#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2d86 s SER 2 N 0.00 6.54 0.35 1.61 0.01 -1.26 -5.06 113.70 115.89 2d86 s SER 2 Ca 0.00 0.89 -0.26 0.00 1.31 0.00 0.00 55.95 57.88 2d86 s SER 2 Cb 0.00 -2.21 -0.09 0.00 0.21 0.00 0.00 66.02 63.92 2d86 s SER 2 CO 0.00 -0.18 1.05 -0.44 0.41 0.00 0.00 173.24 174.08 2d86 s SER 3 N -2.80 7.02 -0.29 2.44 0.01 -1.26 -5.04 113.70 113.78 2d86 s SER 3 Ca 0.47 2.10 0.05 0.00 1.31 0.00 0.00 55.95 59.87 2d86 s SER 3 Cb -0.11 -2.60 0.19 0.00 0.21 0.00 0.00 66.02 63.71 2d86 s SER 3 CO 0.26 -0.31 0.53 -0.83 0.41 0.00 0.00 173.24 173.30 2d86 s GLY 4 N -1.32 -1.04 0.19 3.44 0.00 -1.26 -5.14 107.32 102.19 2d86 s GLY 4 Ca 0.52 0.75 -0.30 0.00 0.00 0.00 0.00 44.72 45.69 2d86 s GLY 4 CO 0.32 3.48 1.21 -0.45 0.00 0.00 0.00 173.10 177.65 2d86 s SER 5 N 2.71 7.07 -0.30 1.64 0.15 -1.26 -5.01 113.70 118.70 2d86 s SER 5 Ca 0.10 2.25 -0.13 0.00 0.70 0.00 0.00 55.95 58.87 2d86 s SER 5 Cb -0.11 -2.61 0.17 0.00 -1.71 0.00 0.00 66.02 61.77 2d86 s SER 5 CO -0.27 -0.38 0.98 -0.55 1.20 0.00 0.00 173.24 174.22 2d86 s SER 6 N 0.14 -0.60 0.00 5.45 0.15 -1.26 -5.16 113.70 112.43 2d86 s SER 6 Ca 0.53 0.58 0.00 0.00 0.70 0.00 0.00 55.95 57.76 2d86 s SER 6 Cb -0.33 1.58 0.00 0.00 -1.71 0.00 0.00 66.02 65.57 2d86 s SER 6 CO 0.37 -0.11 0.00 0.61 1.20 0.00 0.00 173.24 175.31 2d86 n GLY 7 N 5.20 -1.40 3.39 9.45 0.00 -1.26 -4.84 105.19 115.73 2d86 n GLY 7 Ca -0.07 -2.09 -0.45 0.00 0.00 0.00 0.00 46.02 43.41 2d86 n GLY 7 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 2d86 s MET 8 N 0.00 3.32 0.99 1.61 -2.45 -1.26 -5.04 119.30 116.47 2d86 s MET 8 Ca 0.00 -1.67 -0.16 0.00 -1.25 0.00 0.00 55.69 52.62 2d86 s MET 8 Cb 0.00 -4.48 -0.03 0.00 1.25 0.00 0.00 34.83 31.57 2d86 s MET 8 CO 0.00 -1.57 -0.16 0.39 1.05 0.00 0.00 175.02 174.73 2d86 n GLU 9 N 5.96 -0.34 -0.08 4.11 -0.58 -1.26 -4.91 120.64 123.54 2d86 n GLU 9 Ca 0.05 -0.08 -0.13 0.00 -0.42 0.00 0.00 57.16 56.58 2d86 n GLU 9 Cb 0.45 -1.51 -0.05 0.00 -0.57 0.00 0.00 31.44 29.76 2d86 n GLU 9 CO 0.00 0.00 0.00 -1.00 -0.48 0.00 0.00 177.13 175.65 2d86 h PRO 10 N -1.41 0.54 -0.61 3.49 0.13 -2.01 -3.19 132.00 128.93 2d86 h PRO 10 Ca -0.45 -0.29 -0.04 0.00 -0.87 0.00 0.00 66.00 64.36 2d86 h PRO 10 Cb 1.31 0.01 -0.03 0.00 0.13 0.00 0.00 31.00 32.42 2d86 h PRO 10 CO 0.30 0.87 0.21 0.11 -0.23 0.00 0.00 178.00 179.26 2d86 h TRP 11 N 0.23 0.93 -0.08 1.56 5.08 -1.99 -3.22 115.95 118.46 2d86 h TRP 11 Ca 0.04 -0.07 0.01 0.00 1.08 0.00 0.00 58.89 59.94 2d86 h TRP 11 Cb 0.77 -0.28 -0.01 0.00 -3.00 0.00 0.00 29.16 26.64 2d86 h TRP 11 CO 0.08 0.74 -0.05 1.63 -1.28 0.00 0.00 178.44 179.55 2d86 n LYS 12 N -4.29 -0.04 -0.19 0.12 4.76 -1.20 0.09 118.16 117.41 2d86 n LYS 12 Ca 0.05 0.78 -0.02 0.00 -2.87 0.00 0.00 58.31 56.25 2d86 n LYS 12 Cb 0.19 -1.17 0.08 0.00 -1.84 0.00 0.00 35.03 32.30 2d86 n LYS 12 CO 0.00 0.00 0.00 -0.56 -1.37 0.00 0.00 177.40 175.47 2d86 h GLN 13 N 0.00 0.47 -0.74 1.97 3.07 -1.72 -2.28 115.11 115.87 2d86 h GLN 13 Ca 0.01 -0.03 0.16 0.00 0.09 0.00 0.00 58.65 58.88 2d86 h GLN 13 Cb 0.03 -0.11 -0.14 0.00 0.08 0.00 0.00 27.48 27.35 2d86 h GLN 13 CO -0.08 0.31 -0.11 0.00 0.09 0.00 0.00 178.83 179.04 2d86 h ALA 15 N 1.72 0.56 0.17 0.00 0.00 -0.25 -0.64 119.26 120.82 2d86 h ALA 15 Ca 0.38 0.35 0.00 0.00 0.00 0.00 0.00 54.91 55.64 2d86 h ALA 15 Cb 0.62 0.74 -0.03 0.00 0.00 0.00 0.00 17.79 19.12 2d86 h ALA 15 CO -0.72 -0.42 -0.41 1.96 0.00 0.00 0.00 179.25 179.66 2d86 h GLN 16 N -0.00 -0.62 -0.88 0.00 1.08 -1.09 -1.49 115.11 112.10 2d86 h GLN 16 Ca 0.43 0.04 0.24 0.00 -1.45 0.00 0.00 58.65 57.91 2d86 h GLN 16 Cb 0.67 0.14 -0.14 0.00 -0.05 0.00 0.00 27.48 28.10 2d86 h GLN 16 CO -0.96 -0.41 0.22 2.35 -0.95 0.00 0.00 178.83 179.08 2d86 h TRP 17 N -0.64 0.32 0.20 2.96 7.01 -1.14 0.31 115.95 124.96 2d86 h TRP 17 Ca -0.02 0.05 0.01 0.00 2.11 0.00 0.00 58.89 61.04 2d86 h TRP 17 Cb 0.62 0.00 -0.02 0.00 -2.10 0.00 0.00 29.16 27.66 2d86 h TRP 17 CO -0.37 -0.23 -0.24 -0.07 -2.79 0.00 0.00 178.44 174.73 2d86 h LEU 18 N 0.18 -0.67 -0.70 0.65 3.38 -0.54 0.40 115.31 118.02 2d86 h LEU 18 Ca 0.56 0.07 0.12 0.00 0.09 0.00 0.00 57.88 58.71 2d86 h LEU 18 Cb 1.13 0.24 -0.08 0.00 0.09 0.00 0.00 40.66 42.04 2d86 h LEU 18 CO -0.68 -0.35 0.28 0.40 0.09 0.00 0.00 178.44 178.19 2d86 h ILE 19 N -0.49 0.73 -0.13 1.22 2.04 0.01 -0.31 117.51 120.58 2d86 h ILE 19 Ca 0.01 -0.16 -0.12 0.00 1.00 0.00 0.00 64.86 65.59 2d86 h ILE 19 Cb 0.48 0.23 -0.01 0.00 -0.74 0.00 0.00 36.82 36.78 2d86 h ILE 19 CO -0.09 0.08 -0.44 0.45 0.00 0.00 0.00 