#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2d86 n SER 2 N 0.00 1.48 -0.07 1.61 2.88 -1.26 -4.80 113.62 113.46 2d86 n SER 2 Ca 0.00 -0.45 -0.08 0.00 -1.33 0.00 0.00 58.87 57.02 2d86 n SER 2 Cb 0.00 -1.35 -0.01 0.00 -0.75 0.00 0.00 64.21 62.09 2d86 n SER 2 CO 0.00 0.00 0.00 0.28 -1.23 0.00 0.00 175.04 174.09 2d86 h SER 3 N 16.24 -0.86 0.00 -3.46 0.02 -2.07 -3.48 113.55 119.94 2d86 h SER 3 Ca -0.14 0.16 0.00 0.00 -0.84 0.00 0.00 61.79 60.96 2d86 h SER 3 Cb 1.24 0.41 0.00 0.00 0.14 0.00 0.00 62.40 64.19 2d86 h SER 3 CO 1.23 -0.29 0.00 0.61 -1.14 0.00 0.00 176.83 177.24 2d86 n GLY 4 N -1.39 0.48 2.25 -3.77 0.00 -1.26 -4.83 105.19 96.66 2d86 n GLY 4 Ca 0.00 -1.15 -0.32 0.00 0.00 0.00 0.00 46.02 44.55 2d86 n GLY 4 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2d86 n SER 5 N 0.00 6.82 -4.14 1.61 2.88 -1.26 -4.97 113.62 114.56 2d86 n SER 5 Ca 0.00 -3.78 -0.12 0.00 -1.33 0.00 0.00 58.87 53.64 2d86 n SER 5 Cb 0.00 -0.78 -0.10 0.00 -0.75 0.00 0.00 64.21 62.58 2d86 n SER 5 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 2d86 s SER 6 N -2.38 1.12 0.00 -3.46 1.04 -1.26 -5.12 113.70 103.64 2d86 s SER 6 Ca 0.60 -0.87 0.00 0.00 0.48 0.00 0.00 55.95 56.16 2d86 s SER 6 Cb 0.48 0.07 0.00 0.00 0.10 0.00 0.00 66.02 66.66 2d86 s SER 6 CO -0.01 -0.37 0.00 0.61 0.98 0.00 0.00 173.24 174.45 2d86 n GLY 7 N 0.41 1.09 3.37 7.32 0.00 -1.26 -4.91 105.19 111.21 2d86 n GLY 7 Ca -0.15 -2.06 -0.45 0.00 0.00 0.00 0.00 46.02 43.36 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 -1.63 3.00 0.99 1.61 -2.45 -1.26 -5.06 119.30 114.49 2d86 s MET 8 Ca 0.00 -1.41 -0.16 0.00 -1.25 0.00 0.00 55.69 52.88 2d86 s MET 8 Cb 0.00 -4.18 -0.03 0.00 1.25 0.00 0.00 34.83 31.87 2d86 s MET 8 CO 0.00 -1.14 -0.16 0.39 1.05 0.00 0.00 175.02 175.16 2d86 n GLU 9 N 5.33 -0.30 -0.04 4.11 -0.58 -1.26 -4.92 120.64 122.99 2d86 n GLU 9 Ca -0.12 -0.06 -0.13 0.00 -0.42 0.00 0.00 57.16 56.42 2d86 n GLU 9 Cb 0.43 -1.50 -0.08 0.00 -0.57 0.00 0.00 31.44 29.72 2d86 n GLU 9 CO 0.00 0.00 0.00 -1.00 -0.48 0.00 0.00 177.13 175.65 2d86 h PRO 10 N -1.38 0.27 -0.95 3.49 0.13 -2.02 -3.23 132.00 128.31 2d86 h PRO 10 Ca -0.44 -0.14 0.01 0.00 -0.87 0.00 0.00 66.00 64.55 2d86 h PRO 10 Cb 1.30 0.01 -0.05 0.00 0.13 0.00 0.00 31.00 32.39 2d86 h PRO 10 CO 0.30 0.68 0.61 0.11 -0.23 0.00 0.00 178.00 179.48 2d86 h TRP 11 N -0.13 1.21 -0.52 1.56 5.08 -1.99 -2.82 115.95 118.35 2d86 h TRP 11 Ca 0.02 0.02 0.05 0.00 1.08 0.00 0.00 58.89 60.05 2d86 h TRP 11 Cb 0.63 -0.41 -0.06 0.00 -3.00 0.00 0.00 29.16 26.33 2d86 h TRP 11 CO 0.09 0.77 -0.31 1.63 -1.28 0.00 0.00 178.44 179.34 2d86 n LYS 12 N -4.40 -0.23 -0.23 0.12 4.76 -1.22 -0.06 118.16 116.90 2d86 n LYS 12 Ca 0.11 1.11 -0.08 0.00 -2.87 0.00 0.00 58.31 56.58 2d86 n LYS 12 Cb 0.02 -1.64 0.03 0.00 -1.84 0.00 0.00 35.03 31.61 2d86 n LYS 12 CO 0.00 0.00 0.00 -0.56 -1.37 0.00 0.00 177.40 175.47 2d86 h GLN 13 N 0.00 1.00 -0.69 1.97 3.07 -1.68 -3.02 115.11 115.76 2d86 h GLN 13 Ca 0.08 -0.23 0.14 0.00 0.09 0.00 0.00 58.65 58.74 2d86 h GLN 13 Cb 0.21 -0.14 -0.13 0.00 0.08 0.00 0.00 27.48 27.51 2d86 h GLN 13 CO -0.49 0.90 -0.13 0.00 0.09 0.00 0.00 178.83 179.20 2d86 h ALA 15 N 1.68 1.10 0.18 0.00 0.00 -0.73 0.21 119.26 121.71 2d86 h ALA 15 Ca 0.34 0.35 0.01 0.00 0.00 0.00 0.00 54.91 55.61 2d86 h ALA 15 Cb 0.54 0.62 -0.03 0.00 0.00 0.00 0.00 17.79 18.92 2d86 h ALA 15 CO -0.69 -0.55 -0.29 1.96 0.00 0.00 0.00 179.25 179.68 2d86 h GLN 16 N 0.01 -0.53 -0.74 0.00 1.08 -1.09 -2.00 115.11 111.83 2d86 h GLN 16 Ca 0.58 0.04 0.17 0.00 -1.45 0.00 0.00 58.65 57.99 2d86 h GLN 16 Cb 1.17 0.12 -0.12 0.00 -0.05 0.00 0.00 27.48 28.60 2d86 h GLN 16 CO -0.94 -0.35 0.15 2.35 -0.95 0.00 0.00 178.83 179.09 2d86 h TRP 17 N -0.55 0.21 -0.23 2.96 7.01 -0.60 -0.18 115.95 124.57 2d86 h TRP 17 Ca 0.01 0.05 0.03 0.00 2.11 0.00 0.00 58.89 61.09 2d86 h TRP 17 Cb 0.55 0.02 -0.03 0.00 -2.10 0.00 0.00 29.16 27.60 2d86 h TRP 17 CO -0.24 -0.12 0.03 -0.07 -2.79 0.00 0.00 178.44 175.25 2d86 h LEU 18 N 0.23 -0.03 -0.57 0.65 3.38 -0.86 0.38 115.31 118.48 2d86 h LEU 18 Ca 0.42 0.04 0.04 0.00 0.09 0.00 0.00 57.88 58.48 2d86 h LEU 18 Cb 0.73 0.07 -0.05 0.00 0.09 0.00 0.00 40.66 41.50 2d86 h LEU 18 CO -0.55 0.02 0.31 0.40 0.09 0.00 0.00 178.44 178.71 2d86 h ILE 19 N 0.11 0.99 -0.03 1.22 2.04 -0.37 -1.61 117.51 119.85 2d86 h ILE 19 Ca 0.11 -0.21 -0.11 0.00 1.00 0.00 0.00 64.86 65.65 2d86 h ILE 19 Cb 0.12 0.33 -0.01 0.00 -0.74 0.00 0.00 36.82 36.52 2d86 h ILE 19 CO -0.16 0.11 -0.49 0.45 0.00 0.00 0.00 178.15 178.06 2d86 h HIS 20 N 