#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1b22 n GLU 17 N 0.00 2.82 0.00 3.44 -0.00 -1.26 -4.96 120.64 120.68 1b22 n GLU 17 Ca 0.00 1.02 0.00 0.00 -0.00 0.00 0.00 57.16 58.18 1b22 n GLU 17 Cb 0.00 -2.91 0.00 0.00 -0.00 0.00 0.00 31.44 28.53 1b22 n GLU 17 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.13 176.28 1b22 n GLU 18 N 5.31 2.48 0.00 3.44 0.28 -1.26 -5.18 120.64 125.71 1b22 n GLU 18 Ca 0.18 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.18 1b22 n GLU 18 Cb 0.37 0.00 0.00 0.00 1.43 0.00 0.00 31.44 33.24 1b22 n GLU 18 CO 0.00 0.00 0.00 -1.13 -0.16 0.00 0.00 177.13 175.84 1b22 n SER 19 N 0.00 0.48 -0.14 -1.84 3.41 -1.26 -5.04 113.62 109.23 1b22 n SER 19 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 1b22 n SER 19 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 1b22 n SER 19 CO 0.00 0.00 0.00 0.49 -0.16 0.00 0.00 175.04 175.37 1b22 n PHE 20 N 0.00 -0.09 0.00 7.33 3.72 -1.26 -5.09 117.46 122.06 1b22 n PHE 20 Ca 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.40 1b22 n PHE 20 Cb 0.00 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.54 1b22 n PHE 20 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1b22 n GLY 21 N 0.00 -0.98 0.10 1.37 0.00 -1.26 -4.77 105.19 99.65 1b22 n GLY 21 Ca 0.00 -0.13 -0.03 0.00 0.00 0.00 0.00 46.02 45.86 1b22 n GLY 21 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1b22 h PRO 22 N 0.00 0.00 -5.90 1.61 0.13 -1.96 -3.48 132.00 122.40 1b22 h PRO 22 Ca 0.00 0.00 -0.40 0.00 -0.87 0.00 0.00 66.00 64.73 1b22 h PRO 22 Cb 0.00 0.00 0.11 0.00 0.13 0.00 0.00 31.00 31.24 1b22 h PRO 22 CO 0.00 0.78 -0.71 1.04 -0.23 0.00 0.00 178.00 178.87 1b22 n GLN 23 N -3.47 -7.26 -0.80 0.86 6.02 -1.26 -4.25 117.38 107.21 1b22 n GLN 23 Ca -0.00 0.79 -0.33 0.00 -0.01 0.00 0.00 57.00 57.44 1b22 n GLN 23 Cb 0.79 -5.79 -0.05 0.00 1.02 0.00 0.00 30.24 26.21 1b22 n GLN 23 CO 0.00 0.00 0.00 -0.35 -1.01 0.00 0.00 177.06 175.70 1b22 n PRO 24 N -4.80 1.22 0.00 -1.09 -0.04 -1.26 -1.74 135.00 127.29 1b22 n PRO 24 Ca -0.05 -1.45 0.01 0.00 -0.04 0.00 0.00 63.50 61.97 1b22 n PRO 24 Cb 0.58 -2.62 0.04 0.00 -0.04 0.00 0.00 33.50 31.45 1b22 n PRO 24 CO 0.00 0.00 0.00 0.44 -0.04 0.00 0.00 175.50 175.90 1b22 n ILE 25 N 5.61 0.00 0.00 0.52 -6.64 -1.26 -4.36 119.36 113.23 1b22 