#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 -5.40 -4.27 1.61 2.88 -1.26 -4.98 113.62 102.21 2d86 n SER 2 Ca 0.00 -0.04 -0.36 0.00 -1.33 0.00 0.00 58.87 57.14 2d86 n SER 2 Cb 0.00 -4.44 -0.13 0.00 -0.75 0.00 0.00 64.21 58.89 2d86 n SER 2 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 2d86 s SER 3 N -2.20 4.81 0.00 -3.46 1.04 -1.26 -4.94 113.70 107.68 2d86 s SER 3 Ca 0.02 -0.85 0.00 0.00 0.48 0.00 0.00 55.95 55.61 2d86 s SER 3 Cb -0.01 -1.78 0.00 0.00 0.10 0.00 0.00 66.02 64.33 2d86 s SER 3 CO 0.03 -0.18 0.00 0.61 0.98 0.00 0.00 173.24 174.67 2d86 n GLY 4 N 4.77 -0.78 4.29 7.32 0.00 -1.26 -5.03 105.19 114.51 2d86 n GLY 4 Ca -0.15 0.62 -0.35 0.00 0.00 0.00 0.00 46.02 46.14 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 -1.37 -4.86 1.61 2.88 -1.26 -4.92 113.62 105.70 2d86 n SER 5 Ca 0.00 -1.14 -0.25 0.00 -1.33 0.00 0.00 58.87 56.15 2d86 n SER 5 Cb 0.00 -2.20 0.08 0.00 -0.75 0.00 0.00 64.21 61.33 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 -3.72 4.72 1.27 -3.46 1.04 -1.26 -4.88 113.70 107.41 2d86 s SER 6 Ca 0.47 0.30 0.00 0.00 0.48 0.00 0.00 55.95 57.20 2d86 s SER 6 Cb -0.27 -0.92 0.00 0.00 0.10 0.00 0.00 66.02 64.94 2d86 s SER 6 CO 0.97 -1.63 0.00 0.61 0.98 0.00 0.00 173.24 174.17 2d86 n GLY 7 N -2.89 3.40 3.65 7.32 0.00 -1.26 -4.49 105.19 110.93 2d86 n GLY 7 Ca 0.09 0.08 -0.35 0.00 0.00 0.00 0.00 46.02 45.84 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 2.99 0.53 1.61 -2.45 -1.26 -5.09 119.30 115.64 2d86 s MET 8 Ca 0.00 -0.44 -0.21 0.00 -1.25 0.00 0.00 55.69 53.79 2d86 s MET 8 Cb 0.00 -2.77 -0.07 0.00 1.25 0.00 0.00 34.83 33.24 2d86 s MET 8 CO 0.00 0.66 0.96 0.39 1.05 0.00 0.00 175.02 178.08 2d86 n GLU 9 N 2.26 1.07 0.15 4.11 1.02 -1.26 -4.87 120.64 123.13 2d86 n GLU 9 Ca -0.18 0.40 0.13 0.00 -0.02 0.00 0.00 57.16 57.48 2d86 n GLU 9 Cb 0.53 -2.10 0.53 0.00 -0.02 0.00 0.00 31.44 30.38 2d86 n GLU 9 CO 0.00 0.00 0.00 -1.00 1.18 0.00 0.00 177.13 177.31 2d86 h PRO 10 N 0.89 0.00 0.10 3.49 0.13 -1.98 -2.97 132.00 131.66 2d86 h PRO 10 Ca -0.47 0.00 -0.34 0.00 -0.87 0.00 0.00 66.00 64.32 2d86 h PRO 10 Cb 1.35 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.46 2d86 h PRO 10 CO 0.53 0.00 -1.84 0.11 -0.23 0.00 0.00 178.00 176.57 2d86 h TRP 11 N 0.00 0.39 -0.41 1.56 5.08 -1.99 -3.13 115.95 117.44 2d86 h TRP 11 Ca 0.00 -0.29 0.06 0.00 1.08 0.00 0.00 58.89 59.74 2d86 h TRP 11 Cb 0.38 -0.02 -0.05 0.00 -3.00 0.00 0.00 29.16 26.47 2d86 h TRP 11 CO 0.00 1.54 0.11 0.87 -1.28 0.00 0.00 178.44 179.68 2d86 h LYS 12 N 0.06 0.25 -0.07 0.12 1.79 -1.89 -2.60 116.57 114.23 2d86 h LYS 12 Ca -0.36 -0.02 -0.04 0.00 -2.18 0.00 0.00 60.65 58.06 2d86 h LYS 12 Cb 2.03 -0.06 -0.00 0.00 -1.58 0.00 0.00 32.23 32.63 2d86 h LYS 12 CO 0.11 0.17 -0.10 1.96 -1.08 0.00 0.00 179.45 180.50 2d86 h GLN 13 N 0.26 0.20 -0.99 3.15 4.20 -1.72 -3.19 115.11 117.02 2d86 h GLN 13 Ca 0.20 -0.12 0.35 0.00 0.06 0.00 0.00 58.65 59.14 2d86 h GLN 13 Cb 0.22 0.01 -0.17 0.00 0.30 0.00 0.00 27.48 27.83 2d86 h GLN 13 CO -0.23 0.67 0.38 0.00 -0.67 0.00 0.00 178.83 178.98 2d86 h ALA 15 N 1.95 0.53 0.17 0.00 0.00 -1.45 -1.59 119.26 118.86 2d86 h ALA 15 Ca 0.74 0.27 0.01 0.00 0.00 0.00 0.00 54.91 55.93 2d86 h ALA 15 Cb 1.79 0.53 -0.03 0.00 0.00 0.00 0.00 17.79 20.07 2d86 h ALA 15 CO -0.78 -0.42 -0.44 1.96 0.00 0.00 0.00 179.25 179.58 2d86 h GLN 16 N 0.02 -0.65 -0.99 0.00 1.08 -0.48 -0.58 115.11 113.51 2d86 h GLN 16 Ca 0.36 0.04 0.28 0.00 -1.45 0.00 0.00 58.65 57.89 2d86 h GLN 16 Cb 0.56 0.15 -0.14 0.00 -0.05 0.00 0.00 27.48 28.00 2d86 h GLN 16 CO -0.73 -0.43 0.54 2.35 -0.95 0.00 0.00 178.83 179.61 2d86 h TRP 17 N -0.67 0.90 -0.04 2.96 7.01 -1.38 0.13 115.95 124.86 2d86 h TRP 17 Ca -0.02 0.04 -0.00 0.00 2.11 0.00 0.00 58.89 61.02 2d86 h TRP 17 Cb 0.65 -0.24 -0.00 0.00 -2.10 0.00 0.00 29.16 27.47 2d86 h TRP 17 CO -0.38 -0.09 0.02 -0.07 -2.79 0.00 0.00 178.44 175.12 2d86 h LEU 18 N 0.40 0.05 -1.20 0.65 3.38 -0.38 0.36 115.31 118.58 2d86 h LEU 18 Ca 0.68 -0.15 0.06 0.00 0.09 0.00 0.00 57.88 58.56 2d86 h LEU 18 Cb 1.45 -0.01 -0.06 0.00 0.09 0.00 0.00 40.66 42.13 2d86 h LEU 18 CO -0.56 0.19 0.56 0.40 0.09 0.00 0.00 178.44 179.12 2d86 h ILE 19 N -0.09 1.06 0.00 1.22 2.04 0.71 -1.36 117.51 121.08 2d86 h ILE 19 Ca 0.01 -0.33 -0.19 0.00 1.00 0.00 0.00 64.86 65.35 2d86 h ILE 19 Cb 0.15 0.00 -0.03 0.00 -0.74 0.00 0.00 36.82 36.21 2d86 h ILE 19 CO -0.00 0.18 -0.89 0.45 0.00 0.00 0.00 178.15 177.89 2d86 h HIS 20 N 0.97 0.00 0.00 1.37 3.86 -0.94 -3.11 115.15 117.30 