#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2pro n ASP 5 N 0.00 -0.23 -0.04 4.52 2.03 -1.26 -4.68 116.55 116.89 2pro n ASP 5 Ca 0.00 1.15 0.03 0.00 0.52 0.00 0.00 54.79 56.49 2pro n ASP 5 Cb 0.00 -0.97 0.39 0.00 -0.72 0.00 0.00 41.12 39.82 2pro n ASP 5 CO 0.00 0.00 0.00 -0.65 -1.92 0.00 0.00 177.20 174.63 2pro h PRO 6 N 2.41 0.62 -0.16 -0.67 0.11 -2.06 -0.15 132.00 132.10 2pro h PRO 6 Ca -0.42 -0.04 -0.11 0.00 0.11 0.00 0.00 66.00 65.54 2pro h PRO 6 Cb 1.42 -0.14 0.00 0.00 0.11 0.00 0.00 31.00 32.40 2pro h PRO 6 CO 0.63 0.42 -0.31 1.96 -0.21 0.00 0.00 178.00 180.49 2pro h GLN 7 N 0.63 0.50 -0.51 1.05 4.20 -2.00 -3.01 115.11 115.96 2pro h GLN 7 Ca 0.17 -0.32 -0.02 0.00 0.06 0.00 0.00 58.65 58.54 2pro h GLN 7 Cb -0.05 0.04 -0.02 0.00 0.30 0.00 0.00 27.48 27.75 2pro h GLN 7 CO -0.03 0.92 0.23 1.25 -0.67 0.00 0.00 178.83 180.53 2pro h LEU 8 N 0.13 0.69 -1.84 1.46 5.85 -1.83 -1.84 115.31 117.94 2pro h LEU 8 Ca 0.01 -0.15 0.00 0.00 0.84 0.00 0.00 57.88 58.58 2pro h LEU 8 Cb 0.90 -0.18 0.00 0.00 0.37 0.00 0.00 40.66 41.75 2pro h LEU 8 CO 0.07 0.65 0.07 0.50 -0.34 0.00 0.00 178.44 179.39 2pro h LYS 9 N 0.69 0.00 0.00 1.25 3.64 -1.01 -1.67 116.57 119.47 2pro h LYS 9 Ca 0.17 0.00 -0.13 0.00 -1.27 0.00 0.00 60.65 59.43 2pro h LYS 9 Cb 0.16 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 31.95 2pro h LYS 9 CO -0.02 0.00 -1.95 1.19 -2.27 0.00 0.00 179.45 176.40 2pro n PHE 10 N -2.51 0.00 0.40 1.91 3.72 -0.75 -3.90 117.46 116.33 2pro n PHE 10 Ca -0.02 0.00 0.12 0.00 -0.05 0.00 0.00 57.45 57.50 2pro n PHE 10 Cb 0.11 -0.58 0.21 0.00 -0.94 0.00 0.00 39.48 38.28 2pro n PHE 10 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2pro h ALA 11 N 1.29 0.80 -0.00 4.37 0.00 -0.77 -3.19 119.26 121.76 2pro h ALA 11 Ca -0.19 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.72 2pro h ALA 11 Cb 1.32 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.11 2pro h ALA 11 CO 0.01 0.00 -0.26 -0.12 0.00 0.00 0.00 179.25 178.88 2pro n MET 12 N -2.54 0.38 0.00 0.00 0.00 -0.69 -2.42 117.12 111.85 2pro n MET 12 Ca 0.04 -0.18 0.00 0.00 0.00 0.00 0.00 57.70 57.56 2pro n MET 12 Cb 0.48 -1.50 0.00 0.00 0.00 0.00 0.00 33.22 32.21 2pro n MET 12 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 175.97 177.01 2pro n GLN 13 N -1.16 0.00 -0.06 2.12 6.02 -1.22 -2.90 117.38 120.19 2pro n GLN 13 Ca 0.10 0.14 -0.01 0.00 -0.01 0.00 0.00 57.00 57.21 2pro n GLN 13 Cb 0.32 -0.56 -0.01 0.00 1.02 0.00 0.00 30.24 31.01 2pro n GLN 13 CO 0.00 0.00 0.00 -2.13 -1.01 0.00 0.00 177.06 173.92 2pro n ARG 14 N -2.02 -0.06 0.26 -1.09 0.63 0.05 0.59 116.66 115.03 2pro n ARG 14 Ca 0.00 0.63 0.11 0.00 -0.92 0.00 0.00 57.85 57.66 2pro n ARG 14 Cb 0.00 -0.93 0.70 0.00 0.45 0.00 0.00 32.46 32.67 2pro n ARG 14 CO 0.00 0.00 0.00 -0.44 -2.51 0.00 0.00 177.63 174.68 2pro h ASP 15 N 0.00 0.00 -0.63 6.15 5.19 -1.70 -1.07 116.42 124.36 2pro h ASP 15 Ca 0.02 0.00 -0.26 0.00 -0.62 0.00 0.00 57.03 56.18 2pro h ASP 15 Cb 0.06 0.00 -0.15 0.00 0.18 0.00 0.00 39.33 39.41 2pro h ASP 15 CO -0.13 0.10 0.32 0.18 -3.12 0.00 0.00 179.24 176.60 2pro n LEU 16 N -3.98 5.34 0.00 1.55 4.77 0.20 -4.88 117.00 120.00 2pro n LEU 16 Ca -0.02 -2.80 0.00 0.00 -0.03 0.00 0.00 56.01 53.16 2pro n LEU 16 Cb 0.19 -0.71 0.00 0.00 -2.33 0.00 0.00 43.42 40.56 2pro n LEU 16 CO 0.32 0.78 0.00 0.61 -1.33 0.00 0.00 177.39 177.77 2pro n GLY 17 N -0.33 0.00 0.37 -0.72 0.00 -0.36 -4.73 105.19 99.42 2pro n GLY 17 Ca 0.36 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.50 2pro n GLY 17 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 2pro h ILE 18 N 0.00 0.87 -1.40 -0.61 1.08 -1.68 -3.44 117.51 112.33 2pro h ILE 18 Ca 0.00 -0.22 0.12 0.00 -0.39 0.00 0.00 64.86 64.37 2pro h ILE 18 Cb 0.00 0.16 -0.27 0.00 -3.07 0.00 0.00 36.82 33.65 2pro h ILE 18 CO 0.00 0.12 0.65 0.12 -0.69 0.00 0.00 178.15 178.34 2pro s PHE 19 N -5.62 -0.29 -1.37 1.37 2.19 -1.25 -4.98 117.98 108.02 2pro s PHE 19 Ca -0.09 0.62 -0.11 0.00 0.33 0.00 0.00 56.93 57.67 2pro s PHE 19 Cb 0.21 0.43 -0.06 0.00 -1.31 0.00 0.00 43.02 42.30 2pro s PHE 19 CO 0.78 -0.19 2.53 -0.35 1.83 0.00 0.00 175.22 179.82 2pro n PRO 20 N 1.36 2.99 -2.36 10.12 -0.04 -1.26 -0.77 135.00 145.04 2pro n PRO 20 Ca -0.09 -2.12 -0.41 0.00 -0.04 0.00 0.00 63.50 60.83 2pro n PRO 20 Cb 0.57 -2.86 -0.03 0.00 -0.04 0.00 0.00 33.50 31.14 2pro n PRO 20 CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 2pro s THR 21 N 2.91 3.65 -0.55 0.52 -4.23 -1.26 -4.97 115.64 111.71 2pro s THR 21 Ca 0.57 1.31 -0.19 0.00 -1.18 0.00 0.00 61.69 62.21 2pro s THR 21 Cb 0.15 -3.84 0.08 0.00 1.34 0.00 0.00 72.50 70.23 2pro s THR 21 CO -0.05 0.17 0.66 -1.10 -0.54 0.00 0.00 174.62 173.76 2pro s GLN 22 N 0.21 3.08 0.17 3.99 -0.21 -1.26 -4.69 119.66 120.94 2pro s GLN 22 Ca 0.55 -1.12 -0.14 0.00 