n ILE 25 Ca 0.42 0.00 0.00 0.00 -1.77 0.00 0.00 62.75 61.40 1b22 n ILE 25 Cb 0.29 -0.23 0.00 0.00 -1.44 0.00 0.00 39.64 38.26 1b22 n ILE 25 CO 0.00 0.00 0.00 -0.24 -1.77 0.00 0.00 176.55 174.54 1b22 n SER 26 N -0.54 0.00 0.18 7.28 2.88 -1.23 -0.00 113.62 122.19 1b22 n SER 26 Ca 0.01 0.72 0.14 0.00 -1.33 0.00 0.00 58.87 58.40 1b22 n SER 26 Cb 0.00 -0.31 0.50 0.00 -0.75 0.00 0.00 64.21 63.65 1b22 n SER 26 CO 0.00 0.00 0.00 -0.09 -1.23 0.00 0.00 175.04 173.72 1b22 h ARG 27 N 0.00 0.00 0.00 -1.46 2.43 -1.86 -2.52 114.38 110.98 1b22 h ARG 27 Ca 0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 1b22 h ARG 27 Cb 0.00 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.55 1b22 h ARG 27 CO 0.00 0.00 0.00 1.28 -1.51 0.00 0.00 179.97 179.74 1b22 n LEU 28 N -2.61 0.00 0.01 3.80 7.99 0.99 -2.50 117.00 124.69 1b22 n LEU 28 Ca 0.02 0.62 -0.09 0.00 -0.01 0.00 0.00 56.01 56.55 1b22 n LEU 28 Cb 0.33 -0.12 -0.13 0.00 -0.11 0.00 0.00 43.42 43.38 1b22 n LEU 28 CO 0.26 -0.12 -0.29 1.05 -1.51 0.00 0.00 177.39 176.78 1b22 h GLU 29 N 0.00 0.03 -0.20 3.23 -0.00 -1.63 -2.61 114.58 113.40 1b22 h GLU 29 Ca 0.00 -0.05 -0.08 0.00 -0.00 0.00 0.00 59.36 59.24 1b22 h GLU 29 Cb 0.00 0.02 -0.01 0.00 -0.00 0.00 0.00 28.75 28.75 1b22 h GLU 29 CO 0.00 0.73 -0.21 0.37 -0.00 0.00 0.00 179.01 179.90 1b22 h GLN 30 N 0.01 0.35 0.00 1.06 -0.00 -1.57 -1.42 115.11 113.53 1b22 h GLN 30 Ca -0.19 -0.11 0.00 0.00 -0.00 0.00 0.00 58.65 58.34 1b22 h GLN 30 Cb 1.93 -0.03 0.00 0.00 0.00 0.00 0.00 27.48 29.38 1b22 h GLN 30 CO 0.10 0.56 0.00 0.00 0.00 0.00 0.00 178.83 179.49 1b22 n GLY 32 N 1.14 0.64 0.00 0.00 0.00 -0.54 -5.06 105.19 101.37 1b22 n GLY 32 Ca 0.05 -0.70 0.00 0.00 0.00 0.00 0.00 46.02 45.37 1b22 n GLY 32 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 1b22 n ILE 33 N 0.00 0.00 0.00 -0.61 3.06 -0.99 -4.93 119.36 115.89 1b22 n ILE 33 Ca 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 62.75 60.25 1b22 n ILE 33 Cb 0.00 0.00 0.00 0.00 0.54 0.00 0.00 39.64 40.18 1b22 n ILE 33 CO 0.00 0.00 0.00 -3.20 -2.50 0.00 0.00 176.55 170.85 1b22 n ASN 34 N 0.00 0.00 0.15 9.51 4.05 -1.26 -4.83 115.26 122.88 1b22 n ASN 34 Ca 0.00 0.00 0.08 0.00 0.45 0.00 0.00 54.58 55.11 1b22 n ASN 34 Cb 0.00 0.00 0.07 0.00 1.23 0.00 0.00 39.78 41.08 1b22 n ASN 34 