#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 7.27 0.00 1.61 0.01 -1.26 -4.90 113.70 116.43 2d86 s SER 2 Ca 0.00 2.04 0.00 0.00 1.31 0.00 0.00 55.95 59.30 2d86 s SER 2 Cb 0.00 -2.60 0.00 0.00 0.21 0.00 0.00 66.02 63.63 2d86 s SER 2 CO 0.00 -0.23 0.00 -0.24 0.41 0.00 0.00 173.24 173.18 2d86 n SER 3 N 2.62 0.99 -0.85 2.44 2.88 -1.26 -5.16 113.62 115.28 2d86 n SER 3 Ca 0.03 0.00 0.11 0.00 -1.33 0.00 0.00 58.87 57.68 2d86 n SER 3 Cb 0.47 0.00 -0.04 0.00 -0.75 0.00 0.00 64.21 63.88 2d86 n SER 3 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2d86 n GLY 4 N 2.27 -2.54 3.22 0.46 0.00 -1.26 -5.00 105.19 102.34 2d86 n GLY 4 Ca 0.00 -1.25 -0.18 0.00 0.00 0.00 0.00 46.02 44.58 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 -6.22 1.92 -0.46 1.61 1.04 -1.26 -5.12 113.70 105.21 2d86 s SER 5 Ca 0.00 -0.74 -0.11 0.00 0.48 0.00 0.00 55.95 55.58 2d86 s SER 5 Cb 0.00 -0.07 0.10 0.00 0.10 0.00 0.00 66.02 66.15 2d86 s SER 5 CO 0.00 -0.11 0.35 -0.55 0.98 0.00 0.00 173.24 173.91 2d86 s SER 6 N -2.19 5.84 0.00 7.02 0.15 -1.26 -4.96 113.70 118.31 2d86 s SER 6 Ca 0.05 -1.64 0.00 0.00 0.70 0.00 0.00 55.95 55.06 2d86 s SER 6 Cb -0.07 -2.07 0.00 0.00 -1.71 0.00 0.00 66.02 62.17 2d86 s SER 6 CO 0.03 -0.66 0.00 0.61 1.20 0.00 0.00 173.24 174.42 2d86 n GLY 7 N 5.02 3.86 3.13 9.45 0.00 -1.26 -5.05 105.19 120.34 2d86 n GLY 7 Ca -0.10 -1.47 -0.54 0.00 0.00 0.00 0.00 46.02 43.90 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 -0.88 0.00 -1.61 1.61 0.00 -1.26 -4.81 117.12 110.17 2d86 n MET 8 Ca 0.00 0.00 -0.38 0.00 -0.00 0.00 0.00 57.70 57.32 2d86 n MET 8 Cb 0.00 -1.31 0.05 0.00 0.00 0.00 0.00 33.22 31.96 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 2.05 0.95 0.25 2.12 -0.58 -1.26 -4.88 120.64 119.29 2d86 n GLU 9 Ca 0.21 0.36 0.16 0.00 -0.42 0.00 0.00 57.16 57.48 2d86 n GLU 9 Cb 0.03 -2.16 0.66 0.00 -0.57 0.00 0.00 31.44 29.40 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 0.60 0.00 0.06 3.49 0.13 -2.01 -3.18 132.00 131.08 2d86 h PRO 10 Ca -0.48 0.00 -0.34 0.00 -0.87 0.00 0.00 66.00 64.31 2d86 h PRO 10 Cb 1.36 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.45 2d86 h PRO 10 CO 0.51 0.00 -1.93 -2.67 -0.23 0.00 0.00 178.00 173.69 2d86 n TRP 11 N -2.91 0.86 -0.33 1.56 4.27 -1.26 -3.32 117.44 116.31 2d86 n TRP 11 Ca 0.01 0.25 0.22 0.00 -3.89 0.00 0.00 57.50 54.08 2d86 n TRP 11 Cb 0.28 -1.10 0.42 0.00 -1.36 0.00 0.00 31.31 29.55 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 -0.37 0.07 0.22 -2.67 1.79 -1.93 0.32 116.57 114.01 2d86 h LYS 12 Ca -0.46 -0.00 -0.32 0.00 -2.18 0.00 0.00 60.65 57.69 2d86 h LYS 12 Cb 1.76 -0.01 0.03 0.00 -1.58 0.00 0.00 32.23 32.42 2d86 h LYS 12 CO -0.08 0.04 -1.46 -0.56 -1.08 0.00 0.00 179.45 176.31 2d86 h GLN 13 N 0.07 0.47 -1.00 3.15 3.07 -1.74 -3.32 115.11 115.80 2d86 h GLN 13 Ca 0.70 -0.80 0.20 0.00 0.09 0.00 0.00 58.65 58.84 2d86 h GLN 13 Cb 1.63 0.30 -0.11 0.00 0.08 0.00 0.00 27.48 29.38 2d86 h GLN 13 CO -0.80 1.38 0.61 0.00 0.09 0.00 0.00 178.83 180.12 2d86 h ALA 15 N 1.65 1.49 0.75 0.00 0.00 -1.06 -1.94 119.26 120.15 2d86 h ALA 15 Ca 0.58 0.16 -0.04 0.00 0.00 0.00 0.00 54.91 55.61 2d86 h ALA 15 Cb 0.96 0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.89 2d86 h ALA 15 CO -0.37 -0.34 -0.41 1.96 0.00 0.00 0.00 179.25 180.09 2d86 h GLN 16 N 0.42 -1.03 -0.89 0.00 1.08 -1.19 -2.57 115.11 110.92 2d86 h GLN 16 Ca 0.58 0.07 0.19 0.00 -1.45 0.00 0.00 58.65 58.03 2d86 h GLN 16 Cb 1.10 0.23 -0.17 0.00 -0.05 0.00 0.00 27.48 28.60 2d86 h GLN 16 CO -0.53 -0.69 -0.19 2.35 -0.95 0.00 0.00 178.83 178.83 2d86 h TRP 17 N -1.07 -0.41 -0.15 2.96 7.01 -1.41 0.13 115.95 123.01 2d86 h TRP 17 Ca -0.10 0.08 0.05 0.00 2.11 0.00 0.00 58.89 61.03 2d86 h TRP 17 Cb 0.84 0.32 -0.06 0.00 -2.10 0.00 0.00 29.16 28.16 2d86 h TRP 17 CO -0.01 -0.38 -0.29 -0.07 -2.79 0.00 0.00 178.44 174.90 2d86 h LEU 18 N 0.01 -0.90 -0.76 0.65 3.38 -1.27 0.80 115.31 117.21 2d86 h LEU 18 Ca 0.44 0.14 0.12 0.00 0.09 0.00 0.00 57.88 58.67 2d86 h LEU 18 Cb 0.70 0.39 -0.08 0.00 0.09 0.00 0.00 40.66 41.76 2d86 h LEU 18 CO -0.90 -0.33 0.36 0.40 0.09 0.00 0.00 178.44 178.06 2d86 h ILE 19 N -0.35 0.77 0.00 1.22 2.04 -0.38 0.20 117.51 121.00 2d86 h ILE 19 Ca 0.10 -0.20 -0.11 0.00 1.00 0.00 0.00 64.86 65.65 2d86 h ILE 19 Cb 0.51 0.15 -0.02 0.00 -0.74 0.00 0.00 36.82 36.72 2d86 h ILE 19 CO -0.35 0.10 -0.55 0.45 0.00 0.00 0.00 178.15 177.81 2d86 h HIS 20 N 0.57 0.00 0.00 1.37 3.86 -0.23 -2.78 115.15 117.94 2d86 h HIS 