#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2d86 h SER 2 N 0.00 -1.53 -3.48 1.61 0.02 -2.07 -3.36 113.55 104.74 2d86 h SER 2 Ca 0.00 0.19 -0.68 0.00 -0.84 0.00 0.00 61.79 60.46 2d86 h SER 2 Cb 0.00 0.60 -0.18 0.00 0.14 0.00 0.00 62.40 62.97 2d86 h SER 2 CO 0.00 -0.47 -0.05 -0.44 -1.14 0.00 0.00 176.83 174.73 2d86 s SER 3 N -4.83 6.24 0.00 3.07 0.01 -1.26 -4.80 113.70 112.13 2d86 s SER 3 Ca -0.16 -0.64 0.00 0.00 1.31 0.00 0.00 55.95 56.46 2d86 s SER 3 Cb 0.08 -2.27 0.00 0.00 0.21 0.00 0.00 66.02 64.04 2d86 s SER 3 CO 0.62 -0.72 0.00 0.61 0.41 0.00 0.00 173.24 174.17 2d86 n GLY 4 N 5.10 0.71 3.25 3.44 0.00 -1.26 -5.11 105.19 111.33 2d86 n GLY 4 Ca -0.05 -0.55 -0.14 0.00 0.00 0.00 0.00 46.02 45.28 2d86 n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2d86 s SER 5 N -4.00 0.86 -0.78 1.61 1.04 -1.26 -5.11 113.70 106.07 2d86 s SER 5 Ca 0.00 -1.30 0.02 0.00 0.48 0.00 0.00 55.95 55.16 2d86 s SER 5 Cb 0.00 0.21 0.19 0.00 0.10 0.00 0.00 66.02 66.52 2d86 s SER 5 CO 0.00 -0.70 0.60 -0.44 0.98 0.00 0.00 173.24 173.68 2d86 s SER 6 N -3.20 5.28 1.00 7.02 0.01 -1.26 -4.80 113.70 117.74 2d86 s SER 6 Ca 0.32 -3.80 -0.16 0.00 1.31 0.00 0.00 55.95 53.62 2d86 s SER 6 Cb 0.07 -1.74 0.21 0.00 0.21 0.00 0.00 66.02 64.77 2d86 s SER 6 CO 0.09 -0.12 1.27 0.61 0.41 0.00 0.00 173.24 175.49 2d86 n GLY 7 N 2.12 -1.47 3.50 3.44 0.00 -1.26 -4.90 105.19 106.62 2d86 n GLY 7 Ca 0.20 -1.71 -0.51 0.00 0.00 0.00 0.00 46.02 44.00 2d86 n GLY 7 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 2d86 n MET 8 N -3.69 1.23 -1.06 1.61 0.00 -1.26 -4.88 117.12 109.07 2d86 n MET 8 Ca 0.16 0.37 -0.35 0.00 -0.00 0.00 0.00 57.70 57.88 2d86 n MET 8 Cb 0.55 -2.47 0.09 0.00 0.00 0.00 0.00 33.22 31.40 2d86 n MET 8 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 175.97 176.36 2d86 n GLU 9 N 7.75 0.05 0.01 2.12 4.71 -1.26 -4.84 120.64 129.19 2d86 n GLU 9 Ca 0.37 0.06 0.07 0.00 -0.01 0.00 0.00 57.16 57.66 2d86 n GLU 9 Cb 0.23 -1.85 0.32 0.00 -1.01 0.00 0.00 31.44 29.14 2d86 n GLU 9 CO 0.00 0.00 0.00 -0.35 0.09 0.00 0.00 177.13 176.87 2d86 n PRO 10 N -1.14 0.02 -0.00 3.49 -0.04 -1.26 -2.46 135.00 133.60 2d86 n PRO 10 Ca 0.09 0.27 -0.10 0.00 -0.04 0.00 0.00 63.50 63.72 2d86 n PRO 10 Cb 0.52 -1.53 -0.14 0.00 -0.04 0.00 0.00 33.50 32.30 2d86 n PRO 10 CO 0.00 0.00 0.00 0.11 -0.04 0.00 0.00 175.50 175.57 2d86 h TRP 11 N 0.00 0.06 -0.42 0.54 5.08 -1.99 -3.17 115.95 116.04 2d86 h TRP 11 Ca 0.00 -0.04 0.06 0.00 1.08 0.00 0.00 58.89 59.98 2d86 h TRP 11 Cb 0.25 -0.00 -0.05 0.00 -3.00 0.00 0.00 29.16 26.36 2d86 h TRP 11 CO 0.00 1.08 0.13 0.87 -1.28 0.00 0.00 178.44 179.24 2d86 h LYS 12 N 0.01 0.28 -0.11 0.12 1.57 -1.83 -1.68 116.57 114.93 2d86 h LYS 12 Ca -0.26 -0.02 -0.19 0.00 -1.87 0.00 0.00 60.65 58.31 2d86 h LYS 12 Cb 1.98 -0.06 0.01 0.00 0.08 0.00 0.00 32.23 34.24 2d86 h LYS 12 CO 0.09 0.19 -0.69 -0.56 -0.57 0.00 0.00 179.45 177.91 2d86 h GLN 13 N 0.29 0.66 -1.00 3.15 3.07 -1.72 -3.22 115.11 116.34 2d86 h GLN 13 Ca 0.20 -0.56 0.20 0.00 0.09 0.00 0.00 58.65 58.58 2d86 h GLN 13 Cb 0.20 0.13 -0.11 0.00 0.08 0.00 0.00 27.48 27.78 2d86 h GLN 13 CO -0.22 1.18 0.61 0.00 0.09 0.00 0.00 178.83 180.49 2d86 h ALA 15 N 1.66 0.81 0.24 0.00 0.00 -1.32 -2.21 119.26 118.44 2d86 h ALA 15 Ca 0.59 0.20 -0.00 0.00 0.00 0.00 0.00 54.91 55.70 2d86 h ALA 15 Cb 0.96 0.33 -0.03 0.00 0.00 0.00 0.00 17.79 19.06 2d86 h ALA 15 CO -0.39 -0.39 -0.40 1.96 0.00 0.00 0.00 179.25 180.03 2d86 h GLN 16 N 0.16 -0.65 -0.94 0.00 1.08 -1.28 -2.16 115.11 111.33 2d86 h GLN 16 Ca 0.39 0.04 0.25 0.00 -1.45 0.00 0.00 58.65 57.89 2d86 h GLN 16 Cb 0.68 0.15 -0.18 0.00 -0.05 0.00 0.00 27.48 28.08 2d86 h GLN 16 CO -0.58 -0.43 0.00 1.87 -0.95 0.00 0.00 178.83 178.74 2d86 n TRP 17 N -4.76 0.58 0.07 2.96 -0.00 -0.85 0.45 117.44 115.89 2d86 n TRP 17 Ca -0.08 1.14 -0.12 0.00 -0.00 0.00 0.00 57.50 58.44 2d86 n TRP 17 Cb 0.34 -1.20 -0.05 0.00 -0.00 0.00 0.00 31.31 30.40 2d86 n TRP 17 CO 0.00 0.00 0.00 -0.07 -0.00 0.00 0.00 177.69 177.62 2d86 h LEU 18 N 0.00 -0.36 -0.72 5.87 3.38 -1.13 0.62 115.31 122.96 2d86 h LEU 18 Ca 0.56 0.05 0.10 0.00 0.09 0.00 0.00 57.88 58.68 2d86 h LEU 18 Cb 1.14 0.15 -0.07 0.00 0.09 0.00 0.00 40.66 41.96 2d86 h LEU 18 CO -0.89 -0.19 0.36 0.40 0.09 0.00 0.00 178.44 178.21 2d86 h ILE 19 N -0.24 0.85 0.00 1.22 2.04 0.51 -0.56 117.51 121.33 2d86 h ILE 19 Ca 0.03 -0.21 -0.12 0.00 1.00 0.00 0.00 64.86 65.56 2d86 h ILE 19 Cb 0.27 0.18 -0.02 0.00 -0.74 0.00 0.00 36.82 36.51 2d86 h ILE 19 CO -0.10 0.11 -0.56 0.45 0.00 0.00 0.00 178.15 178.05 2d86 h HIS 20 N 0.61 0.00 0.00 1.37 3.86 -0.75 -2.85 115.15 117.39 2d86 h HIS 