#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 5.38 0.69 1.61 0.15 -1.26 -5.12 113.70 115.15 2d86 s SER 2 Ca 0.00 -0.59 -0.07 0.00 0.70 0.00 0.00 55.95 55.98 2d86 s SER 2 Cb 0.00 -0.49 0.05 0.00 -1.71 0.00 0.00 66.02 63.87 2d86 s SER 2 CO 0.00 -0.80 1.01 -0.44 1.20 0.00 0.00 173.24 174.21 2d86 s SER 3 N -4.32 4.96 0.00 5.45 0.01 -1.26 -5.08 113.70 113.46 2d86 s SER 3 Ca 0.53 0.57 0.00 0.00 1.31 0.00 0.00 55.95 58.36 2d86 s SER 3 Cb -0.07 -1.27 0.00 0.00 0.21 0.00 0.00 66.02 64.88 2d86 s SER 3 CO 0.32 -1.51 0.00 0.61 0.41 0.00 0.00 173.24 173.06 2d86 n GLY 4 N -2.90 2.09 3.70 3.44 0.00 -1.26 -5.12 105.19 105.14 2d86 n GLY 4 Ca 0.07 -0.18 -0.35 0.00 0.00 0.00 0.00 46.02 45.56 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 1.00 5.81 -0.05 1.61 1.04 -1.26 -5.08 113.70 116.76 2d86 s SER 5 Ca 0.00 0.18 -0.29 0.00 0.48 0.00 0.00 55.95 56.32 2d86 s SER 5 Cb 0.00 -1.94 0.10 0.00 0.10 0.00 0.00 66.02 64.28 2d86 s SER 5 CO 0.00 0.24 0.86 -0.94 0.98 0.00 0.00 173.24 174.38 2d86 s SER 6 N -0.04 -0.44 0.00 7.02 1.04 -1.26 -5.15 113.70 114.86 2d86 s SER 6 Ca 0.07 0.27 0.00 0.00 0.48 0.00 0.00 55.95 56.77 2d86 s SER 6 Cb -0.12 0.41 0.00 0.00 0.10 0.00 0.00 66.02 66.41 2d86 s SER 6 CO 0.01 -0.56 0.00 0.61 0.98 0.00 0.00 173.24 174.28 2d86 n GLY 7 N 0.29 1.61 3.21 7.32 0.00 -1.26 -5.00 105.19 111.35 2d86 n GLY 7 Ca -0.12 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.58 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 3.05 0.62 1.61 -2.45 -1.26 -5.13 119.30 115.75 2d86 s MET 8 Ca 0.00 -0.86 -0.10 0.00 -1.25 0.00 0.00 55.69 53.47 2d86 s MET 8 Cb 0.00 -2.37 -0.03 0.00 1.25 0.00 0.00 34.83 33.69 2d86 s MET 8 CO 0.00 0.11 1.01 -1.21 1.05 0.00 0.00 175.02 175.98 2d86 s GLU 9 N 0.52 3.45 0.15 4.11 2.02 -1.26 -5.00 118.70 122.69 2d86 s GLU 9 Ca -0.14 0.63 -0.10 0.00 0.02 0.00 0.00 54.97 55.38 2d86 s GLU 9 Cb -0.17 -2.10 -0.02 0.00 0.10 0.00 0.00 34.13 31.94 2d86 s GLU 9 CO 0.05 -0.62 1.48 -1.00 0.02 0.00 0.00 175.26 175.19 2d86 h PRO 10 N -0.32 0.91 -0.16 0.39 0.13 -2.02 -3.05 132.00 127.88 2d86 h PRO 10 Ca -0.44 -0.48 -0.00 0.00 -0.87 0.00 0.00 66.00 64.20 2d86 h PRO 10 Cb 1.20 0.02 -0.01 0.00 0.13 0.00 0.00 31.00 32.34 2d86 h PRO 10 CO 0.62 1.13 0.09 0.11 -0.23 0.00 0.00 178.00 179.72 2d86 h TRP 11 N 0.74 0.20 0.05 1.56 5.08 -1.99 -2.39 115.95 119.20 2d86 h TRP 11 Ca 0.06 0.00 0.00 0.00 1.08 0.00 0.00 58.89 60.03 2d86 h TRP 11 Cb 0.98 -0.07 -0.01 0.00 -3.00 0.00 0.00 29.16 27.07 2d86 h TRP 11 CO 0.06 0.14 -0.09 0.87 -1.28 0.00 0.00 178.44 178.14 2d86 h LYS 12 N 0.21 -0.15 -0.92 0.12 1.57 -1.93 -2.22 116.57 113.26 2d86 h LYS 12 Ca 0.06 0.01 0.07 0.00 -1.87 0.00 0.00 60.65 58.92 2d86 h LYS 12 Cb 0.01 0.03 -0.07 0.00 0.08 0.00 0.00 32.23 32.28 2d86 h LYS 12 CO -0.01 -0.10 0.57 -0.56 -0.57 0.00 0.00 179.45 178.79 2d86 h GLN 13 N -0.15 0.99 -0.91 3.15 3.07 -1.67 -1.97 115.11 117.62 2d86 h GLN 13 Ca -0.01 -0.06 0.25 0.00 0.09 0.00 0.00 58.65 58.93 2d86 h GLN 13 Cb 0.14 -0.22 -0.14 0.00 0.08 0.00 0.00 27.48 27.34 2d86 h GLN 13 CO -0.03 0.65 0.34 0.00 0.09 0.00 0.00 178.83 179.88 2d86 h ALA 15 N 1.79 1.33 0.37 0.00 0.00 -0.74 -1.85 119.26 120.17 2d86 h ALA 15 Ca 0.60 0.20 -0.01 0.00 0.00 0.00 0.00 54.91 55.70 2d86 h ALA 15 Cb 1.25 0.26 -0.01 0.00 0.00 0.00 0.00 17.79 19.28 2d86 h ALA 15 CO -0.63 -0.44 -0.35 1.96 0.00 0.00 0.00 179.25 179.80 2d86 h GLN 16 N 0.26 -0.68 -1.00 0.00 1.08 -0.67 -2.15 115.11 111.95 2d86 h GLN 16 Ca 0.56 0.05 0.31 0.00 -1.45 0.00 0.00 58.65 58.11 2d86 h GLN 16 Cb 1.11 0.15 -0.18 0.00 -0.05 0.00 0.00 27.48 28.51 2d86 h GLN 16 CO -0.61 -0.45 0.14 2.35 -0.95 0.00 0.00 178.83 179.31 2d86 h TRP 17 N -0.71 0.15 0.16 2.96 7.01 -1.38 0.40 115.95 124.55 2d86 h TRP 17 Ca -0.05 0.07 0.00 0.00 2.11 0.00 0.00 58.89 61.02 2d86 h TRP 17 Cb 0.61 0.10 -0.01 0.00 -2.10 0.00 0.00 29.16 27.76 2d86 h TRP 17 CO -0.18 -0.45 -0.14 -0.07 -2.79 0.00 0.00 178.44 174.81 2d86 h LEU 18 N 0.00 -0.37 -1.05 0.65 3.38 -1.11 0.29 115.31 117.10 2d86 h LEU 18 Ca 0.66 0.03 0.15 0.00 0.09 0.00 0.00 57.88 58.82 2d86 h LEU 18 Cb 1.48 0.12 -0.09 0.00 0.09 0.00 0.00 40.66 42.26 2d86 h LEU 18 CO -0.90 -0.22 0.62 0.40 0.09 0.00 0.00 178.44 178.43 2d86 h ILE 19 N -0.32 0.83 -0.10 1.22 2.04 0.39 -0.83 117.51 120.74 2d86 h ILE 19 Ca -0.00 -0.30 -0.22 0.00 1.00 0.00 0.00 64.86 65.34 2d86 h ILE 19 Cb 0.30 -0.12 0.01 0.00 -0.74 0.00 0.00 36.82 36.27 2d86 h ILE 19 CO -0.02 0.16 -0.81 0.45 0.00 0.00 0.00 178.15 177.93 2d86 h HIS 20 N 0.87 0.90 0.00 1.37 3.86 -0.78 -2.95 115.15 118.41 2d86 h HIS 20 Ca 0.52 -0.41 0.00 0.00 -1.16 0.00 0.00 60.37 59.32 2d86 h HIS 20 Cb 0.68 -0.13 0.00 0.00 1.06 0.00 0.00 27.41 29.02 2d86 h HIS 20 CO -0.00 1.23 0.00 0.00 0.86 0.00 0.00 177.93 180.01 2d86 n LYS 22 N -1.29 -2.20 0.00 0.00 4.76 -0.88 -4.71 118.16 113.84 2d86 n LYS 22 Ca 0.04 0.32 0.00 0.00 -2.87 0.00 0.00 58.31 55.80 2d86 n LYS 22 Cb 0.07 -3.65 0.00 0.00 -1.84 0.00 0.00 35.03 29.60 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 -2.17 0.00 -4.28 -0.18 0.24 -1.00 -4.90 118.33 106.04 2d86 n VAL 23 Ca -0.09 0.00 -0.21 0.00 -2.04 0.00 0.00 64.34 62.00 2d86 n VAL 23 Cb 0.56 -0.57 -0.13 0.00 -1.47 0.00 0.00 33.84 32.23 2d86 n VAL 23 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 2d86 s LEU 24 N -3.06 2.26 0.69 1.34 1.43 -1.24 -4.99 118.68 115.10 2d86 s LEU 24 Ca 0.00 -0.60 -0.14 0.00 -1.03 0.00 0.00 54.13 52.36 2d86 s LEU 24 Cb 0.00 -0.68 0.02 0.00 0.03 0.00 0.00 46.19 45.56 2d86 s LEU 24 CO 0.00 0.00 1.10 -2.16 0.23 0.00 0.00 176.35 175.53 2d86 s PRO 25 N -1.63 2.64 0.43 1.29 0.04 -1.26 -4.22 135.00 132.29 2d86 s PRO 25 Ca 0.02 1.32 0.18 0.00 0.04 0.00 0.00 61.00 62.56 2d86 s PRO 25 Cb -0.09 -1.93 0.99 0.00 0.04 0.00 0.00 34.50 33.50 2d86 s PRO 25 CO 0.03 -1.37 1.92 1.79 0.04 0.00 0.00 177.00 179.41 2d86 h THR 26 N -0.32 0.98 -0.42 1.26 1.35 -2.01 -2.32 112.91 111.43 2d86 h THR 26 Ca -0.46 -0.95 0.00 0.00 -0.55 0.00 0.00 66.41 64.45 2d86 h THR 26 Cb 1.24 1.54 0.00 0.00 -1.73 0.00 0.00 68.15 69.21 2d86 h THR 26 CO 0.53 0.25 0.00 0.59 -0.25 0.00 0.00 175.52 176.65 2d86 n ASN 27 N -3.94 4.60 -4.09 5.36 4.13 -1.26 -4.97 115.26 115.10 2d86 n ASN 27 Ca -0.02 -2.86 -0.34 0.00 1.68 0.00 0.00 54.58 53.05 2d86 n ASN 27 Cb 0.34 -0.58 0.10 0.00 -1.54 0.00 0.00 39.78 38.09 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 0.15 -1.39 -0.02 3.10 -0.00 -0.87 -4.90 115.22 111.28 2d86 n HIS 28 Ca 0.24 0.41 -0.16 0.00 0.46 0.00 0.00 57.72 58.67 2d86 n HIS 28 Cb 0.97 -1.45 -0.12 0.00 -0.12 0.00 0.00 29.99 29.27 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 -1.59 0.18 -0.93 1.57 0.11 -1.96 -3.26 114.38 108.50 2d86 h ARG 29 Ca -0.43 -0.23 0.26 0.00 0.10 0.00 0.00 59.98 59.67 2d86 h ARG 29 Cb 1.30 0.07 -0.05 0.00 1.11 0.00 0.00 29.97 32.41 2d86 h ARG 29 CO 0.27 1.01 0.65 -0.39 0.10 0.00 0.00 179.97 181.62 2d86 h VAL 30 N -0.54 0.56 -0.64 0.08 -1.51 -1.93 0.12 116.25 112.40 2d86 h VAL 30 Ca -0.05 -0.04 0.07 0.00 -1.23 0.00 0.00 66.70 65.45 2d86 h VAL 30 Cb 1.15 0.44 -0.06 0.00 -2.13 0.00 0.00 31.29 30.69 2d86 h VAL 30 CO 0.06 0.02 0.32 0.71 -1.23 0.00 0.00 177.57 177.45 2d86 h THR 31 N 0.11 0.89 -2.86 7.19 1.35 -1.91 -3.43 112.91 114.27 2d86 h THR 31 Ca 0.46 -0.20 -0.59 0.00 -0.55 0.00 0.00 66.41 65.53 2d86 h THR 31 Cb 1.63 0.27 0.14 0.00 -1.73 0.00 0.00 68.15 68.47 2d86 h THR 31 CO -0.06 0.10 -0.09 0.79 -0.25 0.00 0.00 175.52 176.01 2d86 n TRP 32 N -4.87 0.37 0.23 4.73 7.02 0.03 -4.86 117.44 120.09 2d86 n TRP 32 Ca 0.08 0.55 0.08 0.00 -1.02 0.00 0.00 57.50 57.19 2d86 n TRP 32 Cb 0.21 -2.11 0.54 0.00 -2.42 0.00 0.00 31.31 27.54 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 1.02 0.00 -0.35 -0.99 3.32 -1.87 -2.55 116.42 115.01 2d86 h ASP 33 Ca -0.44 0.00 -0.05 0.00 0.02 0.00 0.00 57.03 56.56 2d86 h ASP 33 Cb 1.37 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.90 2d86 h ASP 33 CO 0.53 0.22 0.04 0.28 -1.72 0.00 0.00 179.24 178.59 2d86 h SER 34 N 0.00 0.64 -3.68 6.45 0.02 -1.91 -3.44 113.55 111.63 2d86 h SER 34 Ca -0.00 -0.13 -0.53 0.00 -0.84 0.00 0.00 61.79 60.29 2d86 h SER 34 Cb 0.45 -0.17 0.21 0.00 0.14 0.00 0.00 62.40 63.03 2d86 h SER 34 CO 0.03 0.68 -0.29 0.00 -1.14 0.00 0.00 176.83 176.11 2d86 n ALA 35 N -2.47 -1.89 -2.35 3.77 0.00 -0.96 -5.04 120.51 111.56 2d86 n ALA 35 Ca 0.02 -0.56 -0.10 0.00 0.00 0.00 0.00 53.44 52.81 2d86 n ALA 35 Cb 0.25 -1.94 -0.09 0.00 0.00 0.00 0.00 19.45 17.67 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 -3.89 1.05 0.29 0.00 -0.21 -1.26 -5.01 119.66 110.63 2d86 s GLN 36 Ca 0.61 -1.38 0.15 0.00 0.02 0.00 0.00 55.36 54.76 2d86 s GLN 36 Cb -0.23 0.29 1.01 0.00 1.00 0.00 0.00 33.01 35.08 2d86 s GLN 36 CO 0.63 -0.34 1.26 1.33 -2.12 0.00 0.00 175.29 176.05 2d86 n VAL 37 N -0.16 -0.33 0.24 1.09 0.24 -1.26 -0.22 118.33 117.93 2d86 n VAL 37 Ca -0.05 1.64 -0.11 0.00 -2.04 0.00 0.00 64.34 63.77 2d86 n VAL 37 Cb 0.64 -2.62 -0.06 0.00 -1.47 0.00 0.00 33.84 30.33 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 -0.77 -0.99 6.34 3.04 -1.96 0.30 116.94 122.90 2d86 