#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 6.86 0.14 1.61 0.15 -1.26 -5.07 113.70 116.13 2d86 s SER 2 Ca 0.00 1.04 0.03 0.00 0.70 0.00 0.00 55.95 57.72 2d86 s SER 2 Cb 0.00 -2.37 -0.04 0.00 -1.71 0.00 0.00 66.02 61.90 2d86 s SER 2 CO 0.00 -0.12 0.20 -0.44 1.20 0.00 0.00 173.24 174.07 2d86 s SER 3 N 0.83 5.95 0.00 5.45 0.01 -1.26 -5.09 113.70 119.59 2d86 s SER 3 Ca 0.33 0.05 0.00 0.00 1.31 0.00 0.00 55.95 57.64 2d86 s SER 3 Cb -0.17 -1.69 0.00 0.00 0.21 0.00 0.00 66.02 64.37 2d86 s SER 3 CO 0.15 0.09 0.00 0.61 0.41 0.00 0.00 173.24 174.49 2d86 n GLY 4 N -0.26 4.20 4.21 3.44 0.00 -1.26 -4.97 105.19 110.55 2d86 n GLY 4 Ca -0.07 -0.34 -0.36 0.00 0.00 0.00 0.00 46.02 45.25 2d86 n GLY 4 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2d86 n SER 5 N 0.00 -1.08 -4.55 1.61 3.41 -1.26 -4.71 113.62 107.04 2d86 n SER 5 Ca 0.00 -1.12 -0.35 0.00 -0.26 0.00 0.00 58.87 57.13 2d86 n SER 5 Cb 0.00 -1.43 -0.03 0.00 -0.26 0.00 0.00 64.21 62.49 2d86 n SER 5 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 2d86 s SER 6 N -3.29 4.60 -0.01 4.04 0.01 -1.26 -4.84 113.70 112.95 2d86 s SER 6 Ca 0.58 0.82 -0.13 0.00 1.31 0.00 0.00 55.95 58.53 2d86 s SER 6 Cb -0.34 -2.51 -0.07 0.00 0.21 0.00 0.00 66.02 63.31 2d86 s SER 6 CO 0.92 -2.83 0.71 1.23 0.41 0.00 0.00 173.24 173.68 2d86 h GLY 7 N 19.04 -0.49 -6.37 3.44 0.00 -2.06 -3.44 103.07 113.20 2d86 h GLY 7 Ca -0.22 0.18 -0.59 0.00 0.00 0.00 0.00 47.33 46.70 2d86 h GLY 7 CO 1.17 -0.18 -0.83 -0.29 0.00 0.00 0.00 176.54 176.41 2d86 s MET 8 N -3.23 2.14 0.74 4.80 -2.45 -1.26 -5.11 119.30 114.92 2d86 s MET 8 Ca -0.07 -0.50 -0.17 0.00 -1.25 0.00 0.00 55.69 53.70 2d86 s MET 8 Cb 0.01 -1.98 -0.15 0.00 1.25 0.00 0.00 34.83 33.96 2d86 s MET 8 CO 0.20 -0.22 -0.45 0.39 1.05 0.00 0.00 175.02 175.98 2d86 n GLU 9 N 4.74 0.00 0.28 4.11 4.71 -1.26 -4.82 120.64 128.41 2d86 n GLU 9 Ca -0.16 0.00 0.18 0.00 -0.01 0.00 0.00 57.16 57.16 2d86 n GLU 9 Cb 0.50 -0.99 0.71 0.00 -1.01 0.00 0.00 31.44 30.65 2d86 n GLU 9 CO 0.00 0.00 0.00 -1.00 0.09 0.00 0.00 177.13 176.22 2d86 h PRO 10 N -0.49 0.00 0.06 3.49 0.13 -2.01 -3.17 132.00 130.01 2d86 h PRO 10 Ca -0.42 0.00 -0.38 0.00 -0.87 0.00 0.00 66.00 64.33 2d86 h PRO 10 Cb 1.37 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 32.45 2d86 h PRO 10 CO 0.33 0.00 -2.26 -2.67 -0.23 0.00 0.00 178.00 173.16 2d86 n TRP 11 N -3.08 0.57 -0.30 1.56 4.27 -1.26 -3.61 117.44 115.59 2d86 n TRP 11 Ca 0.00 0.12 0.09 0.00 -3.89 0.00 0.00 57.50 53.83 2d86 n TRP 11 Cb 0.29 -1.07 0.22 0.00 -1.36 0.00 0.00 31.31 29.39 2d86 n TRP 11 CO 0.00 0.00 0.00 0.87 -2.29 0.00 0.00 177.69 176.27 2d86 h LYS 12 N 0.03 0.08 0.07 -2.67 1.79 -1.89 0.25 116.57 114.23 2d86 h LYS 12 Ca -0.51 -0.00 -0.26 0.00 -2.18 0.00 0.00 60.65 57.70 2d86 h LYS 12 Cb 1.96 -0.02 0.01 0.00 -1.58 0.00 0.00 32.23 32.60 2d86 h LYS 12 CO -0.01 0.05 -1.10 -0.56 -1.08 0.00 0.00 179.45 176.75 2d86 h GLN 13 N 0.08 0.41 -0.90 3.15 3.07 -1.76 -3.28 115.11 115.88 2d86 h GLN 13 Ca 0.50 -0.53 0.17 0.00 0.09 0.00 0.00 58.65 58.87 2d86 h GLN 13 Cb 0.95 0.17 -0.10 0.00 0.08 0.00 0.00 27.48 28.58 2d86 h GLN 13 CO -0.77 1.20 0.48 0.00 0.09 0.00 0.00 178.83 179.83 2d86 h ALA 15 N 1.60 1.54 0.65 0.00 0.00 -1.25 -1.52 119.26 120.28 2d86 h ALA 15 Ca 0.51 0.22 -0.03 0.00 0.00 0.00 0.00 54.91 55.60 2d86 h ALA 15 Cb 0.76 0.27 0.00 0.00 0.00 0.00 0.00 17.79 18.82 2d86 h ALA 15 CO -0.38 -0.51 -0.35 1.96 0.00 0.00 0.00 179.25 179.97 2d86 h GLN 16 N 0.25 -0.88 -0.99 0.00 1.08 -1.30 -2.55 115.11 110.71 2d86 h GLN 16 Ca 0.63 0.06 0.34 0.00 -1.45 0.00 0.00 58.65 58.22 2d86 h GLN 16 Cb 1.34 0.20 -0.18 0.00 -0.05 0.00 0.00 27.48 28.79 2d86 h GLN 16 CO -0.65 -0.59 0.27 2.35 -0.95 0.00 0.00 178.83 179.27 2d86 h TRP 17 N -0.91 0.37 0.05 2.96 7.01 -1.34 0.50 115.95 124.59 2d86 h TRP 17 Ca -0.09 0.06 0.01 0.00 2.11 0.00 0.00 58.89 60.98 2d86 h TRP 17 Cb 0.71 0.00 -0.01 0.00 -2.10 0.00 0.00 29.16 27.76 2d86 h TRP 17 CO 0.02 -0.45 -0.08 -0.07 -2.79 0.00 0.00 178.44 175.08 2d86 h LEU 18 N 0.02 -0.21 -0.90 0.65 3.38 -1.18 0.52 115.31 117.59 2d86 h LEU 18 Ca 0.71 0.03 0.05 0.00 0.09 0.00 0.00 57.88 58.76 2d86 h LEU 18 Cb 1.70 0.08 -0.06 0.00 0.09 0.00 0.00 40.66 42.47 2d86 h LEU 18 CO -0.84 -0.12 0.58 0.40 0.09 0.00 0.00 178.44 178.55 2d86 h ILE 19 N -0.16 1.11 0.00 1.22 2.04 0.35 -1.27 117.51 120.81 2d86 h ILE 19 Ca 0.02 -0.38 -0.10 0.00 1.00 0.00 0.00 64.86 65.40 2d86 h ILE 19 Cb 0.17 -0.08 -0.01 0.00 -0.74 0.00 0.00 36.82 36.16 2d86 h ILE 19 CO -0.05 0.20 -0.49 0.45 0.00 0.00 0.00 178.15 178.26 2d86 h HIS 20 