.05 0.00 0.50 0.00 0.00 28.75 29.06 1jj2 h GLU 42 CO -0.06 0.55 0.15 0.00 -1.00 0.00 0.00 179.01 178.65 1jj2 h ALA 43 N 0.96 0.51 -0.22 3.43 0.00 0.05 0.96 119.26 124.96 1jj2 h ALA 43 Ca 0.11 0.05 0.02 0.00 0.00 0.00 0.00 54.91 55.10 1jj2 h ALA 43 Cb 0.23 0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.03 1jj2 h ALA 43 CO -0.01 -0.24 0.09 0.28 0.00 0.00 0.00 179.25 179.37 1jj2 h VAL 44 N 0.31 0.97 -0.84 0.00 2.07 -1.01 -0.17 116.25 117.58 1jj2 h VAL 44 Ca 0.20 -0.07 -0.01 0.00 0.82 0.00 0.00 66.70 67.64 1jj2 h VAL 44 Cb 0.20 0.75 -0.04 0.00 -1.52 0.00 0.00 31.29 30.68 1jj2 h VAL 44 CO -0.21 0.04 0.49 0.44 0.02 0.00 0.00 177.57 178.35 1jj2 h ASP 45 N 0.20 1.02 0.33 0.57 3.32 -0.89 -1.77 116.42 119.20 1jj2 h ASP 45 Ca 0.09 -0.08 -0.01 0.00 0.02 0.00 0.00 57.03 57.05 1jj2 h ASP 45 Cb 0.04 -0.26 0.00 0.00 0.22 0.00 0.00 39.33 39.34 1jj2 h ASP 45 CO -0.08 0.80 -0.17 0.22 -1.72 0.00 0.00 179.24 178.30 1jj2 h TYR 46 N 1.16 -0.43 0.00 4.55 3.20 -0.26 -2.26 116.97 122.93 1jj2 h TYR 46 Ca 0.30 -0.01 -0.03 0.00 3.14 0.00 0.00 58.73 62.13 1jj2 h TYR 46 Cb -0.02 0.15 -0.00 0.00 1.54 0.00 0.00 36.73 38.39 1jj2 h TYR 46 CO 0.00 -0.27 -0.15 -0.07 -1.64 0.00 0.00 178.16 176.03 1jj2 h LEU 47 N -0.46 0.00 -0.76 2.82 3.38 -0.87 -1.30 115.31 118.13 1jj2 h LEU 47 Ca -0.04 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 57.80 1jj2 h LEU 47 Cb 0.36 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.09 1jj2 h LEU 47 CO 0.07 0.15 -0.59 -0.33 0.09 0.00 0.00 178.44 177.82 1jj2 h GLU 48 N 0.00 0.09 -0.06 1.13 5.08 -1.09 -0.62 114.58 119.11 1jj2 h GLU 48 Ca -0.00 -0.06 -0.18 0.00 -1.00 0.00 0.00 59.36 58.12 1jj2 h GLU 48 Cb 0.29 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.54 1jj2 h GLU 48 CO 0.02 0.66 -0.73 0.00 -1.00 0.00 0.00 179.01 177.95 1jj2 h ALA 49 N 1.33 0.63 -0.01 3.43 0.00 -0.68 -0.16 119.26 123.81 1jj2 h ALA 49 Ca -0.01 -0.62 -0.00 0.00 0.00 0.00 0.00 54.91 54.29 1jj2 h ALA 49 Cb 1.07 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.79 1jj2 h ALA 49 CO 0.08 0.78 0.00 0.28 0.00 0.00 0.00 179.25 180.40 1jj2 h VAL 50 N 0.22 1.19 -0.70 0.00 2.07 -0.96 0.22 116.25 118.30 1jj2 h VAL 50 Ca -0.03 -0.56 0.01 0.00 0.82 0.00 0.00 66.70 66.94 1jj2 h VAL 50 Cb 1.30 1.56 -0.03 0.00 -1.52 0.00 0.00 31.29 32.59 1jj2 h VAL 50 CO 0.12 0.15 0.46 0.40 0.02 0.00 0.00 177.57 178.72 1jj2 h ILE 51 N -0.22 1.18 0.00 4.57 2.04 -1.04 -0.71 117.51 123.34 1jj2 h ILE 51 Ca 0.00 -0.32 -0.04 0.00 1.00 0.00 0.00 64.86 65.50 1jj2 h ILE 51 Cb 0.24 0.15 -0.01 0.00 -0.74 0.00 0.00 36.82 36.46 1jj2 h ILE 51 CO 0.00 0.17 -0.18 -0.08 0.00 0.00 0.00 178.15 178.06 1jj2 h GLU 52 N 0.94 0.00 0.00 2.37 4.57 -0.71 -3.47 114.58 118.28 1jj2 h GLU 52 Ca 0.26 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.44 1jj2 h GLU 52 Cb -0.11 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.48 1jj2 h GLU 52 CO -0.06 0.18 0.00 0.41 -1.18 0.00 0.00 179.01 178.37 1jj2 n GLY 53 N 0.43 0.85 0.06 1.92 0.00 0.50 -4.95 105.19 104.00 1jj2 n GLY 53 Ca 0.01 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.14 1jj2 n GLY 53 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1jj2 n ASP 54 N 0.00 0.90 -3.75 1.61 8.00 0.37 -4.85 116.55 118.83 1jj2 n ASP 54 Ca 0.00 -0.75 -0.22 0.00 0.71 0.00 0.00 54.79 54.52 1jj2 n ASP 54 Cb 0.00 0.61 -0.18 0.00 -0.02 0.00 0.00 41.12 41.54 1jj2 n ASP 54 CO 0.00 0.00 0.00 -1.58 -0.39 0.00 0.00 177.20 175.23 1jj2 s GLN 55 N -2.92 0.49 0.33 -1.24 2.00 -1.01 -4.95 119.66 112.35 1jj2 s GLN 55 Ca 0.11 0.15 -0.14 0.00 -2.00 0.00 0.00 55.36 53.48 1jj2 s GLN 55 Cb 0.17 -0.91 -0.09 0.00 0.80 0.00 0.00 33.01 32.98 1jj2 s GLN 