0.02 0.00 0.00 55.36 54.67 2pro s GLN 22 Cb -0.32 -4.18 0.10 0.00 1.00 0.00 0.00 33.01 29.60 2pro s GLN 22 CO 0.34 -1.38 1.77 -0.07 -2.12 0.00 0.00 175.29 173.84 2pro h LEU 23 N 9.81 0.27 -0.06 2.90 3.38 -1.94 -3.20 115.31 126.47 2pro h LEU 23 Ca -0.28 0.03 0.01 0.00 0.09 0.00 0.00 57.88 57.72 2pro h LEU 23 Cb 1.09 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 41.82 2pro h LEU 23 CO 1.03 0.19 -0.04 -0.65 0.09 0.00 0.00 178.44 179.06 2pro h PRO 24 N 0.40 -0.00 -1.59 1.13 0.11 -1.99 0.93 132.00 130.99 2pro h PRO 24 Ca 0.19 0.00 0.49 0.00 0.11 0.00 0.00 66.00 66.79 2pro h PRO 24 Cb 0.13 0.00 -0.10 0.00 0.11 0.00 0.00 31.00 31.14 2pro h PRO 24 CO -0.16 -0.00 1.10 0.37 -0.21 0.00 0.00 178.00 179.10 2pro h GLN 25 N -0.00 0.03 0.41 1.05 -0.00 -1.98 0.33 115.11 114.95 2pro h GLN 25 Ca 0.01 -0.00 -0.02 0.00 -0.00 0.00 0.00 58.65 58.64 2pro h GLN 25 Cb 0.03 -0.01 0.00 0.00 0.00 0.00 0.00 27.48 27.51 2pro h GLN 25 CO -0.06 0.02 -0.20 -0.92 0.00 0.00 0.00 178.83 177.67 2pro h TYR 26 N 0.03 -0.51 -0.97 3.99 3.20 0.83 0.88 116.97 124.42 2pro h TYR 26 Ca 0.85 -0.01 0.21 0.00 3.14 0.00 0.00 58.73 62.92 2pro h TYR 26 Cb 3.07 0.17 -0.09 0.00 1.54 0.00 0.00 36.73 41.42 2pro h TYR 26 CO -0.00 -0.32 0.62 -0.07 -1.64 0.00 0.00 178.16 176.75 2pro h LEU 27 N -0.67 0.57 -0.43 2.82 3.38 0.10 0.83 115.31 121.92 2pro h LEU 27 Ca -0.06 0.07 0.05 0.00 0.09 0.00 0.00 57.88 58.03 2pro h LEU 27 Cb 0.42 -0.03 -0.04 0.00 0.09 0.00 0.00 40.66 41.10 2pro h LEU 27 CO 0.09 0.19 0.18 -0.61 0.09 0.00 0.00 178.44 178.38 2pro h GLN 28 N 0.55 0.35 -0.28 1.13 4.15 -0.32 -1.16 115.11 119.54 2pro h GLN 28 Ca 0.54 -0.02 -0.12 0.00 0.77 0.00 0.00 58.65 59.82 2pro h GLN 28 Cb 1.13 -0.08 -0.01 0.00 0.21 0.00 0.00 27.48 28.73 2pro h GLN 28 CO -0.28 0.23 -0.34 1.15 -1.93 0.00 0.00 178.83 177.66 2pro h THR 29 N 0.36 1.29 -0.76 2.39 2.02 0.29 -2.65 112.91 115.85 2pro h THR 29 Ca 0.19 -1.46 0.11 0.00 0.77 0.00 0.00 66.41 66.02 2pro h THR 29 Cb 0.15 1.44 -0.08 0.00 -1.74 0.00 0.00 68.15 67.92 2pro h THR 29 CO -0.17 0.47 0.37 -0.08 0.37 0.00 0.00 175.52 176.48 2pro h GLU 30 N 0.51 0.58 0.00 6.66 4.57 0.10 -1.70 114.58 125.31 2pro h GLU 30 Ca 0.06 -0.04 0.00 0.00 -1.18 0.00 0.00 59.36 58.20 2pro h GLU 30 Cb 0.83 -0.13 0.00 0.00 -0.16 0.00 0.00 28.75 29.29 2pro h GLU 30 CO 0.07 0.39 0.00 1.63 -1.18 0.00 0.00 179.01 179.92 2pro n LYS 31 N -4.87 0.00 -0.39 1.92 5.02 -0.53 -1.97 118.16 117.34 2pro n LYS 31 Ca 0.13 0.22 0.31 0.00 -2.02 0.00 0.00 58.31 56.95 2pro n LYS 31 Cb 0.33 -1.17 0.50 0.00 -0.02 0.00 0.00 35.03 34.67 2pro n LYS 31 CO 0.00 0.00 0.00 -0.11 -0.52 0.00 0.00 177.40 176.77 2pro n LEU 32 N -1.17 0.08 0.10 -0.35 0.00 -1.09 0.19 117.00 114.76 2pro n LEU 32 Ca 0.00 0.82 -0.04 0.00 0.00 0.00 0.00 56.01 56.79 2pro n LEU 32 Cb 0.00 -0.40 -0.02 0.00 0.00 0.00 0.00 43.42 43.00 2pro n LEU 32 CO 0.00 -0.86 0.45 0.00 0.00 0.00 0.00 177.39 176.98 2pro h ALA 33 N 0.89 -0.96 -0.80 1.96 0.00 -1.14 -1.98 119.26 117.24 2pro h ALA 33 Ca 0.61 -0.06 0.16 0.00 0.00 0.00 0.00 54.91 55.62 2pro h ALA 33 Cb 2.20 0.10 -0.15 0.00 0.00 0.00 0.00 17.79 19.94 2pro h ALA 33 CO -0.18 -0.94 -0.20 0.00 0.00 0.00 0.00 179.25 177.94 2pro h ARG 34 N -0.29 0.00 -0.53 0.00 3.08 0.28 -1.70 114.38 115.22 2pro h ARG 34 Ca -0.03 -0.00 -0.03 0.00 0.07 0.00 0.00 59.98 60.00 2pro h ARG 34 Cb 0.20 -0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.23 2pro h ARG 34 CO 0.04 0.00 0.23 1.15 -1.07 0.00 0.00 179.97 180.33 2pro h THR 35 N 0.00 1.21 -0.33 2.04 2.02 -1.14 -2.84 112.91 113.86 2pro h THR 35 Ca 0.38 -0.63 0.00 0.00 0.77 0.00 0.00 66.41 66.94 2pro h THR 35 Cb 0.59 0.64 0.00 0.00 -1.74 0.00 0.00 68.15 67.63 2pro h THR 35 CO -0.82 0.24 0.00 0.00 0.37 0.00 0.00 175.52 175.32 2pro n GLN 36 N -4.55 1.87 0.00 6.66 1.13 -0.75 -4.59 117.38 117.15 2pro n GLN 36 Ca 0.02 -1.34 0.00 0.00 -1.94 0.00 0.00 57.00 53.74 2pro n GLN 36 Cb 0.14 -1.33 0.00 0.00 0.11 0.00 0.00 30.24 29.16 2pro n GLN 36 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2pro n ALA 37 N 0.58 -0.31 0.33 -1.58 0.00 -0.68 0.24 120.51 119.07 2pro n ALA 37 Ca 0.14 0.00 -0.18 0.00 0.00 0.00 0.00 53.44 53.40 2pro n ALA 37 Cb 0.33 0.13 -0.10 0.00 0.00 0.00 0.00 19.45 19.82 2pro n ALA 37 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2pro h ALA 38 N -1.76 -1.18 -0.83 0.00 0.00 -1.81 -1.31 119.26 112.37 2pro h ALA 38 Ca 0.00 -0.20 0.21 0.00 0.00 0.00 0.00 54.91 54.91 2pro h ALA 38 Cb 0.00 0.69 -0.16 0.00 0.00 0.00 0.00 17.79 18.32 2pro h ALA 38 CO 0.00 -1.19 -0.06 0.00 0.00 0.00 0.00 179.25 178.00 2pro n ALA 39 N -2.77 0.35 0.49 0.00 0.00 -1.21 -0.38 120.51 116.99 2pro n ALA 39 Ca -0.12 0.90 -0.20 0.00 0.00 0.00 0.00 53.44 54.01 2pro n ALA 39 Cb 0.46 -0.62 -0.10 0.00 0.00 0.00 0.00 19.45 19.20 2pro n ALA 39 