#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1b22 s GLU 17 N 0.00 0.29 -0.37 5.31 -1.05 -1.26 -5.09 118.70 116.53 1b22 s GLU 17 Ca 0.00 0.41 -0.30 0.00 -0.15 0.00 0.00 54.97 54.93 1b22 s GLU 17 Cb 0.00 -0.74 -0.08 0.00 -0.44 0.00 0.00 34.13 32.87 1b22 s GLU 17 CO 0.00 -0.65 2.30 0.39 0.95 0.00 0.00 175.26 178.24 1b22 n GLU 18 N 5.35 1.34 -1.56 -4.83 -0.58 -1.26 -4.81 120.64 114.29 1b22 n GLU 18 Ca -0.04 0.29 -0.36 0.00 -0.42 0.00 0.00 57.16 56.63 1b22 n GLU 18 Cb 0.50 -2.96 0.06 0.00 -0.57 0.00 0.00 31.44 28.47 1b22 n GLU 18 CO 0.00 0.00 0.00 0.45 -0.48 0.00 0.00 177.13 177.10 1b22 n SER 19 N 12.22 7.48 -2.49 1.62 2.88 -1.26 -4.75 113.62 129.32 1b22 n SER 19 Ca 0.37 -3.80 -0.17 0.00 -1.33 0.00 0.00 58.87 53.94 1b22 n SER 19 Cb 0.38 -0.97 -0.10 0.00 -0.75 0.00 0.00 64.21 62.78 1b22 n SER 19 CO 0.00 0.00 0.00 0.49 -1.23 0.00 0.00 175.04 174.30 1b22 n PHE 20 N -0.79 0.67 -3.53 0.66 3.72 -1.26 -4.51 117.46 112.42 1b22 n PHE 20 Ca 0.59 -1.69 -0.20 0.00 -0.05 0.00 0.00 57.45 56.10 1b22 n PHE 20 Cb 0.55 -1.63 0.08 0.00 -0.94 0.00 0.00 39.48 37.53 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 2.96 -0.41 3.71 1.37 0.00 -1.26 -4.48 105.19 107.08 1b22 n GLY 21 Ca 0.45 0.15 -0.42 0.00 0.00 0.00 0.00 46.02 46.20 1b22 n GLY 21 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1b22 s PRO 22 N -5.75 4.40 0.18 1.61 0.04 -1.26 -4.11 135.00 130.10 1b22 s PRO 22 Ca 0.20 1.83 0.00 0.00 0.04 0.00 0.00 61.00 63.07 1b22 s PRO 22 Cb -0.09 -3.34 0.00 0.00 0.04 0.00 0.00 34.50 31.11 1b22 s PRO 22 CO 0.74 -0.31 0.00 1.04 0.04 0.00 0.00 177.00 178.52 1b22 n GLN 23 N 4.01 0.00 -0.60 4.56 3.00 -1.26 -4.84 117.38 122.25 1b22 n GLN 23 Ca 0.10 0.00 -0.15 0.00 -0.01 0.00 0.00 57.00 56.93 1b22 n GLN 23 Cb 0.45 0.00 -0.04 0.00 0.00 0.00 0.00 30.24 30.66 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 -2.93 1.59 0.10 -1.09 -0.04 -1.26 0.12 135.00 131.49 1b22 n PRO 24 Ca 0.00 -1.09 0.12 0.00 -0.04 0.00 0.00 63.50 62.49 1b22 n PRO 24 Cb 0.00 -2.20 0.45 0.00 -0.04 0.00 0.00 33.50 31.71 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 3.84 0.70 0.00 0.52 2.08 -1.26 -3.94 119.36 121.29 1b22 n ILE 25 Ca 0.34 0.01 -0.00 0.00 0.56 0.00 0.00 62.75 63.66 1b22 n ILE 25 Cb 0.22 -0.88 -0.00 0.00 -0.75 0.00 0.00 39.64 38.22 1b22 n ILE 25 CO 0.00 0.00 0.00 0.28 0.56 0.00 0.00 176.55 177.39 1b22 h SER 26 N 0.00 -0.01 -0.82 4.38 0.02 -1.76 -0.84 113.55 114.52 1b22 h SER 26 Ca 0.00 0.00 0.33 0.00 -0.84 0.00 0.00 61.79 61.28 1b22 h SER 