55 CO 0.76 -0.31 0.74 -1.25 -0.50 0.00 0.00 175.29 174.72 1jj2 s PRO 56 N 2.01 3.97 -0.30 1.67 0.04 -1.26 -3.84 135.00 137.28 1jj2 s PRO 56 Ca 0.05 0.63 -0.11 0.00 0.04 0.00 0.00 61.00 61.61 1jj2 s PRO 56 Cb -0.12 -2.43 -0.04 0.00 0.04 0.00 0.00 34.50 31.95 1jj2 s PRO 56 CO -0.05 0.14 0.20 0.08 0.04 0.00 0.00 177.00 177.41 1jj2 s VAL 57 N -2.03 5.25 0.17 -0.36 1.01 0.92 -4.87 120.40 120.50 1jj2 s VAL 57 Ca 0.54 0.03 -0.32 0.00 0.00 0.00 0.00 61.98 62.23 1jj2 s VAL 57 Cb -0.10 -3.56 -0.11 0.00 0.00 0.00 0.00 36.38 32.60 1jj2 s VAL 57 CO 0.19 0.17 1.78 -2.84 0.00 0.00 0.00 175.10 174.40 1jj2 s PRO 58 N 1.74 4.13 -0.68 2.72 0.02 -1.26 -1.80 135.00 139.86 1jj2 s PRO 58 Ca 0.07 2.61 -0.11 0.00 0.02 0.00 0.00 61.00 63.59 1jj2 s PRO 58 Cb -0.16 -3.31 0.18 0.00 0.02 0.00 0.00 34.50 31.22 1jj2 s PRO 58 CO 0.11 -0.80 0.59 -0.06 -0.33 0.00 0.00 177.00 176.51 1jj2 s PHE 59 N 1.89 3.56 -0.13 6.54 2.99 -0.45 -4.86 117.98 127.52 1jj2 s PHE 59 Ca 0.78 -2.01 0.16 0.00 0.00 0.00 0.00 56.93 55.86 1jj2 s PHE 59 Cb -0.48 -3.64 -0.09 0.00 0.00 0.00 0.00 43.02 38.81 1jj2 s PHE 59 CO 0.34 -0.97 0.98 0.87 -0.00 0.00 0.00 175.22 176.44 1jj2 h LYS 60 N 7.91 0.00 0.00 0.44 1.57 -1.92 -3.40 116.57 121.18 1jj2 h LYS 60 Ca -0.03 0.00 -0.23 0.00 -1.87 0.00 0.00 60.65 58.51 1jj2 h LYS 60 Cb 1.04 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 33.31 1jj2 h LYS 60 CO 0.81 0.34 -1.81 0.94 -0.57 0.00 0.00 179.45 179.16 1jj2 n GLN 61 N -2.96 0.32 -3.01 3.15 7.27 -1.26 -4.77 117.38 116.12 1jj2 n GLN 61 Ca -0.07 0.11 -0.43 0.00 0.07 0.00 0.00 57.00 56.69 1jj2 n GLN 61 Cb 0.81 -1.12 0.01 0.00 2.41 0.00 0.00 30.24 32.34 1jj2 n GLN 61 CO 0.00 0.00 0.00 0.72 0.07 0.00 0.00 177.06 177.85 1jj2 n HIS 62 N -3.36 2.47 -0.46 3.69 8.25 -1.26 -4.73 115.22 119.81 1jj2 n HIS 62 Ca -0.27 -2.67 0.05 0.00 -0.26 0.00 0.00 57.72 54.57 1jj2 n HIS 62 Cb 0.73 -1.30 0.11 0.00 1.12 0.00 0.00 29.99 30.65 1jj2 n HIS 62 CO 0.00 0.00 0.00 0.27 0.64 0.00 0.00 176.34 177.25 1jj2 n ASN 63 N 1.46 2.61 -4.66 0.41 6.94 -1.26 -4.95 115.26 115.80 1jj2 n ASN 63 Ca 0.26 -2.43 -0.42 0.00 -0.02 0.00 0.00 54.58 51.97 1jj2 n ASN 63 Cb 0.34 -0.25 -0.03 0.00 -2.36 0.00 0.00 39.78 37.48 1jj2 n ASN 63 CO 0.00 0.00 0.00 -0.94 -1.03 0.00 0.00 177.26 175.29 1jj2 s SER 64 N -1.61 6.51 0.00 0.53 1.04 -1.26 -1.30 113.70 117.62 1jj2 s SER 64 Ca 0.20 2.55 0.00 0.00 0.48 0.00 0.00 55.95 59.18 1jj2 s SER 64 Cb 0.15 -2.53 0.00 0.00 0.10 0.00 0.00 66.02 63.74 1jj2 s SER 64 CO 0.06 -1.01 0.00 0.61 0.98 0.00 0.00 173.24 173.88 1jj2 n GLY 65 N 4.39 0.78 3.69 7.32 0.00 -1.26 -5.00 105.19 115.11 1jj2 n GLY 65 Ca 0.19 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.79 1jj2 n GLY 65 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1jj2 s VAL 66 N -3.14 4.61 0.48 1.61 1.01 -0.42 -5.01 120.40 119.55 1jj2 s VAL 66 Ca 0.00 1.89 -0.22 0.00 0.00 0.00 0.00 61.98 63.65 1jj2 s VAL 66 Cb 0.00 -4.21 -0.07 0.00 0.00 0.00 0.00 36.38 32.10 1jj2 s VAL 66 CO 0.00 0.02 1.18 -0.83 0.00 0.00 0.00 175.10 175.47 1jj2 s GLY 67 N 1.20 2.77 0.60 4.51 0.00 -1.26 -4.75 107.32 110.39 1jj2 s GLY 67 Ca 0.51 0.96 -0.17 0.00 0.00 0.00 0.00 44.72 46.02 1jj2 s GLY 67 CO 0.20 1.41 1.13 0.30 0.00 0.00 0.00 173.10 176.15 1jj2 s HIS 68 N -1.55 2.61 -0.08 1.90 0.09 -1.26 -3.50 115.29 113.50 1jj2 s HIS 68 Ca 0.66 1.55 0.02 0.00 -0.00 0.00 0.00 55.06 57.28 1jj2 s HIS 68 Cb -0.29 -3.26 0.02 0.00 -0.00 0.00 0.00 32.58 29.04 1jj2 s HIS 68 CO 0.35 -1.70 -0.11 0.15 -0.00 0.00 0.00 174.74 173.43 1jj2 s LYS 69 N -3.64 1.72 0.38 1.40 -0.14 0.19 -4.88 119.74 114.77 1jj2 s LYS 69 Ca 0.71 -0.39 0.06 0.00 -1.36 0.00 0.00 55.97 54.99 1jj2 