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 2pro h ILE 40 N 0.00 0.05 -0.70 0.00 2.04 0.47 -2.13 117.51 117.24 2pro h ILE 40 Ca 0.47 0.00 0.14 0.00 1.00 0.00 0.00 64.86 66.47 2pro h ILE 40 Cb 0.89 0.05 -0.13 0.00 -0.74 0.00 0.00 36.82 36.89 2pro h ILE 40 CO -0.81 0.00 -0.20 -0.33 0.00 0.00 0.00 178.15 176.80 2pro h GLU 41 N -1.27 -0.02 -0.73 2.37 5.08 0.41 0.60 114.58 121.01 2pro h GLU 41 Ca -0.13 0.00 0.06 0.00 -1.00 0.00 0.00 59.36 58.29 2pro h GLU 41 Cb 0.98 0.01 -0.06 0.00 0.50 0.00 0.00 28.75 30.18 2pro h GLU 41 CO 0.19 -0.02 0.43 0.00 -1.00 0.00 0.00 179.01 178.62 2pro h ARG 42 N -0.03 0.77 0.53 2.33 3.08 -1.03 0.91 114.38 120.93 2pro h ARG 42 Ca 0.33 -0.05 -0.03 0.00 0.07 0.00 0.00 59.98 60.31 2pro h ARG 42 Cb 0.53 -0.17 0.00 0.00 0.08 0.00 0.00 29.97 30.41 2pro h ARG 42 CO -0.73 0.51 -0.26 1.49 -1.07 0.00 0.00 179.97 179.91 2pro h GLU 43 N 0.79 -0.69 -0.15 0.04 4.81 -0.18 -3.17 114.58 116.04 2pro h GLU 43 Ca 0.32 0.05 -0.09 0.00 -0.13 0.00 0.00 59.36 59.51 2pro h GLU 43 Cb 0.17 0.16 -0.01 0.00 0.63 0.00 0.00 28.75 29.70 2pro h GLU 43 CO -0.17 -0.46 -0.29 0.74 -0.73 0.00 0.00 179.01 178.09 2pro h PHE 44 N -0.71 0.32 0.00 0.92 0.04 -1.51 -3.47 116.94 112.53 2pro h PHE 44 Ca -0.07 -0.07 0.00 0.00 2.80 0.00 0.00 57.97 60.63 2pro h PHE 44 Cb 0.55 -0.08 0.00 0.00 2.20 0.00 0.00 35.95 38.62 2pro h PHE 44 CO 0.10 0.56 0.00 0.41 -0.60 0.00 0.00 178.31 178.77 2pro n GLY 45 N -0.43 3.20 0.30 -1.45 0.00 0.31 -2.09 105.19 105.04 2pro n GLY 45 Ca -0.01 -0.03 0.09 0.00 0.00 0.00 0.00 46.02 46.07 2pro n GLY 45 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2pro h ALA 46 N -0.59 1.29 -0.05 4.61 0.00 -1.90 -0.18 119.26 122.44 2pro h ALA 46 Ca 0.00 0.13 -0.09 0.00 0.00 0.00 0.00 54.91 54.94 2pro h ALA 46 Cb 0.00 0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 2pro h ALA 46 CO 0.00 -0.24 -0.41 1.96 0.00 0.00 0.00 179.25 180.56 2pro h GLN 47 N 0.47 0.10 -3.65 0.00 1.08 -1.82 -3.41 115.11 107.88 2pro h GLN 47 Ca 0.49 -0.04 -0.42 0.00 -1.45 0.00 0.00 58.65 57.22 2pro h GLN 47 Cb 0.83 -0.00 0.06 0.00 -0.05 0.00 0.00 27.48 28.31 2pro h GLN 47 CO -0.45 0.50 -0.24 0.34 -0.95 0.00 0.00 178.83 178.03 2pro n PHE 48 N -4.04 -0.14 -0.11 2.96 7.35 -0.08 -1.46 117.46 121.93 2pro n PHE 48 Ca -0.02 0.60 0.00 0.00 -0.76 0.00 0.00 57.45 57.28 2pro n PHE 48 Cb 0.46 -1.21 0.00 0.00 0.35 0.00 0.00 39.48 39.08 2pro n PHE 48 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 2pro n ALA 49 N 0.21 1.91 0.00 3.13 0.00 -1.15 -1.45 120.51 123.15 2pro n ALA 49 Ca 0.11 -0.26 0.00 0.00 0.00 0.00 0.00 53.44 53.29 2pro n ALA 49 Cb 0.13 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.58 2pro n ALA 49 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2pro n GLY 50 N 0.29 3.15 3.16 0.00 0.00 -1.26 -4.25 105.19 106.28 2pro n GLY 50 Ca 0.00 -1.84 -0.12 0.00 0.00 0.00 0.00 46.02 44.06 2pro n GLY 50 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2pro s SER 51 N 0.00 -0.15 0.10 1.61 0.01 -1.26 0.40 113.70 114.41 2pro s SER 51 Ca 0.00 0.16 -0.20 0.00 1.31 0.00 0.00 55.95 57.22 2pro s SER 51 Cb 0.00 0.36 0.05 0.00 0.21 0.00 0.00 66.02 66.64 2pro s SER 51 CO 0.00 -0.28 0.49 -1.66 0.41 0.00 0.00 173.24 172.21 2pro s TRP 52 N -0.76 -0.37 -0.35 2.43 -2.14 0.85 -4.98 118.94 113.62 2pro s TRP 52 Ca -0.08 0.22 -0.18 0.00 2.66 0.00 0.00 56.10 58.71 2pro s TRP 52 Cb -0.05 0.36 -0.00 0.00 -3.10 0.00 0.00 33.47 30.69 2pro s TRP 52 CO 0.02 -0.72 0.53 0.42 -2.66 0.00 0.00 176.95 174.54 2pro s ILE 53 N -3.28 5.00 0.60 0.66 1.01 -1.26 0.14 121.20 124.08 2pro s ILE 53 Ca -0.01 0.40 0.08 0.00 0.00 0.00 0.00 60.65 61.12 2pro s ILE 53 Cb 0.00 -3.98 0.10 0.00 0.01 0.00 0.00 42.46 38.59 2pro s ILE 53 CO -0.08 -0.22 0.83 -1.61 0.00 0.00 0.00 174.94 173.86 2pro s GLU 54 N 2.44 2.18 -0.18 2.79 2.02 0.22 -4.87 118.70 123.30 2pro s GLU 54 Ca 0.20 -1.58 -0.02 0.00 0.02 0.00 0.00 54.97 53.59 2pro s GLU 54 Cb -0.15 -2.59 -0.01 0.00 0.10 0.00 0.00 34.13 31.47 2pro s GLU 54 CO 0.13 -0.98 -0.08 1.03 0.02 0.00 0.00 175.26 175.38 2pro s ARG 55 N -4.76 3.39 0.77 1.61 0.52 -1.26 0.80 118.95 120.03 2pro s ARG 55 Ca 0.63 -0.65 -0.11 0.00 -0.52 0.00 0.00 55.73 55.08 2pro s ARG 55 Cb -0.05 -2.85 0.05 0.00 0.52 0.00 0.00 34.95 32.62 2pro s ARG 55 CO 0.40 -0.02 1.09 1.21 0.02 0.00 0.00 175.30 178.01 2pro s ASN 56 N 0.98 4.74 0.26 0.23 3.84 0.63 -4.87 114.94 120.75 2pro s ASN 56 Ca -0.01 1.29 0.05 0.00 0.21 0.00 0.00 52.86 54.40 2pro s ASN 56 Cb -0.15 -2.05 0.72 0.00 -0.55 0.00 0.00 41.25 39.23 2pro s ASN 56 CO -0.00 -1.81 1.27 1.21 -2.79 0.00 0.00 177.10 174.98 2pro n GLU 57 N -3.33 -0.06 -1.76 0.43 2.13 -1.26 -1.57 120.64 115.22 2pro n GLU 57 Ca 0.07 1.19 -0.34 0.00 0.66 0.00 0.00 57.16 58.74 2pro n GLU 57 Cb 0.56 -1.94 -0.00 0.00 0.27 0.00 0.00 31.44 30.32 2pro n GLU 57 CO 0.00 0.00 0.00 -0.40 -0.41 0.00 0.00 177.13 176.32 2pro n ASP 58 N -5.08 7.08 0.00 4.31 5.75 -1.26 -4.83 116.55 122.53 2pro n ASP 58 Ca 0.22 -3.54 0.00 0.00 -0.01 0.00 0.00 54.79 51.46 2pro n ASP 58 Cb 0.72 -1.15 0.00 0.00 -1.03 0.00 0.00 41.12 39.66 2pro n ASP 58 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2pro n GLY 59 N 0.15 0.42 3.75 6.12 0.00 -0.61 -4.94 105.19 110.09 2pro n GLY 59 Ca 0.52 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 46.21 2pro n GLY 59 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2pro s SER 60 N -1.90 4.67 -0.06 1.61 1.04 -1.25 -4.68 113.70 113.13 2pro s SER 60 Ca 0.00 2.04 -0.08 0.00 0.48 0.00 0.00 55.95 58.39 2pro s SER 60 Cb 0.00 -2.55 -0.04 0.00 0.10 0.00 0.00 66.02 63.52 2pro s SER 60 CO 0.00 -1.93 0.22 -0.36 0.98 0.00 0.00 173.24 172.15 2pro s PHE 61 N -2.42 3.61 0.13 5.02 0.08 -1.26 0.23 117.98 123.37 2pro s PHE 61 Ca 0.67 0.60 0.07 0.00 0.12 0.00 0.00 56.93 58.38 2pro s PHE 61 Cb -0.21 -2.00 -0.04 0.00 -0.57 0.00 0.00 43.02 40.20 2pro s PHE 61 CO 0.46 0.69 -0.15 -1.59 -0.10 0.00 0.00 175.22 174.52 2pro s LYS 62 N -1.30 1.08 -0.27 0.44 -2.85 0.24 -4.79 119.74 112.29 2pro s LYS 62 Ca 0.20 -1.26 -0.09 0.00 -1.00 0.00 0.00 55.97 53.82 2pro s LYS 62 Cb -0.13 -1.03 -0.03 0.00 -2.06 0.00 0.00 37.83 34.58 2pro s LYS 62 CO 0.10 0.21 0.14 -1.17 0.10 0.00 0.00 175.35 174.72 2pro s LEU 63 N -2.43 3.80 -0.21 2.77 2.96 -1.26 0.73 118.68 125.03 2pro s LEU 63 Ca 0.10 -0.17 -0.06 0.00 -0.22 0.00 0.00 54.13 53.77 2pro s LEU 63 Cb -0.06 -2.02 -0.03 0.00 0.50 0.00 0.00 46.19 44.58 2pro s LEU 63 CO 0.04 -0.07 0.03 -0.69 -1.32 0.00 0.00 176.35 174.34 2pro s VAL 64 N 1.68 4.26 -0.24 1.68 1.01 0.38 -1.57 120.40 127.59 2pro s VAL 64 Ca 0.06 -0.21 0.02 0.00 0.00 0.00 0.00 61.98 61.85 2pro s VAL 64 Cb -0.16 -2.94 0.04 0.00 0.00 0.00 0.00 36.38 33.33 2pro s VAL 64 CO 0.07 0.42 -0.12 0.00 0.00 0.00 0.00 175.10 175.47 2pro s ALA 65 N 0.96 2.54 0.71 5.51 0.00 -0.60 -0.11 121.76 130.78 2pro s ALA 65 Ca 0.03 -1.59 -0.04 0.00 0.00 0.00 0.00 51.96 50.36 2pro s ALA 65 Cb -0.14 -1.52 0.10 0.00 0.00 0.00 0.00 23.12 21.55 2pro s ALA 65 CO 0.02 -0.94 0.99 0.00 0.00 0.00 0.00 175.76 175.84 2pro s ALA 66 N 1.19 3.42 -0.29 0.00 0.00 0.16 -2.05 121.76 124.19 2pro s ALA 66 Ca -0.04 -1.36 -0.15 0.00 0.00 0.00 0.00 51.96 50.41 2pro s ALA 66 Cb -0.18 -2.28 0.13 0.00 0.00 0.00 0.00 23.12 20.80 2pro s ALA 66 CO -0.07 -1.38 0.88 -0.08 0.00 0.00 0.00 175.76 175.12 2pro s THR 67 N -3.18 -0.17 -1.89 0.00 -1.32 -1.21 -2.93 115.64 104.94 2pro s THR 67 Ca 0.64 0.00 0.00 0.00 -1.21 0.00 0.00 61.69 61.12 2pro s THR 67 Cb -0.08 -1.00 0.00 0.00 -1.51 0.00 0.00 72.50 69.91 2pro s THR 67 CO 0.44 0.00 0.73 -1.54 -2.21 0.00 0.00 174.62 172.04 2pro n SER 68 N 4.21 0.08 0.00 8.08 3.41 -0.54 -2.18 113.62 126.69 2pro n SER 68 Ca -0.17 -1.55 0.00 0.00 -0.26 0.00 0.00 58.87 56.89 2pro n SER 68 Cb 0.56 -0.04 0.00 0.00 -0.26 0.00 0.00 64.21 64.47 2pro n SER 68 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2pro n GLY 69 N 0.26 0.22 0.00 5.00 0.00 -1.26 -4.89 105.19 104.51 2pro n GLY 69 Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 46.02 46.00 2pro n GLY 69 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2pro n ALA 70 N -3.00 0.00 -2.71 4.61 0.00 -1.26 -4.99 120.51 113.16 2pro n ALA 70 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 53.02 2pro n ALA 70 Cb 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.42 2pro n ALA 70 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.50 176.52 2pro s ARG 71 N 0.00 3.41 0.60 0.00 3.03 -1.26 -4.82 118.95 119.91 2pro s ARG 71 Ca 0.00 -1.04 0.29 0.00 2.03 0.00 0.00 55.73 57.01 2pro s ARG 71 Cb 0.00 -4.78 1.56 0.00 -1.03 0.00 0.00 34.95 30.71 2pro s ARG 71 CO 0.00 -2.01 1.86 1.57 -1.13 0.00 0.00 175.30 175.59 2pro h LYS 72 N 9.56 0.00 -5.22 3.89 -0.00 -1.98 -3.42 116.57 119.40 2pro h LYS 72 Ca -0.01 0.00 -0.46 0.00 -0.00 0.00 0.00 60.65 60.18 2pro h LYS 72 Cb 1.03 0.00 -0.14 0.00 -0.00 0.00 0.00 32.23 33.12 2pro h LYS 72 CO 1.27 0.00 -0.62 -1.54 -0.00 0.00 0.00 179.45 178.56 2pro s SER 73 N -4.34 2.28 -0.27 7.07 1.04 -1.26 -4.76 113.70 113.46 2pro s SER 73 Ca -0.03 -1.34 -0.22 0.00 0.48 0.00 0.00 55.95 54.84 2pro s SER 73 Cb 0.08 -0.07 0.08 0.00 0.10 0.00 0.00 66.02 66.21 2pro s SER 73 CO 0.26 -0.57 0.73 -0.55 0.98 0.00 0.00 173.24 174.09 2pro s SER 74 N -3.45 -0.80 -0.07 7.02 0.15 -1.26 -5.05 113.70 110.25 2pro s SER 74 Ca 0.35 1.43 0.02 0.00 0.70 0.00 0.00 55.95 58.45 2pro s SER 74 Cb 0.08 1.41 0.16 0.00 -1.71 0.00 0.00 66.02 65.96 2pro s SER 74 CO 0.14 -0.24 0.94 0.35 1.20 0.00 0.00 173.24 175.63 2pro n THR 75 N 3.24 0.94 -2.97 6.45 -2.24 -1.26 -4.88 114.28 113.56 2pro n THR 75 Ca -0.16 -0.34 -0.35 0.00 -2.27 0.00 0.00 64.05 60.93 2pro n THR 75 Cb 0.56 -0.62 -0.06 0.00 -2.10 0.00 