#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 5.14 -0.25 1.61 0.15 -1.26 -4.93 113.70 114.16 2d86 s SER 2 Ca 0.00 -0.63 -0.23 0.00 0.70 0.00 0.00 55.95 55.79 2d86 s SER 2 Cb 0.00 -2.56 -0.01 0.00 -1.71 0.00 0.00 66.02 61.74 2d86 s SER 2 CO 0.00 -2.74 0.74 -0.94 1.20 0.00 0.00 173.24 171.51 2d86 s SER 3 N 8.05 6.72 0.00 5.45 1.04 -1.26 -5.01 113.70 128.70 2d86 s SER 3 Ca 0.70 0.90 0.00 0.00 0.48 0.00 0.00 55.95 58.03 2d86 s SER 3 Cb -0.07 -2.39 0.00 0.00 0.10 0.00 0.00 66.02 63.66 2d86 s SER 3 CO 0.00 -0.45 0.00 0.61 0.98 0.00 0.00 173.24 174.38 2d86 n GLY 4 N 3.92 1.21 2.89 7.32 0.00 -1.26 -4.97 105.19 114.30 2d86 n GLY 4 Ca 0.03 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.90 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 -3.21 -3.90 1.61 2.88 -1.26 -4.99 113.62 104.75 2d86 n SER 5 Ca 0.00 -0.44 -0.28 0.00 -1.33 0.00 0.00 58.87 56.82 2d86 n SER 5 Cb 0.00 -3.89 -0.12 0.00 -0.75 0.00 0.00 64.21 59.44 2d86 n SER 5 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 2d86 s SER 6 N -3.72 4.70 -0.16 -3.46 0.15 -1.26 -4.91 113.70 105.03 2d86 s SER 6 Ca 0.16 -3.69 -0.24 0.00 0.70 0.00 0.00 55.95 52.88 2d86 s SER 6 Cb -0.07 -1.62 -0.24 0.00 -1.71 0.00 0.00 66.02 62.38 2d86 s SER 6 CO 0.54 -0.11 0.52 1.23 1.20 0.00 0.00 173.24 176.62 2d86 h GLY 7 N 5.61 0.05 -6.59 9.45 0.00 -2.06 -3.45 103.07 106.08 2d86 h GLY 7 Ca 0.10 -0.13 -0.61 0.00 0.00 0.00 0.00 47.33 46.69 2d86 h GLY 7 CO 0.71 0.11 0.06 -0.29 0.00 0.00 0.00 176.54 177.14 2d86 s MET 8 N -2.32 4.10 0.87 4.80 -2.45 -1.26 -5.05 119.30 117.98 2d86 s MET 8 Ca -0.23 0.43 -0.12 0.00 -1.25 0.00 0.00 55.69 54.52 2d86 s MET 8 Cb 0.02 -3.64 0.09 0.00 1.25 0.00 0.00 34.83 32.55 2d86 s MET 8 CO 0.67 -0.36 1.01 0.39 1.05 0.00 0.00 175.02 177.78 2d86 n GLU 9 N 5.55 -0.12 0.03 4.11 4.71 -1.26 -4.93 120.64 128.73 2d86 n GLU 9 Ca -0.03 0.04 -0.06 0.00 -0.01 0.00 0.00 57.16 57.10 2d86 n GLU 9 Cb 0.49 -2.28 0.14 0.00 -1.01 0.00 0.00 31.44 28.78 2d86 n GLU 9 CO 0.00 0.00 0.00 -1.00 0.09 0.00 0.00 177.13 176.22 2d86 h PRO 10 N -1.34 0.43 -0.18 3.49 0.13 -1.96 -3.20 132.00 129.37 2d86 h PRO 10 Ca -0.45 -0.23 -0.15 0.00 -0.87 0.00 0.00 66.00 64.31 2d86 h PRO 10 Cb 1.29 0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.43 2d86 h PRO 10 CO 0.42 0.79 -0.47 0.11 -0.23 0.00 0.00 178.00 178.62 2d86 h TRP 11 N 0.35 0.82 -0.71 1.56 5.08 -1.95 -3.15 115.95 117.96 2d86 h TRP 11 Ca 0.03 -0.32 0.09 0.00 1.08 0.00 0.00 58.89 59.77 2d86 h TRP 11 Cb 0.92 -0.14 -0.10 0.00 -3.00 0.00 0.00 29.16 26.83 2d86 h TRP 11 CO 0.03 1.10 -0.33 1.63 -1.28 0.00 0.00 178.44 179.59 2d86 n LYS 12 N -4.19 -0.22 -0.12 0.12 4.76 -1.21 0.11 118.16 117.41 2d86 n LYS 12 Ca -0.06 1.09 -0.12 0.00 -2.87 0.00 0.00 58.31 56.34 2d86 n LYS 12 Cb 0.58 -1.61 -0.03 0.00 -1.84 0.00 0.00 35.03 32.14 2d86 n LYS 12 CO 0.00 0.00 0.00 -0.56 -1.37 0.00 0.00 177.40 175.47 2d86 h GLN 13 N 0.00 0.75 -0.72 1.97 3.07 -1.71 -3.19 115.11 115.28 2d86 h GLN 13 Ca 0.20 -0.33 0.14 0.00 0.09 0.00 0.00 58.65 58.75 2d86 h GLN 13 Cb 0.38 -0.02 -0.14 0.00 0.08 0.00 0.00 27.48 27.78 2d86 h GLN 13 CO -0.69 0.95 -0.21 0.00 0.09 0.00 0.00 178.83 178.97 2d86 n ALA 15 N -3.22 0.12 -0.03 0.00 0.00 -0.30 -0.87 120.51 116.20 2d86 n ALA 15 Ca 0.09 0.99 -0.09 0.00 0.00 0.00 0.00 53.44 54.42 2d86 n ALA 15 Cb 0.37 -0.55 -0.06 0.00 0.00 0.00 0.00 19.45 19.21 2d86 n ALA 15 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.50 179.46 2d86 h GLN 16 N 0.00 -0.32 -0.81 0.00 1.08 -1.19 -0.14 115.11 113.73 2d86 h GLN 16 Ca 0.41 0.02 0.19 0.00 -1.45 0.00 0.00 58.65 57.81 2d86 h GLN 16 Cb 0.64 0.07 -0.15 0.00 -0.05 0.00 0.00 27.48 27.99 2d86 h GLN 16 CO -0.94 -0.21 -0.03 2.35 -0.95 0.00 0.00 178.83 179.04 2d86 h TRP 17 N -0.33 -0.13 -0.06 2.96 7.01 -1.06 0.77 115.95 125.11 2d86 h TRP 17 Ca 0.03 0.06 0.03 0.00 2.11 0.00 0.00 58.89 61.12 2d86 h TRP 17 Cb 0.42 0.19 -0.03 0.00 -2.10 0.00 0.00 29.16 27.63 2d86 h TRP 17 CO -0.58 -0.30 -0.13 -0.07 -2.79 0.00 0.00 178.44 174.57 2d86 h LEU 18 N 0.07 -0.39 -0.80 0.65 3.38 -0.64 0.68 115.31 118.25 2d86 h LEU 18 Ca 0.44 0.07 0.09 0.00 0.09 0.00 0.00 57.88 58.57 2d86 h LEU 18 Cb 0.79 0.18 -0.07 0.00 0.09 0.00 0.00 40.66 41.64 2d86 h LEU 18 CO -0.75 -0.18 0.45 0.40 0.09 0.00 0.00 178.44 178.46 2d86 h ILE 19 N -0.19 0.91 0.00 1.22 2.04 0.86 -0.66 117.51 121.69 2d86 h ILE 19 Ca 0.07 -0.26 -0.12 0.00 1.00 0.00 0.00 64.86 65.54 2d86 h ILE 19 Cb 0.28 0.07 -0.02 0.00 -0.74 0.00 0.00 36.82 36.41 2d86 h ILE 19 CO -0.17 0.14 -0.59 0.45 0.00 0.00 0.00 178.15 