#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1h67 h PRO 28 N 0.00 0.46 0.00 3.17 0.11 -1.95 -3.46 132.00 130.34 1h67 h PRO 28 Ca 0.00 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.08 1h67 h PRO 28 Cb 0.00 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 31.01 1h67 h PRO 28 CO 0.00 0.31 0.00 0.00 -0.21 0.00 0.00 178.00 178.10 1h67 n GLN 29 N -4.88 0.00 -1.45 1.05 10.64 -1.26 -4.02 117.38 117.47 1h67 n GLN 29 Ca 0.03 0.00 -0.36 0.00 -1.83 0.00 0.00 57.00 54.83 1h67 n GLN 29 Cb 0.10 0.00 0.08 0.00 -0.86 0.00 0.00 30.24 29.55 1h67 n GLN 29 CO 0.00 0.00 0.00 -2.37 -1.83 0.00 0.00 177.06 172.86 1h67 n THR 30 N 0.00 3.22 0.15 -0.39 5.66 -1.26 -4.82 114.28 116.84 1h67 n THR 30 Ca 0.00 -0.41 0.18 0.00 -3.05 0.00 0.00 64.05 60.77 1h67 n THR 30 Cb 0.00 -1.14 0.70 0.00 -1.55 0.00 0.00 70.33 68.34 1h67 n THR 30 CO 0.00 0.00 0.00 -0.33 -3.05 0.00 0.00 175.07 171.69 1h67 h GLU 31 N -0.04 0.00 -0.74 1.09 3.07 -2.01 -1.52 114.58 114.44 1h67 h GLU 31 Ca -0.48 0.00 0.16 0.00 -0.50 0.00 0.00 59.36 58.54 1h67 h GLU 31 Cb 1.34 0.00 -0.11 0.00 -0.84 0.00 0.00 28.75 29.14 1h67 h GLU 31 CO 0.48 0.00 0.20 -0.09 -1.40 0.00 0.00 179.01 178.21 1h67 h ARG 32 N 0.00 0.29 -0.01 2.33 2.43 -1.87 0.27 114.38 117.82 1h67 h ARG 32 Ca 0.15 -0.02 -0.20 0.00 -0.81 0.00 0.00 59.98 59.11 1h67 h ARG 32 Cb 1.17 -0.07 -0.01 0.00 -0.42 0.00 0.00 29.97 30.64 1h67 h ARG 32 CO -0.00 0.19 -0.86 1.96 -1.51 0.00 0.00 179.97 179.76 1h67 h GLN 33 N 0.30 0.27 -0.14 0.20 1.08 -1.44 -3.15 115.11 112.24 1h67 h GLN 33 Ca 0.42 -0.28 0.03 0.00 -1.45 0.00 0.00 58.65 57.37 1h67 h GLN 33 Cb 0.70 0.08 -0.03 0.00 -0.05 0.00 0.00 27.48 28.17 1h67 h GLN 33 CO -0.49 0.98 -0.06 -0.07 -0.95 0.00 0.00 178.83 178.24 1h67 h LEU 34 N 0.16 -0.21 -0.05 1.46 3.38 -1.02 0.55 115.31 119.58 1h67 h LEU 34 Ca -0.05 0.05 -0.00 0.00 0.09 0.00 0.00 57.88 57.97 1h67 h LEU 34 Cb 1.47 0.12 -0.00 0.00 0.09 0.00 0.00 40.66 42.34 1h67 h LEU 34 CO 0.14 -0.08 0.02 0.08 0.09 0.00 0.00 178.44 178.68 1h67 h ARG 35 N -0.04 0.08 -0.94 1.13 0.11 -1.37 -2.28 114.38 111.08 1h67 h ARG 35 Ca 0.08 -0.02 0.05 0.00 0.10 0.00 0.00 59.98 60.19 1h67 h ARG 35 Cb 0.16 -0.01 -0.06 0.00 1.11 0.00 0.00 29.97 31.17 1h67 h ARG 35 CO -0.17 0.25 0.61 0.28 0.10 0.00 0.00 179.97 181.04 1h67 h VAL 36 N -0.10 1.12 0.25 0.08 2.07 -1.48 -0.82 116.25 117.37 1h67 h VAL 36 Ca 0.02 -0.39 -0.01 0.00 0.82 0.00 0.00 66.70 67.14 1h67 h VAL 36 Cb 0.20 -0.11 0.00 0.00 -1.52 0.00 0.00 31.29 29.86 1h67 h VAL 36 CO -0.00 0.21 -0.12 -0.25 0.02 0.00 0.00 177.57 177.43 1h67 h TRP 37 N 1.13 -0.31 -0.41 1.57 7.01 -0.72 -1.21 115.95 123.02 1h67 h TRP 37 Ca 0.38 -0.01 0.05 0.00 2.11 0.00 0.00 58.89 61.43 1h67 h TRP 37 Cb 0.09 0.10 -0.05 0.00 -2.10 0.00 0.00 29.16 27.20 1h67 h TRP 37 CO -0.00 -0.19 0.12 0.82 -2.79 0.00 0.00 178.44 176.40 1h67 h ILE 38 N -0.37 0.84 -0.73 2.65 2.04 -1.40 -0.93 117.51 119.61 1h67 h ILE 38 Ca -0.03 -0.09 0.05 0.00 1.00 0.00 0.00 64.86 65.79 1h67 h ILE 38 Cb 0.26 0.55 -0.05 0.00 -0.74 0.00 0.00 36.82 36.83 1h67 h ILE 38 CO 0.06 0.05 0.44 -0.33 0.00 0.00 0.00 178.15 178.36 1h67 h GLU 39 N 0.27 0.79 -0.15 2.37 5.08 -1.23 -1.32 114.58 120.39 1h67 h GLU 39 Ca 0.19 -0.05 -0.06 0.00 -1.00 0.00 0.00 59.36 58.45 1h67 h GLU 39 Cb 0.20 -0.18 -0.01 0.00 0.50 0.00 0.00 28.75 29.26 1h67 h GLU 39 CO -0.22 0.52 -0.16 0.78 -1.00 0.00 0.00 179.01 178.94 1h67 h GLY 40 N 0.81 0.26 0.02 -3.84 0.00 -0.50 0.37 103.07 100.17 1h67 h GLY 40 Ca 0.32 -0.16 0.23 0.00 0.00 0.00 0.00 47.33 47.71 1h67 h GLY 40 CO -0.16 0.15 0.63 0.00 0.00 0.00 0.00 176.54 177.15 1h67 