#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1h67 n PRO 28 N 0.00 2.91 -3.56 2.12 -0.04 -1.26 -5.10 135.00 130.06 1h67 n PRO 28 Ca 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.46 1h67 n PRO 28 Cb 0.00 0.00 -0.06 0.00 -0.04 0.00 0.00 33.50 33.40 1h67 n PRO 28 CO 0.00 0.00 0.00 -1.14 -0.04 0.00 0.00 175.50 174.32 1h67 s GLN 29 N 0.00 0.24 -0.12 0.54 2.00 -1.26 -5.07 119.66 115.98 1h67 s GLN 29 Ca 0.00 0.45 0.00 0.00 -2.00 0.00 0.00 55.36 53.81 1h67 s GLN 29 Cb 0.00 0.11 0.00 0.00 0.80 0.00 0.00 33.01 33.93 1h67 s GLN 29 CO 0.00 -0.06 0.71 -2.37 -0.50 0.00 0.00 175.29 173.07 1h67 n THR 30 N 3.81 0.00 0.26 -0.34 5.66 -1.26 -4.99 114.28 117.41 1h67 n THR 30 Ca -0.16 -0.21 -0.16 0.00 -3.05 0.00 0.00 64.05 60.47 1h67 n THR 30 Cb 0.56 0.50 -0.08 0.00 -1.55 0.00 0.00 70.33 69.76 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 0.42 -0.58 0.12 1.09 4.39 -1.99 -1.93 114.58 116.10 1h67 h GLU 31 Ca -0.26 0.04 -0.18 0.00 0.34 0.00 0.00 59.36 59.30 1h67 h GLU 31 Cb 1.10 0.13 0.01 0.00 -0.10 0.00 0.00 28.75 29.89 1h67 h GLU 31 CO -0.10 -0.36 -0.82 -0.09 -1.16 0.00 0.00 179.01 176.47 1h67 h ARG 32 N -0.64 0.25 0.00 2.33 2.43 -2.04 -3.26 114.38 113.45 1h67 h ARG 32 Ca -0.06 -0.43 0.00 0.00 -0.81 0.00 0.00 59.98 58.68 1h67 h ARG 32 Cb 0.48 0.16 0.00 0.00 -0.42 0.00 0.00 29.97 30.19 1h67 h ARG 32 CO 0.10 1.21 0.13 1.04 -1.51 0.00 0.00 179.97 180.93 1h67 n GLN 33 N -4.15 0.06 0.00 0.20 6.02 -1.24 -1.86 117.38 116.40 1h67 n GLN 33 Ca -0.15 0.50 -0.12 0.00 -0.01 0.00 0.00 57.00 57.22 1h67 n GLN 33 Cb 0.79 -1.82 -0.06 0.00 1.02 0.00 0.00 30.24 30.18 1h67 n GLN 33 CO 0.00 0.00 0.00 1.25 -1.01 0.00 0.00 177.06 177.30 1h67 h LEU 34 N 0.00 0.09 -0.20 1.08 5.85 -1.39 0.22 115.31 120.96 1h67 h LEU 34 Ca 0.00 -0.10 -0.02 0.00 0.84 0.00 0.00 57.88 58.60 1h67 h LEU 34 Cb 0.25 -0.02 -0.01 0.00 0.37 0.00 0.00 40.66 41.25 1h67 h LEU 34 CO 0.00 0.16 0.04 0.08 -0.34 0.00 0.00 178.44 178.38 1h67 h ARG 35 N 0.02 0.32 -1.00 1.25 0.11 -1.60 -1.14 114.38 112.34 1h67 h ARG 35 Ca 0.03 -0.08 0.04 0.00 0.10 0.00 0.00 59.98 60.07 1h67 h ARG 35 Cb 0.09 -0.04 -0.06 0.00 1.11 0.00 0.00 29.97 31.07 1h67 h ARG 35 CO -0.00 0.46 0.65 0.28 0.10 0.00 0.00 179.97 181.46 1h67 h VAL 36 N 0.13 1.16 0.30 0.08 2.07 -1.62 0.97 116.25 119.33 1h67 