177.98 2d86 h HIS 20 N 0.77 0.00 0.00 1.37 3.86 -0.53 -2.91 115.15 117.70 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 0.35 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.82 2d86 h HIS 20 CO -0.07 0.59 0.00 0.00 0.86 0.00 0.00 177.93 179.31 2d86 n LYS 22 N -0.83 -5.23 0.00 0.00 4.76 -1.07 -4.77 118.16 111.02 2d86 n LYS 22 Ca 0.11 0.60 0.00 0.00 -2.87 0.00 0.00 58.31 56.15 2d86 n LYS 22 Cb 0.05 -4.92 0.00 0.00 -1.84 0.00 0.00 35.03 28.32 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 -3.76 0.00 -4.11 -0.18 0.24 -0.95 -4.92 118.33 104.65 2d86 n VAL 23 Ca -0.10 0.00 -0.14 0.00 -2.04 0.00 0.00 64.34 62.06 2d86 n VAL 23 Cb 0.58 -0.62 -0.11 0.00 -1.47 0.00 0.00 33.84 32.22 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 -3.34 2.30 0.98 1.34 1.43 -1.23 -4.97 118.68 115.19 2d86 s LEU 24 Ca 0.00 -0.63 -0.12 0.00 -1.03 0.00 0.00 54.13 52.34 2d86 s LEU 24 Cb 0.00 -0.25 0.18 0.00 0.03 0.00 0.00 46.19 46.15 2d86 s LEU 24 CO 0.00 -0.21 1.09 -2.16 0.23 0.00 0.00 176.35 175.31 2d86 s PRO 25 N -1.95 0.57 0.19 1.29 0.04 -1.26 -4.25 135.00 129.64 2d86 s PRO 25 Ca -0.05 0.58 0.08 0.00 0.04 0.00 0.00 61.00 61.65 2d86 s PRO 25 Cb -0.08 -1.75 0.06 0.00 0.04 0.00 0.00 34.50 32.77 2d86 s PRO 25 CO 0.00 -2.65 1.43 1.79 0.04 0.00 0.00 177.00 177.62 2d86 h THR 26 N -1.83 1.57 -0.50 1.26 1.35 -2.01 -3.18 112.91 109.57 2d86 h THR 26 Ca -0.54 -2.77 -0.12 0.00 -0.55 0.00 0.00 66.41 62.44 2d86 h THR 26 Cb 1.32 2.50 -0.07 0.00 -1.73 0.00 0.00 68.15 70.17 2d86 h THR 26 CO 0.57 0.79 0.10 0.59 -0.25 0.00 0.00 175.52 177.32 2d86 n ASN 27 N -3.58 4.18 -4.20 5.36 5.03 -1.26 -4.97 115.26 115.82 2d86 n ASN 27 Ca -0.01 -3.23 -0.34 0.00 0.87 0.00 0.00 54.58 51.87 2d86 n ASN 27 Cb 0.78 -0.65 0.13 0.00 -1.02 0.00 0.00 39.78 39.02 2d86 n ASN 27 CO 0.00 0.00 0.00 1.57 -1.83 0.00 0.00 177.26 177.00 2d86 n HIS 28 N -0.39 -1.43 -0.02 3.10 -0.00 -1.20 -4.91 115.22 110.37 2d86 n HIS 28 Ca 0.32 0.29 -0.16 0.00 0.46 0.00 0.00 57.72 58.63 2d86 n HIS 28 Cb 1.15 -1.51 -0.11 0.00 -0.12 0.00 0.00 29.99 29.40 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 -1.75 0.30 -1.04 1.57 0.11 -1.96 -3.24 114.38 108.36 2d86 h ARG 29 Ca -0.49 -0.29 0.27 0.00 0.10 0.00 0.00 59.98 59.56 2d86 h ARG 29 Cb 1.37 0.07 -0.10 0.00 1.11 0.00 0.00 29.97 32.42 2d86 h ARG 29 CO 0.33 0.97 0.66 -0.39 0.10 0.00 0.00 179.97 181.65 2d86 h VAL 30 N -0.26 0.51 -0.50 0.08 -1.51 -1.95 0.37 116.25 113.00 2d86 h VAL 30 Ca -0.04 -0.14 0.08 0.00 -1.23 0.00 0.00 66.70 65.37 2d86 h VAL 30 Cb 1.08 0.06 -0.07 0.00 -2.13 0.00 0.00 31.29 30.23 2d86 h VAL 30 CO 0.08 0.08 0.10 0.71 -1.23 0.00 0.00 177.57 177.30 2d86 h THR 31 N 0.41 0.73 -2.03 7.19 1.35 -1.91 -3.42 112.91 115.23 2d86 h THR 31 Ca 0.61 -0.08 -0.62 0.00 -0.55 0.00 0.00 66.41 65.77 2d86 h THR 31 Cb 1.50 0.47 0.04 0.00 -1.73 0.00 0.00 68.15 68.43 2d86 h THR 31 CO -0.33 0.04 0.84 0.79 -0.25 0.00 0.00 175.52 176.61 2d86 n TRP 32 N -5.11 2.14 -0.32 4.73 7.02 0.12 -4.85 117.44 121.18 2d86 n TRP 32 Ca 0.05 0.27 0.00 0.00 -1.02 0.00 0.00 57.50 56.81 2d86 n TRP 32 Cb 0.24 -2.54 0.07 0.00 -2.42 0.00 0.00 31.31 26.66 2d86 n TRP 32 CO 0.00 0.00 0.00 0.38 -2.02 0.00 0.00 177.69 176.05 2d86 h ASP 33 N 6.81 -1.11 -0.94 -0.99 2.03 -1.86 0.43 116.42 120.80 2d86 h ASP 33 Ca -0.47 0.28 0.38 0.00 -0.73 0.00 0.00 57.03 56.49 2d86 h ASP 33 Cb 1.28 0.63 -0.17 0.00 -0.83 0.00 0.00 39.33 40.24 2d86 h ASP 33 CO 0.90 -0.29 0.46 -1.20 -1.03 0.00 0.00 179.24 178.07 2d86 n SER 34 N -5.51 0.29 -4.43 4.15 7.64 -1.26 -4.48 113.62 110.02 2d86 n SER 34 Ca 0.11 1.57 -0.32 0.00 1.01 0.00 0.00 58.87 61.23 2d86 n SER 34 Cb 0.41 -0.75 0.14 0.00 -1.01 0.00 0.00 64.21 63.01 2d86 n SER 34 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2d86 n ALA 35 N -2.38 -2.62 -2.81 -0.43 0.00 0.15 -5.04 120.51 107.39 2d86 n ALA 35 Ca 0.35 -0.72 -0.09 0.00 0.00 0.00 0.00 53.44 52.97 2d86 n ALA 35 Cb 1.17 -1.82 -0.06 0.00 0.00 0.00 0.00 19.45 18.74 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 -3.76 1.15 0.20 0.00 -0.21 -1.26 -5.02 119.66 110.76 2d86 s GLN 36 Ca 0.58 -1.07 -0.02 0.00 0.02 0.00 0.00 55.36 54.88 2d86 s GLN 36 Cb -0.20 0.40 0.43 0.00 1.00 0.00 0.00 33.01 34.64 2d86 s GLN 36 CO 0.66 -0.43 1.08 1.33 -2.12 0.00 0.00 175.29 175.81 2d86 n VAL 37 N -0.22 -0.29 -0.03 1.09 0.24 -1.26 0.22 118.33 118.08 2d86 n VAL 37 Ca -0.09 1.55 -0.13 0.00 -2.04 0.00 0.00 64.34 63.62 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 -1.43 -0.66 6.34 3.04 -1.96 0.53 116.94 122.79 2d86 h PHE 38 Ca 0.38 0.06 0.06 