20 Ca 0.39 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.60 2d86 h HIS 20 Cb 0.50 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.97 2d86 h HIS 20 CO -0.12 0.55 0.00 0.00 0.86 0.00 0.00 177.93 179.22 2d86 n LYS 22 N -0.90 -4.90 0.00 0.00 4.76 -1.05 -4.72 118.16 111.36 2d86 n LYS 22 Ca 0.12 0.58 0.00 0.00 -2.87 0.00 0.00 58.31 56.14 2d86 n LYS 22 Cb 0.06 -4.83 0.00 0.00 -1.84 0.00 0.00 35.03 28.42 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 -3.52 0.00 -4.16 -0.18 0.24 -1.05 -4.91 118.33 104.75 2d86 n VAL 23 Ca -0.13 0.00 -0.16 0.00 -2.04 0.00 0.00 64.34 62.01 2d86 n VAL 23 Cb 0.59 -0.68 -0.12 0.00 -1.47 0.00 0.00 33.84 32.17 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 -3.21 2.31 0.95 1.34 1.43 -1.24 -4.98 118.68 115.29 2d86 s LEU 24 Ca 0.00 -0.66 -0.12 0.00 -1.03 0.00 0.00 54.13 52.32 2d86 s LEU 24 Cb 0.00 -0.40 0.16 0.00 0.03 0.00 0.00 46.19 45.98 2d86 s LEU 24 CO 0.00 -0.15 1.09 -2.16 0.23 0.00 0.00 176.35 175.36 2d86 s PRO 25 N -2.02 0.78 0.22 1.29 0.04 -1.26 -4.30 135.00 129.76 2d86 s PRO 25 Ca -0.01 0.66 0.09 0.00 0.04 0.00 0.00 61.00 61.77 2d86 s PRO 25 Cb -0.08 -1.77 0.17 0.00 0.04 0.00 0.00 34.50 32.86 2d86 s PRO 25 CO 0.01 -2.52 1.50 1.79 0.04 0.00 0.00 177.00 177.82 2d86 h THR 26 N -1.75 1.52 -0.54 1.26 1.35 -2.02 -3.13 112.91 109.60 2d86 h THR 26 Ca -0.52 -2.51 -0.18 0.00 -0.55 0.00 0.00 66.41 62.65 2d86 h THR 26 Cb 1.31 2.36 -0.11 0.00 -1.73 0.00 0.00 68.15 69.98 2d86 h THR 26 CO 0.56 0.72 0.15 0.59 -0.25 0.00 0.00 175.52 177.29 2d86 n ASN 27 N -3.67 3.94 -3.32 5.36 4.13 -1.26 -4.96 115.26 115.47 2d86 n ASN 27 Ca -0.01 -3.34 -0.12 0.00 1.68 0.00 0.00 54.58 52.79 2d86 n ASN 27 Cb 0.72 -0.68 0.12 0.00 -1.54 0.00 0.00 39.78 38.40 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 -0.57 -2.26 0.03 3.10 -0.00 -1.19 -4.93 115.22 109.41 2d86 n HIS 28 Ca 0.36 -0.12 -0.21 0.00 0.46 0.00 0.00 57.72 58.21 2d86 n HIS 28 Cb 1.20 -0.94 -0.14 0.00 -0.12 0.00 0.00 29.99 29.99 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 0.30 -0.01 1.57 0.11 -1.95 -3.33 114.38 111.06 2d86 h ARG 29 Ca -0.16 -0.51 0.00 0.00 0.10 0.00 0.00 59.98 59.41 2d86 h ARG 29 Cb 0.54 0.19 -0.00 0.00 1.11 0.00 0.00 29.97 31.81 2d86 h ARG 29 CO 0.10 1.21 0.15 -0.39 0.10 0.00 0.00 179.97 181.14 2d86 h VAL 30 N 0.08 0.04 -0.00 0.08 -1.51 -1.93 0.80 116.25 113.81 2d86 h VAL 30 Ca -0.38 0.00 -0.16 0.00 -1.23 0.00 0.00 66.70 64.93 2d86 h VAL 30 Cb 2.06 0.86 -0.02 0.00 -2.13 0.00 0.00 31.29 32.05 2d86 h VAL 30 CO 0.13 0.00 -0.75 0.71 -1.23 0.00 0.00 177.57 176.42 2d86 h THR 31 N 0.00 1.53 -4.00 7.19 1.35 -1.92 -3.46 112.91 113.60 2d86 h THR 31 Ca 0.01 -2.56 -0.55 0.00 -0.55 0.00 0.00 66.41 62.76 2d86 h THR 31 Cb 0.30 2.38 0.13 0.00 -1.73 0.00 0.00 68.15 69.23 2d86 h THR 31 CO -0.00 0.73 0.70 0.79 -0.25 0.00 0.00 175.52 177.49 2d86 n TRP 32 N -3.65 2.67 -0.03 4.73 7.02 0.27 -4.90 117.44 123.56 2d86 n TRP 32 Ca -0.01 0.43 0.01 0.00 -1.02 0.00 0.00 57.50 56.91 2d86 n TRP 32 Cb 0.73 -2.45 0.31 0.00 -2.42 0.00 0.00 31.31 27.48 2d86 n TRP 32 CO 0.00 0.00 0.00 0.22 -2.02 0.00 0.00 177.69 175.89 2d86 h ASP 33 N 2.15 0.54 -0.16 -0.99 3.58 -1.87 -2.14 116.42 117.51 2d86 h ASP 33 Ca -0.51 -0.07 -0.03 0.00 0.42 0.00 0.00 57.03 56.84 2d86 h ASP 33 Cb 1.27 -0.14 -0.01 0.00 1.72 0.00 0.00 39.33 42.17 2d86 h ASP 33 CO 0.60 0.53 0.02 -1.28 -2.88 0.00 0.00 179.24 176.24 2d86 h SER 34 N 0.58 0.34 -3.01 2.28 0.87 -1.91 -3.44 113.55 109.25 2d86 h SER 34 Ca 0.13 -0.05 -0.50 0.00 -1.23 0.00 0.00 61.79 60.15 2d86 h SER 34 Cb 0.20 -0.09 0.22 0.00 -0.44 0.00 0.00 62.40 62.30 2d86 h SER 34 CO -0.01 0.38 -0.75 0.00 -0.53 0.00 0.00 176.83 175.93 2d86 n ALA 35 N -2.49 -3.17 -2.70 6.23 0.00 -0.81 -5.04 120.51 112.53 2d86 n ALA 35 Ca 0.01 -0.86 -0.09 0.00 0.00 0.00 0.00 53.44 52.49 2d86 n ALA 35 Cb 0.19 -1.70 -0.06 0.00 0.00 0.00 0.00 19.45 17.88 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 -3.58 0.96 0.28 0.00 -0.21 -1.26 -5.00 119.66 110.86 2d86 s GLN 36 Ca 0.57 -0.93 0.18 0.00 0.02 0.00 0.00 55.36 55.20 2d86 s GLN 36 Cb -0.18 0.38 0.99 0.00 1.00 0.00 0.00 33.01 35.21 2d86 s GLN 36 CO 0.67 -0.34 1.10 1.33 -2.12 0.00 0.00 175.29 175.93 2d86 n VAL 37 N -0.13 -0.24 0.38 1.09 0.24 -1.26 0.11 118.33 118.52 2d86 n VAL 37 Ca -0.14 1.35 -0.18 0.00 -2.04 0.00 0.00 64.34 63.33 2d86 n VAL 37 Cb 0.63 -2.20 -0.09 0.00 -1.47 0.00 0.00 33.84 30.71 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 -0.88 -0.96 6.34 3.04 -1.96 0.57 