2d86 h HIS 20 Ca 0.37 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.58 2d86 h HIS 20 Cb 0.21 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.68 2d86 h HIS 20 CO -0.00 0.89 0.00 0.00 0.86 0.00 0.00 177.93 179.68 2d86 n LYS 22 N -0.96 -4.21 0.00 0.00 4.76 -1.09 -4.76 118.16 111.91 2d86 n LYS 22 Ca 0.13 0.53 0.00 0.00 -2.87 0.00 0.00 58.31 56.09 2d86 n LYS 22 Cb 0.06 -4.60 0.00 0.00 -1.84 0.00 0.00 35.03 28.65 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 -3.06 0.00 -4.27 -0.18 0.24 -1.01 -4.91 118.33 105.13 2d86 n VAL 23 Ca -0.16 0.00 -0.20 0.00 -2.04 0.00 0.00 64.34 61.94 2d86 n VAL 23 Cb 0.60 -0.60 -0.13 0.00 -1.47 0.00 0.00 33.84 32.24 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 -2.82 2.23 0.73 1.34 1.43 -1.22 -4.99 118.68 115.38 2d86 s LEU 24 Ca 0.00 -0.55 -0.12 0.00 -1.03 0.00 0.00 54.13 52.43 2d86 s LEU 24 Cb 0.00 -0.60 0.04 0.00 0.03 0.00 0.00 46.19 45.66 2d86 s LEU 24 CO 0.00 -0.01 1.10 -2.16 0.23 0.00 0.00 176.35 175.51 2d86 s PRO 25 N -1.48 2.43 0.48 1.29 0.04 -1.26 -4.27 135.00 132.24 2d86 s PRO 25 Ca 0.00 1.25 0.27 0.00 0.04 0.00 0.00 61.00 62.56 2d86 s PRO 25 Cb -0.09 -1.91 1.16 0.00 0.04 0.00 0.00 34.50 33.69 2d86 s PRO 25 CO 0.02 -1.52 1.92 1.79 0.04 0.00 0.00 177.00 179.26 2d86 h THR 26 N -0.74 0.47 -0.30 1.26 1.35 -2.01 -2.67 112.91 110.28 2d86 h THR 26 Ca -0.45 -0.86 -0.05 0.00 -0.55 0.00 0.00 66.41 64.51 2d86 h THR 26 Cb 1.24 1.60 -0.03 0.00 -1.73 0.00 0.00 68.15 69.23 2d86 h THR 26 CO 0.52 0.16 0.00 -3.20 -0.25 0.00 0.00 175.52 172.75 2d86 n ASN 27 N -3.40 3.62 -3.59 5.36 2.85 -1.26 -4.97 115.26 113.86 2d86 n ASN 27 Ca -0.00 -3.18 -0.16 0.00 -0.11 0.00 0.00 54.58 51.13 2d86 n ASN 27 Cb 0.35 -0.57 0.13 0.00 1.24 0.00 0.00 39.78 40.94 2d86 n ASN 27 CO 0.00 0.00 0.00 1.57 -2.11 0.00 0.00 177.26 176.72 2d86 n HIS 28 N -0.65 -2.30 1.09 1.20 -0.00 -1.01 -4.89 115.22 108.66 2d86 n HIS 28 Ca 0.25 0.04 0.12 0.00 0.46 0.00 0.00 57.72 58.58 2d86 n HIS 28 Cb 0.94 -1.38 0.17 0.00 -0.12 0.00 0.00 29.99 29.60 2d86 n HIS 28 CO 0.00 0.00 0.00 2.89 0.46 0.00 0.00 176.34 179.69 2d86 n ARG 29 N -1.46 0.60 0.04 1.57 0.00 -1.26 -3.90 116.66 112.25 2d86 n ARG 29 Ca 0.06 -0.43 0.12 0.00 -0.00 0.00 0.00 57.85 57.60 2d86 n ARG 29 Cb 0.32 -1.49 0.27 0.00 -0.00 0.00 0.00 32.46 31.56 2d86 n ARG 29 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.63 178.96 2d86 n VAL 30 N -0.82 0.23 0.14 8.89 0.24 -1.26 -3.65 118.33 122.09 2d86 n VAL 30 Ca 0.09 -0.16 0.09 0.00 -2.04 0.00 0.00 64.34 62.31 2d86 n VAL 30 Cb 0.37 -0.10 0.06 0.00 -1.47 0.00 0.00 33.84 32.70 2d86 n VAL 30 CO 0.00 0.00 0.00 0.71 -2.14 0.00 0.00 176.83 175.40 2d86 h THR 31 N 0.00 0.21 -2.92 3.34 1.35 -1.92 -3.46 112.91 109.51 2d86 h THR 31 Ca 0.00 -1.34 -0.53 0.00 -0.55 0.00 0.00 66.41 63.99 2d86 h THR 31 Cb 0.64 1.91 0.03 0.00 -1.73 0.00 0.00 68.15 69.01 2d86 h THR 31 CO 0.00 0.12 0.80 0.26 -0.25 0.00 0.00 175.52 176.45 2d86 s TRP 32 N -3.18 3.15 0.21 4.73 0.52 -1.24 -4.91 118.94 118.22 2d86 s TRP 32 Ca 0.03 0.79 -0.16 0.00 0.02 0.00 0.00 56.10 56.77 2d86 s TRP 32 Cb 0.07 -3.81 0.21 0.00 -1.15 0.00 0.00 33.47 28.80 2d86 s TRP 32 CO 0.74 -2.90 1.59 0.38 0.02 0.00 0.00 176.95 176.78 2d86 h ASP 33 N 6.77 -0.97 -1.12 2.95 2.03 -1.92 0.54 116.42 124.71 2d86 h ASP 33 Ca -0.42 0.23 0.31 0.00 -0.73 0.00 0.00 57.03 56.42 2d86 h ASP 33 Cb 1.21 0.54 -0.09 0.00 -0.83 0.00 0.00 39.33 40.16 2d86 h ASP 33 CO 0.89 -0.28 0.74 0.77 -1.03 0.00 0.00 179.24 180.33 2d86 h SER 34 N -0.08 0.32 -2.64 4.15 4.64 -1.95 -3.42 113.55 114.58 2d86 h SER 34 Ca 0.30 0.07 -0.53 0.00 -0.47 0.00 0.00 61.79 61.15 2d86 h SER 34 Cb 0.55 0.03 0.23 0.00 -0.31 0.00 0.00 62.40 62.90 2d86 h SER 34 CO -0.74 0.03 -1.26 0.00 -0.87 0.00 0.00 176.83 173.99 2d86 n ALA 35 N -2.55 -4.09 -2.65 5.18 0.00 0.19 -5.02 120.51 111.57 2d86 n ALA 35 Ca 0.27 -0.71 -0.09 0.00 0.00 0.00 0.00 53.44 52.91 2d86 n ALA 35 Cb 1.04 -1.45 -0.07 0.00 0.00 0.00 0.00 19.45 18.97 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 -2.85 1.03 0.25 0.00 -0.21 -1.26 -5.02 119.66 111.61 2d86 s GLN 36 Ca 0.49 -1.08 -0.04 0.00 0.02 0.00 0.00 55.36 54.74 2d86 s GLN 36 Cb -0.18 0.36 0.48 0.00 1.00 0.00 0.00 33.01 34.67 2d86 s GLN 36 CO 0.74 -0.36 1.35 1.33 -2.12 0.00 0.00 175.29 176.23 2d86 n VAL 37 N -0.15 -0.36 -0.04 1.09 0.24 -1.26 -0.47 118.33 117.37 2d86 n VAL 37 Ca -0.10 1.95 -0.11 0.00 -2.04 0.00 0.00 64.34 64.03 2d86 n VAL 37 Cb 0.63 -2.75 -0.08 0.00 -1.47 0.00 0.00 33.84 30.18 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 -1.26 -0.80 6.34 3.57 -1.96 0.43 116.94 123.26 2d86 h PHE 38 Ca 0.45 0.05 0.08 0.00 3.53 0.00 0.00 57.97 62.08 2d86 h PHE 38 Cb 0.77 0.57 -0.10 0.00 2.79 0.00 0.00 35.95 39.98 2d86 h PHE 38 CO -0.59 -0.40 -0.44 -0.25 -2.23 0.00 0.00 178.31 174.39 2d86 n ASP 39 N -4.73 -0.79 0.20 0.41 9.92 0.38 0.22 116.55 122.16 2d86 n ASP 39 Ca -0.04 1.42 0.04 0.00 -0.53 0.00 0.00 54.79 55.68 2d86 n ASP 39 Cb 0.28 -0.21 0.41 0.00 -0.64 0.00 0.00 41.12 40.96 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 -0.80 0.64 5.85 -1.35 -2.07 115.31 117.59 2d86 h LEU 40 Ca 0.16 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.87 2d86 h LEU 40 Cb 0.36 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.39 2d86 h LEU 40 CO -0.76 0.31 -0.05 0.00 -0.34 0.00 0.00 178.44 177.60 2d86 h ALA 41 N 1.69 0.99 0.04 1.25 0.00 0.73 -3.28 119.26 120.68 2d86 h ALA 41 Ca -0.00 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 54.86 2d86 h ALA 41 Cb 0.57 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.35 2d86 h ALA 41 CO 0.04 0.06 -0.02 1.96 0.00 0.00 0.00 179.25 181.29 2d86 h GLN 42 N 0.00 -0.06 -0.53 0.00 4.20 0.16 0.22 115.11 119.09 2d86 h GLN 42 Ca -0.00 0.00 0.15 0.00 0.06 0.00 0.00 58.65 58.87 2d86 h GLN 42 Cb 0.77 0.01 -0.02 0.00 0.30 0.00 0.00 27.48 28.54 2d86 h GLN 42 CO 0.01 -0.04 0.95 0.00 -0.67 0.00 0.00 178.83 179.08 2d86 h THR 43 N -0.88 0.05 0.00 -0.54 1.03 -1.61 1.13 112.91 112.09 2d86 h THR 43 Ca -0.01 0.00 -0.17 0.00 -0.01 0.00 0.00 66.41 66.22 2d86 h THR 43 Cb 0.05 0.16 -0.03 0.00 -1.07 0.00 0.00 68.15 67.26 2d86 h THR 43 CO 0.01 0.00 -1.88 0.18 -0.01 0.00 0.00 175.52 173.82 2d86 n LEU 44 N -3.05 0.00 -0.41 0.00 4.77 -1.24 -4.43 117.00 112.64 2d86 n LEU 44 Ca 0.12 0.00 0.33 0.00 -0.03 0.00 0.00 56.01 56.42 2d86 n LEU 44 Cb 1.13 0.23 0.61 0.00 -2.33 0.00 0.00 43.42 43.05 2d86 n LEU 44 CO 0.16 0.23 1.21 -0.09 -1.33 0.00 0.00 177.39 177.57 2d86 h ARG 45 N 0.00 0.15 0.36 3.23 2.43 0.47 0.93 114.38 121.95 2d86 h ARG 45 Ca -0.25 -0.01 -0.02 0.00 -0.81 0.00 0.00 59.98 58.89 2d86 h ARG 45 Cb 1.47 -0.03 0.00 0.00 -0.42 0.00 0.00 29.97 30.99 2d86 h ARG 45 CO 0.01 0.10 -0.17 0.38 -1.51 0.00 0.00 179.97 178.78 2d86 h ASP 46 N 0.16 -0.41 0.00 -3.80 2.03 -1.77 -3.39 116.42 109.24 2d86 h ASP 46 Ca 0.77 -0.15 0.00 0.00 -0.73 0.00 0.00 57.03 56.92 2d86 h ASP 46 Cb 2.28 0.10 0.00 0.00 -0.83 0.00 0.00 39.33 40.89 2d86 h ASP 46 CO -0.43 -0.01 0.00 0.61 -1.03 0.00 0.00 179.24 178.38 2d86 n GLY 47 N -0.20 1.71 0.07 7.15 0.00 0.32 -4.44 105.19 109.79 2d86 n GLY 47 Ca -0.09 0.00 -0.07 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 -0.35 0.95 -0.08 1.61 0.31 -1.26 -4.38 118.33 115.13 2d86 n VAL 48 Ca 0.00 -0.57 -0.12 0.00 -0.01 0.00 0.00 64.34 63.64 2d86 n VAL 48 Cb 0.00 -0.66 -0.07 0.00 -0.91 0.00 0.00 33.84 32.19 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 0.00 -0.72 7.52 5.85 -1.90 -3.36 115.31 122.71 2d86 h LEU 49 Ca -0.37 -0.41 0.08 0.00 0.84 0.00 0.00 57.88 58.01 2d86 h LEU 49 Cb 1.83 0.00 -0.09 0.00 0.37 0.00 0.00 40.66 42.77 2d86 h LEU 49 CO 0.02 1.00 -0.39 0.18 -0.34 0.00 0.00 178.44 178.91 2d86 n LEU 50 N -4.59 -0.69 -0.31 2.25 4.77 -1.26 0.22 117.00 117.38 2d86 n LEU 50 Ca -0.14 1.27 0.13 0.00 -0.03 0.00 0.00 56.01 57.24 2d86 n LEU 50 Cb 0.40 -0.19 0.31 0.00 -2.33 0.00 0.00 43.42 41.61 2d86 n LEU 50 CO 0.17 -1.06 1.09 0.00 -1.33 0.00 0.00 177.39 176.25 2d86 h GLN 52 N 0.49 -0.26 -0.34 0.00 4.20 0.25 -2.77 115.11 116.68 2d86 h GLN 52 Ca 0.56 0.02 0.03 0.00 0.06 0.00 0.00 58.65 59.32 2d86 h GLN 52 Cb 1.03 0.06 -0.04 0.00 0.30 0.00 0.00 27.48 28.83 2d86 h GLN 52 CO -0.49 -0.17 -0.20 -0.11 -0.67 0.00 0.00 178.83 177.19 2d86 n LEU 53 N -5.25 -0.36 -0.17 1.46 7.94 -0.33 0.68 117.00 120.98 2d86 n LEU 53 Ca -0.07 0.98 -0.02 0.00 -1.11 0.00 0.00 56.01 55.79 2d86 n LEU 53 Cb 0.17 -0.26 0.08 0.00 0.53 0.00 0.00 43.42 43.93 2d86 n LEU 53 CO 0.30 -0.68 0.94 -0.07 -1.11 0.00 0.00 177.39 176.77 2d86 h LEU 54 N 0.00 0.10 -1.92 -1.96 3.38 -1.58 0.56 115.31 113.88 2d86 h LEU 54 Ca 0.05 0.08 0.13 0.00 0.09 0.00 0.00 57.88 58.23 2d86 h LEU 54 Cb 0.14 0.09 -0.02 0.00 0.09 0.00 0.00 40.66 40.96 2d86 h LEU 54 CO -0.32 0.08 0.35 0.78 0.09 0.00 0.00 178.44 179.42 2d86 h ASN 55 N 0.30 0.07 -0.04 -0.43 2.35 0.55 0.12 115.58 118.51 2d86 h ASN 55 Ca 0.26 0.00 -0.16 0.00 -0.55 0.00 0.00 56.30 55.86 2d86 h ASN 55 Cb 0.33 -0.01 0.01 0.00 0.05 0.00 0.00 38.32 38.70 2d86 h ASN 55 CO -0.30 0.04 -0.58 0.78 -1.65 0.00 0.00 177.43 175.72 2d86 h ASN 56 N 