h PHE 38 Ca 0.65 -0.01 0.13 0.00 3.98 0.00 0.00 57.97 62.72 2d86 h PHE 38 Cb 1.68 0.28 -0.14 0.00 2.56 0.00 0.00 35.95 40.33 2d86 h PHE 38 CO -0.06 -0.42 -0.46 -0.25 -2.02 0.00 0.00 178.31 175.09 2d86 n ASP 39 N -4.12 -0.80 0.27 0.41 9.92 0.70 0.23 116.55 123.16 2d86 n ASP 39 Ca -0.08 1.73 0.15 0.00 -0.53 0.00 0.00 54.79 56.06 2d86 n ASP 39 Cb 0.29 -0.33 0.75 0.00 -0.64 0.00 0.00 41.12 41.19 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 -1.41 -2.03 115.31 118.35 2d86 h LEU 40 Ca 0.27 0.00 -0.11 0.00 0.84 0.00 0.00 57.88 58.88 2d86 h LEU 40 Cb 0.52 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.53 2d86 h LEU 40 CO -0.96 0.09 -0.56 0.00 -0.34 0.00 0.00 178.44 176.67 2d86 h ALA 41 N 1.91 0.66 0.05 1.25 0.00 0.67 -3.34 119.26 120.47 2d86 h ALA 41 Ca -0.00 -0.48 -0.00 0.00 0.00 0.00 0.00 54.91 54.42 2d86 h ALA 41 Cb 0.40 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.12 2d86 h ALA 41 CO 0.01 0.65 -0.02 1.96 0.00 0.00 0.00 179.25 181.85 2d86 h GLN 42 N 0.00 -0.06 -0.18 0.00 4.20 0.83 0.26 115.11 120.16 2d86 h GLN 42 Ca -0.01 0.00 0.05 0.00 0.06 0.00 0.00 58.65 58.75 2d86 h GLN 42 Cb 1.40 0.01 -0.01 0.00 0.30 0.00 0.00 27.48 29.19 2d86 h GLN 42 CO 0.07 0.52 0.71 0.00 -0.67 0.00 0.00 178.83 179.46 2d86 h THR 43 N -0.93 0.04 0.00 -0.54 1.03 -1.62 0.40 112.91 111.30 2d86 h THR 43 Ca -0.01 0.00 -0.14 0.00 -0.01 0.00 0.00 66.41 66.25 2d86 h THR 43 Cb 0.61 0.33 -0.03 0.00 -1.07 0.00 0.00 68.15 67.99 2d86 h THR 43 CO 0.01 0.00 -1.64 0.18 -0.01 0.00 0.00 175.52 174.06 2d86 n LEU 44 N -2.88 0.00 -0.29 0.00 4.77 -1.22 -4.55 117.00 112.82 2d86 n LEU 44 Ca 0.03 0.00 0.17 0.00 -0.03 0.00 0.00 56.01 56.18 2d86 n LEU 44 Cb 0.79 0.19 0.33 0.00 -2.33 0.00 0.00 43.42 42.40 2d86 n LEU 44 CO 0.11 0.19 0.75 -1.14 -1.33 0.00 0.00 177.39 175.97 2d86 n ARG 45 N -2.26 -0.06 -0.22 3.23 0.63 0.14 0.19 116.66 118.31 2d86 n ARG 45 Ca -0.13 1.27 -0.03 0.00 -0.92 0.00 0.00 57.85 58.04 2d86 n ARG 45 Cb 0.70 -2.08 0.08 0.00 0.45 0.00 0.00 32.46 31.61 2d86 n ARG 45 CO 0.00 0.00 0.00 -0.44 -2.51 0.00 0.00 177.63 174.68 2d86 h ASP 46 N 0.00 0.56 0.00 6.15 5.19 -1.81 -3.41 116.42 123.09 2d86 h ASP 46 Ca 0.58 0.02 0.00 0.00 -0.62 0.00 0.00 57.03 57.01 2d86 h ASP 46 Cb 1.32 -0.09 0.00 0.00 0.18 0.00 0.00 39.33 40.74 2d86 h ASP 46 CO -0.77 0.37 0.00 0.61 -3.12 0.00 0.00 179.24 176.33 2d86 n GLY 47 N -1.28 0.90 0.10 2.75 0.00 0.52 -4.47 105.19 103.71 2d86 n GLY 47 Ca 0.07 -0.08 -0.13 0.00 0.00 0.00 0.00 46.02 45.88 2d86 n GLY 47 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2d86 h VAL 48 N 0.00 0.99 0.05 1.61 2.07 -1.87 -3.37 116.25 115.74 2d86 h VAL 48 Ca 0.00 -2.75 -0.00 0.00 0.82 0.00 0.00 66.70 64.77 2d86 h VAL 48 Cb 0.00 2.58 0.00 0.00 -1.52 0.00 0.00 31.29 32.35 2d86 h VAL 48 CO 0.00 0.71 -0.03 0.25 0.02 0.00 0.00 177.57 178.52 2d86 h LEU 49 N 0.03 -0.06 -0.80 2.57 5.85 -1.87 -3.31 115.31 117.73 2d86 h LEU 49 Ca -0.27 -0.53 0.10 0.00 0.84 0.00 0.00 57.88 58.02 2d86 h LEU 49 Cb 1.99 0.02 -0.11 0.00 0.37 0.00 0.00 40.66 42.92 2d86 h LEU 49 CO 0.11 0.66 -0.38 0.18 -0.34 0.00 0.00 178.44 178.66 2d86 n LEU 50 N -4.76 -0.67 -0.31 2.25 4.77 -1.26 0.19 117.00 117.20 2d86 n LEU 50 Ca -0.07 1.40 0.11 0.00 -0.03 0.00 0.00 56.01 57.43 2d86 n LEU 50 Cb 0.29 -0.26 0.29 0.00 -2.33 0.00 0.00 43.42 41.41 2d86 n LEU 50 CO 0.23 -1.21 1.10 0.00 -1.33 0.00 0.00 177.39 176.19 2d86 h GLN 52 N 0.57 -0.42 -0.81 0.00 4.20 0.19 -2.68 115.11 116.17 2d86 h GLN 52 Ca 0.53 0.03 0.08 0.00 0.06 0.00 0.00 58.65 59.35 2d86 h GLN 52 Cb 0.89 0.09 -0.10 0.00 0.30 0.00 0.00 27.48 28.67 2d86 h GLN 52 CO -0.43 -0.27 -0.47 -0.11 -0.67 0.00 0.00 178.83 176.87 2d86 n LEU 53 N -5.27 -0.84 -0.21 1.46 7.94 -0.57 0.18 117.00 119.69 2d86 n LEU 53 Ca -0.10 1.44 0.04 0.00 -1.11 0.00 0.00 56.01 56.28 2d86 n LEU 53 Cb 0.19 -0.19 0.31 0.00 0.53 0.00 0.00 43.42 44.26 2d86 n LEU 53 CO 0.35 -1.18 1.23 -0.07 -1.11 0.00 0.00 177.39 176.61 2d86 h LEU 54 N 0.00 0.76 -1.80 -1.96 3.38 -1.50 0.05 115.31 114.23 2d86 h LEU 54 Ca 0.14 -0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.07 2d86 h LEU 54 Cb 0.34 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 40.92 2d86 h LEU 54 CO -0.76 0.51 -0.13 0.78 0.09 0.00 0.00 178.44 178.92 2d86 h ASN 55 N 0.87 0.00 0.09 -0.43 2.35 0.23 -0.80 115.58 117.90 2d86 h ASN 55 Ca 0.31 0.00 -0.17 0.00 -0.55 0.00 0.00 56.30 55.89 2d86 h ASN 55 Cb 0.13 0.00 0.02 0.00 0.05 0.00 0.00 38.32 38.52 2d86 h ASN 55 CO -0.10 0.13 -0.74 0.78 -1.65 0.00 0.00 177.43 175.86 2d86 h ASN 