h ALA 41 N 1.62 1.95 0.00 3.60 0.00 0.02 -3.37 119.26 123.08 1h67 h ALA 41 Ca 0.04 0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.03 1h67 h ALA 41 Cb 0.42 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.19 1h67 h ALA 41 CO 0.03 -0.34 0.00 0.25 0.00 0.00 0.00 179.25 179.19 1h67 n THR 42 N -4.71 0.77 0.00 0.00 -2.24 -1.09 -5.01 114.28 102.00 1h67 n THR 42 Ca 0.24 0.26 0.00 0.00 -2.27 0.00 0.00 64.05 62.28 1h67 n THR 42 Cb 0.72 -1.21 0.00 0.00 -2.10 0.00 0.00 70.33 67.74 1h67 n THR 42 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1h67 n GLY 43 N 2.93 3.29 3.71 3.38 0.00 0.13 -5.12 105.19 113.51 1h67 n GLY 43 Ca 0.00 -0.45 -0.42 0.00 0.00 0.00 0.00 46.02 45.15 1h67 n GLY 43 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1h67 n ARG 44 N 0.00 2.23 -3.07 1.61 -4.01 -1.26 -4.86 116.66 107.30 1h67 n ARG 44 Ca 0.00 0.78 -0.39 0.00 -1.04 0.00 0.00 57.85 57.20 1h67 n ARG 44 Cb 0.00 -2.40 -0.06 0.00 -3.04 0.00 0.00 32.46 26.97 1h67 n ARG 44 CO 0.00 0.00 0.00 1.03 -3.04 0.00 0.00 177.63 175.62 1h67 s ARG 45 N -1.94 4.45 0.10 2.89 1.81 -1.26 -4.57 118.95 120.42 1h67 s ARG 45 Ca 0.55 1.01 -0.25 0.00 -1.72 0.00 0.00 55.73 55.32 1h67 s ARG 45 Cb -0.55 -3.28 -0.12 0.00 -0.45 0.00 0.00 34.95 30.55 1h67 s ARG 45 CO 0.62 0.51 1.69 0.82 -0.68 0.00 0.00 175.30 178.27 1h67 h ILE 46 N 3.60 0.70 0.00 1.52 2.04 -1.93 -3.49 117.51 119.95 1h67 h ILE 46 Ca -0.47 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.39 1h67 h ILE 46 Cb 1.21 0.70 0.00 0.00 -0.74 0.00 0.00 36.82 37.99 1h67 h ILE 46 CO 0.67 0.00 0.00 0.61 0.00 0.00 0.00 178.15 179.43 1h67 n GLY 47 N -1.25 0.58 0.06 5.37 0.00 -1.26 -4.67 105.19 104.01 1h67 n GLY 47 Ca -0.07 -1.46 -0.05 0.00 0.00 0.00 0.00 46.02 44.44 1h67 n GLY 47 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1h67 h ASP 48 N 0.00 0.00 -3.28 1.61 5.19 -2.00 -3.46 116.42 114.48 1h67 h ASP 48 Ca 0.00 -0.23 -0.57 0.00 -0.62 0.00 0.00 57.03 55.61 1h67 h ASP 48 Cb 0.00 0.00 -0.06 0.00 0.18 0.00 0.00 39.33 39.45 1h67 h ASP 48 CO 0.00 0.71 -0.05 0.20 -3.12 0.00 0.00 179.24 176.98 1h67 s ASN 49 N -5.81 6.92 0.01 6.45 0.01 -1.26 -4.99 114.94 116.28 1h67 s ASN 49 Ca -0.08 1.10 -0.24 0.00 -0.71 0.00 0.00 52.86 52.92 1h67 s ASN 49 Cb 0.00 -2.34 -0.18 0.00 0.41 0.00 0.00 41.25 39.14 1h67 s ASN 49 CO 0.22 0.12 1.38 0.15 -1.51 0.00 0.00 177.10 177.46 1h67 h PHE 50 N 5.63 0.08 0.00 2.20 3.57 -1.97 -1.03 116.94 125.43 1h67 h PHE 50 Ca -0.45 -0.02 -0.00 0.00 3.53 0.00 0.00 57.97 61.03 1h67 h PHE 50 Cb 1.20 -0.02 0.00 0.00 2.79 0.00 0.00 35.95 39.92 1h67 h PHE 50 CO 0.66 0.43 -0.00 0.52 -2.23 0.00 0.00 178.31 177.69 1h67 h MET 51 N -0.29 -0.00 -0.88 1.11 0.00 -1.99 -2.75 114.93 110.12 1h67 h MET 51 Ca 0.01 0.00 0.07 0.00 0.00 0.00 0.00 59.70 59.77 1h67 h MET 51 Cb 0.41 0.00 -0.06 0.00 0.00 0.00 0.00 31.60 31.94 1h67 h MET 51 CO 0.00 0.44 0.55 0.22 0.00 0.00 0.00 176.91 178.12 1h67 h ASP 52 N -0.44 0.86 -0.49 1.22 3.58 -1.92 -2.26 116.42 116.97 1h67 h ASP 52 Ca -0.00 0.02 -0.01 0.00 0.42 0.00 0.00 57.03 57.46 1h67 h ASP 52 Cb 0.44 -0.16 -0.02 0.00 1.72 0.00 0.00 39.33 41.31 1h67 h ASP 52 CO 0.00 0.55 0.28 1.23 -2.88 0.00 0.00 179.24 178.42 1h67 h GLY 53 N 0.99 0.72 2.00 -0.78 0.00 -1.17 -2.24 103.07 102.60 1h67 h GLY 53 Ca 0.39 -0.31 -0.01 0.00 0.00 0.00 0.00 47.33 47.39 1h67 h GLY 53 CO -0.18 0.30 -0.06 1.41 0.00 0.00 0.00 176.54 178.01 1h67 h LEU 54 N 0.65 0.00 -1.59 3.11 3.38 -1.11 -2.65 115.31 117.09 1h67 h LEU 54 Ca 0.17 0.00 0.25 0.00 0.09 0.00 0.00 57.88 58.39 1h67 h LEU 54 Cb 0.02 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 