h VAL 36 Ca 0.06 -0.43 -0.01 0.00 0.82 0.00 0.00 66.70 67.14 1h67 h VAL 36 Cb 0.29 -0.20 0.00 0.00 -1.52 0.00 0.00 31.29 29.86 1h67 h VAL 36 CO 0.00 0.23 -0.14 -0.25 0.02 0.00 0.00 177.57 177.43 1h67 h TRP 37 N 1.25 -0.37 -0.06 1.57 7.01 -0.76 -0.57 115.95 124.02 1h67 h TRP 37 Ca 0.41 -0.01 0.02 0.00 2.11 0.00 0.00 58.89 61.42 1h67 h TRP 37 Cb 0.03 0.12 -0.03 0.00 -2.10 0.00 0.00 29.16 27.19 1h67 h TRP 37 CO -0.00 -0.23 -0.09 0.82 -2.79 0.00 0.00 178.44 176.15 1h67 h ILE 38 N -0.53 0.76 -0.17 2.65 2.04 -1.19 0.17 117.51 121.24 1h67 h ILE 38 Ca -0.04 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 65.82 1h67 h ILE 38 Cb 0.31 0.76 -0.01 0.00 -0.74 0.00 0.00 36.82 37.14 1h67 h ILE 38 CO 0.07 0.00 0.10 -0.33 0.00 0.00 0.00 178.15 177.99 1h67 h GLU 39 N -0.12 0.23 -0.29 2.37 5.08 -0.93 -2.70 114.58 118.21 1h67 h GLU 39 Ca 0.06 -0.02 -0.04 0.00 -1.00 0.00 0.00 59.36 58.36 1h67 h GLU 39 Cb 0.20 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.39 1h67 h GLU 39 CO -0.13 0.21 0.02 0.78 -1.00 0.00 0.00 179.01 178.89 1h67 h GLY 40 N 0.19 0.47 0.29 -3.84 0.00 -0.90 0.16 103.07 99.43 1h67 h GLY 40 Ca 0.06 -0.25 -0.01 0.00 0.00 0.00 0.00 47.33 47.14 1h67 h GLY 40 CO -0.01 0.24 -0.35 0.00 0.00 0.00 0.00 176.54 176.41 1h67 h ALA 41 N 1.61 -0.99 0.00 3.60 0.00 -0.32 -3.36 119.26 119.80 1h67 h ALA 41 Ca 0.10 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1h67 h ALA 41 Cb 0.25 0.62 0.00 0.00 0.00 0.00 0.00 17.79 18.66 1h67 h ALA 41 CO 0.00 -1.03 -0.19 1.79 0.00 0.00 0.00 179.25 179.83 1h67 h THR 42 N -0.65 0.00 0.00 0.00 1.35 -1.55 -3.50 112.91 108.56 1h67 h THR 42 Ca -0.04 -0.85 0.00 0.00 -0.55 0.00 0.00 66.41 64.98 1h67 h THR 42 Cb 0.58 0.00 0.00 0.00 -1.73 0.00 0.00 68.15 67.00 1h67 h THR 42 CO -0.08 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.80 1h67 n GLY 43 N 1.74 1.57 3.73 5.82 0.00 0.54 -5.12 105.19 113.47 1h67 n GLY 43 Ca -0.03 -0.12 -0.42 0.00 0.00 0.00 0.00 46.02 45.46 1h67 n GLY 43 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1h67 s ARG 44 N 0.00 4.24 -0.16 1.61 1.81 -1.24 -4.81 118.95 120.39 1h67 s ARG 44 Ca 0.00 2.33 0.04 0.00 -1.72 0.00 0.00 55.73 56.38 1h67 s ARG 44 Cb 0.00 -3.14 0.34 0.00 -0.45 0.00 0.00 34.95 31.70 1h67 s ARG 44 CO 0.00 -0.52 1.27 0.54 -0.68 0.00 0.00 175.30 