s LYS 69 Cb -0.23 -1.51 0.76 0.00 -1.68 0.00 0.00 37.83 35.17 1jj2 s LYS 69 CO 0.34 -0.05 1.97 0.66 -0.76 0.00 0.00 175.35 177.51 1jj2 h SER 70 N 7.30 0.44 0.68 2.83 4.64 -1.97 -2.52 113.55 124.96 1jj2 h SER 70 Ca -0.31 -0.05 0.00 0.00 -0.47 0.00 0.00 61.79 60.96 1jj2 h SER 70 Cb 1.17 -0.11 0.00 0.00 -0.31 0.00 0.00 62.40 63.15 1jj2 h SER 70 CO 0.46 0.43 0.00 0.29 -0.87 0.00 0.00 176.83 177.14 1jj2 n LYS 71 N -4.38 0.04 -2.54 4.77 5.02 -1.26 -4.71 118.16 115.11 1jj2 n LYS 71 Ca 0.02 0.13 -0.43 0.00 -2.02 0.00 0.00 58.31 56.01 1jj2 n LYS 71 Cb 0.16 -1.50 -0.02 0.00 -0.02 0.00 0.00 35.03 33.64 1jj2 n LYS 71 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1jj2 s VAL 72 N -2.95 4.45 -0.19 -0.18 1.01 -0.95 -4.96 120.40 116.63 1jj2 s VAL 72 Ca 0.11 1.75 -0.09 0.00 0.00 0.00 0.00 61.98 63.76 1jj2 s VAL 72 Cb 0.14 -4.13 -0.04 0.00 0.00 0.00 0.00 36.38 32.34 1jj2 s VAL 72 CO 0.38 -0.06 0.09 -0.62 0.00 0.00 0.00 175.10 174.89 1jj2 s ASP 73 N 1.45 5.87 0.00 3.32 2.15 -1.26 -4.29 116.67 123.91 1jj2 s ASP 73 Ca 0.52 0.14 0.00 0.00 0.43 0.00 0.00 52.55 53.63 1jj2 s ASP 73 Cb -0.21 -2.02 0.00 0.00 -0.30 0.00 0.00 42.92 40.39 1jj2 s ASP 73 CO 0.17 0.17 0.00 0.61 -0.17 0.00 0.00 175.17 175.95 1jj2 n GLY 74 N 3.59 0.46 3.81 2.66 0.00 -1.26 -4.96 105.19 109.50 1jj2 n GLY 74 Ca -0.16 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.77 1jj2 n GLY 74 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 1jj2 s TRP 75 N -1.98 0.07 0.03 1.61 -0.11 -1.26 -5.13 118.94 112.18 1jj2 s TRP 75 Ca 0.00 -0.70 0.00 0.00 1.22 0.00 0.00 56.10 56.62 1jj2 s TRP 75 Cb 0.00 0.81 0.00 0.00 -1.50 0.00 0.00 33.47 32.78 1jj2 s TRP 75 CO 0.00 -1.51 0.00 -0.40 -4.62 0.00 0.00 176.95 170.42 1jj2 n ASP 76 N -1.23 0.37 -4.75 5.86 5.68 -1.26 -4.73 116.55 116.48 1jj2 n ASP 76 Ca -0.08 0.05 -0.40 0.00 -0.50 0.00 0.00 54.79 53.86 1jj2 n ASP 76 Cb 0.60 -0.11 -0.04 0.00 -1.14 0.00 0.00 41.12 40.42 1jj2 n ASP 76 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1jj2 s ALA 77 N -2.00 3.40 0.07 2.12 0.00 -1.26 -0.64 121.76 123.45 1jj2 s ALA 77 Ca 0.00 0.87 -0.26 0.00 0.00 0.00 0.00 51.96 52.57 1jj2 s ALA 77 Cb 0.00 -3.33 0.09 0.00 0.00 0.00 0.00 23.12 19.88 1jj2 s ALA 77 CO 0.00 -0.16 0.74 0.20 0.00 0.00 0.00 175.76 176.54 1jj2 s GLY 78 N -0.71 -0.54 0.22 0.00 0.00 -1.23 -1.34 107.32 103.72 1jj2 s GLY 78 Ca 0.45 0.81 -0.00 0.00 0.00 0.00 0.00 44.72 45.98 1jj2 s GLY 78 CO 0.39 0.31 0.28 0.54 0.00 0.00 0.00 173.10 174.62 1jj2 n ARG 79 N -0.21 0.41 -3.30 2.90 1.74 -0.75 -4.74 116.66 112.71 1jj2 n ARG 79 Ca -0.13 -1.79 -0.26 0.00 -0.77 0.00 0.00 57.85 54.89 1jj2 n ARG 79 Cb 0.63 1.68 -0.07 0.00 -1.02 0.00 0.00 32.46 33.68 1jj2 n ARG 79 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 1jj2 n TYR 80 N -0.37 2.70 -1.61 -1.55 4.02 -1.26 -0.05 117.16 119.04 1jj2 n TYR 80 Ca 0.01 -4.00 -0.15 0.00 -0.01 0.00 0.00 57.90 53.76 1jj2 n TYR 80 Cb 0.37 -0.50 -0.10 0.00 -0.02 0.00 0.00 39.34 39.09 1jj2 n TYR 80 CO 0.00 0.00 0.00 -2.14 -1.01 0.00 0.00 176.86 173.71 1jj2 s PRO 81 N -2.32 1.38 0.19 -0.72 0.02 -1.26 -4.80 135.00 127.48 1jj2 s PRO 81 Ca 0.40 -0.09 -0.08 0.00 0.02 0.00 0.00 61.00 61.25 1jj2 s PRO 81 Cb 0.18 -4.91 0.10 0.00 0.02 0.00 0.00 34.50 29.88 1jj2 s PRO 81 CO -0.05 -5.05 1.63 1.05 -0.33 0.00 0.00 177.00 174.25 1jj2 h GLU 82 N 11.99 1.00 0.69 5.54 4.11 -1.93 -2.12 114.58 133.86 1jj2 h GLU 82 Ca 0.01 -0.35 -0.03 0.00 0.07 0.00 0.00 59.36 59.06 1jj2 h GLU 82 Cb 1.00 -0.08 0.01 0.00 0.50 0.00 0.00 28.75 30.18 1jj2 h GLU 82 CO 1.02 1.03 -0.33 -0.22 0.07 0.00 0.00 179.01 180.57 1jj2 h LYS 83 N 0.90 -0.89 -0.82 1.06 3.64 -1.99 0.54 116.57 119.00 