26 Cb 0.51 0.00 -0.15 0.00 0.14 0.00 0.00 62.40 62.91 1b22 h SER 26 CO 0.00 -0.00 0.40 0.54 -1.14 0.00 0.00 176.83 176.62 1b22 n ARG 27 N -2.02 -0.05 0.00 3.45 1.74 -1.25 0.33 116.66 118.86 1b22 n ARG 27 Ca -0.00 1.15 0.00 0.00 -0.77 0.00 0.00 57.85 58.23 1b22 n ARG 27 Cb 0.00 -2.03 0.00 0.00 -1.02 0.00 0.00 32.46 29.41 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 -4.89 0.79 -0.12 0.55 4.77 -1.17 -2.61 117.00 114.31 1b22 n LEU 28 Ca 0.30 0.19 0.22 0.00 -0.03 0.00 0.00 56.01 56.69 1b22 n LEU 28 Cb 1.02 -0.29 0.65 0.00 -2.33 0.00 0.00 43.42 42.47 1b22 n LEU 28 CO 0.00 -0.29 1.22 1.05 -1.33 0.00 0.00 177.39 178.04 1b22 h GLU 29 N 0.00 0.11 0.01 3.23 -0.00 -1.05 -2.49 114.58 114.38 1b22 h GLU 29 Ca 0.00 -0.01 -0.30 0.00 -0.00 0.00 0.00 59.36 59.05 1b22 h GLU 29 Cb 0.00 -0.02 -0.05 0.00 -0.00 0.00 0.00 28.75 28.67 1b22 h GLU 29 CO 0.00 0.07 -1.77 0.94 -0.00 0.00 0.00 179.01 178.25 1b22 n GLN 30 N -4.37 0.64 0.00 1.06 7.27 0.15 -3.41 117.38 118.72 1b22 n GLN 30 Ca 0.15 0.27 0.07 0.00 0.07 0.00 0.00 57.00 57.56 1b22 n GLN 30 Cb 0.74 -1.77 0.42 0.00 2.41 0.00 0.00 30.24 32.04 1b22 n GLN 30 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 1b22 n GLY 32 N 0.63 0.60 0.00 0.00 0.00 -1.21 -5.04 105.19 100.18 1b22 n GLY 32 Ca 0.11 -0.56 0.00 0.00 0.00 0.00 0.00 46.02 45.57 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 -0.94 -0.61 0.13 -1.11 -5.00 119.36 111.83 1b22 n ILE 33 Ca 0.00 0.00 0.00 0.00 -1.10 0.00 0.00 62.75 61.65 1b22 n ILE 33 Cb 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 39.64 38.80 1b22 n ILE 33 CO 0.00 0.00 0.00 -3.20 2.80 0.00 0.00 176.55 176.15 1b22 n ASN 34 N 0.00 0.00 -0.34 9.51 5.15 -1.26 -4.82 115.26 123.50 1b22 n ASN 34 Ca 0.00 0.00 0.18 0.00 -0.60 0.00 0.00 54.58 54.16 1b22 n ASN 34 Cb 0.00 0.00 0.41 0.00 -0.53 0.00 0.00 39.78 39.66 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 -1.47 1.90 -0.29 5.20 0.00 -1.97 -2.66 119.26 119.97 1b22 h ALA 35 Ca 0.00 0.10 0.03 0.00 0.00 0.00 0.00 54.91 55.03 1b22 h ALA 35 Cb 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 17.76 1b22 h ALA 35 CO 0.00 -0.33 -0.17 0.27 0.00 0.00 0.00 179.25 179.02 1b22 n ASN 36 N -4.79 -0.31 0.00 0.00 0.23 -1.26 -2.27 115.26 106.86 1b22 n ASN 36 Ca 0.26 1.14 0.00 0.00 -0.53 0.00 0.00 54.58 55.44 1b22 n ASN 36 Cb 0.75 -0.38 0.00 0.00 -2.08 0.00 0.00 39.78 38.07 1b22 n ASN 36 CO 0.00 0.00 0.00 -0.67 -0.93 0.00 0.00 177.26 175.66 1b22 n ASP 37 N -3.62 0.00 0.05 0.53 2.03 -1.00 0.17 116.55 114.71 