0.00 70.33 68.11 2pro n THR 75 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 2pro s LEU 76 N -0.64 4.21 0.04 3.22 1.43 -1.26 -5.03 118.68 120.65 2pro s LEU 76 Ca 0.12 1.55 -0.28 0.00 -1.03 0.00 0.00 54.13 54.49 2pro s LEU 76 Cb 0.09 -3.99 -0.04 0.00 0.03 0.00 0.00 46.19 42.28 2pro s LEU 76 CO 0.03 -0.12 0.91 -0.83 0.23 0.00 0.00 176.35 176.57 2pro s GLY 77 N -1.87 2.90 0.00 -3.19 0.00 -1.26 -3.89 107.32 100.01 2pro s GLY 77 Ca 0.51 0.47 0.00 0.00 0.00 0.00 0.00 44.72 45.70 2pro s GLY 77 CO 0.19 1.45 0.00 0.61 0.00 0.00 0.00 173.10 175.36 2pro n GLY 78 N 2.60 0.85 3.36 0.20 0.00 -1.26 -5.03 105.19 105.91 2pro n GLY 78 Ca 0.03 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.72 2pro n GLY 78 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2pro s VAL 79 N -3.34 2.79 -0.20 1.61 1.01 -1.25 -4.22 120.40 116.80 2pro s VAL 79 Ca 0.00 -0.78 -0.08 0.00 0.00 0.00 0.00 61.98 61.12 2pro s VAL 79 Cb 0.00 -2.12 -0.04 0.00 0.00 0.00 0.00 36.38 34.22 2pro s VAL 79 CO 0.00 0.55 0.08 -0.70 0.00 0.00 0.00 175.10 175.03 2pro s GLU 80 N 0.05 3.98 -0.09 2.72 2.12 -0.61 -4.90 118.70 121.96 2pro s GLU 80 Ca -0.06 -0.34 -0.25 0.00 0.36 0.00 0.00 54.97 54.69 2pro s GLU 80 Cb -0.15 -3.29 -0.03 0.00 0.26 0.00 0.00 34.13 30.92 2pro s GLU 80 CO 0.05 0.20 0.76 0.08 -0.54 0.00 0.00 175.26 175.81 2pro s VAL 81 N 0.59 4.98 -0.75 3.70 1.01 -1.26 -1.55 120.40 127.12 2pro s VAL 81 Ca 0.04 1.55 0.03 0.00 0.00 0.00 0.00 61.98 63.60 2pro s VAL 81 Cb -0.13 -4.09 0.18 0.00 0.00 0.00 0.00 36.38 32.34 2pro s VAL 81 CO 0.01 0.17 0.57 -0.60 0.00 0.00 0.00 175.10 175.25 2pro s ARG 82 N 1.24 2.69 -0.72 2.72 6.06 -0.87 -4.95 118.95 125.11 2pro s ARG 82 Ca 0.39 -3.28 -0.26 0.00 -2.50 0.00 0.00 55.73 50.08 2pro s ARG 82 Cb -0.18 -3.59 -0.15 0.00 0.06 0.00 0.00 34.95 31.10 2pro s ARG 82 CO 0.17 -1.27 2.48 0.09 -2.50 0.00 0.00 175.30 174.27 2pro n ASN 83 N 2.17 1.34 -1.37 -2.12 3.02 -1.26 -3.31 115.26 113.73 2pro n ASN 83 Ca 0.19 -0.46 0.00 0.00 -0.03 0.00 0.00 54.58 54.28 2pro n ASN 83 Cb 0.35 -1.32 0.00 0.00 -0.61 0.00 0.00 39.78 38.21 2pro n ASN 83 CO 0.00 0.00 0.00 1.33 -2.62 0.00 0.00 177.26 175.97 2pro n VAL 84 N 7.77 0.00 -0.08 2.41 0.24 -0.93 -4.94 118.33 122.80 2pro n VAL 84 Ca 0.49 0.00 -0.13 0.00 -2.04 0.00 0.00 64.34 62.66 2pro n VAL 84 Cb 0.35 -0.97 -0.08 0.00 -1.47 0.00 0.00 33.84 31.67 2pro n VAL 84 CO 0.00 0.00 0.00 -0.09 -2.14 0.00 0.00 176.83 174.60 2pro h ARG 85 N 0.00 0.00 -6.11 7.34 9.65 -1.91 -3.40 114.38 119.95 2pro h ARG 85 Ca 0.00 0.00 -0.68 0.00 -1.10 0.00 0.00 59.98 58.20 2pro h ARG 85 Cb 0.00 0.00 -0.18 0.00 -1.39 0.00 0.00 29.97 28.40 2pro h ARG 85 CO 0.00 0.65 -0.68 0.71 2.80 0.00 0.00 179.97 183.45 2pro s TYR 86 N -2.18 2.99 0.68 2.20 2.02 -1.26 -4.84 117.35 116.96 2pro s TYR 86 Ca -0.19 0.06 -0.14 0.00 -0.37 0.00 0.00 57.07 56.43 2pro s TYR 86 Cb 0.02 -1.72 0.01 0.00 -0.40 0.00 0.00 41.96 39.87 2pro s TYR 86 CO 0.45 0.37 1.12 -1.54 -1.57 0.00 0.00 175.55 174.38 2pro s SER 87 N -0.86 4.90 0.62 2.29 1.04 -1.26 -4.60 113.70 115.82 2pro s SER 87 Ca 0.13 2.03 0.41 0.00 0.48 0.00 0.00 55.95 59.00 2pro s SER 87 Cb -0.11 -2.55 2.24 0.00 0.10 0.00 0.00 66.02 65.69 2pro s SER 87 CO 0.02 -1.77 2.26 0.25 0.98 0.00 0.00 173.24 174.98 2pro h LEU 88 N -0.15 0.00 0.00 2.42 5.85 -1.42 -2.74 115.31 119.28 2pro h LEU 88 Ca -0.46 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.26 2pro h LEU 88 Cb 1.25 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.28 2pro h LEU 88 CO 0.53 0.00 0.00 1.17 -0.34 0.00 0.00 178.44 179.80 2pro n LYS 89 N -2.95 0.00 -0.14 1.25 3.00 -1.26 -3.25 118.16 114.80 2pro n LYS 89 Ca -0.03 0.29 0.20 0.00 -0.00 0.00 0.00 58.31 58.77 2pro n LYS 89 Cb 0.08 -0.94 0.30 0.00 0.00 0.00 0.00 35.03 34.47 2pro n LYS 89 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.40 178.44 2pro n GLN 90 N -1.36 0.01 0.06 1.64 6.02 -1.05 0.16 117.38 122.85 2pro n GLN 90 Ca 0.00 0.74 -0.21 0.00 -0.01 0.00 0.00 57.00 57.52 2pro n GLN 90 Cb 0.00 -1.84 -0.15 0.00 1.02 0.00 0.00 30.24 29.27 2pro n GLN 90 CO 0.00 0.00 0.00 -0.07 -1.01 0.00 0.00 177.06 175.98 2pro h LEU 91 N 0.00 0.51 -1.21 1.08 3.38 -1.61 -2.70 115.31 114.75 2pro h LEU 91 Ca 0.35 -0.82 -0.07 0.00 0.09 0.00 0.00 57.88 57.43 2pro h LEU 91 Cb 2.11 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 42.68 2pro h LEU 91 CO -0.00 1.70 -0.16 1.56 0.09 0.00 0.00 178.44 181.62 2pro h GLN 92 N 0.09 0.34 0.53 1.13 1.08 0.16 1.64 115.11 120.08 2pro h GLN 92 Ca -0.34 -0.10 -0.03 0.00 -1.45 0.00 0.00 58.65 56.74 2pro h GLN 92 Cb 2.07 -0.04 0.01 0.00 -0.05 0.00 0.00 27.48 29.47 2pro h GLN 92 CO 0.16 0.51 -0.25 1.03 -0.95 0.00 0.00 178.83 179.32 2pro h SER 93 N 0.32 -0.60 0.00 1.46 0.87 -1.53 -2.26 113.55 111.80 2pro h SER 93 Ca 0.06 0.02 0.00 0.00 -1.23 0.00 0.00 61.79 60.64 