1jj2 h LYS 83 Ca 0.15 0.06 0.08 0.00 -1.27 0.00 0.00 60.65 59.67 1jj2 h LYS 83 Cb 0.63 0.20 -0.05 0.00 -0.41 0.00 0.00 32.23 32.59 1jj2 h LYS 83 CO 0.04 -0.56 0.54 0.00 -2.27 0.00 0.00 179.45 177.20 1jj2 h ALA 84 N -0.90 1.65 -0.67 5.00 0.00 -1.93 -0.65 119.26 121.76 1jj2 h ALA 84 Ca -0.09 -0.02 -0.05 0.00 0.00 0.00 0.00 54.91 54.75 1jj2 h ALA 84 Cb 0.74 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 18.29 1jj2 h ALA 84 CO 0.15 0.21 0.23 0.77 0.00 0.00 0.00 179.25 180.61 1jj2 h SER 85 N 0.85 0.95 -0.42 0.00 0.02 -1.17 -0.68 113.55 113.10 1jj2 h SER 85 Ca 0.36 -0.16 -0.10 0.00 -0.84 0.00 0.00 61.79 61.05 1jj2 h SER 85 Cb 0.31 -0.25 -0.02 0.00 0.14 0.00 0.00 62.40 62.58 1jj2 h SER 85 CO -0.14 0.88 -0.12 0.11 -1.14 0.00 0.00 176.83 176.42 1jj2 h LYS 86 N 0.99 0.88 -0.22 3.45 1.57 0.56 -0.50 116.57 123.30 1jj2 h LYS 86 Ca 0.22 -0.32 -0.08 0.00 -1.87 0.00 0.00 60.65 58.61 1jj2 h LYS 86 Cb 0.26 -0.06 -0.01 0.00 0.08 0.00 0.00 32.23 32.49 1jj2 h LYS 86 CO -0.01 0.96 -0.19 0.00 -0.57 0.00 0.00 179.45 179.64 1jj2 h ALA 87 N 1.06 1.26 -0.08 3.86 0.00 -0.68 -1.75 119.26 122.93 1jj2 h ALA 87 Ca 0.13 -0.29 -0.16 0.00 0.00 0.00 0.00 54.91 54.59 1jj2 h ALA 87 Cb 0.64 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.31 1jj2 h ALA 87 CO 0.04 0.49 -0.63 0.74 0.00 0.00 0.00 179.25 179.89 1jj2 h PHE 88 N 0.36 0.39 -0.48 0.00 -1.00 -0.67 -1.52 116.94 114.02 1jj2 h PHE 88 Ca 0.06 -0.15 -0.04 0.00 2.81 0.00 0.00 57.97 60.65 1jj2 h PHE 88 Cb 0.54 -0.07 -0.02 0.00 3.61 0.00 0.00 35.95 40.01 1jj2 h PHE 88 CO 0.01 0.84 0.12 -0.07 -1.61 0.00 0.00 178.31 177.60 1jj2 h LEU 89 N 0.22 0.67 -0.63 1.54 3.38 -0.46 0.15 115.31 120.18 1jj2 h LEU 89 Ca -0.01 -0.11 -0.09 0.00 0.09 0.00 0.00 57.88 57.76 1jj2 h LEU 89 Cb 1.15 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 41.71 1jj2 h LEU 89 CO 0.10 0.66 0.02 0.44 0.09 0.00 0.00 178.44 179.76 1jj2 h ASP 90 N 0.70 1.07 -0.50 -0.43 5.19 -0.98 0.58 116.42 122.06 1jj2 h ASP 90 Ca 0.16 -0.30 -0.04 0.00 -0.62 0.00 0.00 57.03 56.23 1jj2 h ASP 90 Cb 0.26 -0.29 -0.02 0.00 0.18 0.00 0.00 39.33 39.47 1jj2 h ASP 90 CO -0.00 1.10 0.15 0.25 -3.12 0.00 0.00 179.24 177.62 1jj2 h LEU 91 N 1.00 0.72 -0.42 1.55 5.85 -0.29 -2.07 115.31 121.65 1jj2 h LEU 91 Ca 0.18 -0.21 -0.18 0.00 0.84 0.00 0.00 57.88 58.52 1jj2 h LEU 91 Cb 0.54 -0.19 -0.00 0.00 0.37 0.00 0.00 40.66 41.38 1jj2 h LEU 91 CO 0.03 0.74 -0.62 -0.07 -0.34 0.00 0.00 178.44 178.18 1jj2 h LEU 92 N 0.67 0.66 -1.10 2.25 3.38 -0.54 -1.12 115.31 119.52 1jj2 h LEU 92 Ca 0.16 -0.38 -0.00 0.00 0.09 0.00 0.00 57.88 57.75 1jj2 h LEU 92 Cb 0.28 -0.19 -0.04 0.00 0.09 0.00 0.00 40.66 40.79 1jj2 h LEU 92 CO -0.00 1.12 0.52 -0.08 0.09 0.00 0.00 178.44 180.09 1jj2 h GLU 93 N 0.43 1.13 0.17 1.13 4.81 -0.76 0.11 114.58 121.60 1jj2 h GLU 93 Ca -0.01 -0.09 -0.01 0.00 -0.13 0.00 0.00 59.36 59.12 1jj2 h GLU 93 Cb 1.19 -0.24 0.00 0.00 0.63 0.00 0.00 28.75 30.33 1jj2 h GLU 93 CO 0.12 0.78 -0.08 -0.97 -0.73 0.00 0.00 179.01 178.13 1jj2 h ASN 94 N 1.16 -0.19 0.21 1.04 -1.24 -1.20 -1.88 115.58 113.47 1jj2 h ASN 94 Ca 0.30 -0.33 0.01 0.00 0.71 0.00 0.00 56.30 57.00 1jj2 h ASN 94 Cb -0.07 0.05 -0.04 0.00 0.73 0.00 0.00 38.32 38.99 1jj2 h ASN 94 CO -0.06 0.28 -0.37 0.00 -1.29 0.00 0.00 177.43 175.98 1jj2 h ALA 95 N -0.03 -0.71 -0.69 1.57 0.00 -0.97 0.15 119.26 118.59 1jj2 h ALA 95 Ca -0.02 -0.09 0.12 0.00 0.00 0.00 0.00 54.91 54.93 1jj2 h ALA 95 Cb 0.50 0.59 -0.04 0.00 0.00 0.00 0.00 17.79 18.84 1jj2 h ALA 95 CO 0.04 -0.95 0.46 0.28 0.00 0.00 0.00 179.25 179.08 1jj2 h VAL 96 N -0.66 0.85 -0.24 0.00 2.07 -0.87 0.23 116.25 117.62 1jj2 h VAL 96 Ca 0.01 -0.15 -0.19 