1b22 n ASP 37 Ca 0.01 0.26 -0.13 0.00 0.52 0.00 0.00 54.79 55.45 1b22 n ASP 37 Cb 0.08 -0.11 -0.08 0.00 -0.72 0.00 0.00 41.12 40.28 1b22 n ASP 37 CO 0.00 0.00 0.00 0.58 -1.92 0.00 0.00 177.20 175.86 1b22 h VAL 38 N 0.00 0.00 0.00 5.18 2.07 -1.65 -3.09 116.25 118.75 1b22 h VAL 38 Ca 0.00 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.52 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 -0.21 0.11 0.02 0.00 0.00 177.57 177.49 1b22 h LYS 39 N -0.55 0.00 -0.92 1.57 6.56 -0.58 -2.87 116.57 119.78 1b22 h LYS 39 Ca 0.01 0.00 0.09 0.00 -1.06 0.00 0.00 60.65 59.69 1b22 h LYS 39 Cb 0.58 0.00 -0.12 0.00 -0.57 0.00 0.00 32.23 32.12 1b22 h LYS 39 CO -0.27 0.05 -0.51 1.63 -2.06 0.00 0.00 179.45 178.29 1b22 n LYS 40 N -4.71 -0.37 0.10 3.15 4.76 0.45 -1.89 118.16 119.66 1b22 n LYS 40 Ca -0.04 1.39 0.07 0.00 -2.87 0.00 0.00 58.31 56.86 1b22 n LYS 40 Cb 0.12 -2.05 -0.01 0.00 -1.84 0.00 0.00 35.03 31.26 1b22 n LYS 40 CO 0.00 0.00 0.00 1.37 -1.37 0.00 0.00 177.40 177.40 1b22 h LEU 41 N 0.00 0.00 -0.76 -0.35 8.10 -1.51 -3.38 115.31 117.42 1b22 h LEU 41 Ca 0.18 0.00 0.02 0.00 0.11 0.00 0.00 57.88 58.19 1b22 h LEU 41 Cb 0.41 0.00 -0.04 0.00 -0.44 0.00 0.00 40.66 40.59 1b22 h LEU 41 CO -0.87 0.25 0.49 -0.08 -4.11 0.00 0.00 178.44 174.12 1b22 h GLU 42 N 0.00 0.96 0.31 0.17 4.81 -1.14 0.32 114.58 120.02 1b22 h GLU 42 Ca -0.05 -0.06 -0.02 0.00 -0.13 0.00 0.00 59.36 59.10 1b22 h GLU 42 Cb 1.24 -0.22 0.00 0.00 0.63 0.00 0.00 28.75 30.40 1b22 h GLU 42 CO 0.02 0.64 -0.15 1.49 -0.73 0.00 0.00 179.01 180.28 1b22 h GLU 43 N 0.99 -0.40 0.00 1.92 4.81 -1.72 -3.41 114.58 116.76 1b22 h GLU 43 Ca 0.29 0.03 -0.03 0.00 -0.13 0.00 0.00 59.36 59.52 1b22 h GLU 43 Cb -0.06 0.09 -0.00 0.00 0.63 0.00 0.00 28.75 29.40 1b22 h GLU 43 CO -0.08 -0.27 -0.57 0.00 -0.73 0.00 0.00 179.01 177.36 1b22 h ALA 44 N -1.53 0.03 0.00 2.92 0.00 -1.72 -3.50 119.26 115.46 1b22 h ALA 44 Ca -0.04 -0.57 0.00 0.00 0.00 0.00 0.00 54.91 54.30 1b22 h ALA 44 Cb 0.32 0.51 0.00 0.00 0.00 0.00 0.00 17.79 18.62 1b22 h ALA 44 CO 0.07 0.51 0.00 0.41 0.00 0.00 0.00 179.25 180.24 1b22 n GLY 45 N 1.60 0.65 0.89 0.00 0.00 0.11 -5.00 105.19 103.44 1b22 n GLY 45 Ca -0.10 -0.48 0.00 0.00 0.00 0.00 0.00 46.02 45.45 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 -1.27 1.61 3.01 -1.26 -4.69 117.46 114.86 1b22 n PHE 46 Ca 0.00 -0.35 -0.43 0.00 1.01 0.00 0.00 57.45 57.68 1b22 n PHE 46 Cb 0.00 -0.20 -0.04 0.00 -0.01 0.00 0.00 39.48 39.22 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 