0.08 0.58 0.52 5.81 2.35 0.19 -3.36 115.58 121.76 2d86 h ASN 56 Ca 0.24 -0.71 -0.03 0.00 -0.55 0.00 0.00 56.30 55.25 2d86 h ASN 56 Cb 0.83 -0.18 0.01 0.00 0.05 0.00 0.00 38.32 39.03 2d86 h ASN 56 CO -0.02 1.21 -0.25 -0.07 -1.65 0.00 0.00 177.43 176.65 2d86 h LEU 57 N 0.01 -0.60 -9.45 1.61 3.38 -0.41 -3.46 115.31 106.40 2d86 h LEU 57 Ca -0.06 -0.04 -0.59 0.00 0.09 0.00 0.00 57.88 57.28 2d86 h LEU 57 Cb 1.26 0.15 -0.11 0.00 0.09 0.00 0.00 40.66 42.05 2d86 h LEU 57 CO 0.12 -0.20 -0.68 -0.60 0.09 0.00 0.00 178.44 177.17 2d86 s ARG 58 N -4.35 2.18 0.13 1.13 3.52 0.32 -4.87 118.95 117.01 2d86 s ARG 58 Ca -0.13 -1.38 -0.14 0.00 -0.13 0.00 0.00 55.73 53.95 2d86 s ARG 58 Cb 0.01 -2.14 -0.07 0.00 -1.56 0.00 0.00 34.95 31.20 2d86 s ARG 58 CO 0.42 0.39 0.53 0.00 -0.81 0.00 0.00 175.30 175.83 2d86 s ALA 59 N -2.12 3.60 -1.45 6.12 0.00 -1.26 -4.08 121.76 122.57 2d86 s ALA 59 Ca 0.29 -0.16 -0.03 0.00 0.00 0.00 0.00 51.96 52.07 2d86 s ALA 59 Cb -0.07 -2.49 0.00 0.00 0.00 0.00 0.00 23.12 20.56 2d86 s ALA 59 CO 0.18 0.47 0.40 0.72 0.00 0.00 0.00 175.76 177.52 2d86 n HIS 60 N 0.89 -1.52 0.03 0.00 8.25 -1.26 -4.91 115.22 116.70 2d86 n HIS 60 Ca -0.06 0.34 -0.19 0.00 -0.26 0.00 0.00 57.72 57.55 2d86 n HIS 60 Cb 0.52 -4.01 -0.14 0.00 1.12 0.00 0.00 29.99 27.48 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 -0.91 0.42 -3.24 0.41 0.02 -1.87 -3.47 113.55 104.91 2d86 h SER 61 Ca -0.47 -0.94 -0.16 0.00 -0.84 0.00 0.00 61.79 59.38 2d86 h SER 61 Cb 1.33 -0.13 -0.29 0.00 0.14 0.00 0.00 62.40 63.45 2d86 h SER 61 CO 0.51 1.33 -0.42 -0.63 -1.14 0.00 0.00 176.83 176.48 2d86 s ILE 62 N -2.48 -0.08 -0.36 3.27 1.01 -1.26 -4.81 121.20 116.48 2d86 s ILE 62 Ca -0.14 0.14 -0.27 0.00 0.00 0.00 0.00 60.65 60.37 2d86 s ILE 62 Cb 0.01 -0.48 0.02 0.00 0.01 0.00 0.00 42.46 42.02 2d86 s ILE 62 CO 0.81 0.06 1.01 0.21 0.00 0.00 0.00 174.94 177.03 2d86 s ASN 63 N 1.44 6.77 0.38 3.58 2.47 -1.26 -4.89 114.94 123.43 2d86 s ASN 63 Ca -0.08 0.75 0.13 0.00 0.42 0.00 0.00 52.86 54.07 2d86 s ASN 63 Cb -0.10 -2.51 0.94 0.00 -1.45 0.00 0.00 41.25 38.14 2d86 s ASN 63 CO -0.10 -0.92 1.85 -0.07 -3.72 0.00 0.00 177.10 174.14 2d86 h LEU 64 N 10.23 0.55 -1.06 3.21 3.38 -1.99 0.13 115.31 129.76 2d86 h LEU 64 Ca -0.22 0.05 -0.05 0.00 0.09 0.00 0.00 57.88 57.75 2d86 h LEU 64 Cb 1.07 -0.05 -0.03 0.00 0.09 0.00 0.00 40.66 41.74 2d86 h LEU 64 CO 1.02 0.24 0.15 0.11 0.09 0.00 0.00 178.44 180.04 2d86 h LYS 65 N 0.56 0.82 0.00 1.13 1.79 -2.03 -2.03 116.57 116.81 2d86 h LYS 65 Ca 0.48 -0.16 -0.05 0.00 -2.18 0.00 0.00 60.65 58.75 2d86 h LYS 65 Cb 0.98 -0.13 -0.01 0.00 -1.58 0.00 0.00 32.23 31.49 2d86 h LYS 65 CO -0.22 0.73 -0.22 0.93 -1.08 0.00 0.00 179.45 179.59 2d86 h GLU 66 N 0.79 0.00 -5.71 3.15 4.39 -1.15 -3.42 114.58 112.63 2d86 h GLU 66 Ca 0.18 0.00 -0.67 0.00 0.34 0.00 0.00 59.36 59.21 2d86 h GLU 66 Cb 0.27 0.00 -0.10 0.00 -0.10 0.00 0.00 28.75 28.81 2d86 h GLU 66 CO -0.00 0.22 -0.53 0.96 -1.16 0.00 0.00 179.01 178.49 2d86 s ILE 67 N -4.13 5.05 -0.91 3.13 -4.36 -0.76 -5.00 121.20 114.23 2d86 s ILE 67 Ca -0.02 0.04 -0.25 0.00 -0.26 0.00 0.00 60.65 60.16 2d86 s ILE 67 Cb 0.13 -3.19 -0.07 0.00 1.25 0.00 0.00 42.46 40.59 2d86 s ILE 67 CO 0.64 0.60 2.02 0.54 0.24 0.00 0.00 174.94 178.98 2d86 s ASN 68 N -0.83 4.91 0.56 4.36 2.20 -1.26 -4.77 114.94 120.10 2d86 s ASN 68 Ca 0.13 -0.63 0.37 0.00 -0.94 0.00 0.00 52.86 51.79 2d86 s ASN 68 Cb -0.12 -2.56 1.52 0.00 -2.00 0.00 0.00 41.25 38.09 2d86 s ASN 68 CO 0.03 -2.98 1.75 -0.07 -2.94 0.00 0.00 177.10 172.89 2d86 h LEU 69 N 18.68 0.00 -7.11 3.54 3.38 -1.91 -2.85 115.31 129.04 2d86 h LEU 69 Ca 0.09 0.00 -0.62 0.00 0.09 0.00 0.00 57.88 57.44 2d86 h LEU 69 Cb 1.00 0.00 -0.42 0.00 0.09 0.00 0.00 40.66 41.33 2d86 h LEU 69 CO 1.18 0.00 -0.57 0.00 0.09 0.00 0.00 178.44 179.13 2d86 s ARG 70 N -4.86 2.44 0.00 1.13 1.70 -1.26 -4.91 118.95 113.19 2d86 s ARG 70 Ca -0.05 -3.30 0.15 0.00 -0.47 0.00 0.00 55.73 52.06 2d86 s ARG 70 Cb 0.22 -3.42 0.74 0.00 -0.57 0.00 0.00 34.95 31.91 2d86 s ARG 70 CO 0.76 -1.27 1.41 -0.35 -1.08 0.00 0.00 175.30 174.77 2d86 n PRO 71 N 2.04 0.19 -3.99 3.89 -0.04 -1.08 -4.88 135.00 131.14 2d86 n PRO 71 Ca 0.19 0.16 -0.31 0.00 -0.04 0.00 0.00 63.50 63.49 2d86 n PRO 71 Cb 0.35 -1.50 -0.04 0.00 -0.04 0.00 0.00 33.50 32.27 2d86 n PRO 71 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 2d86 n GLN 72 N -1.30 -0.68 -3.84 0.54 6.02 -1.26 0.54 117.38 117.39 2d86 n GLN 72 Ca 0.07 0.01 -0.24 0.00 -0.01 0.00 0.00 57.00 56.83 2d86 n GLN 72 Cb 0.12 -2.36 -0.07 0.00 1.02 0.00 0.00 30.24 28.95 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 -4.06 -0.94 -2.71 -1.09 2.81 -1.26 -4.89 117.12 104.97 2d86 n MET 73 Ca -0.18 0.07 -0.22 0.00 -1.81 0.00 0.00 57.70 55.55 2d86 n MET 73 Cb 0.51 -2.71 0.09 0.00 -0.71 0.00 0.00 33.22 30.41 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 -3.95 4.56 -0.24 7.83 0.01 0.19 -5.05 113.70 117.06 2d86 s SER 74 Ca 0.04 -0.49 0.07 0.00 1.31 0.00 0.00 55.95 56.87 2d86 s SER 74 Cb -0.02 0.06 -0.19 0.00 0.21 0.00 0.00 66.02 66.07 2d86 s SER 74 CO 0.74 -1.71 -0.14 1.67 0.41 0.00 0.00 173.24 174.22 2d86 n GLN 75 N -2.66 0.67 -0.05 12.44 7.27 -1.26 -4.01 117.38 129.77 2d86 n GLN 75 Ca 0.15 0.10 -0.02 0.00 0.07 0.00 0.00 57.00 57.30 2d86 n GLN 75 Cb 0.61 -1.51 -0.02 0.00 2.41 0.00 0.00 30.24 31.73 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 0.00 0.00 -0.11 3.69 -1.00 -1.96 -3.09 116.94 114.47 2d86 h PHE 76 Ca -0.56 0.00 0.04 0.00 2.81 0.00 0.00 57.97 60.27 2d86 h PHE 76 Cb 1.98 0.00 -0.06 0.00 3.61 0.00 0.00 35.95 41.49 2d86 h PHE 76 CO 0.02 0.13 -0.29 -0.07 -1.61 0.00 0.00 178.31 176.49 2d86 h LEU 77 N -1.00 -0.88 0.03 1.54 3.38 -1.87 0.17 115.31 116.67 2d86 h LEU 77 Ca -0.00 0.13 0.01 0.00 0.09 0.00 0.00 57.88 58.11 2d86 h LEU 77 Cb 0.14 0.38 -0.02 0.00 0.09 0.00 0.00 40.66 41.25 2d86 h LEU 77 CO -0.00 -0.34 -0.20 0.00 0.09 0.00 0.00 178.44 178.00 2d86 h LEU 79 N -0.27 0.67 0.69 0.00 3.38 -1.44 -1.35 115.31 117.00 2d86 h LEU 79 Ca -0.00 0.12 -0.03 0.00 0.09 0.00 0.00 57.88 58.06 2d86 h LEU 79 Cb 0.27 0.01 0.01 0.00 0.09 0.00 0.00 40.66 41.04 2d86 h LEU 79 CO -0.11 0.14 -0.33 0.50 0.09 0.00 0.00 178.44 178.73 2d86 h LYS 80 N 0.60 -0.89 -0.04 1.13 3.11 0.23 -2.80 116.57 117.90 2d86 h LYS 80 Ca 0.62 0.06 0.02 0.00 -2.81 0.00 0.00 60.65 58.54 2d86 h LYS 80 Cb 1.18 0.20 -0.04 0.00 -1.00 0.00 0.00 32.23 32.58 2d86 h LYS 80 CO -0.43 -0.58 -0.33 -0.91 -2.81 0.00 0.00 179.45 174.38 2d86 h ASN 81 N -0.95 -1.03 -0.84 4.20 2.35 0.36 -2.52 115.58 117.16 2d86 h ASN 81 Ca -0.09 0.12 0.09 0.00 -0.55 0.00 0.00 56.30 55.86 2d86 h ASN 81 Cb 0.71 0.40 -0.11 0.00 0.05 0.00 0.00 38.32 39.37 2d86 h ASN 81 CO 0.15 -0.31 -0.46 -0.38 -1.65 0.00 0.00 177.43 174.78 2d86 n ILE 82 N -4.30 -0.55 -0.29 2.81 5.41 -0.83 0.68 119.36 122.29 2d86 n ILE 82 Ca -0.04 2.03 0.05 0.00 1.00 0.00 0.00 62.75 65.79 2d86 n ILE 82 Cb 0.24 -2.54 0.14 0.00 -0.71 0.00 0.00 39.64 36.77 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 0.03 -0.85 0.38 3.08 -1.18 0.31 114.38 116.15 2d86 h ARG 83 Ca 0.17 -0.00 0.22 0.00 0.07 0.00 0.00 59.98 60.43 2d86 h ARG 83 Cb 0.38 -0.01 -0.14 0.00 0.08 0.00 0.00 29.97 30.28 2d86 h ARG 83 CO -0.80 0.02 0.21 1.15 -1.07 0.00 0.00 179.97 179.47 2d86 h THR 84 N 0.03 0.35 0.52 2.04 2.02 0.55 -0.34 112.91 118.08 2d86 h THR 84 Ca 0.43 -0.07 -0.03 0.00 0.77 0.00 0.00 66.41 67.51 2d86 h THR 84 Cb 0.72 0.12 0.01 0.00 -1.74 0.00 0.00 68.15 67.26 2d86 h THR 84 CO -0.82 0.04 -0.25 0.15 0.37 0.00 0.00 175.52 175.01 2d86 h PHE 85 N 0.21 -0.65 -0.68 3.16 3.57 -0.26 -1.91 116.94 120.38 2d86 h PHE 85 Ca 0.52 -0.02 0.20 0.00 3.53 0.00 0.00 57.97 62.20 2d86 h PHE 85 Cb 1.01 0.21 -0.03 0.00 2.79 0.00 0.00 35.95 39.93 2d86 h PHE 85 CO -0.28 -0.35 0.55 -0.07 -2.23 0.00 0.00 178.31 175.93 2d86 h LEU 86 N -0.81 0.00 -0.01 0.59 3.38 -0.89 -0.54 115.31 117.03 2d86 h LEU 86 Ca -0.07 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.88 2d86 h LEU 86 Cb 0.58 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.33 2d86 h LEU 86 CO 0.12 0.00 -0.07 0.74 0.09 0.00 0.00 178.44 179.32 2d86 h THR 87 N 0.00 1.53 -0.29 0.22 2.02 -0.68 -3.24 112.91 112.47 2d86 h THR 87 Ca 0.32 -1.65 0.00 0.00 0.77 0.00 0.00 66.41 65.86 2d86 h THR 87 Cb 1.42 2.60 -0.01 0.00 -1.74 0.00 0.00 68.15 70.42 2d86 h THR 87 CO -0.00 0.44 0.19 0.00 0.37 0.00 0.00 175.52 176.51 2d86 h ALA 88 N 0.33 1.78 -0.01 6.16 0.00 -0.36 0.23 119.26 127.40 2d86 h ALA 88 Ca -0.01 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.88 2d86 h ALA 88 Cb 0.75 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.42 2d86 h ALA 88 CO 0.01 0.20 0.01 0.00 0.00 0.00 0.00 179.25 179.47 2d86 n GLU 91 N -1.98 0.52 -0.02 0.00 -0.58 0.67 -3.49 120.64 115.76 2d86 n GLU 91 Ca -0.05 0.49 -0.16 0.00 -0.42 0.00 0.00 57.16 57.02 2d86 n GLU 91 Cb 0.40 -1.67 -0.11 0.00 -0.57 0.00 0.00 31.44 29.49 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 1.49 0.00 2.62 2.02 0.61 -3.42 112.91 115.23 2d86 h THR 92 Ca -0.24 -1.90 0.00 0.00 0.77 0.00 