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 1b22 h ALA 35 N -2.00 0.77 -0.63 5.20 0.00 -1.94 -3.37 119.26 117.29 1b22 h ALA 35 Ca 0.00 -0.22 0.06 0.00 0.00 0.00 0.00 54.91 54.76 1b22 h ALA 35 Cb 0.00 0.01 -0.09 0.00 0.00 0.00 0.00 17.79 17.70 1b22 h ALA 35 CO 0.00 0.27 -0.55 -0.91 0.00 0.00 0.00 179.25 178.05 1b22 h ASN 36 N 0.00 -1.93 0.00 0.00 2.35 -1.88 -2.83 115.58 111.29 1b22 h ASN 36 Ca -0.02 0.27 0.00 0.00 -0.55 0.00 0.00 56.30 56.00 1b22 h ASN 36 Cb 1.17 0.82 0.00 0.00 0.05 0.00 0.00 38.32 40.36 1b22 h ASN 36 CO 0.02 -0.32 0.00 -0.67 -1.65 0.00 0.00 177.43 174.81 1b22 n ASP 37 N -5.24 0.00 0.19 5.81 -0.08 -1.25 0.18 116.55 116.15 1b22 n ASP 37 Ca -0.01 0.27 -0.15 0.00 -1.51 0.00 0.00 54.79 53.39 1b22 n ASP 37 Cb 0.30 -0.11 -0.08 0.00 2.34 0.00 0.00 41.12 43.57 1b22 n ASP 37 CO 0.00 0.00 0.00 0.58 0.12 0.00 0.00 177.20 177.90 1b22 h VAL 38 N 0.00 0.00 0.00 5.18 2.07 -1.80 -3.04 116.25 118.66 1b22 h VAL 38 Ca 0.00 0.00 -0.03 0.00 0.82 0.00 0.00 66.70 67.49 1b22 h VAL 38 Cb 0.00 0.00 -0.00 0.00 -1.52 0.00 0.00 31.29 29.77 1b22 h VAL 38 CO 0.00 0.00 -0.22 0.11 0.02 0.00 0.00 177.57 177.48 1b22 h LYS 39 N -0.77 0.00 -0.15 1.57 6.56 -1.09 -2.91 116.57 119.79 1b22 h LYS 39 Ca -0.04 0.00 0.02 0.00 -1.06 0.00 0.00 60.65 59.58 1b22 h LYS 39 Cb 0.70 0.00 -0.04 0.00 -0.57 0.00 0.00 32.23 32.32 1b22 h LYS 39 CO -0.12 0.61 -0.32 -0.22 -2.06 0.00 0.00 179.45 177.34 1b22 h LYS 40 N -1.00 -0.27 0.00 3.15 3.11 0.17 -3.08 116.57 118.64 1b22 h LYS 40 Ca -0.05 0.02 0.00 0.00 -2.81 0.00 0.00 60.65 57.81 1b22 h LYS 40 Cb 0.70 0.06 0.00 0.00 -1.00 0.00 0.00 32.23 31.99 1b22 h LYS 40 CO -0.03 -0.18 -0.49 1.37 -2.81 0.00 0.00 179.45 177.31 1b22 h LEU 41 N -0.28 0.00 0.17 5.20 8.10 -1.44 -3.30 115.31 123.75 1b22 h LEU 41 Ca 0.03 -0.12 -0.26 0.00 0.11 0.00 0.00 57.88 57.64 1b22 h LEU 41 Cb 0.37 0.00 0.02 0.00 -0.44 0.00 0.00 40.66 40.60 1b22 h LEU 41 CO -0.29 0.06 -1.19 -0.08 -4.11 0.00 0.00 178.44 172.83 1b22 h GLU 42 N 0.00 0.35 0.00 0.17 4.81 -1.43 -1.74 114.58 116.74 1b22 h GLU 42 Ca 0.00 -0.60 -0.01 0.00 -0.13 0.00 0.00 59.36 58.62 1b22 h GLU 42 Cb 0.80 0.22 -0.00 0.00 0.63 0.00 0.00 28.75 30.41 1b22 h GLU 42 CO 0.00 1.29 -0.04 1.49 -0.73 0.00 0.00 179.01 181.02 1b22 h GLU 43 N -0.20 0.00 0.00 1.92 4.81 -1.73 -3.42 114.58 