56 N 0.00 0.49 0.17 5.81 2.35 0.13 -3.37 115.58 121.16 2d86 h ASN 56 Ca -0.00 -0.89 -0.01 0.00 -0.55 0.00 0.00 56.30 54.85 2d86 h ASN 56 Cb 0.39 -0.16 0.00 0.00 0.05 0.00 0.00 38.32 38.61 2d86 h ASN 56 CO 0.02 1.33 -0.08 -0.07 -1.65 0.00 0.00 177.43 176.97 2d86 h LEU 57 N -0.28 -0.20 -9.30 1.61 3.38 -1.21 -3.46 115.31 105.85 2d86 h LEU 57 Ca -0.12 -0.29 -0.60 0.00 0.09 0.00 0.00 57.88 56.96 2d86 h LEU 57 Cb 1.52 0.05 -0.13 0.00 0.09 0.00 0.00 40.66 42.19 2d86 h LEU 57 CO 0.14 0.22 -0.73 -0.60 0.09 0.00 0.00 178.44 177.56 2d86 s ARG 58 N -4.41 1.87 0.05 1.13 3.52 -0.32 -4.91 118.95 115.87 2d86 s ARG 58 Ca -0.14 -1.62 -0.11 0.00 -0.13 0.00 0.00 55.73 53.72 2d86 s ARG 58 Cb 0.02 -1.91 -0.06 0.00 -1.56 0.00 0.00 34.95 31.44 2d86 s ARG 58 CO 0.58 0.35 0.39 0.00 -0.81 0.00 0.00 175.30 175.80 2d86 s ALA 59 N -2.35 3.73 -1.53 6.12 0.00 -1.26 -4.13 121.76 122.33 2d86 s ALA 59 Ca 0.29 -0.35 -0.01 0.00 0.00 0.00 0.00 51.96 51.89 2d86 s ALA 59 Cb -0.06 -2.28 0.00 0.00 0.00 0.00 0.00 23.12 20.78 2d86 s ALA 59 CO 0.16 0.55 0.15 0.72 0.00 0.00 0.00 175.76 177.34 2d86 n HIS 60 N 1.21 -1.12 -0.02 0.00 8.25 -1.26 -4.91 115.22 117.37 2d86 n HIS 60 Ca -0.10 0.13 -0.16 0.00 -0.26 0.00 0.00 57.72 57.33 2d86 n HIS 60 Cb 0.52 -3.78 -0.11 0.00 1.12 0.00 0.00 29.99 27.74 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 -0.34 0.31 -3.15 0.41 0.02 -1.85 -3.45 113.55 105.50 2d86 h SER 61 Ca -0.45 -0.74 -0.29 0.00 -0.84 0.00 0.00 61.79 59.46 2d86 h SER 61 Cb 1.33 -0.10 -0.36 0.00 0.14 0.00 0.00 62.40 63.42 2d86 h SER 61 CO 0.52 1.01 -0.64 -0.63 -1.14 0.00 0.00 176.83 175.95 2d86 s ILE 62 N -3.27 -0.22 -0.41 3.27 1.01 -1.26 -4.78 121.20 115.54 2d86 s ILE 62 Ca -0.15 0.34 -0.28 0.00 0.00 0.00 0.00 60.65 60.56 2d86 s ILE 62 Cb 0.02 -0.27 -0.01 0.00 0.01 0.00 0.00 42.46 42.20 2d86 s ILE 62 CO 0.76 0.14 1.71 0.21 0.00 0.00 0.00 174.94 177.76 2d86 s ASN 63 N 2.14 5.88 0.55 3.58 2.47 -1.26 -4.84 114.94 123.46 2d86 s ASN 63 Ca 0.02 0.98 0.33 0.00 0.42 0.00 0.00 52.86 54.60 2d86 s ASN 63 Cb -0.12 -2.53 1.49 0.00 -1.45 0.00 0.00 41.25 38.64 2d86 s ASN 63 CO -0.05 -1.77 1.84 -0.07 -3.72 0.00 0.00 177.10 173.32 2d86 h LEU 64 N 13.84 0.00 -0.66 3.21 3.38 -1.98 0.63 115.31 133.73 2d86 h LEU 64 Ca -0.31 0.00 -0.14 0.00 0.09 0.00 0.00 57.88 57.52 2d86 h LEU 64 Cb 1.15 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.89 2d86 h LEU 64 CO 1.08 0.00 -0.57 0.11 0.09 0.00 0.00 178.44 179.16 2d86 h LYS 65 N 0.00 0.31 0.00 1.13 1.79 -2.03 -2.85 116.57 114.91 2d86 h LYS 65 Ca 0.44 -0.20 -0.02 0.00 -2.18 0.00 0.00 60.65 58.70 2d86 h LYS 65 Cb 1.87 0.02 -0.00 0.00 -1.58 0.00 0.00 32.23 32.54 2d86 h LYS 65 CO -0.00 0.79 -0.09 0.93 -1.08 0.00 0.00 179.45 180.00 2d86 h GLU 66 N 0.24 0.00 -6.02 3.15 5.08 -0.11 -3.43 114.58 113.49 2d86 h GLU 66 Ca 0.00 0.00 -0.67 0.00 -1.00 0.00 0.00 59.36 57.69 2d86 h GLU 66 Cb 1.06 0.00 -0.14 0.00 0.50 0.00 0.00 28.75 30.18 2d86 h GLU 66 CO 0.09 0.09 -0.62 0.96 -1.00 0.00 0.00 179.01 178.53 2d86 s ILE 67 N -3.69 4.36 -0.96 3.13 -4.36 -1.07 -5.01 121.20 113.60 2d86 s ILE 67 Ca 0.01 -0.35 -0.24 0.00 -0.26 0.00 0.00 60.65 59.80 2d86 s ILE 67 Cb 0.10 -2.89 0.00 0.00 1.25 0.00 0.00 42.46 40.92 2d86 s ILE 67 CO 0.58 0.51 1.70 0.20 0.24 0.00 0.00 174.94 178.17 2d86 s ASN 68 N -1.20 5.81 0.54 4.36 0.01 -1.26 -4.80 114.94 118.41 2d86 s ASN 68 Ca 0.16 -1.06 0.29 0.00 -0.71 0.00 0.00 52.86 51.54 2d86 s ASN 68 Cb -0.11 -2.56 1.45 0.00 0.41 0.00 0.00 41.25 40.43 2d86 s ASN 68 CO 0.06 -2.13 1.93 -0.07 -1.51 0.00 0.00 177.10 175.38 2d86 h LEU 69 N 15.37 0.00 -7.02 0.60 3.38 -1.93 -3.12 115.31 122.59 2d86 h LEU 69 Ca 0.15 0.00 -0.62 0.00 0.09 0.00 0.00 57.88 57.50 2d86 h LEU 69 Cb 1.01 0.00 -0.41 0.00 0.09 0.00 0.00 40.66 41.34 2d86 h LEU 69 CO 1.32 0.00 -0.62 -0.60 0.09 0.00 0.00 178.44 178.63 2d86 s ARG 70 N -4.95 2.25 0.32 1.13 3.52 -1.26 -4.91 118.95 115.05 2d86 s ARG 70 Ca -0.05 -3.15 0.26 0.00 -0.13 0.00 0.00 55.73 52.66 2d86 s ARG 70 Cb 0.20 -3.18 1.08 0.00 -1.56 0.00 0.00 34.95 31.49 2d86 s ARG 70 CO 0.73 -1.28 1.77 -1.00 -0.81 0.00 0.00 175.30 174.71 2d86 h PRO 71 N 5.51 0.00 -6.71 5.12 0.13 -1.94 -3.47 132.00 130.64 2d86 h PRO 71 Ca 0.14 0.00 -0.55 0.00 -0.87 0.00 0.00 66.00 64.73 2d86 h PRO 71 Cb 0.78 0.00 -0.19 0.00 0.13 0.00 0.00 31.00 31.72 2d86 h PRO 71 CO 0.67 0.00 -0.84 1.04 -0.23 0.00 0.00 178.00 178.65 2d86 n GLN 72 N -2.42 -3.24 -3.57 0.86 6.02 -1.26 -0.55 117.38 113.21 2d86 n GLN 72 Ca 0.02 0.38 -0.20 0.00 -0.01 0.00 0.00 57.00 57.19 2d86 n GLN 