N 1.09 0.00 0.00 1.37 3.86 -0.78 -2.85 115.15 117.84 2d86 h HIS 20 Ca 0.37 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.58 2d86 h HIS 20 Cb 0.07 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.54 2d86 h HIS 20 CO -0.02 0.49 0.00 0.00 0.86 0.00 0.00 177.93 179.26 2d86 n LYS 22 N -0.60 -6.02 0.00 0.00 4.76 -1.07 -4.81 118.16 110.41 2d86 n LYS 22 Ca 0.05 0.74 0.00 0.00 -2.87 0.00 0.00 58.31 56.22 2d86 n LYS 22 Cb 0.02 -5.57 0.00 0.00 -1.84 0.00 0.00 35.03 27.64 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 -4.34 0.00 -4.07 -0.18 0.24 -0.94 -4.94 118.33 104.10 2d86 n VAL 23 Ca -0.23 0.00 -0.13 0.00 -2.04 0.00 0.00 64.34 61.94 2d86 n VAL 23 Cb 0.65 -0.20 -0.12 0.00 -1.47 0.00 0.00 33.84 32.70 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 -2.65 2.20 0.52 1.34 1.43 -1.21 -4.98 118.68 115.33 2d86 s LEU 24 Ca 0.00 -0.44 -0.20 0.00 -1.03 0.00 0.00 54.13 52.45 2d86 s LEU 24 Cb 0.00 -0.17 -0.06 0.00 0.03 0.00 0.00 46.19 45.99 2d86 s LEU 24 CO 0.00 -0.15 1.14 -2.16 0.23 0.00 0.00 176.35 175.41 2d86 s PRO 25 N -1.25 3.47 0.60 1.29 0.04 -1.26 -4.14 135.00 133.75 2d86 s PRO 25 Ca -0.08 1.66 0.35 0.00 0.04 0.00 0.00 61.00 62.97 2d86 s PRO 25 Cb -0.08 -2.12 1.93 0.00 0.04 0.00 0.00 34.50 34.26 2d86 s PRO 25 CO 0.00 -0.76 2.23 1.79 0.04 0.00 0.00 177.00 180.31 2d86 h THR 26 N 1.40 0.29 -0.29 1.26 1.35 -2.00 -0.92 112.91 114.00 2d86 h THR 26 Ca -0.50 -0.17 -0.01 0.00 -0.55 0.00 0.00 66.41 65.17 2d86 h THR 26 Cb 1.26 1.13 -0.01 0.00 -1.73 0.00 0.00 68.15 68.80 2d86 h THR 26 CO 0.58 0.03 0.00 0.59 -0.25 0.00 0.00 175.52 176.47 2d86 n ASN 27 N -3.44 3.90 -4.09 5.36 4.13 -1.26 -4.94 115.26 114.92 2d86 n ASN 27 Ca -0.02 -3.06 -0.30 0.00 1.68 0.00 0.00 54.58 52.87 2d86 n ASN 27 Cb 0.13 -0.56 0.14 0.00 -1.54 0.00 0.00 39.78 37.96 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 -0.50 -1.57 0.20 3.10 -0.00 -0.35 -4.88 115.22 111.20 2d86 n HIS 28 Ca 0.23 0.21 0.10 0.00 0.46 0.00 0.00 57.72 58.72 2d86 n HIS 28 Cb 0.92 -1.49 0.13 0.00 -0.12 0.00 0.00 29.99 29.43 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 -2.01 0.00 0.00 1.57 -0.00 -1.96 -3.21 114.38 108.77 2d86 h ARG 29 Ca -0.45 0.00 -0.05 0.00 -0.00 0.00 0.00 59.98 59.48 2d86 h ARG 29 Cb 1.24 0.00 -0.01 0.00 -0.00 0.00 0.00 29.97 31.21 2d86 h ARG 29 CO 0.31 0.08 -0.22 -0.39 -0.00 0.00 0.00 179.97 179.74 2d86 h VAL 30 N 0.00 0.45 -0.20 0.08 -1.51 -1.95 -3.14 116.25 109.98 2d86 h VAL 30 Ca -0.00 -1.29 -0.14 0.00 -1.23 0.00 0.00 66.70 64.04 2d86 h VAL 30 Cb 1.06 1.94 -0.01 0.00 -2.13 0.00 0.00 31.29 32.15 2d86 h VAL 30 CO 0.01 0.22 -0.45 0.71 -1.23 0.00 0.00 177.57 176.83 2d86 h THR 31 N 0.00 1.31 -3.14 7.19 1.35 -1.90 -3.45 112.91 114.28 2d86 h THR 31 Ca -0.00 -1.64 -0.58 0.00 -0.55 0.00 0.00 66.41 63.64 2d86 h THR 31 Cb 0.92 1.65 0.11 0.00 -1.73 0.00 0.00 68.15 69.10 2d86 h THR 31 CO 0.03 0.51 0.40 0.79 -0.25 0.00 0.00 175.52 177.00 2d86 n TRP 32 N -4.00 1.96 -0.06 4.73 7.02 -1.19 -4.89 117.44 121.00 2d86 n TRP 32 Ca -0.02 0.58 -0.08 0.00 -1.02 0.00 0.00 57.50 56.96 2d86 n TRP 32 Cb 0.54 -2.36 -0.01 0.00 -2.42 0.00 0.00 31.31 27.06 2d86 n TRP 32 CO 0.00 0.00 0.00 -0.44 -2.02 0.00 0.00 177.69 175.23 2d86 h ASP 33 N 2.30 0.00 -1.19 -0.99 5.19 -1.90 -1.41 116.42 118.43 2d86 h ASP 33 Ca -0.45 0.04 0.34 0.00 -0.62 0.00 0.00 57.03 56.34 2d86 h ASP 33 Cb 1.30 0.06 -0.07 0.00 0.18 0.00 0.00 39.33 40.80 2d86 h ASP 33 CO 0.61 0.04 0.83 0.28 -3.12 0.00 0.00 179.24 177.88 2d86 h SER 34 N 0.14 0.13 -2.52 6.45 0.02 -1.93 -3.41 113.55 112.42 2d86 h SER 34 Ca 0.12 0.03 -0.49 0.00 -0.84 0.00 0.00 61.79 60.61 2d86 h SER 34 Cb 0.12 0.01 0.23 0.00 0.14 0.00 0.00 62.40 62.90 2d86 h SER 34 CO -0.16 0.01 -1.10 0.00 -1.14 0.00 0.00 176.83 174.44 2d86 n ALA 35 N -2.69 -3.89 -2.83 3.77 0.00 -0.53 -5.04 120.51 109.29 2d86 n ALA 35 Ca 0.27 -1.06 -0.09 0.00 0.00 0.00 0.00 53.44 52.55 2d86 n ALA 35 Cb 1.19 -1.53 -0.06 0.00 0.00 0.00 0.00 19.45 19.06 2d86 n ALA 35 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 2d86 s GLN 36 N -3.32 1.11 0.35 0.00 -0.21 -1.26 -5.03 119.66 111.31 2d86 s GLN 36 Ca 0.54 -0.99 0.16 0.00 0.02 0.00 0.00 55.36 55.09 2d86 s GLN 36 Cb -0.13 0.41 1.19 0.00 1.00 0.00 0.00 33.01 35.48 2d86 s GLN 36 CO 0.67 -0.42 1.59 -0.39 -2.12 0.00 0.00 175.29 174.63 2d86 h VAL 37 N 2.50 0.05 0.35 1.09 -1.51 -1.98 0.17 116.25 116.91 2d86 h VAL 37 Ca -0.32 -0.02 -0.01 0.00 -1.23 0.00 0.00 66.70 65.13 2d86 h VAL 37 Cb 1.23 -0.00 -0.02 0.00 -2.13 0.00 0.00 31.29 30.37 2d86 h VAL 37 CO 0.48 0.01 -0.38 0.15 -1.23 0.00 0.00 177.57 