2pro h SER 93 Cb 0.48 0.16 0.00 0.00 -0.44 0.00 0.00 62.40 62.60 2pro h SER 93 CO 0.03 -0.37 0.44 0.00 -0.53 0.00 0.00 176.83 176.40 2pro h ALA 94 N -1.55 1.43 0.00 6.23 0.00 -1.11 0.96 119.26 125.22 2pro h ALA 94 Ca -0.07 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.84 2pro h ALA 94 Cb 0.54 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.33 2pro h ALA 94 CO 0.12 -0.43 -0.22 -0.12 0.00 0.00 0.00 179.25 178.59 2pro n MET 95 N -2.79 0.11 -0.13 0.00 0.00 0.56 -3.71 117.12 111.15 2pro n MET 95 Ca -0.02 0.06 -0.26 0.00 0.00 0.00 0.00 57.70 57.48 2pro n MET 95 Cb 0.48 -1.60 -0.11 0.00 0.00 0.00 0.00 33.22 31.99 2pro n MET 95 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 175.97 176.36 2pro n GLU 96 N -1.77 0.61 -0.53 2.12 1.02 0.33 -1.99 120.64 120.43 2pro n GLU 96 Ca 0.06 0.27 0.41 0.00 -0.02 0.00 0.00 57.16 57.88 2pro n GLU 96 Cb 0.38 -1.53 0.65 0.00 -0.02 0.00 0.00 31.44 30.92 2pro n GLU 96 CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 2pro n GLN 97 N -4.03 -0.01 -0.07 3.49 6.02 -1.05 0.66 117.38 122.38 2pro n GLN 97 Ca -0.50 0.99 -0.10 0.00 -0.01 0.00 0.00 57.00 57.38 2pro n GLN 97 Cb 0.90 -2.13 -0.06 0.00 1.02 0.00 0.00 30.24 29.97 2pro n GLN 97 CO 0.00 0.00 0.00 -0.07 -1.01 0.00 0.00 177.06 175.98 2pro h LEU 98 N 0.00 0.00 -1.97 1.08 4.07 -1.71 -2.48 115.31 114.30 2pro h LEU 98 Ca 0.79 -0.32 0.02 0.00 0.08 0.00 0.00 57.88 58.44 2pro h LEU 98 Cb 2.91 0.00 -0.00 0.00 1.08 0.00 0.00 40.66 44.65 2pro h LEU 98 CO -0.17 0.92 0.36 0.44 -1.08 0.00 0.00 178.44 178.91 2pro h ASP 99 N -1.00 0.00 0.00 -0.43 3.32 0.81 -1.42 116.42 117.71 2pro h ASP 99 Ca -0.09 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.96 2pro h ASP 99 Cb 0.68 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.23 2pro h ASP 99 CO -0.05 0.00 0.00 0.00 -1.72 0.00 0.00 179.24 177.47 2pro n ALA 100 N -1.95 0.00 0.00 3.45 0.00 3.02 -4.19 120.51 120.84 2pro n ALA 100 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.43 2pro n ALA 100 Cb 0.42 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.87 2pro n ALA 100 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2pro n GLY 101 N 2.53 0.00 3.81 0.00 0.00 -0.94 -5.05 105.19 105.55 2pro n GLY 101 Ca 0.00 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.69 2pro n GLY 101 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2pro s ALA 102 N -1.45 2.94 -0.52 4.61 0.00 -0.54 -4.96 121.76 121.85 2pro s ALA 102 Ca 0.00 0.46 -0.16 0.00 0.00 0.00 0.00 51.96 52.26 2pro s ALA 102 Cb 0.00 -3.20 -0.15 0.00 0.00 0.00 0.00 23.12 19.77 2pro s ALA 102 CO 0.00 -0.19 1.55 0.41 0.00 0.00 0.00 175.76 177.53 2pro n GLY 115 N -0.63 -0.18 2.78 0.00 0.00 -1.26 -5.08 105.19 100.82 2pro n GLY 115 Ca 0.08 -0.05 -0.30 0.00 0.00 0.00 0.00 46.02 45.76 2pro n GLY 115 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2pro s VAL 116 N 9.22 1.57 0.36 1.61 1.01 -1.26 -3.04 120.40 129.87 2pro s VAL 116 Ca 0.45 -2.48 0.18 0.00 0.00 0.00 0.00 61.98 60.14 2pro s VAL 116 Cb -0.01 -2.12 0.34 0.00 0.00 0.00 0.00 36.38 34.60 2pro s VAL 116 CO 0.12 -0.82 1.61 1.56 0.00 0.00 0.00 175.10 177.57 2pro h GLN 117 N 6.97 0.11 0.00 2.72 4.20 -1.34 -3.47 115.11 124.31 2pro h GLN 117 Ca -0.04 -0.01 0.00 0.00 0.06 0.00 0.00 58.65 58.66 2pro h GLN 117 Cb 0.94 -0.02 0.00 0.00 0.30 0.00 0.00 27.48 28.70 2pro h GLN 117 CO 0.52 0.07 0.00 -1.13 -0.67 0.00 0.00 178.83 177.62 2pro n SER 118 N -5.20 0.00 -3.92 1.46 3.41 -1.05 -4.99 113.62 103.34 2pro n SER 118 Ca 0.35 0.00 -0.08 0.00 -0.26 0.00 0.00 58.87 58.88 2pro n SER 118 Cb 1.16 0.00 -0.08 0.00 -0.26 0.00 0.00 64.21 65.03 2pro n SER 118 CO 0.00 0.00 0.00 -1.66 -0.16 0.00 0.00 175.04 173.22 2pro s TRP 119 N -2.84 0.25 -0.26 7.33 -2.14 -1.26 0.13 118.94 120.15 2pro s TRP 119 Ca 0.00 -0.71 -0.26 0.00 2.66 0.00 0.00 56.10 57.79 2pro s TRP 119 Cb 0.00 -0.14 0.14 0.00 -3.10 0.00 0.00 33.47 30.37 2pro s TRP 119 CO 0.00 -0.52 1.12 1.52 -2.66 0.00 0.00 176.95 176.42 2pro s TYR 120 N -3.88 -0.35 1.06 1.66 -0.85 -1.15 -4.93 117.35 108.90 2pro s TYR 120 Ca 0.06 0.78 -0.12 0.00 -0.52 0.00 0.00 57.07 57.27 2pro s TYR 120 Cb 0.06 0.41 0.22 0.00 0.38 0.00 0.00 41.96 43.03 2pro s TYR 120 CO -0.10 -0.20 1.07 0.08 -1.52 0.00 0.00 175.55 174.87 2pro s VAL 121 N -0.18 2.14 -0.37 -3.49 1.01 -1.26 -0.81 120.40 117.44 2pro s VAL 121 Ca 0.03 0.05 0.05 0.00 0.00 0.00 0.00 61.98 62.11 2pro s VAL 121 Cb -0.04 -2.23 0.17 0.00 0.00 0.00 0.00 36.38 34.28 2pro s VAL 121 CO -0.06 -0.06 0.50 -0.62 0.00 0.00 0.00 175.10 174.86 2pro s ASP 122 N -2.82 -0.30 0.57 3.32 2.15 -0.57 -4.74 116.67 114.29 2pro s ASP 122 Ca 0.67 -0.94 0.27 0.00 0.43 0.00 0.00 52.55 52.97 2pro s ASP 122 Cb -0.23 1.34 1.59 0.00 -0.30 0.00 0.00 42.92 45.33 2pro s ASP 122 CO 0.61 -0.24 2.10 1.55 -0.17 0.00 0.00 175.17 179.03 2pro h