20 Ca 0.36 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.57 2d86 h HIS 20 Cb 0.38 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.85 2d86 h HIS 20 CO -0.10 0.56 0.00 0.00 0.86 0.00 0.00 177.93 179.25 2d86 n LYS 22 N -0.88 -5.03 0.00 0.00 4.76 -1.06 -4.75 118.16 111.20 2d86 n LYS 22 Ca 0.12 0.59 0.00 0.00 -2.87 0.00 0.00 58.31 56.15 2d86 n LYS 22 Cb 0.06 -4.86 0.00 0.00 -1.84 0.00 0.00 35.03 28.38 2d86 n LYS 22 CO 0.00 0.00 0.00 1.33 -1.37 0.00 0.00 177.40 177.36 2d86 n VAL 23 N -3.63 0.00 -4.12 -0.18 0.24 -0.97 -4.92 118.33 104.75 2d86 n VAL 23 Ca -0.12 0.00 -0.15 0.00 -2.04 0.00 0.00 64.34 62.04 2d86 n VAL 23 Cb 0.59 -0.61 -0.11 0.00 -1.47 0.00 0.00 33.84 32.23 2d86 n VAL 23 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 2d86 s LEU 24 N -3.32 2.30 0.71 1.34 1.43 -1.23 -4.98 118.68 114.93 2d86 s LEU 24 Ca 0.00 -0.64 -0.13 0.00 -1.03 0.00 0.00 54.13 52.33 2d86 s LEU 24 Cb 0.00 -0.30 0.03 0.00 0.03 0.00 0.00 46.19 45.95 2d86 s LEU 24 CO 0.00 -0.19 1.10 -2.16 0.23 0.00 0.00 176.35 175.34 2d86 s PRO 25 N -1.97 2.55 0.39 1.29 0.04 -1.26 -4.32 135.00 131.72 2d86 s PRO 25 Ca -0.03 1.29 0.13 0.00 0.04 0.00 0.00 61.00 62.43 2d86 s PRO 25 Cb -0.08 -1.92 0.80 0.00 0.04 0.00 0.00 34.50 33.33 2d86 s PRO 25 CO 0.01 -1.43 1.87 1.79 0.04 0.00 0.00 177.00 179.27 2d86 h THR 26 N -0.50 1.22 -0.56 1.26 1.35 -2.01 -2.49 112.91 111.18 2d86 h THR 26 Ca -0.45 -1.11 -0.18 0.00 -0.55 0.00 0.00 66.41 64.11 2d86 h THR 26 Cb 1.24 1.60 -0.11 0.00 -1.73 0.00 0.00 68.15 69.15 2d86 h THR 26 CO 0.53 0.32 0.16 0.59 -0.25 0.00 0.00 175.52 176.87 2d86 n ASN 27 N -4.14 3.99 -3.39 5.36 4.13 -1.26 -4.94 115.26 115.00 2d86 n ASN 27 Ca -0.02 -3.34 -0.19 0.00 1.68 0.00 0.00 54.58 52.72 2d86 n ASN 27 Cb 0.37 -0.68 0.18 0.00 -1.54 0.00 0.00 39.78 38.10 2d86 n ASN 27 CO 0.00 0.00 0.00 1.57 0.28 0.00 0.00 177.26 179.11 2d86 n HIS 28 N -0.55 -2.82 0.03 3.10 -0.00 -0.94 -4.93 115.22 109.11 2d86 n HIS 28 Ca 0.36 -0.26 -0.13 0.00 0.46 0.00 0.00 57.72 58.15 2d86 n HIS 28 Cb 1.22 -1.24 -0.14 0.00 -0.12 0.00 0.00 29.99 29.71 2d86 n HIS 28 CO 0.00 0.00 0.00 0.07 0.46 0.00 0.00 176.34 176.87 2d86 h ARG 29 N 0.00 0.14 0.00 1.57 0.11 -1.95 -3.31 114.38 110.94 2d86 h ARG 29 Ca -0.24 -0.23 0.00 0.00 0.10 0.00 0.00 59.98 59.61 2d86 h ARG 29 Cb 0.81 0.09 0.00 0.00 1.11 0.00 0.00 29.97 31.98 2d86 h ARG 29 CO 0.14 0.91 0.00 -0.39 0.10 0.00 0.00 179.97 180.73 2d86 h VAL 30 N 0.04 0.00 0.00 0.08 -1.51 -1.94 -1.48 116.25 111.43 2d86 h VAL 30 Ca -0.25 -0.13 -0.14 0.00 -1.23 0.00 0.00 66.70 64.95 2d86 h VAL 30 Cb 1.98 0.86 -0.02 0.00 -2.13 0.00 0.00 31.29 31.99 2d86 h VAL 30 CO 0.12 0.00 -0.65 0.71 -1.23 0.00 0.00 177.57 176.52 2d86 h THR 31 N 0.00 1.15 -3.72 7.19 1.35 -1.92 -3.45 112.91 113.51 2d86 h THR 31 Ca 0.00 -2.54 -0.52 0.00 -0.55 0.00 0.00 66.41 62.80 2d86 h THR 31 Cb 0.17 2.51 0.06 0.00 -1.73 0.00 0.00 68.15 69.16 2d86 h THR 31 CO 0.00 0.64 0.67 0.26 -0.25 0.00 0.00 175.52 176.84 2d86 s TRP 32 N -2.95 3.05 0.54 4.73 0.52 -0.56 -4.89 118.94 119.37 2d86 s TRP 32 Ca 0.03 1.30 0.23 0.00 0.02 0.00 0.00 56.10 57.67 2d86 s TRP 32 Cb 0.09 -3.72 1.39 0.00 -1.15 0.00 0.00 33.47 30.08 2d86 s TRP 32 CO 0.76 -2.09 2.06 0.22 0.02 0.00 0.00 176.95 177.93 2d86 h ASP 33 N 3.95 0.00 0.29 2.95 1.82 -1.88 0.47 116.42 124.03 2d86 h ASP 33 Ca -0.48 0.00 -0.07 0.00 -0.39 0.00 0.00 57.03 56.09 2d86 h ASP 33 Cb 1.22 0.00 -0.01 0.00 0.68 0.00 0.00 39.33 41.22 2d86 h ASP 33 CO 0.69 0.00 -0.32 0.28 -1.61 0.00 0.00 179.24 178.29 2d86 h SER 34 N 0.00 0.04 -4.26 2.28 0.02 -1.90 -3.44 113.55 106.29 2d86 h SER 34 Ca 0.14 -0.01 -0.52 0.00 -0.84 0.00 0.00 61.79 60.56 2d86 h SER 34 Cb 0.60 -0.01 0.19 0.00 0.14 0.00 0.00 62.40 63.33 2d86 h SER 34 CO -0.00 0.36 0.24 0.00 -1.14 0.00 0.00 176.83 176.29 2d86 s ALA 35 N -4.32 1.52 0.19 3.77 0.00 0.15 -5.05 121.76 118.02 2d86 s ALA 35 Ca -0.03 0.62 -0.10 0.00 0.00 0.00 0.00 51.96 52.45 2d86 s ALA 35 Cb 0.15 -3.46 -0.01 0.00 0.00 0.00 0.00 23.12 19.80 2d86 s ALA 35 CO 0.72 -2.71 0.34 -0.65 0.00 0.00 0.00 175.76 173.46 2d86 s GLN 36 N -4.59 1.27 0.20 0.00 -0.21 -1.26 -4.99 119.66 110.08 2d86 s GLN 36 Ca 0.67 -1.21 -0.03 0.00 0.02 0.00 0.00 55.36 54.82 2d86 s GLN 36 Cb -0.23 0.40 0.40 0.00 1.00 0.00 0.00 33.01 34.58 2d86 s GLN 36 CO 0.57 -0.49 1.09 1.33 -2.12 0.00 0.00 175.29 175.68 2d86 n VAL 37 N -0.27 -0.29 0.07 1.09 0.24 -1.26 0.42 118.33 118.33 2d86 n VAL 37 Ca -0.05 1.57 -0.16 0.00 -2.04 0.00 0.00 64.34 63.67 2d86 n VAL 37 Cb 0.63 -2.23 -0.09 0.00 -1.47 0.00 0.00 33.84 30.68 2d86 n VAL 37 CO 0.00 0.00 0.00 0.15 -2.14 0.00 0.00 176.83 174.84 2d86 h PHE 38 N 0.00 -1.49 -0.61 6.34 3.04 -1.96 0.76 116.94 123.02 2d86 h PHE 38 Ca 0.37 0.05 0.08 0.00 3.98 0.00 0.00 57.97 62.44 2d86 h PHE 38 Cb 0.65 0.65 -0.10 0.00 2.56 0.00 0.00 35.95 39.70 2d86 h PHE 38 CO -0.47 -0.57 -0.51 -0.44 -2.02 0.00 0.00 178.31 174.31 2d86 h ASP 39 N -0.68 -1.75 0.69 0.41 5.19 -0.43 1.02 116.42 120.87 2d86 h ASP 39 Ca 0.01 0.26 0.00 0.00 -0.62 0.00 0.00 57.03 56.69 2d86 h ASP 39 Cb 0.72 0.76 0.00 0.00 0.18 0.00 0.00 39.33 41.00 2d86 h ASP 39 CO -0.33 -0.34 0.00 0.25 -3.12 0.00 0.00 179.24 175.70 2d86 h LEU 40 N -0.24 0.00 0.00 1.55 5.85 -1.18 -2.23 115.31 119.06 2d86 h LEU 40 Ca 0.15 0.00 -0.18 0.00 0.84 0.00 0.00 57.88 58.68 2d86 h LEU 40 Cb 0.55 0.00 -0.03 0.00 0.37 0.00 0.00 40.66 41.55 2d86 h LEU 40 CO -0.71 0.00 -1.08 0.00 -0.34 0.00 0.00 178.44 176.31 2d86 h ALA 41 N 2.07 0.59 0.07 1.25 0.00 0.74 -3.34 119.26 120.64 2d86 h ALA 41 Ca 0.00 -0.86 -0.00 0.00 0.00 0.00 0.00 54.91 54.04 2d86 h ALA 41 Cb 0.34 0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.21 2d86 h ALA 41 CO 0.00 1.05 -0.03 1.96 0.00 0.00 0.00 179.25 182.23 2d86 h GLN 42 N 0.00 -0.09 -0.70 0.00 4.20 0.12 0.26 115.11 118.90 2d86 h GLN 42 Ca -0.09 0.01 0.20 0.00 0.06 0.00 0.00 58.65 58.83 2d86 h GLN 42 Cb 1.66 0.02 -0.03 0.00 0.30 0.00 0.00 27.48 29.43 2d86 h GLN 42 CO 0.08 0.48 0.76 0.00 -0.67 0.00 0.00 178.83 179.48 2d86 h THR 43 N -0.85 0.23 0.00 -0.54 1.03 -1.66 0.26 112.91 111.38 2d86 h THR 43 Ca -0.01 0.00 -0.30 0.00 -0.01 0.00 0.00 66.41 66.09 2d86 h THR 43 Cb 0.62 0.40 -0.06 0.00 -1.07 0.00 0.00 68.15 68.04 2d86 h THR 43 CO 0.02 0.00 -2.19 0.18 -0.01 0.00 0.00 175.52 173.51 2d86 n LEU 44 N -3.57 0.00 -0.44 0.00 4.77 -1.21 -4.44 117.00 112.11 2d86 n LEU 44 Ca 0.15 0.00 0.37 0.00 -0.03 0.00 0.00 56.01 56.50 2d86 n LEU 44 Cb 1.00 0.41 0.65 0.00 -2.33 0.00 0.00 43.42 43.14 2d86 n LEU 44 CO 0.27 0.41 1.21 -0.09 -1.33 0.00 0.00 177.39 177.86 2d86 h ARG 45 N 0.00 0.06 0.31 3.23 2.43 0.32 0.40 114.38 121.13 2d86 h ARG 45 Ca -0.45 -0.00 -0.02 0.00 -0.81 0.00 0.00 59.98 58.70 2d86 h ARG 45 Cb 2.01 -0.01 0.00 0.00 -0.42 0.00 0.00 29.97 31.55 2d86 h ARG 45 CO 0.02 0.04 -0.15 -0.44 -1.51 0.00 0.00 179.97 177.93 2d86 h ASP 46 N 0.06 -0.36 0.00 -3.80 3.32 -1.76 -3.41 116.42 110.47 2d86 h ASP 46 Ca 0.84 -0.07 0.00 0.00 0.02 0.00 0.00 57.03 57.82 2d86 h ASP 46 Cb 2.61 0.09 0.00 0.00 0.22 0.00 0.00 39.33 42.25 2d86 h ASP 46 CO -0.48 -0.15 0.00 0.61 -1.72 0.00 0.00 179.24 177.50 2d86 n GLY 47 N -0.92 1.56 0.10 2.75 0.00 0.14 -4.41 105.19 104.42 2d86 n GLY 47 Ca -0.10 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.79 2d86 n GLY 47 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2d86 n VAL 48 N -1.20 1.27 -0.02 1.61 0.31 -1.26 -4.36 118.33 114.68 2d86 n VAL 48 Ca 0.00 -0.61 -0.07 0.00 -0.01 0.00 0.00 64.34 63.65 2d86 n VAL 48 Cb 0.00 -0.98 -0.06 0.00 -0.91 0.00 0.00 33.84 31.89 2d86 n VAL 48 CO 0.00 0.00 0.00 0.25 -1.32 0.00 0.00 176.83 175.76 2d86 h LEU 49 N 0.00 -0.07 -0.76 7.52 5.85 -1.89 -3.32 115.31 122.65 2d86 h LEU 49 Ca -0.50 -0.39 0.08 0.00 0.84 0.00 0.00 57.88 57.91 2d86 h LEU 49 Cb 1.92 0.02 -0.10 0.00 0.37 0.00 0.00 40.66 42.87 2d86 h LEU 49 CO -0.03 0.60 -0.42 0.18 -0.34 0.00 0.00 178.44 178.43 2d86 n LEU 50 N -4.78 -0.74 -0.31 2.25 4.77 -1.26 0.19 117.00 117.11 2d86 n LEU 50 Ca -0.05 1.35 0.14 0.00 -0.03 0.00 0.00 56.01 57.42 2d86 n LEU 50 Cb 0.22 -0.20 0.32 0.00 -2.33 0.00 0.00 43.42 41.43 2d86 n LEU 50 CO 0.17 -1.13 1.06 0.00 -1.33 0.00 0.00 177.39 176.17 2d86 h GLN 52 N 0.42 -0.21 -0.60 0.00 4.20 0.20 -2.69 115.11 116.42 2d86 h GLN 52 Ca 0.58 0.01 0.05 0.00 0.06 0.00 0.00 58.65 59.36 2d86 h GLN 52 Cb 1.11 0.05 -0.07 0.00 0.30 0.00 0.00 27.48 28.87 2d86 h GLN 52 CO -0.53 -0.14 -0.36 -0.11 -0.67 0.00 0.00 178.83 177.03 2d86 n LEU 53 N -5.25 -0.64 -0.35 1.46 7.94 -0.15 0.16 117.00 120.16 2d86 n LEU 53 Ca -0.06 1.20 0.01 0.00 -1.11 0.00 0.00 56.01 56.05 2d86 n LEU 53 Cb 0.17 -0.20 0.15 0.00 0.53 0.00 0.00 43.42 44.07 2d86 n LEU 53 CO 0.28 -0.94 1.25 -0.07 -1.11 0.00 0.00 177.39 176.80 2d86 h LEU 54 N 0.00 1.00 -2.25 -1.96 3.38 -1.57 0.02 115.31 113.93 2d86 h LEU 54 Ca 0.10 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.06 2d86 h LEU 54 Cb 0.25 -0.21 -0.00 0.00 0.09 0.00 0.00 40.66 40.78 2d86 h LEU 54 CO -0.57 0.66 -0.05 0.78 0.09 0.00 0.00 178.44 179.35 2d86 h ASN 55 N 1.15 0.00 0.02 -0.43 2.35 0.18 -0.10 115.58 118.75 2d86 h ASN 55 Ca 0.40 0.00 -0.05 0.00 -0.55 0.00 0.00 56.30 56.10 2d86 h ASN 55 Cb 0.09 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.46 2d86 h ASN 55 CO -0.15 0.05 -0.24 0.78 -1.65 0.00 0.00 177.43 176.22 2d86 h