178.15 178.16 2d86 h HIS 20 N 0.46 0.36 0.00 1.37 3.86 -0.84 -2.46 115.15 117.90 2d86 h HIS 20 Ca 0.36 -0.10 0.00 0.00 -1.16 0.00 0.00 60.37 59.47 2d86 h HIS 20 Cb 0.49 -0.08 0.00 0.00 1.06 0.00 0.00 27.41 28.88 2d86 h HIS 20 CO -0.16 0.69 0.00 0.00 0.86 0.00 0.00 177.93 179.33 2d86 n LYS 22 N -1.17 -3.15 0.00 0.00 4.76 -0.92 -4.67 118.16 113.00 2d86 n LYS 22 Ca 0.08 0.39 0.00 0.00 -2.87 0.00 0.00 58.31 55.92 2d86 n LYS 22 Cb 0.08 -4.07 0.00 0.00 -1.84 0.00 0.00 35.03 29.20 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 -2.58 0.00 -4.13 -0.18 0.24 -1.05 -4.88 118.33 105.74 2d86 n VAL 23 Ca -0.12 0.00 -0.15 0.00 -2.04 0.00 0.00 64.34 62.03 2d86 n VAL 23 Cb 0.57 -0.72 -0.11 0.00 -1.47 0.00 0.00 33.84 32.11 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 -3.28 2.31 1.05 1.34 1.43 -1.25 -4.99 118.68 115.29 2d86 s LEU 24 Ca 0.00 -0.65 -0.14 0.00 -1.03 0.00 0.00 54.13 52.31 2d86 s LEU 24 Cb 0.00 -0.32 0.21 0.00 0.03 0.00 0.00 46.19 46.11 2d86 s LEU 24 CO 0.00 -0.18 1.10 -2.16 0.23 0.00 0.00 176.35 175.34 2d86 s PRO 25 N -2.01 0.01 0.31 1.29 0.04 -1.26 -4.33 135.00 129.05 2d86 s PRO 25 Ca -0.03 0.38 0.17 0.00 0.04 0.00 0.00 61.00 61.56 2d86 s PRO 25 Cb -0.08 -1.70 0.13 0.00 0.04 0.00 0.00 34.50 32.89 2d86 s PRO 25 CO 0.01 -2.98 1.48 1.79 0.04 0.00 0.00 177.00 177.34 2d86 h THR 26 N -2.07 0.69 -0.35 1.26 1.35 -2.02 -3.23 112.91 108.55 2d86 h THR 26 Ca -0.53 -1.97 -0.08 0.00 -0.55 0.00 0.00 66.41 63.27 2d86 h THR 26 Cb 1.33 2.34 -0.05 0.00 -1.73 0.00 0.00 68.15 70.03 2d86 h THR 26 CO 0.53 0.39 0.02 0.59 -0.25 0.00 0.00 175.52 176.81 2d86 n ASN 27 N -3.20 3.58 -4.00 5.36 4.13 -1.26 -4.99 115.26 114.87 2d86 n ASN 27 Ca 0.02 -3.27 -0.28 0.00 1.68 0.00 0.00 54.58 52.74 2d86 n ASN 27 Cb 0.69 -0.60 0.18 0.00 -1.54 0.00 0.00 39.78 38.52 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 -0.67 -1.89 0.11 3.10 -0.00 -1.22 -4.94 115.22 109.71 2d86 n HIS 28 Ca 0.28 -0.01 -0.23 0.00 0.46 0.00 0.00 57.72 58.21 2d86 n HIS 28 Cb 1.00 -1.50 -0.15 0.00 -0.12 0.00 0.00 29.99 29.22 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 -2.44 0.45 -0.99 1.57 0.11 -1.96 -3.31 114.38 107.82 2d86 h ARG 29 Ca -0.45 -0.77 0.21 0.00 0.10 0.00 0.00 59.98 59.07 2d86 h ARG 29 Cb 1.20 0.29 -0.10 0.00 1.11 0.00 0.00 29.97 32.47 2d86 h ARG 29 CO 0.31 1.37 0.62 -0.39 0.10 0.00 0.00 179.97 181.98 2d86 h VAL 30 N -0.03 0.66 -0.68 0.08 -1.51 -1.93 0.03 116.25 112.87 2d86 h VAL 30 Ca -0.23 -0.21 0.06 0.00 -1.23 0.00 0.00 66.70 65.09 2d86 h VAL 30 Cb 1.99 -0.00 -0.05 0.00 -2.13 0.00 0.00 31.29 31.09 2d86 h VAL 30 CO 0.23 0.11 0.38 0.71 -1.23 0.00 0.00 177.57 177.77 2d86 h THR 31 N 0.61 0.98 -2.20 7.19 1.35 -1.93 -3.43 112.91 115.49 2d86 h THR 31 Ca 0.56 -0.24 -0.62 0.00 -0.55 0.00 0.00 66.41 65.55 2d86 h THR 31 Cb 1.08 0.21 0.08 0.00 -1.73 0.00 0.00 68.15 67.79 2d86 h THR 31 CO -0.32 0.13 0.42 0.79 -0.25 0.00 0.00 175.52 176.29 2d86 n TRP 32 N -4.77 1.65 -0.20 4.73 7.02 -0.00 -4.86 117.44 121.01 2d86 n TRP 32 Ca 0.08 0.57 0.00 0.00 -1.02 0.00 0.00 57.50 57.14 2d86 n TRP 32 Cb 0.16 -2.36 0.11 0.00 -2.42 0.00 0.00 31.31 26.81 2d86 n TRP 32 CO 0.00 0.00 0.00 0.38 -2.02 0.00 0.00 177.69 176.05 2d86 h ASP 33 N 3.84 0.20 -0.47 -0.99 2.03 -1.86 0.97 116.42 120.14 2d86 h ASP 33 Ca -0.44 0.08 0.14 0.00 -0.73 0.00 0.00 57.03 56.08 2d86 h ASP 33 Cb 1.32 0.07 -0.02 0.00 -0.83 0.00 0.00 39.33 39.86 2d86 h ASP 33 CO 0.73 0.12 0.59 0.77 -1.03 0.00 0.00 179.24 180.42 2d86 h SER 34 N 0.39 0.00 -4.25 4.15 4.64 -1.91 -3.41 113.55 113.16 2d86 h SER 34 Ca 0.31 0.00 -0.51 0.00 -0.47 0.00 0.00 61.79 61.11 2d86 h SER 34 Cb 0.39 0.00 0.13 0.00 -0.31 0.00 0.00 62.40 62.60 2d86 h SER 34 CO -0.32 0.00 0.34 0.00 -0.87 0.00 0.00 176.83 175.99 2d86 s ALA 35 N -4.50 2.28 0.14 5.18 0.00 0.33 -5.07 121.76 120.12 2d86 s ALA 35 Ca -0.04 0.46 -0.03 0.00 0.00 0.00 0.00 51.96 52.36 2d86 s ALA 35 Cb 0.14 -3.32 -0.03 0.00 0.00 0.00 0.00 23.12 19.90 2d86 s ALA 35 CO 0.49 -1.63 0.10 -0.65 0.00 0.00 0.00 175.76 174.06 2d86 s GLN 36 N -4.45 0.97 0.24 0.00 -0.21 -1.26 -5.00 119.66 109.95 2d86 s GLN 36 Ca 0.65 -1.39 0.04 0.00 0.02 0.00 0.00 55.36 54.68 2d86 s GLN 36 Cb -0.20 0.27 0.64 0.00 1.00 0.00 0.00 33.01 34.72 2d86 s GLN 36 CO 0.49 -0.29 1.17 1.33 -2.12 0.00 0.00 175.29 175.86 2d86 n VAL 37 N -0.12 -0.31 -0.01 1.09 0.24 -1.26 -0.02 118.33 117.93 2d86 n VAL 37 Ca -0.06 1.62 -0.12 0.00 -2.04 0.00 0.00 64.34 63.75 2d86 n VAL 37 Cb 0.64 -2.40 -0.08 0.00 -1.47 0.00 0.00 33.84 30.52 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 -1.26 -0.98 6.34 3.57 -1.96 0.34 116.94 122.98 2d86 h PHE 38 Ca 0.48 0.05 0.13 0.00 3.53 0.00 0.00 57.97 62.16 2d86 h PHE 38 Cb 1.05 0.57 -0.15 0.00 2.79 0.00 0.00 35.95 40.21 2d86 h PHE 38 CO -0.32 -0.42 -0.44 -0.25 -2.23 0.00 0.00 178.31 174.64 2d86 n ASP 39 N -4.78 -0.76 0.26 0.41 9.92 0.97 0.22 116.55 122.79 2d86 n ASP 39 Ca -0.05 1.73 0.13 0.00 -0.53 0.00 0.00 54.79 56.07 2d86 n ASP 39 Cb 0.29 -0.35 0.70 0.00 -0.64 0.00 0.00 41.12 41.13 2d86 n ASP 39 CO 0.00 0.00 0.00 0.25 0.13 0.00 0.00 177.20 177.58 2d86 h LEU 40 N 0.00 0.00 0.00 0.64 5.85 -1.33 -2.01 115.31 118.46 2d86 h LEU 40 Ca 0.29 0.00 -0.08 0.00 0.84 0.00 0.00 57.88 58.93 2d86 h LEU 40 Cb 0.54 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.55 2d86 h LEU 40 CO -0.96 0.12 -0.52 0.00 -0.34 0.00 0.00 178.44 176.74 2d86 h ALA 41 N 1.88 0.74 0.00 1.25 0.00 0.68 -3.30 119.26 120.51 2d86 h ALA 41 Ca -0.00 -0.36 -0.01 0.00 0.00 0.00 0.00 54.91 54.54 2d86 h ALA 41 Cb 0.41 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.19 2d86 h ALA 41 CO 0.02 0.47 -0.04 1.96 0.00 0.00 0.00 179.25 181.66 2d86 h GLN 42 N 0.00 0.02 -0.27 0.00 4.20 0.13 0.64 115.11 119.83 2d86 h GLN 42 Ca -0.02 -0.03 0.08 0.00 0.06 0.00 0.00 58.65 58.74 2d86 h GLN 42 Cb 1.29 0.01 -0.01 0.00 0.30 0.00 0.00 27.48 29.07 2d86 h GLN 42 CO 0.04 0.82 0.32 0.00 -0.67 0.00 0.00 178.83 179.34 2d86 h THR 43 N -0.76 0.38 0.00 -0.54 1.03 -1.62 -1.31 112.91 110.10 2d86 h THR 43 Ca -0.00 0.00 -0.25 0.00 -0.01 0.00 0.00 66.41 66.14 2d86 h THR 43 Cb 0.83 0.74 -0.05 0.00 -1.07 0.00 0.00 68.15 68.60 2d86 h THR 43 CO 0.01 0.00 -2.09 0.18 -0.01 0.00 0.00 175.52 173.61 2d86 n LEU 44 N -3.68 0.00 -0.29 0.00 4.77 -1.22 -4.46 117.00 112.12 2d86 n LEU 44 Ca 0.04 0.00 0.25 0.00 -0.03 0.00 0.00 56.01 56.27 2d86 n LEU 44 Cb 0.46 0.34 0.47 0.00 -2.33 0.00 0.00 43.42 42.36 2d86 n LEU 44 CO 0.26 0.34 0.89 -1.14 -1.33 0.00 0.00 177.39 176.41 2d86 n ARG 45 N -2.54 -0.06 0.22 3.23 0.63 0.22 0.52 116.66 118.89 2d86 n ARG 45 Ca -0.23 1.24 -0.15 0.00 -0.92 0.00 0.00 57.85 57.79 2d86 n ARG 45 Cb 0.95 -2.17 -0.08 0.00 0.45 0.00 0.00 32.46 31.60 2d86 n ARG 45 CO 0.00 0.00 0.00 0.38 -2.51 0.00 0.00 177.63 175.50 2d86 h ASP 46 N 0.00 -0.46 0.00 6.15 2.03 -1.79 -3.39 116.42 118.97 2d86 h ASP 46 Ca 0.71 -0.08 0.00 0.00 -0.73 0.00 0.00 57.03 56.92 2d86 h ASP 46 Cb 1.80 0.12 0.00 0.00 -0.83 0.00 0.00 39.33 40.42 2d86 h ASP 46 CO -0.71 -0.18 0.00 0.61 -1.03 0.00 0.00 179.24 177.93 2d86 n GLY 47 N -0.77 1.74 0.12 7.15 0.00 0.19 -4.07 105.19 109.54 2d86 n GLY 47 Ca -0.11 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.75 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 -0.86 1.47 0.00 1.61 0.31 -1.26 -4.20 118.33 115.40 2d86 n VAL 48 Ca 0.00 -0.64 -0.17 0.00 -0.01 0.00 0.00 64.34 63.51 2d86 n VAL 48 Cb 0.00 -1.19 -0.13 0.00 -0.91 0.00 0.00 33.84 31.61 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 0.32 -0.94 7.52 5.85 -1.89 -3.29 115.31 122.88 2d86 h LEU 49 Ca -0.57 -0.90 0.25 0.00 0.84 0.00 0.00 57.88 57.50 2d86 h LEU 49 Cb 1.99 -0.10 -0.17 0.00 0.37 0.00 0.00 40.66 42.75 2d86 h LEU 49 CO -0.06 1.19 0.03 -0.07 -0.34 0.00 0.00 178.44 179.20 2d86 h LEU 50 N -0.51 -0.44 -0.80 2.25 3.38 -1.88 0.82 115.31 118.13 2d86 h LEU 50 Ca -0.08 0.26 -0.02 0.00 0.09 0.00 0.00 57.88 58.13 2d86 h LEU 50 Cb 1.32 0.45 -0.04 0.00 0.09 0.00 0.00 40.66 42.49 2d86 h LEU 50 CO 0.09 -0.31 0.43 0.00 0.09 0.00 0.00 178.44 178.74 2d86 h GLN 52 N 1.12 0.08 -0.78 0.00 4.20 0.58 -2.78 115.11 117.52 2d86 h GLN 52 Ca 0.28 -0.00 0.07 0.00 0.06 0.00 0.00 58.65 59.06 2d86 h GLN 52 Cb 0.05 -0.02 -0.09 0.00 0.30 0.00 0.00 27.48 27.72 2d86 h GLN 52 CO -0.04 0.05 -0.46 -0.11 -0.67 0.00 0.00 178.83 177.60 2d86 n LEU 53 N -5.13 -0.82 -0.36 1.46 7.94 -0.73 0.11 117.00 119.46 2d86 n LEU 53 Ca -0.02 1.48 0.04 0.00 -1.11 0.00 0.00 56.01 56.40 2d86 n LEU 53 Cb 0.12 -0.23 0.19 0.00 0.53 0.00 0.00 43.42 44.03 2d86 n LEU 53 CO 0.26 -1.17 1.24 -0.07 -1.11 0.00 0.00 177.39 176.54 2d86 h LEU 54 N 0.00 0.97 -2.19 -1.96 3.38 -1.61 0.85 115.31 114.76 2d86 h LEU 54 Ca 0.12 0.02 -0.01 0.00 0.09 0.00 0.00 57.88 58.11 2d86 h LEU 54 Cb 0.32 -0.18 -0.00 0.00 0.09 0.00 0.00 40.66 40.89 2d86 h LEU 54 CO -0.73 0.59 -0.06 0.78 0.09 0.00 0.00 178.44 179.10 2d86 h ASN 55 N 1.09 0.00 0.11 -0.43 2.35 1.00 0.15 115.58 119.85 2d86 h ASN 55 Ca 0.45 0.00 -0.17 0.00 -0.55 0.00 0.00 56.30 56.03 2d86 h ASN 55 Cb 0.28 0.00 0.02 0.00 0.05 0.00 0.00 38.32 38.67 2d86 h ASN 55 CO -0.21 0.06 -0.74 0.78 -1.65 0.00 0.00 177.43 175.68 