#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 0.42 -2.77 3.49 2.13 -1.26 -5.08 120.64 117.56 1b22 n GLU 17 Ca 0.00 0.16 -0.01 0.00 0.66 0.00 0.00 57.16 57.98 1b22 n GLU 17 Cb 0.00 -1.23 0.00 0.00 0.27 0.00 0.00 31.44 30.48 1b22 n GLU 17 CO 0.00 0.00 0.00 -1.91 -0.41 0.00 0.00 177.13 174.81 1b22 n GLU 18 N -4.25 -3.18 -1.16 5.31 2.13 -1.26 -4.82 120.64 113.42 1b22 n GLU 18 Ca -0.11 2.59 0.00 0.00 0.66 0.00 0.00 57.16 60.30 1b22 n GLU 18 Cb 0.41 -5.02 0.00 0.00 0.27 0.00 0.00 31.44 27.10 1b22 n GLU 18 CO 0.00 0.00 0.00 0.45 -0.41 0.00 0.00 177.13 177.17 1b22 n SER 19 N 0.70 -6.54 0.00 4.31 2.88 -1.26 -5.04 113.62 108.67 1b22 n SER 19 Ca 0.01 0.89 0.00 0.00 -1.33 0.00 0.00 58.87 58.44 1b22 n SER 19 Cb 0.07 -3.15 0.00 0.00 -0.75 0.00 0.00 64.21 60.39 1b22 n SER 19 CO 0.00 0.00 0.00 0.33 -1.23 0.00 0.00 175.04 174.14 1b22 n PHE 20 N -0.76 -0.34 0.00 0.66 -0.00 -1.26 -5.14 117.46 110.62 1b22 n PHE 20 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.45 1b22 n PHE 20 Cb 0.00 0.21 0.00 0.00 -0.00 0.00 0.00 39.48 39.69 1b22 n PHE 20 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 1b22 n GLY 21 N 0.51 4.62 0.00 7.13 0.00 -1.26 -5.11 105.19 111.08 1b22 n GLY 21 Ca 0.00 -0.75 0.00 0.00 0.00 0.00 0.00 46.02 45.27 1b22 n GLY 21 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1b22 n PRO 22 N 0.00 0.25 -0.08 1.61 -0.04 -1.26 -5.03 135.00 130.45 1b22 n PRO 22 Ca 0.00 0.00 0.02 0.00 -0.04 0.00 0.00 63.50 63.48 1b22 n PRO 22 Cb 0.00 0.00 0.03 0.00 -0.04 0.00 0.00 33.50 33.49 1b22 n PRO 22 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1b22 n GLN 23 N -0.59 1.53 -0.86 0.54 0.00 -1.26 -4.87 117.38 111.87 1b22 n GLN 23 Ca 0.00 -1.44 -0.27 0.00 0.00 0.00 0.00 57.00 55.30 1b22 n GLN 23 Cb 0.00 -0.93 -0.02 0.00 0.00 0.00 0.00 30.24 29.29 1b22 n GLN 23 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.06 176.71 1b22 n PRO 24 N -0.52 2.13 0.00 2.61 -0.04 -1.26 0.64 135.00 138.56 1b22 n PRO 24 Ca 0.04 -1.59 0.08 0.00 -0.04 0.00 0.00 63.50 61.98 1b22 n PRO 24 Cb 0.45 -2.56 0.45 0.00 -0.04 0.00 0.00 33.50 31.79 1b22 n PRO 24 CO 0.00 0.00 0.00 -0.89 -0.04 0.00 0.00 175.50 174.57 1b22 n ILE 25 N 4.44 0.37 0.08 0.52 2.08 -1.26 -3.79 119.36 121.80 1b22 n ILE 25 Ca 0.48 0.09 -0.03 0.00 0.56 0.00 0.00 62.75 63.85 1b22 n ILE 25 Cb 0.18 -0.82 -0.01 0.00 -0.75 0.00 0.00 39.64 38.24 1b22 n ILE 25 CO 0.00 0.00 0.00 0.77 0.56 0.00 0.00 176.55 177.88 1b22 h SER 26 N 0.00 -0.17 -0.88 4.38 4.64 -1.77 -3.11 113.55 116.64 1b22 h SER 26 Ca 0.00 