0.00 3.98 0.00 0.00 57.97 62.45 2d86 h PHE 38 Cb 0.70 0.65 -0.09 0.00 2.56 0.00 0.00 35.95 39.77 2d86 h PHE 38 CO -0.43 -0.47 -0.53 -0.44 -2.02 0.00 0.00 178.31 174.43 2d86 h ASP 39 N -0.47 -1.86 -0.04 0.41 5.19 -0.63 0.73 116.42 119.75 2d86 h ASP 39 Ca 0.03 0.27 0.01 0.00 -0.62 0.00 0.00 57.03 56.72 2d86 h ASP 39 Cb 0.58 0.80 -0.00 0.00 0.18 0.00 0.00 39.33 40.88 2d86 h ASP 39 CO -0.41 -0.29 0.03 0.25 -3.12 0.00 0.00 179.24 175.70 2d86 h LEU 40 N -0.17 0.00 -0.71 1.55 5.85 -1.31 -0.38 115.31 120.14 2d86 h LEU 40 Ca 0.11 0.00 -0.10 0.00 0.84 0.00 0.00 57.88 58.73 2d86 h LEU 40 Cb 0.46 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.47 2d86 h LEU 40 CO -0.71 0.00 -0.48 0.00 -0.34 0.00 0.00 178.44 176.91 2d86 h ALA 41 N 1.98 0.90 0.27 1.25 0.00 0.54 -3.29 119.26 120.92 2d86 h ALA 41 Ca 0.02 -0.43 -0.01 0.00 0.00 0.00 0.00 54.91 54.48 2d86 h ALA 41 Cb 0.07 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.79 2d86 h ALA 41 CO -0.00 0.60 -0.13 1.96 0.00 0.00 0.00 179.25 181.67 2d86 h GLN 42 N 0.00 -0.35 -0.84 0.00 4.20 0.18 0.55 115.11 118.84 2d86 h GLN 42 Ca -0.00 0.02 0.24 0.00 0.06 0.00 0.00 58.65 58.97 2d86 h GLN 42 Cb 1.06 0.08 -0.03 0.00 0.30 0.00 0.00 27.48 28.89 2d86 h GLN 42 CO 0.06 -0.19 1.05 0.00 -0.67 0.00 0.00 178.83 179.08 2d86 h THR 43 N -1.08 0.06 0.00 -0.54 1.03 -1.56 0.71 112.91 111.53 2d86 h THR 43 Ca -0.04 0.00 -0.28 0.00 -0.01 0.00 0.00 66.41 66.08 2d86 h THR 43 Cb 0.32 0.13 -0.05 0.00 -1.07 0.00 0.00 68.15 67.48 2d86 h THR 43 CO 0.06 0.00 -2.07 0.18 -0.01 0.00 0.00 175.52 173.68 2d86 n LEU 44 N -3.27 0.53 -0.27 0.00 4.77 -1.22 -4.50 117.00 113.03 2d86 n LEU 44 Ca 0.19 -0.02 0.19 0.00 -0.03 0.00 0.00 56.01 56.34 2d86 n LEU 44 Cb 1.32 0.19 0.36 0.00 -2.33 0.00 0.00 43.42 42.95 2d86 n LEU 44 CO 0.22 0.46 0.76 -1.14 -1.33 0.00 0.00 177.39 176.36 2d86 n ARG 45 N -2.66 -0.06 0.02 3.23 0.63 0.25 0.14 116.66 118.20 2d86 n ARG 45 Ca -0.27 1.19 -0.11 0.00 -0.92 0.00 0.00 57.85 57.74 2d86 n ARG 45 Cb 0.98 -2.00 -0.05 0.00 0.45 0.00 0.00 32.46 31.84 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 -0.14 0.00 6.15 2.03 -1.78 -3.41 116.42 119.26 2d86 h ASP 46 Ca 0.59 0.03 0.00 0.00 -0.73 0.00 0.00 57.03 56.93 2d86 h ASP 46 Cb 1.42 0.08 0.00 0.00 -0.83 0.00 0.00 39.33 39.99 2d86 h ASP 46 CO -0.71 -0.07 0.00 0.61 -1.03 0.00 0.00 179.24 178.05 2d86 n GLY 47 N -1.17 1.67 0.10 7.15 0.00 0.36 -4.52 105.19 108.80 2d86 n GLY 47 Ca -0.05 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.85 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 -1.22 1.30 0.02 1.61 0.31 -1.26 -4.47 118.33 114.62 2d86 n VAL 48 Ca 0.00 -0.69 -0.20 0.00 -0.01 0.00 0.00 64.34 63.44 2d86 n VAL 48 Cb 0.00 -0.81 -0.14 0.00 -0.91 0.00 0.00 33.84 31.98 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 0.36 -0.92 7.52 5.85 -1.87 -3.34 115.31 122.91 2d86 h LEU 49 Ca -0.51 -0.92 0.11 0.00 0.84 0.00 0.00 57.88 57.40 2d86 h LEU 49 Cb 2.03 -0.12 -0.13 0.00 0.37 0.00 0.00 40.66 42.81 2d86 h LEU 49 CO -0.01 1.40 -0.52 -0.07 -0.34 0.00 0.00 178.44 178.90 2d86 h LEU 50 N -0.47 -1.88 -0.85 2.25 3.38 -1.87 0.52 115.31 116.39 2d86 h LEU 50 Ca -0.17 0.31 0.18 0.00 0.09 0.00 0.00 57.88 58.29 2d86 h LEU 50 Cb 1.57 0.86 -0.11 0.00 0.09 0.00 0.00 40.66 43.07 2d86 h LEU 50 CO 0.09 -0.27 0.38 0.00 0.09 0.00 0.00 178.44 178.74 2d86 h GLN 52 N 0.48 0.39 -0.46 0.00 4.20 -0.11 -2.31 115.11 117.30 2d86 h GLN 52 Ca 0.49 -0.02 0.04 0.00 0.06 0.00 0.00 58.65 59.22 2d86 h GLN 52 Cb 0.81 -0.09 -0.06 0.00 0.30 0.00 0.00 27.48 28.45 2d86 h GLN 52 CO -0.44 0.26 -0.30 1.25 -0.67 0.00 0.00 178.83 178.92 2d86 h LEU 53 N 0.40 -1.10 -0.55 1.46 5.85 -0.18 0.50 115.31 121.69 2d86 h LEU 53 Ca 0.23 0.16 0.07 0.00 0.84 0.00 0.00 57.88 59.18 2d86 h LEU 53 Cb 0.21 0.48 -0.06 0.00 0.37 0.00 0.00 40.66 41.66 2d86 h LEU 53 CO -0.21 -0.14 0.23 -0.07 -0.34 0.00 0.00 178.44 177.92 2d86 h LEU 54 N -0.04 0.28 -2.04 2.25 3.38 -1.55 -0.04 115.31 117.56 2d86 h LEU 54 Ca 0.07 0.05 0.09 0.00 0.09 0.00 0.00 57.88 58.18 2d86 h LEU 54 Cb 0.23 0.01 -0.01 0.00 0.09 0.00 0.00 40.66 40.98 2d86 h LEU 54 CO -0.45 0.19 0.23 0.78 0.09 0.00 0.00 178.44 179.27 2d86 h ASN 55 N 0.44 0.00 0.00 -0.43 2.35 -0.39 0.15 115.58 117.70 2d86 h ASN 55 Ca 0.26 0.00 -0.14 0.00 -0.55 0.00 0.00 56.30 55.87 2d86 h ASN 55 Cb 0.25 0.00 0.01 0.00 0.05 0.00 0.00 38.32 38.63 2d86 h ASN 55 CO -0.23 0.00 -0.55 0.78 -1.65 0.00 0.00 177.43 175.79 2d86 h ASN 56 N 0.00 0.48 0.40 5.81 2.35 0.18 -3.36 115.58 121.43 2d86 h ASN 56 Ca 0.14 -0.77 -0.02 0.00 -0.55 