0.60 0.10 0.00 1.37 3.86 -0.72 -2.43 115.15 117.93 2d86 h HIS 20 Ca 0.25 -0.03 0.00 0.00 -1.16 0.00 0.00 60.37 59.43 2d86 h HIS 20 Cb 0.12 -0.02 0.00 0.00 1.06 0.00 0.00 27.41 28.57 2d86 h HIS 20 CO -0.08 0.55 0.00 0.00 0.86 0.00 0.00 177.93 179.26 2d86 n LYS 22 N -1.01 -4.28 0.00 0.00 4.76 -0.91 -4.77 118.16 111.95 2d86 n LYS 22 Ca 0.17 0.57 0.00 0.00 -2.87 0.00 0.00 58.31 56.18 2d86 n LYS 22 Cb 0.08 -4.75 0.00 0.00 -1.84 0.00 0.00 35.03 28.52 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 -3.08 0.00 -4.32 -0.18 0.24 -0.85 -4.89 118.33 105.24 2d86 n VAL 23 Ca -0.19 0.00 -0.21 0.00 -2.04 0.00 0.00 64.34 61.91 2d86 n VAL 23 Cb 0.61 -0.55 -0.13 0.00 -1.47 0.00 0.00 33.84 32.30 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 -2.78 2.21 0.67 1.34 1.43 -1.22 -4.98 118.68 115.34 2d86 s LEU 24 Ca 0.00 -0.53 -0.15 0.00 -1.03 0.00 0.00 54.13 52.42 2d86 s LEU 24 Cb 0.00 -0.65 0.00 0.00 0.03 0.00 0.00 46.19 45.58 2d86 s LEU 24 CO 0.00 0.02 1.11 -2.16 0.23 0.00 0.00 176.35 175.55 2d86 s PRO 25 N -1.39 2.77 0.50 1.29 0.04 -1.26 -4.28 135.00 132.67 2d86 s PRO 25 Ca 0.02 1.37 0.33 0.00 0.04 0.00 0.00 61.00 62.76 2d86 s PRO 25 Cb -0.09 -1.95 1.45 0.00 0.04 0.00 0.00 34.50 33.96 2d86 s PRO 25 CO 0.02 -1.27 1.98 1.79 0.04 0.00 0.00 177.00 179.55 2d86 h THR 26 N -0.05 0.00 -0.22 1.26 1.35 -2.01 -2.28 112.91 110.97 2d86 h THR 26 Ca -0.47 -0.36 0.00 0.00 -0.55 0.00 0.00 66.41 65.04 2d86 h THR 26 Cb 1.25 1.28 0.00 0.00 -1.73 0.00 0.00 68.15 68.95 2d86 h THR 26 CO 0.54 0.00 0.00 -3.20 -0.25 0.00 0.00 175.52 172.61 2d86 n ASN 27 N -2.89 3.31 -4.16 5.36 4.05 -1.26 -5.01 115.26 114.66 2d86 n ASN 27 Ca 0.00 -2.76 -0.35 0.00 0.45 0.00 0.00 54.58 51.92 2d86 n ASN 27 Cb 0.24 -0.43 0.11 0.00 1.23 0.00 0.00 39.78 40.94 2d86 n ASN 27 CO 0.00 0.00 0.00 1.57 -3.05 0.00 0.00 177.26 175.78 2d86 n HIS 28 N -0.46 -1.54 0.04 1.20 -0.00 -0.86 -4.91 115.22 108.69 2d86 n HIS 28 Ca 0.17 0.35 -0.19 0.00 0.46 0.00 0.00 57.72 58.51 2d86 n HIS 28 Cb 0.71 -1.49 -0.13 0.00 -0.12 0.00 0.00 29.99 28.96 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 -1.58 0.39 -0.69 1.57 0.11 -1.97 -3.26 114.38 108.96 2d86 h ARG 29 Ca -0.47 -0.53 0.20 0.00 0.10 0.00 0.00 59.98 59.28 2d86 h ARG 29 Cb 1.37 0.18 -0.03 0.00 1.11 0.00 0.00 29.97 32.60 2d86 h ARG 29 CO 0.31 1.20 0.49 -0.39 0.10 0.00 0.00 179.97 181.68 2d86 h VAL 30 N -0.17 0.66 -0.17 0.08 -1.51 -1.94 0.16 116.25 113.36 2d86 h VAL 30 Ca -0.12 -0.00 -0.00 0.00 -1.23 0.00 0.00 66.70 65.34 2d86 h VAL 30 Cb 1.54 0.65 -0.01 0.00 -2.13 0.00 0.00 31.29 31.34 2d86 h VAL 30 CO 0.15 0.00 0.09 0.71 -1.23 0.00 0.00 177.57 177.30 2d86 h THR 31 N 0.01 1.05 -3.49 7.19 1.35 -1.91 -3.43 112.91 113.69 2d86 h THR 31 Ca 0.33 -0.14 -0.53 0.00 -0.55 0.00 0.00 66.41 65.52 2d86 h THR 31 Cb 1.30 0.83 0.07 0.00 -1.73 0.00 0.00 68.15 68.61 2d86 h THR 31 CO -0.01 0.06 0.78 0.26 -0.25 0.00 0.00 175.52 176.36 2d86 s TRP 32 N -5.21 2.90 0.22 4.73 0.52 0.56 -4.91 118.94 117.75 2d86 s TRP 32 Ca -0.06 1.02 -0.08 0.00 0.02 0.00 0.00 56.10 57.00 2d86 s TRP 32 Cb 0.17 -3.90 0.32 0.00 -1.15 0.00 0.00 33.47 28.91 2d86 s TRP 32 CO 0.70 -2.86 1.74 -0.44 0.02 0.00 0.00 176.95 176.10 2d86 h ASP 33 N 4.55 0.23 -0.80 2.95 5.19 -1.86 -1.29 116.42 125.38 2d86 h ASP 33 Ca -0.47 0.09 0.18 0.00 -0.62 0.00 0.00 57.03 56.20 2d86 h ASP 33 Cb 1.22 0.07 -0.11 0.00 0.18 0.00 0.00 39.33 40.69 2d86 h ASP 33 CO 0.75 0.13 0.28 -1.28 -3.12 0.00 0.00 179.24 176.00 2d86 h SER 34 N 0.42 0.19 -2.99 6.45 0.87 -1.92 -3.42 113.55 113.15 2d86 h SER 34 Ca 0.33 0.14 -0.53 0.00 -1.23 0.00 0.00 61.79 60.50 2d86 h SER 34 Cb 0.43 0.15 0.22 0.00 -0.44 0.00 0.00 62.40 62.76 2d86 h SER 34 CO -0.33 0.01 -0.95 0.00 -0.53 0.00 0.00 176.83 175.03 2d86 n ALA 35 N -2.57 -3.44 -2.18 6.23 0.00 -0.49 -5.03 120.51 113.03 2d86 n ALA 35 Ca 0.17 -0.66 -0.10 0.00 0.00 0.00 0.00 53.44 52.86 2d86 n ALA 35 Cb 0.52 -1.61 -0.10 0.00 0.00 0.00 0.00 19.45 18.26 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 -3.19 0.93 0.23 0.00 -0.21 -1.26 -5.00 119.66 111.16 2d86 s GLN 36 Ca 0.52 -1.41 -0.00 0.00 0.02 0.00 0.00 55.36 54.48 2d86 s GLN 36 Cb -0.20 0.25 0.52 0.00 1.00 0.00 0.00 33.01 34.58 2d86 s GLN 36 CO 0.71 -0.26 1.19 1.33 -2.12 0.00 0.00 175.29 176.14 2d86 n VAL 37 N -0.09 -0.32 -0.08 1.09 0.24 -1.26 -0.29 118.33 117.62 2d86 n VAL 37 Ca -0.06 1.69 -0.09 0.00 -2.04 0.00 0.00 64.34 63.84 2d86 n VAL 37 Cb 0.64 -2.43 -0.06 0.00 -1.47 0.00 0.00 33.84 30.51 2d86 n VAL 37 CO 0.00 0.00 0.00 0.15 -2.14 0.00 0.00 176.83 174.84 2d86 h PHE 38 N 