0.00 66.41 65.04 2d86 h THR 92 Cb 1.03 2.61 0.00 0.00 -1.74 0.00 0.00 68.15 70.06 2d86 h THR 92 CO -0.15 0.53 0.00 0.49 0.37 0.00 0.00 175.52 176.77 2d86 n PHE 93 N -4.44 0.00 0.00 3.16 3.01 -0.58 -5.04 117.46 113.57 2d86 n PHE 93 Ca -0.09 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.37 2d86 n PHE 93 Cb 0.53 -0.16 0.00 0.00 -0.01 0.00 0.00 39.48 39.84 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 1.70 0.75 3.94 1.37 0.00 0.99 -4.91 105.19 109.03 2d86 n GLY 94 Ca 0.00 -0.29 -0.22 0.00 0.00 0.00 0.00 46.02 45.51 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 3.36 0.12 1.61 -1.94 0.13 -4.91 119.30 117.65 2d86 s MET 95 Ca 0.00 -0.78 -0.31 0.00 -1.71 0.00 0.00 55.69 52.89 2d86 s MET 95 Cb 0.00 -2.85 -0.08 0.00 2.01 0.00 0.00 34.83 33.91 2d86 s MET 95 CO 0.00 0.44 1.45 1.03 -0.01 0.00 0.00 175.02 177.93 2d86 s ARG 96 N -3.84 4.29 0.39 2.03 0.52 -1.26 -4.50 118.95 116.57 2d86 s ARG 96 Ca 0.34 2.16 0.09 0.00 -0.52 0.00 0.00 55.73 57.79 2d86 s ARG 96 Cb -0.09 -3.24 0.79 0.00 0.52 0.00 0.00 34.95 32.92 2d86 s ARG 96 CO 0.28 -0.50 1.93 -0.22 0.02 0.00 0.00 175.30 176.82 2d86 h LYS 97 N 6.88 0.30 0.00 3.54 1.63 -1.96 -1.39 116.57 125.57 2d86 h LYS 97 Ca -0.42 -0.06 0.00 0.00 -0.85 0.00 0.00 60.65 59.32 2d86 h LYS 97 Cb 1.21 -0.05 0.00 0.00 -0.60 0.00 0.00 32.23 32.79 2d86 h LYS 97 CO 0.88 0.38 0.00 0.77 -3.45 0.00 0.00 179.45 178.04 2d86 h SER 98 N 0.29 0.00 0.38 4.20 0.02 -2.01 -2.54 113.55 113.89 2d86 h SER 98 Ca 0.06 0.00 -0.32 0.00 -0.84 0.00 0.00 61.79 60.70 2d86 h SER 98 Cb 0.31 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 62.83 2d86 h SER 98 CO 0.01 0.00 -1.69 -0.33 -1.14 0.00 0.00 176.83 173.68 2d86 h GLU 99 N 0.00 0.19 -6.85 3.45 5.08 -1.64 -3.47 114.58 111.34 2d86 h GLU 99 Ca 0.00 -0.32 -0.37 0.00 -1.00 0.00 0.00 59.36 57.67 2d86 h GLU 99 Cb 0.29 0.12 0.21 0.00 0.50 0.00 0.00 28.75 29.87 2d86 h GLU 99 CO 0.00 0.99 -0.22 1.28 -1.00 0.00 0.00 179.01 180.06 2d86 n LEU 100 N -3.36 -1.08 -4.91 1.33 4.77 -0.96 -4.66 117.00 108.14 2d86 n LEU 100 Ca -0.20 -0.56 -0.20 0.00 -0.03 0.00 0.00 56.01 55.01 2d86 n LEU 100 Cb 1.05 -1.04 -0.02 0.00 -2.33 0.00 0.00 43.42 41.07 2d86 n LEU 100 CO 0.47 -3.98 0.02 0.72 -1.33 0.00 0.00 177.39 173.30 2d86 s PHE 101 N -2.20 2.78 -0.24 -1.77 -0.12 -1.26 -5.03 117.98 110.15 2d86 s PHE 101 Ca 0.63 -0.43 -0.24 0.00 -0.05 0.00 0.00 56.93 56.84 2d86 s PHE 101 Cb -0.15 -2.15 -0.01 0.00 -0.63 0.00 0.00 43.02 40.08 2d86 s PHE 101 CO 0.57 -0.14 0.80 -2.00 -0.05 0.00 0.00 175.22 174.40 2d86 s GLU 102 N -4.16 4.18 0.22 1.99 2.56 -1.26 -4.93 118.70 117.30 2d86 s GLU 102 Ca 0.48 0.89 0.00 0.00 0.00 0.00 0.00 54.97 56.35 2d86 s GLU 102 Cb -0.05 -3.64 0.52 0.00 2.00 0.00 0.00 34.13 32.95 2d86 s GLU 102 CO 0.29 -0.50 1.14 0.00 -0.56 0.00 0.00 175.26 175.63 2d86 n ALA 103 N 5.94 0.34 0.35 6.30 0.00 -1.26 0.60 120.51 132.78 2d86 n ALA 103 Ca 0.05 0.78 -0.18 0.00 0.00 0.00 0.00 53.44 54.09 2d86 n ALA 103 Cb 0.48 -0.55 -0.09 0.00 0.00 0.00 0.00 19.45 19.28 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 -0.87 -0.88 0.00 3.57 -1.97 -1.98 116.94 114.81 2d86 h PHE 104 Ca 0.43 -0.02 0.33 0.00 3.53 0.00 0.00 57.97 62.24 2d86 h PHE 104 Cb 0.85 0.30 -0.12 0.00 2.79 0.00 0.00 35.95 39.77 2d86 h PHE 104 CO -0.40 -0.53 0.52 -0.25 -2.23 0.00 0.00 178.31 175.43 2d86 n ASP 105 N -5.48 0.21 -0.06 0.41 8.00 0.20 0.19 116.55 120.01 2d86 n ASP 105 Ca -0.13 1.14 -0.05 0.00 0.71 0.00 0.00 54.79 56.46 2d86 n ASP 105 Cb 0.37 -0.56 -0.05 0.00 -0.02 0.00 0.00 41.12 40.87 2d86 n ASP 105 CO 0.00 0.00 0.00 0.25 -0.39 0.00 0.00 177.20 177.06 2d86 h LEU 106 N 0.00 -0.00 -0.04 0.64 5.85 -1.31 0.67 115.31 121.12 2d86 h LEU 106 Ca 0.64 -0.35 0.01 0.00 0.84 0.00 0.00 57.88 59.02 2d86 h LEU 106 Cb 1.88 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 42.89 2d86 h LEU 106 CO -0.46 0.68 -0.14 0.15 -0.34 0.00 0.00 178.44 178.33 2d86 h PHE 107 N -1.00 -0.41 0.00 1.25 3.57 0.48 0.19 116.94 121.03 2d86 h PHE 107 Ca -0.00 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.52 2d86 h PHE 107 Cb 0.35 0.18 0.00 0.00 2.79 0.00 0.00 35.95 39.28 2d86 h PHE 107 CO 0.10 -0.13 0.00 -3.47 -2.23 0.00 0.00 178.31 172.58 2d86 n ASP 108 N -3.29 0.09 -3.20 0.41 2.03 -0.05 -4.88 116.55 107.65 2d86 n ASP 108 Ca -0.01 0.52 -0.16 0.00 0.52 0.00 0.00 54.79 55.66 2d86 n ASP 108 Cb 0.09 -0.54 0.08 0.00 -0.72 0.00 0.00 41.12 40.03 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 -1.60 -4.98 0.12 5.18 0.31 0.05 -4.97 118.33 112.45 2d86 n VAL 