40.70 1h67 h LEU 54 CO -0.03 0.06 0.65 0.11 0.09 0.00 0.00 178.44 179.32 1h67 h LYS 55 N 0.00 0.28 -0.58 1.13 1.57 -0.94 0.13 116.57 118.17 1h67 h LYS 55 Ca -0.00 -0.02 0.12 0.00 -1.87 0.00 0.00 60.65 58.89 1h67 h LYS 55 Cb 0.13 -0.06 -0.03 0.00 0.08 0.00 0.00 32.23 32.34 1h67 h LYS 55 CO 0.01 0.19 0.40 0.38 -0.57 0.00 0.00 179.45 179.85 1h67 h ASP 56 N 0.29 0.23 0.00 0.86 2.03 -1.60 -3.46 116.42 114.77 1h67 h ASP 56 Ca 0.51 0.01 0.00 0.00 -0.73 0.00 0.00 57.03 56.82 1h67 h ASP 56 Cb 1.48 -0.04 0.00 0.00 -0.83 0.00 0.00 39.33 39.94 1h67 h ASP 56 CO -0.17 0.13 0.00 0.61 -1.03 0.00 0.00 179.24 178.78 1h67 n GLY 57 N -1.56 1.00 0.22 7.15 0.00 0.45 -4.30 105.19 108.15 1h67 n GLY 57 Ca 0.10 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.07 1h67 n GLY 57 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1h67 h VAL 58 N 0.00 0.48 0.01 1.61 2.07 -1.86 0.45 116.25 119.00 1h67 h VAL 58 Ca 0.00 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.55 1h67 h VAL 58 Cb 0.00 0.48 -0.04 0.00 -1.52 0.00 0.00 31.29 30.20 1h67 h VAL 58 CO 0.00 0.00 -0.25 0.40 0.02 0.00 0.00 177.57 177.74 1h67 h ILE 59 N -0.07 0.44 -0.47 4.57 2.04 -1.90 0.92 117.51 123.03 1h67 h ILE 59 Ca 0.20 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 66.06 1h67 h ILE 59 Cb 0.38 0.44 -0.02 0.00 -0.74 0.00 0.00 36.82 36.88 1h67 h ILE 59 CO -0.47 0.00 0.25 -0.07 0.00 0.00 0.00 178.15 177.86 1h67 h LEU 60 N -0.39 0.57 -1.10 1.44 3.38 -1.76 0.83 115.31 118.29 1h67 h LEU 60 Ca 0.06 -0.04 -0.07 0.00 0.09 0.00 0.00 57.88 57.93 1h67 h LEU 60 Cb 0.47 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 41.06 1h67 h LEU 60 CO -0.22 0.46 -0.08 0.00 0.09 0.00 0.00 178.44 178.70 1h67 h GLU 62 N 0.50 0.74 0.30 0.00 5.08 0.30 -2.94 114.58 118.56 1h67 h GLU 62 Ca 0.10 -0.40 -0.01 0.00 -1.00 0.00 0.00 59.36 58.04 1h67 h GLU 62 Cb 0.45 0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.72 1h67 h GLU 62 CO 0.02 1.02 -0.14 1.25 -1.00 0.00 0.00 179.01 180.16 1h67 h LEU 63 N 0.49 -0.34 -1.93 1.33 5.85 -0.65 -3.06 115.31 116.99 1h67 h LEU 63 Ca 0.04 -0.18 0.26 0.00 0.84 0.00 0.00 57.88 58.85 1h67 h LEU 63 Cb 0.90 0.09 -0.04 0.00 0.37 0.00 0.00 40.66 41.97 1h67 h LEU 63 CO 0.08 0.03 0.67 -0.29 -0.34 0.00 0.00 178.44 178.58 1h67 h ILE 64 N -0.76 0.54 -0.96 4.05 6.09 -1.04 0.95 117.51 126.39 1h67 h ILE 64 Ca -0.04 -0.02 0.19 0.00 -1.37 0.00 0.00 64.86 63.62 1h67 h ILE 64 Cb 0.50 0.49 -0.11 0.00 0.47 0.00 0.00 36.82 38.17 1h67 h ILE 64 CO 0.07 0.01 0.56 0.78 -3.07 0.00 0.00 178.15 176.49 1h67 h ASN 65 N 0.05 0.68 -0.09 2.19 -0.26 -1.40 0.19 115.58 116.94 1h67 h ASN 65 Ca 0.45 0.11 -0.02 0.00 -0.56 0.00 0.00 56.30 56.28 1h67 h ASN 65 Cb 1.72 -0.01 -0.00 0.00 -1.06 0.00 0.00 38.32 38.97 1h67 h ASN 65 CO -0.03 0.22 -0.02 0.11 -1.06 0.00 0.00 177.43 176.65 1h67 h LYS 66 N 0.69 0.18 -0.02 0.81 1.79 -0.94 -2.97 116.57 116.11 1h67 h LYS 66 Ca 0.56 -0.07 0.01 0.00 -2.18 0.00 0.00 60.65 58.97 1h67 h LYS 66 Cb 0.90 -0.01 -0.00 0.00 -1.58 0.00 0.00 32.23 31.54 1h67 h LYS 66 CO -0.40 0.50 0.01 -0.07 -1.08 0.00 0.00 179.45 178.41 1h67 h LEU 67 N -0.15 0.00 -7.14 2.94 4.07 -1.11 -3.42 115.31 110.50 1h67 h LEU 67 Ca 0.02 0.00 -0.07 0.00 0.08 0.00 0.00 57.88 57.92 1h67 h LEU 67 Cb 0.43 0.00 -0.24 0.00 1.08 0.00 0.00 40.66 41.92 1h67 h LEU 67 CO 0.01 0.00 -0.18 -1.58 -1.08 0.00 0.00 178.44 175.61 1h67 s GLN 68 N -5.04 0.51 0.00 1.13 0.74 0.52 -4.95 119.66 112.57 1h67 s GLN 68 Ca -0.05 0.94 -0.03 0.00 0.05 0.00 0.00 55.36 56.27 1h67 s GLN 68 Cb 0.17 0.04 -0.13 0.00 1.10 0.00 0.00 33.01 34.20 1h67 s GLN 68 