0.00 0.00 56.30 55.10 2d86 h ASN 56 Cb 0.59 -0.15 0.00 0.00 0.05 0.00 0.00 38.32 38.82 2d86 h ASN 56 CO -0.00 1.18 -0.19 -0.07 -1.65 0.00 0.00 177.43 176.70 2d86 h LEU 57 N -0.18 -0.46 -9.46 1.61 3.38 -0.51 -3.46 115.31 106.23 2d86 h LEU 57 Ca -0.07 -0.12 -0.58 0.00 0.09 0.00 0.00 57.88 57.20 2d86 h LEU 57 Cb 1.27 0.12 -0.11 0.00 0.09 0.00 0.00 40.66 42.03 2d86 h LEU 57 CO 0.11 -0.06 -0.67 -0.60 0.09 0.00 0.00 178.44 177.30 2d86 s ARG 58 N -4.41 2.17 0.09 1.13 3.52 0.43 -4.86 118.95 117.02 2d86 s ARG 58 Ca -0.13 -1.44 -0.13 0.00 -0.13 0.00 0.00 55.73 53.90 2d86 s ARG 58 Cb 0.02 -2.11 -0.06 0.00 -1.56 0.00 0.00 34.95 31.24 2d86 s ARG 58 CO 0.48 0.37 0.47 0.00 -0.81 0.00 0.00 175.30 175.81 2d86 s ALA 59 N -2.24 3.65 -1.41 6.12 0.00 -1.26 -4.10 121.76 122.52 2d86 s ALA 59 Ca 0.30 -0.22 -0.04 0.00 0.00 0.00 0.00 51.96 52.00 2d86 s ALA 59 Cb -0.07 -2.42 0.00 0.00 0.00 0.00 0.00 23.12 20.64 2d86 s ALA 59 CO 0.18 0.49 0.51 0.72 0.00 0.00 0.00 175.76 177.67 2d86 n HIS 60 N 1.06 -1.71 0.07 0.00 8.25 -1.26 -4.91 115.22 116.72 2d86 n HIS 60 Ca -0.08 0.44 -0.21 0.00 -0.26 0.00 0.00 57.72 57.61 2d86 n HIS 60 Cb 0.52 -4.12 -0.14 0.00 1.12 0.00 0.00 29.99 27.37 2d86 n HIS 60 CO 0.00 0.00 0.00 0.77 0.64 0.00 0.00 176.34 177.75 2d86 h SER 61 N -1.18 0.67 -3.09 0.41 0.02 -1.86 -3.46 113.55 105.06 2d86 h SER 61 Ca -0.47 -0.88 -0.11 0.00 -0.84 0.00 0.00 61.79 59.48 2d86 h SER 61 Cb 1.33 -0.21 -0.27 0.00 0.14 0.00 0.00 62.40 63.39 2d86 h SER 61 CO 0.51 1.49 -0.31 -0.63 -1.14 0.00 0.00 176.83 176.76 2d86 s ILE 62 N -2.72 -0.14 -0.50 3.27 1.01 -1.26 -4.82 121.20 116.03 2d86 s ILE 62 Ca -0.11 0.11 -0.29 0.00 0.00 0.00 0.00 60.65 60.36 2d86 s ILE 62 Cb 0.03 -0.63 0.02 0.00 0.01 0.00 0.00 42.46 41.90 2d86 s ILE 62 CO 0.88 0.04 1.27 0.21 0.00 0.00 0.00 174.94 177.35 2d86 s ASN 63 N 1.63 6.42 0.38 3.58 2.47 -1.26 -4.88 114.94 123.29 2d86 s ASN 63 Ca -0.08 0.44 0.20 0.00 0.42 0.00 0.00 52.86 53.84 2d86 s ASN 63 Cb -0.09 -2.55 1.18 0.00 -1.45 0.00 0.00 41.25 38.34 2d86 s ASN 63 CO -0.13 -1.44 1.68 -0.07 -3.72 0.00 0.00 177.10 173.43 2d86 h LEU 64 N 11.99 0.43 -1.09 3.21 3.38 -1.99 0.79 115.31 132.03 2d86 h LEU 64 Ca -0.25 0.14 -0.02 0.00 0.09 0.00 0.00 57.88 57.84 2d86 h LEU 64 Cb 1.08 0.09 -0.04 0.00 0.09 0.00 0.00 40.66 41.88 2d86 h LEU 64 CO 1.14 -0.08 0.40 0.11 0.09 0.00 0.00 178.44 180.11 2d86 h LYS 65 N 0.29 1.04 0.00 1.13 1.79 -2.03 -1.61 116.57 117.18 2d86 h LYS 65 Ca 0.72 -0.12 -0.03 0.00 -2.18 0.00 0.00 60.65 59.04 2d86 h LYS 65 Cb 1.87 -0.21 -0.00 0.00 -1.58 0.00 0.00 32.23 32.31 2d86 h LYS 65 CO -0.46 0.77 -0.16 0.93 -1.08 0.00 0.00 179.45 179.45 2d86 h GLU 66 N 1.05 0.00 -5.58 3.15 4.39 0.21 -3.42 114.58 114.38 2d86 h GLU 66 Ca 0.26 0.00 -0.66 0.00 0.34 0.00 0.00 59.36 59.31 2d86 h GLU 66 Cb 0.04 0.00 -0.09 0.00 -0.10 0.00 0.00 28.75 28.60 2d86 h GLU 66 CO -0.04 0.16 -0.50 0.96 -1.16 0.00 0.00 179.01 178.43 2d86 s ILE 67 N -4.35 5.38 -0.99 3.13 -4.36 -0.60 -5.02 121.20 114.39 2d86 s ILE 67 Ca -0.03 0.16 -0.24 0.00 -0.26 0.00 0.00 60.65 60.28 2d86 s ILE 67 Cb 0.14 -3.36 -0.05 0.00 1.25 0.00 0.00 42.46 40.44 2d86 s ILE 67 CO 0.63 0.58 1.90 0.20 0.24 0.00 0.00 174.94 178.49 2d86 s ASN 68 N -0.70 5.27 0.55 4.36 0.01 -1.26 -4.78 114.94 118.39 2d86 s ASN 68 Ca 0.13 -1.01 0.37 0.00 -0.71 0.00 0.00 52.86 51.64 2d86 s ASN 68 Cb -0.12 -2.57 1.54 0.00 0.41 0.00 0.00 41.25 40.51 2d86 s ASN 68 CO 0.03 -2.68 1.76 -0.07 -1.51 0.00 0.00 177.10 174.63 2d86 h LEU 69 N 17.30 0.00 -7.14 0.60 3.38 -1.91 -2.88 115.31 124.65 2d86 h LEU 69 Ca 0.14 0.00 -0.63 0.00 0.09 0.00 0.00 57.88 57.48 2d86 h LEU 69 Cb 0.99 0.00 -0.41 0.00 0.09 0.00 0.00 40.66 41.32 2d86 h LEU 69 CO 1.24 0.00 -0.55 0.00 0.09 0.00 0.00 178.44 179.22 2d86 s ARG 70 N -4.89 2.46 0.38 1.13 3.03 -1.26 -4.90 118.95 114.90 2d86 s ARG 70 Ca -0.05 -3.25 0.28 0.00 2.03 0.00 0.00 55.73 54.74 2d86 s ARG 70 Cb 0.22 -3.45 1.16 0.00 -1.03 0.00 0.00 34.95 31.85 2d86 s ARG 70 CO 0.78 -1.26 1.83 -1.00 -1.13 0.00 0.00 175.30 174.52 2d86 h PRO 71 N 5.58 0.00 -6.50 3.89 0.13 -1.90 -3.47 132.00 129.74 2d86 h PRO 71 Ca 0.12 0.00 -0.51 0.00 -0.87 0.00 0.00 66.00 64.74 2d86 h PRO 71 Cb 0.78 0.00 -0.11 0.00 0.13 0.00 0.00 31.00 31.80 2d86 h PRO 71 CO 0.72 0.00 -0.80 1.04 -0.23 0.00 0.00 178.00 178.74 2d86 n GLN 72 N -2.58 -4.41 -4.12 0.86 6.02 -1.26 -0.73 117.38 111.16 2d86 n GLN 72 Ca 0.01 0.49 -0.33 0.00 -0.01 0.00 0.00 57.00 57.17 2d86 n GLN 72 Cb 0.25 -5.27 -0.02 0.00 1.02 0.00 0.00 30.24 26.22 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 -4.54 -3.51 -2.34 -1.09 2.81 -1.26 -4.94 117.12 102.24 2d86 n MET 73 Ca 0.03 0.41 -0.26 0.00 -1.81 0.00 0.00 57.70 56.07 2d86 n MET 73 Cb 0.52 -5.01 0.13 0.00 -0.71 0.00 0.00 33.22 28.15 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 -3.56 4.03 -0.23 7.83 0.01 0.09 -5.04 113.70 116.83 2d86 s SER 74 Ca 0.55 -0.08 -0.12 0.00 1.31 0.00 0.00 55.95 57.61 2d86 s SER 74 Cb -0.30 -0.24 -0.10 0.00 0.21 0.00 0.00 66.02 65.60 2d86 s SER 74 CO 0.91 -2.09 -0.31 1.67 0.41 0.00 0.00 173.24 173.82 2d86 n GLN 75 N -3.13 0.50 -0.13 12.44 7.27 -1.26 -3.82 117.38 129.25 2d86 n GLN 75 Ca 0.14 0.22 -0.10 0.00 0.07 0.00 0.00 57.00 57.33 2d86 n GLN 75 Cb 0.60 -1.34 -0.01 0.00 2.41 0.00 0.00 30.24 31.90 2d86 n GLN 75 CO 0.00 0.00 0.00 0.74 0.07 0.00 0.00 177.06 177.87 2d86 h PHE 76 N -0.86 0.69 0.51 3.69 0.04 -1.97 -1.46 116.94 117.58 2d86 h PHE 76 Ca -0.52 -0.09 -0.03 0.00 2.80 0.00 0.00 57.97 60.13 2d86 h PHE 76 Cb 1.43 -0.19 0.01 0.00 2.20 0.00 0.00 35.95 39.40 2d86 h PHE 76 CO -0.12 0.68 -0.25 -0.07 -0.60 0.00 0.00 178.31 177.95 2d86 h LEU 77 N 0.50 -0.58 -0.06 1.54 3.38 -1.90 -2.51 115.31 115.67 2d86 h LEU 77 Ca 0.12 -0.06 0.03 0.00 0.09 0.00 0.00 57.88 58.06 2d86 h LEU 77 Cb 0.36 0.15 -0.06 0.00 0.09 0.00 0.00 40.66 41.20 2d86 h LEU 77 CO 0.01 -0.20 -0.53 0.00 0.09 0.00 0.00 178.44 177.81 2d86 h LEU 79 N -0.63 -0.30 0.98 0.00 3.38 -1.36 -1.87 115.31 115.52 2d86 h LEU 79 Ca 0.03 0.19 -0.05 0.00 0.09 0.00 0.00 57.88 58.14 2d86 h LEU 79 Cb 0.70 0.33 0.01 0.00 0.09 0.00 0.00 40.66 41.79 2d86 h LEU 79 CO -0.39 -0.16 -0.47 0.50 0.09 0.00 0.00 178.44 178.00 2d86 h LYS 80 N 0.12 -1.27 -0.78 1.13 3.11 -0.82 -3.05 116.57 115.02 2d86 h LYS 80 Ca 0.42 0.09 0.07 0.00 -2.81 0.00 0.00 60.65 58.41 2d86 h LYS 80 Cb 0.74 0.29 -0.09 0.00 -1.00 0.00 0.00 32.23 32.16 2d86 h LYS 80 CO -0.65 -0.85 -0.46 0.09 -2.81 0.00 0.00 179.45 174.78 2d86 n ASN 81 N -5.60 -0.82 -0.35 4.20 4.13 0.26 -0.24 115.26 116.83 2d86 n ASN 81 Ca -0.16 1.53 -0.01 0.00 1.68 0.00 0.00 54.58 57.61 2d86 n ASN 81 Cb 0.52 -0.25 0.04 0.00 -1.54 0.00 0.00 39.78 38.55 2d86 n ASN 81 CO 0.00 0.00 0.00 0.40 0.28 0.00 0.00 177.26 177.94 2d86 h ILE 82 N 0.00 0.03 -0.31 2.41 2.04 -1.40 0.19 117.51 120.48 2d86 h ILE 82 Ca 0.12 0.00 0.07 0.00 1.00 0.00 0.00 64.86 66.05 2d86 h ILE 82 Cb 0.32 0.03 -0.07 0.00 -0.74 0.00 0.00 36.82 36.36 2d86 h ILE 82 CO -0.73 0.00 -0.17 0.03 0.00 0.00 0.00 178.15 177.28 2d86 h ARG 83 N -0.03 -0.12 -0.94 2.37 3.08 -0.50 -1.37 114.38 116.87 2d86 h ARG 83 Ca 0.34 0.01 0.27 0.00 0.07 0.00 0.00 59.98 60.67 2d86 h ARG 83 Cb 0.60 0.03 -0.16 0.00 0.08 0.00 0.00 29.97 30.51 2d86 h ARG 83 CO -0.94 -0.08 0.16 1.15 -1.07 0.00 0.00 179.97 179.19 2d86 h THR 84 N -0.13 0.14 0.59 2.04 2.02 0.16 0.72 112.91 118.45 2d86 h THR 84 Ca 0.16 -0.03 -0.03 0.00 0.77 0.00 0.00 66.41 67.28 2d86 h THR 84 Cb 0.38 0.05 0.01 0.00 -1.74 0.00 0.00 68.15 66.84 2d86 h THR 84 CO -0.39 0.02 -0.28 0.15 0.37 0.00 0.00 175.52 175.38 2d86 h PHE 85 N 0.08 -0.74 -0.96 3.16 3.04 -1.00 -2.47 116.94 118.05 2d86 h PHE 85 Ca 0.60 -0.02 0.28 0.00 3.98 0.00 0.00 57.97 62.81 2d86 h PHE 85 Cb 1.28 0.24 -0.04 0.00 2.56 0.00 0.00 35.95 40.00 2d86 h PHE 85 CO -0.35 -0.40 0.70 -0.07 -2.02 0.00 0.00 178.31 176.16 2d86 h LEU 86 N -1.00 0.00 -0.06 0.59 3.38 -0.67 0.28 115.31 117.83 2d86 h LEU 86 Ca -0.08 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.86 2d86 h LEU 86 Cb 0.66 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.41 2d86 h LEU 86 CO 0.13 0.00 -0.07 0.74 0.09 0.00 0.00 178.44 179.33 2d86 h THR 87 N 0.00 1.38 -0.67 0.22 2.02 -0.68 -3.17 112.91 112.01 2d86 h THR 87 Ca 0.46 -1.26 0.03 0.00 0.77 0.00 0.00 66.41 66.40 2d86 h THR 87 Cb 1.85 2.08 -0.04 0.00 -1.74 0.00 0.00 68.15 70.30 2d86 h THR 87 CO -0.00 0.35 0.45 0.00 0.37 0.00 0.00 175.52 176.68 2d86 h ALA 88 N 0.54 1.60 0.00 6.16 0.00 -0.51 0.34 119.26 127.39 2d86 h ALA 88 Ca 0.01 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.88 2d86 h ALA 88 Cb 0.60 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.15 2d86 h ALA 88 CO 0.02 0.34 0.01 0.00 0.00 0.00 0.00 179.25 179.62 2d86 n GLU 91 N -2.12 0.53 -0.02 0.00 -0.58 1.00 -3.06 120.64 116.40 2d86 n GLU 91 Ca -0.08 0.54 -0.13 0.00 -0.42 0.00 0.00 57.16 57.07 2d86 n GLU 91 Cb 0.59 -1.71 -0.10 0.00 -0.57 0.00 0.00 31.44 29.64 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 1.41 0.00 2.62 2.02 0.60 -3.40 112.91 115.16 2d86 h THR 92 Ca -0.27 -1.38 0.00 0.00 0.77 0.00 0.00 66.41 65.53 2d86 h THR 92 Cb 1.10 2.32 0.00 0.00 -1.74 