116.94 123.10 2d86 h PHE 38 Ca 0.61 -0.02 0.11 0.00 3.98 0.00 0.00 57.97 62.65 2d86 h PHE 38 Cb 1.77 0.29 -0.13 0.00 2.56 0.00 0.00 35.95 40.44 2d86 h PHE 38 CO -0.01 -0.54 -0.51 -0.44 -2.02 0.00 0.00 178.31 174.79 2d86 h ASP 39 N -0.99 -1.88 0.49 0.41 5.19 0.32 1.30 116.42 121.27 2d86 h ASP 39 Ca -0.10 0.32 -0.05 0.00 -0.62 0.00 0.00 57.03 56.58 2d86 h ASP 39 Cb 0.74 0.87 -0.01 0.00 0.18 0.00 0.00 39.33 41.11 2d86 h ASP 39 CO 0.16 -0.26 -0.22 0.25 -3.12 0.00 0.00 179.24 176.05 2d86 h LEU 40 N -0.03 0.00 -0.35 1.55 5.85 -1.49 -2.15 115.31 118.69 2d86 h LEU 40 Ca 0.22 0.00 -0.06 0.00 0.84 0.00 0.00 57.88 58.88 2d86 h LEU 40 Cb 0.49 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.51 2d86 h LEU 40 CO -0.93 0.22 -0.27 0.00 -0.34 0.00 0.00 178.44 177.11 2d86 h ALA 41 N 1.78 0.86 0.08 1.25 0.00 0.36 -3.30 119.26 120.29 2d86 h ALA 41 Ca -0.00 -0.25 -0.00 0.00 0.00 0.00 0.00 54.91 54.66 2d86 h ALA 41 Cb 0.52 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.27 2d86 h ALA 41 CO 0.03 0.34 -0.04 1.96 0.00 0.00 0.00 179.25 181.54 2d86 h GLN 42 N 0.00 -0.10 -0.53 0.00 4.20 0.14 0.14 115.11 118.96 2d86 h GLN 42 Ca -0.00 0.01 0.15 0.00 0.06 0.00 0.00 58.65 58.87 2d86 h GLN 42 Cb 1.08 0.02 -0.02 0.00 0.30 0.00 0.00 27.48 28.86 2d86 h GLN 42 CO 0.04 0.27 0.79 0.00 -0.67 0.00 0.00 178.83 179.25 2d86 h THR 43 N -0.98 0.13 0.00 -0.54 1.03 -1.62 0.34 112.91 111.28 2d86 h THR 43 Ca -0.01 0.00 -0.34 0.00 -0.01 0.00 0.00 66.41 66.05 2d86 h THR 43 Cb 0.42 0.33 -0.06 0.00 -1.07 0.00 0.00 68.15 67.76 2d86 h THR 43 CO 0.02 0.00 -2.27 0.18 -0.01 0.00 0.00 175.52 173.44 2d86 n LEU 44 N -3.26 0.96 -0.30 0.00 4.77 -1.23 -4.48 117.00 113.47 2d86 n LEU 44 Ca 0.11 -0.04 0.23 0.00 -0.03 0.00 0.00 56.01 56.28 2d86 n LEU 44 Cb 0.97 0.04 0.43 0.00 -2.33 0.00 0.00 43.42 42.53 2d86 n LEU 44 CO 0.20 0.59 0.86 -1.14 -1.33 0.00 0.00 177.39 176.57 2d86 n ARG 45 N -2.84 -0.06 -0.19 3.23 0.63 0.12 0.18 116.66 117.73 2d86 n ARG 45 Ca -0.33 1.27 -0.03 0.00 -0.92 0.00 0.00 57.85 57.84 2d86 n ARG 45 Cb 1.04 -2.19 0.07 0.00 0.45 0.00 0.00 32.46 31.83 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 0.44 -0.04 6.15 2.03 -1.77 -3.40 116.42 119.83 2d86 h ASP 46 Ca 0.68 0.03 0.00 0.00 -0.73 0.00 0.00 57.03 57.01 2d86 h ASP 46 Cb 1.68 -0.05 0.00 0.00 -0.83 0.00 0.00 39.33 40.12 2d86 h ASP 46 CO -0.75 0.29 0.00 0.61 -1.03 0.00 0.00 179.24 178.37 2d86 n GLY 47 N -1.26 1.46 0.07 7.15 0.00 0.47 -4.24 105.19 108.84 2d86 n GLY 47 Ca 0.06 -0.24 -0.09 0.00 0.00 0.00 0.00 46.02 45.74 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 -1.70 0.90 -0.03 1.61 0.31 -1.26 -4.37 118.33 113.80 2d86 n VAL 48 Ca 0.00 -0.43 -0.16 0.00 -0.01 0.00 0.00 64.34 63.74 2d86 n VAL 48 Cb 0.14 -0.91 -0.13 0.00 -0.91 0.00 0.00 33.84 32.03 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 0.18 -0.89 7.52 5.85 -1.87 -3.33 115.31 122.76 2d86 h LEU 49 Ca -0.35 -0.93 0.09 0.00 0.84 0.00 0.00 57.88 57.53 2d86 h LEU 49 Cb 1.65 -0.06 -0.12 0.00 0.37 0.00 0.00 40.66 42.51 2d86 h LEU 49 CO -0.03 1.09 -0.48 0.18 -0.34 0.00 0.00 178.44 178.87 2d86 n LEU 50 N -4.46 -0.85 -0.30 2.25 4.77 -1.26 0.12 117.00 117.27 2d86 n LEU 50 Ca -0.11 1.57 0.11 0.00 -0.03 0.00 0.00 56.01 57.55 2d86 n LEU 50 Cb 0.58 -0.24 0.28 0.00 -2.33 0.00 0.00 43.42 41.70 2d86 n LEU 50 CO 0.39 -1.31 1.06 0.00 -1.33 0.00 0.00 177.39 176.20 2d86 h GLN 52 N 0.48 -0.22 -0.27 0.00 4.20 0.86 -2.78 115.11 117.38 2d86 h GLN 52 Ca 0.52 0.01 0.02 0.00 0.06 0.00 0.00 58.65 59.27 2d86 h GLN 52 Cb 0.92 0.05 -0.03 0.00 0.30 0.00 0.00 27.48 28.71 2d86 h GLN 52 CO -0.47 -0.15 -0.16 -0.11 -0.67 0.00 0.00 178.83 177.28 2d86 n LEU 53 N -5.27 -0.29 -0.32 1.46 7.94 -0.40 0.13 117.00 120.25 2d86 n LEU 53 Ca -0.05 0.93 0.07 0.00 -1.11 0.00 0.00 56.01 55.85 2d86 n LEU 53 Cb 0.19 -0.29 0.23 0.00 0.53 0.00 0.00 43.42 44.08 2d86 n LEU 53 CO 0.27 -0.62 1.15 -0.07 -1.11 0.00 0.00 177.39 177.02 2d86 h LEU 54 N 0.00 0.69 -2.02 -1.96 3.38 -1.59 0.24 115.31 114.05 2d86 h LEU 54 Ca 0.04 0.07 -0.01 0.00 0.09 0.00 0.00 57.88 58.07 2d86 h LEU 54 Cb 0.11 -0.05 -0.00 0.00 0.09 0.00 0.00 40.66 40.81 2d86 h LEU 54 CO -0.25 0.32 -0.07 0.78 0.09 0.00 0.00 178.44 179.31 2d86 h ASN 55 N 0.76 0.00 0.02 -0.43 2.35 0.14 0.91 115.58 119.34 2d86 h ASN 55 Ca 0.48 0.00 -0.19 0.00 -0.55 0.00 0.00 56.30 56.04 2d86 h ASN 55 Cb 0.61 0.00 0.02 0.00 0.05 0.00 0.00 38.32 38.99 2d86 h ASN 55 CO -0.32 0.07 -0.75 0.78 -1.65 0.00 0.00 177.43 175.56 2d86 h ASN 56 N 0.00 0.62 