2d86 h ASN 56 N 0.00 0.45 0.17 5.81 2.35 0.18 -3.38 115.58 121.17 2d86 h ASN 56 Ca -0.00 -0.92 -0.01 0.00 -0.55 0.00 0.00 56.30 54.82 2d86 h ASN 56 Cb 0.20 -0.15 0.00 0.00 0.05 0.00 0.00 38.32 38.43 2d86 h ASN 56 CO 0.01 1.34 -0.08 -0.07 -1.65 0.00 0.00 177.43 176.98 2d86 h LEU 57 N -0.36 -0.19 -9.72 1.61 3.38 -1.03 -3.46 115.31 105.53 2d86 h LEU 57 Ca -0.12 -0.34 -0.54 0.00 0.09 0.00 0.00 57.88 56.96 2d86 h LEU 57 Cb 1.55 0.05 -0.08 0.00 0.09 0.00 0.00 40.66 42.27 2d86 h LEU 57 CO 0.14 0.35 -0.58 -0.60 0.09 0.00 0.00 178.44 177.84 2d86 s ARG 58 N -3.47 2.41 -0.05 1.13 3.52 0.49 -4.90 118.95 118.07 2d86 s ARG 58 Ca -0.13 -1.44 -0.05 0.00 -0.13 0.00 0.00 55.73 53.99 2d86 s ARG 58 Cb 0.01 -2.22 -0.04 0.00 -1.56 0.00 0.00 34.95 31.14 2d86 s ARG 58 CO 0.47 0.24 0.18 0.00 -0.81 0.00 0.00 175.30 175.39 2d86 s ALA 59 N -2.35 3.91 -1.64 6.12 0.00 -1.26 -4.06 121.76 122.48 2d86 s ALA 59 Ca 0.35 -0.69 0.00 0.00 0.00 0.00 0.00 51.96 51.62 2d86 s ALA 59 Cb -0.05 -1.94 0.00 0.00 0.00 0.00 0.00 23.12 21.13 2d86 s ALA 59 CO 0.22 0.69 0.00 0.72 0.00 0.00 0.00 175.76 177.38 2d86 n HIS 60 N 1.36 -0.45 -0.10 0.00 8.25 -1.26 -4.89 115.22 118.12 2d86 n HIS 60 Ca -0.14 0.00 -0.14 0.00 -0.26 0.00 0.00 57.72 57.18 2d86 n HIS 60 Cb 0.53 -3.24 -0.03 0.00 1.12 0.00 0.00 29.99 28.37 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 0.92 -3.02 0.41 0.02 -1.85 -3.45 113.55 106.58 2d86 h SER 61 Ca -0.39 -0.48 -0.10 0.00 -0.84 0.00 0.00 61.79 59.98 2d86 h SER 61 Cb 1.22 -0.26 -0.26 0.00 0.14 0.00 0.00 62.40 63.24 2d86 h SER 61 CO 0.50 1.21 -0.29 -0.63 -1.14 0.00 0.00 176.83 176.48 2d86 s ILE 62 N -4.33 -0.19 -0.48 3.27 1.01 -1.26 -4.78 121.20 114.44 2d86 s ILE 62 Ca -0.11 0.10 -0.29 0.00 0.00 0.00 0.00 60.65 60.35 2d86 s ILE 62 Cb 0.10 -0.66 0.03 0.00 0.01 0.00 0.00 42.46 41.94 2d86 s ILE 62 CO 0.87 0.04 1.12 0.21 0.00 0.00 0.00 174.94 177.18 2d86 s ASN 63 N 1.73 6.62 0.48 3.58 3.84 -1.26 -4.89 114.94 125.04 2d86 s ASN 63 Ca -0.08 0.42 0.34 0.00 0.21 0.00 0.00 52.86 53.76 2d86 s ASN 63 Cb -0.09 -2.54 1.46 0.00 -0.55 0.00 0.00 41.25 39.53 2d86 s ASN 63 CO -0.13 -1.24 1.68 -0.07 -2.79 0.00 0.00 177.10 174.54 2d86 h LEU 64 N 11.19 0.17 -0.84 3.21 3.38 -1.99 1.21 115.31 131.64 2d86 h LEU 64 Ca -0.23 0.07 -0.09 0.00 0.09 0.00 0.00 57.88 57.72 2d86 h LEU 64 Cb 1.06 0.05 -0.02 0.00 0.09 0.00 0.00 40.66 41.85 2d86 h LEU 64 CO 1.12 -0.06 -0.09 0.11 0.09 0.00 0.00 178.44 179.61 2d86 h LYS 65 N 0.10 0.76 0.00 1.13 1.79 -2.03 -2.17 116.57 116.16 2d86 h LYS 65 Ca 0.75 -0.24 0.00 0.00 -2.18 0.00 0.00 60.65 58.98 2d86 h LYS 65 Cb 2.58 -0.07 0.00 0.00 -1.58 0.00 0.00 32.23 33.16 2d86 h LYS 65 CO -0.22 0.84 0.00 0.93 -1.08 0.00 0.00 179.45 179.91 2d86 h GLU 66 N 0.70 0.00 -5.28 3.15 5.08 0.11 -3.41 114.58 114.93 2d86 h GLU 66 Ca 0.12 0.00 -0.65 0.00 -1.00 0.00 0.00 59.36 57.83 2d86 h GLU 66 Cb 0.56 0.00 -0.26 0.00 0.50 0.00 0.00 28.75 29.55 2d86 h GLU 66 CO 0.03 0.00 -0.75 0.96 -1.00 0.00 0.00 179.01 178.25 2d86 s ILE 67 N -3.61 3.17 -0.38 3.13 -4.36 -0.81 -5.01 121.20 113.32 2d86 s ILE 67 Ca 0.00 -0.61 -0.28 0.00 -0.26 0.00 0.00 60.65 59.50 2d86 s ILE 67 Cb 0.09 -2.35 -0.02 0.00 1.25 0.00 0.00 42.46 41.43 2d86 s ILE 67 CO 0.40 0.51 1.87 0.20 0.24 0.00 0.00 174.94 178.15 2d86 s ASN 68 N 0.48 5.68 0.10 4.36 0.01 -1.26 -4.88 114.94 119.43 2d86 s ASN 68 Ca -0.08 1.15 -0.27 0.00 -0.71 0.00 0.00 52.86 52.95 2d86 s ASN 68 Cb -0.15 -2.52 -0.06 0.00 0.41 0.00 0.00 41.25 38.92 2d86 s ASN 68 CO 0.04 -1.91 0.83 -0.76 -1.51 0.00 0.00 177.10 173.79 2d86 s LEU 69 N 7.65 4.51 -0.37 0.60 1.43 -1.26 -4.12 118.68 127.13 2d86 s LEU 69 Ca 0.80 1.61 -0.01 0.00 -1.03 0.00 0.00 54.13 55.50 2d86 s LEU 69 Cb -0.21 -3.36 -0.01 0.00 0.03 0.00 0.00 46.19 42.64 2d86 s LEU 69 CO 0.31 0.05 0.31 -1.14 0.23 0.00 0.00 176.35 176.11 2d86 n ARG 70 N 2.41 -1.53 0.00 1.70 0.63 -1.26 -4.91 116.66 113.70 2d86 n ARG 70 Ca -0.02 0.28 0.06 0.00 -0.92 0.00 0.00 57.85 57.24 2d86 n ARG 70 Cb 0.49 -3.29 0.33 0.00 0.45 0.00 0.00 32.46 30.44 2d86 n ARG 70 CO 0.00 0.00 0.00 -0.35 -2.51 0.00 0.00 177.63 174.77 2d86 n PRO 71 N -2.03 0.49 -4.24 -0.14 -0.04 -1.26 -4.84 135.00 122.94 2d86 n PRO 71 Ca -0.06 0.00 -0.34 0.00 -0.04 0.00 0.00 63.50 63.06 2d86 n PRO 71 Cb 0.55 -1.36 -0.05 0.00 -0.04 0.00 0.00 33.50 32.61 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 -0.86 -2.38 -3.96 0.54 6.02 -1.26 -0.01 117.38 115.47 2d86 n GLN 72 Ca 0.08 0.29 -0.28 0.00 -0.01 0.00 0.00 57.00 57.09 2d86 n GLN 72 Cb 0.04 -4.64 -0.00 0.00 1.02 0.00 0.00 30.24 