0.00 0.00 68.15 69.84 2d86 h THR 92 CO -0.16 0.35 -0.13 -0.26 0.37 0.00 0.00 175.52 175.69 2d86 h PHE 93 N -0.63 0.00 0.00 3.16 -1.00 -1.45 -3.50 116.94 113.52 2d86 h PHE 93 Ca -0.00 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.78 2d86 h PHE 93 Cb 0.59 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.15 2d86 h PHE 93 CO 0.13 0.00 0.00 0.41 -1.61 0.00 0.00 178.31 177.24 2d86 n GLY 94 N 1.78 1.26 3.94 -1.45 0.00 -0.94 -4.95 105.19 104.83 2d86 n GLY 94 Ca -0.02 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.76 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 3.49 1.04 1.61 -1.94 0.85 -4.92 119.30 119.43 2d86 s MET 95 Ca 0.00 -0.35 -0.18 0.00 -1.71 0.00 0.00 55.69 53.45 2d86 s MET 95 Cb 0.00 -2.70 0.26 0.00 2.01 0.00 0.00 34.83 34.40 2d86 s MET 95 CO 0.00 0.20 0.91 0.54 -0.01 0.00 0.00 175.02 176.67 2d86 n ARG 96 N -1.59 -2.87 -0.04 2.03 5.12 -1.26 -4.24 116.66 113.81 2d86 n ARG 96 Ca -0.05 -1.47 -0.02 0.00 -1.93 0.00 0.00 57.85 54.38 2d86 n ARG 96 Cb 0.56 -1.39 -0.08 0.00 -1.16 0.00 0.00 32.46 30.39 2d86 n ARG 96 CO 0.00 0.00 0.00 1.17 -1.93 0.00 0.00 177.63 176.87 2d86 n LYS 97 N -4.35 1.84 0.29 5.56 3.00 -1.26 -4.30 118.16 118.94 2d86 n LYS 97 Ca 0.13 -0.03 0.17 0.00 -0.00 0.00 0.00 58.31 58.58 2d86 n LYS 97 Cb 0.50 -1.25 0.96 0.00 0.00 0.00 0.00 35.03 35.23 2d86 n LYS 97 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.40 178.43 2d86 h SER 98 N 0.00 0.00 0.49 3.14 0.87 -2.02 -0.70 113.55 115.33 2d86 h SER 98 Ca -0.20 0.00 -0.23 0.00 -1.23 0.00 0.00 61.79 60.13 2d86 h SER 98 Cb 1.32 0.00 -0.04 0.00 -0.44 0.00 0.00 62.40 63.24 2d86 h SER 98 CO 0.01 0.00 -1.69 -1.84 -0.53 0.00 0.00 176.83 172.79 2d86 n GLU 99 N -3.60 0.64 -0.72 2.24 -0.00 -1.26 -4.95 120.64 112.99 2d86 n GLU 99 Ca -0.02 0.19 -0.28 0.00 -0.00 0.00 0.00 57.16 57.05 2d86 n GLU 99 Cb 0.16 -1.74 0.23 0.00 -0.00 0.00 0.00 31.44 30.09 2d86 n GLU 99 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.13 176.62 2d86 s LEU 100 N -5.76 0.98 0.17 -1.84 1.43 -0.27 -4.48 118.68 108.91 2d86 s LEU 100 Ca -0.05 1.40 0.07 0.00 -1.03 0.00 0.00 54.13 54.52 2d86 s LEU 100 Cb 0.08 -3.37 -0.04 0.00 0.03 0.00 0.00 46.19 42.90 2d86 s LEU 100 CO 0.82 -3.95 -0.01 0.72 0.23 0.00 0.00 176.35 174.16 2d86 s PHE 101 N -2.60 2.83 1.33 0.29 -0.71 -1.26 -5.02 117.98 112.84 2d86 s PHE 101 Ca 0.68 -0.14 -0.19 0.00 -1.04 0.00 0.00 56.93 56.23 2d86 s PHE 101 Cb -0.23 -1.38 0.34 0.00 -1.21 0.00 0.00 43.02 40.54 2d86 s PHE 101 CO 0.63 0.52 0.97 -2.00 -1.34 0.00 0.00 175.22 173.99 2d86 s GLU 102 N -2.92 -2.24 -0.10 1.99 2.12 -1.26 -4.98 118.70 111.31 2d86 s GLU 102 Ca 0.27 0.36 0.07 0.00 0.36 0.00 0.00 54.97 56.03 2d86 s GLU 102 Cb -0.09 -1.44 -0.24 0.00 0.26 0.00 0.00 34.13 32.62 2d86 s GLU 102 CO 0.18 -4.48 0.43 0.00 -0.54 0.00 0.00 175.26 170.85 2d86 n ALA 103 N -5.38 1.31 0.00 6.30 0.00 -1.26 -4.36 120.51 117.12 2d86 n ALA 103 Ca 0.09 -0.82 -0.10 0.00 0.00 0.00 0.00 53.44 52.62 2d86 n ALA 103 Cb 0.58 -0.66 -0.08 0.00 0.00 0.00 0.00 19.45 19.30 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 0.02 -0.11 -0.72 0.00 3.57 -1.93 -2.83 116.94 114.94 2d86 h PHE 104 Ca -0.38 -0.00 0.28 0.00 3.53 0.00 0.00 57.97 61.39 2d86 h PHE 104 Cb 2.04 0.04 -0.13 0.00 2.79 0.00 0.00 35.95 40.69 2d86 h PHE 104 CO 0.03 0.39 0.30 -0.40 -2.23 0.00 0.00 178.31 176.39 2d86 n ASP 105 N -4.82 0.17 0.04 0.41 5.75 -1.26 0.17 116.55 117.00 2d86 n ASP 105 Ca -0.07 1.20 -0.19 0.00 -0.01 0.00 0.00 54.79 55.72 2d86 n ASP 105 Cb 0.27 -0.55 -0.14 0.00 -1.03 0.00 0.00 41.12 39.68 2d86 n ASP 105 CO 0.00 0.00 0.00 0.25 -0.11 0.00 0.00 177.20 177.34 2d86 h LEU 106 N 0.00 0.48 -0.04 -2.12 5.85 -1.76 0.89 115.31 118.61 2d86 h LEU 106 Ca 0.57 -0.91 0.03 0.00 0.84 0.00 0.00 57.88 58.40 2d86 h LEU 106 Cb 1.44 -0.15 -0.04 0.00 0.37 0.00 0.00 40.66 42.27 2d86 h LEU 106 CO -0.58 1.35 -0.19 0.15 -0.34 0.00 0.00 178.44 178.83 2d86 h PHE 107 N -0.32 -0.49 -0.35 1.25 3.57 0.20 -1.04 116.94 119.75 2d86 h PHE 107 Ca -0.13 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.39 2d86 h PHE 107 Cb 1.57 0.22 0.00 0.00 2.79 0.00 0.00 35.95 40.53 2d86 h PHE 107 CO 0.19 -0.27 0.00 -0.25 -2.23 0.00 0.00 178.31 175.75 2d86 n ASP 108 N -5.32 3.15 -3.84 0.41 9.92 0.62 -4.89 116.55 116.60 2d86 n ASP 108 Ca -0.04 -2.35 -0.29 0.00 -0.53 0.00 0.00 54.79 51.58 2d86 n ASP 108 Cb 0.24 -0.50 -0.04 0.00 -0.64 0.00 0.00 41.12 40.18 2d86 n ASP 108 CO 0.00 0.00 0.00 0.52 0.13 0.00 0.00 177.20 177.85 2d86 n VAL 109 N 0.45 -0.22 0.24 2.53 0.31 -0.40 -4.81 118.33 