0.00 0.82 0.00 0.00 66.70 67.19 1jj2 h VAL 96 Cb 0.65 0.38 0.00 0.00 -1.52 0.00 0.00 31.29 30.81 1jj2 h VAL 96 CO -0.17 0.08 -0.60 1.23 0.02 0.00 0.00 177.57 178.13 1jj2 h GLY 97 N 0.43 0.89 0.92 2.17 0.00 -0.42 -1.42 103.07 105.63 1jj2 h GLY 97 Ca 0.33 -1.08 -0.04 0.00 0.00 0.00 0.00 47.33 46.54 1jj2 h GLY 97 CO -0.10 0.97 0.08 3.43 0.00 0.00 0.00 176.54 180.92 1jj2 h ASN 98 N 0.61 0.57 -0.48 0.19 -0.26 0.65 -1.86 115.58 114.99 1jj2 h ASN 98 Ca -0.00 -0.24 0.07 0.00 -0.56 0.00 0.00 56.30 55.57 1jj2 h ASN 98 Cb 1.20 -0.15 -0.06 0.00 -1.06 0.00 0.00 38.32 38.25 1jj2 h ASN 98 CO 0.13 0.67 0.14 0.00 -1.06 0.00 0.00 177.43 177.30 1jj2 h ALA 99 N 0.92 0.57 -0.62 -0.83 0.00 -0.52 -2.47 119.26 116.32 1jj2 h ALA 99 Ca 0.11 0.08 -0.07 0.00 0.00 0.00 0.00 54.91 55.04 1jj2 h ALA 99 Cb 0.33 0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.17 1jj2 h ALA 99 CO 0.00 -0.26 0.13 -0.44 0.00 0.00 0.00 179.25 178.68 1jj2 h ASP 100 N 0.30 0.96 0.19 0.00 3.32 -1.04 -1.96 116.42 118.19 1jj2 h ASP 100 Ca 0.24 -0.25 0.00 0.00 0.02 0.00 0.00 57.03 57.04 1jj2 h ASP 100 Cb 0.27 -0.26 0.00 0.00 0.22 0.00 0.00 39.33 39.57 1jj2 h ASP 100 CO -0.27 0.96 0.00 1.57 -1.72 0.00 0.00 179.24 179.78 1jj2 n HIS 101 N -4.30 0.00 0.42 4.55 -0.00 -0.72 -1.45 115.22 113.72 1jj2 n HIS 101 Ca 0.04 0.00 0.06 0.00 0.46 0.00 0.00 57.72 58.27 1jj2 n HIS 101 Cb 0.26 -0.28 0.05 0.00 -0.12 0.00 0.00 29.99 29.91 1jj2 n HIS 101 CO 0.00 0.00 0.00 1.04 0.46 0.00 0.00 176.34 177.84 1jj2 n GLN 102 N -1.28 0.73 -0.00 1.57 6.02 -0.79 -4.99 117.38 118.63 1jj2 n GLN 102 Ca 0.05 -1.23 0.00 0.00 -0.01 0.00 0.00 57.00 55.81 1jj2 n GLN 102 Cb 0.08 -1.22 0.00 0.00 1.02 0.00 0.00 30.24 30.12 1jj2 n GLN 102 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1jj2 n GLY 103 N 0.62 0.15 3.93 1.08 0.00 -0.53 -5.08 105.19 105.36 1jj2 n GLY 103 Ca 0.07 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.80 1jj2 n GLY 103 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1jj2 s PHE 104 N -2.04 2.12 -0.79 1.61 0.40 -0.88 -4.99 117.98 113.40 1jj2 s PHE 104 Ca 0.00 0.42 -0.14 0.00 -0.60 0.00 0.00 56.93 56.61 1jj2 s PHE 104 Cb 0.00 -3.78 0.21 0.00 0.51 0.00 0.00 43.02 39.96 1jj2 s PHE 104 CO 0.00 -2.22 0.72 0.34 0.70 0.00 0.00 175.22 174.76 1jj2 s ASP 105 N -4.76 6.63 0.06 1.36 2.15 -1.26 -4.22 116.67 116.64 1jj2 s ASP 105 Ca 0.69 -2.61 -0.12 0.00 0.43 0.00 0.00 52.55 50.94 1jj2 s ASP 105 Cb -0.07 -2.19 -0.03 0.00 -0.30 0.00 0.00 42.92 40.33 1jj2 s ASP 105 CO 0.50 -0.59 1.21 1.23 -0.17 0.00 0.00 175.17 177.36 1jj2 h GLY 106 N 7.86 -1.88 -0.15 2.66 0.00 -1.85 -2.56 103.07 107.15 1jj2 h GLY 106 Ca 0.06 0.96 0.25 0.00 0.00 0.00 0.00 47.33 48.60 1jj2 h GLY 106 CO 0.78 -0.58 0.62 0.83 0.00 0.00 0.00 176.54 178.19 1jj2 h GLU 107 N -0.05 0.52 0.00 4.80 5.08 -1.93 -1.01 114.58 121.98 1jj2 h GLU 107 Ca 0.05 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.38 1jj2 h GLU 107 Cb 0.18 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 29.32 1jj2 h GLU 107 CO -0.33 0.34 0.00 0.00 -1.00 0.00 0.00 179.01 178.02 1jj2 n ALA 108 N -2.36 2.24 -1.78 3.43 0.00 -0.97 -1.15 120.51 119.92 1jj2 n ALA 108 Ca 0.27 -0.10 -0.36 0.00 0.00 0.00 0.00 53.44 53.25 1jj2 n ALA 108 Cb 0.79 -1.43 -0.02 0.00 0.00 0.00 0.00 19.45 18.79 1jj2 n ALA 108 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 1jj2 s MET 109 N -2.89 3.74 0.23 0.00 -1.94 -0.39 -4.67 119.30 113.38 1jj2 s MET 109 Ca 0.16 1.60 -0.21 0.00 -1.71 0.00 0.00 55.69 55.52 1jj2 s MET 109 Cb 0.17 -2.27 -0.08 0.00 2.01 0.00 0.00 34.83 34.66 1jj2 s MET 109 CO 0.46 -0.52 0.76 0.99 -0.01 0.00 0.00 175.02 176.70 1jj2 s THR 110 N -1.71 4.49 -0.82 2.05 2.01 -0.04 -0.90 115.64 120.72 1jj2 s THR 110 Ca 0.66 1.43 -0.23 0.00 0.31 0.00 0.00 61.69 63.85 1jj2 s THR 110 Cb -0.24 -3.92 0.06 0.00 0.01 0.00 0.00 72.50 68.41 1jj2 s THR 110 CO 0.28 0.25 1.21 -0.63 -0.69 0.00 0.00 174.62 175.04 1jj2 s ILE 111 N -1.48 4.11 0.08 1.82 1.01 0.12 -0.40 121.20 126.46 1jj2 s ILE 111 Ca 0.43 -0.43 -0.16 0.00 0.00 0.00 0.00 60.65 60.49 1jj2 s ILE 111 Cb -0.18 -4.86 -0.11 0.00 0.01 0.00 0.00 42.46 37.32 1jj2 s ILE 111 CO 0.22 -1.71 1.37 0.50 0.00 0.00 0.00 174.94 175.33 1jj2 h LYS 112 N 9.64 0.64 -3.24 2.79 3.64 -1.24 -1.79 116.57 127.01 1jj2 h LYS 112 Ca -0.09 -0.38 -0.21 0.00 -1.27 0.00 0.00 60.65 58.70 1jj2 h LYS 112 Cb 1.04 0.03 -0.29 0.00 -0.41 0.00 0.00 32.23 32.60 1jj2 h LYS 112 CO 1.26 0.99 -0.55 -1.58 -2.27 0.00 0.00 179.45 177.30 1jj2 s HIS 113 N -4.19 -0.20 -0.15 1.91 5.04 -1.08 -4.81 115.29 111.81 1jj2 s HIS 113 Ca -0.12 0.53 -0.08 0.00 -1.54 0.00 0.00 55.06 53.84 1jj2 s HIS 113 Cb 0.08 -0.00 0.06 0.00 0.04 0.00 0.00 32.58 32.75 1jj2 s HIS 113 CO 0.83 -0.15 0.36 0.54 -2.34 0.00 0.00 174.74 173.98 1jj2 s VAL 114 N 0.78 -0.04 -0.25 0.89 0.11 -1.26 -0.15 120.40 120.48 1jj2 s VAL 114 Ca -0.06 0.11 -0.26 0.00 -2.93 0.00 0.00 61.98 58.85 1jj2 s VAL 114 Cb -0.07 -0.54 0.08 0.00 -1.53 0.00 0.00 36.38 34.32 1jj2 s VAL 114 CO -0.04 0.05 0.79 0.00 -3.33 0.00 0.00 175.10 172.57 1jj2 s ALA 115 N 1.39 -1.83 0.04 1.54 0.00 -0.87 -4.78 121.76 117.24 1jj2 s ALA 115 Ca -0.09 1.92 0.00 0.00 0.00 0.00 0.00 51.96 53.79 1jj2 s ALA 115 Cb -0.09 -1.12 -0.04 0.00 0.00 0.00 0.00 23.12 21.87 1jj2 s ALA 115 CO -0.11 -0.32 0.15 0.00 0.00 0.00 0.00 175.76 175.48 1jj2 s ALA 116 N 0.17 3.83 -0.02 0.00 0.00 -1.26 -1.58 121.76 122.89 1jj2 s ALA 116 Ca -0.00 -0.87 0.00 0.00 0.00 0.00 0.00 51.96 51.09 1jj2 s ALA 116 Cb -0.04 -1.71 0.02 0.00 0.00 0.00 0.00 23.12 21.38 1jj2 s ALA 116 CO 0.00 0.77 -0.00 -1.01 0.00 0.00 0.00 175.76 175.52 1jj2 s HIS 117 N -1.39 0.21 -0.35 0.00 3.76 0.09 -4.96 115.29 112.65 1jj2 s HIS 117 Ca 0.30 0.01 -0.28 0.00 -0.15 0.00 0.00 55.06 54.94 1jj2 s HIS 117 Cb -0.13 -0.27 0.02 0.00 1.11 0.00 0.00 32.58 33.32 1jj2 s HIS 117 CO 0.22 -0.07 1.03 0.21 -0.85 0.00 0.00 174.74 175.27 1jj2 s LYS 118 N 0.63 3.96 0.00 1.40 2.20 -1.26 -1.18 119.74 125.49 1jj2 s LYS 118 Ca -0.06 0.85 0.23 0.00 -0.36 0.00 0.00 55.97 56.63 1jj2 s LYS 118 Cb -0.09 -3.78 0.12 0.00 -1.51 0.00 0.00 37.83 32.57 1jj2 s LYS 118 CO -0.01 -0.96 1.17 0.28 -0.36 0.00 0.00 175.35 175.47 1jj2 n VAL 119 N 6.00 0.00 -2.84 4.02 0.31 0.15 -4.97 118.33 121.00 1jj2 n VAL 119 Ca 0.10 -0.29 0.00 0.00 -0.01 0.00 0.00 64.34 64.15 1jj2 n VAL 119 Cb 0.48 1.20 0.00 0.00 -0.91 0.00 0.00 33.84 34.61 1jj2 n VAL 119 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1jj2 n GLY 120 N 1.40 -1.34 2.86 2.92 0.00 -1.20 -4.97 105.19 104.85 1jj2 n GLY 120 Ca 0.10 -1.33 -0.16 0.00 0.00 0.00 0.00 46.02 44.63 1jj2 n GLY 120 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1jj2 s GLU 121 N -1.98 0.26 -0.42 1.61 2.02 -1.26 -0.14 118.70 118.80 1jj2 s GLU 121 Ca 0.00 0.00 -0.28 0.00 0.02 0.00 0.00 54.97 54.72 1jj2 s GLU 121 Cb 0.00 -0.36 0.02 0.00 0.10 0.00 0.00 34.13 33.89 1jj2 s GLU 121 CO 0.00 -0.05 1.04 -1.14 0.02 0.00 0.00 175.26 175.13 1jj2 s GLN 122 N 0.56 3.80 0.31 1.61 0.74 0.80 -4.87 119.66 122.61 1jj2 s GLN 122 Ca -0.05 0.62 -0.28 0.00 0.05 0.00 0.00 55.36 55.69 1jj2 s GLN 122 Cb -0.08 -3.85 -0.09 0.00 1.10 0.00 0.00 33.01 30.08 1jj2 s GLN 122 CO -0.01 -1.15 1.12 -0.65 -0.55 0.00 0.00 175.29 174.04 1jj2 s GLN 123 N 3.95 4.49 0.07 1.67 -0.21 -1.26 -1.45 119.66 126.92 1jj2 s GLN 123 Ca 0.43 1.80 -0.01 0.00 0.02 0.00 0.00 