0.43 2.22 -1.69 1.38 1.44 -1.26 -4.05 115.22 113.69 1b22 n HIS 47 Ca 0.00 -2.06 0.00 0.00 -2.01 0.00 0.00 57.72 53.65 1b22 n HIS 47 Cb 0.41 -1.89 0.00 0.00 0.12 0.00 0.00 29.99 28.63 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 5.78 0.00 -0.55 0.61 5.66 -1.26 -3.68 114.28 120.83 1b22 n THR 48 Ca 0.50 0.00 0.42 0.00 -3.05 0.00 0.00 64.05 61.92 1b22 n THR 48 Cb 0.40 0.00 0.65 0.00 -1.55 0.00 0.00 70.33 69.83 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 3.14 -0.02 -0.43 1.08 0.31 0.32 -0.31 118.33 122.42 1b22 n VAL 49 Ca 0.00 1.22 0.40 0.00 -0.01 0.00 0.00 64.34 65.94 1b22 n VAL 49 Cb 0.00 -2.02 0.63 0.00 -0.91 0.00 0.00 33.84 31.54 1b22 n VAL 49 CO 0.00 0.00 0.00 -0.08 -1.32 0.00 0.00 176.83 175.43 1b22 h GLU 50 N 0.00 0.00 0.00 5.55 4.81 -1.83 1.44 114.58 124.54 1b22 h GLU 50 Ca 0.75 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.98 1b22 h GLU 50 Cb 2.96 0.00 0.00 0.00 0.63 0.00 0.00 28.75 32.34 1b22 h GLU 50 CO -0.04 0.00 0.00 0.00 -0.73 0.00 0.00 179.01 178.24 1b22 n ALA 51 N -2.57 1.31 -2.23 2.92 0.00 0.57 -4.52 120.51 115.99 1b22 n ALA 51 Ca 0.32 0.09 -0.07 0.00 0.00 0.00 0.00 53.44 53.78 1b22 n ALA 51 Cb 1.72 -1.26 -0.10 0.00 0.00 0.00 0.00 19.45 19.81 1b22 n ALA 51 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 1b22 s VAL 52 N -3.28 0.20 -0.97 0.00 -7.23 0.49 -4.93 120.40 104.68 1b22 s VAL 52 Ca 0.01 -1.65 -0.10 0.00 -1.81 0.00 0.00 61.98 58.43 1b22 s VAL 52 Cb 0.06 -1.39 -0.01 0.00 0.56 0.00 0.00 36.38 35.60 1b22 s VAL 52 CO 0.22 -0.91 0.75 0.00 -0.31 0.00 0.00 175.10 174.86 1b22 n ALA 53 N 0.22 -2.58 -1.00 1.32 0.00 -1.26 -4.80 120.51 112.40 1b22 n ALA 53 Ca -0.15 -0.14 0.00 0.00 0.00 0.00 0.00 53.44 53.15 1b22 n ALA 53 Cb 0.61 -3.11 0.00 0.00 0.00 0.00 0.00 19.45 16.95 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 -3.20 0.00 -4.12 0.00 9.36 -1.26 -4.96 117.16 112.99 1b22 n TYR 54 Ca -0.11 0.00 -0.27 0.00 3.32 0.00 0.00 57.90 60.85 1b22 n TYR 54 Cb 0.59 0.00 -0.06 0.00 -0.63 0.00 0.00 39.34 39.24 1b22 n TYR 54 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 1b22 s ALA 55 N -1.00 3.46 -0.09 2.98 0.00 -1.26 -5.06 121.76 120.79 1b22 s ALA 55 Ca 0.00 -1.24 -0.30 0.00 0.00 0.00 0.00 51.96 50.42 1b22 s ALA 55 Cb 0.00 -1.26 -0.04 0.00 0.00 0.00 0.00 23.12 21.82 1b22 s ALA 55 CO 0.00 0.51 1.50 -1.25 0.00 0.00 0.00 175.76 176.52 1b22 s PRO 56 N -3.01 4.21 0.60 0.00 0.04 -1.26 -4.85 135.00 130.73 1b22 s PRO 56 Ca 0.30 1.98 0.28 0.00 0.04 0.00 0.00 61.00 63.60 