0.01 0.23 0.00 -0.47 0.00 0.00 61.79 61.56 1b22 h SER 26 Cb 0.11 0.04 -0.16 0.00 -0.31 0.00 0.00 62.40 62.08 1b22 h SER 26 CO 0.00 -0.11 -0.01 0.54 -0.87 0.00 0.00 176.83 176.38 1b22 n ARG 27 N -2.59 -0.07 0.00 4.77 1.74 -1.25 0.21 116.66 119.47 1b22 n ARG 27 Ca -0.02 1.32 0.00 0.00 -0.77 0.00 0.00 57.85 58.38 1b22 n ARG 27 Cb 0.08 -2.09 0.00 0.00 -1.02 0.00 0.00 32.46 29.43 1b22 n ARG 27 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 1b22 n LEU 28 N -5.30 0.00 0.01 0.55 7.99 -1.20 -1.77 117.00 117.28 1b22 n LEU 28 Ca 0.20 0.59 -0.09 0.00 -0.01 0.00 0.00 56.01 56.70 1b22 n LEU 28 Cb 0.65 -0.09 0.06 0.00 -0.11 0.00 0.00 43.42 43.92 1b22 n LEU 28 CO -0.07 -0.09 0.48 1.05 -1.51 0.00 0.00 177.39 177.24 1b22 h GLU 29 N 0.00 0.53 -0.77 3.23 4.11 -1.40 -3.06 114.58 117.23 1b22 h GLU 29 Ca 0.00 -0.34 0.13 0.00 0.07 0.00 0.00 59.36 59.22 1b22 h GLU 29 Cb 0.00 0.04 -0.05 0.00 0.50 0.00 0.00 28.75 29.24 1b22 h GLU 29 CO 0.00 0.95 0.50 0.37 0.07 0.00 0.00 179.01 180.90 1b22 h GLN 30 N 0.41 0.52 0.00 1.06 -0.00 0.24 0.80 115.11 118.14 1b22 h GLN 30 Ca 0.01 -0.03 0.00 0.00 -0.00 0.00 0.00 58.65 58.63 1b22 h GLN 30 Cb 1.09 -0.12 0.00 0.00 0.00 0.00 0.00 27.48 28.45 1b22 h GLN 30 CO 0.10 0.35 0.00 0.00 0.00 0.00 0.00 178.83 179.28 1b22 n GLY 32 N 0.98 0.84 0.00 0.00 0.00 0.28 -5.09 105.19 102.19 1b22 n GLY 32 Ca 0.19 -0.76 0.00 0.00 0.00 0.00 0.00 46.02 45.46 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 -0.06 0.00 -0.07 -0.61 3.06 -1.13 -4.93 119.36 115.62 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 0.02 0.00 0.00 0.00 0.54 0.00 0.00 39.64 40.20 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 -0.43 9.51 5.15 -1.26 -4.66 115.26 123.58 1b22 n ASN 34 Ca 0.00 0.00 0.39 0.00 -0.60 0.00 0.00 54.58 54.37 1b22 n ASN 34 Cb 0.00 0.00 0.64 0.00 -0.53 0.00 0.00 39.78 39.89 1b22 n ASN 34 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1b22 h ALA 35 N -1.96 3.35 -0.57 5.20 0.00 -1.95 -1.67 119.26 121.67 1b22 h ALA 35 Ca 0.00 -0.05 0.05 0.00 0.00 0.00 0.00 54.91 54.91 1b22 h ALA 35 Cb 0.00 0.11 -0.08 0.00 0.00 0.00 0.00 17.79 17.82 1b22 h ALA 35 CO 0.00 -2.00 -0.43 -0.91 0.00 0.00 0.00 179.25 175.91 1b22 h ASN 36 N 0.00 -1.52 -0.27 0.00 4.21 -1.85 -2.01 115.58 114.14 1b22 h ASN 36 Ca 0.68 0.22 0.02 0.00 1.21 0.00 0.00 56.30 58.44 1b22 h ASN 36 Cb 3.20 0.65 -0.03 0.00 -1.12 0.00 0.00 38.32 41.02 1b22 h ASN 36 CO -0.01 -0.22 -0.16 -0.67 -1.29 0.00 0.00 177.43 175.08 1b22 n ASP 37 N -4.67 -0.28 0.19 5.81 -0.08 -0.63 0.42 116.55 