176.59 2d86 h PHE 38 N 0.04 -1.07 -0.86 5.19 3.57 -1.96 0.62 116.94 122.48 2d86 h PHE 38 Ca 0.78 0.01 0.09 0.00 3.53 0.00 0.00 57.97 62.38 2d86 h PHE 38 Cb 1.96 0.42 -0.11 0.00 2.79 0.00 0.00 35.95 41.01 2d86 h PHE 38 CO -0.11 -0.50 -0.48 -0.25 -2.23 0.00 0.00 178.31 174.74 2d86 n ASP 39 N -4.70 -0.85 0.25 0.41 8.00 0.04 0.23 116.55 119.92 2d86 n ASP 39 Ca -0.09 1.53 0.08 0.00 0.71 0.00 0.00 54.79 57.02 2d86 n ASP 39 Cb 0.34 -0.23 0.61 0.00 -0.02 0.00 0.00 41.12 41.83 2d86 n ASP 39 CO 0.00 0.00 0.00 0.25 -0.39 0.00 0.00 177.20 177.06 2d86 h LEU 40 N 0.00 0.00 -0.06 0.64 5.85 -1.43 -0.26 115.31 120.05 2d86 h LEU 40 Ca 0.17 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.89 2d86 h LEU 40 Cb 0.38 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.41 2d86 h LEU 40 CO -0.82 0.10 0.00 0.00 -0.34 0.00 0.00 178.44 177.38 2d86 n ALA 41 N -2.48 2.22 -0.09 1.25 0.00 0.63 -3.63 120.51 118.42 2d86 n ALA 41 Ca -0.03 -0.04 -0.18 0.00 0.00 0.00 0.00 53.44 53.20 2d86 n ALA 41 Cb 0.18 -1.46 -0.10 0.00 0.00 0.00 0.00 19.45 18.07 2d86 n ALA 41 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.50 179.46 2d86 h GLN 42 N 0.00 0.00 -0.00 0.00 4.20 0.17 -1.90 115.11 117.58 2d86 h GLN 42 Ca 0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 2d86 h GLN 42 Cb 0.63 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.41 2d86 h GLN 42 CO 0.00 0.86 0.31 0.00 -0.67 0.00 0.00 178.83 179.33 2d86 h THR 43 N -1.00 0.00 0.00 -0.54 1.03 -1.54 0.15 112.91 111.01 2d86 h THR 43 Ca -0.23 0.00 -0.04 0.00 -0.01 0.00 0.00 66.41 66.13 2d86 h THR 43 Cb 1.12 0.69 -0.01 0.00 -1.07 0.00 0.00 68.15 68.88 2d86 h THR 43 CO -0.14 0.00 -1.70 0.18 -0.01 0.00 0.00 175.52 173.85 2d86 n LEU 44 N -2.90 0.00 -0.30 0.00 4.77 -1.24 -4.54 117.00 112.79 2d86 n LEU 44 Ca -0.02 0.00 0.13 0.00 -0.03 0.00 0.00 56.01 56.09 2d86 n LEU 44 Cb 0.36 0.05 0.31 0.00 -2.33 0.00 0.00 43.42 41.81 2d86 n LEU 44 CO 0.14 0.05 1.01 -0.09 -1.33 0.00 0.00 177.39 177.18 2d86 h ARG 45 N 0.00 0.32 -0.40 3.23 2.43 0.16 0.61 114.38 120.73 2d86 h ARG 45 Ca -0.06 -0.02 0.08 0.00 -0.81 0.00 0.00 59.98 59.17 2d86 h ARG 45 Cb 0.84 -0.07 -0.07 0.00 -0.42 0.00 0.00 29.97 30.25 2d86 h ARG 45 CO 0.00 0.21 -0.04 0.38 -1.51 0.00 0.00 179.97 179.01 2d86 h ASP 46 N 0.33 -0.26 0.00 -3.80 2.03 -1.79 -3.42 116.42 109.51 2d86 h ASP 46 Ca 0.56 0.11 0.00 0.00 -0.73 0.00 0.00 57.03 56.97 2d86 h ASP 46 Cb 1.10 0.20 0.00 0.00 -0.83 0.00 0.00 39.33 39.80 2d86 h ASP 46 CO -0.57 -0.09 0.00 0.61 -1.03 0.00 0.00 179.24 178.16 2d86 n GLY 47 N -1.29 1.60 0.08 7.15 0.00 0.21 -4.52 105.19 108.41 2d86 n GLY 47 Ca 0.03 -0.01 -0.10 0.00 0.00 0.00 0.00 46.02 45.94 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 -1.41 0.92 -0.03 1.61 0.31 -1.26 -4.28 118.33 114.19 2d86 n VAL 48 Ca 0.00 -0.42 -0.12 0.00 -0.01 0.00 0.00 64.34 63.79 2d86 n VAL 48 Cb 0.00 -0.94 -0.10 0.00 -0.91 0.00 0.00 33.84 31.90 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 -0.04 -0.99 7.52 5.85 -1.88 -3.27 115.31 122.50 2d86 h LEU 49 Ca -0.36 -0.65 0.19 0.00 0.84 0.00 0.00 57.88 57.90 2d86 h LEU 49 Cb 1.65 0.01 -0.18 0.00 0.37 0.00 0.00 40.66 42.51 2d86 h LEU 49 CO -0.03 0.70 -0.28 0.18 -0.34 0.00 0.00 178.44 178.67 2d86 n LEU 50 N -4.75 -0.42 -0.30 2.25 4.77 -1.26 0.12 117.00 117.41 2d86 n LEU 50 Ca -0.08 1.70 0.02 0.00 -0.03 0.00 0.00 56.01 57.63 2d86 n LEU 50 Cb 0.34 -0.49 0.16 0.00 -2.33 0.00 0.00 43.42 41.10 2d86 n LEU 50 CO 0.29 -1.61 1.17 0.00 -1.33 0.00 0.00 177.39 175.90 2d86 h GLN 52 N 0.87 0.02 -0.90 0.00 4.20 0.93 -2.62 115.11 117.61 2d86 h GLN 52 Ca 0.40 -0.00 0.15 0.00 0.06 0.00 0.00 58.65 59.25 2d86 h GLN 52 Cb 0.30 -0.01 -0.15 0.00 0.30 0.00 0.00 27.48 27.93 2d86 h GLN 52 CO -0.22 0.02 -0.32 -0.11 -0.67 0.00 0.00 178.83 177.52 2d86 n LEU 53 N -5.13 -0.53 -0.12 1.46 7.94 -0.74 0.64 117.00 120.51 2d86 n LEU 53 Ca -0.04 1.56 -0.09 0.00 -1.11 0.00 0.00 56.01 56.33 2d86 n LEU 53 Cb 0.08 -0.38 -0.01 0.00 0.53 0.00 0.00 43.42 43.63 2d86 n LEU 53 CO 0.28 -1.43 0.90 -0.07 -1.11 0.00 0.00 177.39 175.97 2d86 h LEU 54 N 0.00 0.52 -2.59 -1.96 3.38 -1.53 -1.99 115.31 111.13 2d86 h LEU 54 Ca 0.34 -0.18 0.01 0.00 0.09 0.00 0.00 57.88 58.14 2d86 h LEU 54 Cb 0.56 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 41.18 2d86 h LEU 54 CO -0.90 0.56 0.10 0.78 0.09 0.00 0.00 178.44 179.07 2d86 h ASN 55 N 0.45 0.00 0.03 -0.43 2.35 0.56 0.21 115.58 118.75 2d86 h ASN 55 Ca 0.12 0.00 -0.07 0.00 -0.55 0.00 0.00 56.30 55.80 2d86 h ASN 55 Cb 0.21 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.58 2d86 