26.65 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 -4.37 -3.94 -2.11 -1.09 2.81 -1.26 -4.96 117.12 102.20 2d86 n MET 73 Ca -0.08 0.47 -0.28 0.00 -1.81 0.00 0.00 57.70 56.00 2d86 n MET 73 Cb 0.56 -4.93 0.18 0.00 -0.71 0.00 0.00 33.22 28.33 2d86 n MET 73 CO 0.00 0.00 0.00 0.45 1.51 0.00 0.00 175.97 177.93 2d86 n SER 74 N -2.90 0.45 -0.11 7.83 2.88 0.98 -5.00 113.62 117.75 2d86 n SER 74 Ca -0.17 -1.67 -0.15 0.00 -1.33 0.00 0.00 58.87 55.55 2d86 n SER 74 Cb 0.62 -0.93 -0.10 0.00 -0.75 0.00 0.00 64.21 63.05 2d86 n SER 74 CO 0.00 0.00 0.00 1.67 -1.23 0.00 0.00 175.04 175.48 2d86 n GLN 75 N -3.59 0.53 0.07 -1.46 7.27 -1.26 -3.86 117.38 115.08 2d86 n GLN 75 Ca 0.17 0.13 -0.21 0.00 0.07 0.00 0.00 57.00 57.15 2d86 n GLN 75 Cb 0.59 -1.42 -0.13 0.00 2.41 0.00 0.00 30.24 31.69 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 -0.03 0.86 0.26 3.69 3.57 -1.96 -3.05 116.94 120.28 2d86 h PHE 76 Ca -0.48 -0.55 -0.01 0.00 3.53 0.00 0.00 57.97 60.46 2d86 h PHE 76 Cb 1.73 -0.07 0.00 0.00 2.79 0.00 0.00 35.95 40.40 2d86 h PHE 76 CO 0.02 1.40 -0.12 -0.07 -2.23 0.00 0.00 178.31 177.30 2d86 h LEU 77 N 0.08 -0.29 -0.57 0.59 3.38 -1.90 -2.95 115.31 113.66 2d86 h LEU 77 Ca -0.16 0.01 0.06 0.00 0.09 0.00 0.00 57.88 57.87 2d86 h LEU 77 Cb 1.78 0.08 -0.09 0.00 0.09 0.00 0.00 40.66 42.51 2d86 h LEU 77 CO 0.20 -0.05 -0.51 0.00 0.09 0.00 0.00 178.44 178.17 2d86 h LEU 79 N -0.22 -1.65 -0.18 0.00 3.38 -1.67 -1.56 115.31 113.40 2d86 h LEU 79 Ca 0.09 0.23 0.04 0.00 0.09 0.00 0.00 57.88 58.34 2d86 h LEU 79 Cb 0.47 0.70 -0.07 0.00 0.09 0.00 0.00 40.66 41.85 2d86 h LEU 79 CO -0.65 -0.27 -0.48 0.50 0.09 0.00 0.00 178.44 177.63 2d86 h LYS 80 N -0.19 -0.49 -0.73 1.13 3.11 -1.16 -2.51 116.57 115.74 2d86 h LYS 80 Ca 0.09 0.03 0.07 0.00 -2.81 0.00 0.00 60.65 58.03 2d86 h LYS 80 Cb 0.42 0.11 -0.09 0.00 -1.00 0.00 0.00 32.23 31.68 2d86 h LYS 80 CO -0.62 -0.32 -0.43 0.09 -2.81 0.00 0.00 179.45 175.36 2d86 n ASN 81 N -5.43 -0.77 -0.31 4.20 3.02 -0.01 -1.12 115.26 114.83 2d86 n ASN 81 Ca -0.04 1.49 -0.08 0.00 -0.03 0.00 0.00 54.58 55.92 2d86 n ASN 81 Cb 0.37 -0.27 -0.07 0.00 -0.61 0.00 0.00 39.78 39.20 2d86 n ASN 81 CO 0.00 0.00 0.00 -0.38 -2.62 0.00 0.00 177.26 174.26 2d86 n ILE 82 N -4.68 -0.50 -0.32 2.41 5.41 -0.76 -0.17 119.36 120.74 2d86 n ILE 82 Ca 0.01 2.16 0.06 0.00 1.00 0.00 0.00 62.75 65.98 2d86 n ILE 82 Cb 0.19 -2.71 0.13 0.00 -0.71 0.00 0.00 39.64 36.55 2d86 n ILE 82 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 176.55 177.09 2d86 n ARG 83 N -4.66 -0.08 -0.11 0.38 1.74 -0.28 -0.54 116.66 113.12 2d86 n ARG 83 Ca 0.01 1.38 -0.12 0.00 -0.77 0.00 0.00 57.85 58.36 2d86 n ARG 83 Cb 0.19 -2.07 -0.08 0.00 -1.02 0.00 0.00 32.46 29.48 2d86 n ARG 83 CO 0.00 0.00 0.00 1.15 -1.52 0.00 0.00 177.63 177.26 2d86 h THR 84 N 0.00 0.00 -0.51 0.55 2.02 -0.30 0.18 112.91 114.84 2d86 h THR 84 Ca 0.43 0.00 0.10 0.00 0.77 0.00 0.00 66.41 67.72 2d86 h THR 84 Cb 0.68 0.00 -0.10 0.00 -1.74 0.00 0.00 68.15 66.99 2d86 h THR 84 CO -0.91 0.00 -0.16 0.15 0.37 0.00 0.00 175.52 174.97 2d86 h PHE 85 N -0.33 -0.38 -0.62 3.16 3.57 -0.73 0.24 116.94 121.84 2d86 h PHE 85 Ca 0.06 0.05 0.09 0.00 3.53 0.00 0.00 57.97 61.69 2d86 h PHE 85 Cb 0.49 0.25 -0.04 0.00 2.79 0.00 0.00 35.95 39.44 2d86 h PHE 85 CO -0.70 -0.26 0.42 -0.07 -2.23 0.00 0.00 178.31 175.47 2d86 h LEU 86 N -0.04 0.45 -0.13 0.59 3.38 -0.76 -1.57 115.31 117.23 2d86 h LEU 86 Ca 0.25 0.01 -0.05 0.00 0.09 0.00 0.00 57.88 58.18 2d86 h LEU 86 Cb 0.42 -0.09 -0.00 0.00 0.09 0.00 0.00 40.66 41.08 2d86 h LEU 86 CO -0.55 0.28 -0.10 0.74 0.09 0.00 0.00 178.44 178.90 2d86 h THR 87 N 0.51 1.34 -0.61 0.22 2.02 0.24 -3.13 112.91 113.50 2d86 h THR 87 Ca 0.28 -1.23 0.02 0.00 0.77 0.00 0.00 66.41 66.25 2d86 h THR 87 Cb 0.44 1.88 -0.03 0.00 -1.74 0.00 0.00 68.15 68.70 2d86 h THR 87 CO -0.09 0.36 0.41 0.00 0.37 0.00 0.00 175.52 176.57 2d86 h ALA 88 N 0.61 1.61 0.00 6.16 0.00 -0.42 0.72 119.26 127.94 2d86 h ALA 88 Ca 0.02 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2d86 h ALA 88 Cb 0.61 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.18 2d86 h ALA 88 CO 0.03 0.34 0.00 0.00 0.00 0.00 0.00 179.25 179.62 2d86 n GLU 91 N -1.86 0.53 0.00 0.00 -0.58 0.06 -3.60 120.64 115.19 2d86 n GLU 91 Ca -0.03 0.40 -0.13 0.00 -0.42 0.00 0.00 57.16 56.98 2d86 n GLU 91 Cb 0.30 -1.59 -0.10 0.00 -0.57 0.00 0.00 31.44 29.48 2d86 n GLU 91 CO 0.00 0.00 0.00 1.15 -0.48 0.00 0.00 177.13 177.80 2d86 h THR 92 N -1.00 1.30 0.00 2.62 2.02 0.12 -3.41 112.91 114.56 2d86 h THR 92 Ca -0.26 -1.20 