117.31 1b22 n ASP 37 Ca -0.00 0.54 -0.07 0.00 -1.51 0.00 0.00 54.79 53.74 1b22 n ASP 37 Cb 0.22 -0.09 -0.04 0.00 2.34 0.00 0.00 41.12 43.55 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 -1.59 -3.14 116.25 118.77 1b22 h VAL 38 Ca 0.04 -0.02 0.00 0.00 0.82 0.00 0.00 66.70 67.54 1b22 h VAL 38 Cb 0.11 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 29.88 1b22 h VAL 38 CO -0.25 0.00 -0.10 0.11 0.02 0.00 0.00 177.57 177.35 1b22 h LYS 39 N -0.51 0.00 -1.35 1.57 1.79 -1.02 -2.94 116.57 114.11 1b22 h LYS 39 Ca -0.05 0.00 0.47 0.00 -2.18 0.00 0.00 60.65 58.89 1b22 h LYS 39 Cb 0.37 0.00 -0.14 0.00 -1.58 0.00 0.00 32.23 30.88 1b22 h LYS 39 CO 0.08 0.00 0.86 0.87 -1.08 0.00 0.00 179.45 180.18 1b22 h LYS 40 N -0.77 0.01 0.00 3.15 1.79 -0.22 -2.32 116.57 118.20 1b22 h LYS 40 Ca 0.00 -0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 1b22 h LYS 40 Cb 0.10 -0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.74 1b22 h LYS 40 CO 0.00 0.00 -0.03 -0.07 -1.08 0.00 0.00 179.45 178.28 1b22 h LEU 41 N 0.01 0.00 -0.23 2.94 3.38 -1.40 -2.39 115.31 117.62 1b22 h LEU 41 Ca 0.88 0.00 0.03 0.00 0.09 0.00 0.00 57.88 58.88 1b22 h LEU 41 Cb 2.79 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 43.51 1b22 h LEU 41 CO -0.50 0.04 0.05 -0.08 0.09 0.00 0.00 178.44 178.05 1b22 h GLU 42 N -0.06 0.14 -1.30 1.13 4.57 -1.42 1.01 114.58 118.64 1b22 h GLU 42 Ca 0.00 -0.01 0.38 0.00 -1.18 0.00 0.00 59.36 58.55 1b22 h GLU 42 Cb 0.03 -0.03 -0.05 0.00 -0.16 0.00 0.00 28.75 28.53 1b22 h GLU 42 CO 0.00 0.09 1.18 0.39 -1.18 0.00 0.00 179.01 179.49 1b22 n GLU 43 N -5.08 0.01 0.00 1.92 -0.58 -0.88 -4.11 120.64 111.92 1b22 n GLU 43 Ca -0.02 0.94 0.00 0.00 -0.42 0.00 0.00 57.16 57.66 1b22 n GLU 43 Cb 0.10 -2.26 0.00 0.00 -0.57 0.00 0.00 31.44 28.70 1b22 n GLU 43 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1b22 n ALA 44 N -2.44 0.00 0.00 0.62 0.00 -1.03 -5.04 120.51 112.62 1b22 n ALA 44 Ca 0.29 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.73 1b22 n ALA 44 Cb 1.57 0.00 0.00 0.00 0.00 0.00 0.00 19.45 21.02 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 -1.35 0.83 0.00 0.00 0.00 0.35 -5.00 105.19 100.01 1b22 n GLY 45 Ca 0.00 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.03 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 0.00 -0.58 1.61 3.01 -0.90 -4.51 117.46 116.09 1b22 n PHE 46 Ca 0.00 0.00 -0.41 0.00 1.01 0.00 0.00 57.45 58.05 1b22 n PHE 46 Cb 0.00 0.00 -0.10 0.00 -0.01 0.00 0.00 39.48 39.37 