ASN 56 N 0.00 0.08 0.21 5.81 2.35 0.16 -3.38 115.58 120.81 2d86 h ASN 56 Ca -0.00 -0.96 -0.01 0.00 -0.55 0.00 0.00 56.30 54.78 2d86 h ASN 56 Cb 0.19 -0.03 0.00 0.00 0.05 0.00 0.00 38.32 38.53 2d86 h ASN 56 CO 0.01 1.11 -0.10 -0.07 -1.65 0.00 0.00 177.43 176.72 2d86 h LEU 57 N -0.89 -0.24 -9.33 1.61 3.38 -1.10 -3.45 115.31 105.29 2d86 h LEU 57 Ca -0.05 -0.15 -0.59 0.00 0.09 0.00 0.00 57.88 57.17 2d86 h LEU 57 Cb 1.14 0.06 -0.13 0.00 0.09 0.00 0.00 40.66 41.82 2d86 h LEU 57 CO 0.01 0.02 -0.72 -0.60 0.09 0.00 0.00 178.44 177.24 2d86 s ARG 58 N -5.24 1.92 0.12 1.13 3.52 -0.07 -4.93 118.95 115.39 2d86 s ARG 58 Ca -0.15 -1.60 -0.09 0.00 -0.13 0.00 0.00 55.73 53.76 2d86 s ARG 58 Cb 0.03 -1.94 -0.06 0.00 -1.56 0.00 0.00 34.95 31.43 2d86 s ARG 58 CO 0.61 0.35 0.42 0.00 -0.81 0.00 0.00 175.30 175.88 2d86 s ALA 59 N -2.36 3.71 -1.80 6.12 0.00 -1.26 -4.10 121.76 122.06 2d86 s ALA 59 Ca 0.30 -0.40 0.00 0.00 0.00 0.00 0.00 51.96 51.86 2d86 s ALA 59 Cb -0.06 -2.27 0.00 0.00 0.00 0.00 0.00 23.12 20.79 2d86 s ALA 59 CO 0.17 0.58 0.00 0.72 0.00 0.00 0.00 175.76 177.22 2d86 n HIS 60 N 0.53 -0.55 -0.10 0.00 8.25 -1.26 -4.88 115.22 117.21 2d86 n HIS 60 Ca -0.05 0.00 -0.13 0.00 -0.26 0.00 0.00 57.72 57.28 2d86 n HIS 60 Cb 0.52 -3.54 -0.03 0.00 1.12 0.00 0.00 29.99 28.06 2d86 n HIS 60 CO 0.00 0.00 0.00 0.77 0.64 0.00 0.00 176.34 177.75 2d86 h SER 61 N 0.00 0.86 -3.79 0.41 0.02 -1.85 -3.46 113.55 105.74 2d86 h SER 61 Ca -0.43 -0.47 -0.11 0.00 -0.84 0.00 0.00 61.79 59.94 2d86 h SER 61 Cb 1.30 -0.24 -0.24 0.00 0.14 0.00 0.00 62.40 63.36 2d86 h SER 61 CO 0.55 1.15 -0.21 -0.63 -1.14 0.00 0.00 176.83 176.56 2d86 s ILE 62 N -4.37 -0.00 -0.48 3.27 1.01 -1.26 -4.77 121.20 114.60 2d86 s ILE 62 Ca -0.12 0.01 -0.21 0.00 0.00 0.00 0.00 60.65 60.33 2d86 s ILE 62 Cb 0.10 -0.62 0.04 0.00 0.01 0.00 0.00 42.46 41.98 2d86 s ILE 62 CO 0.85 0.01 0.73 0.21 0.00 0.00 0.00 174.94 176.73 2d86 s ASN 63 N 0.42 6.32 0.31 3.58 3.84 -1.26 -4.92 114.94 123.21 2d86 s ASN 63 Ca -0.01 -0.44 0.06 0.00 0.21 0.00 0.00 52.86 52.68 2d86 s ASN 63 Cb -0.04 -2.35 0.83 0.00 -0.55 0.00 0.00 41.25 39.14 2d86 s ASN 63 CO -0.02 -0.92 1.66 -0.07 -2.79 0.00 0.00 177.10 174.96 2d86 h LEU 64 N 10.04 0.20 -1.69 3.21 3.38 -1.99 0.92 115.31 129.38 2d86 h LEU 64 Ca -0.26 0.19 0.03 0.00 0.09 0.00 0.00 57.88 57.93 2d86 h LEU 64 Cb 1.09 0.21 -0.02 0.00 0.09 0.00 0.00 40.66 42.03 2d86 h LEU 64 CO 0.96 -0.13 0.26 0.11 0.09 0.00 0.00 178.44 179.73 2d86 h LYS 65 N 0.27 0.40 0.00 1.13 1.79 -2.00 -0.27 116.57 117.89 2d86 h LYS 65 Ca 0.61 -0.02 -0.07 0.00 -2.18 0.00 0.00 60.65 58.99 2d86 h LYS 65 Cb 1.28 -0.09 -0.01 0.00 -1.58 0.00 0.00 32.23 31.83 2d86 h LYS 65 CO -0.63 0.26 -0.33 0.93 -1.08 0.00 0.00 179.45 178.61 2d86 h GLU 66 N 0.41 0.00 -5.43 3.15 5.08 0.46 -3.43 114.58 114.82 2d86 h GLU 66 Ca 0.16 0.00 -0.63 0.00 -1.00 0.00 0.00 59.36 57.89 2d86 h GLU 66 Cb 0.13 0.00 -0.15 0.00 0.50 0.00 0.00 28.75 29.22 2d86 h GLU 66 CO -0.04 0.33 -0.57 0.96 -1.00 0.00 0.00 179.01 178.69 2d86 s ILE 67 N -3.48 4.72 -0.10 3.13 -4.36 -0.11 -5.02 121.20 115.97 2d86 s ILE 67 Ca 0.01 -0.07 -0.33 0.00 -0.26 0.00 0.00 60.65 60.00 2d86 s ILE 67 Cb 0.10 -3.09 -0.11 0.00 1.25 0.00 0.00 42.46 40.61 2d86 s ILE 67 CO 0.68 0.50 1.95 0.59 0.24 0.00 0.00 174.94 178.90 2d86 n ASN 68 N 3.15 3.46 0.06 4.36 3.02 -1.26 -4.84 115.26 123.20 2d86 n ASN 68 Ca -0.17 0.86 0.06 0.00 -0.03 0.00 0.00 54.58 55.29 2d86 n ASN 68 Cb 0.53 -1.40 -0.06 0.00 -0.61 0.00 0.00 39.78 38.24 2d86 n ASN 68 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 2d86 n LEU 69 N 7.47 0.76 -3.32 3.41 4.77 -1.26 -4.39 117.00 124.43 2d86 n LEU 69 Ca 0.24 0.31 -0.32 0.00 -0.03 0.00 0.00 56.01 56.22 2d86 n LEU 69 Cb 0.32 0.02 -0.03 0.00 -2.33 0.00 0.00 43.42 41.40 2d86 n LEU 69 CO 0.72 -0.00 0.52 0.54 -1.33 0.00 0.00 177.39 177.84 2d86 n ARG 70 N -2.74 3.69 0.00 3.23 3.00 -1.26 -4.86 116.66 117.72 2d86 n ARG 70 Ca -0.06 -4.75 0.00 0.00 -0.01 0.00 0.00 57.85 53.04 2d86 n ARG 70 Cb 0.70 -2.32 0.00 0.00 0.00 0.00 0.00 32.46 30.84 2d86 n ARG 70 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.63 177.28 2d86 n PRO 71 N 0.23 0.49 -0.60 5.56 -0.04 -1.26 -4.85 135.00 134.52 2d86 n PRO 71 Ca 0.34 0.00 -0.11 0.00 -0.04 0.00 0.00 63.50 63.69 2d86 n PRO 71 Cb 0.36 -1.19 -0.08 0.00 -0.04 0.00 0.00 33.50 32.55 2d86 n PRO 71 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 2d86 n GLN 72 N 0.10 0.00 -3.77 0.54 6.02 -1.26 0.58 117.38 119.58 2d86 n GLN 72 Ca 0.00 0.00 -0.22 0.00 -0.01 0.00 0.00 57.00 56.77 2d86 n GLN 72 Cb 0.10 -0.46 -0.07 0.00 1.02 0.00 0.00 30.24 30.83 2d86 n GLN 72 CO 0.00 0.00 