1b22 s PRO 56 Cb -0.10 -3.88 1.08 0.00 0.04 0.00 0.00 34.50 31.64 1b22 s PRO 56 CO 0.22 -0.78 1.45 1.57 0.04 0.00 0.00 177.00 179.50 1b22 h LYS 57 N 8.95 0.00 0.00 4.56 -0.00 -1.97 0.85 116.57 128.96 1b22 h LYS 57 Ca -0.34 0.00 -0.14 0.00 -0.00 0.00 0.00 60.65 60.16 1b22 h LYS 57 Cb 1.15 0.00 -0.02 0.00 -0.00 0.00 0.00 32.23 33.36 1b22 h LYS 57 CO 0.96 0.00 -0.68 -0.22 -0.00 0.00 0.00 179.45 179.50 1b22 h LYS 58 N 0.00 0.00 0.02 0.07 3.64 -1.89 -2.90 116.57 115.51 1b22 h LYS 58 Ca 0.44 0.00 -0.00 0.00 -1.27 0.00 0.00 60.65 59.82 1b22 h LYS 58 Cb 2.54 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 34.36 1b22 h LYS 58 CO -0.00 0.68 -0.01 1.49 -2.27 0.00 0.00 179.45 179.34 1b22 h GLU 59 N 0.00 -0.02 0.48 1.90 4.57 0.36 -2.78 114.58 119.09 1b22 h GLU 59 Ca -0.01 0.00 -0.01 0.00 -1.18 0.00 0.00 59.36 58.16 1b22 h GLU 59 Cb 1.45 0.01 -0.02 0.00 -0.16 0.00 0.00 28.75 30.02 1b22 h GLU 59 CO 0.09 0.68 -0.51 1.25 -1.18 0.00 0.00 179.01 179.34 1b22 h LEU 60 N -0.95 -1.42 -1.86 1.64 5.85 -1.65 0.87 115.31 117.79 1b22 h LEU 60 Ca -0.00 0.12 0.27 0.00 0.84 0.00 0.00 57.88 59.10 1b22 h LEU 60 Cb 0.72 0.47 -0.04 0.00 0.37 0.00 0.00 40.66 42.18 1b22 h LEU 60 CO 0.00 -0.67 0.77 0.16 -0.34 0.00 0.00 178.44 178.37 1b22 h ILE 61 N -1.00 0.34 0.00 4.05 -0.00 -1.65 0.79 117.51 120.04 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 0.88 0.43 0.00 0.00 -0.00 0.00 0.00 36.82 38.12 1b22 h ILE 61 CO -0.08 0.00 0.22 -3.20 -0.00 0.00 0.00 178.15 175.09 1b22 n ASN 62 N -3.91 0.17 0.00 2.16 2.85 0.30 -1.58 115.26 115.26 1b22 n ASN 62 Ca 0.19 0.45 0.00 0.00 -0.11 0.00 0.00 54.58 55.11 1b22 n ASN 62 Cb 1.09 -0.43 0.00 0.00 1.24 0.00 0.00 39.78 41.68 1b22 n ASN 62 CO 0.00 0.00 0.00 -0.38 -2.11 0.00 0.00 177.26 174.77 1b22 n ILE 63 N -1.68 0.00 0.14 -1.44 5.41 0.28 -2.93 119.36 119.14 1b22 n ILE 63 Ca -0.00 1.03 0.02 0.00 1.00 0.00 0.00 62.75 64.79 1b22 n ILE 63 Cb 0.23 -1.67 0.09 0.00 -0.71 0.00 0.00 39.64 37.58 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 1.63 -1.82 -3.46 116.57 113.30 1b22 h LYS 64 Ca 0.00 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.80 1b22 h LYS 64 Cb 0.00 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 31.63 1b22 h LYS 64 CO 0.00 0.55 0.00 0.41 -3.45 0.00 0.00 179.45 176.96 1b22 n GLY 65 N 0.94 1.40 0.00 5.01 0.00 -1.04 -5.15 105.19 106.35 1b22 n GLY 65 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.03 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 -0.49 -0.61 5.41 -0.61 -4.93 