109 Ca 0.03 -0.38 -0.05 0.00 -0.01 0.00 0.00 64.34 63.93 2d86 n VAL 109 Cb 0.17 -4.59 -0.03 0.00 -0.91 0.00 0.00 33.84 28.48 2d86 n VAL 109 CO 0.00 0.00 0.00 0.03 -1.32 0.00 0.00 176.83 175.54 2d86 h ARG 110 N -1.83 -0.34 -3.70 5.55 2.47 0.10 -3.44 114.38 113.19 2d86 h ARG 110 Ca -0.53 0.02 -0.59 0.00 -1.26 0.00 0.00 59.98 57.62 2d86 h ARG 110 Cb 1.31 0.08 -0.40 0.00 -1.65 0.00 0.00 29.97 29.31 2d86 h ARG 110 CO 0.46 -0.23 -0.75 0.34 0.56 0.00 0.00 179.97 180.35 2d86 s ASP 111 N -4.03 4.13 0.10 7.04 -1.08 -1.23 -4.99 116.67 116.62 2d86 s ASP 111 Ca -0.05 -1.71 -0.15 0.00 -0.52 0.00 0.00 52.55 50.12 2d86 s ASP 111 Cb 0.01 -0.96 -0.07 0.00 -1.46 0.00 0.00 42.92 40.43 2d86 s ASP 111 CO 0.15 -0.41 1.45 0.15 0.52 0.00 0.00 175.17 177.04 2d86 h PHE 112 N 8.03 0.79 -1.47 -5.34 3.57 -1.84 -3.06 116.94 117.61 2d86 h PHE 112 Ca -0.12 -0.21 0.44 0.00 3.53 0.00 0.00 57.97 61.61 2d86 h PHE 112 Cb 1.01 -0.18 -0.09 0.00 2.79 0.00 0.00 35.95 39.48 2d86 h PHE 112 CO 0.37 0.92 1.01 0.78 -2.23 0.00 0.00 178.31 179.16 2d86 h GLY 113 N 0.43 0.65 1.32 2.40 0.00 -1.99 1.06 103.07 106.94 2d86 h GLY 113 Ca 0.06 -0.06 -0.10 0.00 0.00 0.00 0.00 47.33 47.23 2d86 h GLY 113 CO 0.05 -0.18 -0.13 0.50 0.00 0.00 0.00 176.54 176.79 2d86 h LYS 114 N 0.07 0.80 -0.12 4.80 1.57 -1.97 -2.22 116.57 119.50 2d86 h LYS 114 Ca 0.78 -0.28 -0.21 0.00 -1.87 0.00 0.00 60.65 59.08 2d86 h LYS 114 Cb 2.78 -0.06 0.00 0.00 0.08 0.00 0.00 32.23 35.03 2d86 h LYS 114 CO -0.20 0.89 -0.76 0.28 -0.57 0.00 0.00 179.45 179.08 2d86 h VAL 115 N 0.72 1.32 -0.34 0.50 2.07 0.10 -3.20 116.25 117.42 2d86 h VAL 115 Ca 0.12 -2.04 -0.01 0.00 0.82 0.00 0.00 66.70 65.58 2d86 h VAL 115 Cb 0.62 2.03 -0.02 0.00 -1.52 0.00 0.00 31.29 32.41 2d86 h VAL 115 CO 0.04 0.63 0.16 0.40 0.02 0.00 0.00 177.57 178.83 2d86 h ILE 116 N 0.43 1.16 0.00 4.57 2.04 -1.18 -3.14 117.51 121.40 2d86 h ILE 116 Ca -0.04 -0.46 0.03 0.00 1.00 0.00 0.00 64.86 65.39 2d86 h ILE 116 Cb 1.37 0.84 -0.05 0.00 -0.74 0.00 0.00 36.82 38.24 2d86 h ILE 116 CO 0.15 0.17 -0.40 -0.08 0.00 0.00 0.00 178.15 177.98 2d86 h GLU 117 N 0.41 -0.54 -0.81 2.37 4.57 -1.45 -1.80 114.58 117.33 2d86 h GLU 117 Ca 0.12 0.04 0.20 0.00 -1.18 0.00 0.00 59.36 58.53 2d86 h GLU 117 Cb 0.12 0.12 -0.15 0.00 -0.16 0.00 0.00 28.75 28.68 2d86 h GLU 117 CO -0.01 -0.36 -0.07 2.41 -1.18 0.00 0.00 179.01 179.80 2d86 n THR 118 N -5.45 -0.34 -0.02 0.32 -1.04 -1.19 0.80 114.28 107.37 2d86 n THR 118 Ca -0.06 1.81 -0.13 0.00 -2.04 0.00 0.00 64.05 63.64 2d86 n THR 118 Cb 0.36 -2.59 -0.08 0.00 -1.82 0.00 0.00 70.33 66.20 2d86 n THR 118 CO 0.00 0.00 0.00 -0.07 -0.64 0.00 0.00 175.07 174.36 2d86 h LEU 119 N 0.00 0.11 -0.96 -4.42 3.38 -1.41 0.61 115.31 112.62 2d86 h LEU 119 Ca 0.45 -0.39 0.30 0.00 0.09 0.00 0.00 57.88 58.33 2d86 h LEU 119 Cb 0.85 -0.03 -0.16 0.00 0.09 0.00 0.00 40.66 41.41 2d86 h LEU 119 CO -0.79 0.47 0.34 0.28 0.09 0.00 0.00 178.44 178.83 2d86 h SER 120 N -0.26 0.09 0.09 -0.43 0.02 0.11 -0.24 113.55 112.95 2d86 h SER 120 Ca 0.01 0.23 -0.19 0.00 -0.84 0.00 0.00 61.79 61.00 2d86 h SER 120 Cb 0.43 0.28 0.00 0.00 0.14 0.00 0.00 62.40 63.25 2d86 h SER 120 CO 0.01 -0.25 -0.95 0.08 -1.14 0.00 0.00 176.83 174.58 2d86 h ARG 121 N 0.15 0.19 -1.00 3.45 0.11 -1.28 -3.35 114.38 112.66 2d86 h ARG 121 Ca 0.67 -0.33 0.31 0.00 0.10 0.00 0.00 59.98 60.73 2d86 h ARG 121 Cb 1.51 0.12 -0.18 0.00 1.11 0.00 0.00 29.97 32.52 2d86 h ARG 121 CO -0.72 1.16 0.14 1.25 0.10 0.00 0.00 179.97 181.90 2d86 h LEU 122 N -0.53 -0.30 -0.92 0.08 5.85 0.87 0.71 115.31 121.06 2d86 h LEU 122 Ca -0.20 0.28 0.27 0.00 0.84 0.00 0.00 57.88 59.07 2d86 h LEU 122 Cb 1.54 0.44 -0.15 0.00 0.37 0.00 0.00 40.66 42.86 2d86 h LEU 122 CO 0.05 -0.38 0.32 0.77 -0.34 0.00 0.00 178.44 178.86 2d86 h SER 123 N 0.00 0.11 -1.14 1.25 4.64 -1.45 0.36 113.55 117.32 2d86 h SER 123 Ca 0.66 0.21 0.40 0.00 -0.47 0.00 0.00 61.79 62.59 2d86 h SER 123 Cb 1.48 0.25 -0.15 0.00 -0.31 0.00 0.00 62.40 63.67 2d86 h SER 123 CO -0.90 -0.18 0.68 0.08 -0.87 0.00 0.00 176.83 175.64 2d86 h ARG 124 N 0.21 0.11 -6.26 4.77 -0.00 0.24 -3.30 114.38 110.15 2d86 h ARG 124 Ca 0.62 -0.01 -0.60 0.00 -0.00 0.00 0.00 59.98 59.99 2d86 h ARG 124 Cb 1.32 -0.02 0.17 0.00 -0.00 0.00 0.00 29.97 31.43 2d86 h ARG 124 CO -0.67 0.07 -0.69 0.25 -0.00 0.00 0.00 179.97 178.93 2d86 n THR 125 N -4.97 1.29 0.98 0.08 -2.24 0.12 -4.78 114.28 104.77 2d86 n THR 125 Ca 0.36 -0.50 0.07 0.00 -2.27 0.00 0.00 64.05 61.71 2d86 n THR 125 Cb 1.28 -0.37 0.39 0.00 -2.10 0.00 0.00 70.33 69.53 