0.00 -1.33 -1.01 0.00 0.00 177.06 174.72 2d86 n MET 73 N 2.54 -0.95 -3.87 -1.09 2.81 -1.26 -4.85 117.12 110.44 2d86 n MET 73 Ca 0.27 0.06 -0.31 0.00 -1.81 0.00 0.00 57.70 55.92 2d86 n MET 73 Cb 0.04 -2.53 -0.12 0.00 -0.71 0.00 0.00 33.22 29.91 2d86 n MET 73 CO 0.00 0.00 0.00 0.45 1.51 0.00 0.00 175.97 177.93 2d86 s SER 74 N -3.94 4.78 0.14 7.83 0.15 0.20 -4.98 113.70 117.87 2d86 s SER 74 Ca 0.01 -3.36 -0.17 0.00 0.70 0.00 0.00 55.95 53.13 2d86 s SER 74 Cb -0.01 -1.69 0.06 0.00 -1.71 0.00 0.00 66.02 62.67 2d86 s SER 74 CO 0.70 -0.19 1.08 1.67 1.20 0.00 0.00 173.24 177.70 2d86 n GLN 75 N 2.68 -0.24 -0.31 5.44 7.27 -1.26 0.21 117.38 131.18 2d86 n GLN 75 Ca 0.12 1.07 0.15 0.00 0.07 0.00 0.00 57.00 58.41 2d86 n GLN 75 Cb 0.34 -1.58 0.32 0.00 2.41 0.00 0.00 30.24 31.74 2d86 n GLN 75 CO 0.00 0.00 0.00 0.35 0.07 0.00 0.00 177.06 177.48 2d86 h PHE 76 N 0.00 0.53 -0.04 3.69 3.04 -1.97 0.35 116.94 122.54 2d86 h PHE 76 Ca 0.18 0.05 -0.05 0.00 3.98 0.00 0.00 57.97 62.12 2d86 h PHE 76 Cb 0.35 -0.09 0.00 0.00 2.56 0.00 0.00 35.95 38.78 2d86 h PHE 76 CO -0.67 -0.16 -0.17 -0.07 -2.02 0.00 0.00 178.31 175.22 2d86 h LEU 77 N 0.28 0.23 0.40 0.59 3.38 0.22 -2.83 115.31 117.58 2d86 h LEU 77 Ca 0.58 -0.64 -0.02 0.00 0.09 0.00 0.00 57.88 57.89 2d86 h LEU 77 Cb 1.18 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.86 2d86 h LEU 77 CO -0.61 0.83 -0.29 0.00 0.09 0.00 0.00 178.44 178.47 2d86 h LEU 79 N -0.66 -1.87 -0.18 0.00 3.38 -0.53 -1.81 115.31 113.64 2d86 h LEU 79 Ca -0.05 0.25 0.04 0.00 0.09 0.00 0.00 57.88 58.21 2d86 h LEU 79 Cb 0.54 0.77 -0.07 0.00 0.09 0.00 0.00 40.66 41.99 2d86 h LEU 79 CO 0.03 -0.39 -0.46 0.50 0.09 0.00 0.00 178.44 178.21 2d86 h LYS 80 N -0.37 -0.47 -0.98 1.13 3.11 -1.48 -2.21 116.57 115.30 2d86 h LYS 80 Ca 0.08 0.03 0.11 0.00 -2.81 0.00 0.00 60.65 58.07 2d86 h LYS 80 Cb 0.58 0.11 -0.13 0.00 -1.00 0.00 0.00 32.23 31.79 2d86 h LYS 80 CO -0.62 -0.31 -0.50 0.09 -2.81 0.00 0.00 179.45 175.29 2d86 n ASN 81 N -5.43 -0.89 -0.13 4.20 3.02 0.12 -0.86 115.26 115.29 2d86 n ASN 81 Ca -0.04 1.73 -0.13 0.00 -0.03 0.00 0.00 54.58 56.12 2d86 n ASN 81 Cb 0.37 -0.29 -0.08 0.00 -0.61 0.00 0.00 39.78 39.16 2d86 n ASN 81 CO 0.00 0.00 0.00 0.40 -2.62 0.00 0.00 177.26 175.04 2d86 h ILE 82 N 0.00 0.03 -0.68 2.41 2.04 -0.76 -1.04 117.51 119.51 2d86 h ILE 82 Ca 0.23 0.00 0.13 0.00 1.00 0.00 0.00 64.86 66.22 2d86 h ILE 82 Cb 0.47 0.03 -0.13 0.00 -0.74 0.00 0.00 36.82 36.46 2d86 h ILE 82 CO -0.94 0.00 -0.21 0.03 0.00 0.00 0.00 178.15 177.03 2d86 h ARG 83 N -0.39 -0.04 -0.97 2.37 3.08 -0.71 0.10 114.38 117.83 2d86 h ARG 83 Ca 0.09 0.00 0.30 0.00 0.07 0.00 0.00 59.98 60.45 2d86 h ARG 83 Cb 0.60 0.01 -0.17 0.00 0.08 0.00 0.00 29.97 30.48 2d86 h ARG 83 CO -0.59 -0.02 0.21 1.15 -1.07 0.00 0.00 179.97 179.65 2d86 h THR 84 N -0.04 0.08 0.53 2.04 2.02 -0.27 0.15 112.91 117.42 2d86 h THR 84 Ca 0.31 -0.02 -0.03 0.00 0.77 0.00 0.00 66.41 67.45 2d86 h THR 84 Cb 0.52 0.02 0.01 0.00 -1.74 0.00 0.00 68.15 66.96 2d86 h THR 84 CO -0.71 0.01 -0.25 0.15 0.37 0.00 0.00 175.52 175.08 2d86 h PHE 85 N 0.05 -0.66 -1.02 3.16 3.57 -0.67 -2.63 116.94 118.73 2d86 h PHE 85 Ca 0.66 -0.02 0.30 0.00 3.53 0.00 0.00 57.97 62.44 2d86 h PHE 85 Cb 1.48 0.22 -0.04 0.00 2.79 0.00 0.00 35.95 40.39 2d86 h PHE 85 CO -0.32 -0.41 0.95 -0.07 -2.23 0.00 0.00 178.31 176.23 2d86 h LEU 86 N -0.89 0.00 0.12 0.59 3.38 -0.98 0.20 115.31 117.74 2d86 h LEU 86 Ca -0.07 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.89 2d86 h LEU 86 Cb 0.54 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.29 2d86 h LEU 86 CO 0.12 0.00 -0.06 0.74 0.09 0.00 0.00 178.44 179.33 2d86 h THR 87 N 0.00 1.06 -0.02 0.22 2.02 -0.82 -3.17 112.91 112.20 2d86 h THR 87 Ca 0.49 -1.15 0.01 0.00 0.77 0.00 0.00 66.41 66.52 2d86 h THR 87 Cb 2.38 1.73 -0.00 0.00 -1.74 0.00 0.00 68.15 70.52 2d86 h THR 87 CO -0.01 0.26 0.02 0.00 0.37 0.00 0.00 175.52 176.16 2d86 h ALA 88 N -0.02 1.61 0.00 6.16 0.00 -0.27 -0.23 119.26 126.51 2d86 h ALA 88 Ca -0.02 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 2d86 h ALA 88 Cb 0.54 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.33 2d86 h ALA 88 CO 0.03 -0.03 -0.03 0.00 0.00 0.00 0.00 179.25 179.21 2d86 h GLU 91 N 0.00 0.00 0.30 0.00 4.39 -0.77 -3.12 114.58 115.38 2d86 h GLU 91 Ca -0.21 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.48 2d86 h GLU 91 Cb 1.33 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.98 2d86 h GLU 91 CO 0.01 0.00 -0.14 1.15 -1.16 0.00 0.00 179.01 178.87 2d86 h THR 92 N -0.81 0.74 0.00 1.13 2.02 -0.15 -3.39 112.91 112.44 2d86 h THR 92 Ca 0.00 -0.38 0.00 0.00 0.77 