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 -0.72 0.34 -3.77 1.38 1.44 -1.26 -4.05 115.22 108.58 1b22 n HIS 47 Ca 0.02 -0.74 0.00 0.00 -2.01 0.00 0.00 57.72 54.99 1b22 n HIS 47 Cb 0.01 -0.92 0.00 0.00 0.12 0.00 0.00 29.99 29.21 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 6.66 0.00 -0.50 0.61 5.66 -1.26 -3.27 114.28 122.18 1b22 n THR 48 Ca 0.44 0.00 0.40 0.00 -3.05 0.00 0.00 64.05 61.85 1b22 n THR 48 Cb 0.39 0.00 0.62 0.00 -1.55 0.00 0.00 70.33 69.78 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 6.90 0.00 -0.49 1.08 0.31 0.21 -0.76 118.33 125.58 1b22 n VAL 49 Ca 0.00 1.22 0.43 0.00 -0.01 0.00 0.00 64.34 65.98 1b22 n VAL 49 Cb 0.00 -2.07 0.67 0.00 -0.91 0.00 0.00 33.84 31.53 1b22 n VAL 49 CO 0.00 0.00 0.00 -0.33 -1.32 0.00 0.00 176.83 175.18 1b22 h GLU 50 N 0.00 0.00 0.02 5.55 3.07 -1.71 0.43 114.58 121.95 1b22 h GLU 50 Ca 0.71 0.00 -0.00 0.00 -0.50 0.00 0.00 59.36 59.57 1b22 h GLU 50 Cb 3.05 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 30.96 1b22 h GLU 50 CO -0.01 0.00 -0.01 0.00 -1.40 0.00 0.00 179.01 177.59 1b22 h ALA 51 N 0.84 -0.03 -0.90 3.43 0.00 -1.09 -3.35 119.26 118.16 1b22 h ALA 51 Ca 0.74 -0.28 -0.47 0.00 0.00 0.00 0.00 54.91 54.90 1b22 h ALA 51 Cb 3.37 0.01 -0.28 0.00 0.00 0.00 0.00 17.79 20.89 1b22 h ALA 51 CO -0.01 -0.04 0.60 1.55 0.00 0.00 0.00 179.25 181.34 1b22 n VAL 52 N -4.72 2.99 0.00 0.00 3.14 0.50 -4.27 118.33 115.98 1b22 n VAL 52 Ca -0.06 -1.73 0.00 0.00 -2.96 0.00 0.00 64.34 59.59 1b22 n VAL 52 Cb 0.28 -0.52 0.00 0.00 -1.06 0.00 0.00 33.84 32.53 1b22 n VAL 52 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 1b22 n ALA 53 N -0.99 0.00 -0.49 1.55 0.00 0.12 -4.92 120.51 115.79 1b22 n ALA 53 Ca 0.54 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.98 1b22 n ALA 53 Cb 1.56 0.00 0.00 0.00 0.00 0.00 0.00 19.45 21.01 1b22 n ALA 53 CO 0.00 0.00 0.00 0.98 0.00 0.00 0.00 177.50 178.48 1b22 n TYR 54 N -0.58 0.00 0.00 0.00 9.36 -1.26 -3.15 117.16 121.53 1b22 n TYR 54 Ca 0.00 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.22 1b22 n TYR 54 Cb 0.00 -0.39 0.00 0.00 -0.63 0.00 0.00 39.34 38.32 1b22 n TYR 54 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 1b22 n ALA 55 N 0.70 0.00 -2.14 2.98 0.00 -1.26 -4.99 120.51 115.80 1b22 n ALA 55 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 53.44 53.01 1b22 n ALA 55 Cb 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.43 1b22 n ALA 55 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1b22 s PRO 56 N -0.76 3.71 0.42 0.00 0.04 -1.26 -4.70 