PRO 123 N 7.26 0.00 -0.07 4.34 0.13 -1.85 -0.12 132.00 141.69 2pro h PRO 123 Ca 0.03 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.15 2pro h PRO 123 Cb 1.13 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.25 2pro h PRO 123 CO 0.16 0.00 0.01 -0.09 -0.23 0.00 0.00 178.00 177.85 2pro h ARG 124 N 0.00 0.11 -0.20 0.86 2.43 -1.95 -3.13 114.38 112.50 2pro h ARG 124 Ca 0.09 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.23 2pro h ARG 124 Cb 0.47 -0.01 0.00 0.00 -0.42 0.00 0.00 29.97 30.01 2pro h ARG 124 CO -0.00 0.35 0.00 -1.13 -1.51 0.00 0.00 179.97 177.68 2pro n SER 125 N -4.88 2.40 -3.49 -3.80 3.41 -0.87 -4.97 113.62 101.41 2pro n SER 125 Ca -0.07 -1.81 -0.20 0.00 -0.26 0.00 0.00 58.87 56.53 2pro n SER 125 Cb 0.17 -0.12 0.06 0.00 -0.26 0.00 0.00 64.21 64.05 2pro n SER 125 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 2pro n ASN 126 N 0.82 -4.10 -3.54 4.04 4.05 -0.11 -5.01 115.26 111.41 2pro n ASN 126 Ca 0.17 -0.78 -0.14 0.00 0.45 0.00 0.00 54.58 54.28 2pro n ASN 126 Cb 0.46 -4.53 -0.05 0.00 1.23 0.00 0.00 39.78 36.88 2pro n ASN 126 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 2pro s ALA 127 N -3.47 -1.84 0.67 5.20 0.00 -1.13 -4.82 121.76 116.37 2pro s ALA 127 Ca 0.26 1.39 -0.13 0.00 0.00 0.00 0.00 51.96 53.47 2pro s ALA 127 Cb -0.06 -0.26 0.00 0.00 0.00 0.00 0.00 23.12 22.81 2pro s ALA 127 CO 0.78 -0.38 1.08 0.08 0.00 0.00 0.00 175.76 177.32 2pro s VAL 128 N -1.37 3.63 -0.32 0.00 1.01 0.35 -1.50 120.40 122.19 2pro s VAL 128 Ca -0.05 0.66 -0.02 0.00 0.00 0.00 0.00 61.98 62.57 2pro s VAL 128 Cb -0.00 -3.22 0.12 0.00 0.00 0.00 0.00 36.38 33.27 2pro s VAL 128 CO 0.04 -0.56 0.17 -0.69 0.00 0.00 0.00 175.10 174.05 2pro s VAL 129 N -2.66 0.17 0.31 2.92 1.01 0.00 -2.58 120.40 119.58 2pro s VAL 129 Ca 0.63 -1.30 -0.29 0.00 0.00 0.00 0.00 61.98 61.01 2pro s VAL 129 Cb -0.17 -1.15 -0.11 0.00 0.00 0.00 0.00 36.38 34.96 2pro s VAL 129 CO 0.46 -0.84 1.44 -0.69 0.00 0.00 0.00 175.10 175.47 2pro s VAL 130 N 1.54 2.43 -0.39 2.92 1.01 -1.22 -2.95 120.40 123.74 2pro s VAL 130 Ca 0.13 0.39 0.03 0.00 0.00 0.00 0.00 61.98 62.54 2pro s VAL 130 Cb -0.19 -3.25 0.11 0.00 0.00 0.00 0.00 36.38 33.05 2pro s VAL 130 CO -0.18 0.08 0.14 -0.75 0.00 0.00 0.00 175.10 174.39 2pro s LYS 131 N -1.21 1.44 0.50 2.72 2.20 0.34 -3.07 119.74 122.67 2pro s LYS 131 Ca 0.55 -1.94 -0.01 0.00 -0.36 0.00 0.00 55.97 54.21 2pro s LYS 131 Cb -0.43 -2.89 0.01 0.00 -1.51 0.00 0.00 37.83 33.00 2pro s LYS 131 CO 0.52 -1.02 0.74 0.14 -0.36 0.00 0.00 175.35 175.37 2pro s VAL 132 N 0.65 3.63 0.96 4.02 -7.23 -1.09 -0.93 120.40 120.41 2pro s VAL 132 Ca 0.13 -0.43 -0.15 0.00 -1.81 0.00 0.00 61.98 59.72 2pro s VAL 132 Cb -0.21 -3.37 0.20 0.00 0.56 0.00 0.00 36.38 33.56 2pro s VAL 132 CO -0.08 -0.29 1.32 -0.62 -0.31 0.00 0.00 175.10 175.12 2pro s ASP 133 N -4.28 3.09 0.06 4.85 -1.08 -1.17 -4.33 116.67 113.81 2pro s ASP 133 Ca 0.51 0.20 -0.31 0.00 -0.52 0.00 0.00 52.55 52.43 2pro s ASP 133 Cb -0.10 -0.23 -0.07 0.00 -1.46 0.00 0.00 42.92 41.07 2pro s ASP 133 CO 0.40 -2.74 1.39 -1.81 0.52 0.00 0.00 175.17 172.92 2pro s ASP 134 N -4.91 6.85 0.00 -0.34 1.11 -1.26 -2.28 116.67 115.84 2pro s ASP 134 Ca 0.74 2.22 0.00 0.00 0.18 0.00 0.00 52.55 55.69 2pro s ASP 134 Cb -0.03 -2.57 0.00 0.00 1.07 0.00 0.00 42.92 41.38 2pro s ASP 134 CO 0.53 -0.67 0.00 0.61 1.18 0.00 0.00 175.17 176.82 2pro n GLY 135 N 3.55 1.21 1.40 0.21 0.00 -1.26 -4.89 105.19 105.41 2pro n GLY 135 Ca 0.12 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.05 2pro n GLY 135 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2pro n ALA 136 N -0.36 4.63 -0.10 4.61 0.00 -0.97 -4.66 120.51 123.66 2pro n ALA 136 Ca 0.00 -3.16 -0.10 0.00 0.00 0.00 0.00 53.44 50.18 2pro n ALA 136 Cb 0.00 -0.86 -0.02 0.00 0.00 0.00 0.00 19.45 18.57 2pro n ALA 136 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 2pro h THR 137 N 1.05 1.18 0.00 0.00 2.02 -1.89 -0.82 112.91 114.44 2pro h THR 137 Ca 0.30 -0.56 -0.11 0.00 0.77 0.00 0.00 66.41 66.82 2pro h THR 137 Cb 1.81 0.95 -0.02 0.00 -1.74 0.00 0.00 68.15 69.15 2pro h THR 137 CO 0.55 0.19 -0.53 -2.24 0.37 0.00 0.00 175.52 173.86 2pro h ASP 138 N 0.37 0.00 -1.00 4.18 2.03 -1.97 1.06 116.42 121.09 2pro h ASP 138 Ca 0.11 0.00 0.20 0.00 -0.73 0.00 0.00 57.03 56.61 2pro h ASP 138 Cb 0.18 0.00 -0.11 0.00 -0.83 0.00 0.00 39.33 38.57 2pro h ASP 138 CO -0.01 0.53 0.61 0.00 -1.03 0.00 0.00 179.24 179.35 2pro h ALA 139 N 1.47 1.69 0.00 4.15 0.00 -1.63 0.14 119.26 125.08 2pro h ALA 139 Ca -0.01 0.09 -0.07 0.00 0.00 0.00 0.00 54.91 54.92 2pro h ALA 139 Cb 0.97 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.68 2pro h ALA 139 CO 0.07 -0.08 -1.22 0.41 0.00 0.00 0.00 179.25 178.43 2pro n GLY 140 N -1.32 -1.34 0.32 0.00 0.00 -0.05 -2.79 105.19 100.01 2pro n GLY 140 