0.00 0.00 0.77 0.00 0.00 66.41 65.72 2d86 h THR 92 Cb 1.10 2.08 0.00 0.00 -1.74 0.00 0.00 68.15 69.59 2d86 h THR 92 CO -0.16 0.30 -0.09 0.49 0.37 0.00 0.00 175.52 176.43 2d86 n PHE 93 N -4.86 0.10 0.00 3.16 3.01 -0.97 -5.05 117.46 112.85 2d86 n PHE 93 Ca -0.09 0.05 0.00 0.00 1.01 0.00 0.00 57.45 58.42 2d86 n PHE 93 Cb 0.27 -0.27 0.00 0.00 -0.01 0.00 0.00 39.48 39.47 2d86 n PHE 93 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2d86 n GLY 94 N 1.68 0.57 3.94 1.37 0.00 -0.07 -4.92 105.19 107.76 2d86 n GLY 94 Ca -0.01 -0.80 -0.19 0.00 0.00 0.00 0.00 46.02 45.01 2d86 n GLY 94 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2d86 s MET 95 N -0.71 2.87 -0.17 1.61 -1.94 0.12 -4.92 119.30 116.16 2d86 s MET 95 Ca 0.00 -1.21 -0.29 0.00 -1.71 0.00 0.00 55.69 52.48 2d86 s MET 95 Cb 0.00 -2.65 -0.02 0.00 2.01 0.00 0.00 34.83 34.17 2d86 s MET 95 CO 0.00 -0.03 1.34 1.03 -0.01 0.00 0.00 175.02 177.36 2d86 s ARG 96 N -4.15 4.16 0.43 2.03 1.81 -1.26 -4.64 118.95 117.33 2d86 s ARG 96 Ca 0.46 1.68 0.23 0.00 -1.72 0.00 0.00 55.73 56.38 2d86 s ARG 96 Cb -0.08 -3.82 1.22 0.00 -0.45 0.00 0.00 34.95 31.82 2d86 s ARG 96 CO 0.30 -0.81 1.76 -0.22 -0.68 0.00 0.00 175.30 175.65 2d86 h LYS 97 N 8.66 0.28 -0.11 3.54 1.63 -1.96 0.76 116.57 129.37 2d86 h LYS 97 Ca -0.29 -0.02 -0.05 0.00 -0.85 0.00 0.00 60.65 59.45 2d86 h LYS 97 Cb 1.12 -0.06 -0.01 0.00 -0.60 0.00 0.00 32.23 32.67 2d86 h LYS 97 CO 0.98 0.19 -0.15 1.03 -3.45 0.00 0.00 179.45 178.05 2d86 h SER 98 N 0.29 0.16 -0.23 4.20 0.87 -2.01 -2.55 113.55 114.28 2d86 h SER 98 Ca 0.61 -0.03 -0.15 0.00 -1.23 0.00 0.00 61.79 60.99 2d86 h SER 98 Cb 1.76 -0.04 -0.01 0.00 -0.44 0.00 0.00 62.40 63.67 2d86 h SER 98 CO -0.26 0.33 -0.40 -0.33 -0.53 0.00 0.00 176.83 175.65 2d86 h GLU 99 N 0.17 0.78 -7.06 2.24 5.08 0.17 -3.45 114.58 112.51 2d86 h GLU 99 Ca 0.03 -0.40 -0.39 0.00 -1.00 0.00 0.00 59.36 57.60 2d86 h GLU 99 Cb 0.36 0.01 0.22 0.00 0.50 0.00 0.00 28.75 29.84 2d86 h GLU 99 CO 0.02 1.03 -0.10 -0.51 -1.00 0.00 0.00 179.01 178.46 2d86 s LEU 100 N -8.72 -0.77 0.37 1.33 1.43 -0.96 -4.53 118.68 106.83 2d86 s LEU 100 Ca -0.09 0.97 0.08 0.00 -1.03 0.00 0.00 54.13 54.06 2d86 s LEU 100 Cb 0.12 -2.48 -0.04 0.00 0.03 0.00 0.00 46.19 43.81 2d86 s LEU 100 CO 0.86 -5.18 0.16 0.72 0.23 0.00 0.00 176.35 173.14 2d86 s PHE 101 N -2.31 2.66 0.05 0.29 -0.12 -1.26 -5.02 117.98 112.28 2d86 s PHE 101 Ca 0.69 -0.46 -0.29 0.00 -0.05 0.00 0.00 56.93 56.82 2d86 s PHE 101 Cb -0.15 -1.77 -0.05 0.00 -0.63 0.00 0.00 43.02 40.43 2d86 s PHE 101 CO 0.59 0.27 0.94 -1.21 -0.05 0.00 0.00 175.22 175.76 2d86 s GLU 102 N -3.87 4.61 0.37 1.99 2.02 -1.26 -4.93 118.70 117.63 2d86 s GLU 102 Ca 0.39 1.38 0.17 0.00 0.02 0.00 0.00 54.97 56.93 2d86 s GLU 102 Cb -0.00 -3.41 1.10 0.00 0.10 0.00 0.00 34.13 31.92 2d86 s GLU 102 CO 0.23 0.11 1.71 0.00 0.02 0.00 0.00 175.26 177.32 2d86 h ALA 103 N 6.12 2.13 0.56 5.21 0.00 -1.96 -1.70 119.26 129.62 2d86 h ALA 103 Ca -0.42 0.12 -0.03 0.00 0.00 0.00 0.00 54.91 54.58 2d86 h ALA 103 Cb 1.21 0.09 0.01 0.00 0.00 0.00 0.00 17.79 19.10 2d86 h ALA 103 CO 0.73 -0.65 -0.27 0.35 0.00 0.00 0.00 179.25 179.41 2d86 h PHE 104 N 0.37 -0.70 -0.72 0.00 3.57 -1.95 -2.16 116.94 115.34 2d86 h PHE 104 Ca 0.68 -0.02 0.27 0.00 3.53 0.00 0.00 57.97 62.43 2d86 h PHE 104 Cb 1.66 0.23 -0.13 0.00 2.79 0.00 0.00 35.95 40.50 2d86 h PHE 104 CO -0.01 -0.44 0.26 -0.25 -2.23 0.00 0.00 178.31 175.65 2d86 n ASP 105 N -5.06 0.13 -0.03 0.41 9.92 -0.66 0.16 116.55 121.42 2d86 n ASP 105 Ca -0.09 1.21 -0.15 0.00 -0.53 0.00 0.00 54.79 55.23 2d86 n ASP 105 Cb 0.30 -0.54 -0.11 0.00 -0.64 0.00 0.00 41.12 40.14 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 0.25 0.79 0.64 5.85 -1.48 0.26 115.31 121.62 2d86 h LEU 106 Ca 0.55 -0.70 -0.04 0.00 0.84 0.00 0.00 57.88 58.53 2d86 h LEU 106 Cb 1.37 -0.07 0.00 0.00 0.37 0.00 0.00 40.66 42.33 2d86 h LEU 106 CO -0.60 0.92 -0.42 0.15 -0.34 0.00 0.00 178.44 178.14 2d86 h PHE 107 N -0.40 -1.10 0.00 1.25 3.57 0.22 -2.04 116.94 118.45 2d86 h PHE 107 Ca -0.02 -0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.46 2d86 h PHE 107 Cb 0.93 0.38 0.00 0.00 2.79 0.00 0.00 35.95 40.05 2d86 h PHE 107 CO 0.16 -0.66 0.00 -3.47 -2.23 0.00 0.00 178.31 172.11 2d86 n ASP 108 N -5.58 0.00 -4.33 0.41 2.03 0.11 -4.87 116.55 104.31 2d86 n ASP 108 Ca -0.15 -1.60 -0.33 0.00 0.52 0.00 0.00 54.79 53.23 2d86 n ASP 108 Cb 0.46 0.00 -0.09 0.00 -0.72 0.00 0.00 41.12 40.77 2d86 n ASP 108 CO 0.00 0.00 0.00 0.52 -1.92 0.00 0.00 177.20 175.80 2d86 n VAL 109 N -0.62 -0.96 0.13 5.18 0.31 -0.43 -4.86 118.33 117.08 2d86 n VAL 109 Ca 0.05 -0.39 -0.08 0.00 -0.01 0.00 0.00 64.34 63.92 2d86 n VAL 109 Cb 0.02 -1.05 -0.04 0.00 -0.91 0.00 0.00 33.84 31.86 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 -1.61 -0.41 -3.29 5.55 3.08 -0.81 -3.43 114.38 113.46 2d86 h ARG 110 Ca -0.64 0.03 -0.60 0.00 0.07 0.00 0.00 59.98 58.84 2d86 h ARG 110 Cb 1.40 0.09 -0.40 0.00 0.08 0.00 0.00 29.97 31.14 2d86 h ARG 110 CO 0.74 -0.20 -0.75 -0.51 -1.07 0.00 0.00 179.97 178.18 2d86 s ASP 111 N -5.10 3.83 0.14 7.04 1.01 -1.25 -4.98 116.67 117.36 2d86 s ASP 111 Ca -0.08 -2.09 -0.12 0.00 0.71 0.00 0.00 52.55 50.97 2d86 s ASP 111 Cb 0.01 -0.93 -0.02 0.00 1.01 0.00 0.00 42.92 43.00 2d86 s ASP 111 CO 0.26 -0.35 1.53 0.15 0.21 0.00 0.00 175.17 176.97 2d86 h PHE 112 N 7.45 1.03 -1.33 4.23 3.57 -1.84 -3.07 116.94 126.98 2d86 h PHE 112 Ca -0.07 -0.25 0.44 0.00 3.53 0.00 0.00 57.97 61.63 2d86 h PHE 112 Cb 0.98 -0.24 -0.13 0.00 2.79 0.00 0.00 35.95 39.34 2d86 h PHE 112 CO 0.42 1.03 0.85 0.78 -2.23 0.00 0.00 178.31 179.16 2d86 h GLY 113 N 0.73 1.35 1.20 2.40 0.00 -2.00 1.20 103.07 107.94 2d86 h GLY 113 Ca 0.10 -0.11 -0.07 0.00 0.00 0.00 0.00 47.33 47.25 2d86 h GLY 113 CO 0.06 -0.43 0.09 0.50 0.00 0.00 0.00 176.54 176.76 2d86 h LYS 114 N 0.07 0.99 -0.19 4.80 1.57 -1.98 -2.26 116.57 119.56 2d86 h LYS 114 Ca 0.84 -0.25 -0.16 0.00 -1.87 0.00 0.00 60.65 59.20 2d86 h LYS 114 Cb 2.62 -0.12 -0.01 0.00 0.08 0.00 0.00 32.23 34.80 2d86 h LYS 114 CO -0.44 0.91 -0.54 0.28 -0.57 0.00 0.00 179.45 179.09 2d86 h VAL 115 N 0.93 1.32 0.31 0.50 2.07 0.13 -3.03 116.25 118.48 2d86 h VAL 115 Ca 0.19 -1.79 -0.02 0.00 0.82 0.00 0.00 66.70 65.90 2d86 h VAL 115 Cb 0.41 1.76 0.00 0.00 -1.52 0.00 0.00 31.29 31.95 2d86 h VAL 115 CO 0.01 0.56 -0.15 0.40 0.02 0.00 0.00 177.57 178.41 2d86 h ILE 116 N 0.44 0.72 -0.34 4.57 2.04 -1.07 -3.14 117.51 120.73 2d86 h ILE 116 Ca 0.01 -0.23 0.07 0.00 1.00 0.00 0.00 64.86 65.71 2d86 h ILE 116 Cb 1.09 0.85 -0.08 0.00 -0.74 0.00 0.00 36.82 37.94 2d86 h ILE 116 CO 0.10 0.05 -0.18 -0.08 0.00 0.00 0.00 178.15 178.04 2d86 h GLU 117 N -0.54 -0.13 -0.90 2.37 4.81 -1.46 -1.69 114.58 117.04 2d86 h GLU 117 Ca -0.04 0.01 0.21 0.00 -0.13 0.00 0.00 59.36 59.41 2d86 h GLU 117 Cb 0.40 0.03 -0.17 0.00 0.63 0.00 0.00 28.75 29.64 2d86 h GLU 117 CO 0.07 -0.08 -0.12 2.41 -0.73 0.00 0.00 179.01 180.56 2d86 n THR 118 N -5.35 -0.38 -0.06 0.32 -1.04 -1.14 0.76 114.28 107.38 2d86 n THR 118 Ca 0.01 2.04 -0.11 0.00 -2.04 0.00 0.00 64.05 63.95 2d86 n THR 118 Cb 0.27 -2.88 -0.05 0.00 -1.82 0.00 0.00 70.33 65.85 2d86 n THR 118 CO 0.00 0.00 0.00 -0.07 -0.64 0.00 0.00 175.07 174.36 2d86 h LEU 119 N 0.00 0.28 -1.12 -4.42 3.38 -1.34 -1.44 115.31 110.66 2d86 h LEU 119 Ca 0.48 -0.20 0.32 0.00 0.09 0.00 0.00 57.88 58.58 2d86 h LEU 119 Cb 0.86 -0.07 -0.13 0.00 0.09 0.00 0.00 40.66 41.41 2d86 h LEU 119 CO -0.90 0.40 0.63 -1.28 0.09 0.00 0.00 178.44 177.39 2d86 h SER 120 N 0.15 0.48 0.01 -0.43 0.87 0.60 -1.59 113.55 113.64 2d86 h SER 120 Ca 0.06 0.16 -0.00 0.00 -1.23 0.00 0.00 61.79 60.78 2d86 h SER 120 Cb 0.22 0.11 0.00 0.00 -0.44 0.00 0.00 62.40 62.28 2d86 h SER 120 CO -0.00 -0.08 -0.00 0.03 -0.53 0.00 0.00 176.83 176.24 2d86 h ARG 121 N 0.32 -0.01 -0.80 2.24 3.08 -1.14 -3.35 114.38 114.73 2d86 h ARG 121 Ca 0.72 0.00 0.25 0.00 0.07 0.00 0.00 59.98 61.02 2d86 h ARG 121 Cb 1.75 0.00 -0.15 0.00 0.08 0.00 0.00 29.97 31.65 2d86 h ARG 121 CO -0.52 0.26 0.11 -0.11 -1.07 0.00 0.00 179.97 178.64 2d86 n LEU 122 N -4.74 -0.01 -0.29 3.04 7.94 -0.57 0.12 117.00 122.50 2d86 n LEU 122 Ca -0.03 1.35 0.08 0.00 -1.11 0.00 0.00 56.01 56.31 2d86 n LEU 122 Cb 0.13 -0.53 0.20 0.00 0.53 0.00 0.00 43.42 43.75 2d86 n LEU 122 CO 0.09 -1.40 0.82 0.77 -1.11 0.00 0.00 177.39 176.56 2d86 h SER 123 N 0.00 -0.39 -1.31 1.96 4.64 -1.45 0.47 113.55 117.47 2d86 h SER 123 Ca 0.53 0.22 0.43 0.00 -0.47 0.00 0.00 61.79 62.50 2d86 h SER 123 Cb 1.18 0.39 -0.13 0.00 -0.31 0.00 0.00 62.40 63.54 2d86 h SER 123 CO -0.72 -0.23 0.84 0.08 -0.87 0.00 0.00 176.83 175.93 2d86 h ARG 124 N 0.08 0.09 -6.38 4.77 -0.00 0.80 -3.29 114.38 110.45 2d86 h ARG 124 Ca 0.47 -0.01 -0.60 0.00 -0.00 0.00 0.00 59.98 59.85 2d86 h ARG 124 Cb 0.88 -0.02 0.15 0.00 -0.00 0.00 0.00 29.97 30.98 2d86 h ARG 124 CO -0.75 0.06 -0.38 0.25 -0.00 0.00 0.00 179.97 179.15 2d86 n THR 125 N -4.70 1.88 0.97 0.08 -2.24 0.16 -4.80 114.28 105.64 2d86 n THR 125 Ca 0.37 -0.50 0.07 0.00 -2.27 0.00 0.00 64.05 61.72 2d86 n THR 125 Cb 1.42 -0.61 0.43 0.00 -2.10 0.00 0.00 70.33 