0.00 -1.05 -0.86 6.34 3.57 -1.96 0.32 116.94 123.31 2d86 h PHE 38 Ca 0.44 0.05 0.12 0.00 3.53 0.00 0.00 57.97 62.11 2d86 h PHE 38 Cb 0.85 0.49 -0.13 0.00 2.79 0.00 0.00 35.95 39.95 2d86 h PHE 38 CO -0.44 -0.30 -0.37 -3.47 -2.23 0.00 0.00 178.31 171.50 2d86 n ASP 39 N -4.34 -0.62 0.08 0.41 2.03 0.60 0.21 116.55 114.91 2d86 n ASP 39 Ca -0.02 1.51 0.01 0.00 0.52 0.00 0.00 54.79 56.80 2d86 n ASP 39 Cb 0.21 -0.32 0.32 0.00 -0.72 0.00 0.00 41.12 40.62 2d86 n ASP 39 CO 0.00 0.00 0.00 0.25 -1.92 0.00 0.00 177.20 175.53 2d86 h LEU 40 N 0.00 0.32 -0.29 -2.67 5.85 -1.28 -1.63 115.31 115.61 2d86 h LEU 40 Ca 0.27 -0.08 0.00 0.00 0.84 0.00 0.00 57.88 58.91 2d86 h LEU 40 Cb 0.49 -0.08 0.00 0.00 0.37 0.00 0.00 40.66 41.43 2d86 h LEU 40 CO -0.85 0.50 0.00 0.00 -0.34 0.00 0.00 178.44 177.75 2d86 n ALA 41 N -2.48 2.00 -0.09 1.25 0.00 0.56 -3.55 120.51 118.21 2d86 n ALA 41 Ca -0.00 0.02 -0.20 0.00 0.00 0.00 0.00 53.44 53.26 2d86 n ALA 41 Cb 0.31 -1.43 -0.12 0.00 0.00 0.00 0.00 19.45 18.21 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 0.02 0.00 0.00 4.20 0.11 -1.35 115.11 118.09 2d86 h GLN 42 Ca 0.00 -0.03 0.00 0.00 0.06 0.00 0.00 58.65 58.68 2d86 h GLN 42 Cb 0.55 0.01 0.00 0.00 0.30 0.00 0.00 27.48 28.34 2d86 h GLN 42 CO 0.00 1.01 0.14 -2.37 -0.67 0.00 0.00 178.83 176.94 2d86 n THR 43 N -4.44 0.94 -0.02 -0.54 5.66 -0.94 -0.95 114.28 113.98 2d86 n THR 43 Ca -0.26 0.71 0.00 0.00 -3.05 0.00 0.00 64.05 61.45 2d86 n THR 43 Cb 0.64 -1.71 -0.06 0.00 -1.55 0.00 0.00 70.33 67.66 2d86 n THR 43 CO 0.00 0.00 0.00 0.18 -3.05 0.00 0.00 175.07 172.20 2d86 n LEU 44 N -2.05 0.00 -0.41 1.09 4.77 -1.23 -4.46 117.00 114.70 2d86 n LEU 44 Ca -0.01 0.00 0.33 0.00 -0.03 0.00 0.00 56.01 56.30 2d86 n LEU 44 Cb 0.16 0.09 0.61 0.00 -2.33 0.00 0.00 43.42 41.96 2d86 n LEU 44 CO 0.07 0.09 1.23 -0.09 -1.33 0.00 0.00 177.39 177.35 2d86 h ARG 45 N 0.00 0.15 -0.29 3.23 2.43 0.16 0.58 114.38 120.64 2d86 h ARG 45 Ca -0.10 -0.01 -0.04 0.00 -0.81 0.00 0.00 59.98 59.03 2d86 h ARG 45 Cb 0.91 -0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 30.41 2d86 h ARG 45 CO 0.01 0.10 0.04 0.38 -1.51 0.00 0.00 179.97 178.99 2d86 h ASP 46 N 0.16 0.46 0.00 -3.80 2.03 -1.81 -3.42 116.42 110.04 2d86 h ASP 46 Ca 0.76 -0.27 0.00 0.00 -0.73 0.00 0.00 57.03 56.80 2d86 h ASP 46 Cb 2.30 -0.12 0.00 0.00 -0.83 0.00 0.00 39.33 40.67 2d86 h ASP 46 CO -0.39 0.61 0.00 0.61 -1.03 0.00 0.00 179.24 179.04 2d86 n GLY 47 N -0.45 1.60 0.12 7.15 0.00 0.20 -4.33 105.19 109.48 2d86 n GLY 47 Ca -0.03 -0.06 -0.16 0.00 0.00 0.00 0.00 46.02 45.78 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 -1.47 1.36 -0.01 1.61 0.31 -1.26 -4.37 118.33 114.51 2d86 n VAL 48 Ca 0.00 -0.57 -0.10 0.00 -0.01 0.00 0.00 64.34 63.66 2d86 n VAL 48 Cb 0.02 -1.22 -0.08 0.00 -0.91 0.00 0.00 33.84 31.65 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 -0.08 -0.75 7.52 5.85 -1.88 -3.31 115.31 122.65 2d86 h LEU 49 Ca -0.53 -0.50 0.09 0.00 0.84 0.00 0.00 57.88 57.78 2d86 h LEU 49 Cb 1.88 0.02 -0.11 0.00 0.37 0.00 0.00 40.66 42.82 2d86 h LEU 49 CO -0.07 0.60 -0.36 0.18 -0.34 0.00 0.00 178.44 178.44 2d86 n LEU 50 N -4.80 -0.63 -0.30 2.25 4.77 -1.26 0.20 117.00 117.23 2d86 n LEU 50 Ca -0.07 1.32 0.10 0.00 -0.03 0.00 0.00 56.01 57.34 2d86 n LEU 50 Cb 0.29 -0.24 0.27 0.00 -2.33 0.00 0.00 43.42 41.41 2d86 n LEU 50 CO 0.24 -1.14 1.07 0.00 -1.33 0.00 0.00 177.39 176.24 2d86 h GLN 52 N 0.51 -0.07 -0.94 0.00 4.20 0.22 -2.26 115.11 116.77 2d86 h GLN 52 Ca 0.52 0.01 0.08 0.00 0.06 0.00 0.00 58.65 59.32 2d86 h GLN 52 Cb 0.87 0.02 -0.11 0.00 0.30 0.00 0.00 27.48 28.56 2d86 h GLN 52 CO -0.45 -0.05 -0.55 -0.11 -0.67 0.00 0.00 178.83 177.00 2d86 n LEU 53 N -5.22 -1.00 -0.36 1.46 7.94 -0.38 0.42 117.00 119.87 2d86 n LEU 53 Ca -0.04 1.72 0.01 0.00 -1.11 0.00 0.00 56.01 56.60 2d86 n LEU 53 Cb 0.14 -0.24 0.16 0.00 0.53 0.00 0.00 43.42 44.01 2d86 n LEU 53 CO 0.25 -1.39 1.26 -0.07 -1.11 0.00 0.00 177.39 176.34 2d86 h LEU 54 N 0.00 1.03 -2.04 -1.96 3.38 -1.51 0.18 115.31 114.38 2d86 h LEU 54 Ca 0.15 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.11 2d86 h LEU 54 Cb 0.39 -0.22 -0.00 0.00 0.09 0.00 0.00 40.66 40.92 2d86 h LEU 54 CO -0.88 0.67 -0.08 0.78 0.09 0.00 0.00 178.44 179.02 2d86 h ASN 55 N 1.18 0.00 0.17 -0.43 2.35 0.57 -0.16 115.58 119.27 2d86 h ASN 55 Ca 0.41 0.00 -0.23 0.00 -0.55 0.00 0.00 56.30 55.93 2d86 h ASN 55 Cb 0.11 0.00 0.03 0.00 0.05 0.00 0.00 38.32 38.51 2d86 h ASN 55 CO -0.16 0.08 -1.01 0.78 -1.65 0.00 0.00 177.43 175.47 2d86 h ASN 56 N 0.00 0.57 0.18 5.81 