116.44 2d86 n VAL 109 Ca 0.15 0.00 -0.16 0.00 -0.01 0.00 0.00 64.34 64.32 2d86 n VAL 109 Cb 0.63 -0.66 -0.08 0.00 -0.91 0.00 0.00 33.84 32.83 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 -0.71 -0.58 -2.89 5.55 3.08 0.54 -3.42 114.38 115.95 2d86 h ARG 110 Ca -0.42 0.04 -0.34 0.00 0.07 0.00 0.00 59.98 59.33 2d86 h ARG 110 Cb 1.28 0.13 -0.37 0.00 0.08 0.00 0.00 29.97 31.09 2d86 h ARG 110 CO 0.61 -0.38 -0.66 -0.51 -1.07 0.00 0.00 179.97 177.96 2d86 s ASP 111 N -4.67 1.31 -0.04 7.04 1.01 -1.20 -5.02 116.67 115.10 2d86 s ASP 111 Ca -0.16 -0.06 -0.13 0.00 0.71 0.00 0.00 52.55 52.91 2d86 s ASP 111 Cb 0.05 0.19 -0.31 0.00 1.01 0.00 0.00 42.92 43.86 2d86 s ASP 111 CO 0.64 -0.30 0.72 0.15 0.21 0.00 0.00 175.17 176.59 2d86 h PHE 112 N 8.36 0.75 -1.36 4.23 3.57 -1.86 -3.34 116.94 127.29 2d86 h PHE 112 Ca -0.15 -0.55 0.42 0.00 3.53 0.00 0.00 57.97 61.22 2d86 h PHE 112 Cb 1.14 -0.03 -0.10 0.00 2.79 0.00 0.00 35.95 39.74 2d86 h PHE 112 CO 0.27 1.65 0.92 0.78 -2.23 0.00 0.00 178.31 179.70 2d86 h GLY 113 N 0.50 0.86 1.25 2.40 0.00 -1.99 0.89 103.07 106.96 2d86 h GLY 113 Ca -0.32 -0.09 -0.14 0.00 0.00 0.00 0.00 47.33 46.77 2d86 h GLY 113 CO 0.19 -0.22 -0.33 0.50 0.00 0.00 0.00 176.54 176.67 2d86 h LYS 114 N 0.11 0.84 -0.37 4.80 1.57 -2.01 -2.75 116.57 118.75 2d86 h LYS 114 Ca 0.76 -0.41 -0.15 0.00 -1.87 0.00 0.00 60.65 58.98 2d86 h LYS 114 Cb 2.55 -0.00 -0.01 0.00 0.08 0.00 0.00 32.23 34.85 2d86 h LYS 114 CO -0.26 1.04 -0.37 0.28 -0.57 0.00 0.00 179.45 179.57 2d86 h VAL 115 N 0.70 1.28 0.14 0.50 2.07 0.58 -3.19 116.25 118.34 2d86 h VAL 115 Ca 0.07 -1.54 0.00 0.00 0.82 0.00 0.00 66.70 66.06 2d86 h VAL 115 Cb 0.89 1.40 -0.01 0.00 -1.52 0.00 0.00 31.29 32.05 2d86 h VAL 115 CO 0.08 0.51 -0.15 0.40 0.02 0.00 0.00 177.57 178.44 2d86 h ILE 116 N 0.72 0.67 -0.80 4.57 2.04 -1.19 -2.61 117.51 120.91 2d86 h ILE 116 Ca 0.06 0.00 0.19 0.00 1.00 0.00 0.00 64.86 66.11 2d86 h ILE 116 Cb 0.96 0.67 -0.13 0.00 -0.74 0.00 0.00 36.82 37.59 2d86 h ILE 116 CO 0.09 0.00 0.18 -0.08 0.00 0.00 0.00 178.15 178.35 2d86 h GLU 117 N -0.32 0.23 -0.67 2.37 4.22 -1.52 0.23 114.58 119.12 2d86 h GLU 117 Ca 0.01 -0.01 0.14 0.00 0.08 0.00 0.00 59.36 59.57 2d86 h GLU 117 Cb 0.31 -0.05 -0.12 0.00 0.50 0.00 0.00 28.75 29.39 2d86 h GLU 117 CO -0.04 0.15 -0.02 1.15 -2.18 0.00 0.00 179.01 178.06 2d86 h THR 118 N 0.23 0.42 -0.66 0.32 2.02 -1.45 0.40 112.91 114.20 2d86 h THR 118 Ca 0.47 -0.03 0.02 0.00 0.77 0.00 0.00 66.41 67.64 2d86 h THR 118 Cb 0.88 0.32 -0.04 0.00 -1.74 0.00 0.00 68.15 67.57 2d86 h THR 118 CO -0.59 0.02 0.42 -0.07 0.37 0.00 0.00 175.52 175.67 2d86 h LEU 119 N 0.09 0.71 -0.86 2.58 3.38 -0.94 -1.34 115.31 118.94 2d86 h LEU 119 Ca 0.35 -0.01 0.16 0.00 0.09 0.00 0.00 57.88 58.47 2d86 h LEU 119 Cb 0.58 -0.16 -0.10 0.00 0.09 0.00 0.00 40.66 41.06 2d86 h LEU 119 CO -0.59 0.50 0.43 -1.28 0.09 0.00 0.00 178.44 177.59 2d86 h SER 120 N 0.84 0.49 0.75 -0.43 0.87 -0.65 0.24 113.55 115.66 2d86 h SER 120 Ca 0.25 0.10 -0.16 0.00 -1.23 0.00 0.00 61.79 60.76 2d86 h SER 120 Cb -0.04 0.03 -0.02 0.00 -0.44 0.00 0.00 62.40 61.93 2d86 h SER 120 CO -0.08 0.17 -0.77 0.03 -0.53 0.00 0.00 176.83 175.66 2d86 h ARG 121 N 0.58 0.01 0.23 2.24 3.08 -0.98 -3.28 114.38 116.25 2d86 h ARG 121 Ca 0.48 -0.01 -0.01 0.00 0.07 0.00 0.00 59.98 60.51 2d86 h ARG 121 Cb 0.74 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.79 2d86 h ARG 121 CO -0.40 0.77 -0.11 1.25 -1.07 0.00 0.00 179.97 180.42 2d86 h LEU 122 N 0.01 -0.26 -0.93 3.04 5.85 0.32 -3.21 115.31 120.12 2d86 h LEU 122 Ca -0.01 -0.26 0.27 0.00 0.84 0.00 0.00 57.88 58.72 2d86 h LEU 122 Cb 1.36 0.07 -0.16 0.00 0.37 0.00 0.00 40.66 42.29 2d86 h LEU 122 CO 0.10 0.18 0.19 0.77 -0.34 0.00 0.00 178.44 179.34 2d86 h SER 123 N -0.76 -0.14 -0.96 1.25 4.64 -0.75 0.56 113.55 117.39 2d86 h SER 123 Ca -0.03 0.23 0.27 0.00 -0.47 0.00 0.00 61.79 61.79 2d86 h SER 123 Cb 0.50 0.35 -0.14 0.00 -0.31 0.00 0.00 62.40 62.80 2d86 h SER 123 CO 0.05 -0.26 0.48 0.03 -0.87 0.00 0.00 176.83 176.26 2d86 h ARG 124 N 0.11 0.37 -6.03 4.77 2.47 -1.61 -3.31 114.38 111.14 2d86 h ARG 124 Ca 0.60 -0.02 -0.60 0.00 -1.26 0.00 0.00 59.98 58.70 2d86 h ARG 124 Cb 1.28 -0.08 0.18 0.00 -1.65 0.00 0.00 29.97 29.70 2d86 h ARG 124 CO -0.76 0.24 -1.15 0.25 0.56 0.00 0.00 179.97 179.11 2d86 n THR 125 N -5.04 0.13 0.59 2.04 -2.24 0.20 -4.74 114.28 105.21 2d86 n THR 125 Ca 0.27 -0.50 0.07 0.00 -2.27 0.00 0.00 64.05 61.62 2d86 n THR 125 Cb 0.81 -0.04 0.34 0.00 -2.10 0.00 0.00 70.33 69.34 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 