55.36 57.60 1jj2 s GLN 123 Cb -0.10 -3.04 -0.04 0.00 1.00 0.00 0.00 33.01 30.84 1jj2 s GLN 123 CO 0.24 0.08 -0.01 0.20 -2.12 0.00 0.00 175.29 173.68 1jj2 s GLY 124 N -0.97 0.60 -0.05 3.09 0.00 -1.07 -4.94 107.32 103.99 1jj2 s GLY 124 Ca 0.48 -1.28 0.03 0.00 0.00 0.00 0.00 44.72 43.95 1jj2 s GLY 124 CO 0.40 -1.33 -0.11 -1.60 0.00 0.00 0.00 173.10 170.45 1jj2 s ARG 125 N -3.95 1.40 -0.21 2.90 6.06 -1.26 -0.82 118.95 123.06 1jj2 s ARG 125 Ca 0.11 -0.39 -0.00 0.00 -2.50 0.00 0.00 55.73 52.95 1jj2 s ARG 125 Cb 0.08 -1.22 0.02 0.00 0.06 0.00 0.00 34.95 33.89 1jj2 s ARG 125 CO -0.07 0.09 -0.12 0.21 -2.50 0.00 0.00 175.30 172.91 1jj2 s LYS 126 N 0.40 2.93 0.33 5.12 2.47 0.56 -4.84 119.74 126.71 1jj2 s LYS 126 Ca -0.08 -0.89 -0.29 0.00 -1.56 0.00 0.00 55.97 53.14 1jj2 s LYS 126 Cb -0.12 -2.79 -0.11 0.00 -1.46 0.00 0.00 37.83 33.34 1jj2 s LYS 126 CO 0.02 -0.30 1.57 -2.30 0.16 0.00 0.00 175.35 174.50 1jj2 n PRO 127 N 4.64 2.73 -4.66 4.03 -0.02 -1.26 -1.61 135.00 138.86 1jj2 n PRO 127 Ca -0.18 0.97 -0.30 0.00 -2.02 0.00 0.00 63.50 61.97 1jj2 n PRO 127 Cb 0.48 -2.74 -0.08 0.00 -0.02 0.00 0.00 33.50 31.14 1jj2 n PRO 127 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 1jj2 s ARG 128 N -1.12 2.05 0.85 -0.52 1.81 0.43 -4.90 118.95 117.56 1jj2 s ARG 128 Ca 0.60 -2.27 -0.11 0.00 -1.72 0.00 0.00 55.73 52.23 1jj2 s ARG 128 Cb -0.48 -1.27 0.10 0.00 -0.45 0.00 0.00 34.95 32.85 1jj2 s ARG 128 CO 0.54 -0.33 1.09 0.00 -0.68 0.00 0.00 175.30 175.93 1jj2 s ALA 129 N -2.96 1.81 -1.00 2.13 0.00 -1.26 -3.68 121.76 116.80 1jj2 s ALA 129 Ca 0.17 0.06 0.00 0.00 0.00 0.00 0.00 51.96 52.18 1jj2 s ALA 129 Cb 0.04 -3.22 0.00 0.00 0.00 0.00 0.00 23.12 19.94 1jj2 s ALA 129 CO 0.09 -2.13 0.00 -1.33 0.00 0.00 0.00 175.76 172.39 1jj2 n MET 130 N -3.75 -0.69 -1.85 0.00 2.81 -1.26 -3.42 117.12 108.97 1jj2 n MET 130 Ca 0.08 0.78 -0.07 0.00 -1.81 0.00 0.00 57.70 56.68 1jj2 n MET 130 Cb 0.54 -4.71 -0.01 0.00 -0.71 0.00 0.00 33.22 28.33 1jj2 n MET 130 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1jj2 n GLY 131 N -1.68 0.35 3.29 3.03 0.00 -1.25 -5.04 105.19 103.89 1jj2 n GLY 131 Ca -0.10 -0.62 -0.23 0.00 0.00 0.00 0.00 46.02 45.08 1jj2 n GLY 131 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1jj2 s ARG 132 N -3.82 1.14 0.20 1.61 3.52 -1.22 -5.01 118.95 115.38 1jj2 s ARG 132 Ca 0.00 -1.23 0.10 0.00 -0.13 0.00 0.00 55.73 54.47 1jj2 s ARG 132 Cb 0.00 -1.31 -0.04 0.00 -1.56 0.00 0.00 34.95 32.04 1jj2 s ARG 132 CO 0.00 0.29 -0.20 0.00 -0.81 0.00 0.00 175.30 174.57 1jj2 s ALA 133 N -1.50 2.36 0.15 6.12 0.00 -1.26 0.16 121.76 127.80 1jj2 s ALA 133 Ca 0.09 -1.64 -0.01 0.00 0.00 0.00 0.00 51.96 50.40 1jj2 s ALA 133 Cb -0.08 -0.25 -0.04 0.00 0.00 0.00 0.00 23.12 22.75 1jj2 s ALA 133 CO 0.05 0.30 0.06 -1.54 0.00 0.00 0.00 175.76 174.63 1jj2 s SER 134 N -2.90 0.45 0.62 0.00 1.04 -0.63 -4.89 113.70 107.38 1jj2 s SER 134 Ca 0.21 -1.24 -0.19 0.00 0.48 0.00 0.00 55.95 55.21 1jj2 s SER 134 Cb -0.06 0.28 -0.02 0.00 0.10 0.00 0.00 66.02 66.32 1jj2 s SER 134 CO 0.10 -0.72 1.31 0.00 0.98 0.00 0.00 173.24 174.90 1jj2 n ALA 135 N -0.16 1.26 -2.87 5.32 0.00 -1.26 -0.32 120.51 122.48 1jj2 n ALA 135 Ca -0.04 0.03 -0.09 0.00 0.00 0.00 0.00 53.44 53.34 1jj2 n ALA 135 Cb 0.64 -2.33 -0.00 0.00 0.00 0.00 0.00 19.45 17.75 1jj2 n ALA 135 CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 177.50 179.37 1jj2 n TRP 136 N -1.70 -3.21 -3.43 0.00 -0.00 0.00 -4.59 117.44 104.51 1jj2 n TRP 136 Ca 0.15 -1.79 -0.20 0.00 -0.00 0.00 0.00 57.50 55.66 1jj2 n TRP 136 Cb 0.47 1.25 -0.02 0.00 -0.00 0.00 0.00 31.31 33.01 1jj2 n TRP 136 CO 0.00 0.00 0.00 -0.80 -0.00 0.00 0.00 