0.24 5.81 2.35 0.31 -3.36 115.58 121.54 2d86 h ASN 56 Ca -0.00 -0.78 -0.01 0.00 -0.55 0.00 0.00 56.30 54.96 2d86 h ASN 56 Cb 0.14 -0.19 0.00 0.00 0.05 0.00 0.00 38.32 38.32 2d86 h ASN 56 CO 0.01 1.33 -0.11 -0.07 -1.65 0.00 0.00 177.43 176.93 2d86 h LEU 57 N -0.01 -0.27 -9.28 1.61 3.38 -0.89 -3.46 115.31 106.40 2d86 h LEU 57 Ca -0.10 -0.26 -0.61 0.00 0.09 0.00 0.00 57.88 57.00 2d86 h LEU 57 Cb 1.46 0.07 -0.14 0.00 0.09 0.00 0.00 40.66 42.14 2d86 h LEU 57 CO 0.15 0.21 -0.74 -0.60 0.09 0.00 0.00 178.44 177.55 2d86 s ARG 58 N -3.85 1.89 0.16 1.13 3.52 0.27 -4.91 118.95 117.17 2d86 s ARG 58 Ca -0.13 -1.48 -0.12 0.00 -0.13 0.00 0.00 55.73 53.87 2d86 s ARG 58 Cb 0.01 -1.99 -0.07 0.00 -1.56 0.00 0.00 34.95 31.34 2d86 s ARG 58 CO 0.48 0.39 0.51 0.00 -0.81 0.00 0.00 175.30 175.87 2d86 s ALA 59 N -2.03 3.61 -1.61 6.12 0.00 -1.26 -4.03 121.76 122.56 2d86 s ALA 59 Ca 0.27 -0.24 0.00 0.00 0.00 0.00 0.00 51.96 51.98 2d86 s ALA 59 Cb -0.07 -2.43 0.00 0.00 0.00 0.00 0.00 23.12 20.62 2d86 s ALA 59 CO 0.15 0.50 0.00 0.72 0.00 0.00 0.00 175.76 177.13 2d86 n HIS 60 N 0.51 -0.82 0.00 0.00 8.25 -1.26 -4.90 115.22 117.00 2d86 n HIS 60 Ca -0.04 0.00 -0.17 0.00 -0.26 0.00 0.00 57.72 57.25 2d86 n HIS 60 Cb 0.52 -3.61 -0.11 0.00 1.12 0.00 0.00 29.99 27.91 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 0.56 -2.79 0.41 0.02 -1.86 -3.45 113.55 106.44 2d86 h SER 61 Ca -0.44 -0.75 -0.17 0.00 -0.84 0.00 0.00 61.79 59.60 2d86 h SER 61 Cb 1.32 -0.17 -0.30 0.00 0.14 0.00 0.00 62.40 63.38 2d86 h SER 61 CO 0.52 1.23 -0.46 -0.63 -1.14 0.00 0.00 176.83 176.36 2d86 s ILE 62 N -3.27 -0.45 -0.39 3.27 1.01 -1.26 -4.79 121.20 115.32 2d86 s ILE 62 Ca -0.13 0.22 -0.29 0.00 0.00 0.00 0.00 60.65 60.46 2d86 s ILE 62 Cb 0.04 -0.53 0.00 0.00 0.01 0.00 0.00 42.46 41.98 2d86 s ILE 62 CO 0.83 0.09 1.53 0.21 0.00 0.00 0.00 174.94 177.60 2d86 s ASN 63 N 2.35 6.19 0.38 3.58 2.47 -1.26 -4.87 114.94 123.78 2d86 s ASN 63 Ca -0.01 0.95 0.18 0.00 0.42 0.00 0.00 52.86 54.40 2d86 s ASN 63 Cb -0.12 -2.54 1.10 0.00 -1.45 0.00 0.00 41.25 38.25 2d86 s ASN 63 CO -0.10 -1.53 1.73 -0.07 -3.72 0.00 0.00 177.10 173.41 2d86 h LEU 64 N 12.70 0.47 -1.43 3.21 3.38 -1.99 0.82 115.31 132.47 2d86 h LEU 64 Ca -0.29 0.11 -0.04 0.00 0.09 0.00 0.00 57.88 57.74 2d86 h LEU 64 Cb 1.12 0.04 -0.01 0.00 0.09 0.00 0.00 40.66 41.91 2d86 h LEU 64 CO 1.07 0.03 -0.09 0.11 0.09 0.00 0.00 178.44 179.65 2d86 h LYS 65 N 0.38 0.26 0.00 1.13 1.79 -2.03 -1.81 116.57 116.29 2d86 h LYS 65 Ca 0.65 -0.05 -0.05 0.00 -2.18 0.00 0.00 60.65 59.02 2d86 h LYS 65 Cb 1.61 -0.04 -0.01 0.00 -1.58 0.00 0.00 32.23 32.21 2d86 h LYS 65 CO -0.38 0.36 -0.22 0.93 -1.08 0.00 0.00 179.45 179.07 2d86 h GLU 66 N 0.25 0.00 -5.80 3.15 4.39 0.29 -3.43 114.58 113.43 2d86 h GLU 66 Ca 0.05 0.00 -0.67 0.00 0.34 0.00 0.00 59.36 59.08 2d86 h GLU 66 Cb 0.33 0.00 -0.10 0.00 -0.10 0.00 0.00 28.75 28.88 2d86 h GLU 66 CO 0.02 0.22 -0.54 0.96 -1.16 0.00 0.00 179.01 178.51 2d86 s ILE 67 N -3.91 5.01 -0.63 3.13 -4.36 -0.68 -5.02 121.20 114.73 2d86 s ILE 67 Ca -0.01 -0.02 -0.27 0.00 -0.26 0.00 0.00 60.65 60.08 2d86 s ILE 67 Cb 0.12 -3.17 0.02 0.00 1.25 0.00 0.00 42.46 40.67 2d86 s ILE 67 CO 0.63 0.58 1.37 0.20 0.24 0.00 0.00 174.94 177.96 2d86 s ASN 68 N -1.07 6.12 0.28 4.36 0.01 -1.26 -4.90 114.94 118.47 2d86 s ASN 68 Ca 0.16 0.01 -0.29 0.00 -0.71 0.00 0.00 52.86 52.02 2d86 s ASN 68 Cb -0.12 -2.55 -0.09 0.00 0.41 0.00 0.00 41.25 38.90 2d86 s ASN 68 CO 0.05 -1.77 0.98 -0.76 -1.51 0.00 0.00 177.10 174.09 2d86 s LEU 69 N 6.02 4.53 -0.66 0.60 1.43 -1.26 -4.01 118.68 125.33 2d86 s LEU 69 Ca 0.46 2.00 -0.02 0.00 -1.03 0.00 0.00 54.13 55.55 2d86 s LEU 69 Cb -0.09 -3.74 -0.02 0.00 0.03 0.00 0.00 46.19 42.37 2d86 s LEU 69 CO 0.21 0.00 0.56 -1.14 0.23 0.00 0.00 176.35 176.21 2d86 n ARG 70 N 1.13 -2.69 0.00 1.70 0.63 -1.26 -4.90 116.66 111.27 2d86 n ARG 70 Ca -0.01 0.50 0.07 0.00 -0.92 0.00 0.00 57.85 57.50 2d86 n ARG 70 Cb 0.47 -4.25 0.40 0.00 0.45 0.00 0.00 32.46 29.53 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 -2.67 0.30 -4.39 -0.14 -0.04 -1.26 -4.85 135.00 121.95 2d86 n PRO 71 Ca -0.11 0.10 -0.40 0.00 -0.04 0.00 0.00 63.50 63.04 2d86 n PRO 71 Cb 0.59 -1.50 -0.08 0.00 -0.04 0.00 0.00 33.50 32.47 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 -1.19 -0.73 -2.99 0.54 6.02 -1.26 0.53 117.38 118.29 2d86 n GLN 72 Ca 0.09 0.13 -0.12 0.00 -0.01 0.00 0.00 57.00 57.08 2d86 n GLN 72 Cb 0.10 -4.45 0.06 0.00 1.02 0.00 0.00 30.24 26.97 