72 Cb 0.24 -5.04 0.06 0.00 1.02 0.00 0.00 30.24 26.52 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 -4.40 -5.97 -3.63 -1.09 2.81 -1.26 -4.97 117.12 98.61 2d86 n MET 73 Ca 0.03 0.75 -0.39 0.00 -1.81 0.00 0.00 57.70 56.28 2d86 n MET 73 Cb 0.51 -5.58 -0.11 0.00 -0.71 0.00 0.00 33.22 27.33 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 -4.26 5.65 0.25 7.83 0.01 0.28 -4.97 113.70 118.49 2d86 s SER 74 Ca 0.06 -0.67 -0.03 0.00 1.31 0.00 0.00 55.95 56.62 2d86 s SER 74 Cb -0.03 -2.02 0.49 0.00 0.21 0.00 0.00 66.02 64.67 2d86 s SER 74 CO 0.77 -0.26 1.73 -0.61 0.41 0.00 0.00 173.24 175.28 2d86 h GLN 75 N 8.39 0.44 0.92 12.44 4.15 -1.93 0.38 115.11 139.90 2d86 h GLN 75 Ca -0.30 -0.03 -0.05 0.00 0.77 0.00 0.00 58.65 59.05 2d86 h GLN 75 Cb 1.13 -0.10 0.01 0.00 0.21 0.00 0.00 27.48 28.73 2d86 h GLN 75 CO 0.63 0.29 -0.44 0.74 -1.93 0.00 0.00 178.83 178.12 2d86 h PHE 76 N 0.45 -1.14 0.53 3.99 0.04 -1.96 -2.21 116.94 116.64 2d86 h PHE 76 Ca 0.43 -0.03 -0.02 0.00 2.80 0.00 0.00 57.97 61.15 2d86 h PHE 76 Cb 0.67 0.38 -0.01 0.00 2.20 0.00 0.00 35.95 39.19 2d86 h PHE 76 CO -0.16 -0.71 -0.38 -0.07 -0.60 0.00 0.00 178.31 176.39 2d86 h LEU 77 N -1.28 -0.99 -0.86 1.54 3.38 -1.80 -2.07 115.31 113.23 2d86 h LEU 77 Ca -0.13 0.06 0.08 0.00 0.09 0.00 0.00 57.88 57.99 2d86 h LEU 77 Cb 0.95 0.30 -0.11 0.00 0.09 0.00 0.00 40.66 41.89 2d86 h LEU 77 CO 0.21 -0.56 -0.49 0.00 0.09 0.00 0.00 178.44 177.69 2d86 h LEU 79 N 0.00 0.44 0.13 0.00 3.38 -1.30 -1.68 115.31 116.28 2d86 h LEU 79 Ca 0.16 0.10 -0.01 0.00 0.09 0.00 0.00 57.88 58.21 2d86 h LEU 79 Cb 0.37 0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.15 2d86 h LEU 79 CO -0.81 0.19 -0.06 0.50 0.09 0.00 0.00 178.44 178.34 2d86 h LYS 80 N 0.56 -0.17 0.04 1.13 3.11 0.15 -2.99 116.57 118.41 2d86 h LYS 80 Ca 0.44 0.01 0.01 0.00 -2.81 0.00 0.00 60.65 58.30 2d86 h LYS 80 Cb 0.63 0.04 -0.04 0.00 -1.00 0.00 0.00 32.23 31.86 2d86 h LYS 80 CO -0.37 -0.09 -0.40 -0.91 -2.81 0.00 0.00 179.45 174.87 2d86 h ASN 81 N -0.20 -1.23 -0.89 4.20 4.21 0.08 -2.47 115.58 119.28 2d86 h ASN 81 Ca -0.02 0.13 0.11 0.00 1.21 0.00 0.00 56.30 57.74 2d86 h ASN 81 Cb 0.16 0.46 -0.13 0.00 -1.12 0.00 0.00 38.32 37.69 2d86 h ASN 81 CO 0.03 -0.40 -0.42 -0.38 -1.29 0.00 0.00 177.43 174.96 2d86 n ILE 82 N -4.72 -0.53 -0.25 2.81 5.41 -0.82 0.70 119.36 121.97 2d86 n ILE 82 Ca -0.06 2.11 0.04 0.00 1.00 0.00 0.00 62.75 65.84 2d86 n ILE 82 Cb 0.30 -2.71 0.14 0.00 -0.71 0.00 0.00 39.64 36.67 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 0.08 -0.96 0.38 3.08 -1.30 0.25 114.38 115.91 2d86 h ARG 83 Ca 0.24 -0.00 0.24 0.00 0.07 0.00 0.00 59.98 60.52 2d86 h ARG 83 Cb 0.46 -0.02 -0.13 0.00 0.08 0.00 0.00 29.97 30.36 2d86 h ARG 83 CO -0.86 0.05 0.51 1.15 -1.07 0.00 0.00 179.97 179.75 2d86 h THR 84 N 0.08 0.49 0.28 2.04 2.02 0.59 0.62 112.91 119.03 2d86 h THR 84 Ca 0.40 -0.16 -0.01 0.00 0.77 0.00 0.00 66.41 67.40 2d86 h THR 84 Cb 0.68 -0.04 0.00 0.00 -1.74 0.00 0.00 68.15 67.06 2d86 h THR 84 CO -0.67 0.09 -0.13 0.15 0.37 0.00 0.00 175.52 175.32 2d86 h PHE 85 N 0.48 -0.35 -0.53 3.16 3.57 -0.35 -1.69 116.94 121.24 2d86 h PHE 85 Ca 0.62 -0.01 0.14 0.00 3.53 0.00 0.00 57.97 62.25 2d86 h PHE 85 Cb 1.20 0.11 -0.02 0.00 2.79 0.00 0.00 35.95 40.03 2d86 h PHE 85 CO -0.06 -0.03 0.38 -0.07 -2.23 0.00 0.00 178.31 176.30 2d86 h LEU 86 N -0.69 0.07 -0.07 0.59 3.38 -0.82 -1.40 115.31 116.38 2d86 h LEU 86 Ca -0.04 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.84 2d86 h LEU 86 Cb 0.48 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.22 2d86 h LEU 86 CO 0.06 0.04 -0.32 0.74 0.09 0.00 0.00 178.44 179.05 2d86 h THR 87 N 0.08 1.43 0.00 0.22 2.02 -0.76 -3.09 112.91 112.81 2d86 h THR 87 Ca 0.25 -1.73 0.00 0.00 0.77 0.00 0.00 66.41 65.70 2d86 h THR 87 Cb 0.90 2.34 0.00 0.00 -1.74 0.00 0.00 68.15 69.65 2d86 h THR 87 CO -0.02 0.50 0.00 0.00 0.37 0.00 0.00 175.52 176.37 2d86 h ALA 88 N 0.42 1.00 0.00 6.16 0.00 -0.31 -0.62 119.26 125.91 2d86 h ALA 88 Ca -0.02 0.00 -0.04 0.00 0.00 0.00 0.00 54.91 54.85 2d86 h ALA 88 Cb 0.97 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.76 2d86 h ALA 88 CO 0.07 0.00 -0.20 0.00 0.00 0.00 0.00 179.25 179.12 2d86 n GLU 91 N -1.71 0.57 -0.01 0.00 -0.58 -0.40 -3.43 120.64 115.08 2d86 n GLU 91 Ca -0.01 0.50 -0.08 0.00 -0.42 0.00 0.00 57.16 57.15 2d86 n GLU 91 Cb 0.24 -1.68 -0.06 0.00 -0.57 0.00 0.00 31.44 29.36 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 0.77 0.00 2.62 2.02 -0.90 -3.41 112.91 113.01 2d86 h THR 92 Ca -0.42 -1.40 -0.03 0.00 0.77 0.00 0.00 66.41 65.33 2d86 h THR 92 Cb 1.36 1.41 -0.00 0.00 -1.74 0.00 0.00 68.15 69.17 2d86 h THR 92 CO -0.26 0.24 -0.43 -0.26 0.37 0.00 0.00 175.52 175.18 2d86 h PHE 93 N -0.97 0.00 -0.40 3.16 -1.00 -1.64 -3.50 116.94 112.58 2d86 h PHE 93 Ca -0.01 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.77 2d86 h PHE 93 Cb 0.47 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.03 2d86 h PHE 93 CO 0.11 0.22 0.00 0.41 -1.61 0.00 0.00 178.31 177.43 2d86 n GLY 94 N 1.64 0.78 2.46 -1.45 0.00 -0.13 -4.94 105.19 103.55 2d86 n GLY 94 Ca -0.08 -0.71 -0.18 0.00 0.00 0.00 0.00 46.02 45.05 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 -0.16 1.00 -2.27 1.61 0.00 -0.64 -4.94 117.12 111.73 2d86 n MET 95 Ca 0.00 -2.28 -0.42 0.00 0.00 0.00 0.00 57.70 55.00 2d86 n MET 95 Cb 0.07 0.32 -0.03 0.00 0.00 0.00 0.00 33.22 33.58 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 -3.42 4.36 -0.13 3.17 0.52 -1.26 -4.70 118.95 117.49 2d86 s ARG 96 Ca 0.16 1.95 0.01 0.00 -0.52 0.00 0.00 55.73 57.34 2d86 s ARG 96 Cb -0.01 -3.29 0.20 0.00 0.52 0.00 0.00 34.95 32.36 2d86 s ARG 96 CO 0.10 -0.37 1.27 1.17 0.02 0.00 0.00 175.30 177.49 2d86 n LYS 97 N 3.98 1.40 -0.00 3.54 4.81 -1.26 -3.51 118.16 127.12 2d86 n LYS 97 Ca 0.11 -0.91 -0.00 0.00 -0.87 0.00 0.00 58.31 56.64 2d86 n LYS 97 Cb 0.44 -1.36 -0.01 0.00 0.02 0.00 0.00 35.03 34.12 2d86 n LYS 97 CO 0.00 0.00 0.00 0.43 1.17 0.00 0.00 177.40 179.00 2d86 n SER 98 N 0.01 4.84 0.15 3.14 7.64 -1.26 -4.66 113.62 123.48 2d86 n SER 98 Ca 0.18 0.00 0.04 0.00 1.01 0.00 0.00 58.87 60.10 2d86 n SER 98 Cb 0.85 0.57 0.05 0.00 -1.01 0.00 0.00 64.21 64.67 2d86 n SER 98 CO 0.00 0.00 0.00 1.05 -3.01 0.00 0.00 175.04 173.08 2d86 h GLU 99 N 0.00 0.00 -6.73 1.43 -0.00 -1.98 -3.46 114.58 103.84 2d86 h GLU 99 Ca -0.02 0.00 -0.52 0.00 -0.00 0.00 0.00 59.36 58.83 2d86 h GLU 99 Cb 0.93 0.00 0.22 0.00 -0.00 0.00 0.00 28.75 29.90 2d86 h GLU 99 CO 0.00 0.39 -0.74 1.28 -0.00 0.00 0.00 179.01 179.95 2d86 n LEU 100 N -3.19 -0.89 -4.98 3.06 4.77 -1.26 -4.73 117.00 109.77 2d86 n LEU 100 Ca 0.02 0.23 -0.20 0.00 -0.03 0.00 0.00 56.01 56.04 2d86 n LEU 100 Cb 0.70 -1.14 -0.00 0.00 -2.33 0.00 0.00 43.42 40.65 2d86 n LEU 100 CO 0.39 -3.63 0.09 0.72 -1.33 0.00 0.00 177.39 173.63 2d86 s PHE 101 N -2.35 3.16 -0.19 -1.77 -0.12 -1.26 -5.07 117.98 110.37 2d86 s PHE 101 Ca 0.56 -0.13 -0.26 0.00 -0.05 0.00 0.00 56.93 57.05 2d86 s PHE 101 Cb -0.19 -2.01 -0.01 0.00 -0.63 0.00 0.00 43.02 40.18 2d86 s PHE 101 CO 0.68 -0.03 0.87 -1.21 -0.05 0.00 0.00 175.22 175.48 2d86 s GLU 102 N -4.22 4.27 0.34 1.99 0.41 -1.26 -4.92 118.70 115.31 2d86 s GLU 102 Ca 0.45 1.07 0.17 0.00 -0.41 0.00 0.00 54.97 56.25 2d86 s GLU 102 Cb -0.10 -3.60 1.20 0.00 -1.78 0.00 0.00 34.13 29.85 2d86 s GLU 102 CO 0.32 -0.43 1.49 0.00 -0.49 0.00 0.00 175.26 176.15 2d86 n ALA 103 N 5.60 0.90 0.02 5.21 0.00 -1.26 0.80 120.51 131.79 2d86 n ALA 103 Ca 0.06 0.97 -0.13 0.00 0.00 0.00 0.00 53.44 54.34 2d86 n ALA 103 Cb 0.48 -0.93 -0.08 0.00 0.00 0.00 0.00 19.45 18.92 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 -0.02 -1.23 0.00 3.57 -1.97 -1.73 116.94 115.57 2d86 h PHE 104 Ca 0.77 -0.00 0.39 0.00 3.53 0.00 0.00 57.97 62.66 2d86 h PHE 104 Cb 1.99 0.01 -0.12 0.00 2.79 0.00 0.00 35.95 40.62 2d86 h PHE 104 CO -0.07 0.22 0.78 0.22 -2.23 0.00 0.00 178.31 177.23 2d86 h ASP 105 N -0.25 0.31 0.00 0.41 1.82 0.01 0.15 116.42 118.86 2d86 h ASP 105 Ca -0.00 0.13 -0.00 0.00 -0.39 0.00 0.00 57.03 56.77 2d86 h ASP 105 Cb 0.24 0.10 -0.00 0.00 0.68 0.00 0.00 39.33 40.35 2d86 h ASP 105 CO 0.00 -0.12 -0.02 0.25 -1.61 0.00 0.00 179.24 177.74 2d86 h LEU 106 N 0.17 0.00 -0.16 2.28 5.85 -1.27 0.26 115.31 122.43 2d86 h LEU 106 Ca 0.76 -0.22 0.02 0.00 0.84 0.00 0.00 57.88 59.28 2d86 h LEU 106 Cb 2.26 0.00 -0.03 0.00 0.37 0.00 0.00 40.66 43.26 2d86 h LEU 106 CO -0.41 0.62 -0.21 0.15 -0.34 0.00 0.00 178.44 178.25 2d86 h PHE 107 N -1.00 -0.65 0.00 1.25 3.57 -0.31 0.49 116.94 120.29 2d86 h PHE 107 Ca -0.00 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.53 2d86 h PHE 107 Cb 0.23 0.30 0.00 0.00 2.79 0.00 0.00 35.95 39.27 2d86 h PHE 107 CO 0.06 -0.18 0.00 -3.47 -2.23 0.00 0.00 178.31 172.48 2d86 n ASP 108 N -3.72 0.00 -2.91 0.41 -0.08 -0.08 -4.83 116.55 105.35 2d86 n ASP 108 Ca -0.01 -0.05 -0.21 0.00 -1.51 0.00 0.00 54.79 53.01 2d86 n ASP 108 Cb 0.13 -0.21 0.01 0.00 2.34 0.00 0.00 41.12 43.40 2d86 n ASP 108 CO 0.00 0.00 0.00 0.52 0.12 0.00 0.00 177.20 177.84 2d86 n VAL 109 N -1.21 -1.44 