h ASN 55 CO -0.01 0.00 -0.34 0.78 -1.65 0.00 0.00 177.43 176.21 2d86 h ASN 56 N 0.00 0.11 0.08 5.81 2.35 -0.04 -3.38 115.58 120.51 2d86 h ASN 56 Ca 0.02 -0.94 -0.00 0.00 -0.55 0.00 0.00 56.30 54.82 2d86 h ASN 56 Cb 0.22 -0.04 0.00 0.00 0.05 0.00 0.00 38.32 38.55 2d86 h ASN 56 CO -0.00 1.15 -0.04 -0.07 -1.65 0.00 0.00 177.43 176.82 2d86 h LEU 57 N -0.85 -0.09 -9.35 1.61 3.38 -0.95 -3.45 115.31 105.62 2d86 h LEU 57 Ca -0.07 -0.40 -0.61 0.00 0.09 0.00 0.00 57.88 56.88 2d86 h LEU 57 Cb 1.19 0.02 -0.13 0.00 0.09 0.00 0.00 40.66 41.83 2d86 h LEU 57 CO 0.01 0.38 -0.71 -0.60 0.09 0.00 0.00 178.44 177.61 2d86 s ARG 58 N -4.25 2.06 0.28 1.13 3.52 0.67 -4.90 118.95 117.47 2d86 s ARG 58 Ca -0.15 -1.34 -0.09 0.00 -0.13 0.00 0.00 55.73 54.01 2d86 s ARG 58 Cb 0.02 -2.12 -0.07 0.00 -1.56 0.00 0.00 34.95 31.22 2d86 s ARG 58 CO 0.62 0.41 0.61 0.00 -0.81 0.00 0.00 175.30 176.13 2d86 s ALA 59 N -1.88 3.52 -1.49 6.12 0.00 -1.26 -3.98 121.76 122.78 2d86 s ALA 59 Ca 0.26 -0.30 -0.14 0.00 0.00 0.00 0.00 51.96 51.78 2d86 s ALA 59 Cb -0.08 -2.48 0.11 0.00 0.00 0.00 0.00 23.12 20.67 2d86 s ALA 59 CO 0.16 0.33 0.70 -2.39 0.00 0.00 0.00 175.76 174.56 2d86 n HIS 60 N -0.56 -1.86 0.09 0.00 1.44 -1.26 -4.84 115.22 108.22 2d86 n HIS 60 Ca 0.01 0.68 -0.14 0.00 -2.01 0.00 0.00 57.72 56.26 2d86 n HIS 60 Cb 0.53 -3.11 -0.14 0.00 0.12 0.00 0.00 29.99 27.40 2d86 n HIS 60 CO 0.00 0.00 0.00 0.77 -2.81 0.00 0.00 176.34 174.30 2d86 h SER 61 N -1.38 0.33 -2.89 4.39 0.02 -1.87 -3.46 113.55 108.70 2d86 h SER 61 Ca -0.52 -0.36 -0.03 0.00 -0.84 0.00 0.00 61.79 60.04 2d86 h SER 61 Cb 1.34 -0.11 -0.24 0.00 0.14 0.00 0.00 62.40 63.54 2d86 h SER 61 CO 0.66 1.28 -0.16 -0.63 -1.14 0.00 0.00 176.83 176.84 2d86 s ILE 62 N -2.66 -0.22 -0.54 3.27 1.01 -1.26 -4.78 121.20 116.01 2d86 s ILE 62 Ca -0.03 0.05 -0.28 0.00 0.00 0.00 0.00 60.65 60.39 2d86 s ILE 62 Cb 0.08 -0.82 0.02 0.00 0.01 0.00 0.00 42.46 41.74 2d86 s ILE 62 CO 0.87 0.02 1.37 0.21 0.00 0.00 0.00 174.94 177.41 2d86 s ASN 63 N 1.84 6.23 0.54 3.58 3.84 -1.26 -4.86 114.94 124.85 2d86 s ASN 63 Ca -0.08 0.34 0.39 0.00 0.21 0.00 0.00 52.86 53.71 2d86 s ASN 63 Cb -0.08 -2.55 1.58 0.00 -0.55 0.00 0.00 41.25 39.65 2d86 s ASN 63 CO -0.16 -1.62 1.77 -0.07 -2.79 0.00 0.00 177.10 174.22 2d86 h LEU 64 N 12.71 0.01 -0.53 3.21 3.38 -1.99 1.14 115.31 133.23 2d86 h LEU 64 Ca -0.26 0.00 -0.16 0.00 0.09 0.00 0.00 57.88 57.54 2d86 h LEU 64 Cb 1.09 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.83 2d86 h LEU 64 CO 1.16 -0.00 -0.69 0.11 0.09 0.00 0.00 178.44 179.11 2d86 h LYS 65 N 0.01 0.22 0.00 1.13 1.79 -2.03 -2.97 116.57 114.72 2d86 h LYS 65 Ca 0.63 -0.18 -0.02 0.00 -2.18 0.00 0.00 60.65 58.90 2d86 h LYS 65 Cb 2.51 0.04 -0.00 0.00 -1.58 0.00 0.00 32.23 33.19 2d86 h LYS 65 CO -0.01 0.83 -0.09 0.93 -1.08 0.00 0.00 179.45 180.03 2d86 h GLU 66 N 0.15 0.00 -5.36 3.15 4.39 0.95 -3.42 114.58 114.44 2d86 h GLU 66 Ca -0.02 0.00 -0.63 0.00 0.34 0.00 0.00 59.36 59.05 2d86 h GLU 66 Cb 1.24 0.00 -0.18 0.00 -0.10 0.00 0.00 28.75 29.71 2d86 h GLU 66 CO 0.11 0.09 -0.62 0.96 -1.16 0.00 0.00 179.01 178.39 2d86 s ILE 67 N -3.72 4.32 -0.54 3.13 -4.36 -1.01 -5.01 121.20 114.01 2d86 s ILE 67 Ca 0.00 -0.21 -0.26 0.00 -0.26 0.00 0.00 60.65 59.92 2d86 s ILE 67 Cb 0.10 -2.91 -0.04 0.00 1.25 0.00 0.00 42.46 40.86 2d86 s ILE 67 CO 0.58 0.49 2.11 0.20 0.24 0.00 0.00 174.94 178.56 2d86 s ASN 68 N 0.23 4.93 0.25 4.36 0.01 -1.26 -4.82 114.94 118.64 2d86 s ASN 68 Ca 0.01 0.75 -0.04 0.00 -0.71 0.00 0.00 52.86 52.86 2d86 s ASN 68 Cb -0.13 -2.52 0.30 0.00 0.41 0.00 0.00 41.25 39.31 2d86 s ASN 68 CO 0.02 -2.56 1.80 -0.07 -1.51 0.00 0.00 177.10 174.77 2d86 h LEU 69 N 17.70 0.91 -7.36 0.60 3.38 -1.93 -3.33 115.31 125.27 2d86 h LEU 69 Ca -0.26 -0.16 -0.69 0.00 0.09 0.00 0.00 57.88 56.87 2d86 h LEU 69 Cb 1.21 -0.24 -0.37 0.00 0.09 0.00 0.00 40.66 41.36 2d86 h LEU 69 CO 1.18 0.86 -0.28 0.00 0.09 0.00 0.00 178.44 180.29 2d86 s ARG 70 N -5.32 2.87 0.00 1.13 1.70 -1.26 -4.90 118.95 113.17 2d86 s ARG 70 Ca -0.11 -3.03 0.12 0.00 -0.47 0.00 0.00 55.73 52.25 2d86 s ARG 70 Cb 0.15 -3.78 0.73 0.00 -0.57 0.00 0.00 34.95 31.49 2d86 s ARG 70 CO 0.82 -1.23 1.16 -0.35 -1.08 0.00 0.00 175.30 174.62 2d86 n PRO 71 N 2.68 0.49 -3.38 3.89 -0.04 -1.25 -4.83 135.00 132.56 2d86 n PRO 71 Ca 0.16 0.00 -0.19 0.00 -0.04 0.00 0.00 63.50 63.43 2d86 n PRO 71 Cb 0.37 -1.39 -0.04 0.00 -0.04 0.00 0.00 33.50 32.40 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 -0.89 -1.94 -3.49 0.54 6.02 -1.26 0.95 117.38 117.30 2d86 n GLN 72 Ca 0.09 0.06 -0.18 0.00 -0.01 0.00 0.00 57.00 56.96 2d86 n GLN 72 Cb 0.04 -4.51 0.08 0.00 1.02 0.00 0.00 30.24 26.87 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 -3.14 -6.27 -5.15 -1.09 2.81 -1.26 -5.00 117.12 98.01 2d86 n MET 73 Ca 0.05 0.80 -0.32 0.00 -1.81 0.00 0.00 57.70 56.42 2d86 n MET 73 Cb 0.47 -5.72 -0.16 0.00 -0.71 0.00 0.00 33.22 27.10 2d86 n MET 73 CO 0.00 0.00 0.00 -1.12 1.51 0.00 0.00 175.97 176.36 2d86 s SER 74 N -4.34 3.32 0.02 7.83 0.01 0.27 -5.06 113.70 115.76 2d86 s SER 74 Ca 0.01 -0.45 -0.20 0.00 1.31 0.00 0.00 55.95 56.62 2d86 s SER 74 Cb -0.01 -0.97 -0.11 0.00 0.21 0.00 0.00 66.02 65.14 2d86 s SER 74 CO 0.75 0.24 1.17 -0.61 0.41 0.00 0.00 173.24 175.20 2d86 h GLN 75 N 6.08 -0.70 -0.79 12.44 4.15 -1.95 0.20 115.11 134.55 2d86 h GLN 75 Ca -0.32 0.05 0.19 0.00 0.77 0.00 0.00 58.65 59.34 2d86 h GLN 75 Cb 1.18 0.16 -0.15 0.00 0.21 0.00 0.00 27.48 28.88 2d86 h GLN 75 CO 0.49 -0.46 -0.07 0.34 -1.93 0.00 0.00 178.83 177.19 2d86 n PHE 76 N -4.16 0.41 0.13 3.99 7.35 -1.26 -0.09 117.46 123.82 2d86 n PHE 76 Ca -0.09 0.96 -0.09 0.00 -0.76 0.00 0.00 57.45 57.47 2d86 n PHE 76 Cb 0.29 -1.04 -0.06 0.00 0.35 0.00 0.00 39.48 39.02 2d86 n PHE 76 CO 0.00 0.00 0.00 -0.07 -0.76 0.00 0.00 176.76 175.93 2d86 h LEU 77 N 0.00 -0.34 -0.60 -2.13 3.38 -1.88 -3.04 115.31 110.70 2d86 h LEU 77 Ca 0.44 -0.14 0.07 0.00 0.09 0.00 0.00 57.88 58.34 2d86 h LEU 77 Cb 0.81 0.09 -0.10 0.00 0.09 0.00 0.00 40.66 41.55 2d86 h LEU 77 CO -0.77 0.14 -0.54 0.00 0.09 0.00 0.00 178.44 177.36 2d86 h LEU 79 N -0.26 -1.76 -0.18 0.00 3.38 -0.63 -1.99 115.31 113.87 2d86 h LEU 79 Ca 0.12 0.23 0.05 0.00 0.09 0.00 0.00 57.88 58.37 2d86 h LEU 79 Cb 0.54 0.72 -0.07 0.00 0.09 0.00 0.00 40.66 41.94 2d86 h LEU 79 CO -0.71 -0.42 -0.37 0.50 0.09 0.00 0.00 178.44 177.53 2d86 h LYS 80 N -0.43 -0.40 -0.85 1.13 3.11 -1.19 -1.69 116.57 116.25 2d86 h LYS 80 Ca 0.07 0.03 0.17 0.00 -2.81 0.00 0.00 60.65 58.11 2d86 h LYS 80 Cb 0.62 0.09 -0.16 0.00 -1.00 0.00 0.00 32.23 31.78 2d86 h LYS 80 CO -0.56 -0.27 -0.23 0.09 -2.81 0.00 0.00 179.45 175.68 2d86 n ASN 81 N -5.42 -0.33 -0.22 4.20 3.02 0.27 0.23 115.26 117.00 2d86 n ASN 81 Ca -0.03 1.46 -0.01 0.00 -0.03 0.00 0.00 54.58 55.98 2d86 n ASN 81 Cb 0.35 -0.43 0.21 0.00 -0.61 0.00 0.00 39.78 39.30 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 1.21 -0.12 2.41 2.04 -0.95 -3.10 117.51 119.00 2d86 h ILE 82 Ca 0.39 -0.47 0.02 0.00 1.00 0.00 0.00 64.86 65.81 2d86 h ILE 82 Cb 0.61 0.17 -0.05 0.00 -0.74 0.00 0.00 36.82 36.81 2d86 h ILE 82 CO -0.87 0.22 -0.40 0.03 0.00 0.00 0.00 178.15 177.13 2d86 h ARG 83 N 1.03 -0.40 -0.91 2.37 2.47 0.33 -2.16 114.38 117.10 2d86 h ARG 83 Ca 0.27 0.03 0.08 0.00 -1.26 0.00 0.00 59.98 59.10 2d86 h ARG 83 Cb -0.03 0.09 -0.11 0.00 -1.65 0.00 0.00 29.97 28.27 2d86 h ARG 83 CO -0.05 -0.26 -0.54 2.41 0.56 0.00 0.00 179.97 182.09 2d86 n THR 84 N -4.64 -0.62 -0.25 2.04 -1.04 -1.11 -0.23 114.28 108.42 2d86 n THR 84 Ca -0.04 2.31 -0.00 0.00 -2.04 0.00 0.00 64.05 64.28 2d86 n THR 84 Cb 0.27 -2.87 0.07 0.00 -1.82 0.00 0.00 70.33 65.98 2d86 n THR 84 CO 0.00 0.00 0.00 0.15 -0.64 0.00 0.00 175.07 174.58 2d86 h PHE 85 N 0.00 -0.58 0.00 -1.42 3.57 -1.52 0.92 116.94 117.91 2d86 h PHE 85 Ca 0.15 0.07 -0.02 0.00 3.53 0.00 0.00 57.97 61.70 2d86 h PHE 85 Cb 0.37 0.37 -0.00 0.00 2.79 0.00 0.00 35.95 39.48 2d86 h PHE 85 CO -1.00 -0.35 -0.09 -0.07 -2.23 0.00 0.00 178.31 174.57 2d86 h LEU 86 N -0.04 0.00 -0.04 0.59 3.38 0.03 -1.96 115.31 117.26 2d86 h LEU 86 Ca 0.33 0.00 -0.15 0.00 0.09 0.00 0.00 57.88 58.15 2d86 h LEU 86 Cb 0.56 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.32 2d86 h LEU 86 CO -0.77 0.09 -0.54 0.74 0.09 0.00 0.00 178.44 178.05 2d86 h THR 87 N 0.00 1.40 0.00 0.22 2.02 0.32 -3.17 112.91 113.70 2d86 h THR 87 Ca -0.00 -1.96 -0.01 0.00 0.77 0.00 0.00 66.41 65.21 2d86 h THR 87 Cb 0.17 2.43 -0.00 0.00 -1.74 0.00 0.00 68.15 69.00 2d86 h THR 87 CO 0.01 0.58 -0.04 0.00 0.37 0.00 0.00 175.52 176.44 2d86 h ALA 88 N 0.39 1.05 0.00 6.16 0.00 -0.22 0.27 119.26 126.90 2d86 h ALA 88 Ca -0.06 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.82 2d86 h ALA 88 Cb 1.23 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.01 2d86 h ALA 88 CO 0.11 0.05 0.00 0.00 0.00 0.00 0.00 179.25 179.41 2d86 n GLU 91 N -1.34 0.66 0.01 0.00 -0.58 0.01 -3.43 120.64 115.97 2d86 n GLU 91 Ca 0.00 0.29 -0.21 0.00 -0.42 0.00 0.00 57.16 56.82 2d86 n GLU 91 Cb 0.00 -1.62 -0.14 0.00 -0.57 0.00 0.00 31.44 29.11 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 -0.36 1.19 0.00 2.62 2.02 -0.76 -3.43 