2.35 0.18 -3.38 115.58 121.29 2d86 h ASN 56 Ca -0.00 -0.94 -0.01 0.00 -0.55 0.00 0.00 56.30 54.80 2d86 h ASN 56 Cb 0.29 -0.19 0.00 0.00 0.05 0.00 0.00 38.32 38.48 2d86 h ASN 56 CO 0.01 1.49 -0.09 -0.07 -1.65 0.00 0.00 177.43 177.12 2d86 h LEU 57 N -0.23 -0.21 -9.25 1.61 3.38 -1.04 -3.46 115.31 106.11 2d86 h LEU 57 Ca -0.18 -0.32 -0.63 0.00 0.09 0.00 0.00 57.88 56.85 2d86 h LEU 57 Cb 1.79 0.05 -0.15 0.00 0.09 0.00 0.00 40.66 42.44 2d86 h LEU 57 CO 0.18 0.28 -0.75 -0.60 0.09 0.00 0.00 178.44 177.64 2d86 s ARG 58 N -3.94 1.88 0.18 1.13 3.52 -0.10 -4.85 118.95 116.77 2d86 s ARG 58 Ca -0.14 -1.42 -0.12 0.00 -0.13 0.00 0.00 55.73 53.92 2d86 s ARG 58 Cb 0.01 -2.02 -0.07 0.00 -1.56 0.00 0.00 34.95 31.31 2d86 s ARG 58 CO 0.53 0.40 0.55 0.00 -0.81 0.00 0.00 175.30 175.97 2d86 s ALA 59 N -1.86 3.57 -1.69 6.12 0.00 -1.26 -4.05 121.76 122.60 2d86 s ALA 59 Ca 0.25 -0.19 -0.01 0.00 0.00 0.00 0.00 51.96 52.01 2d86 s ALA 59 Cb -0.08 -2.49 0.00 0.00 0.00 0.00 0.00 23.12 20.56 2d86 s ALA 59 CO 0.14 0.48 0.10 0.72 0.00 0.00 0.00 175.76 177.20 2d86 n HIS 60 N 0.45 -1.12 0.03 0.00 8.25 -1.26 -4.89 115.22 116.68 2d86 n HIS 60 Ca -0.03 0.09 -0.19 0.00 -0.26 0.00 0.00 57.72 57.32 2d86 n HIS 60 Cb 0.52 -3.96 -0.11 0.00 1.12 0.00 0.00 29.99 27.55 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 -0.23 0.67 -4.01 0.41 0.02 -1.85 -3.47 113.55 105.08 2d86 h SER 61 Ca -0.48 -0.78 -0.13 0.00 -0.84 0.00 0.00 61.79 59.55 2d86 h SER 61 Cb 1.35 -0.21 -0.24 0.00 0.14 0.00 0.00 62.40 63.45 2d86 h SER 61 CO 0.56 1.37 -0.29 -0.63 -1.14 0.00 0.00 176.83 176.70 2d86 s ILE 62 N -3.13 0.01 -0.43 3.27 1.01 -1.26 -4.76 121.20 115.90 2d86 s ILE 62 Ca -0.12 -0.06 -0.21 0.00 0.00 0.00 0.00 60.65 60.26 2d86 s ILE 62 Cb 0.04 -0.52 0.02 0.00 0.01 0.00 0.00 42.46 42.02 2d86 s ILE 62 CO 0.86 -0.03 0.67 0.21 0.00 0.00 0.00 174.94 176.65 2d86 s ASN 63 N -0.02 6.36 0.38 3.58 2.47 -1.26 -4.92 114.94 121.53 2d86 s ASN 63 Ca -0.02 -0.22 0.16 0.00 0.42 0.00 0.00 52.86 53.20 2d86 s ASN 63 Cb -0.03 -2.33 1.04 0.00 -1.45 0.00 0.00 41.25 38.48 2d86 s ASN 63 CO 0.01 -0.78 1.76 -0.07 -3.72 0.00 0.00 177.10 174.30 2d86 h LEU 64 N 9.74 0.51 -1.06 3.21 3.38 -1.99 0.45 115.31 129.56 2d86 h LEU 64 Ca -0.25 0.09 -0.06 0.00 0.09 0.00 0.00 57.88 57.75 2d86 h LEU 64 Cb 1.10 0.01 -0.02 0.00 0.09 0.00 0.00 40.66 41.84 2d86 h LEU 64 CO 0.90 0.10 0.03 0.11 0.09 0.00 0.00 178.44 179.67 2d86 h LYS 65 N 0.45 0.69 0.00 1.13 1.79 -2.02 -1.96 116.57 116.65 2d86 h LYS 65 Ca 0.60 -0.16 -0.02 0.00 -2.18 0.00 0.00 60.65 58.89 2d86 h LYS 65 Cb 1.41 -0.09 -0.00 0.00 -1.58 0.00 0.00 32.23 31.97 2d86 h LYS 65 CO -0.34 0.69 -0.09 0.93 -1.08 0.00 0.00 179.45 179.57 2d86 h GLU 66 N 0.66 0.00 -5.74 3.15 5.08 -0.51 -3.42 114.58 113.79 2d86 h GLU 66 Ca 0.14 0.00 -0.66 0.00 -1.00 0.00 0.00 59.36 57.83 2d86 h GLU 66 Cb 0.37 0.00 -0.15 0.00 0.50 0.00 0.00 28.75 29.47 2d86 h GLU 66 CO 0.01 0.09 -0.60 0.96 -1.00 0.00 0.00 179.01 178.47 2d86 s ILE 67 N -3.81 4.48 -0.47 3.13 -4.36 -0.74 -5.01 121.20 114.42 2d86 s ILE 67 Ca -0.00 -0.17 -0.27 0.00 -0.26 0.00 0.00 60.65 59.94 2d86 s ILE 67 Cb 0.11 -2.92 -0.03 0.00 1.25 0.00 0.00 42.46 40.86 2d86 s ILE 67 CO 0.56 0.57 1.96 0.20 0.24 0.00 0.00 174.94 178.47 2d86 s ASN 68 N -0.55 5.35 0.07 4.36 0.01 -1.26 -4.85 114.94 118.08 2d86 s ASN 68 Ca 0.10 0.90 -0.18 0.00 -0.71 0.00 0.00 52.86 52.97 2d86 s ASN 68 Cb -0.12 -2.52 -0.11 0.00 0.41 0.00 0.00 41.25 38.91 2d86 s ASN 68 CO 0.02 -2.21 1.41 -0.07 -1.51 0.00 0.00 177.10 174.75 2d86 h LEU 69 N 15.94 0.52 -7.36 0.60 3.38 -1.92 -3.36 115.31 123.11 2d86 h LEU 69 Ca -0.29 -0.44 -0.71 0.00 0.09 0.00 0.00 57.88 56.53 2d86 h LEU 69 Cb 1.19 -0.15 -0.35 0.00 0.09 0.00 0.00 40.66 41.44 2d86 h LEU 69 CO 1.13 0.85 -0.10 0.00 0.09 0.00 0.00 178.44 180.40 2d86 s ARG 70 N -4.48 3.24 0.09 1.13 1.70 -1.26 -4.89 118.95 114.47 2d86 s ARG 70 Ca -0.13 -3.19 -0.16 0.00 -0.47 0.00 0.00 55.73 51.78 2d86 s ARG 70 Cb 0.07 -3.96 -0.09 0.00 -0.57 0.00 0.00 34.95 30.40 2d86 s ARG 70 CO 0.78 -1.26 1.41 -1.00 -1.08 0.00 0.00 175.30 174.15 2d86 h PRO 71 N 6.16 0.64 -2.41 3.89 0.13 -1.98 -3.48 132.00 134.95 2d86 h PRO 71 Ca 0.14 -0.34 -0.20 0.00 -0.87 0.00 0.00 66.00 64.74 2d86 h PRO 71 Cb 0.83 0.01 0.03 0.00 0.13 0.00 0.00 31.00 32.00 2d86 h PRO 71 CO 0.84 0.94 -0.30 1.04 -0.23 0.00 0.00 178.00 180.29 2d86 n GLN 72 N -4.32 -2.36 -2.78 0.86 6.02 -1.26 -3.49 117.38 110.04 2d86 n GLN 72 Ca -0.04 0.45 -0.10 0.00 -0.01 0.00 0.00 57.00 57.30 2d86 n GLN 72 Cb 0.45 -4.36 0.05 0.00 1.02 0.00 0.00 30.24 27.40 