119.36 118.13 1b22 n ILE 66 Ca 0.00 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.75 1b22 n ILE 66 Cb 0.00 0.00 0.00 0.00 -0.71 0.00 0.00 39.64 38.93 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 0.12 0.23 4.38 3.41 -1.26 -4.45 113.62 116.06 1b22 n SER 67 Ca 0.00 0.00 0.14 0.00 -0.26 0.00 0.00 58.87 58.75 1b22 n SER 67 Cb 0.00 0.00 0.73 0.00 -0.26 0.00 0.00 64.21 64.68 1b22 n SER 67 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 1b22 h GLU 68 N 0.00 0.00 0.00 4.33 5.08 -1.95 -3.00 114.58 119.03 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 -1.82 0.00 0.08 3.43 0.00 -1.26 -0.68 120.51 120.25 1b22 n ALA 69 Ca -0.02 0.00 -0.22 0.00 0.00 0.00 0.00 53.44 53.21 1b22 n ALA 69 Cb 0.15 0.25 -0.15 0.00 0.00 0.00 0.00 19.45 19.70 1b22 n ALA 69 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 1b22 h LYS 70 N 0.00 0.38 -0.16 0.00 1.79 -1.97 -3.05 116.57 113.57 1b22 h LYS 70 Ca 0.00 -0.66 0.04 0.00 -2.18 0.00 0.00 60.65 57.86 1b22 h LYS 70 Cb 0.00 0.24 -0.07 0.00 -1.58 0.00 0.00 32.23 30.83 1b22 h LYS 70 CO 0.00 1.29 -0.44 0.00 -1.08 0.00 0.00 179.45 179.22 1b22 h ALA 71 N 0.22 -0.61 -0.82 3.86 0.00 -1.55 -0.77 119.26 119.59 1b22 h ALA 71 Ca -0.30 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.60 1b22 h ALA 71 Cb 2.09 0.83 -0.04 0.00 0.00 0.00 0.00 17.79 20.67 1b22 h ALA 71 CO 0.19 -0.94 0.51 0.22 0.00 0.00 0.00 179.25 179.23 1b22 h ASP 72 N -0.48 0.97 -1.34 0.00 3.58 -1.05 -1.59 116.42 116.50 1b22 h ASP 72 Ca 0.08 -0.06 0.39 0.00 0.42 0.00 0.00 57.03 57.86 1b22 h ASP 72 Cb 0.63 -0.25 -0.06 0.00 1.72 0.00 0.00 39.33 41.38 1b22 h ASP 72 CO -0.42 0.74 0.96 0.50 -2.88 0.00 0.00 179.24 178.14 1b22 h LYS 73 N 1.12 0.02 0.00 0.28 1.63 -1.03 0.27 116.57 118.85 1b22 h LYS 73 Ca 0.30 -0.00 -0.11 0.00 -0.85 0.00 0.00 60.65 59.99 1b22 h LYS 73 Cb -0.07 -0.00 -0.02 0.00 -0.60 0.00 0.00 32.23 31.54 1b22 h LYS 73 CO -0.06 0.01 -0.64 0.82 -3.45 0.00 0.00 179.45 176.13 1b22 h ILE 74 N 0.02 1.00 -0.01 2.00 2.04 -0.84 -2.49 117.51 119.23 1b22 h ILE 74 Ca 0.65 -1.97 0.00 0.00 1.00 0.00 0.00 64.86 64.54 1b22 h ILE 74 Cb 2.55 2.11 -0.00 0.00 -0.74 0.00 0.00 36.82 40.74 1b22 h ILE 74 CO -0.03 0.34 0.14 -0.07 0.00 0.00 0.00 178.15 178.53 1b22 h LEU 75 N -1.00 0.00 0.00 1.44 4.07 -0.95 0.66 115.31 119.54 1b22 h LEU 75 Ca -0.16 0.00 -0.14 0.00 0.08 0.00 0.00 57.88 57.66 1b22 h LEU 75 Cb 0.98 0.00 -0.02 0.00 1.08 0.00 0.00 40.66 42.70 1b22 h LEU 75 CO -0.10 0.00 -0.83 0.00 -1.08 0.00 0.00 178.44 176.44 