115.97 1b22 h GLU 43 Ca -0.22 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.01 1b22 h GLU 43 Cb 1.83 0.00 0.00 0.00 0.63 0.00 0.00 28.75 31.21 1b22 h GLU 43 CO 0.16 0.04 0.00 0.00 -0.73 0.00 0.00 179.01 178.48 1b22 n ALA 44 N -2.11 2.62 0.00 2.92 0.00 -1.25 -5.10 120.51 117.59 1b22 n ALA 44 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.46 1b22 n ALA 44 Cb 0.42 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.87 1b22 n ALA 44 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1b22 n GLY 45 N 2.30 0.48 1.15 0.00 0.00 -0.65 -4.99 105.19 103.48 1b22 n GLY 45 Ca 0.00 -0.05 -0.01 0.00 0.00 0.00 0.00 46.02 45.96 1b22 n GLY 45 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1b22 n PHE 46 N 0.00 0.89 -0.21 1.61 3.01 -1.26 -4.70 117.46 116.81 1b22 n PHE 46 Ca 0.00 -0.49 -0.05 0.00 1.01 0.00 0.00 57.45 57.91 1b22 n PHE 46 Cb 0.00 -0.33 -0.01 0.00 -0.01 0.00 0.00 39.48 39.13 1b22 n PHE 46 CO 0.00 0.00 0.00 -2.39 1.01 0.00 0.00 176.76 175.38 1b22 n HIS 47 N 0.13 0.29 -4.03 1.38 1.44 -1.26 -4.44 115.22 108.73 1b22 n HIS 47 Ca 0.14 -0.75 0.04 0.00 -2.01 0.00 0.00 57.72 55.14 1b22 n HIS 47 Cb 0.71 -0.83 0.01 0.00 0.12 0.00 0.00 29.99 29.99 1b22 n HIS 47 CO 0.00 0.00 0.00 -2.37 -2.81 0.00 0.00 176.34 171.16 1b22 n THR 48 N 4.24 0.00 -0.28 0.61 5.66 -1.26 -3.55 114.28 119.70 1b22 n THR 48 Ca 0.12 -0.01 0.29 0.00 -3.05 0.00 0.00 64.05 61.39 1b22 n THR 48 Cb 0.07 0.41 0.45 0.00 -1.55 0.00 0.00 70.33 69.71 1b22 n THR 48 CO 0.00 0.00 0.00 0.52 -3.05 0.00 0.00 175.07 172.54 1b22 n VAL 49 N -0.80 0.00 -0.01 1.08 0.31 -0.71 -1.59 118.33 116.61 1b22 n VAL 49 Ca 0.05 1.12 0.17 0.00 -0.01 0.00 0.00 64.34 65.67 1b22 n VAL 49 Cb 0.47 -1.98 0.26 0.00 -0.91 0.00 0.00 33.84 31.68 1b22 n VAL 49 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 1b22 n GLU 50 N -3.11 0.02 -0.56 5.55 1.02 -1.26 -2.99 120.64 119.31 1b22 n GLU 50 Ca 0.24 0.94 -0.15 0.00 -0.02 0.00 0.00 57.16 58.18 1b22 n GLU 50 Cb 1.41 -2.42 -0.03 0.00 -0.02 0.00 0.00 31.44 30.38 1b22 n GLU 50 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1b22 n ALA 51 N -1.91 3.83 -1.00 0.62 0.00 -0.62 -3.27 120.51 118.16 1b22 n ALA 51 Ca 0.14 -1.41 0.00 0.00 0.00 0.00 0.00 53.44 52.17 1b22 n ALA 51 Cb 1.27 -2.75 0.00 0.00 0.00 0.00 0.00 19.45 17.97 1b22 n