Ca 0.24 -0.19 -0.02 0.00 0.00 0.00 0.00 46.02 46.05 2pro n GLY 140 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2pro h VAL 141 N 0.00 1.21 0.05 1.61 2.07 0.36 -1.07 116.25 120.49 2pro h VAL 141 Ca -0.07 -0.67 -0.00 0.00 0.82 0.00 0.00 66.70 66.78 2pro h VAL 141 Cb 1.26 0.49 0.00 0.00 -1.52 0.00 0.00 31.29 31.52 2pro h VAL 141 CO 0.02 0.27 -0.02 0.44 0.02 0.00 0.00 177.57 178.29 2pro h ASP 142 N 0.87 -0.06 -0.75 0.57 3.32 -1.03 -2.58 116.42 116.76 2pro h ASP 142 Ca 0.21 -0.16 0.26 0.00 0.02 0.00 0.00 57.03 57.35 2pro h ASP 142 Cb 0.17 0.01 -0.14 0.00 0.22 0.00 0.00 39.33 39.59 2pro h ASP 142 CO -0.02 0.51 0.20 0.33 -1.72 0.00 0.00 179.24 178.54 2pro n PHE 143 N -4.80 0.67 0.00 4.55 7.35 -1.12 0.27 117.46 124.39 2pro n PHE 143 Ca -0.03 0.90 0.00 0.00 -0.76 0.00 0.00 57.45 57.56 2pro n PHE 143 Cb 0.11 -1.18 0.00 0.00 0.35 0.00 0.00 39.48 38.75 2pro n PHE 143 CO 0.00 0.00 0.00 0.28 -0.76 0.00 0.00 176.76 176.28 2pro n VAL 144 N -4.88 0.00 -0.00 -2.13 0.31 -0.42 -3.64 118.33 107.58 2pro n VAL 144 Ca 0.23 0.79 -0.00 0.00 -0.01 0.00 0.00 64.34 65.35 2pro n VAL 144 Cb 0.77 -1.63 -0.00 0.00 -0.91 0.00 0.00 33.84 32.07 2pro n VAL 144 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2pro n ALA 145 N -1.57 -0.00 0.15 3.52 0.00 0.14 0.31 120.51 123.05 2pro n ALA 145 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2pro n ALA 145 Cb 0.00 0.07 0.00 0.00 0.00 0.00 0.00 19.45 19.52 2pro n ALA 145 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 177.50 178.97 2pro n LEU 146 N -2.18 0.46 0.00 0.00 -0.00 0.55 -1.78 117.00 114.04 2pro n LEU 146 Ca 0.00 -0.23 0.00 0.00 -0.00 0.00 0.00 56.01 55.78 2pro n LEU 146 Cb 0.00 -0.08 0.00 0.00 -0.00 0.00 0.00 43.42 43.34 2pro n LEU 146 CO -0.00 0.08 -0.10 -1.54 -0.00 0.00 0.00 177.39 175.83 2pro n SER 147 N 0.94 0.98 0.00 1.45 3.41 0.91 -4.84 113.62 116.48 2pro n SER 147 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 2pro n SER 147 Cb 0.08 0.20 0.00 0.00 -0.26 0.00 0.00 64.21 64.22 2pro n SER 147 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2pro n GLY 148 N 0.49 3.14 3.49 5.00 0.00 -0.74 -4.56 105.19 112.01 2pro n GLY 148 Ca 0.00 0.00 -0.48 0.00 0.00 0.00 0.00 46.02 45.54 2pro n GLY 148 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2pro n ALA 149 N -0.59 1.27 -1.15 4.61 0.00 -1.26 -4.76 120.51 118.64 2pro n ALA 149 Ca 0.00 -0.14 -0.49 0.00 0.00 0.00 0.00 53.44 52.81 2pro n ALA 149 Cb 0.00 -2.67 -0.09 0.00 0.00 0.00 0.00 19.45 16.70 2pro n ALA 149 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 2pro n ASP 150 N 10.54 0.75 0.33 0.00 -0.08 -1.26 -4.70 116.55 122.12 2pro n ASP 150 Ca 0.38 0.71 0.08 0.00 -1.51 0.00 0.00 54.79 54.45 2pro n ASP 150 Cb 0.30 -0.69 0.42 0.00 2.34 0.00 0.00 41.12 43.49 2pro n ASP 150 CO 0.00 0.00 0.00 0.77 0.12 0.00 0.00 177.20 178.09 2pro h SER 151 N 5.50 0.00 0.95 1.67 4.64 -1.96 0.13 113.55 124.48 2pro h SER 151 Ca -0.20 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.12 2pro h SER 151 Cb 1.08 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.17 2pro h SER 151 CO 0.80 0.00 -0.44 0.00 -0.87 0.00 0.00 176.83 176.32 2pro n ALA 152 N -1.69 2.83 0.85 5.18 0.00 -1.26 -3.93 120.51 122.49 2pro n ALA 152 Ca -0.01 -0.21 0.09 0.00 0.00 0.00 0.00 53.44 53.32 2pro n ALA 152 Cb 0.67 -1.24 -0.03 0.00 0.00 0.00 0.00 19.45 18.85 2pro n ALA 152 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 2pro n GLN 153 N -2.03 1.36 -2.39 0.00 6.02 0.45 -4.97 117.38 115.82 2pro n GLN 153 Ca 0.04 -0.69 -0.14 0.00 -0.01 0.00 0.00 57.00 56.20 2pro n GLN 153 Cb 0.42 -1.37 0.05 0.00 1.02 0.00 0.00 30.24 30.36 2pro n GLN 153 CO 0.00 0.00 0.00 1.33 -1.01 0.00 0.00 177.06 177.38 2pro n VAL 154 N -0.40 0.00 -3.06 5.09 0.24 -1.21 0.13 118.33 119.12 2pro n VAL 154 Ca 0.07 -1.38 0.03 0.00 -2.04 0.00 0.00 64.34 61.02 2pro n VAL 154 Cb 0.37 -0.68 -0.00 0.00 -1.47 0.00 0.00 33.84 32.06 2pro n VAL 154 CO 0.00 0.00 0.00 -0.60 -2.14 0.00 0.00 176.83 174.09 2pro s ARG 155 N -3.94 0.41 -0.48 7.34 3.52 -1.07 -4.72 118.95 120.02 2pro s ARG 155 Ca 0.44 0.08 -0.27 0.00 -0.13 0.00 0.00 55.73 55.85 2pro s ARG 155 Cb -0.03 0.10 0.03 0.00 -1.56 0.00 0.00 34.95 33.49 2pro s ARG 155 CO 0.28 -0.66 1.03 0.42 -0.81 0.00 0.00 175.30 175.56 2pro s ILE 156 N 2.39 4.33 0.40 4.11 1.01 -1.26 -3.37 121.20 128.81 2pro s ILE 156 Ca 0.17 0.95 0.07 0.00 0.00 0.00 0.00 60.65 61.84 2pro s ILE 156 Cb -0.03 -4.53 -0.06 0.00 0.01 0.00 0.00 42.46 37.86 2pro s ILE 156 CO -0.18 -0.94 0.14 -1.61 0.00 0.00 0.00 174.94 172.34 2pro s GLU 157 N 4.12 2.18 0.00 2.79 2.02 -1.17 -5.01 118.70 123.62 2pro s GLU 157 Ca 0.42 -1.86 0.00 0.00 0.02 0.00 0.00 54.97 53.55 2pro s GLU 157 Cb -0.09 -1.93 0.00 0.00 0.10 0.00 0.00 34.13 32.21 2pro s GLU 157 CO 0.29 -0.07 0.00 0.43 0.02 0.00 0.00 175.26 175.93