69.47 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 0.43 0.49 -0.07 -0.78 -0.04 -1.26 -2.62 135.00 131.15 2d86 n PRO 126 Ca 0.11 0.00 -0.18 0.00 -0.04 0.00 0.00 63.50 63.39 2d86 n PRO 126 Cb 0.42 -1.47 -0.13 0.00 -0.04 0.00 0.00 33.50 32.28 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 -0.97 1.61 -0.03 0.52 -0.00 -1.26 -3.47 119.36 115.76 2d86 n ILE 127 Ca 0.11 -0.64 -0.14 0.00 -0.00 0.00 0.00 62.75 62.09 2d86 n ILE 127 Cb 0.05 -1.47 -0.10 0.00 -0.00 0.00 0.00 39.64 38.12 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 0.14 0.07 -0.37 -1.39 0.00 -1.68 -3.25 119.26 112.79 2d86 h ALA 128 Ca -0.50 -0.34 -0.07 0.00 0.00 0.00 0.00 54.91 53.99 2d86 h ALA 128 Cb 1.98 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 19.75 2d86 h ALA 128 CO 0.00 -0.04 -0.08 -0.07 0.00 0.00 0.00 179.25 179.06 2d86 h LEU 129 N -0.38 0.61 -0.81 0.00 3.38 -1.60 -3.10 115.31 113.41 2d86 h LEU 129 Ca -0.00 -0.16 0.15 0.00 0.09 0.00 0.00 57.88 57.96 2d86 h LEU 129 Cb 0.72 -0.16 -0.15 0.00 0.09 0.00 0.00 40.66 41.16 2d86 h LEU 129 CO 0.02 0.73 -0.27 0.00 0.09 0.00 0.00 178.44 179.01 2d86 h ALA 130 N 1.33 0.33 -0.92 1.53 0.00 -1.59 0.59 119.26 120.55 2d86 h ALA 130 Ca 0.11 0.28 0.15 0.00 0.00 0.00 0.00 54.91 55.44 2d86 h ALA 130 Cb 0.49 0.74 -0.07 0.00 0.00 0.00 0.00 17.79 18.95 2d86 h ALA 130 CO 0.03 -0.51 0.59 1.79 0.00 0.00 0.00 179.25 181.14 2d86 h THR 131 N -0.04 0.83 0.00 0.00 1.35 -1.64 -3.46 112.91 109.95 2d86 h THR 131 Ca 0.35 -0.25 0.00 0.00 -0.55 0.00 0.00 66.41 65.96 2d86 h THR 131 Cb 0.59 0.04 0.00 0.00 -1.73 0.00 0.00 68.15 67.05 2d86 h THR 131 CO -0.84 0.13 0.00 0.61 -0.25 0.00 0.00 175.52 175.17 2d86 n GLY 132 N -1.42 1.08 3.74 5.82 0.00 0.21 -5.08 105.19 109.54 2d86 n GLY 132 Ca 0.18 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.79 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 4.01 -0.32 -0.61 1.01 -1.26 -4.93 121.20 117.11 2d86 s ILE 133 Ca 0.00 1.73 -0.43 0.00 0.00 0.00 0.00 60.65 61.95 2d86 s ILE 133 Cb 0.00 -4.10 -0.18 0.00 0.01 0.00 0.00 42.46 38.19 2d86 s ILE 133 CO 0.00 0.30 1.60 -2.11 0.00 0.00 0.00 174.94 174.72 2d86 n ARG 134 N 2.42 0.58 -2.25 2.79 1.85 -1.26 -4.85 116.66 115.94 2d86 n ARG 134 Ca 0.02 0.21 -0.39 0.00 -1.00 0.00 0.00 57.85 56.69 2d86 n ARG 134 Cb 0.47 -1.80 -0.02 0.00 -1.05 0.00 0.00 32.46 30.05 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 2.77 4.25 0.01 2.89 0.04 -1.26 -4.92 135.00 138.79 2d86 s PRO 135 Ca 0.99 1.98 -0.03 0.00 0.04 0.00 0.00 61.00 63.98 2d86 s PRO 135 Cb -1.25 -2.91 -0.01 0.00 0.04 0.00 0.00 34.50 30.37 2d86 s PRO 135 CO 0.70 -0.19 1.05 0.74 0.04 0.00 0.00 177.00 179.35 2d86 h PHE 136 N 3.10 -0.17 -1.38 0.56 -1.00 -1.89 -3.43 116.94 112.73 2d86 h PHE 136 Ca -0.48 0.01 0.00 0.00 2.81 0.00 0.00 57.97 60.31 2d86 h PHE 136 Cb 1.23 0.08 0.00 0.00 3.61 0.00 0.00 35.95 40.87 2d86 h PHE 136 CO 0.56 -0.04 0.00 -0.35 -1.61 0.00 0.00 178.31 176.86 2d86 n PRO 137 N -3.06 -0.80 0.37 1.51 -0.04 -1.26 -4.96 135.00 126.76 2d86 n PRO 137 Ca -0.00 0.00 -0.18 0.00 -0.04 0.00 0.00 63.50 63.28 2d86 n PRO 137 Cb 0.03 0.00 -0.09 0.00 -0.04 0.00 0.00 33.50 33.40 2d86 n PRO 137 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 2d86 h SER 138 N -0.91 -0.96 -2.45 3.54 4.64 -2.03 -3.49 113.55 111.88 2d86 h SER 138 Ca 0.00 0.05 0.00 0.00 -0.47 0.00 0.00 61.79 61.37 2d86 h SER 138 Cb 0.00 0.27 0.00 0.00 -0.31 0.00 0.00 62.40 62.36 2d86 h SER 138 CO 0.00 -0.61 0.00 0.61 -0.87 0.00 0.00 176.83 175.96 2d86 n GLY 139 N -1.53 0.01 0.09 -0.77 0.00 -1.26 -4.89 105.19 96.83 2d86 n GLY 139 Ca -0.13 -1.65 -0.13 0.00 0.00 0.00 0.00 46.02 44.10 2d86 n GLY 139 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2d86 h PRO 140 N 4.76 0.15 -5.47 1.61 0.13 -2.02 -3.48 132.00 127.68 2d86 h PRO 140 Ca 0.00 -0.08 -0.35 0.00 -0.87 0.00 0.00 66.00 64.71 2d86 h PRO 140 Cb 0.00 0.00 0.14 0.00 0.13 0.00 0.00 31.00 31.27 2d86 h PRO 140 CO 0.00 0.59 -0.66 0.45 -0.23 0.00 0.00 178.00 178.15 2d86 n SER 141 N -4.73 -4.64 0.02 1.44 2.88 -1.26 -4.91 113.62 102.40 2d86 n SER 141 Ca -0.07 -0.53 0.00 0.00 -1.33 0.00 0.00 58.87 56.94 2d86 n SER 141 Cb 0.29 -4.75 0.00 0.00 -0.75 0.00 0.00 64.21 59.00 2d86 n SER 141 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 2d86 n SER 142 N -2.80 0.32 0.00 -3.46 3.41 -1.26 -5.31 113.62 104.52 2d86 n SER 142 Ca -0.09 0.05 0.00 0.00 -0.26 0.00 0.00 58.87 58.57 2d86 n SER 142 Cb 0.59 -0.09 0.00 0.00 -0.26 0.00 0.00 64.21 64.45 2d86 n SER 142 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49