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 -3.90 -4.06 -3.29 -1.09 2.81 -1.26 -4.97 117.12 101.36 2d86 n MET 73 Ca 0.10 0.63 -0.46 0.00 -1.81 0.00 0.00 57.70 56.16 2d86 n MET 73 Cb 0.43 -4.93 -0.04 0.00 -0.71 0.00 0.00 33.22 27.98 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 -3.82 6.37 0.22 7.83 0.01 0.19 -4.93 113.70 119.57 2d86 s SER 74 Ca 0.09 -2.03 0.00 0.00 1.31 0.00 0.00 55.95 55.33 2d86 s SER 74 Cb -0.01 -2.22 0.53 0.00 0.21 0.00 0.00 66.02 64.52 2d86 s SER 74 CO 0.54 -0.80 1.15 1.67 0.41 0.00 0.00 173.24 176.21 2d86 n GLN 75 N 5.00 -0.06 0.27 12.44 7.27 -1.26 0.80 117.38 141.85 2d86 n GLN 75 Ca -0.05 1.11 -0.16 0.00 0.07 0.00 0.00 57.00 57.97 2d86 n GLN 75 Cb 0.42 -1.74 -0.08 0.00 2.41 0.00 0.00 30.24 31.25 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 -0.77 0.74 3.69 3.04 -1.97 -1.35 116.94 120.32 2d86 h PHE 76 Ca 0.43 -0.01 -0.04 0.00 3.98 0.00 0.00 57.97 62.34 2d86 h PHE 76 Cb 0.86 0.28 0.01 0.00 2.56 0.00 0.00 35.95 39.65 2d86 h PHE 76 CO -0.40 -0.45 -0.36 -0.07 -2.02 0.00 0.00 178.31 175.01 2d86 h LEU 77 N -0.73 -0.84 -0.79 0.59 3.38 0.03 -2.58 115.31 114.36 2d86 h LEU 77 Ca -0.05 0.03 0.07 0.00 0.09 0.00 0.00 57.88 58.02 2d86 h LEU 77 Cb 0.60 0.22 -0.10 0.00 0.09 0.00 0.00 40.66 41.47 2d86 h LEU 77 CO 0.05 -0.48 -0.47 0.00 0.09 0.00 0.00 178.44 177.63 2d86 h LEU 79 N -0.00 -0.73 0.54 0.00 3.38 -1.32 -1.06 115.31 116.12 2d86 h LEU 79 Ca 0.13 0.18 -0.02 0.00 0.09 0.00 0.00 57.88 58.26 2d86 h LEU 79 Cb 0.33 0.41 -0.02 0.00 0.09 0.00 0.00 40.66 41.47 2d86 h LEU 79 CO -0.75 -0.24 -0.48 0.50 0.09 0.00 0.00 178.44 177.57 2d86 h LYS 80 N -0.09 -0.97 -0.34 1.13 3.11 -0.37 -2.91 116.57 116.13 2d86 h LYS 80 Ca 0.24 0.07 0.04 0.00 -2.81 0.00 0.00 60.65 58.18 2d86 h LYS 80 Cb 0.46 0.22 -0.05 0.00 -1.00 0.00 0.00 32.23 31.86 2d86 h LYS 80 CO -0.57 -0.64 -0.33 -0.91 -2.81 0.00 0.00 179.45 174.18 2d86 h ASN 81 N -1.00 -1.14 -0.72 4.20 2.35 0.00 -1.11 115.58 118.16 2d86 h ASN 81 Ca -0.07 0.16 0.11 0.00 -0.55 0.00 0.00 56.30 55.94 2d86 h ASN 81 Cb 0.85 0.48 -0.11 0.00 0.05 0.00 0.00 38.32 39.59 2d86 h ASN 81 CO -0.03 -0.20 -0.30 -0.38 -1.65 0.00 0.00 177.43 174.87 2d86 n ILE 82 N -4.26 -0.40 -0.24 2.81 5.41 -0.45 0.19 119.36 122.42 2d86 n ILE 82 Ca -0.01 1.71 0.04 0.00 1.00 0.00 0.00 62.75 65.48 2d86 n ILE 82 Cb 0.18 -2.23 0.16 0.00 -0.71 0.00 0.00 39.64 37.04 2d86 n ILE 82 CO 0.00 0.00 0.00 0.03 0.00 0.00 0.00 176.55 176.58 2d86 h ARG 83 N 0.00 0.41 -0.77 0.38 3.08 -1.01 -0.86 114.38 115.62 2d86 h ARG 83 Ca 0.23 -0.02 0.15 0.00 0.07 0.00 0.00 59.98 60.41 2d86 h ARG 83 Cb 0.41 -0.09 -0.10 0.00 0.08 0.00 0.00 29.97 30.27 2d86 h ARG 83 CO -0.71 0.27 0.29 1.15 -1.07 0.00 0.00 179.97 179.89 2d86 h THR 84 N 0.42 0.61 0.92 2.04 2.02 0.25 -1.48 112.91 117.69 2d86 h THR 84 Ca 0.38 -0.14 -0.05 0.00 0.77 0.00 0.00 66.41 67.38 2d86 h THR 84 Cb 0.56 0.17 0.01 0.00 -1.74 0.00 0.00 68.15 67.14 2d86 h THR 84 CO -0.38 0.07 -0.44 0.15 0.37 0.00 0.00 175.52 175.29 2d86 h PHE 85 N 0.40 -1.15 -1.25 3.16 3.57 -0.83 -2.50 116.94 118.34 2d86 h PHE 85 Ca 0.43 -0.03 0.36 0.00 3.53 0.00 0.00 57.97 62.27 2d86 h PHE 85 Cb 0.70 0.38 -0.05 0.00 2.79 0.00 0.00 35.95 39.77 2d86 h PHE 85 CO -0.18 -0.71 0.91 -0.07 -2.23 0.00 0.00 178.31 176.02 2d86 h LEU 86 N -1.28 0.00 0.52 0.59 3.38 -1.15 -0.30 115.31 117.07 2d86 h LEU 86 Ca -0.13 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.82 2d86 h LEU 86 Cb 0.95 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.70 2d86 h LEU 86 CO 0.21 0.00 -0.25 0.74 0.09 0.00 0.00 178.44 179.23 2d86 h THR 87 N 0.00 0.36 -0.99 0.22 2.02 -0.85 -3.13 112.91 110.55 2d86 h THR 87 Ca 0.59 -0.38 0.16 0.00 0.77 0.00 0.00 66.41 67.54 2d86 h THR 87 Cb 2.40 0.49 -0.09 0.00 -1.74 0.00 0.00 68.15 69.21 2d86 h THR 87 CO -0.01 0.05 0.62 0.00 0.37 0.00 0.00 175.52 176.55 2d86 h ALA 88 N -0.68 1.65 0.00 6.16 0.00 -0.79 0.30 119.26 125.89 2d86 h ALA 88 Ca -0.07 0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.88 2d86 h ALA 88 Cb 0.62 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.27 2d86 h ALA 88 CO 0.12 0.05 0.33 0.00 0.00 0.00 0.00 179.25 179.74 2d86 h GLU 91 N 0.00 0.00 0.32 0.00 4.39 0.57 -3.13 114.58 116.73 2d86 h GLU 91 Ca -0.19 0.00 -0.02 0.00 0.34 0.00 0.00 59.36 59.49 2d86 h GLU 91 Cb 1.43 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 30.08 2d86 h GLU 91 CO 0.01 0.65 -0.15 1.15 -1.16 0.00 0.00 179.01 179.51 2d86 h THR 92 N -1.00 0.62 0.00 1.13 2.02 0.15 -3.41 112.91 112.41 