CO 0.66 -0.15 2.75 -0.35 -0.55 0.00 0.00 175.29 177.65 1h67 n PRO 69 N 4.23 1.46 0.00 1.67 -0.04 -1.22 -3.63 135.00 137.47 1h67 n PRO 69 Ca -0.22 -0.46 0.00 0.00 -0.04 0.00 0.00 63.50 62.78 1h67 n PRO 69 Cb 0.57 -1.47 0.00 0.00 -0.04 0.00 0.00 33.50 32.56 1h67 n PRO 69 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1h67 n GLY 70 N 1.97 0.00 0.11 0.55 0.00 -1.26 -5.04 105.19 101.52 1h67 n GLY 70 Ca 0.20 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 46.01 1h67 n GLY 70 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1h67 h SER 71 N 0.00 0.15 -3.33 1.61 0.02 -1.87 -3.47 113.55 106.65 1h67 h SER 71 Ca 0.00 -0.68 -0.28 0.00 -0.84 0.00 0.00 61.79 59.99 1h67 h SER 71 Cb 0.00 -0.05 -0.34 0.00 0.14 0.00 0.00 62.40 62.15 1h67 h SER 71 CO 0.00 1.56 -0.65 -0.69 -1.14 0.00 0.00 176.83 175.91 1h67 s VAL 72 N -2.41 -0.12 -0.22 2.27 1.01 -1.26 -4.44 120.40 115.23 1h67 s VAL 72 Ca -0.26 0.27 -0.03 0.00 0.00 0.00 0.00 61.98 61.96 1h67 s VAL 72 Cb 0.05 -0.22 -0.12 0.00 0.00 0.00 0.00 36.38 36.09 1h67 s VAL 72 CO 0.66 0.11 -0.23 1.67 0.00 0.00 0.00 175.10 177.32 1h67 n GLN 73 N 4.67 0.51 -1.01 2.72 -0.06 -1.26 -4.60 117.38 118.34 1h67 n GLN 73 Ca -0.17 0.16 -0.18 0.00 -2.00 0.00 0.00 57.00 54.80 1h67 n GLN 73 Cb 0.51 -1.37 -0.12 0.00 -4.06 0.00 0.00 30.24 25.19 1h67 n GLN 73 CO 0.00 0.00 0.00 1.63 -0.20 0.00 0.00 177.06 178.49 1h67 n LYS 74 N -3.46 2.30 -1.02 3.69 5.02 -1.26 -4.79 118.16 118.64 1h67 n LYS 74 Ca -0.40 -1.25 -0.33 0.00 -2.02 0.00 0.00 58.31 54.32 1h67 n LYS 74 Cb 0.86 -2.18 -0.03 0.00 -0.02 0.00 0.00 35.03 33.66 1h67 n LYS 74 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 1h67 n VAL 75 N 2.85 2.48 -2.01 -0.18 0.31 -1.26 -4.51 118.33 116.01 1h67 n VAL 75 Ca 0.49 -1.75 -0.41 0.00 -0.01 0.00 0.00 64.34 62.66 1h67 n VAL 75 Cb 0.68 -2.28 -0.02 0.00 -0.91 0.00 0.00 33.84 31.30 1h67 n VAL 75 CO 0.00 0.00 0.00 0.20 -1.32 0.00 0.00 176.83 175.71 1h67 s ASN 76 N 3.83 6.64 0.37 4.52 0.01 -1.26 -4.96 114.94 124.09 1h67 s ASN 76 Ca 0.49 2.70 -0.28 0.00 -0.71 0.00 0.00 52.86 55.06 1h67 s ASN 76 Cb 0.13 -2.63 -0.11 0.00 0.41 0.00 0.00 41.25 39.05 1h67 s ASN 76 CO 0.01 -0.69 1.45 -1.81 -1.51 0.00 0.00 177.10 174.54 1h67 s ASP 77 N 0.22 6.41 -0.00 -1.22 1.11 -1.26 -4.78 116.67 117.15 1h67 s ASP 77 Ca 0.58 2.98 -0.30 0.00 0.18 0.00 0.00 52.55 55.98 1h67 s ASP 77 Cb -0.42 -2.66 -0.06 0.00 1.07 0.00 0.00 42.92 40.85 1h67 s ASP 77 CO 0.46 -0.82 1.51 -2.16 1.18 0.00 0.00 175.17 175.34 1h67 s PRO 78 N -2.05 4.24 0.27 8.23 0.04 -1.26 -4.74 135.00 139.73 1h67 s PRO 78 Ca 0.52 2.09 0.00 0.00 0.04 0.00 0.00 61.00 63.65 1h67 s PRO 78 Cb -0.45 -3.68 0.00 0.00 0.04 0.00 0.00 34.50 30.41 1h67 s PRO 78 CO 0.61 -0.68 0.00 0.28 0.04 0.00 0.00 177.00 177.25 1h67 n VAL 79 N 4.89 0.00 0.00 -0.36 0.31 -1.26 -5.11 118.33 116.80 1h67 n VAL 79 Ca 0.15 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.48 1h67 n VAL 79 Cb 0.43 -0.11 0.00 0.00 -0.91 0.00 0.00 33.84 33.25 1h67 n VAL 79 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1h67 n GLN 80 N -3.13 0.00 0.00 5.55 6.02 -1.26 -5.07 117.38 119.49 1h67 n GLN 80 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.99 1h67 n GLN 80 Cb 0.00 0.00 0.00 0.00 1.02 0.00 0.00 30.24 31.26 1h67 n GLN 80 CO 0.00 0.00 0.00 0.27 -1.01 0.00 0.00 177.06 176.32 1h67 n ASN 81 N 0.00 1.99 0.27 1.08 0.23 -1.26 -4.76 115.26 112.81 1h67 n ASN 81 Ca 0.00 0.00 0.15 0.00 -0.53 0.00 0.00 54.58 54.20 1h67 n ASN 81 Cb 0.00 0.00 0.68 0.00 -2.08 0.00 0.00 39.78 38.38 1h67 n ASN 81 CO 0.00 0.00 0.00 4.11 -0.93 0.00 0.00 177.26 180.44 