112.91 114.20 2d86 h THR 92 Ca -0.51 -2.42 0.00 0.00 0.77 0.00 0.00 66.41 64.25 2d86 h THR 92 Cb 1.78 2.85 0.00 0.00 -1.74 0.00 0.00 68.15 71.04 2d86 h THR 92 CO -0.12 0.68 -0.76 0.49 0.37 0.00 0.00 175.52 176.17 2d86 n PHE 93 N -4.05 0.17 0.00 3.16 3.01 -0.88 -5.05 117.46 113.82 2d86 n PHE 93 Ca -0.22 0.07 0.00 0.00 1.01 0.00 0.00 57.45 58.32 2d86 n PHE 93 Cb 0.84 -0.48 0.00 0.00 -0.01 0.00 0.00 39.48 39.83 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 1.50 0.87 3.00 1.37 0.00 -0.75 -4.93 105.19 106.25 2d86 n GLY 94 Ca -0.11 -0.79 -0.21 0.00 0.00 0.00 0.00 46.02 44.91 2d86 n GLY 94 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 173.32 174.47 2d86 n MET 95 N 0.00 0.86 -2.01 1.61 0.00 -0.55 -4.95 117.12 112.09 2d86 n MET 95 Ca 0.00 -2.73 -0.34 0.00 0.00 0.00 0.00 57.70 54.63 2d86 n MET 95 Cb 0.00 0.32 -0.04 0.00 0.00 0.00 0.00 33.22 33.50 2d86 n MET 95 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 175.97 177.00 2d86 s ARG 96 N -3.76 2.55 0.65 3.17 3.00 -1.26 -4.75 118.95 118.55 2d86 s ARG 96 Ca 0.23 0.34 0.17 0.00 0.00 0.00 0.00 55.73 56.47 2d86 s ARG 96 Cb -0.02 -4.63 0.93 0.00 0.00 0.00 0.00 34.95 31.23 2d86 s ARG 96 CO 0.15 -3.02 1.52 0.87 0.00 0.00 0.00 175.30 174.81 2d86 h LYS 97 N 13.90 0.00 0.09 3.54 1.57 -1.95 0.82 116.57 134.54 2d86 h LYS 97 Ca -0.13 0.00 -0.27 0.00 -1.87 0.00 0.00 60.65 58.37 2d86 h LYS 97 Cb 1.11 0.00 0.02 0.00 0.08 0.00 0.00 32.23 33.44 2d86 h LYS 97 CO 1.21 0.00 -1.16 0.77 -0.57 0.00 0.00 179.45 179.70 2d86 h SER 98 N 0.00 0.66 0.10 0.86 0.02 -2.02 -3.23 113.55 109.95 2d86 h SER 98 Ca 0.00 -0.61 -0.03 0.00 -0.84 0.00 0.00 61.79 60.31 2d86 h SER 98 Cb 1.21 -0.21 -0.01 0.00 0.14 0.00 0.00 62.40 63.54 2d86 h SER 98 CO 0.00 1.43 -0.12 1.05 -1.14 0.00 0.00 176.83 178.05 2d86 h GLU 99 N 0.21 0.05 -6.72 3.45 4.11 0.28 -3.44 114.58 112.52 2d86 h GLU 99 Ca -0.14 -0.01 -0.48 0.00 0.07 0.00 0.00 59.36 58.80 2d86 h GLU 99 Cb 1.84 -0.01 0.23 0.00 0.50 0.00 0.00 28.75 31.30 2d86 h GLU 99 CO 0.21 0.18 -0.89 1.28 0.07 0.00 0.00 179.01 179.86 2d86 n LEU 100 N -4.37 -1.59 -4.99 3.06 4.77 -1.16 -4.63 117.00 108.09 2d86 n LEU 100 Ca -0.02 0.03 -0.19 0.00 -0.03 0.00 0.00 56.01 55.80 2d86 n LEU 100 Cb 0.21 -1.05 0.00 0.00 -2.33 0.00 0.00 43.42 40.25 2d86 n LEU 100 CO 0.36 -3.28 0.10 0.72 -1.33 0.00 0.00 177.39 173.97 2d86 s PHE 101 N -2.29 3.03 0.02 -1.77 -0.12 -1.26 -5.02 117.98 110.56 2d86 s PHE 101 Ca 0.57 -0.24 -0.28 0.00 -0.05 0.00 0.00 56.93 56.92 2d86 s PHE 101 Cb -0.15 -2.14 -0.04 0.00 -0.63 0.00 0.00 43.02 40.06 2d86 s PHE 101 CO 0.67 -0.17 0.91 -1.21 -0.05 0.00 0.00 175.22 175.37 2d86 s GLU 102 N -4.26 4.57 0.40 1.99 0.41 -1.26 -4.93 118.70 115.63 2d86 s GLU 102 Ca 0.48 1.31 0.22 0.00 -0.41 0.00 0.00 54.97 56.57 2d86 s GLU 102 Cb -0.10 -3.43 1.21 0.00 -1.78 0.00 0.00 34.13 30.04 2d86 s GLU 102 CO 0.32 0.07 1.70 0.00 -0.49 0.00 0.00 175.26 176.87 2d86 h ALA 103 N 6.35 2.36 0.06 5.21 0.00 -1.96 0.08 119.26 131.37 2d86 h ALA 103 Ca -0.42 0.10 -0.00 0.00 0.00 0.00 0.00 54.91 54.59 2d86 h ALA 103 Cb 1.21 0.11 0.00 0.00 0.00 0.00 0.00 17.79 19.11 2d86 h ALA 103 CO 0.74 -0.88 -0.03 0.35 0.00 0.00 0.00 179.25 179.43 2d86 h PHE 104 N 0.28 -0.08 -0.91 0.00 3.57 -1.96 -2.17 116.94 115.67 2d86 h PHE 104 Ca 0.70 -0.00 0.32 0.00 3.53 0.00 0.00 57.97 62.51 2d86 h PHE 104 Cb 1.90 0.02 -0.17 0.00 2.79 0.00 0.00 35.95 40.50 2d86 h PHE 104 CO -0.00 0.47 0.26 -3.47 -2.23 0.00 0.00 178.31 173.34 2d86 n ASP 105 N -4.85 0.11 -0.06 0.41 -0.08 -0.00 -0.23 116.55 111.85 2d86 n ASP 105 Ca -0.08 1.53 -0.12 0.00 -1.51 0.00 0.00 54.79 54.60 2d86 n ASP 105 Cb 0.29 -0.65 -0.11 0.00 2.34 0.00 0.00 41.12 42.99 2d86 n ASP 105 CO 0.00 0.00 0.00 0.25 0.12 0.00 0.00 177.20 177.57 2d86 h LEU 106 N 0.00 -0.01 -0.25 -2.67 5.85 -1.54 0.76 115.31 117.45 2d86 h LEU 106 Ca 0.66 -0.85 0.04 0.00 0.84 0.00 0.00 57.88 58.58 2d86 h LEU 106 Cb 1.60 0.00 -0.07 0.00 0.37 0.00 0.00 40.66 42.56 2d86 h LEU 106 CO -0.78 0.90 -0.51 0.15 -0.34 0.00 0.00 178.44 177.86 2d86 h PHE 107 N -0.96 -1.52 0.00 1.25 3.57 -0.00 -0.28 116.94 118.99 2d86 h PHE 107 Ca -0.00 0.07 0.00 0.00 3.53 0.00 0.00 57.97 61.57 2d86 h PHE 107 Cb 0.85 0.70 0.00 0.00 2.79 0.00 0.00 35.95 40.29 2d86 h PHE 107 CO 0.23 -0.51 -0.13 -3.47 -2.23 0.00 0.00 178.31 172.21 2d86 n ASP 108 N -5.42 0.42 -2.35 0.41 2.03 0.68 -4.93 116.55 107.40 2d86 n ASP 108 Ca -0.04 0.40 -0.15 0.00 0.52 0.00 0.00 54.79 55.52 2d86 n ASP 108 Cb 0.36 -0.44 0.04 0.00 -0.72 0.00 0.00 41.12 40.36 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 -1.84 -1.73 0.38 5.18 0.31 0.29 -4.96 118.33 115.96 2d86 n VAL 109 Ca 0.06 0.00 -0.15 0.00 -0.01 0.00 0.00 64.34 64.24 2d86 n VAL 109 Cb 0.38 -2.95 -0.07 0.00 -0.91 0.00 0.00 33.84 30.29 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 -1.49 -0.94 -2.99 5.55 2.47 0.17 -3.40 114.38 113.76 2d86 h ARG 110 Ca -0.36 0.06 -0.60 0.00 -1.26 0.00 0.00 59.98 57.83 2d86 h ARG 110 Cb 1.24 0.21 -0.40 0.00 -1.65 0.00 0.00 29.97 29.37 2d86 h ARG 110 CO 0.36 -0.62 -0.76 -0.51 0.56 0.00 0.00 179.97 178.99 2d86 s ASP 111 N -3.43 3.56 0.31 7.04 1.11 -1.24 -4.97 116.67 119.05 2d86 s ASP 111 Ca -0.14 -2.38 0.00 0.00 0.18 0.00 0.00 52.55 50.22 2d86 s ASP 111 Cb 0.01 -0.87 0.50 0.00 1.07 0.00 0.00 42.92 43.63 2d86 s ASP 111 CO 0.43 -0.30 1.90 0.15 1.18 0.00 0.00 175.17 178.53 2d86 h PHE 112 N 7.01 0.82 -1.15 4.23 3.57 -1.82 -2.63 116.94 126.97 2d86 h PHE 112 Ca -0.02 -0.04 0.34 0.00 3.53 0.00 0.00 57.97 61.78 2d86 h PHE 112 Cb 0.95 -0.26 -0.11 0.00 2.79 0.00 0.00 35.95 39.33 2d86 h PHE 112 CO 0.45 0.62 0.74 0.78 -2.23 0.00 0.00 178.31 178.67 2d86 h GLY 113 N 0.93 1.26 1.33 2.40 0.00 -1.98 0.61 103.07 107.63 2d86 h GLY 113 Ca 0.20 -0.17 -0.11 0.00 0.00 0.00 0.00 47.33 47.25 2d86 h GLY 113 CO -0.02 -0.25 -0.21 0.50 0.00 0.00 0.00 176.54 176.56 2d86 h LYS 114 N 0.26 0.77 -0.32 4.80 1.57 -1.90 -2.39 116.57 119.36 2d86 h LYS 114 Ca 0.69 -0.30 -0.16 0.00 -1.87 0.00 0.00 60.65 59.01 2d86 h LYS 114 Cb 1.94 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 34.20 2d86 h LYS 114 CO -0.35 0.92 -0.42 0.28 -0.57 0.00 0.00 179.45 179.30 2d86 h VAL 115 N 0.68 1.28 -0.11 0.50 2.07 0.06 -3.09 116.25 117.63 2d86 h VAL 115 Ca 0.10 -1.60 -0.01 0.00 0.82 0.00 0.00 66.70 66.01 2d86 h VAL 115 Cb 0.72 1.48 -0.01 0.00 -1.52 0.00 0.00 31.29 31.96 2d86 h VAL 115 CO 0.06 0.52 0.05 0.40 0.02 0.00 0.00 177.57 178.61 2d86 h ILE 116 N 0.65 1.14 -0.57 4.57 2.04 -1.09 -3.03 117.51 121.22 2d86 h ILE 116 Ca 0.05 -0.43 0.11 0.00 1.00 0.00 0.00 64.86 65.59 2d86 h ILE 116 Cb 0.99 1.22 -0.09 0.00 -0.74 0.00 0.00 36.82 38.20 2d86 h ILE 116 CO 0.09 0.13 0.05 -0.08 0.00 0.00 0.00 178.15 178.34 2d86 h GLU 117 N 0.03 0.16 -0.91 2.37 4.57 -1.44 -0.80 114.58 118.56 2d86 h GLU 117 Ca 0.04 -0.01 0.26 0.00 -1.18 0.00 0.00 59.36 58.47 2d86 h GLU 117 Cb 0.16 -0.04 -0.15 0.00 -0.16 0.00 0.00 28.75 28.56 2d86 h GLU 117 CO -0.00 0.11 0.22 1.15 -1.18 0.00 0.00 179.01 179.30 2d86 h THR 118 N 0.17 0.22 -0.19 0.32 2.02 -1.45 0.21 112.91 114.21 2d86 h THR 118 Ca 0.30 -0.05 -0.10 0.00 0.77 0.00 0.00 66.41 67.33 2d86 h THR 118 Cb 0.46 0.06 -0.00 0.00 -1.74 0.00 0.00 68.15 66.93 2d86 h THR 118 CO -0.45 0.03 -0.28 -0.07 0.37 0.00 0.00 175.52 175.12 2d86 h LEU 119 N 0.15 0.57 -1.99 2.58 3.38 -1.22 -2.04 115.31 116.74 2d86 h LEU 119 Ca 0.59 -0.52 0.43 0.00 0.09 0.00 0.00 57.88 58.47 2d86 h LEU 119 Cb 1.24 -0.16 -0.06 0.00 0.09 0.00 0.00 40.66 41.77 2d86 h LEU 119 CO -0.72 0.98 1.06 0.28 0.09 0.00 0.00 178.44 180.13 2d86 h SER 120 N 0.18 0.00 0.00 -0.43 0.02 0.02 -1.05 113.55 112.30 2d86 h SER 120 Ca 0.02 0.00 -0.22 0.00 -0.84 0.00 0.00 61.79 60.75 2d86 h SER 120 Cb 0.85 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 63.36 2d86 h SER 120 CO 0.06 0.00 -1.37 0.54 -1.14 0.00 0.00 176.83 174.93 2d86 n ARG 121 N -4.07 0.55 -0.28 3.45 1.74 -1.00 -4.31 116.66 112.74 2d86 n ARG 121 Ca 0.32 0.49 0.23 0.00 -0.77 0.00 0.00 57.85 58.12 2d86 n ARG 121 Cb 1.53 -1.67 0.43 0.00 -1.02 0.00 0.00 32.46 31.73 2d86 n ARG 121 CO 0.00 0.00 0.00 -0.11 -1.52 0.00 0.00 177.63 176.00 2d86 n LEU 122 N -4.43 0.19 -0.13 0.55 7.94 -0.46 0.15 117.00 120.81 2d86 n LEU 122 Ca -0.31 1.42 -0.04 0.00 -1.11 0.00 0.00 56.01 55.97 2d86 n LEU 122 Cb 0.64 -0.65 0.04 0.00 0.53 0.00 0.00 43.42 43.98 2d86 n LEU 122 CO 0.14 -1.55 0.90 0.77 -1.11 0.00 0.00 177.39 176.54 2d86 h SER 123 N 0.00 -0.02 -1.81 1.96 4.64 -1.59 -1.00 113.55 115.73 2d86 h SER 123 Ca 0.67 0.08 0.55 0.00 -0.47 0.00 0.00 61.79 62.61 2d86 h SER 123 Cb 1.69 0.11 -0.09 0.00 -0.31 0.00 0.00 62.40 63.79 2d86 h SER 123 CO -0.70 0.03 1.28 0.54 -0.87 0.00 0.00 176.83 177.11 2d86 n ARG 124 N -5.12 -0.01 -1.45 4.77 5.12 0.39 -3.56 116.66 116.82 2d86 n ARG 124 Ca 0.03 1.12 -0.37 0.00 -1.93 0.00 0.00 57.85 56.70 2d86 n ARG 124 Cb 0.20 -2.48 0.05 0.00 -1.16 0.00 0.00 32.46 29.08 2d86 n ARG 124 CO 0.00 0.00 0.00 0.25 -1.93 0.00 0.00 177.63 175.95 2d86 n THR 125 N -4.11 2.58 0.72 0.55 -2.24 -0.38 -4.78 114.28 106.61 2d86 n THR 125 Ca 0.43 -0.47 0.07 0.00 -2.27 0.00 0.00 64.05 61.82 2d86 n THR 125 Cb 1.89 -0.84 0.38 0.00 -2.10 0.00 0.00 70.33 