2d86 h THR 92 Ca -0.22 -0.67 0.00 0.00 0.77 0.00 0.00 66.41 66.29 2d86 h THR 92 Cb 1.02 0.92 0.00 0.00 -1.74 0.00 0.00 68.15 68.35 2d86 h THR 92 CO -0.14 0.12 -0.45 0.49 0.37 0.00 0.00 175.52 175.91 2d86 n PHE 93 N -5.12 0.49 0.00 3.16 3.01 -0.50 -5.03 117.46 113.48 2d86 n PHE 93 Ca -0.09 0.21 0.00 0.00 1.01 0.00 0.00 57.45 58.58 2d86 n PHE 93 Cb 0.27 -0.55 0.00 0.00 -0.01 0.00 0.00 39.48 39.19 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 1.61 0.81 3.78 1.37 0.00 -0.16 -4.92 105.19 107.67 2d86 n GLY 94 Ca -0.06 -0.80 -0.22 0.00 0.00 0.00 0.00 46.02 44.93 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 -1.64 2.74 -0.63 1.61 -1.94 0.12 -4.92 119.30 114.63 2d86 s MET 95 Ca 0.00 -1.17 -0.26 0.00 -1.71 0.00 0.00 55.69 52.55 2d86 s MET 95 Cb 0.00 -2.45 -0.11 0.00 2.01 0.00 0.00 34.83 34.28 2d86 s MET 95 CO 0.00 0.38 2.43 0.54 -0.01 0.00 0.00 175.02 178.36 2d86 n ARG 96 N -1.11 0.78 -0.27 2.03 3.00 -1.26 -4.62 116.66 115.21 2d86 n ARG 96 Ca -0.07 -0.24 0.24 0.00 -0.01 0.00 0.00 57.85 57.77 2d86 n ARG 96 Cb 0.58 -3.27 0.44 0.00 0.00 0.00 0.00 32.46 30.22 2d86 n ARG 96 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.63 178.80 2d86 n LYS 97 N 8.79 -0.05 -0.21 5.56 4.81 -1.26 0.16 118.16 135.95 2d86 n LYS 97 Ca 0.43 1.16 0.02 0.00 -0.87 0.00 0.00 58.31 59.05 2d86 n LYS 97 Cb 0.46 -2.04 0.13 0.00 0.02 0.00 0.00 35.03 33.60 2d86 n LYS 97 CO 0.00 0.00 0.00 0.66 1.17 0.00 0.00 177.40 179.23 2d86 h SER 98 N 0.00 0.01 -0.80 3.14 4.64 -2.00 0.84 113.55 119.38 2d86 h SER 98 Ca 0.66 0.12 0.10 0.00 -0.47 0.00 0.00 61.79 62.20 2d86 h SER 98 Cb 1.70 0.16 -0.05 0.00 -0.31 0.00 0.00 62.40 63.90 2d86 h SER 98 CO -0.67 0.00 0.52 1.05 -0.87 0.00 0.00 176.83 176.87 2d86 h GLU 99 N 0.27 0.72 0.00 4.77 4.11 0.11 -3.43 114.58 121.14 2d86 h GLU 99 Ca 0.34 -0.04 -0.26 0.00 0.07 0.00 0.00 59.36 59.47 2d86 h GLU 99 Cb 0.52 -0.16 0.15 0.00 0.50 0.00 0.00 28.75 29.77 2d86 h GLU 99 CO -0.43 0.48 -0.13 1.28 0.07 0.00 0.00 179.01 180.28 2d86 n LEU 100 N -4.51 0.00 -4.83 3.06 4.77 0.29 -4.52 117.00 111.25 2d86 n LEU 100 Ca 0.13 -0.62 -0.27 0.00 -0.03 0.00 0.00 56.01 55.21 2d86 n LEU 100 Cb 0.32 -0.83 -0.04 0.00 -2.33 0.00 0.00 43.42 40.54 2d86 n LEU 100 CO 0.32 -2.58 -0.07 0.72 -1.33 0.00 0.00 177.39 174.45 2d86 s PHE 101 N -2.01 1.91 0.63 -1.77 -0.71 -1.26 -4.97 117.98 109.80 2d86 s PHE 101 Ca 0.48 -0.81 -0.11 0.00 -1.04 0.00 0.00 56.93 55.45 2d86 s PHE 101 Cb -0.08 -1.86 0.15 0.00 -1.21 0.00 0.00 43.02 40.02 2d86 s PHE 101 CO 0.40 -0.16 0.83 0.39 -1.34 0.00 0.00 175.22 175.34 2d86 n GLU 102 N -1.53 -0.95 -0.11 1.99 1.02 -1.26 -5.03 120.64 114.77 2d86 n GLU 102 Ca -0.06 -1.28 -0.13 0.00 -0.02 0.00 0.00 57.16 55.67 2d86 n GLU 102 Cb 0.65 -0.88 -0.15 0.00 -0.02 0.00 0.00 31.44 31.04 2d86 n GLU 102 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2d86 n ALA 103 N -3.60 1.48 0.10 0.62 0.00 -1.26 -4.43 120.51 113.43 2d86 n ALA 103 Ca -0.14 -1.26 -0.18 0.00 0.00 0.00 0.00 53.44 51.86 2d86 n ALA 103 Cb 0.37 -0.15 -0.14 0.00 0.00 0.00 0.00 19.45 19.52 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 0.00 0.60 -0.73 0.00 3.57 -1.97 -3.09 116.94 115.32 2d86 h PHE 104 Ca -0.56 -0.44 0.16 0.00 3.53 0.00 0.00 57.97 60.66 2d86 h PHE 104 Cb 2.14 -0.02 -0.11 0.00 2.79 0.00 0.00 35.95 40.74 2d86 h PHE 104 CO 0.01 1.38 0.15 0.38 -2.23 0.00 0.00 178.31 178.01 2d86 h ASP 105 N 0.09 -0.04 0.17 0.41 3.04 -1.94 0.37 116.42 118.52 2d86 h ASP 105 Ca -0.20 0.15 -0.01 0.00 -3.24 0.00 0.00 57.03 53.74 2d86 h ASP 105 Cb 2.03 0.21 0.00 0.00 -1.04 0.00 0.00 39.33 40.54 2d86 h ASP 105 CO 0.21 -0.06 -0.08 0.25 -2.04 0.00 0.00 179.24 177.52 2d86 h LEU 106 N 0.24 -0.19 -0.03 0.15 5.85 -1.78 0.60 115.31 120.16 2d86 h LEU 106 Ca 0.41 -0.33 0.02 0.00 0.84 0.00 0.00 57.88 58.82 2d86 h LEU 106 Cb 0.71 0.05 -0.05 0.00 0.37 0.00 0.00 40.66 41.73 2d86 h LEU 106 CO -0.53 0.37 -0.49 0.15 -0.34 0.00 0.00 178.44 177.60 2d86 h PHE 107 N -0.89 -1.46 0.00 1.25 3.57 -1.36 0.20 116.94 118.25 2d86 h PHE 107 Ca -0.02 0.05 0.00 0.00 3.53 0.00 0.00 57.97 61.53 2d86 h PHE 107 Cb 0.51 0.64 0.00 0.00 2.79 0.00 0.00 35.95 39.89 2d86 h PHE 107 CO 0.08 -0.52 0.00 -3.47 -2.23 0.00 0.00 178.31 172.17 2d86 n ASP 108 N -5.20 0.00 -4.41 0.41 2.03 0.13 -4.87 116.55 104.65 2d86 n ASP 108 Ca -0.06 -1.81 -0.37 0.00 0.52 0.00 0.00 54.79 53.07 2d86 n ASP 108 Cb 0.36 0.00 -0.08 0.00 -0.72 0.00 0.00 41.12 40.68 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 -0.54 -0.62 0.20 5.18 