1h67 h TRP 82 N 0.00 0.00 0.21 -2.53 5.08 -1.99 -3.02 115.95 113.70 1h67 h TRP 82 Ca 0.00 0.00 0.01 0.00 1.08 0.00 0.00 58.89 59.98 1h67 h TRP 82 Cb 0.58 0.00 -0.02 0.00 -3.00 0.00 0.00 29.16 26.72 1h67 h TRP 82 CO 0.00 0.07 -0.24 0.45 -1.28 0.00 0.00 178.44 177.45 1h67 h HIS 83 N 0.00 -0.62 -0.46 0.12 3.86 -1.91 -1.48 115.15 114.65 1h67 h HIS 83 Ca -0.00 0.01 -0.04 0.00 -1.16 0.00 0.00 60.37 59.18 1h67 h HIS 83 Cb 0.51 0.25 -0.02 0.00 1.06 0.00 0.00 27.41 29.21 1h67 h HIS 83 CO 0.00 -0.34 0.15 0.87 0.86 0.00 0.00 177.93 179.46 1h67 h LYS 84 N -0.49 0.71 -0.69 2.45 1.57 -1.72 -2.30 116.57 116.10 1h67 h LYS 84 Ca 0.00 -0.15 0.15 0.00 -1.87 0.00 0.00 60.65 58.78 1h67 h LYS 84 Cb 0.47 -0.10 -0.04 0.00 0.08 0.00 0.00 32.23 32.63 1h67 h LYS 84 CO -0.07 0.68 0.47 -0.07 -0.57 0.00 0.00 179.45 179.89 1h67 h LEU 85 N 0.61 0.27 0.00 2.94 3.38 -1.38 0.16 115.31 121.28 1h67 h LEU 85 Ca 0.15 0.01 -0.01 0.00 0.09 0.00 0.00 57.88 58.12 1h67 h LEU 85 Cb 0.26 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 40.98 1h67 h LEU 85 CO -0.01 0.14 -0.04 -0.08 0.09 0.00 0.00 178.44 178.54 1h67 h GLU 86 N 0.29 0.02 -0.69 1.13 4.57 -0.91 -2.72 114.58 116.26 1h67 h GLU 86 Ca 0.33 -0.03 0.01 0.00 -1.18 0.00 0.00 59.36 58.50 1h67 h GLU 86 Cb 0.91 0.01 -0.04 0.00 -0.16 0.00 0.00 28.75 29.47 1h67 h GLU 86 CO -0.08 0.88 0.46 -0.91 -1.18 0.00 0.00 179.01 178.18 1h67 h ASN 87 N -0.82 0.78 -0.57 1.04 2.35 -0.86 -2.19 115.58 115.31 1h67 h ASN 87 Ca -0.01 -0.02 -0.05 0.00 -0.55 0.00 0.00 56.30 55.68 1h67 h ASN 87 Cb 0.90 -0.19 -0.02 0.00 0.05 0.00 0.00 38.32 39.05 1h67 h ASN 87 CO 0.01 0.56 0.17 0.40 -1.65 0.00 0.00 177.43 176.92 1h67 h ILE 88 N 0.93 1.24 -0.40 2.81 2.04 -0.82 -0.97 117.51 122.34 1h67 h ILE 88 Ca 0.26 -0.82 0.01 0.00 1.00 0.00 0.00 64.86 65.31 1h67 h ILE 88 Cb -0.09 0.69 -0.02 0.00 -0.74 0.00 0.00 36.82 36.66 1h67 h ILE 88 CO -0.06 0.31 0.24 1.23 0.00 0.00 0.00 178.15 179.87 1h67 h GLY 89 N 0.81 0.55 1.05 5.37 0.00 -1.13 -1.01 103.07 108.72 1h67 h GLY 89 Ca 0.18 -0.18 -0.11 0.00 0.00 0.00 0.00 47.33 47.22 1h67 h GLY 89 CO -0.00 0.17 -0.17 3.43 0.00 0.00 0.00 176.54 179.96 1h67 h ASN 90 N 0.49 0.93 0.28 0.19 2.35 -1.29 -1.41 115.58 117.12 1h67 h ASN 90 Ca 0.15 -0.38 -0.01 0.00 -0.55 0.00 0.00 56.30 55.51 1h67 h ASN 90 Cb -0.01 -0.25 0.00 0.00 0.05 0.00 0.00 38.32 38.11 1h67 h ASN 90 CO -0.06 1.10 -0.14 0.15 -1.65 0.00 0.00 177.43 176.83 1h67 h PHE 91 N 0.74 -0.36 -0.38 1.19 3.57 -0.91 0.97 116.94 121.75 1h67 h PHE 91 Ca 0.11 -0.01 -0.05 0.00 3.53 0.00 0.00 57.97 61.55 1h67 h PHE 91 Cb 0.73 0.12 -0.01 0.00 2.79 0.00 0.00 35.95 39.57 1h67 h PHE 91 CO 0.05 -0.23 0.03 -0.07 -2.23 0.00 0.00 178.31 175.87 1h67 h LEU 92 N -0.39 0.63 -1.15 0.59 3.38 -1.22 -0.37 115.31 116.78 1h67 h LEU 92 Ca -0.04 -0.28 -0.01 0.00 0.09 0.00 0.00 57.88 57.64 1h67 h LEU 92 Cb 0.30 -0.17 -0.04 0.00 0.09 0.00 0.00 40.66 40.84 1h67 h LEU 92 CO 0.06 0.76 0.45 -0.09 0.09 0.00 0.00 178.44 179.71 1h67 h ARG 93 N 0.49 1.03 -0.19 1.13 9.65 -1.19 0.13 114.38 125.42 1h67 h ARG 93 Ca 0.11 -0.09 -0.12 0.00 -1.10 0.00 0.00 59.98 58.78 1h67 h ARG 93 Cb 0.42 -0.22 -0.00 0.00 -1.39 0.00 0.00 29.97 28.78 1h67 h ARG 93 CO 0.01 0.72 -0.33 0.00 2.80 0.00 0.00 179.97 183.17 1h67 h ALA 94 N 1.45 0.30 -0.23 2.80 0.00 -0.56 -3.00 119.26 120.02 1h67 h ALA 94 Ca 0.27 -0.42 -0.16 0.00 0.00 0.00 0.00 54.91 54.60 1h67 h ALA 94 Cb -0.03 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 1h67 h ALA 94 CO -0.05 0.35 -0.50 -0.84 0.00 0.00 0.00 179.25 178.21 1h67 h ILE 95 N 0.24 1.31 -0.85 0.00 3.07 -0.77 0.40 117.51 120.91 