2d86 n GLN 72 CO 0.00 0.00 0.00 -1.33 -1.01 0.00 0.00 177.06 174.72 2d86 n MET 73 N -2.34 -3.37 -3.89 -1.09 2.81 -1.26 -5.02 117.12 102.96 2d86 n MET 73 Ca -0.06 0.51 -0.36 0.00 -1.81 0.00 0.00 57.70 55.98 2d86 n MET 73 Cb 0.56 -4.41 -0.12 0.00 -0.71 0.00 0.00 33.22 28.54 2d86 n MET 73 CO 0.00 0.00 0.00 -1.54 1.51 0.00 0.00 175.97 175.94 2d86 s SER 74 N -3.68 5.15 0.02 7.83 1.04 -1.23 -5.02 113.70 117.80 2d86 s SER 74 Ca 0.06 -0.15 -0.12 0.00 0.48 0.00 0.00 55.95 56.22 2d86 s SER 74 Cb -0.01 -1.91 -0.06 0.00 0.10 0.00 0.00 66.02 64.14 2d86 s SER 74 CO 0.44 0.03 1.09 -0.61 0.98 0.00 0.00 173.24 175.16 2d86 h GLN 75 N 7.76 -0.40 -0.94 4.02 4.15 -1.95 0.60 115.11 128.36 2d86 h GLN 75 Ca -0.37 0.03 0.28 0.00 0.77 0.00 0.00 58.65 59.35 2d86 h GLN 75 Cb 1.18 0.09 -0.16 0.00 0.21 0.00 0.00 27.48 28.80 2d86 h GLN 75 CO 0.61 -0.27 0.24 0.74 -1.93 0.00 0.00 178.83 178.22 2d86 h PHE 76 N -0.44 0.33 0.00 3.99 0.04 -1.99 0.33 116.94 119.20 2d86 h PHE 76 Ca -0.04 0.05 0.00 0.00 2.80 0.00 0.00 57.97 60.78 2d86 h PHE 76 Cb 0.32 0.01 0.00 0.00 2.20 0.00 0.00 35.95 38.48 2d86 h PHE 76 CO 0.14 -0.32 0.00 1.28 -0.60 0.00 0.00 178.31 178.81 2d86 n LEU 77 N -5.30 0.00 -0.27 1.54 4.77 -1.17 -2.25 117.00 114.31 2d86 n LEU 77 Ca 0.25 0.71 0.01 0.00 -0.03 0.00 0.00 56.01 56.95 2d86 n LEU 77 Cb 0.81 -0.50 0.05 0.00 -2.33 0.00 0.00 43.42 41.46 2d86 n LEU 77 CO 0.02 -0.50 0.44 0.00 -1.33 0.00 0.00 177.39 176.01 2d86 h LEU 79 N 0.00 0.91 0.69 0.00 3.38 -1.05 -2.74 115.31 116.49 2d86 h LEU 79 Ca 0.28 -0.01 -0.03 0.00 0.09 0.00 0.00 57.88 58.20 2d86 h LEU 79 Cb 0.46 -0.21 0.01 0.00 0.09 0.00 0.00 40.66 41.00 2d86 h LEU 79 CO -0.72 0.64 -0.33 0.50 0.09 0.00 0.00 178.44 178.61 2d86 h LYS 80 N 1.07 -0.90 -0.37 1.13 3.11 0.34 -3.09 116.57 117.86 2d86 h LYS 80 Ca 0.32 0.06 0.04 0.00 -2.81 0.00 0.00 60.65 58.26 2d86 h LYS 80 Cb -0.05 0.20 -0.06 0.00 -1.00 0.00 0.00 32.23 31.33 2d86 h LYS 80 CO -0.09 -0.59 -0.34 -0.91 -2.81 0.00 0.00 179.45 174.70 2d86 h ASN 81 N -0.95 -1.19 -0.79 4.20 2.35 -0.88 -1.05 115.58 117.27 2d86 h ASN 81 Ca -0.10 0.17 0.11 0.00 -0.55 0.00 0.00 56.30 55.93 2d86 h ASN 81 Cb 0.72 0.50 -0.12 0.00 0.05 0.00 0.00 38.32 39.47 2d86 h ASN 81 CO 0.16 -0.21 -0.34 -0.38 -1.65 0.00 0.00 177.43 175.01 2d86 n ILE 82 N -4.33 -0.44 -0.27 2.81 5.41 -1.05 0.17 119.36 121.67 2d86 n ILE 82 Ca -0.01 1.86 0.06 0.00 1.00 0.00 0.00 62.75 65.66 2d86 n ILE 82 Cb 0.19 -2.43 0.20 0.00 -0.71 0.00 0.00 39.64 36.89 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 0.50 -0.86 0.38 3.08 -1.12 -0.18 114.38 116.17 2d86 h ARG 83 Ca 0.25 -0.03 0.14 0.00 0.07 0.00 0.00 59.98 60.41 2d86 h ARG 83 Cb 0.45 -0.11 -0.09 0.00 0.08 0.00 0.00 29.97 30.29 2d86 h ARG 83 CO -0.78 0.33 0.46 1.15 -1.07 0.00 0.00 179.97 180.06 2d86 h THR 84 N 0.51 0.76 -0.32 2.04 2.02 0.23 -0.30 112.91 117.86 2d86 h THR 84 Ca 0.43 -0.23 -0.12 0.00 0.77 0.00 0.00 66.41 67.26 2d86 h THR 84 Cb 0.64 0.03 -0.01 0.00 -1.74 0.00 0.00 68.15 67.07 2d86 h THR 84 CO -0.39 0.12 -0.27 0.15 0.37 0.00 0.00 175.52 175.50 2d86 h PHE 85 N 0.67 0.90 0.00 3.16 3.04 -0.68 -2.69 116.94 121.34 2d86 h PHE 85 Ca 0.46 -0.26 -0.01 0.00 3.98 0.00 0.00 57.97 62.14 2d86 h PHE 85 Cb 0.62 -0.19 -0.00 0.00 2.56 0.00 0.00 35.95 38.94 2d86 h PHE 85 CO -0.08 1.01 -0.06 -0.07 -2.02 0.00 0.00 178.31 177.09 2d86 h LEU 86 N 0.52 0.00 -0.09 0.59 3.38 -0.41 -2.17 115.31 117.14 2d86 h LEU 86 Ca 0.06 0.00 -0.15 0.00 0.09 0.00 0.00 57.88 57.88 2d86 h LEU 86 Cb 0.84 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.60 2d86 h LEU 86 CO 0.07 0.06 -0.52 0.74 0.09 0.00 0.00 178.44 178.88 2d86 h THR 87 N 0.00 1.37 -0.85 0.22 2.02 -0.93 -3.26 112.91 111.48 2d86 h THR 87 Ca -0.00 -1.85 -0.00 0.00 0.77 0.00 0.00 66.41 65.32 2d86 h THR 87 Cb 0.11 2.23 -0.04 0.00 -1.74 0.00 0.00 68.15 68.71 2d86 h THR 87 CO 0.01 0.55 0.51 0.00 0.37 0.00 0.00 175.52 176.97 2d86 h ALA 88 N 0.46 1.08 -0.10 6.16 0.00 -1.11 0.30 119.26 126.05 2d86 h ALA 88 Ca -0.04 -0.09 0.03 0.00 0.00 0.00 0.00 54.91 54.81 2d86 h ALA 88 Cb 1.17 -0.34 -0.00 0.00 0.00 0.00 0.00 17.79 18.61 2d86 h ALA 88 CO 0.11 0.54 0.21 0.00 0.00 0.00 0.00 179.25 180.11 2d86 n GLU 91 N -1.93 0.51 -0.01 0.00 -0.58 0.96 -3.45 120.64 116.13 2d86 n GLU 91 Ca -0.02 0.38 -0.13 0.00 -0.42 0.00 0.00 57.16 56.97 2d86 n GLU 91 Cb 0.35 -1.57 -0.10 0.00 -0.57 0.00 0.00 31.44 29.55 2d86 n GLU 91 CO 0.00 0.00 0.00 1.15 -0.48 0.00 0.00 177.13 177.80 2d86 h THR 92 N -1.00 1.36 0.00 2.62 2.02 0.77 -3.40 112.91 115.29 2d86 h THR 92 Ca -0.10 -1.07 0.00 0.00 