0.00 0.00 66.41 66.80 2d86 h THR 92 Cb 0.33 0.94 0.00 0.00 -1.74 0.00 0.00 68.15 67.68 2d86 h THR 92 CO 0.00 0.08 -0.15 -0.26 0.37 0.00 0.00 175.52 175.56 2d86 h PHE 93 N -0.61 0.00 0.00 3.16 -1.00 -1.45 -3.50 116.94 113.54 2d86 h PHE 93 Ca -0.04 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.74 2d86 h PHE 93 Cb 0.44 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.00 2d86 h PHE 93 CO -0.00 0.00 0.00 0.41 -1.61 0.00 0.00 178.31 177.11 2d86 n GLY 94 N 1.72 0.77 3.63 -1.45 0.00 0.70 -4.92 105.19 105.63 2d86 n GLY 94 Ca -0.02 -0.70 -0.28 0.00 0.00 0.00 0.00 46.02 45.02 2d86 n GLY 94 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 2d86 s MET 95 N -1.37 1.97 -0.61 1.61 0.23 -0.72 -4.93 119.30 115.47 2d86 s MET 95 Ca 0.00 -2.13 -0.27 0.00 -1.03 0.00 0.00 55.69 52.26 2d86 s MET 95 Cb 0.00 -1.57 -0.10 0.00 -1.53 0.00 0.00 34.83 31.63 2d86 s MET 95 CO 0.00 -0.10 2.47 0.54 -2.03 0.00 0.00 175.02 175.90 2d86 n ARG 96 N -0.99 0.81 -0.32 3.16 1.74 -1.26 -4.68 116.66 115.13 2d86 n ARG 96 Ca -0.07 -0.05 0.19 0.00 -0.77 0.00 0.00 57.85 57.15 2d86 n ARG 96 Cb 0.67 -3.09 0.44 0.00 -1.02 0.00 0.00 32.46 29.46 2d86 n ARG 96 CO 0.00 0.00 0.00 -0.22 -1.52 0.00 0.00 177.63 175.89 2d86 h LYS 97 N 17.82 0.51 -0.96 5.56 1.63 -1.96 0.21 116.57 139.38 2d86 h LYS 97 Ca -0.19 -0.03 0.07 0.00 -0.85 0.00 0.00 60.65 59.65 2d86 h LYS 97 Cb 1.26 -0.11 -0.06 0.00 -0.60 0.00 0.00 32.23 32.71 2d86 h LYS 97 CO 1.20 0.33 0.62 1.03 -3.45 0.00 0.00 179.45 179.18 2d86 h SER 98 N 0.52 0.98 -0.70 4.20 0.87 -2.02 -1.85 113.55 115.54 2d86 h SER 98 Ca 0.58 0.01 -0.02 0.00 -1.23 0.00 0.00 61.79 61.13 2d86 h SER 98 Cb 1.26 -0.20 -0.03 0.00 -0.44 0.00 0.00 62.40 62.99 2d86 h SER 98 CO -0.33 0.62 0.34 -0.33 -0.53 0.00 0.00 176.83 176.61 2d86 h GLU 99 N 1.11 1.00 -6.20 2.24 4.39 -0.96 -3.44 114.58 112.72 2d86 h GLU 99 Ca 0.41 -0.14 -0.53 0.00 0.34 0.00 0.00 59.36 59.44 2d86 h GLU 99 Cb 0.19 -0.18 0.24 0.00 -0.10 0.00 0.00 28.75 28.89 2d86 h GLU 99 CO -0.16 0.79 -1.73 1.28 -1.16 0.00 0.00 179.01 178.02 2d86 n LEU 100 N -4.44 -4.10 -4.88 1.33 4.77 -0.70 -4.90 117.00 104.08 2d86 n LEU 100 Ca 0.06 0.15 -0.21 0.00 -0.03 0.00 0.00 56.01 55.98 2d86 n LEU 100 Cb 0.13 -0.81 -0.03 0.00 -2.33 0.00 0.00 43.42 40.37 2d86 n LEU 100 CO 0.38 -4.71 -0.01 0.72 -1.33 0.00 0.00 177.39 172.44 2d86 s PHE 101 N -2.09 2.76 0.57 -1.77 -0.71 -1.26 -5.06 117.98 110.41 2d86 s PHE 101 Ca 0.44 -0.45 -0.10 0.00 -1.04 0.00 0.00 56.93 55.78 2d86 s PHE 101 Cb -0.13 -2.10 0.13 0.00 -1.21 0.00 0.00 43.02 39.72 2d86 s PHE 101 CO 0.76 -0.07 0.74 -0.85 -1.34 0.00 0.00 175.22 174.46 2d86 n GLU 102 N -1.52 -0.90 -0.08 1.99 0.00 -1.26 -5.00 120.64 113.87 2d86 n GLU 102 Ca 0.03 -1.14 -0.18 0.00 0.00 0.00 0.00 57.16 55.87 2d86 n GLU 102 Cb 0.61 -0.79 -0.13 0.00 0.00 0.00 0.00 31.44 31.13 2d86 n GLU 102 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 2d86 n ALA 103 N -3.55 1.26 0.52 -1.84 0.00 -1.26 -4.42 120.51 111.21 2d86 n ALA 103 Ca -0.12 -0.93 -0.21 0.00 0.00 0.00 0.00 53.44 52.18 2d86 n ALA 103 Cb 0.33 -0.35 -0.10 0.00 0.00 0.00 0.00 19.45 19.33 2d86 n ALA 103 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.50 177.85 2d86 h PHE 104 N 0.02 -1.27 -1.00 0.00 3.57 -1.96 0.18 116.94 116.48 2d86 h PHE 104 Ca -0.51 -0.03 0.38 0.00 3.53 0.00 0.00 57.97 61.34 2d86 h PHE 104 Cb 1.98 0.42 -0.14 0.00 2.79 0.00 0.00 35.95 41.01 2d86 h PHE 104 CO 0.04 -0.77 0.60 -0.25 -2.23 0.00 0.00 178.31 175.70 2d86 n ASP 105 N -5.67 0.24 -0.04 0.41 9.92 -1.26 0.59 116.55 120.74 2d86 n ASP 105 Ca -0.17 1.29 -0.19 0.00 -0.53 0.00 0.00 54.79 55.20 2d86 n ASP 105 Cb 0.53 -0.63 -0.13 0.00 -0.64 0.00 0.00 41.12 40.25 2d86 n ASP 105 CO 0.00 0.00 0.00 0.25 0.13 0.00 0.00 177.20 177.58 2d86 h LEU 106 N 0.00 0.16 0.22 0.64 5.85 -1.68 0.12 115.31 120.62 2d86 h LEU 106 Ca 0.73 -0.83 0.01 0.00 0.84 0.00 0.00 57.88 58.63 2d86 h LEU 106 Cb 2.14 -0.05 -0.03 0.00 0.37 0.00 0.00 40.66 43.09 2d86 h LEU 106 CO -0.53 1.33 -0.35 0.15 -0.34 0.00 0.00 178.44 178.71 2d86 h PHE 107 N -0.74 -0.95 -0.18 1.25 3.57 0.32 -0.99 116.94 119.23 2d86 h PHE 107 Ca -0.18 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.33 2d86 h PHE 107 Cb 1.36 0.39 0.00 0.00 2.79 0.00 0.00 35.95 40.48 2d86 h PHE 107 CO 0.18 -0.47 0.00 -0.25 -2.23 0.00 0.00 178.31 175.54 2d86 n ASP 108 N -5.44 2.15 -2.64 0.41 9.92 0.12 -4.86 116.55 116.21 2d86 n ASP 108 Ca -0.08 -2.22 -0.06 0.00 -0.53 0.00 0.00 54.79 51.90 2d86 n ASP 108 Cb 0.35 -0.48 -0.01 0.00 -0.64 0.00 0.00 41.12 40.34 2d86 n ASP 108 CO 0.00 0.00 0.00 0.52 0.13 0.00 0.00 177.20 177.85 2d86 n VAL 109 N 0.17 0.00 0.38 2.53 