0.00 5.18 0.31 0.17 -4.92 118.33 116.43 2d86 n VAL 109 Ca 0.07 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.40 2d86 n VAL 109 Cb 0.09 -2.84 0.00 0.00 -0.91 0.00 0.00 33.84 30.18 2d86 n VAL 109 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 2d86 n ARG 110 N -3.64 0.00 -3.89 5.55 1.74 0.89 -4.41 116.66 112.91 2d86 n ARG 110 Ca -0.12 0.39 -0.30 0.00 -0.77 0.00 0.00 57.85 57.06 2d86 n ARG 110 Cb 0.62 -1.26 -0.14 0.00 -1.02 0.00 0.00 32.46 30.66 2d86 n ARG 110 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 2d86 s ASP 111 N -2.26 4.17 0.30 0.55 1.11 -1.23 -4.95 116.67 114.36 2d86 s ASP 111 Ca 0.00 -2.97 -0.01 0.00 0.18 0.00 0.00 52.55 49.76 2d86 s ASP 111 Cb 0.00 -1.50 0.48 0.00 1.07 0.00 0.00 42.92 42.97 2d86 s ASP 111 CO 0.00 -0.23 1.93 0.15 1.18 0.00 0.00 175.17 178.20 2d86 h PHE 112 N 6.49 1.06 -1.28 4.23 3.57 -1.81 -1.88 116.94 127.33 2d86 h PHE 112 Ca -0.05 0.03 0.37 0.00 3.53 0.00 0.00 57.97 61.84 2d86 h PHE 112 Cb 0.89 -0.35 -0.07 0.00 2.79 0.00 0.00 35.95 39.21 2d86 h PHE 112 CO 0.52 0.60 0.90 0.78 -2.23 0.00 0.00 178.31 178.88 2d86 h GLY 113 N 1.08 0.30 1.37 2.40 0.00 -1.97 0.65 103.07 106.90 2d86 h GLY 113 Ca 0.36 -0.04 -0.10 0.00 0.00 0.00 0.00 47.33 47.55 2d86 h GLY 113 CO -0.12 -0.06 -0.15 0.50 0.00 0.00 0.00 176.54 176.71 2d86 h LYS 114 N 0.07 0.74 -0.12 4.80 1.57 -1.77 -2.41 116.57 119.44 2d86 h LYS 114 Ca 0.64 -0.26 -0.19 0.00 -1.87 0.00 0.00 60.65 58.97 2d86 h LYS 114 Cb 2.38 -0.05 0.00 0.00 0.08 0.00 0.00 32.23 34.64 2d86 h LYS 114 CO -0.09 0.85 -0.72 0.28 -0.57 0.00 0.00 179.45 179.21 2d86 h VAL 115 N 0.66 1.33 -0.28 0.50 2.07 0.15 -3.17 116.25 117.51 2d86 h VAL 115 Ca 0.11 -2.03 -0.01 0.00 0.82 0.00 0.00 66.70 65.59 2d86 h VAL 115 Cb 0.63 2.01 -0.01 0.00 -1.52 0.00 0.00 31.29 32.39 2d86 h VAL 115 CO 0.04 0.62 0.14 0.40 0.02 0.00 0.00 177.57 178.79 2d86 h ILE 116 N 0.40 1.15 -0.22 4.57 2.04 -1.23 -3.05 117.51 121.17 2d86 h ILE 116 Ca -0.03 -0.43 0.06 0.00 1.00 0.00 0.00 64.86 65.46 2d86 h ILE 116 Cb 1.31 0.91 -0.06 0.00 -0.74 0.00 0.00 36.82 38.24 2d86 h ILE 116 CO 0.13 0.15 -0.16 -0.08 0.00 0.00 0.00 178.15 178.20 2d86 h GLU 117 N 0.32 -0.14 -0.99 2.37 4.81 -1.47 -2.00 114.58 117.47 2d86 h GLU 117 Ca 0.10 0.01 0.24 0.00 -0.13 0.00 0.00 59.36 59.58 2d86 h GLU 117 Cb 0.12 0.03 -0.19 0.00 0.63 0.00 0.00 28.75 29.34 2d86 h GLU 117 CO -0.01 -0.10 -0.08 1.15 -0.73 0.00 0.00 179.01 179.24 2d86 h THR 118 N -0.15 0.02 -0.83 0.32 2.02 -1.50 0.98 112.91 113.76 2d86 h THR 118 Ca 0.13 -0.00 -0.03 0.00 0.77 0.00 0.00 66.41 67.27 2d86 h THR 118 Cb 0.34 0.01 -0.04 0.00 -1.74 0.00 0.00 68.15 66.73 2d86 h THR 118 CO -0.32 0.00 0.39 -0.07 0.37 0.00 0.00 175.52 175.89 2d86 h LEU 119 N 0.00 1.11 -1.38 2.58 3.38 -1.40 -1.29 115.31 118.31 2d86 h LEU 119 Ca 0.55 -0.14 0.18 0.00 0.09 0.00 0.00 57.88 58.56 2d86 h LEU 119 Cb 1.03 -0.28 -0.07 0.00 0.09 0.00 0.00 40.66 41.42 2d86 h LEU 119 CO -0.96 0.94 0.59 -1.28 0.09 0.00 0.00 178.44 177.82 2d86 h SER 120 N 1.19 0.53 0.05 -0.43 0.87 0.12 -0.81 113.55 115.08 2d86 h SER 120 Ca 0.28 0.05 -0.12 0.00 -1.23 0.00 0.00 61.79 60.78 2d86 h SER 120 Cb 0.14 -0.05 0.00 0.00 -0.44 0.00 0.00 62.40 62.05 2d86 h SER 120 CO -0.03 0.23 -0.57 0.03 -0.53 0.00 0.00 176.83 175.95 2d86 h ARG 121 N 0.54 0.11 -0.70 2.24 3.08 -1.00 -3.36 114.38 115.30 2d86 h ARG 121 Ca 0.47 -0.20 0.15 0.00 0.07 0.00 0.00 59.98 60.48 2d86 h ARG 121 Cb 0.98 0.07 -0.11 0.00 0.08 0.00 0.00 29.97 30.99 2d86 h ARG 121 CO -0.21 1.09 0.08 1.25 -1.07 0.00 0.00 179.97 181.11 2d86 h LEU 122 N -0.74 -0.16 -1.42 3.04 5.85 -0.61 0.40 115.31 121.67 2d86 h LEU 122 Ca -0.12 0.16 0.18 0.00 0.84 0.00 0.00 57.88 58.94 2d86 h LEU 122 Cb 1.32 0.25 -0.03 0.00 0.37 0.00 0.00 40.66 42.57 2d86 h LEU 122 CO 0.02 -0.09 0.83 0.77 -0.34 0.00 0.00 178.44 179.62 2d86 h SER 123 N 0.18 0.00 -0.40 1.25 4.64 -1.31 0.66 113.55 118.57 2d86 h SER 123 Ca 0.38 0.00 -0.10 0.00 -0.47 0.00 0.00 61.79 61.60 2d86 h SER 123 Cb 0.65 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.73 2d86 h SER 123 CO -0.55 0.00 -0.16 0.03 -0.87 0.00 0.00 176.83 175.29 2d86 h ARG 124 N 0.00 0.82 -5.72 4.77 2.47 -0.38 -3.26 114.38 113.08 2d86 h ARG 124 Ca 0.30 -0.34 -0.57 0.00 -1.26 0.00 0.00 59.98 58.10 2d86 h ARG 124 Cb 1.95 -0.03 0.17 0.00 -1.65 0.00 0.00 29.97 30.41 2d86 h ARG 124 CO -0.00 0.97 -1.07 0.25 0.56 0.00 0.00 179.97 180.68 2d86 n THR 125 N -4.27 0.09 0.98 2.04 -2.24 0.23 -4.66 114.28 106.45 2d86 n THR 125 Ca -0.01 -0.48 0.06 0.00 -2.27 0.00 0.00 64.05 61.35 2d86 