ALA 51 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1b22 n VAL 52 N 3.98 0.00 -0.00 0.00 0.31 -1.16 -4.81 118.33 116.65 1b22 n VAL 52 Ca 0.32 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.65 1b22 n VAL 52 Cb 0.18 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.11 1b22 n VAL 52 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1b22 n ALA 53 N -1.03 2.12 0.10 3.52 0.00 -1.25 -4.63 120.51 119.34 1b22 n ALA 53 Ca 0.00 -0.88 -0.02 0.00 0.00 0.00 0.00 53.44 52.53 1b22 n ALA 53 Cb 0.00 -0.01 -0.05 0.00 0.00 0.00 0.00 19.45 19.39 1b22 n ALA 53 CO 0.00 0.00 0.00 -0.92 0.00 0.00 0.00 177.50 176.58 1b22 h TYR 54 N 0.03 0.00 -1.61 0.00 5.03 -1.89 -3.46 116.97 115.07 1b22 h TYR 54 Ca 0.00 0.00 0.08 0.00 2.58 0.00 0.00 58.73 61.39 1b22 h TYR 54 Cb 0.38 0.00 -0.26 0.00 1.55 0.00 0.00 36.73 38.40 1b22 h TYR 54 CO 0.00 0.76 0.37 0.00 -1.32 0.00 0.00 178.16 177.97 1b22 s ALA 55 N -2.83 -2.12 -0.56 1.82 0.00 -1.26 -5.09 121.76 111.72 1b22 s ALA 55 Ca 0.02 2.10 -0.27 0.00 0.00 0.00 0.00 51.96 53.82 1b22 s ALA 55 Cb 0.09 -1.57 -0.03 0.00 0.00 0.00 0.00 23.12 21.60 1b22 s ALA 55 CO 0.78 -0.31 1.95 -1.25 0.00 0.00 0.00 175.76 176.94 1b22 s PRO 56 N 0.94 2.61 0.20 0.00 0.04 -1.26 -4.68 135.00 132.85 1b22 s PRO 56 Ca -0.04 0.83 -0.01 0.00 0.04 0.00 0.00 61.00 61.82 1b22 s PRO 56 Cb -0.04 -4.40 0.45 0.00 0.04 0.00 0.00 34.50 30.54 1b22 s PRO 56 CO -0.12 -2.74 1.04 1.63 0.04 0.00 0.00 177.00 176.85 1b22 n LYS 57 N 9.08 -0.06 -0.34 4.56 4.01 -1.26 0.27 118.16 134.42 1b22 n LYS 57 Ca 0.23 1.01 0.23 0.00 -0.51 0.00 0.00 58.31 59.27 1b22 n LYS 57 Cb 0.52 -1.58 0.48 0.00 -0.51 0.00 0.00 35.03 33.94 1b22 n LYS 57 CO 0.00 0.00 0.00 0.87 -1.11 0.00 0.00 177.40 177.16 1b22 h LYS 58 N 0.00 0.40 0.02 1.97 1.57 -1.90 0.55 116.57 119.19 1b22 h LYS 58 Ca 0.38 -0.02 -0.00 0.00 -1.87 0.00 0.00 60.65 59.13 1b22 h LYS 58 Cb 0.73 -0.09 0.00 0.00 0.08 0.00 0.00 32.23 32.95 1b22 h LYS 58 CO -0.65 0.27 -0.01 1.49 -0.57 0.00 0.00 179.45 179.98 1b22 h GLU 59 N 0.42 -0.03 -0.36 3.15 4.81 0.34 -2.93 114.58 119.96 1b22 h GLU 59 Ca 0.66 0.00 0.06 0.00 -0.13 0.00 0.00 59.36 59.95 1b22 h GLU 59 Cb 1.55 0.01 -0.09 0.00 0.63 0.00 0.00 28.75 30.85 1b22 h GLU 59 CO -0.42 0.31 -0.43 1.25 -0.73 0.00 0.00 179.01 178.99 1b22 h LEU 60 N -1.00 -1.42 -1.93 