135.00 132.45 1b22 s PRO 56 Ca 0.00 1.52 0.33 0.00 0.04 0.00 0.00 61.00 62.88 1b22 s PRO 56 Cb 0.00 -4.05 1.40 0.00 0.04 0.00 0.00 34.50 31.89 1b22 s PRO 56 CO 0.00 -1.40 1.42 0.36 0.04 0.00 0.00 177.00 177.42 1b22 n LYS 57 N 7.80 -0.03 0.22 4.56 0.00 -1.26 0.26 118.16 129.72 1b22 n LYS 57 Ca 0.19 1.11 0.06 0.00 -0.00 0.00 0.00 58.31 59.67 1b22 n LYS 57 Cb 0.46 -2.26 0.51 0.00 -0.00 0.00 0.00 35.03 33.74 1b22 n LYS 57 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.40 177.18 1b22 h LYS 58 N 0.00 0.00 0.12 -1.58 3.64 -1.88 -0.99 116.57 115.88 1b22 h LYS 58 Ca 0.81 0.00 -0.19 0.00 -1.27 0.00 0.00 60.65 60.00 1b22 h LYS 58 Cb 2.75 0.00 0.01 0.00 -0.41 0.00 0.00 32.23 34.59 1b22 h LYS 58 CO -0.35 0.21 -0.90 1.49 -2.27 0.00 0.00 179.45 177.63 1b22 h GLU 59 N 0.00 0.26 0.48 1.90 4.57 0.32 -2.81 114.58 119.30 1b22 h GLU 59 Ca -0.00 -0.44 -0.02 0.00 -1.18 0.00 0.00 59.36 57.72 1b22 h GLU 59 Cb 0.39 0.16 -0.01 0.00 -0.16 0.00 0.00 28.75 29.14 1b22 h GLU 59 CO 0.03 1.21 -0.34 1.25 -1.18 0.00 0.00 179.01 179.98 1b22 h LEU 60 N -0.42 -0.89 -1.85 1.64 5.85 -1.30 -0.32 115.31 118.01 1b22 h LEU 60 Ca -0.17 0.06 0.32 0.00 0.84 0.00 0.00 57.88 58.92 1b22 h LEU 60 Cb 1.61 0.27 -0.04 0.00 0.37 0.00 0.00 40.66 42.87 1b22 h LEU 60 CO 0.11 -0.50 0.90 0.16 -0.34 0.00 0.00 178.44 178.77 1b22 h ILE 61 N -0.79 0.29 0.00 4.05 -0.00 -1.33 0.74 117.51 120.48 1b22 h ILE 61 Ca -0.06 0.00 0.00 0.00 -0.00 0.00 0.00 64.86 64.80 1b22 h ILE 61 Cb 0.64 0.34 0.00 0.00 -0.00 0.00 0.00 36.82 37.81 1b22 h ILE 61 CO 0.04 0.00 0.35 -3.20 -0.00 0.00 0.00 178.15 175.34 1b22 n ASN 62 N -3.92 0.29 0.00 2.16 5.15 -0.13 -1.58 115.26 117.23 1b22 n ASN 62 Ca 0.24 0.51 0.00 0.00 -0.60 0.00 0.00 54.58 54.73 1b22 n ASN 62 Cb 1.26 -0.43 0.00 0.00 -0.53 0.00 0.00 39.78 40.08 1b22 n ASN 62 CO 0.00 0.00 0.00 -0.38 1.40 0.00 0.00 177.26 178.28 1b22 n ILE 63 N -1.98 0.00 0.21 -1.44 5.41 0.26 -2.93 119.36 118.88 1b22 n ILE 63 Ca -0.01 0.80 0.07 0.00 1.00 0.00 0.00 62.75 64.61 1b22 n ILE 63 Cb 0.37 -1.54 0.44 0.00 -0.71 0.00 0.00 39.64 38.21 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 0.00 0.00 0.38 3.11 -1.80 -3.46 116.57 114.80 1b22 h LYS 64 Ca 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 60.65 57.84 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 0.30 0.00 0.41 -2.81 0.00 0.00 179.45 177.35 1b22 n GLY 65 N -0.16 1.99 0.00 5.01 0.00 -0.71 -5.13 105.19 106.19 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 -0.04 0.00 0.00 -0.61 -0.00 -0.61 -4.89 119.36 