1h67 h ILE 95 Ca 0.01 -1.72 0.04 0.00 1.55 0.00 0.00 64.86 64.74 1h67 h ILE 95 Cb 0.92 1.67 -0.05 0.00 -0.27 0.00 0.00 36.82 39.09 1h67 h ILE 95 CO 0.08 0.54 0.54 0.11 -1.05 0.00 0.00 178.15 178.37 1h67 h LYS 96 N 0.50 1.02 0.11 0.16 1.57 -0.80 -2.19 116.57 116.94 1h67 h LYS 96 Ca 0.02 -0.06 -0.30 0.00 -1.87 0.00 0.00 60.65 58.44 1h67 h LYS 96 Cb 1.05 -0.23 -0.01 0.00 0.08 0.00 0.00 32.23 33.12 1h67 h LYS 96 CO 0.10 0.67 -1.50 1.25 -0.57 0.00 0.00 179.45 179.40 1h67 h HIS 97 N 1.05 0.43 -0.81 -1.35 2.76 -1.46 -3.34 115.15 112.43 1h67 h HIS 97 Ca 0.34 -0.31 0.16 0.00 -2.20 0.00 0.00 60.37 58.36 1h67 h HIS 97 Cb 0.03 -0.02 -0.10 0.00 1.55 0.00 0.00 27.41 28.87 1h67 h HIS 97 CO -0.02 1.36 0.35 -0.92 -1.30 0.00 0.00 177.93 177.40 1h67 h TYR 98 N 0.06 0.61 0.00 5.26 3.20 0.17 -3.45 116.97 122.82 1h67 h TYR 98 Ca -0.23 0.04 0.00 0.00 3.14 0.00 0.00 58.73 61.68 1h67 h TYR 98 Cb 2.01 -0.14 0.00 0.00 1.54 0.00 0.00 36.73 40.13 1h67 h TYR 98 CO 0.06 0.07 0.00 0.41 -1.64 0.00 0.00 178.16 177.06 1h67 n GLY 99 N -1.33 0.36 3.71 1.82 0.00 -0.86 -5.07 105.19 103.82 1h67 n GLY 99 Ca 0.17 -0.02 -0.42 0.00 0.00 0.00 0.00 46.02 45.74 1h67 n GLY 99 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1h67 s VAL 100 N 0.00 2.42 0.22 1.61 1.01 -0.96 -4.95 120.40 119.75 1h67 s VAL 100 Ca 0.00 0.19 -0.30 0.00 0.00 0.00 0.00 61.98 61.87 1h67 s VAL 100 Cb 0.00 -3.12 -0.09 0.00 0.00 0.00 0.00 36.38 33.17 1h67 s VAL 100 CO 0.00 0.01 1.18 -0.54 0.00 0.00 0.00 175.10 175.75 1h67 s LYS 101 N 1.69 4.52 0.41 2.72 -0.14 -1.26 -3.75 119.74 123.94 1h67 s LYS 101 Ca 0.75 1.88 0.18 0.00 -1.36 0.00 0.00 55.97 57.42 1h67 s LYS 101 Cb -0.46 -3.21 1.09 0.00 -1.68 0.00 0.00 37.83 33.57 1h67 s LYS 101 CO 0.33 -0.02 1.83 -1.00 -0.76 0.00 0.00 175.35 175.74 1h67 h PRO 102 N 4.71 0.39 -0.61 -1.68 0.13 -1.90 0.24 132.00 133.28 1h67 h PRO 102 Ca -0.45 -0.02 0.13 0.00 -0.87 0.00 0.00 66.00 64.78 1h67 h PRO 102 Cb 1.21 -0.09 -0.03 0.00 0.13 0.00 0.00 31.00 32.22 1h67 h PRO 102 CO 0.72 0.26 0.42 1.25 -0.23 0.00 0.00 178.00 180.41 1h67 h HIS 103 N 0.40 0.28 -0.86 1.56 2.76 -2.00 0.28 115.15 117.57 1h67 h HIS 103 Ca 0.50 0.01 -0.56 0.00 -2.20 0.00 0.00 60.37 58.12 1h67 h HIS 103 Cb 1.26 -0.09 -0.30 0.00 1.55 0.00 0.00 27.41 29.83 1h67 h HIS 103 CO -0.00 0.12 0.35 -0.25 -1.30 0.00 0.00 177.93 176.84 1h67 n ASP 104 N -4.44 5.82 -3.77 3.26 9.92 0.83 -4.92 116.55 123.26 1h67 n ASP 104 Ca 0.11 -3.76 -0.13 0.00 -0.53 0.00 0.00 54.79 50.48 1h67 n ASP 104 Cb 0.50 -0.77 -0.14 0.00 -0.64 0.00 0.00 41.12 40.07 1h67 n ASP 104 CO 0.00 0.00 0.00 -0.63 0.13 0.00 0.00 177.20 176.70 1h67 s ILE 105 N -4.35 -0.04 0.35 0.53 1.01 0.98 -3.97 121.20 115.71 1h67 s ILE 105 Ca 0.58 0.13 -0.26 0.00 0.00 0.00 0.00 60.65 61.10 1h67 s ILE 105 Cb 0.47 -0.24 -0.09 0.00 0.01 0.00 0.00 42.46 42.61 1h67 s ILE 105 CO 0.02 0.06 1.09 0.72 0.00 0.00 0.00 174.94 176.82 1h67 s PHE 106 N 0.91 3.35 0.45 3.97 -0.12 -1.26 -4.89 117.98 120.39 1h67 s PHE 106 Ca -0.07 1.65 -0.08 0.00 -0.05 0.00 0.00 56.93 58.38 1h67 s PHE 106 Cb -0.09 -3.23 -0.05 0.00 -0.63 0.00 0.00 43.02 39.02 1h67 s PHE 106 CO -0.05 -0.71 0.79 -1.21 -0.05 0.00 0.00 175.22 174.00 1h67 s GLU 107 N -2.06 3.67 0.39 1.99 8.01 -1.26 -4.92 118.70 124.51 1h67 s GLU 107 Ca 0.53 0.37 0.18 0.00 0.01 0.00 0.00 54.97 56.05 1h67 s GLU 107 Cb -0.27 -2.37 1.10 0.00 -4.31 0.00 0.00 34.13 28.28 1h67 s GLU 107 CO 0.34 -0.14 1.75 0.00 0.01 0.00 0.00 175.26 177.23 1h67 h ALA 108 N 0.73 2.21 -0.11 5.21 0.00 -1.96 0.28 119.26 125.62 1h67 h ALA 108 Ca -0.47 0.08 -0.16 0.00 0.00 0.00 0.00 54.91 