0.77 0.00 0.00 66.41 66.01 2d86 h THR 92 Cb 0.89 2.08 0.00 0.00 -1.74 0.00 0.00 68.15 69.38 2d86 h THR 92 CO -0.06 0.28 -0.31 0.49 0.37 0.00 0.00 175.52 176.29 2d86 n PHE 93 N -4.86 0.49 0.00 3.16 3.01 -1.02 -5.05 117.46 113.19 2d86 n PHE 93 Ca -0.08 0.21 0.00 0.00 1.01 0.00 0.00 57.45 58.59 2d86 n PHE 93 Cb 0.24 -0.53 0.00 0.00 -0.01 0.00 0.00 39.48 39.18 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 1.66 0.71 3.97 1.37 0.00 0.36 -4.94 105.19 108.32 2d86 n GLY 94 Ca -0.04 -0.27 -0.22 0.00 0.00 0.00 0.00 46.02 45.49 2d86 n GLY 94 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2d86 s MET 95 N 0.01 2.68 -0.11 1.61 -1.94 0.68 -4.91 119.30 117.32 2d86 s MET 95 Ca 0.00 -0.71 -0.30 0.00 -1.71 0.00 0.00 55.69 52.98 2d86 s MET 95 Cb 0.00 -2.51 -0.01 0.00 2.01 0.00 0.00 34.83 34.32 2d86 s MET 95 CO 0.00 -0.59 1.09 1.03 -0.01 0.00 0.00 175.02 176.53 2d86 s ARG 96 N -4.70 4.37 0.25 2.03 1.81 -1.26 -4.60 118.95 116.84 2d86 s ARG 96 Ca 0.55 1.49 0.22 0.00 -1.72 0.00 0.00 55.73 56.27 2d86 s ARG 96 Cb -0.10 -3.58 0.97 0.00 -0.45 0.00 0.00 34.95 31.80 2d86 s ARG 96 CO 0.38 -0.42 1.68 1.17 -0.68 0.00 0.00 175.30 177.43 2d86 n LYS 97 N 5.36 0.17 0.00 3.54 4.81 -1.26 -1.84 118.16 128.94 2d86 n LYS 97 Ca 0.10 0.44 0.12 0.00 -0.87 0.00 0.00 58.31 58.11 2d86 n LYS 97 Cb 0.47 -1.86 0.56 0.00 0.02 0.00 0.00 35.03 34.22 2d86 n LYS 97 CO 0.00 0.00 0.00 0.45 1.17 0.00 0.00 177.40 179.02 2d86 n SER 98 N -2.19 0.00 -0.05 3.14 2.88 -1.26 -3.27 113.62 112.87 2d86 n SER 98 Ca 0.02 0.30 -0.05 0.00 -1.33 0.00 0.00 58.87 57.80 2d86 n SER 98 Cb 0.20 -0.43 -0.09 0.00 -0.75 0.00 0.00 64.21 63.14 2d86 n SER 98 CO 0.00 0.00 0.00 -1.84 -1.23 0.00 0.00 175.04 171.97 2d86 n GLU 99 N -1.43 2.12 -0.75 -1.46 0.28 -0.77 -5.03 120.64 113.62 2d86 n GLU 99 Ca 0.08 -0.01 -0.32 0.00 -0.16 0.00 0.00 57.16 56.75 2d86 n GLU 99 Cb 0.26 -1.29 0.14 0.00 1.43 0.00 0.00 31.44 31.98 2d86 n GLU 99 CO 0.00 0.00 0.00 1.28 -0.16 0.00 0.00 177.13 178.25 2d86 n LEU 100 N -2.40 0.69 -4.95 -1.84 4.77 -1.16 -4.76 117.00 107.34 2d86 n LEU 100 Ca -0.18 0.33 -0.23 0.00 -0.03 0.00 0.00 56.01 55.90 2d86 n LEU 100 Cb 0.85 -1.28 0.02 0.00 -2.33 0.00 0.00 43.42 40.68 2d86 n LEU 100 CO 0.24 -3.18 0.32 0.72 -1.33 0.00 0.00 177.39 174.16 2d86 s PHE 101 N -2.46 3.18 0.03 -1.77 -0.12 -1.26 -5.04 117.98 110.54 2d86 s PHE 101 Ca 0.60 0.25 -0.21 0.00 -0.05 0.00 0.00 56.93 57.52 2d86 s PHE 101 Cb -0.21 -2.42 -0.06 0.00 -0.63 0.00 0.00 43.02 39.70 2d86 s PHE 101 CO 0.65 -0.48 0.62 -2.00 -0.05 0.00 0.00 175.22 173.96 2d86 s GLU 102 N -4.63 4.33 0.27 1.99 2.56 -1.26 -4.97 118.70 116.99 2d86 s GLU 102 Ca 0.50 0.80 -0.05 0.00 0.00 0.00 0.00 54.97 56.22 2d86 s GLU 102 Cb -0.10 -3.32 0.52 0.00 2.00 0.00 0.00 34.13 33.23 2d86 s GLU 102 CO 0.39 0.43 1.60 0.00 -0.56 0.00 0.00 175.26 177.11 2d86 h ALA 103 N 5.34 0.84 0.46 6.30 0.00 -1.95 -0.57 119.26 129.68 2d86 h ALA 103 Ca -0.46 0.31 -0.02 0.00 0.00 0.00 0.00 54.91 54.73 2d86 h ALA 103 Cb 1.20 0.56 0.00 0.00 0.00 0.00 0.00 17.79 19.56 2d86 h ALA 103 CO 0.68 -0.46 -0.22 0.35 0.00 0.00 0.00 179.25 179.60 2d86 h PHE 104 N 0.04 -0.58 -1.49 0.00 3.57 -1.94 -0.78 116.94 115.77 2d86 h PHE 104 Ca 0.48 -0.01 0.46 0.00 3.53 0.00 0.00 57.97 62.43 2d86 h PHE 104 Cb 0.86 0.19 -0.09 0.00 2.79 0.00 0.00 35.95 39.70 2d86 h PHE 104 CO -0.53 -0.29 1.03 -3.47 -2.23 0.00 0.00 178.31 172.82 2d86 n ASP 105 N -5.30 0.09 -0.08 0.41 2.03 -0.25 0.59 116.55 114.04 2d86 n ASP 105 Ca -0.11 1.03 -0.22 0.00 0.52 0.00 0.00 54.79 56.01 2d86 n ASP 105 Cb 0.29 -0.51 -0.12 0.00 -0.72 0.00 0.00 41.12 40.06 2d86 n ASP 105 CO 0.00 0.00 0.00 0.25 -1.92 0.00 0.00 177.20 175.53 2d86 h LEU 106 N 0.00 0.11 0.05 -2.67 5.85 -1.17 0.27 115.31 117.74 2d86 h LEU 106 Ca 0.80 -0.62 0.01 0.00 0.84 0.00 0.00 57.88 58.91 2d86 h LEU 106 Cb 2.92 -0.03 -0.02 0.00 0.37 0.00 0.00 40.66 43.90 2d86 h LEU 106 CO -0.19 1.59 -0.24 0.15 -0.34 0.00 0.00 178.44 179.40 2d86 h PHE 107 N -0.73 -0.71 0.00 1.25 3.57 0.17 -0.45 116.94 120.03 2d86 h PHE 107 Ca -0.37 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.15 2d86 h PHE 107 Cb 1.49 0.30 0.00 0.00 2.79 0.00 0.00 35.95 40.53 2d86 h PHE 107 CO 0.09 -0.27 0.00 -3.47 -2.23 0.00 0.00 178.31 172.43 2d86 n ASP 108 N -3.83 0.00 -3.54 0.41 2.03 -0.25 -4.88 116.55 106.49 2d86 n ASP 108 Ca -0.04 -0.24 -0.20 0.00 0.52 0.00 0.00 54.79 54.83 2d86 n ASP 108 Cb 0.19 -0.18 0.07 0.00 -0.72 0.00 0.00 41.12 40.48 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 -1.18 -4.96 0.00 5.18 0.31 -0.18 -4.96 118.33 112.54 