0.31 -0.38 -4.78 118.33 116.56 2d86 n VAL 109 Ca 0.08 0.00 -0.15 0.00 -0.01 0.00 0.00 64.34 64.26 2d86 n VAL 109 Cb 0.46 -0.07 -0.07 0.00 -0.91 0.00 0.00 33.84 33.25 2d86 n VAL 109 CO 0.00 0.00 0.00 0.03 -1.32 0.00 0.00 176.83 175.54 2d86 h ARG 110 N -0.13 -0.94 -3.29 5.55 2.47 -0.99 -3.40 114.38 113.66 2d86 h ARG 110 Ca -0.09 0.06 -0.62 0.00 -1.26 0.00 0.00 59.98 58.08 2d86 h ARG 110 Cb 0.97 0.21 -0.40 0.00 -1.65 0.00 0.00 29.97 29.10 2d86 h ARG 110 CO 0.13 -0.63 -0.72 -0.51 0.56 0.00 0.00 179.97 178.80 2d86 s ASP 111 N -3.48 3.92 0.13 7.04 1.11 -1.12 -4.96 116.67 119.30 2d86 s ASP 111 Ca -0.14 -2.49 -0.10 0.00 0.18 0.00 0.00 52.55 49.99 2d86 s ASP 111 Cb 0.02 -1.16 -0.09 0.00 1.07 0.00 0.00 42.92 42.76 2d86 s ASP 111 CO 0.44 -0.29 1.37 0.15 1.18 0.00 0.00 175.17 178.02 2d86 h PHE 112 N 6.99 1.01 -1.33 4.23 3.57 -1.78 -3.18 116.94 126.45 2d86 h PHE 112 Ca -0.04 -0.41 0.41 0.00 3.53 0.00 0.00 57.97 61.45 2d86 h PHE 112 Cb 0.94 -0.17 -0.10 0.00 2.79 0.00 0.00 35.95 39.41 2d86 h PHE 112 CO 0.47 1.23 0.89 0.78 -2.23 0.00 0.00 178.31 179.44 2d86 h GLY 113 N 0.71 0.94 1.32 2.40 0.00 -1.97 0.91 103.07 107.38 2d86 h GLY 113 Ca -0.02 -0.10 -0.06 0.00 0.00 0.00 0.00 47.33 47.15 2d86 h GLY 113 CO 0.14 -0.24 0.07 0.50 0.00 0.00 0.00 176.54 177.01 2d86 h LYS 114 N 0.12 0.85 -0.32 4.80 1.57 -1.98 -2.26 116.57 119.34 2d86 h LYS 114 Ca 0.75 -0.20 -0.17 0.00 -1.87 0.00 0.00 60.65 59.17 2d86 h LYS 114 Cb 2.47 -0.11 -0.00 0.00 0.08 0.00 0.00 32.23 34.66 2d86 h LYS 114 CO -0.28 0.80 -0.46 0.28 -0.57 0.00 0.00 179.45 179.22 2d86 h VAL 115 N 0.80 1.28 -0.53 0.50 2.07 0.68 -2.96 116.25 118.09 2d86 h VAL 115 Ca 0.17 -1.64 -0.01 0.00 0.82 0.00 0.00 66.70 66.03 2d86 h VAL 115 Cb 0.38 1.51 -0.02 0.00 -1.52 0.00 0.00 31.29 31.63 2d86 h VAL 115 CO 0.01 0.54 0.27 0.40 0.02 0.00 0.00 177.57 178.81 2d86 h ILE 116 N 0.67 1.19 0.32 4.57 2.04 -1.18 -3.08 117.51 122.04 2d86 h ILE 116 Ca 0.04 -0.50 -0.00 0.00 1.00 0.00 0.00 64.86 65.39 2d86 h ILE 116 Cb 1.04 0.55 -0.01 0.00 -0.74 0.00 0.00 36.82 37.66 2d86 h ILE 116 CO 0.10 0.21 -0.26 -0.08 0.00 0.00 0.00 178.15 178.12 2d86 h GLU 117 N 0.71 -0.56 -0.97 2.37 4.81 -1.40 -2.32 114.58 117.22 2d86 h GLU 117 Ca 0.18 0.04 0.18 0.00 -0.13 0.00 0.00 59.36 59.63 2d86 h GLU 117 Cb 0.08 0.13 -0.18 0.00 0.63 0.00 0.00 28.75 29.41 2d86 h GLU 117 CO -0.03 -0.37 -0.28 1.15 -0.73 0.00 0.00 179.01 178.75 2d86 h THR 118 N -0.58 0.02 -0.71 0.32 2.02 -1.44 0.93 112.91 113.48 2d86 h THR 118 Ca -0.02 0.00 -0.03 0.00 0.77 0.00 0.00 66.41 67.13 2d86 h THR 118 Cb 0.51 0.02 -0.03 0.00 -1.74 0.00 0.00 68.15 66.91 2d86 h THR 118 CO -0.02 0.00 0.34 -0.07 0.37 0.00 0.00 175.52 176.14 2d86 h LEU 119 N -0.00 0.91 -0.73 2.58 3.38 -1.44 -0.76 115.31 119.24 2d86 h LEU 119 Ca 0.43 -0.10 0.15 0.00 0.09 0.00 0.00 57.88 58.45 2d86 h LEU 119 Cb 0.68 -0.23 -0.10 0.00 0.09 0.00 0.00 40.66 41.09 2d86 h LEU 119 CO -0.99 0.77 0.22 -1.28 0.09 0.00 0.00 178.44 177.25 2d86 h SER 120 N 1.00 0.12 0.49 -0.43 0.87 0.14 -1.30 113.55 114.44 2d86 h SER 120 Ca 0.24 0.13 -0.30 0.00 -1.23 0.00 0.00 61.79 60.63 2d86 h SER 120 Cb 0.10 0.15 0.01 0.00 -0.44 0.00 0.00 62.40 62.23 2d86 h SER 120 CO -0.03 0.02 -1.36 0.08 -0.53 0.00 0.00 176.83 175.00 2d86 h ARG 121 N 0.33 0.36 -0.71 2.24 0.11 -1.11 -3.33 114.38 112.27 2d86 h ARG 121 Ca 0.41 -0.62 0.15 0.00 0.10 0.00 0.00 59.98 60.03 2d86 h ARG 121 Cb 0.66 0.23 -0.11 0.00 1.11 0.00 0.00 29.97 31.86 2d86 h ARG 121 CO -0.46 1.29 0.12 1.25 0.10 0.00 0.00 179.97 182.26 2d86 h LEU 122 N 0.10 -0.09 -1.93 0.08 5.85 -0.06 0.56 115.31 119.82 2d86 h LEU 122 Ca -0.19 0.15 0.08 0.00 0.84 0.00 0.00 57.88 58.77 2d86 h LEU 122 Cb 2.05 0.23 -0.01 0.00 0.37 0.00 0.00 40.66 43.29 2d86 h LEU 122 CO 0.22 -0.07 0.43 0.77 -0.34 0.00 0.00 178.44 179.46 2d86 h SER 123 N 0.22 0.00 0.01 1.25 4.64 -1.43 0.25 113.55 118.47 2d86 h SER 123 Ca 0.39 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.71 2d86 h SER 123 Cb 0.67 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.76 2d86 h SER 123 CO -0.53 0.00 -0.00 0.08 -0.87 0.00 0.00 176.83 175.51 2d86 h ARG 124 N 0.00 0.00 -6.99 4.77 -0.00 -0.05 -3.28 114.38 108.83 2d86 h ARG 124 Ca 0.14 0.00 -0.56 0.00 -0.00 0.00 0.00 59.98 59.56 2d86 h ARG 124 Cb 1.01 0.00 0.17 0.00 -0.00 0.00 0.00 29.97 31.14 2d86 h ARG 124 CO -0.00 0.00 0.28 0.25 -0.00 0.00 0.00 179.97 180.51 2d86 n THR 125 N -4.24 3.96 0.97 0.08 -2.24 0.87 -4.85 114.28 108.83 2d86 n THR 125 Ca -0.03 -0.46 0.07 0.00 -2.27 0.00 0.00 64.05 61.36 2d86 n THR 125 Cb 0.09 -1.28 0.41 0.00 -2.10 0.00 0.00 70.33 67.46 2d86 n THR 125 CO 0.00 0.00 0.00 -0.81 -0.57 0.00 