69.66 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 -0.58 0.23 -0.00 -0.78 -0.04 -1.26 -2.47 135.00 130.09 2d86 n PRO 126 Ca 0.12 0.14 -0.12 0.00 -0.04 0.00 0.00 63.50 63.59 2d86 n PRO 126 Cb 0.48 -1.50 -0.14 0.00 -0.04 0.00 0.00 33.50 32.30 2d86 n PRO 126 CO 0.00 0.00 0.00 0.82 -0.04 0.00 0.00 175.50 176.28 2d86 h ILE 127 N 0.00 0.87 0.05 0.52 5.03 -1.88 -3.09 117.51 119.02 2d86 h ILE 127 Ca 0.00 -2.67 -0.12 0.00 -0.12 0.00 0.00 64.86 61.95 2d86 h ILE 127 Cb 0.13 2.50 0.00 0.00 -3.03 0.00 0.00 36.82 36.42 2d86 h ILE 127 CO 0.00 0.65 -0.59 0.00 -0.68 0.00 0.00 178.15 177.52 2d86 h ALA 128 N 0.72 0.04 -0.36 1.87 0.00 -1.64 -3.35 119.26 116.54 2d86 h ALA 128 Ca -0.30 -0.73 -0.06 0.00 0.00 0.00 0.00 54.91 53.81 2d86 h ALA 128 Cb 2.01 0.20 -0.02 0.00 0.00 0.00 0.00 17.79 19.98 2d86 h ALA 128 CO 0.09 0.32 -0.04 -0.07 0.00 0.00 0.00 179.25 179.55 2d86 h LEU 129 N -0.73 0.56 -0.52 0.00 3.38 -1.55 -3.03 115.31 113.43 2d86 h LEU 129 Ca -0.13 -0.13 0.10 0.00 0.09 0.00 0.00 57.88 57.82 2d86 h LEU 129 Cb 1.32 -0.15 -0.10 0.00 0.09 0.00 0.00 40.66 41.82 2d86 h LEU 129 CO 0.02 0.66 -0.19 0.00 0.09 0.00 0.00 178.44 179.02 2d86 h ALA 130 N 1.41 0.22 -0.85 1.53 0.00 -1.67 0.86 119.26 120.76 2d86 h ALA 130 Ca 0.11 0.19 0.08 0.00 0.00 0.00 0.00 54.91 55.29 2d86 h ALA 130 Cb 0.42 0.50 -0.06 0.00 0.00 0.00 0.00 17.79 18.65 2d86 h ALA 130 CO 0.02 -0.51 0.55 1.79 0.00 0.00 0.00 179.25 181.10 2d86 h THR 131 N -0.07 1.01 0.00 0.00 1.35 -1.66 -3.46 112.91 110.08 2d86 h THR 131 Ca 0.24 -0.30 0.00 0.00 -0.55 0.00 0.00 66.41 65.80 2d86 h THR 131 Cb 0.45 0.05 0.00 0.00 -1.73 0.00 0.00 68.15 66.92 2d86 h THR 131 CO -0.57 0.16 0.00 0.61 -0.25 0.00 0.00 175.52 175.47 2d86 n GLY 132 N -1.42 0.98 3.75 5.82 0.00 0.29 -5.08 105.19 109.54 2d86 n GLY 132 Ca 0.13 -0.03 -0.41 0.00 0.00 0.00 0.00 46.02 45.72 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 3.72 -0.83 -0.61 1.01 -1.26 -4.83 121.20 116.41 2d86 s ILE 133 Ca 0.00 1.59 -0.23 0.00 0.00 0.00 0.00 60.65 62.01 2d86 s ILE 133 Cb 0.00 -4.01 -0.19 0.00 0.01 0.00 0.00 42.46 38.26 2d86 s ILE 133 CO 0.00 0.32 2.18 0.54 0.00 0.00 0.00 174.94 177.98 2d86 n ARG 134 N 1.86 0.00 -2.25 2.79 1.74 -1.26 -4.82 116.66 114.72 2d86 n ARG 134 Ca 0.01 0.00 -0.39 0.00 -0.77 0.00 0.00 57.85 56.69 2d86 n ARG 134 Cb 0.46 -1.19 -0.02 0.00 -1.02 0.00 0.00 32.46 30.68 2d86 n ARG 134 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 2d86 s PRO 135 N 7.25 4.25 0.49 5.56 0.04 -1.26 -4.83 135.00 146.49 2d86 s PRO 135 Ca 1.12 1.97 -0.22 0.00 0.04 0.00 0.00 61.00 63.91 2d86 s PRO 135 Cb -1.00 -2.90 -0.09 0.00 0.04 0.00 0.00 34.50 30.55 2d86 s PRO 135 CO 0.41 -0.19 0.90 1.19 0.04 0.00 0.00 177.00 179.35 2d86 n PHE 136 N 0.51 0.73 0.97 0.56 3.01 -1.26 -4.82 117.46 117.15 2d86 n PHE 136 Ca 0.02 0.51 0.06 0.00 1.01 0.00 0.00 57.45 59.05 2d86 n PHE 136 Cb 0.44 -2.15 0.34 0.00 -0.01 0.00 0.00 39.48 38.10 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 -0.14 0.49 -1.30 -1.08 -0.04 -1.26 -4.88 135.00 126.79 2d86 n PRO 137 Ca 0.11 0.00 -0.46 0.00 -0.04 0.00 0.00 63.50 63.11 2d86 n PRO 137 Cb 0.42 -1.37 -0.04 0.00 -0.04 0.00 0.00 33.50 32.48 2d86 n PRO 137 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 2d86 n SER 138 N -0.87 -0.95 0.00 3.54 7.64 -1.26 -4.88 113.62 116.83 2d86 n SER 138 Ca 0.09 1.04 0.00 0.00 1.01 0.00 0.00 58.87 61.00 2d86 n SER 138 Cb 0.04 -0.86 0.00 0.00 -1.01 0.00 0.00 64.21 62.38 2d86 n SER 138 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2d86 n GLY 139 N 1.75 -1.47 3.70 0.23 0.00 -1.26 -5.13 105.19 103.02 2d86 n GLY 139 Ca 0.17 -1.05 -0.42 0.00 0.00 0.00 0.00 46.02 44.71 2d86 n GLY 139 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2d86 s PRO 140 N -1.23 4.31 -0.01 1.61 0.04 -1.26 -5.03 135.00 133.43 2d86 s PRO 140 Ca 0.00 2.03 0.05 0.00 0.04 0.00 0.00 61.00 63.12 2d86 s PRO 140 Cb 0.00 -3.39 -0.03 0.00 0.04 0.00 0.00 34.50 31.12 2d86 s PRO 140 CO 0.00 -0.49 -0.15 -1.12 0.04 0.00 0.00 177.00 175.28 2d86 s SER 141 N 1.46 4.03 -1.55 6.66 0.01 -1.26 -4.65 113.70 118.40 2d86 s SER 141 Ca 0.64 -0.27 -0.09 0.00 1.31 0.00 0.00 55.95 57.55 2d86 s SER 141 Cb -0.34 -0.80 0.07 0.00 0.21 0.00 0.00 66.02 65.16 2d86 s SER 141 CO 0.29 0.31 0.57 -0.24 0.41 0.00 0.00 173.24 174.57 2d86 n SER 142 N 1.94 -1.66 0.00 2.44 2.88 -1.26 -5.31 113.62 112.65 2d86 n SER 142 Ca -0.16 -1.02 0.00 0.00 -1.33 0.00 0.00 58.87 56.35 2d86 n SER 142 Cb 0.52 -2.85 0.00 0.00 -0.75 0.00 0.00 64.21 61.13 2d86 n SER 142 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42