113.21 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 -0.24 -0.00 0.00 0.00 176.55 176.31 1b22 n SER 67 N 0.00 0.00 0.23 4.38 2.88 -1.26 -4.58 113.62 115.27 1b22 n SER 67 Ca 0.00 0.00 0.14 0.00 -1.33 0.00 0.00 58.87 57.68 1b22 n SER 67 Cb 0.00 0.00 0.77 0.00 -0.75 0.00 0.00 64.21 64.23 1b22 n SER 67 CO 0.00 0.00 0.00 -0.33 -1.23 0.00 0.00 175.04 173.48 1b22 h GLU 68 N 0.00 0.00 0.00 -1.46 5.08 -1.95 -2.90 114.58 113.34 1b22 h GLU 68 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1b22 h GLU 68 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 1b22 h GLU 68 CO 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 179.01 178.01 1b22 n ALA 69 N -1.85 0.00 0.04 3.43 0.00 -1.26 -0.69 120.51 120.18 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 0.11 0.25 -0.14 0.00 0.00 0.00 0.00 19.45 19.67 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 0.34 0.33 0.00 2.10 -1.97 -2.98 116.57 114.39 1b22 h LYS 70 Ca 0.00 -0.57 -0.01 0.00 -2.00 0.00 0.00 60.65 58.07 1b22 h LYS 70 Cb 0.00 0.21 -0.03 0.00 -0.90 0.00 0.00 32.23 31.52 1b22 h LYS 70 CO 0.00 1.27 -0.44 0.00 -2.00 0.00 0.00 179.45 178.28 1b22 h ALA 71 N 0.09 -1.05 -0.76 0.07 0.00 -1.58 -1.58 119.26 114.46 1b22 h ALA 71 Ca -0.38 -0.14 0.06 0.00 0.00 0.00 0.00 54.91 54.44 1b22 h ALA 71 Cb 2.07 0.72 -0.05 0.00 0.00 0.00 0.00 17.79 20.53 1b22 h ALA 71 CO 0.14 -1.10 0.50 0.22 0.00 0.00 0.00 179.25 179.00 1b22 h ASP 72 N -0.80 0.72 -0.85 0.00 1.82 -1.05 -0.63 116.42 115.63 1b22 h ASP 72 Ca -0.04 0.00 0.25 0.00 -0.39 0.00 0.00 57.03 56.85 1b22 h ASP 72 Cb 0.72 -0.15 -0.03 0.00 0.68 0.00 0.00 39.33 40.55 1b22 h ASP 72 CO -0.11 0.47 0.65 0.50 -1.61 0.00 0.00 179.24 179.14 1b22 h LYS 73 N 0.82 0.00 0.07 0.28 1.63 -1.08 -1.02 116.57 117.27 1b22 h LYS 73 Ca 0.32 0.00 -0.12 0.00 -0.85 0.00 0.00 60.65 60.00 1b22 h LYS 73 Cb 0.22 0.00 0.01 0.00 -0.60 0.00 0.00 32.23 31.86 1b22 h LYS 73 CO -0.11 0.00 -0.57 0.97 -3.45 0.00 0.00 179.45 176.29 1b22 h ILE 74 N 0.00 1.53 -0.27 2.00 -0.00 -0.75 -2.96 117.51 117.07 1b22 h ILE 74 Ca 0.40 -2.41 0.08 0.00 -0.00 0.00 0.00 64.86 62.93 1b22 h ILE 74 Cb 1.70 3.15 -0.01 0.00 -0.00 0.00 0.00 36.82 41.66 1b22 h ILE 74 CO -0.00 0.64 0.47 -0.07 -0.00 0.00 0.00 178.15 179.18 1b22 h LEU 75 N -0.68 0.00 0.00 2.19 4.07 -1.14 1.17 115.31 120.92 1b22 h LEU 75 Ca -0.12 0.00 -0.08 0.00 0.08 0.00 0.00 57.88 57.76 1b22 h LEU 75 Cb 1.35 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 43.08 1b22 h LEU 75 CO 0.05 0.00 -0.47 0.00 -1.08 0.00 0.00 178.44 176.94 