1.64 5.85 -0.81 0.76 115.31 118.40 1b22 h LEU 60 Ca -0.00 0.21 0.24 0.00 0.84 0.00 0.00 57.88 59.17 1b22 h LEU 60 Cb 0.35 0.61 -0.04 0.00 0.37 0.00 0.00 40.66 41.96 1b22 h LEU 60 CO 0.01 -0.38 0.62 0.16 -0.34 0.00 0.00 178.44 178.51 1b22 h ILE 61 N -0.35 0.58 0.00 4.05 -0.00 -0.07 0.60 117.51 122.32 1b22 h ILE 61 Ca 0.13 -0.02 0.00 0.00 -0.00 0.00 0.00 64.86 64.97 1b22 h ILE 61 Cb 0.59 0.52 0.00 0.00 -0.00 0.00 0.00 36.82 37.93 1b22 h ILE 61 CO -0.55 0.01 0.23 -0.46 -0.00 0.00 0.00 178.15 177.39 1b22 n ASN 62 N -4.31 0.13 0.00 2.16 6.94 0.26 -1.41 115.26 119.03 1b22 n ASN 62 Ca 0.18 0.40 0.00 0.00 -0.02 0.00 0.00 54.58 55.14 1b22 n ASN 62 Cb 0.90 -0.38 0.00 0.00 -2.36 0.00 0.00 39.78 37.94 1b22 n ASN 62 CO 0.00 0.00 0.00 -0.38 -1.03 0.00 0.00 177.26 175.85 1b22 n ILE 63 N -1.59 0.00 0.10 1.53 5.41 0.21 -3.19 119.36 121.83 1b22 n ILE 63 Ca -0.00 0.49 -0.01 0.00 1.00 0.00 0.00 62.75 64.23 1b22 n ILE 63 Cb 0.24 -1.12 0.24 0.00 -0.71 0.00 0.00 39.64 38.29 1b22 n ILE 63 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 176.55 177.05 1b22 h LYS 64 N 0.00 0.22 0.00 0.38 3.11 -1.83 -3.46 116.57 114.99 1b22 h LYS 64 Ca 0.00 -0.10 0.00 0.00 -2.81 0.00 0.00 60.65 57.74 1b22 h LYS 64 Cb 0.00 -0.00 0.00 0.00 -1.00 0.00 0.00 32.23 31.23 1b22 h LYS 64 CO 0.00 0.59 0.00 0.41 -2.81 0.00 0.00 179.45 177.64 1b22 n GLY 65 N -0.23 0.61 0.00 5.01 0.00 -1.08 -5.15 105.19 104.35 1b22 n GLY 65 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.01 1b22 n GLY 65 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1b22 n ILE 66 N 0.00 0.00 0.00 -0.61 -0.00 -0.50 -4.91 119.36 113.34 1b22 n ILE 66 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 62.75 62.75 1b22 n ILE 66 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 39.64 39.64 1b22 n ILE 66 CO 0.00 0.00 0.00 -1.54 -0.00 0.00 0.00 176.55 175.01 1b22 n SER 67 N 0.00 0.00 0.29 4.38 3.41 -1.26 -4.40 113.62 116.04 1b22 n SER 67 Ca 0.00 0.00 0.17 0.00 -0.26 0.00 0.00 58.87 58.78 1b22 n SER 67 Cb 0.00 0.00 0.88 0.00 -0.26 0.00 0.00 64.21 64.83 1b22 n SER 67 CO 0.00 0.00 0.00 -0.08 -0.16 0.00 0.00 175.04 174.80 1b22 h GLU 68 N 0.00 0.00 0.00 4.33 4.81 -1.95 -2.88 114.58 118.89 1b22 h GLU 68 Ca 0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 1b22 h GLU 68 Cb 0.00 