0.00 175.07 173.69 2d86 n PRO 126 N -1.69 0.49 -0.05 -0.78 -0.04 -1.26 -2.73 135.00 128.93 2d86 n PRO 126 Ca 0.15 0.00 -0.21 0.00 -0.04 0.00 0.00 63.50 63.39 2d86 n PRO 126 Cb 0.48 -1.45 -0.13 0.00 -0.04 0.00 0.00 33.50 32.37 2d86 n PRO 126 CO 0.00 0.00 0.00 -0.89 -0.04 0.00 0.00 175.50 174.57 2d86 n ILE 127 N -0.95 1.66 0.11 0.52 -0.00 -1.26 -3.51 119.36 115.93 2d86 n ILE 127 Ca 0.10 -0.53 -0.12 0.00 -0.00 0.00 0.00 62.75 62.21 2d86 n ILE 127 Cb 0.05 -1.71 -0.08 0.00 -0.00 0.00 0.00 39.64 37.90 2d86 n ILE 127 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.55 176.55 2d86 h ALA 128 N -0.10 -0.33 -0.93 -1.39 0.00 -1.73 -3.25 119.26 111.53 2d86 h ALA 128 Ca -0.47 -0.20 0.06 0.00 0.00 0.00 0.00 54.91 54.29 2d86 h ALA 128 Cb 1.87 0.13 -0.06 0.00 0.00 0.00 0.00 17.79 19.73 2d86 h ALA 128 CO -0.03 -0.43 0.61 -0.07 0.00 0.00 0.00 179.25 179.32 2d86 h LEU 129 N -0.84 0.96 -0.76 0.00 3.38 -1.60 -2.47 115.31 113.98 2d86 h LEU 129 Ca -0.03 0.00 0.16 0.00 0.09 0.00 0.00 57.88 58.10 2d86 h LEU 129 Cb 0.51 -0.20 -0.14 0.00 0.09 0.00 0.00 40.66 40.92 2d86 h LEU 129 CO 0.06 0.62 -0.13 0.00 0.09 0.00 0.00 178.44 179.07 2d86 h ALA 130 N 1.49 0.59 -0.81 1.53 0.00 -1.60 0.51 119.26 120.96 2d86 h ALA 130 Ca 0.39 0.28 0.13 0.00 0.00 0.00 0.00 54.91 55.71 2d86 h ALA 130 Cb 0.15 0.54 -0.06 0.00 0.00 0.00 0.00 17.79 18.42 2d86 h ALA 130 CO -0.14 -0.42 0.53 1.79 0.00 0.00 0.00 179.25 181.01 2d86 h THR 131 N 0.02 0.86 0.00 0.00 1.35 -1.50 -3.46 112.91 110.19 2d86 h THR 131 Ca 0.38 -0.21 0.00 0.00 -0.55 0.00 0.00 66.41 66.03 2d86 h THR 131 Cb 0.61 0.18 0.00 0.00 -1.73 0.00 0.00 68.15 67.22 2d86 h THR 131 CO -0.75 0.11 0.00 0.61 -0.25 0.00 0.00 175.52 175.24 2d86 n GLY 132 N -1.46 1.02 3.75 5.82 0.00 0.18 -5.08 105.19 109.42 2d86 n GLY 132 Ca 0.15 -0.13 -0.40 0.00 0.00 0.00 0.00 46.02 45.64 2d86 n GLY 132 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2d86 s ILE 133 N -2.00 4.11 -0.73 -0.61 1.01 -1.26 -4.90 121.20 116.82 2d86 s ILE 133 Ca 0.00 2.03 -0.34 0.00 0.00 0.00 0.00 60.65 62.35 2d86 s ILE 133 Cb 0.00 -4.30 -0.18 0.00 0.01 0.00 0.00 42.46 38.00 2d86 s ILE 133 CO 0.00 0.49 2.47 -2.11 0.00 0.00 0.00 174.94 175.79 2d86 n ARG 134 N 1.47 0.29 -2.26 2.79 1.85 -1.26 -4.85 116.66 114.68 2d86 n ARG 134 Ca -0.02 0.04 -0.40 0.00 -1.00 0.00 0.00 57.85 56.46 2d86 n ARG 134 Cb 0.47 -1.90 -0.03 0.00 -1.05 0.00 0.00 32.46 29.96 2d86 n ARG 134 CO 0.00 0.00 0.00 -1.25 -0.01 0.00 0.00 177.63 176.37 2d86 s PRO 135 N 7.87 4.37 0.80 2.89 0.04 -1.26 -4.84 135.00 144.87 2d86 s PRO 135 Ca 1.24 2.01 -0.17 0.00 0.04 0.00 0.00 61.00 64.12 2d86 s PRO 135 Cb -1.11 -3.02 -0.14 0.00 0.04 0.00 0.00 34.50 30.27 2d86 s PRO 135 CO 0.50 -0.10 -0.46 1.19 0.04 0.00 0.00 177.00 178.16 2d86 n PHE 136 N 0.75 -4.08 0.75 0.56 3.01 -1.26 -4.77 117.46 112.42 2d86 n PHE 136 Ca 0.01 0.17 0.07 0.00 1.01 0.00 0.00 57.45 58.71 2d86 n PHE 136 Cb 0.44 -1.56 0.39 0.00 -0.01 0.00 0.00 39.48 38.74 2d86 n PHE 136 CO 0.00 0.00 0.00 -0.35 1.01 0.00 0.00 176.76 177.42 2d86 n PRO 137 N 1.89 0.26 -3.55 -1.08 -0.04 -1.26 -4.52 135.00 126.70 2d86 n PRO 137 Ca 0.02 0.12 -0.41 0.00 -0.04 0.00 0.00 63.50 63.19 2d86 n PRO 137 Cb 0.52 -1.50 -0.11 0.00 -0.04 0.00 0.00 33.50 32.38 2d86 n PRO 137 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2d86 s SER 138 N -2.46 5.86 0.00 3.54 0.15 -1.26 -5.00 113.70 114.53 2d86 s SER 138 Ca 0.16 -1.01 0.00 0.00 0.70 0.00 0.00 55.95 55.79 2d86 s SER 138 Cb 0.10 -2.07 0.00 0.00 -1.71 0.00 0.00 66.02 62.34 2d86 s SER 138 CO 0.22 -0.43 0.00 0.61 1.20 0.00 0.00 173.24 174.84 2d86 n GLY 139 N 5.05 3.60 3.48 9.45 0.00 -1.26 -4.98 105.19 120.52 2d86 n GLY 139 Ca -0.11 -0.94 -0.30 0.00 0.00 0.00 0.00 46.02 44.67 2d86 n GLY 139 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2d86 n PRO 140 N -1.25 -3.15 -1.44 1.61 -0.04 -1.26 -4.97 135.00 124.50 2d86 n PRO 140 Ca 0.00 -1.74 -0.37 0.00 -0.04 0.00 0.00 63.50 61.36 2d86 n PRO 140 Cb 0.00 -1.63 0.06 0.00 -0.04 0.00 0.00 33.50 31.90 2d86 n PRO 140 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 2d86 n SER 141 N -4.87 -0.06 -4.37 3.54 3.41 -1.26 -4.92 113.62 105.10 2d86 n SER 141 Ca 0.15 0.70 -0.46 0.00 -0.26 0.00 0.00 58.87 59.01 2d86 n SER 141 Cb 0.58 -1.32 -0.03 0.00 -0.26 0.00 0.00 64.21 63.18 2d86 n SER 141 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 2d86 s SER 142 N -1.40 6.53 0.00 4.04 0.01 -1.26 -5.29 113.70 116.33 2d86 s SER 142 Ca 0.72 -2.15 0.04 0.00 1.31 0.00 0.00 55.95 55.87 2d86 s SER 142 Cb -0.38 -2.27 0.03 0.00 0.21 0.00 0.00 66.02 63.61 2d86 s SER 142 CO 0.51 -0.84 0.64 0.61 0.41 0.00 0.00 173.24 174.57