1.47 0.10 0.06 -0.78 -0.04 -1.26 -2.74 135.00 131.80 2d86 n PRO 126 Ca 0.08 0.20 -0.23 0.00 -0.04 0.00 0.00 63.50 63.51 2d86 n PRO 126 Cb 0.48 -1.50 -0.15 0.00 -0.04 0.00 0.00 33.50 32.29 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 0.88 -0.25 0.52 5.03 -1.87 -2.83 117.51 118.99 2d86 h ILE 127 Ca 0.00 -2.48 -0.09 0.00 -0.12 0.00 0.00 64.86 62.17 2d86 h ILE 127 Cb 0.19 2.72 -0.00 0.00 -3.03 0.00 0.00 36.82 36.70 2d86 h ILE 127 CO 0.00 0.87 -0.21 0.00 -0.68 0.00 0.00 178.15 178.13 2d86 h ALA 128 N 0.10 0.36 -0.23 1.87 0.00 -1.69 -3.19 119.26 116.48 2d86 h ALA 128 Ca -0.36 -0.36 -0.15 0.00 0.00 0.00 0.00 54.91 54.04 2d86 h ALA 128 Cb 2.09 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 19.79 2d86 h ALA 128 CO 0.16 0.31 -0.47 -0.07 0.00 0.00 0.00 179.25 179.18 2d86 h LEU 129 N 0.29 0.65 -0.90 0.00 3.38 -1.62 -3.20 115.31 113.91 2d86 h LEU 129 Ca 0.04 -0.32 0.21 0.00 0.09 0.00 0.00 57.88 57.91 2d86 h LEU 129 Cb 0.76 -0.18 -0.17 0.00 0.09 0.00 0.00 40.66 41.16 2d86 h LEU 129 CO 0.05 1.02 -0.06 0.00 0.09 0.00 0.00 178.44 179.54 2d86 h ALA 130 N 1.00 0.88 -0.76 1.53 0.00 -1.48 0.93 119.26 121.36 2d86 h ALA 130 Ca 0.03 0.32 0.09 0.00 0.00 0.00 0.00 54.91 55.35 2d86 h ALA 130 Cb 1.00 0.58 -0.05 0.00 0.00 0.00 0.00 17.79 19.32 2d86 h ALA 130 CO 0.09 -0.47 0.50 1.79 0.00 0.00 0.00 179.25 181.16 2d86 h THR 131 N 0.03 0.96 0.00 0.00 1.35 -1.64 -3.46 112.91 110.15 2d86 h THR 131 Ca 0.50 -0.24 0.00 0.00 -0.55 0.00 0.00 66.41 66.12 2d86 h THR 131 Cb 0.91 0.20 0.00 0.00 -1.73 0.00 0.00 68.15 67.52 2d86 h THR 131 CO -0.86 0.13 0.00 0.61 -0.25 0.00 0.00 175.52 175.15 2d86 n GLY 132 N -1.45 1.28 3.76 5.82 0.00 0.32 -5.08 105.19 109.84 2d86 n GLY 132 Ca 0.12 -0.05 -0.40 0.00 0.00 0.00 0.00 46.02 45.69 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 4.53 -0.33 -0.61 1.01 -1.26 -4.96 121.20 117.58 2d86 s ILE 133 Ca 0.00 1.66 -0.39 0.00 0.00 0.00 0.00 60.65 61.92 2d86 s ILE 133 Cb 0.00 -4.12 -0.15 0.00 0.01 0.00 0.00 42.46 38.20 2d86 s ILE 133 CO 0.00 0.46 1.93 0.54 0.00 0.00 0.00 174.94 177.86 2d86 n ARG 134 N 2.11 0.99 -2.25 2.79 1.74 -1.26 -4.85 116.66 115.93 2d86 n ARG 134 Ca -0.04 0.33 -0.40 0.00 -0.77 0.00 0.00 57.85 56.97 2d86 n ARG 134 Cb 0.49 -2.14 -0.03 0.00 -1.02 0.00 0.00 32.46 29.77 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 4.65 4.40 -0.09 5.56 0.04 -1.26 -4.83 135.00 143.47 2d86 s PRO 135 Ca 1.04 2.03 -0.01 0.00 0.04 0.00 0.00 61.00 64.11 2d86 s PRO 135 Cb -1.06 -3.05 0.03 0.00 0.04 0.00 0.00 34.50 30.46 2d86 s PRO 135 CO 0.61 -0.08 -0.04 -0.59 0.04 0.00 0.00 177.00 176.93 2d86 s PHE 136 N -1.19 1.08 0.00 0.56 -0.71 -1.26 -5.14 117.98 111.31 2d86 s PHE 136 Ca 0.49 -0.44 0.00 0.00 -1.04 0.00 0.00 56.93 55.93 2d86 s PHE 136 Cb -0.36 -1.00 0.00 0.00 -1.21 0.00 0.00 43.02 40.45 2d86 s PHE 136 CO 0.47 -0.40 0.00 -0.35 -1.34 0.00 0.00 175.22 173.60 2d86 n PRO 137 N 4.91 -0.18 0.06 1.99 -0.04 -1.26 -4.61 135.00 135.87 2d86 n PRO 137 Ca -0.12 0.00 -0.05 0.00 -0.04 0.00 0.00 63.50 63.29 2d86 n PRO 137 Cb 0.50 0.00 -0.03 0.00 -0.04 0.00 0.00 33.50 33.93 2d86 n PRO 137 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 2d86 h SER 138 N -0.59 -0.21 -2.11 3.54 0.87 -1.90 -3.44 113.55 109.71 2d86 h SER 138 Ca 0.00 -0.06 -0.61 0.00 -1.23 0.00 0.00 61.79 59.88 2d86 h SER 138 Cb 0.00 0.05 -0.13 0.00 -0.44 0.00 0.00 62.40 61.88 2d86 h SER 138 CO 0.00 0.29 -0.51 -0.83 -0.53 0.00 0.00 176.83 175.25 2d86 s GLY 139 N -3.29 2.82 0.00 5.77 0.00 -1.26 -4.94 107.32 106.41 2d86 s GLY 139 Ca -0.05 -0.84 0.13 0.00 0.00 0.00 0.00 44.72 43.95 2d86 s GLY 139 CO 0.17 -1.97 1.19 -1.55 0.00 0.00 0.00 173.10 170.94 2d86 n PRO 140 N -1.06 0.49 -4.01 2.90 -0.04 -1.26 -4.72 135.00 127.30 2d86 n PRO 140 Ca -0.11 0.00 -0.32 0.00 -0.04 0.00 0.00 63.50 63.03 2d86 n PRO 140 Cb 0.66 -1.41 -0.06 0.00 -0.04 0.00 0.00 33.50 32.65 2d86 n PRO 140 CO 0.00 0.00 0.00 -1.12 -0.04 0.00 0.00 175.50 174.34 2d86 s SER 141 N -1.91 5.89 0.00 3.54 0.01 -1.26 -5.01 113.70 114.96 2d86 s SER 141 Ca 0.19 0.15 0.00 0.00 1.31 0.00 0.00 55.95 57.61 2d86 s SER 141 Cb 0.09 -1.71 0.00 0.00 0.21 0.00 0.00 66.02 64.60 2d86 s SER 141 CO 0.15 0.22 0.00 -0.24 0.41 0.00 0.00 173.24 173.77 2d86 n SER 142 N 0.71 2.09 0.00 2.44 2.88 -1.26 -4.89 113.62 115.60 2d86 n SER 142 Ca -0.09 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.45 2d86 n SER 142 Cb 0.52 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.98 2d86 n SER 142 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42