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.38 1b22 h GLU 68 CO 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 179.01 178.28 1b22 n ALA 69 N -1.90 0.00 0.02 2.92 0.00 -1.26 -1.02 120.51 119.27 1b22 n ALA 69 Ca -0.02 0.00 -0.22 0.00 0.00 0.00 0.00 53.44 53.20 1b22 n ALA 69 Cb 0.20 0.26 -0.14 0.00 0.00 0.00 0.00 19.45 19.77 1b22 n ALA 69 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 177.50 179.07 1b22 h LYS 70 N 0.00 0.28 -0.11 0.00 2.10 -1.96 -3.05 116.57 113.83 1b22 h LYS 70 Ca 0.00 -0.48 0.03 0.00 -2.00 0.00 0.00 60.65 58.20 1b22 h LYS 70 Cb 0.00 0.18 -0.06 0.00 -0.90 0.00 0.00 32.23 31.45 1b22 h LYS 70 CO 0.00 1.23 -0.54 0.00 -2.00 0.00 0.00 179.45 178.14 1b22 h ALA 71 N 0.00 -0.89 -0.42 0.07 0.00 -1.58 -1.26 119.26 115.19 1b22 h ALA 71 Ca -0.35 -0.06 0.02 0.00 0.00 0.00 0.00 54.91 54.51 1b22 h ALA 71 Cb 1.91 0.99 -0.03 0.00 0.00 0.00 0.00 17.79 20.66 1b22 h ALA 71 CO 0.09 -1.09 0.24 0.22 0.00 0.00 0.00 179.25 178.71 1b22 h ASP 72 N -0.60 0.38 -1.29 0.00 3.58 -1.24 -0.73 116.42 116.53 1b22 h ASP 72 Ca 0.03 0.01 0.37 0.00 0.42 0.00 0.00 57.03 57.86 1b22 h ASP 72 Cb 0.69 -0.07 -0.05 0.00 1.72 0.00 0.00 39.33 41.61 1b22 h ASP 72 CO -0.42 0.28 1.04 0.50 -2.88 0.00 0.00 179.24 177.76 1b22 h LYS 73 N 0.49 0.00 0.15 0.28 1.63 -1.14 -0.68 116.57 117.29 1b22 h LYS 73 Ca 0.17 0.00 -0.01 0.00 -0.85 0.00 0.00 60.65 59.96 1b22 h LYS 73 Cb 0.02 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 31.65 1b22 h LYS 73 CO -0.08 0.00 -0.07 0.82 -3.45 0.00 0.00 179.45 176.66 1b22 h ILE 74 N 0.00 0.00 -0.30 2.00 1.08 -0.34 0.79 117.51 120.74 1b22 h ILE 74 Ca 0.61 -0.64 0.09 0.00 -0.39 0.00 0.00 64.86 64.53 1b22 h ILE 74 Cb 2.69 0.00 -0.01 0.00 -3.07 0.00 0.00 36.82 36.43 1b22 h ILE 74 CO -0.01 0.00 0.59 -0.07 -0.69 0.00 0.00 178.15 177.98 1b22 h LEU 75 N -0.84 0.00 0.00 1.44 4.07 -1.13 0.69 115.31 119.53 1b22 h LEU 75 Ca -0.02 0.00 -0.15 0.00 0.08 0.00 0.00 57.88 57.79 1b22 h LEU 75 Cb 0.15 0.00 -0.02 0.00 1.08 0.00 0.00 40.66 41.87 1b22 h LEU 75 CO 0.03 0.00 -0.89 0.00 -1.08 0.00 0.00 178.44 176.51 1b22 h ALA 76 N 1.10 0.18 0.00 1.53 0.00 -1.18 -2.99 119.26 117.89 1b22 h ALA 76 Ca 0.14 -0.96 -0.05 0.00 0.00 0.00 0.00 54.91 54.05 1b22 h ALA 76 Cb 1.33 0.55 -0.01 0.00 0.00 0.00 0.00 17.79 19.66 1b22 h ALA 76 