n THR 125 Cb 0.40 0.00 0.37 0.00 -2.10 0.00 0.00 70.33 69.01 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 1.41 0.49 -0.08 -0.78 -0.04 -1.26 -2.64 135.00 132.10 2d86 n PRO 126 Ca 0.08 0.00 -0.19 0.00 -0.04 0.00 0.00 63.50 63.35 2d86 n PRO 126 Cb 0.44 -1.40 -0.13 0.00 -0.04 0.00 0.00 33.50 32.37 2d86 n PRO 126 CO 0.00 0.00 0.00 -0.89 -0.04 0.00 0.00 175.50 174.57 2d86 n ILE 127 N -0.90 1.58 0.05 0.52 -0.00 -1.26 -3.50 119.36 115.85 2d86 n ILE 127 Ca 0.09 -0.61 -0.20 0.00 -0.00 0.00 0.00 62.75 62.03 2d86 n ILE 127 Cb 0.04 -1.49 -0.11 0.00 -0.00 0.00 0.00 39.64 38.09 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 0.07 0.08 -0.24 -1.39 0.00 -1.74 -3.29 119.26 112.76 2d86 h ALA 128 Ca -0.52 -0.69 -0.14 0.00 0.00 0.00 0.00 54.91 53.55 2d86 h ALA 128 Cb 1.96 0.07 -0.01 0.00 0.00 0.00 0.00 17.79 19.81 2d86 h ALA 128 CO -0.03 0.63 -0.44 -0.07 0.00 0.00 0.00 179.25 179.34 2d86 h LEU 129 N 0.28 0.64 -0.76 0.00 3.38 -1.55 -3.20 115.31 114.10 2d86 h LEU 129 Ca -0.14 -0.30 0.15 0.00 0.09 0.00 0.00 57.88 57.69 2d86 h LEU 129 Cb 1.69 -0.18 -0.14 0.00 0.09 0.00 0.00 40.66 42.11 2d86 h LEU 129 CO 0.20 0.99 -0.18 0.00 0.09 0.00 0.00 178.44 179.54 2d86 h ALA 130 N 1.03 0.52 -0.61 1.53 0.00 -1.62 0.60 119.26 120.70 2d86 h ALA 130 Ca 0.03 0.30 0.08 0.00 0.00 0.00 0.00 54.91 55.32 2d86 h ALA 130 Cb 0.96 0.57 -0.04 0.00 0.00 0.00 0.00 17.79 19.29 2d86 h ALA 130 CO 0.09 -0.41 0.41 1.79 0.00 0.00 0.00 179.25 181.12 2d86 h THR 131 N 0.00 0.95 0.00 0.00 1.35 -1.67 -3.46 112.91 110.08 2d86 h THR 131 Ca 0.37 -0.18 0.00 0.00 -0.55 0.00 0.00 66.41 66.05 2d86 h THR 131 Cb 0.57 0.39 0.00 0.00 -1.73 0.00 0.00 68.15 67.38 2d86 h THR 131 CO -0.78 0.09 0.00 0.61 -0.25 0.00 0.00 175.52 175.19 2d86 n GLY 132 N -1.49 1.01 3.73 5.82 0.00 0.21 -5.06 105.19 109.40 2d86 n GLY 132 Ca 0.09 -0.36 -0.41 0.00 0.00 0.00 0.00 46.02 45.34 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 4.38 -0.61 -0.61 1.01 -1.26 -4.84 121.20 117.27 2d86 s ILE 133 Ca 0.00 2.06 -0.13 0.00 0.00 0.00 0.00 60.65 62.58 2d86 s ILE 133 Cb 0.00 -4.32 -0.17 0.00 0.01 0.00 0.00 42.46 37.99 2d86 s ILE 133 CO 0.00 0.36 1.51 0.54 0.00 0.00 0.00 174.94 177.35 2d86 n ARG 134 N 2.47 0.00 -2.26 2.79 1.74 -1.26 -4.79 116.66 115.34 2d86 n ARG 134 Ca 0.01 0.00 -0.39 0.00 -0.77 0.00 0.00 57.85 56.71 2d86 n ARG 134 Cb 0.49 -0.79 -0.02 0.00 -1.02 0.00 0.00 32.46 31.12 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 4.98 4.12 0.77 5.56 0.04 -1.26 -4.94 135.00 144.27 2d86 s PRO 135 Ca 0.82 1.91 -0.16 0.00 0.04 0.00 0.00 61.00 63.62 2d86 s PRO 135 Cb -0.66 -2.76 -0.03 0.00 0.04 0.00 0.00 34.50 31.08 2d86 s PRO 135 CO 0.32 -0.29 0.46 1.19 0.04 0.00 0.00 177.00 178.72 2d86 n PHE 136 N 0.24 -1.08 -2.09 0.56 3.01 -1.26 -4.83 117.46 112.00 2d86 n PHE 136 Ca 0.03 0.32 -0.43 0.00 1.01 0.00 0.00 57.45 58.38 2d86 n PHE 136 Cb 0.45 -1.87 -0.03 0.00 -0.01 0.00 0.00 39.48 38.03 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 -2.89 3.43 0.02 -1.08 0.04 -1.26 -4.88 135.00 128.38 2d86 s PRO 137 Ca 0.63 1.33 -0.17 0.00 0.04 0.00 0.00 61.00 62.83 2d86 s PRO 137 Cb -0.32 -4.14 -0.33 0.00 0.04 0.00 0.00 34.50 29.75 2d86 s PRO 137 CO 0.61 -1.74 1.01 0.77 0.04 0.00 0.00 177.00 177.68 2d86 h SER 138 N 12.17 0.76 -4.71 6.66 0.02 -1.98 -3.50 113.55 122.96 2d86 h SER 138 Ca -0.32 -0.90 0.00 0.00 -0.84 0.00 0.00 61.79 59.73 2d86 h SER 138 Cb 1.15 -0.24 0.00 0.00 0.14 0.00 0.00 62.40 63.45 2d86 h SER 138 CO 1.04 1.59 0.00 0.61 -1.14 0.00 0.00 176.83 178.93 2d86 n GLY 139 N 1.59 3.62 0.20 -3.77 0.00 -1.26 -4.89 105.19 100.67 2d86 n GLY 139 Ca -0.15 -1.80 0.05 0.00 0.00 0.00 0.00 46.02 44.12 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 0.00 0.00 -6.79 1.61 0.13 -2.05 -3.44 132.00 121.46 2d86 h PRO 140 Ca 0.00 0.00 -0.53 0.00 -0.87 0.00 0.00 66.00 64.60 2d86 h PRO 140 Cb 0.00 0.00 0.08 0.00 0.13 0.00 0.00 31.00 31.21 2d86 h PRO 140 CO 0.00 0.35 0.87 0.45 -0.23 0.00 0.00 178.00 179.44 2d86 s SER 141 N -6.55 6.41 -0.09 1.44 0.15 -1.26 -5.01 113.70 108.79 2d86 s SER 141 Ca -0.01 2.91 -0.00 0.00 0.70 0.00 0.00 55.95 59.54 2d86 s SER 141 Cb 0.12 -2.63 0.02 0.00 -1.71 0.00 0.00 66.02 61.82 2d86 s SER 141 CO 0.69 -0.88 -0.07 -0.94 1.20 0.00 0.00 173.24 173.24 2d86 s SER 142 N 0.48 1.90 0.00 5.45 1.04 -1.26 -5.12 113.70 116.18 2d86 s SER 142 Ca 0.63 -0.25 0.00 0.00 0.48 0.00 0.00 55.95 56.81 2d86 s SER 142 Cb -0.47 -0.73 0.00 0.00 0.10 0.00 0.00 66.02 64.92 2d86 s SER 142 CO 0.47 -0.10 0.00 0.61 0.98 0.00 0.00 173.24 175.20