1b22 h ALA 76 N 1.32 0.10 0.00 1.53 0.00 -1.44 -2.83 119.26 117.94 1b22 h ALA 76 Ca 0.13 -0.73 -0.11 0.00 0.00 0.00 0.00 54.91 54.19 1b22 h ALA 76 Cb 1.06 0.28 -0.02 0.00 0.00 0.00 0.00 17.79 19.11 1b22 h ALA 76 CO -0.00 0.27 -0.54 0.93 0.00 0.00 0.00 179.25 179.90 1b22 h GLU 77 N -1.00 0.00 -0.14 0.00 4.39 -1.03 -2.47 114.58 114.33 1b22 h GLU 77 Ca -0.13 0.00 -0.18 0.00 0.34 0.00 0.00 59.36 59.39 1b22 h GLU 77 Cb 1.04 0.00 0.01 0.00 -0.10 0.00 0.00 28.75 29.70 1b22 h GLU 77 CO -0.08 0.54 -0.63 0.00 -1.16 0.00 0.00 179.01 177.69 1b22 h ALA 78 N 1.46 0.27 0.00 3.43 0.00 0.12 -0.35 119.26 124.19 1b22 h ALA 78 Ca -0.01 -0.55 0.00 0.00 0.00 0.00 0.00 54.91 54.36 1b22 h ALA 78 Cb 1.06 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.83 1b22 h ALA 78 CO 0.07 0.54 0.00 0.00 0.00 0.00 0.00 179.25 179.86 1b22 h ALA 79 N 0.53 1.00 0.00 0.00 0.00 -1.47 0.58 119.26 119.89 1b22 h ALA 79 Ca -0.04 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1b22 h ALA 79 Cb 1.26 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.05 1b22 h ALA 79 CO 0.13 0.00 -1.16 1.17 0.00 0.00 0.00 179.25 179.39 1b22 n LYS 80 N -2.55 0.71 -0.03 0.00 4.81 -0.93 -4.35 118.16 115.82 1b22 n LYS 80 Ca 0.03 -0.05 -0.06 0.00 -0.87 0.00 0.00 58.31 57.37 1b22 n LYS 80 Cb 0.36 -1.41 -0.02 0.00 0.02 0.00 0.00 35.03 33.98 1b22 n LYS 80 CO 0.00 0.00 0.00 -0.11 1.17 0.00 0.00 177.40 178.46 1b22 n LEU 81 N -1.65 1.38 -3.33 3.14 7.94 -0.15 -4.83 117.00 119.51 1b22 n LEU 81 Ca 0.02 0.04 -0.29 0.00 -1.11 0.00 0.00 56.01 54.66 1b22 n LEU 81 Cb 0.35 -0.19 -0.05 0.00 0.53 0.00 0.00 43.42 44.06 1b22 n LEU 81 CO 0.39 0.30 0.28 1.33 -1.11 0.00 0.00 177.39 178.58 1b22 n VAL 82 N -3.05 3.11 1.26 1.96 0.24 0.19 -4.82 118.33 117.22 1b22 n VAL 82 Ca -0.11 -5.46 0.11 0.00 -2.04 0.00 0.00 64.34 56.83 1b22 n VAL 82 Cb 0.59 -1.83 0.62 0.00 -1.47 0.00 0.00 33.84 31.75 1b22 n VAL 82 CO 0.00 0.00 0.00 -0.81 -2.14 0.00 0.00 176.83 173.88 1b22 n PRO 83 N 0.47 0.57 0.09 7.34 -0.04 -1.23 -4.21 135.00 137.99 1b22 n PRO 83 Ca 0.31 0.03 0.00 0.00 -0.04 0.00 0.00 63.50 63.80 1b22 n PRO 83 Cb 0.39 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.35 1b22 n PRO 83 CO 0.00 0.00 0.00 -1.33 -0.04 0.00 0.00 175.50 174.13 1b22 n MET 84 N -1.09 0.00 -0.70 0.54 2.81 -1.26 -4.53 117.12 112.89 1b22 n MET 84 Ca 0.14 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 56.03 1b22 n MET 84 Cb 0.11 -0.26 0.00 0.00 -0.71 0.00 0.00 33.22 32.36 1b22 n MET 84 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89