2d86 n THR 125 CO 0.00 0.00 0.00 -0.81 -0.57 0.00 0.00 175.07 173.69 2d86 n PRO 126 N 0.70 0.49 -0.12 -0.78 -0.04 -1.26 -2.97 135.00 131.02 2d86 n PRO 126 Ca 0.10 0.00 -0.25 0.00 -0.04 0.00 0.00 63.50 63.31 2d86 n PRO 126 Cb 0.45 -1.42 -0.11 0.00 -0.04 0.00 0.00 33.50 32.38 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 -0.92 1.55 -0.07 0.52 -0.00 -1.26 -3.34 119.36 115.83 2d86 n ILE 127 Ca 0.10 -0.28 -0.10 0.00 -0.00 0.00 0.00 62.75 62.47 2d86 n ILE 127 Cb 0.05 -1.90 -0.03 0.00 -0.00 0.00 0.00 39.64 37.76 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 -0.65 0.31 -0.30 -1.39 0.00 -1.70 -2.80 119.26 112.72 2d86 h ALA 128 Ca -0.54 -0.06 -0.12 0.00 0.00 0.00 0.00 54.91 54.20 2d86 h ALA 128 Cb 1.55 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 19.23 2d86 h ALA 128 CO -0.28 -0.17 -0.30 -0.07 0.00 0.00 0.00 179.25 178.44 2d86 h LEU 129 N 0.29 0.65 -0.73 0.00 3.38 -1.62 -3.15 115.31 114.13 2d86 h LEU 129 Ca 0.09 -0.25 0.15 0.00 0.09 0.00 0.00 57.88 57.96 2d86 h LEU 129 Cb 0.05 -0.18 -0.14 0.00 0.09 0.00 0.00 40.66 40.48 2d86 h LEU 129 CO -0.01 0.91 -0.12 0.00 0.09 0.00 0.00 178.44 179.30 2d86 h ALA 130 N 1.13 0.58 -0.77 1.53 0.00 -1.50 0.41 119.26 120.64 2d86 h ALA 130 Ca 0.07 0.27 0.08 0.00 0.00 0.00 0.00 54.91 55.33 2d86 h ALA 130 Cb 0.78 0.51 -0.05 0.00 0.00 0.00 0.00 17.79 19.03 2d86 h ALA 130 CO 0.06 -0.42 0.51 1.79 0.00 0.00 0.00 179.25 181.19 2d86 h THR 131 N 0.03 0.98 0.00 0.00 1.35 -1.50 -3.46 112.91 110.31 2d86 h THR 131 Ca 0.37 -0.26 0.00 0.00 -0.55 0.00 0.00 66.41 65.97 2d86 h THR 131 Cb 0.60 0.16 0.00 0.00 -1.73 0.00 0.00 68.15 67.18 2d86 h THR 131 CO -0.72 0.14 0.00 0.61 -0.25 0.00 0.00 175.52 175.30 2d86 n GLY 132 N -1.44 1.16 3.80 5.82 0.00 0.14 -5.08 105.19 109.59 2d86 n GLY 132 Ca 0.12 -0.11 -0.36 0.00 0.00 0.00 0.00 46.02 45.67 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 4.34 -0.49 -0.61 1.01 -1.26 -4.92 121.20 117.27 2d86 s ILE 133 Ca 0.00 1.61 -0.36 0.00 0.00 0.00 0.00 60.65 61.91 2d86 s ILE 133 Cb 0.00 -3.90 -0.14 0.00 0.01 0.00 0.00 42.46 38.43 2d86 s ILE 133 CO 0.00 0.07 2.28 0.54 0.00 0.00 0.00 174.94 177.83 2d86 n ARG 134 N 0.37 0.68 -2.25 2.79 5.12 -1.26 -4.86 116.66 117.25 2d86 n ARG 134 Ca 0.02 0.16 -0.40 0.00 -1.93 0.00 0.00 57.85 55.69 2d86 n ARG 134 Cb 0.51 -2.21 -0.03 0.00 -1.16 0.00 0.00 32.46 29.57 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 6.78 4.36 0.70 5.56 0.04 -1.26 -4.86 135.00 146.33 2d86 s PRO 135 Ca 1.15 2.02 -0.17 0.00 0.04 0.00 0.00 61.00 64.03 2d86 s PRO 135 Cb -0.99 -3.01 -0.11 0.00 0.04 0.00 0.00 34.50 30.43 2d86 s PRO 135 CO 0.50 -0.11 -0.03 1.19 0.04 0.00 0.00 177.00 178.59 2d86 n PHE 136 N 0.74 -2.63 -2.26 0.56 3.01 -1.26 -4.88 117.46 110.73 2d86 n PHE 136 Ca 0.01 0.30 -0.38 0.00 1.01 0.00 0.00 57.45 58.39 2d86 n PHE 136 Cb 0.44 -1.72 -0.02 0.00 -0.01 0.00 0.00 39.48 38.17 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 -1.91 4.00 -0.11 -1.08 0.04 -1.26 -5.05 135.00 129.64 2d86 s PRO 137 Ca 0.56 1.87 0.02 0.00 0.04 0.00 0.00 61.00 63.49 2d86 s PRO 137 Cb -0.37 -2.65 0.01 0.00 0.04 0.00 0.00 34.50 31.54 2d86 s PRO 137 CO 0.67 -0.37 -0.15 0.45 0.04 0.00 0.00 177.00 177.63 2d86 s SER 138 N -1.11 2.42 0.15 6.66 0.15 -1.26 -5.11 113.70 115.60 2d86 s SER 138 Ca 0.58 -0.42 -0.23 0.00 0.70 0.00 0.00 55.95 56.57 2d86 s SER 138 Cb -0.31 -1.08 0.08 0.00 -1.71 0.00 0.00 66.02 62.99 2d86 s SER 138 CO 0.39 0.02 1.09 -0.83 1.20 0.00 0.00 173.24 175.11 2d86 s GLY 139 N 0.96 0.09 -1.03 9.45 0.00 -1.26 -5.08 107.32 110.44 2d86 s GLY 139 Ca -0.07 -0.29 -0.24 0.00 0.00 0.00 0.00 44.72 44.12 2d86 s GLY 139 CO -0.01 3.16 1.94 2.56 0.00 0.00 0.00 173.10 180.75 2d86 s PRO 140 N -2.10 2.53 0.29 2.90 0.04 -1.26 -4.94 135.00 132.45 2d86 s PRO 140 Ca 0.24 -0.70 0.04 0.00 0.04 0.00 0.00 61.00 60.62 2d86 s PRO 140 Cb -0.02 -5.15 -0.03 0.00 0.04 0.00 0.00 34.50 29.34 2d86 s PRO 140 CO 0.04 -3.66 0.43 0.45 0.04 0.00 0.00 177.00 174.31 2d86 s SER 141 N 7.31 6.23 0.22 6.66 0.15 -1.26 -5.04 113.70 127.97 2d86 s SER 141 Ca 0.69 0.12 -0.31 0.00 0.70 0.00 0.00 55.95 57.15 2d86 s SER 141 Cb -0.04 -1.77 -0.15 0.00 -1.71 0.00 0.00 66.02 62.34 2d86 s SER 141 CO 0.06 -0.21 1.06 -1.54 1.20 0.00 0.00 173.24 173.80 2d86 n SER 142 N -1.56 1.12 0.00 5.45 3.41 -1.26 -5.30 113.62 115.47 2d86 n SER 142 Ca -0.06 1.15 0.00 0.00 -0.26 0.00 0.00 58.87 59.70 2d86 n SER 142 Cb 0.57 -1.22 0.00 0.00 -0.26 0.00 0.00 64.21 63.30 2d86 n SER 142 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49