54.36 1h67 h ALA 108 Cb 1.19 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 19.02 1h67 h ALA 108 CO 0.63 -0.65 -0.62 -2.95 0.00 0.00 0.00 179.25 175.66 1h67 h ASN 109 N 0.39 0.46 0.09 0.00 7.08 -1.97 -0.93 115.58 120.71 1h67 h ASN 109 Ca 0.62 -0.27 -0.00 0.00 -3.08 0.00 0.00 56.30 53.57 1h67 h ASN 109 Cb 1.56 -0.13 -0.00 0.00 -2.08 0.00 0.00 38.32 37.66 1h67 h ASN 109 CO -0.34 0.97 -0.06 0.44 -2.08 0.00 0.00 177.43 176.36 1h67 h ASP 110 N 0.30 -0.16 -0.02 6.14 5.19 -0.80 0.16 116.42 127.23 1h67 h ASP 110 Ca -0.01 0.01 -0.06 0.00 -0.62 0.00 0.00 57.03 56.35 1h67 h ASP 110 Cb 1.16 0.05 0.00 0.00 0.18 0.00 0.00 39.33 40.72 1h67 h ASP 110 CO 0.11 -0.10 -0.22 0.25 -3.12 0.00 0.00 179.24 176.16 1h67 h LEU 111 N -0.15 0.22 0.71 1.55 5.85 -1.54 0.12 115.31 122.07 1h67 h LEU 111 Ca -0.01 -0.72 -0.03 0.00 0.84 0.00 0.00 57.88 57.96 1h67 h LEU 111 Cb 0.13 -0.07 -0.00 0.00 0.37 0.00 0.00 40.66 41.10 1h67 h LEU 111 CO 0.00 0.91 -0.40 0.15 -0.34 0.00 0.00 178.44 178.76 1h67 h PHE 112 N -0.45 -1.06 -0.05 1.25 3.57 -1.18 -1.98 116.94 117.04 1h67 h PHE 112 Ca -0.02 -0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.46 1h67 h PHE 112 Cb 0.93 0.37 0.00 0.00 2.79 0.00 0.00 35.95 40.04 1h67 h PHE 112 CO 0.16 -0.62 0.00 0.39 -2.23 0.00 0.00 178.31 176.01 1h67 n GLU 113 N -5.55 1.19 -3.58 1.11 -0.58 0.54 -4.85 120.64 108.92 1h67 n GLU 113 Ca -0.14 -0.20 -0.26 0.00 -0.42 0.00 0.00 57.16 56.14 1h67 n GLU 113 Cb 0.43 -1.29 -0.05 0.00 -0.57 0.00 0.00 31.44 29.97 1h67 n GLU 113 CO 0.00 0.00 0.00 0.27 -0.48 0.00 0.00 177.13 176.92 1h67 n ASN 114 N -0.16 -1.37 0.03 1.62 6.94 -0.74 -4.80 115.26 116.78 1h67 n ASN 114 Ca 0.02 -0.63 -0.10 0.00 -0.02 0.00 0.00 54.58 53.85 1h67 n ASN 114 Cb 0.18 -1.24 -0.07 0.00 -2.36 0.00 0.00 39.78 36.29 1h67 n ASN 114 CO 0.00 0.00 0.00 0.71 -1.03 0.00 0.00 177.26 176.94 1h67 h THR 115 N -0.53 0.85 -3.59 5.53 1.35 -0.96 -3.44 112.91 112.12 1h67 h THR 115 Ca -0.36 -1.23 -0.62 0.00 -0.55 0.00 0.00 66.41 63.65 1h67 h THR 115 Cb 1.11 1.47 -0.14 0.00 -1.73 0.00 0.00 68.15 68.85 1h67 h THR 115 CO 0.55 0.23 -0.45 0.20 -0.25 0.00 0.00 175.52 175.80 1h67 s ASN 116 N -5.54 6.17 -0.26 5.36 -0.87 -1.15 -4.97 114.94 113.67 1h67 s ASN 116 Ca -0.12 0.17 -0.12 0.00 -1.57 0.00 0.00 52.86 51.22 1h67 s ASN 116 Cb 0.00 -2.13 -0.11 0.00 -0.02 0.00 0.00 41.25 38.99 1h67 s ASN 116 CO 0.45 0.03 -0.33 1.41 -2.57 0.00 0.00 177.10 176.09 1h67 n HIS 117 N 4.39 0.00 -0.21 2.20 8.25 -1.26 -4.19 115.22 124.40 1h67 n HIS 117 Ca -0.14 0.00 -0.08 0.00 -0.26 0.00 0.00 57.72 57.25 1h67 n HIS 117 Cb 0.52 -0.93 0.03 0.00 1.12 0.00 0.00 29.99 30.73 1h67 n HIS 117 CO 0.00 0.00 0.00 1.15 0.64 0.00 0.00 176.34 178.13 1h67 h THR 118 N -0.87 1.23 -0.92 1.59 2.02 -2.01 -2.72 112.91 111.23 1h67 h THR 118 Ca -0.65 -0.75 0.06 0.00 0.77 0.00 0.00 66.41 65.84 1h67 h THR 118 Cb 1.59 0.60 -0.06 0.00 -1.74 0.00 0.00 68.15 68.53 1h67 h THR 118 CO -0.38 0.29 0.60 -0.61 0.37 0.00 0.00 175.52 175.79 1h67 h GLN 119 N 0.84 1.04 0.04 6.66 5.75 -1.99 -2.16 115.11 125.29 1h67 h GLN 119 Ca 0.20 -0.06 0.02 0.00 -0.15 0.00 0.00 58.65 58.65 1h67 h GLN 119 Cb 0.23 -0.23 -0.02 0.00 1.07 0.00 0.00 27.48 28.52 1h67 h GLN 119 CO -0.01 0.69 -0.13 0.28 -2.65 0.00 0.00 178.83 177.00 1h67 h VAL 120 N 1.07 0.68 -0.64 2.39 2.07 -1.65 -2.75 116.25 117.42 1h67 h VAL 120 Ca 0.39 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.92 1h67 h VAL 120 Cb 0.17 0.68 -0.03 0.00 -1.52 0.00 0.00 31.29 30.59 1h67 h VAL 120 CO -0.15 0.00 0.40 1.56 0.02 0.00 0.00 177.57 179.41 1h67 h GLN 121 N -0.25 0.86 -1.02 1.57 4.20 -1.43 -2.63 115.11 116.42 1h67 h GLN 121 Ca 0.03 -0.07 0.27 0.00 0.06 0.00 0.00 58.65 58.95 1h67 h GLN 121 Cb 0.28 -0.19 -0.12 0.00 0.30 0.00 0.00 27.48 27.75 1h67 h GLN 121 CO -0.10 0.60 0.61 1.03 -0.67 0.00 0.00 178.83 180.30 1h67 h SER 122 N 0.87 0.59 -0.70 1.46 0.87 -1.10 0.11 113.55 115.65 1h67 h SER 122 Ca 0.23 0.14 -0.00 0.00 -1.23 0.00 0.00 61.79 60.93 1h67 h SER 122 Cb -0.06 0.05 -0.03 0.00 -0.44 0.00 0.00 62.40 61.92 1h67 h SER 122 CO -0.05 0.04 0.42 0.74 -0.53 0.00 0.00 176.83 177.46 1h67 h THR 123 N 0.48 1.20 -0.53 2.23 2.02 -1.31 -2.82 112.91 114.18 1h67 h THR 123 Ca 0.66 -0.44 0.03 0.00 0.77 0.00 0.00 66.41 67.43 1h67 h THR 123 Cb 1.42 0.23 -0.04 0.00 -1.74 0.00 0.00 68.15 68.02 1h67 h THR 123 CO -0.47 0.21 0.31 -0.07 0.37 0.00 0.00 175.52 175.87 1h67 h LEU 124 N 0.95 0.49 -0.10 2.58 4.07 -0.85 0.14 115.31 122.59 1h67 h LEU 124 Ca 0.25 0.01 0.00 0.00 0.08 0.00 0.00 57.88 58.23 1h67 h LEU 124 Cb -0.03 -0.09 -0.01 0.00 1.08 0.00 0.00 40.66 41.61 1h67 h LEU 124 CO -0.05 0.34 0.05 0.40 -1.08 0.00 0.00 178.44 178.10 1h67 h ILE 125 N 0.61 1.00 -0.52 1.22 5.03 -1.35 -1.25 117.51 122.25 1h67 h ILE 125 Ca 0.22 -0.04 -0.09 0.00 -0.12 0.00 0.00 64.86 64.84 1h67 h ILE 125 Cb 0.05 0.89 -0.02 0.00 -3.03 0.00 0.00 36.82 34.71 1h67 h ILE 125 CO -0.11 0.02 -0.01 0.00 -0.68 0.00 0.00 178.15 177.37 1h67 h ALA 126 N 1.05 0.71 -0.92 1.87 0.00 -1.29 -3.01 119.26 117.66 1h67 h ALA 126 Ca 0.04 -0.30 0.03 0.00 0.00 0.00 0.00 54.91 54.68 1h67 h ALA 126 Cb 0.00 -0.19 -0.05 0.00 0.00 0.00 0.00 17.79 17.55 1h67 h ALA 126 CO -0.02 0.53 0.60 1.25 0.00 0.00 0.00 179.25 181.61 1h67 h LEU 127 N 0.80 1.00 -0.71 0.00 5.85 -0.51 -2.34 115.31 119.40 1h67 h LEU 127 Ca 0.15 -0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.85 1h67 h LEU 127 Cb 0.54 -0.23 -0.03 0.00 0.37 0.00 0.00 40.66 41.31 1h67 h LEU 127 CO 0.03 0.69 0.42 0.00 -0.34 0.00 0.00 178.44 179.24 1h67 h ALA 128 N 1.37 0.91 -0.81 1.25 0.00 -1.10 -2.38 119.26 118.51 1h67 h ALA 128 Ca 0.36 -0.09 0.04 0.00 0.00 0.00 0.00 54.91 55.23 1h67 h ALA 128 Cb -0.01 -0.29 -0.05 0.00 0.00 0.00 0.00 17.79 17.44 1h67 h ALA 128 CO -0.12 0.39 0.53 0.77 0.00 0.00 0.00 179.25 180.83 1h67 h SER 129 N 0.97 0.83 -0.61 0.00 0.02 -1.30 -2.13 113.55 111.33 1h67 h SER 129 Ca 0.25 -0.01 -0.08 0.00 -0.84 0.00 0.00 61.79 61.12 1h67 h SER 129 Cb -0.02 -0.19 -0.02 0.00 0.14 0.00 0.00 62.40 62.31 1h67 h SER 129 CO -0.05 0.56 0.07 1.56 -1.14 0.00 0.00 176.83 177.84 1h67 h GLN 130 N 0.96 1.03 -1.82 3.45 1.08 -1.19 -0.05 115.11 118.57 1h67 h GLN 130 Ca 0.33 -0.29 0.00 0.00 -1.45 0.00 0.00 58.65 57.24 1h67 h GLN 130 Cb 0.10 -0.11 0.00 0.00 -0.05 0.00 0.00 27.48 27.41 1h67 h GLN 130 CO -0.10 0.98 0.00 0.00 -0.95 0.00 0.00 178.83 178.76 1h67 n ALA 131 N -2.46 3.23 0.00 3.87 0.00 -0.80 -3.18 120.51 121.18 1h67 n ALA 131 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.47 1h67 n ALA 131 Cb 0.30 -1.15 0.00 0.00 0.00 0.00 0.00 19.45 18.60 1h67 n ALA 131 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.50 177.86 1h67 n LYS 132 N 1.37 0.00 -0.14 0.00 2.85 -1.15 -4.95 118.16 116.14 1h67 n LYS 132 Ca 0.00 0.00 -0.07 0.00 -1.05 0.00 0.00 58.31 57.19 1h67 n LYS 132 Cb 0.40 0.00 0.10 0.00 -0.65 0.00 0.00 35.03 34.88 1h67 n LYS 132 CO 0.00 0.00 0.00 1.15 -0.05 0.00 0.00 177.40 178.50 1h67 h THR 133 N 0.00 1.26 0.00 0.58 2.02 -1.02 -3.52 112.91 112.23 1h67 h THR 133 Ca 0.00 -1.11 0.00 0.00 0.77 0.00 0.00 66.41 66.07 1h67 h THR 133 Cb 0.00 0.90 0.00 0.00 -1.74 0.00 0.00 68.15 67.31 1h67 h THR 133 CO 0.00 0.39 0.00 0.29 0.37 0.00 0.00 175.52 176.57