CO -0.00 0.52 -0.23 0.93 0.00 0.00 0.00 179.25 180.47 1b22 h GLU 77 N -1.00 0.00 0.08 0.00 4.39 0.75 -2.61 114.58 116.19 1b22 h GLU 77 Ca -0.23 0.00 -0.00 0.00 0.34 0.00 0.00 59.36 59.46 1b22 h GLU 77 Cb 1.12 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.77 1b22 h GLU 77 CO -0.14 0.23 -0.04 0.00 -1.16 0.00 0.00 179.01 177.90 1b22 h ALA 78 N 1.77 -0.11 0.00 3.43 0.00 0.16 -1.53 119.26 122.98 1b22 h ALA 78 Ca -0.00 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.76 1b22 h ALA 78 Cb 0.52 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.35 1b22 h ALA 78 CO 0.03 -0.12 0.21 0.00 0.00 0.00 0.00 179.25 179.37 1b22 h ALA 79 N -0.72 1.18 0.00 0.00 0.00 -1.53 0.54 119.26 118.73 1b22 h ALA 79 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1b22 h ALA 79 Cb 0.33 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.12 1b22 h ALA 79 CO 0.02 -0.18 -1.20 1.63 0.00 0.00 0.00 179.25 179.52 1b22 n LYS 80 N -2.57 0.45 -0.08 0.00 5.02 -0.98 -4.00 118.16 116.00 1b22 n LYS 80 Ca -0.02 -0.05 -0.15 0.00 -2.02 0.00 0.00 58.31 56.08 1b22 n LYS 80 Cb 0.25 -1.46 -0.06 0.00 -0.02 0.00 0.00 35.03 33.74 1b22 n LYS 80 CO 0.00 0.00 0.00 -0.11 -0.52 0.00 0.00 177.40 176.77 1b22 n LEU 81 N -1.66 1.53 -2.92 -0.35 7.94 0.12 -4.78 117.00 116.88 1b22 n LEU 81 Ca 0.02 0.12 -0.25 0.00 -1.11 0.00 0.00 56.01 54.79 1b22 n LEU 81 Cb 0.37 -0.46 -0.03 0.00 0.53 0.00 0.00 43.42 43.83 1b22 n LEU 81 CO 0.41 0.42 0.10 1.33 -1.11 0.00 0.00 177.39 178.54 1b22 n VAL 82 N -3.50 2.52 -1.64 1.96 0.24 0.15 -5.07 118.33 112.99 1b22 n VAL 82 Ca -0.29 -5.33 -0.32 0.00 -2.04 0.00 0.00 64.34 56.36 1b22 n VAL 82 Cb 0.73 -1.19 0.05 0.00 -1.47 0.00 0.00 33.84 31.96 1b22 n VAL 82 CO 0.00 0.00 0.00 -2.16 -2.14 0.00 0.00 176.83 172.53 1b22 s PRO 83 N -3.34 2.83 0.00 7.34 0.04 -1.24 -4.76 135.00 135.87 1b22 s PRO 83 Ca 0.47 1.15 0.00 0.00 0.04 0.00 0.00 61.00 62.66 1b22 s PRO 83 Cb 0.31 -1.97 0.00 0.00 0.04 0.00 0.00 34.50 32.88 1b22 s PRO 83 CO -0.13 -1.20 0.00 -0.12 0.04 0.00 0.00 177.00 175.59 1b22 n MET 84 N -2.84 0.03 0.00 4.56 1.56 -1.26 -5.10 117.12 114.07 1b22 n MET 84 Ca 0.09 0.00 0.15 0.00 -0.27 0.00 0.00 57.70 57.67 1b22 n MET 84 Cb 0.53 -0.53 0.76 0.00 2.15 0.00 0.00 33.22 36.13 1b22 n MET 84 CO 0.00 0.00 0.00 0.41 -0.73 0.00 0.00 175.97 175.65