0.31 0.71 -4.85 118.33 118.71 2d86 n VAL 109 Ca 0.02 -0.23 -0.09 0.00 -0.01 0.00 0.00 64.34 64.03 2d86 n VAL 109 Cb 0.01 -0.88 -0.04 0.00 -0.91 0.00 0.00 33.84 32.01 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 -1.34 -0.54 -3.48 5.55 3.08 -0.06 -3.42 114.38 114.17 2d86 h ARG 110 Ca -0.63 0.04 -0.61 0.00 0.07 0.00 0.00 59.98 58.85 2d86 h ARG 110 Cb 1.39 0.12 -0.40 0.00 0.08 0.00 0.00 29.97 31.16 2d86 h ARG 110 CO 0.80 -0.36 -0.73 -0.51 -1.07 0.00 0.00 179.97 178.10 2d86 s ASP 111 N -4.28 4.01 0.18 7.04 1.01 -1.24 -4.97 116.67 118.42 2d86 s ASP 111 Ca -0.08 -2.23 -0.05 0.00 0.71 0.00 0.00 52.55 50.89 2d86 s ASP 111 Cb 0.01 -1.11 0.07 0.00 1.01 0.00 0.00 42.92 42.90 2d86 s ASP 111 CO 0.24 -0.34 1.50 0.15 0.21 0.00 0.00 175.17 176.94 2d86 h PHE 112 N 7.33 0.84 -1.10 4.23 3.57 -1.83 -3.14 116.94 126.84 2d86 h PHE 112 Ca -0.06 -0.28 0.32 0.00 3.53 0.00 0.00 57.97 61.48 2d86 h PHE 112 Cb 0.97 -0.17 -0.12 0.00 2.79 0.00 0.00 35.95 39.43 2d86 h PHE 112 CO 0.44 1.03 0.69 0.78 -2.23 0.00 0.00 178.31 179.02 2d86 h GLY 113 N 0.95 1.46 1.35 2.40 0.00 -1.99 0.58 103.07 107.83 2d86 h GLY 113 Ca 0.03 -0.20 -0.08 0.00 0.00 0.00 0.00 47.33 47.07 2d86 h GLY 113 CO 0.10 -0.28 -0.07 0.50 0.00 0.00 0.00 176.54 176.79 2d86 h LYS 114 N 0.32 0.78 -0.34 4.80 1.57 -1.98 -2.39 116.57 119.32 2d86 h LYS 114 Ca 0.68 -0.24 -0.13 0.00 -1.87 0.00 0.00 60.65 59.09 2d86 h LYS 114 Cb 1.78 -0.08 -0.01 0.00 0.08 0.00 0.00 32.23 34.01 2d86 h LYS 114 CO -0.40 0.83 -0.30 0.28 -0.57 0.00 0.00 179.45 179.28 2d86 h VAL 115 N 0.71 1.29 0.29 0.50 2.07 -0.01 -3.11 116.25 117.99 2d86 h VAL 115 Ca 0.13 -1.47 -0.01 0.00 0.82 0.00 0.00 66.70 66.16 2d86 h VAL 115 Cb 0.53 1.46 0.00 0.00 -1.52 0.00 0.00 31.29 31.76 2d86 h VAL 115 CO 0.03 0.48 -0.15 0.40 0.02 0.00 0.00 177.57 178.36 2d86 h ILE 116 N 0.59 0.70 -0.39 4.57 2.04 -1.12 -3.13 117.51 120.78 2d86 h ILE 116 Ca 0.06 0.00 0.05 0.00 1.00 0.00 0.00 64.86 65.97 2d86 h ILE 116 Cb 0.88 0.70 -0.08 0.00 -0.74 0.00 0.00 36.82 37.58 2d86 h ILE 116 CO 0.08 0.00 -0.52 -0.08 0.00 0.00 0.00 178.15 177.63 2d86 h GLU 117 N -0.40 -0.38 -0.71 2.37 4.22 -1.48 -0.97 114.58 117.23 2d86 h GLU 117 Ca -0.04 0.03 0.14 0.00 0.08 0.00 0.00 59.36 59.57 2d86 h GLU 117 Cb 0.31 0.09 -0.13 0.00 0.50 0.00 0.00 28.75 29.51 2d86 h GLU 117 CO 0.06 -0.25 -0.18 2.41 -2.18 0.00 0.00 179.01 178.87 2d86 n THR 118 N -5.40 -0.30 -0.05 0.32 -1.04 -1.18 0.16 114.28 106.79 2d86 n THR 118 Ca -0.03 1.64 -0.10 0.00 -2.04 0.00 0.00 64.05 63.52 2d86 n THR 118 Cb 0.35 -2.26 -0.04 0.00 -1.82 0.00 0.00 70.33 66.56 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 0.25 -0.94 -4.42 3.38 -1.22 -1.72 115.31 110.63 2d86 h LEU 119 Ca 0.34 -0.09 0.27 0.00 0.09 0.00 0.00 57.88 58.49 2d86 h LEU 119 Cb 0.52 -0.06 -0.17 0.00 0.09 0.00 0.00 40.66 41.04 2d86 h LEU 119 CO -0.73 0.26 0.13 -1.28 0.09 0.00 0.00 178.44 176.91 2d86 h SER 120 N 0.21 -0.27 -0.03 -0.43 0.87 0.19 0.21 113.55 114.29 2d86 h SER 120 Ca 0.07 0.25 -0.14 0.00 -1.23 0.00 0.00 61.79 60.74 2d86 h SER 120 Cb 0.07 0.40 0.01 0.00 -0.44 0.00 0.00 62.40 62.44 2d86 h SER 120 CO -0.01 -0.30 -0.53 0.03 -0.53 0.00 0.00 176.83 175.49 2d86 h ARG 121 N 0.06 0.41 -0.89 2.24 3.08 -1.21 -3.30 114.38 114.78 2d86 h ARG 121 Ca 0.60 -0.40 0.20 0.00 0.07 0.00 0.00 59.98 60.44 2d86 h ARG 121 Cb 1.26 0.11 -0.16 0.00 0.08 0.00 0.00 29.97 31.26 2d86 h ARG 121 CO -0.82 1.06 -0.11 1.25 -1.07 0.00 0.00 179.97 180.28 2d86 h LEU 122 N -0.09 -0.64 -0.95 3.04 5.85 0.31 0.36 115.31 123.20 2d86 h LEU 122 Ca -0.06 0.26 0.28 0.00 0.84 0.00 0.00 57.88 59.20 2d86 h LEU 122 Cb 1.23 0.49 -0.17 0.00 0.37 0.00 0.00 40.66 42.58 2d86 h LEU 122 CO 0.11 -0.28 0.19 0.77 -0.34 0.00 0.00 178.44 178.88 2d86 h SER 123 N 0.02 -0.17 -1.02 1.25 4.64 -1.42 0.62 113.55 117.47 2d86 h SER 123 Ca 0.47 0.24 0.34 0.00 -0.47 0.00 0.00 61.79 62.37 2d86 h SER 123 Cb 0.81 0.37 -0.15 0.00 -0.31 0.00 0.00 62.40 63.12 2d86 h SER 123 CO -0.86 -0.29 0.59 0.03 -0.87 0.00 0.00 176.83 175.42 2d86 h ARG 124 N 0.08 0.26 -6.14 4.77 2.47 -0.45 -3.29 114.38 112.08 2d86 h ARG 124 Ca 0.62 -0.02 -0.61 0.00 -1.26 0.00 0.00 59.98 58.71 2d86 h ARG 124 Cb 1.34 -0.06 0.16 0.00 -1.65 0.00 0.00 29.97 29.76 2d86 h ARG 124 CO -0.80 0.17 -0.75 0.25 0.56 0.00 0.00 179.97 179.40 2d86 n THR 125 N -5.05 1.07 0.98 2.04 -2.24 0.22 -4.78 114.28 106.52 2d86 n THR 125 Ca 0.33 -0.50 0.07 0.00 -2.27 0.00 0.00 64.05 61.68 2d86 n THR 125 Cb 1.05 -0.22 0.43 0.00 -2.10 0.00 0.00 70.33 69.49 