2d86 n VAL 109 Ca 0.12 -0.38 0.00 0.00 -0.01 0.00 0.00 64.34 64.06 2d86 n VAL 109 Cb 0.13 -4.48 0.00 0.00 -0.91 0.00 0.00 33.84 28.58 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 -4.35 0.00 -3.88 5.55 5.12 0.93 -4.67 116.66 115.36 2d86 n ARG 110 Ca -0.22 0.30 -0.33 0.00 -1.93 0.00 0.00 57.85 55.67 2d86 n ARG 110 Cb 0.64 -1.04 -0.13 0.00 -1.16 0.00 0.00 32.46 30.77 2d86 n ARG 110 CO 0.00 0.00 0.00 0.34 -1.93 0.00 0.00 177.63 176.04 2d86 s ASP 111 N -2.11 4.82 0.26 0.55 -1.08 -1.21 -4.94 116.67 112.96 2d86 s ASP 111 Ca 0.00 -2.58 0.02 0.00 -0.52 0.00 0.00 52.55 49.47 2d86 s ASP 111 Cb 0.00 -1.72 0.34 0.00 -1.46 0.00 0.00 42.92 40.08 2d86 s ASP 111 CO 0.00 -0.36 1.67 0.15 0.52 0.00 0.00 175.17 177.15 2d86 h PHE 112 N 7.19 0.54 -0.90 -5.34 3.57 -1.83 -2.95 116.94 117.21 2d86 h PHE 112 Ca -0.06 -0.14 0.24 0.00 3.53 0.00 0.00 57.97 61.54 2d86 h PHE 112 Cb 0.97 -0.12 -0.05 0.00 2.79 0.00 0.00 35.95 39.53 2d86 h PHE 112 CO 0.55 0.75 0.63 0.78 -2.23 0.00 0.00 178.31 178.79 2d86 h GLY 113 N 1.08 0.39 1.40 2.40 0.00 -1.98 0.21 103.07 106.57 2d86 h GLY 113 Ca 0.05 -0.08 -0.13 0.00 0.00 0.00 0.00 47.33 47.17 2d86 h GLY 113 CO 0.06 -0.01 -0.35 0.50 0.00 0.00 0.00 176.54 176.74 2d86 h LYS 114 N 0.17 0.67 -0.06 4.80 1.57 -1.95 -2.41 116.57 119.36 2d86 h LYS 114 Ca 0.45 -0.32 -0.18 0.00 -1.87 0.00 0.00 60.65 58.74 2d86 h LYS 114 Cb 1.50 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 33.80 2d86 h LYS 114 CO -0.09 0.92 -0.73 0.28 -0.57 0.00 0.00 179.45 179.27 2d86 h VAL 115 N 0.56 1.40 0.16 0.50 2.07 -0.75 -3.15 116.25 117.04 2d86 h VAL 115 Ca 0.06 -2.18 -0.01 0.00 0.82 0.00 0.00 66.70 65.39 2d86 h VAL 115 Cb 0.86 2.15 0.00 0.00 -1.52 0.00 0.00 31.29 32.78 2d86 h VAL 115 CO 0.07 0.65 -0.08 0.40 0.02 0.00 0.00 177.57 178.64 2d86 h ILE 116 N 0.22 0.96 -0.62 4.57 2.04 -1.13 -3.16 117.51 120.39 2d86 h ILE 116 Ca -0.03 -0.57 0.13 0.00 1.00 0.00 0.00 64.86 65.39 2d86 h ILE 116 Cb 1.29 1.31 -0.10 0.00 -0.74 0.00 0.00 36.82 38.58 2d86 h ILE 116 CO 0.12 0.13 0.05 -0.08 0.00 0.00 0.00 178.15 178.38 2d86 h GLU 117 N -0.49 0.16 -0.93 2.37 4.57 -1.50 -0.74 114.58 118.01 2d86 h GLU 117 Ca -0.02 -0.01 0.26 0.00 -1.18 0.00 0.00 59.36 58.41 2d86 h GLU 117 Cb 0.38 -0.04 -0.17 0.00 -0.16 0.00 0.00 28.75 28.77 2d86 h GLU 117 CO 0.04 0.11 0.13 1.15 -1.18 0.00 0.00 179.01 179.25 2d86 h THR 118 N 0.17 0.14 0.00 0.32 2.02 -1.50 1.40 112.91 115.45 2d86 h THR 118 Ca 0.33 -0.03 -0.10 0.00 0.77 0.00 0.00 66.41 67.39 2d86 h THR 118 Cb 0.53 0.06 -0.01 0.00 -1.74 0.00 0.00 68.15 66.98 2d86 h THR 118 CO -0.49 0.01 -0.46 -0.07 0.37 0.00 0.00 175.52 174.88 2d86 h LEU 119 N 0.08 0.00 -1.73 2.58 3.38 -1.20 -2.22 115.31 116.19 2d86 h LEU 119 Ca 0.59 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.54 2d86 h LEU 119 Cb 1.23 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.97 2d86 h LEU 119 CO -0.80 0.46 0.04 0.28 0.09 0.00 0.00 178.44 178.50 2d86 h SER 120 N 0.00 0.18 0.09 -0.43 0.02 0.22 -2.59 113.55 111.04 2d86 h SER 120 Ca -0.00 -0.01 -0.27 0.00 -0.84 0.00 0.00 61.79 60.67 2d86 h SER 120 Cb 0.83 -0.05 -0.01 0.00 0.14 0.00 0.00 62.40 63.32 2d86 h SER 120 CO 0.06 0.19 -1.40 0.03 -1.14 0.00 0.00 176.83 174.57 2d86 h ARG 121 N 0.21 0.19 -0.49 3.45 3.08 -1.18 -3.39 114.38 116.24 2d86 h ARG 121 Ca 0.05 -0.32 0.09 0.00 0.07 0.00 0.00 59.98 59.87 2d86 h ARG 121 Cb 0.08 0.12 -0.10 0.00 0.08 0.00 0.00 29.97 30.15 2d86 h ARG 121 CO -0.00 1.15 -0.38 1.25 -1.07 0.00 0.00 179.97 180.92 2d86 h LEU 122 N -0.43 -1.28 -0.99 3.04 5.85 -1.24 0.66 115.31 120.94 2d86 h LEU 122 Ca -0.32 0.22 0.34 0.00 0.84 0.00 0.00 57.88 58.96 2d86 h LEU 122 Cb 1.67 0.59 -0.18 0.00 0.37 0.00 0.00 40.66 43.11 2d86 h LEU 122 CO 0.00 -0.33 0.26 -1.54 -0.34 0.00 0.00 178.44 176.49 2d86 n SER 123 N -5.42 0.10 -0.30 1.25 3.41 -0.99 0.10 113.62 111.77 2d86 n SER 123 Ca 0.02 1.66 0.13 0.00 -0.26 0.00 0.00 58.87 60.42 2d86 n SER 123 Cb 0.35 -0.70 0.30 0.00 -0.26 0.00 0.00 64.21 63.90 2d86 n SER 123 CO 0.00 0.00 0.00 0.03 -0.16 0.00 0.00 175.04 174.91 2d86 h ARG 124 N 0.00 0.28 -5.86 4.33 3.08 -1.05 -3.24 114.38 111.92 2d86 h ARG 124 Ca 0.71 -0.02 -0.59 0.00 0.07 0.00 0.00 59.98 60.15 2d86 h ARG 124 Cb 1.69 -0.06 0.17 0.00 0.08 0.00 0.00 29.97 31.85 2d86 h ARG 124 CO -0.85 0.19 -1.09 0.25 -1.07 0.00 0.00 179.97 177.39 2d86 n THR 125 N -5.14 0.10 0.62 2.04 -2.24 0.29 -4.69 114.28 105.25 2d86 n THR 125 Ca 0.22 -0.49 0.07 0.00 -2.27 0.00 0.00 64.05 61.58 2d86 n THR 125 Cb 0.68 0.00 0.35 0.00 -2.10 0.00 0.00 70.33 69.25 