177.69 176.89 1jj2 s ASN 137 N 0.33 5.24 -0.12 5.87 0.01 -1.26 -2.61 114.94 122.40 1jj2 s ASN 137 Ca 0.31 -0.64 0.01 0.00 -0.71 0.00 0.00 52.86 51.84 1jj2 s ASN 137 Cb 0.04 -0.63 0.02 0.00 0.41 0.00 0.00 41.25 41.09 1jj2 s ASN 137 CO -0.10 -0.66 -0.15 -0.44 -1.51 0.00 0.00 177.10 174.24 1jj2 s SER 138 N -4.18 2.49 0.58 -1.22 0.01 -0.53 -4.95 113.70 105.91 1jj2 s SER 138 Ca 0.49 -0.44 -0.19 0.00 1.31 0.00 0.00 55.95 57.12 1jj2 s SER 138 Cb -0.05 -1.11 -0.04 0.00 0.21 0.00 0.00 66.02 65.03 1jj2 s SER 138 CO 0.29 0.00 1.21 -2.84 0.41 0.00 0.00 173.24 172.31 1jj2 s PRO 139 N 1.09 3.06 -0.14 12.44 0.02 -1.26 -0.14 135.00 150.06 1jj2 s PRO 139 Ca -0.04 1.83 0.02 0.00 0.02 0.00 0.00 61.00 62.83 1jj2 s PRO 139 Cb -0.14 -1.98 0.01 0.00 0.02 0.00 0.00 34.50 32.41 1jj2 s PRO 139 CO -0.03 -1.14 -0.22 -0.65 -0.33 0.00 0.00 177.00 174.63 1jj2 s GLN 140 N -3.26 3.03 -0.08 5.54 -0.21 0.80 -3.50 119.66 121.97 1jj2 s GLN 140 Ca 0.76 -0.85 0.05 0.00 0.02 0.00 0.00 55.36 55.34 1jj2 s GLN 140 Cb -0.30 -2.45 -0.01 0.00 1.00 0.00 0.00 33.01 31.25 1jj2 s GLN 140 CO 0.33 -0.03 -0.24 0.08 -2.12 0.00 0.00 175.29 173.32 1jj2 s VAL 141 N 0.85 2.01 0.13 1.09 1.01 0.16 -0.67 120.40 124.97 1jj2 s VAL 141 Ca -0.06 -1.02 0.04 0.00 0.00 0.00 0.00 61.98 60.94 1jj2 s VAL 141 Cb -0.15 -1.72 -0.04 0.00 0.00 0.00 0.00 36.38 34.47 1jj2 s VAL 141 CO -0.03 0.55 0.12 -1.81 0.00 0.00 0.00 175.10 173.94 1jj2 s ASP 142 N 0.09 5.57 -0.18 3.32 1.11 -0.32 -0.45 116.67 125.81 1jj2 s ASP 142 Ca -0.11 -0.06 -0.13 0.00 0.18 0.00 0.00 52.55 52.44 1jj2 s ASP 142 Cb -0.16 -1.49 0.05 0.00 1.07 0.00 0.00 42.92 42.40 1jj2 s ASP 142 CO 0.06 0.11 0.45 0.54 1.18 0.00 0.00 175.17 177.52 1jj2 s VAL 143 N -1.59 -0.01 0.06 -1.27 0.11 -0.97 -0.74 120.40 115.99 1jj2 s VAL 143 Ca 0.30 0.04 0.04 0.00 -2.93 0.00 0.00 61.98 59.44 1jj2 s VAL 143 Cb -0.11 -0.65 -0.04 0.00 -1.53 0.00 0.00 36.38 34.05 1jj2 s VAL 143 CO 0.23 0.02 -0.02 -1.83 -3.33 0.00 0.00 175.10 170.17 1jj2 s GLU 144 N 0.88 2.58 -0.06 1.54 -1.05 -0.62 -1.67 118.70 120.31 1jj2 s GLU 144 Ca -0.05 -0.78 -0.03 0.00 -0.15 0.00 0.00 54.97 53.96 1jj2 s GLU 144 Cb -0.06 -2.55 0.04 0.00 -0.44 0.00 0.00 34.13 31.12 1jj2 s GLU 144 CO -0.07 0.57 0.13 -1.17 0.95 0.00 0.00 175.26 175.67 1jj2 s LEU 145 N -1.99 0.79 -0.19 1.83 2.96 -0.49 -2.06 118.68 119.54 1jj2 s LEU 145 Ca 0.23 0.28 0.01 0.00 -0.22 0.00 0.00 54.13 54.42 1jj2 s LEU 145 Cb -0.12 0.33 0.04 0.00 0.50 0.00 0.00 46.19 46.94 1jj2 s LEU 145 CO 0.14 -0.14 -0.12 -0.63 -1.32 0.00 0.00 176.35 174.28 1jj2 s ILE 146 N 1.11 1.68 0.12 6.68 1.01 0.79 -1.61 121.20 130.98 1jj2 s ILE 146 Ca -0.09 -0.94 -0.11 0.00 0.00 0.00 0.00 60.65 59.52 1jj2 s ILE 146 Cb -0.11 -1.70 -0.06 0.00 0.01 0.00 0.00 42.46 40.60 1jj2 s ILE 146 CO -0.05 0.26 0.46 -0.76 0.00 0.00 0.00 174.94 174.85 1jj2 s LEU 147 N 1.40 4.32 -0.01 2.97 1.43 0.15 -0.72 118.68 128.22 1jj2 s LEU 147 Ca 0.00 0.88 -0.01 0.00 -1.03 0.00 0.00 54.13 53.97 1jj2 s LEU 147 Cb -0.15 -3.16 -0.00 0.00 0.03 0.00 0.00 46.19 42.90 1jj2 s LEU 147 CO -0.09 0.12 0.03 -0.70 0.23 0.00 0.00 176.35 175.94 1jj2 s GLU 148 N -2.06 0.11 0.32 1.70 2.12 0.46 -1.31 118.70 120.04 1jj2 s GLU 148 Ca 0.36 -0.10 -0.29 0.00 0.36 0.00 0.00 54.97 55.30 1jj2 s GLU 148 Cb -0.14 0.05 -0.11 0.00 0.26 0.00 0.00 34.13 34.19 1jj2 s GLU 148 CO 0.19 -0.02 1.51 -1.21 -0.54 0.00 0.00 175.26 175.19 1jj2 s GLU 149 N -0.34 4.15 0.00 4.30 2.02 -1.00 -0.86 118.70 126.98 1jj2 s GLU 149 Ca -0.04 2.51 0.00 0.00 0.02 0.00 0.00 54.97 57.46 1jj2 s GLU 149 Cb -0.02 -3.02 0.00 0.00 0.10 0.00 0.00 34.13 31.19 1jj2 s GLU 149 CO -0.00 -0.53 0.38 -2.30 0.02 0.00 0.00 175.26 172.83