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 1.00 0.49 -0.08 -0.78 -0.04 -1.26 -2.58 135.00 131.75 2d86 n PRO 126 Ca 0.11 0.00 -0.17 0.00 -0.04 0.00 0.00 63.50 63.40 2d86 n PRO 126 Cb 0.41 -1.46 -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 -0.96 1.56 -0.05 0.52 -0.00 -1.26 -3.52 119.36 115.65 2d86 n ILE 127 Ca 0.11 -0.65 -0.15 0.00 -0.00 0.00 0.00 62.75 62.06 2d86 n ILE 127 Cb 0.05 -1.33 -0.07 0.00 -0.00 0.00 0.00 39.64 38.29 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 0.25 0.27 -0.45 -1.39 0.00 -1.67 -3.26 119.26 113.01 2d86 h ALA 128 Ca -0.51 -0.46 -0.13 0.00 0.00 0.00 0.00 54.91 53.82 2d86 h ALA 128 Cb 2.00 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 19.74 2d86 h ALA 128 CO -0.01 0.37 -0.21 -0.07 0.00 0.00 0.00 179.25 179.33 2d86 h LEU 129 N 0.21 0.96 -0.90 0.00 3.38 -1.61 -3.17 115.31 114.19 2d86 h LEU 129 Ca -0.00 -0.40 0.20 0.00 0.09 0.00 0.00 57.88 57.76 2d86 h LEU 129 Cb 1.01 -0.27 -0.17 0.00 0.09 0.00 0.00 40.66 41.33 2d86 h LEU 129 CO 0.09 1.15 -0.15 0.00 0.09 0.00 0.00 178.44 179.62 2d86 h ALA 130 N 0.85 0.72 -0.97 1.53 0.00 -1.60 0.69 119.26 120.47 2d86 h ALA 130 Ca 0.10 0.34 0.06 0.00 0.00 0.00 0.00 54.91 55.41 2d86 h ALA 130 Cb 0.78 0.63 -0.06 0.00 0.00 0.00 0.00 17.79 19.14 2d86 h ALA 130 CO 0.06 -0.43 0.63 1.79 0.00 0.00 0.00 179.25 181.31 2d86 h THR 131 N 0.01 1.10 0.00 0.00 1.35 -1.63 -3.46 112.91 110.28 2d86 h THR 131 Ca 0.46 -0.39 0.00 0.00 -0.55 0.00 0.00 66.41 65.93 2d86 h THR 131 Cb 0.77 -0.15 0.00 0.00 -1.73 0.00 0.00 68.15 67.04 2d86 h THR 131 CO -0.89 0.21 0.00 0.61 -0.25 0.00 0.00 175.52 175.20 2d86 n GLY 132 N -1.38 1.21 3.77 5.82 0.00 0.24 -5.09 105.19 109.77 2d86 n GLY 132 Ca 0.15 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.78 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 3.94 -0.45 -0.61 1.01 -1.26 -4.90 121.20 116.94 2d86 s ILE 133 Ca 0.00 1.79 -0.41 0.00 0.00 0.00 0.00 60.65 62.03 2d86 s ILE 133 Cb 0.00 -4.07 -0.16 0.00 0.01 0.00 0.00 42.46 38.23 2d86 s ILE 133 CO 0.00 0.30 2.14 -2.11 0.00 0.00 0.00 174.94 175.27 2d86 n ARG 134 N 0.95 0.38 -2.25 2.79 1.85 -1.26 -4.86 116.66 114.25 2d86 n ARG 134 Ca 0.00 0.10 -0.40 0.00 -1.00 0.00 0.00 57.85 56.56 2d86 n ARG 134 Cb 0.48 -1.83 -0.03 0.00 -1.05 0.00 0.00 32.46 30.03 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 6.00 4.35 0.78 2.89 0.04 -1.26 -4.94 135.00 142.86 2d86 s PRO 135 Ca 1.16 2.02 -0.16 0.00 0.04 0.00 0.00 61.00 64.06 2d86 s PRO 135 Cb -1.28 -3.00 -0.04 0.00 0.04 0.00 0.00 34.50 30.22 2d86 s PRO 135 CO 0.61 -0.12 0.35 1.19 0.04 0.00 0.00 177.00 179.07 2d86 n PHE 136 N 0.71 -1.43 -2.14 0.56 3.01 -1.26 -4.85 117.46 112.06 2d86 n PHE 136 Ca 0.01 0.30 -0.43 0.00 1.01 0.00 0.00 57.45 58.34 2d86 n PHE 136 Cb 0.44 -1.83 -0.03 0.00 -0.01 0.00 0.00 39.48 38.05 2d86 n PHE 136 CO 0.00 0.00 0.00 -1.25 1.01 0.00 0.00 176.76 176.52 2d86 s PRO 137 N -2.77 4.09 -0.47 -1.08 0.04 -1.26 -4.90 135.00 128.65 2d86 s PRO 137 Ca 0.61 1.91 -0.33 0.00 0.04 0.00 0.00 61.00 63.23 2d86 s PRO 137 Cb -0.32 -3.94 -0.12 0.00 0.04 0.00 0.00 34.50 30.16 2d86 s PRO 137 CO 0.62 -0.93 2.31 0.45 0.04 0.00 0.00 177.00 179.50 2d86 n SER 138 N 7.35 1.91 -4.69 6.66 2.88 -1.26 -4.92 113.62 121.55 2d86 n SER 138 Ca 0.17 0.19 -0.26 0.00 -1.33 0.00 0.00 58.87 57.64 2d86 n SER 138 Cb 0.44 -1.28 -0.09 0.00 -0.75 0.00 0.00 64.21 62.53 2d86 n SER 138 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 2d86 s GLY 139 N 8.57 2.38 0.83 0.46 0.00 -1.26 -5.13 107.32 113.17 2d86 s GLY 139 Ca 1.11 -2.17 -0.11 0.00 0.00 0.00 0.00 44.72 43.55 2d86 s GLY 139 CO 0.44 -1.98 1.09 2.56 0.00 0.00 0.00 173.10 175.21 2d86 s PRO 140 N -3.82 1.77 0.50 2.90 0.04 -1.26 -5.08 135.00 130.05 2d86 s PRO 140 Ca 0.38 1.00 0.04 0.00 0.04 0.00 0.00 61.00 62.47 2d86 s PRO 140 Cb 0.06 -1.85 -0.00 0.00 0.04 0.00 0.00 34.50 32.74 2d86 s PRO 140 CO 0.21 -1.93 0.21 -1.12 0.04 0.00 0.00 177.00 174.41 2d86 s SER 141 N -3.41 4.41 -0.03 6.66 0.01 -1.26 -5.06 113.70 115.02 2d86 s SER 141 Ca 0.62 -1.35 -0.39 0.00 1.31 0.00 0.00 55.95 56.15 2d86 s SER 141 Cb -0.18 0.23 -0.18 0.00 0.21 0.00 0.00 66.02 66.11 2d86 s SER 141 CO 0.56 -0.88 1.35 -0.24 0.41 0.00 0.00 173.24 174.44 2d86 n SER 142 N -1.47 1.31 0.00 2.44 2.88 -1.26 -5.37 113.62 112.16 2d86 n SER 142 Ca -0.07 1.13 0.00 0.00 -1.33 0.00 0.00 58.87 58.59 2d86 n SER 142 Cb 0.65 -1.09 0.00 0.00 -0.75 0.00 0.00 64.21 63.02 2d86 n SER 142 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42