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 1.44 0.13 0.01 -0.78 -0.04 -1.26 -2.56 135.00 131.94 2d86 n PRO 126 Ca 0.08 0.19 -0.15 0.00 -0.04 0.00 0.00 63.50 63.58 2d86 n PRO 126 Cb 0.45 -1.50 -0.14 0.00 -0.04 0.00 0.00 33.50 32.27 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 0.86 0.03 0.52 5.03 -1.87 -3.05 117.51 119.02 2d86 h ILE 127 Ca 0.00 -2.61 -0.17 0.00 -0.12 0.00 0.00 64.86 61.96 2d86 h ILE 127 Cb 0.18 2.55 0.02 0.00 -3.03 0.00 0.00 36.82 36.53 2d86 h ILE 127 CO 0.00 0.73 -0.69 0.00 -0.68 0.00 0.00 178.15 177.51 2d86 h ALA 128 N 0.53 0.04 -0.27 1.87 0.00 -1.67 -3.30 119.26 116.46 2d86 h ALA 128 Ca -0.32 -0.61 -0.11 0.00 0.00 0.00 0.00 54.91 53.87 2d86 h ALA 128 Cb 2.02 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 19.85 2d86 h ALA 128 CO 0.11 0.38 -0.29 -0.07 0.00 0.00 0.00 179.25 179.38 2d86 h LEU 129 N -0.12 0.55 -0.84 0.00 3.38 -1.53 -3.11 115.31 113.63 2d86 h LEU 129 Ca -0.10 -0.21 0.21 0.00 0.09 0.00 0.00 57.88 57.88 2d86 h LEU 129 Cb 1.42 -0.15 -0.15 0.00 0.09 0.00 0.00 40.66 41.87 2d86 h LEU 129 CO 0.13 0.82 0.05 0.00 0.09 0.00 0.00 178.44 179.53 2d86 h ALA 130 N 1.22 0.97 -0.69 1.53 0.00 -1.61 0.49 119.26 121.16 2d86 h ALA 130 Ca 0.06 0.27 -0.03 0.00 0.00 0.00 0.00 54.91 55.21 2d86 h ALA 130 Cb 0.75 0.45 -0.03 0.00 0.00 0.00 0.00 17.79 18.96 2d86 h ALA 130 CO 0.06 -0.46 0.32 1.79 0.00 0.00 0.00 179.25 180.96 2d86 h THR 131 N 0.10 1.22 0.00 0.00 1.35 -1.67 -3.47 112.91 110.44 2d86 h THR 131 Ca 0.49 -0.64 0.00 0.00 -0.55 0.00 0.00 66.41 65.71 2d86 h THR 131 Cb 0.92 0.35 0.00 0.00 -1.73 0.00 0.00 68.15 67.69 2d86 h THR 131 CO -0.74 0.27 0.00 0.61 -0.25 0.00 0.00 175.52 175.41 2d86 n GLY 132 N -1.08 1.15 3.74 5.82 0.00 0.17 -5.07 105.19 109.92 2d86 n GLY 132 Ca 0.06 -0.22 -0.40 0.00 0.00 0.00 0.00 46.02 45.46 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 4.20 -0.64 -0.61 1.01 -1.26 -4.84 121.20 117.06 2d86 s ILE 133 Ca 0.00 2.07 -0.14 0.00 0.00 0.00 0.00 60.65 62.57 2d86 s ILE 133 Cb 0.00 -4.32 -0.17 0.00 0.01 0.00 0.00 42.46 37.98 2d86 s ILE 133 CO 0.00 0.43 1.59 0.54 0.00 0.00 0.00 174.94 177.50 2d86 n ARG 134 N 1.93 0.00 -1.79 2.79 5.12 -1.26 -4.81 116.66 118.64 2d86 n ARG 134 Ca -0.00 0.00 -0.33 0.00 -1.93 0.00 0.00 57.85 55.58 2d86 n ARG 134 Cb 0.48 -0.83 0.04 0.00 -1.16 0.00 0.00 32.46 30.99 2d86 n ARG 134 CO 0.00 0.00 0.00 -1.25 -1.93 0.00 0.00 177.63 174.45 2d86 s PRO 135 N 5.25 2.83 0.80 5.56 0.04 -1.26 -4.87 135.00 143.35 2d86 s PRO 135 Ca 0.86 1.40 -0.13 0.00 0.04 0.00 0.00 61.00 63.17 2d86 s PRO 135 Cb -0.70 -1.95 0.08 0.00 0.04 0.00 0.00 34.50 31.96 2d86 s PRO 135 CO 0.33 -1.23 1.18 -0.06 0.04 0.00 0.00 177.00 177.27 2d86 s PHE 136 N -2.30 1.94 -0.79 0.56 0.40 -1.26 -4.89 117.98 111.63 2d86 s PHE 136 Ca 0.67 1.66 0.18 0.00 -0.60 0.00 0.00 56.93 58.85 2d86 s PHE 136 Cb -0.21 -3.40 0.75 0.00 0.51 0.00 0.00 43.02 40.68 2d86 s PHE 136 CO 0.41 -2.62 1.55 -0.35 0.70 0.00 0.00 175.22 174.91 2d86 n PRO 137 N -3.32 0.08 -2.15 0.24 -0.04 -1.26 -4.63 135.00 123.92 2d86 n PRO 137 Ca 0.13 0.32 -0.40 0.00 -0.04 0.00 0.00 63.50 63.51 2d86 n PRO 137 Cb 0.51 -1.65 -0.03 0.00 -0.04 0.00 0.00 33.50 32.29 2d86 n PRO 137 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 2d86 s SER 138 N -3.49 5.57 0.43 3.54 1.04 -1.26 -4.98 113.70 114.55 2d86 s SER 138 Ca 0.06 0.32 -0.22 0.00 0.48 0.00 0.00 55.95 56.59 2d86 s SER 138 Cb 0.09 -2.54 -0.09 0.00 0.10 0.00 0.00 66.02 63.58 2d86 s SER 138 CO 0.31 -2.15 1.01 -0.83 0.98 0.00 0.00 173.24 172.56 2d86 s GLY 139 N 6.83 2.55 0.11 7.32 0.00 -1.26 -4.97 107.32 117.89 2d86 s GLY 139 Ca 0.62 0.56 -0.31 0.00 0.00 0.00 0.00 44.72 45.59 2d86 s GLY 139 CO 0.22 0.91 1.37 2.56 0.00 0.00 0.00 173.10 178.15 2d86 s PRO 140 N -2.94 4.33 0.40 2.90 0.04 -1.26 -4.97 135.00 133.50 2d86 s PRO 140 Ca 0.62 2.03 -0.27 0.00 0.04 0.00 0.00 61.00 63.43 2d86 s PRO 140 Cb -0.16 -3.27 -0.10 0.00 0.04 0.00 0.00 34.50 31.02 2d86 s PRO 140 CO 0.20 -0.42 1.45 -1.12 0.04 0.00 0.00 177.00 177.16 2d86 s SER 141 N 1.12 6.18 0.20 6.66 0.01 -1.26 -4.88 113.70 121.72 2d86 s SER 141 Ca 0.64 2.98 -0.17 0.00 1.31 0.00 0.00 55.95 60.72 2d86 s SER 141 Cb -0.36 -2.66 0.18 0.00 0.21 0.00 0.00 66.02 63.39 2d86 s SER 141 CO 0.30 -0.98 1.36 -1.20 0.41 0.00 0.00 173.24 173.13 2d86 n SER 142 N 0.21 -0.60 0.00 2.44 7.64 -1.26 -5.35 113.62 116.70 2d86 n SER 142 Ca 0.03 1.53 0.00 0.00 1.01 0.00 0.00 58.87 61.44 2d86 n SER 142 Cb 0.40 -0.33 0.00 0.00 -1.01 0.00 0.00 64.21 63.27 2d86 n SER 142 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64