1b22 h ALA 76 N 1.73 0.16 0.00 1.53 0.00 -0.62 -2.73 119.26 119.33 1b22 h ALA 76 Ca 0.00 -0.90 -0.08 0.00 0.00 0.00 0.00 54.91 53.93 1b22 h ALA 76 Cb 0.28 0.52 -0.01 0.00 0.00 0.00 0.00 17.79 18.58 1b22 h ALA 76 CO -0.00 0.49 -0.39 0.93 0.00 0.00 0.00 179.25 180.28 1b22 h GLU 77 N -1.00 0.00 0.10 0.00 4.39 -0.93 -2.47 114.58 114.67 1b22 h GLU 77 Ca -0.21 0.00 -0.26 0.00 0.34 0.00 0.00 59.36 59.23 1b22 h GLU 77 Cb 1.06 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 29.70 1b22 h GLU 77 CO -0.13 0.39 -1.20 0.00 -1.16 0.00 0.00 179.01 176.91 1b22 h ALA 78 N 1.61 0.16 0.00 3.43 0.00 0.17 -0.32 119.26 124.32 1b22 h ALA 78 Ca -0.00 -0.90 0.00 0.00 0.00 0.00 0.00 54.91 54.00 1b22 h ALA 78 Cb 0.75 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.52 1b22 h ALA 78 CO 0.05 1.05 0.00 0.00 0.00 0.00 0.00 179.25 180.35 1b22 h ALA 79 N 0.68 1.00 -0.00 0.00 0.00 -1.30 -1.15 119.26 118.48 1b22 h ALA 79 Ca -0.11 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.80 1b22 h ALA 79 Cb 1.93 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.72 1b22 h ALA 79 CO 0.18 0.00 -0.05 0.36 0.00 0.00 0.00 179.25 179.75 1b22 n LYS 80 N -2.59 1.23 0.00 0.00 2.85 -0.95 -4.46 118.16 114.25 1b22 n LYS 80 Ca 0.03 -0.55 0.00 0.00 -1.05 0.00 0.00 58.31 56.74 1b22 n LYS 80 Cb 0.36 -0.97 0.00 0.00 -0.65 0.00 0.00 35.03 33.77 1b22 n LYS 80 CO 0.00 0.00 0.00 -0.11 -0.05 0.00 0.00 177.40 177.24 1b22 n LEU 81 N -0.12 2.16 -2.55 -5.58 0.00 -0.13 -4.84 117.00 105.93 1b22 n LEU 81 Ca 0.02 0.00 -0.23 0.00 0.00 0.00 0.00 56.01 55.80 1b22 n LEU 81 Cb 0.09 0.00 0.00 0.00 0.00 0.00 0.00 43.42 43.52 1b22 n LEU 81 CO 0.04 0.35 0.11 0.55 0.00 0.00 0.00 177.39 178.44 1b22 n VAL 82 N -2.45 2.07 -0.64 1.96 3.14 -0.47 -5.03 118.33 116.90 1b22 n VAL 82 Ca 0.00 -4.55 0.00 0.00 -2.96 0.00 0.00 64.34 56.83 1b22 n VAL 82 Cb 0.43 -0.84 0.00 0.00 -1.06 0.00 0.00 33.84 32.37 1b22 n VAL 82 CO 0.00 0.00 0.00 -0.81 -6.46 0.00 0.00 176.83 169.56 1b22 n PRO 83 N -0.37 -0.65 -0.00 1.45 -0.04 -0.97 -4.65 135.00 129.77 1b22 n PRO 83 Ca 0.32 0.00 -0.00 0.00 -0.04 0.00 0.00 63.50 63.78 1b22 n PRO 83 Cb 0.68 0.00 -0.00 0.00 -0.04 0.00 0.00 33.50 34.14 1b22 n PRO 83 CO 0.00 0.00 0.00 1.98 -0.04 0.00 0.00 175.50 177.44 1b22 h MET 84 N 0.00 0.00 0.00 0.54 1.85 -1.79 -3.49 114.93 112.04 1b22 h MET 84 Ca 0.00 0.00 0.00 0.00 -0.61 0.00 0.00 59.70 59.09 1b22 h MET 84 Cb 0.00 0.00 0.00 0.00 0.43 0.00 0.00 31.60 32.03 1b22 h MET 84 CO 0.00 0.00 0.00 0.41 -0.40 0.00 0.00 176.91 176.92