175.91 1h67 n ARG 45 N 3.23 2.12 0.00 3.54 5.12 -1.26 -4.18 116.66 125.23 1h67 n ARG 45 Ca 0.11 -1.41 0.00 0.00 -1.93 0.00 0.00 57.85 54.61 1h67 n ARG 45 Cb 0.39 -1.68 0.00 0.00 -1.16 0.00 0.00 32.46 30.01 1h67 n ARG 45 CO 0.00 0.00 0.00 -0.89 -1.93 0.00 0.00 177.63 174.81 1h67 n ILE 46 N -0.01 0.00 -2.45 0.55 5.41 -1.26 -4.82 119.36 116.78 1h67 n ILE 46 Ca 0.21 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.96 1h67 n ILE 46 Cb 0.88 0.00 0.00 0.00 -0.71 0.00 0.00 39.64 39.81 1h67 n ILE 46 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1h67 n GLY 47 N 0.00 0.55 3.77 7.39 0.00 -1.26 -4.72 105.19 110.92 1h67 n GLY 47 Ca 0.00 -1.11 -0.39 0.00 0.00 0.00 0.00 46.02 44.52 1h67 n GLY 47 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1h67 s ASP 48 N -4.00 6.19 1.26 1.61 1.01 -1.26 -4.75 116.67 116.72 1h67 s ASP 48 Ca 0.00 2.61 0.00 0.00 0.71 0.00 0.00 52.55 55.87 1h67 s ASP 48 Cb 0.00 -2.63 0.00 0.00 1.01 0.00 0.00 42.92 41.30 1h67 s ASP 48 CO 0.00 -0.93 0.00 0.59 0.21 0.00 0.00 175.17 175.04 1h67 n ASN 49 N -0.07 0.00 0.00 0.27 4.13 -1.26 -4.13 115.26 114.19 1h67 n ASN 49 Ca 0.05 0.00 0.00 0.00 1.68 0.00 0.00 54.58 56.31 1h67 n ASN 49 Cb 0.44 0.00 0.00 0.00 -1.54 0.00 0.00 39.78 38.68 1h67 n ASN 49 CO 0.00 0.00 0.00 0.33 0.28 0.00 0.00 177.26 177.87 1h67 n PHE 50 N 13.84 -2.06 0.04 3.10 7.35 -1.26 -4.93 117.46 133.55 1h67 n PHE 50 Ca 0.00 0.00 -0.22 0.00 -0.76 0.00 0.00 57.45 56.47 1h67 n PHE 50 Cb 0.00 0.41 -0.14 0.00 0.35 0.00 0.00 39.48 40.10 1h67 n PHE 50 CO 0.00 0.00 0.00 0.52 -0.76 0.00 0.00 176.76 176.52 1h67 h MET 51 N 0.00 0.31 -0.98 -4.13 0.00 -1.98 -3.33 114.93 104.82 1h67 h MET 51 Ca 0.00 -0.54 0.09 0.00 0.00 0.00 0.00 59.70 59.25 1h67 h MET 51 Cb 0.00 0.20 -0.07 0.00 0.00 0.00 0.00 31.60 31.73 1h67 h MET 51 CO 0.00 1.26 0.62 -0.44 0.00 0.00 0.00 176.91 178.34 1h67 h ASP 52 N -0.23 0.95 -0.84 1.22 3.32 -1.93 -1.50 116.42 117.41 1h67 h ASP 52 Ca -0.26 0.03 0.00 0.00 0.02 0.00 0.00 57.03 56.82 1h67 h ASP 52 Cb 1.81 -0.17 -0.04 0.00 0.22 0.00 0.00 39.33 41.15 1h67 h ASP 52 CO 0.13 0.56 0.53 1.23 -1.72 0.00 0.00 179.24 179.97 1h67 h GLY 53 N 1.06 1.21 1.88 2.75 0.00 -1.72 -1.86 103.07 106.38 1h67 h GLY 53 Ca 0.45 -0.48 -0.03 0.00 0.00 0.00 0.00 47.33 47.27 1h67 h GLY 53 CO -0.22 0.47 -0.06 1.41 0.00 0.00 0.00 176.54 178.14 1h67 h LEU 54 N 1.16 0.15 -0.70 3.11 3.38 -1.38 -3.06 115.31 117.96 1h67 h LEU 54 Ca 0.31 -0.02 0.15 0.00 0.09 0.00 0.00 57.88 58.41 1h67 h LEU 54 Cb -0.09 -0.04 -0.12 0.00 0.09 0.00 0.00 40.66 40.50 1h67 h LEU 54 CO -0.06 0.23 -0.04 0.11 0.09 0.00 0.00 178.44 178.78 1h67 h LYS 55 N 0.16 0.08 -0.68 1.13 1.57 -1.12 0.11 116.57 117.81 1h67 h LYS 55 Ca 0.04 -0.00 0.01 0.00 -1.87 0.00 0.00 60.65 58.82 1h67 h LYS 55 Cb 0.21 -0.02 -0.03 0.00 0.08 0.00 0.00 32.23 32.47 1h67 h LYS 55 CO 0.01 0.05 0.45 -0.44 -0.57 0.00 0.00 179.45 178.96 1h67 h ASP 56 N 0.08 0.78 -4.19 0.86 5.19 -1.67 -3.44 116.42 114.03 1h67 h ASP 56 Ca 0.37 -0.02 0.00 0.00 -0.62 0.00 0.00 57.03 56.76 1h67 h ASP 56 Cb 0.62 -0.19 -0.04 0.00 0.18 0.00 0.00 39.33 39.90 1h67 h ASP 56 CO -0.63 0.56 -0.74 0.61 -3.12 0.00 0.00 179.24 175.92 1h67 n GLY 57 N -1.43 -3.98 2.08 2.75 0.00 0.37 -4.16 105.19 100.81 1h67 n GLY 57 Ca 0.07 0.50 0.00 0.00 0.00 0.00 0.00 46.02 46.59 1h67 n GLY 57 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1h67 n VAL 58 N 0.67 0.00 -0.10 1.61 0.31 -1.26 -4.68 118.33 114.88 1h67 n VAL 58 Ca -0.11 0.00 -0.12 0.00 -0.01 0.00 0.00 64.34 64.10 1h67 n VAL 58 Cb 0.18 -0.12 -0.04 0.00 -0.91 0.00 0.00 33.84 32.95 1h67 n VAL 58 CO 0.00 0.00 0.00 0.40 -1.32 0.00 0.00 176.83 175.91 1h67 h ILE 59 N 0.00 1.28 -0.48 2.52 2.04 -1.95 -1.88 117.51 119.04 1h67 h ILE 59 Ca 0.00 -1.13 0.01 0.00 1.00 0.00 0.00 64.86 64.74 1h67 h ILE 59 Cb 0.00 1.41 -0.03 0.00 -0.74 0.00 0.00 36.82 37.46 1h67 h ILE 59 CO 0.00 0.36 0.31 -0.07 0.00 0.00 0.00 178.15 178.75 1h67 h LEU 60 N 0.34 0.53 -0.77 1.44 3.38 -1.94 0.41 115.31 118.69 1h67 h LEU 60 Ca 0.07 -0.01 0.09 0.00 0.09 0.00 0.00 57.88 58.13 1h67 h LEU 60 Cb 0.58 -0.13 -0.07 0.00 0.09 0.00 0.00 40.66 41.13 1h67 h LEU 60 CO 0.03 0.38 0.42 0.00 0.09 0.00 0.00 178.44 179.36 1h67 h GLU 62 N 0.71 0.64 0.10 0.00 5.08 -0.38 -2.53 114.58 118.20 1h67 h GLU 62 Ca 0.38 -0.20 -0.00 0.00 -1.00 0.00 0.00 59.36 58.53 1h67 h GLU 62 Cb 0.37 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 29.56 1h67 h GLU 62 CO -0.26 0.74 -0.05 1.25 -1.00 0.00 0.00 179.01 179.70 1h67 h LEU 63 N 0.58 -0.11 -1.08 1.33 7.12 0.21 -3.18 115.31 120.17 1h67 h LEU 63 Ca 0.10 -0.27 -0.01 0.00 0.13 0.00 0.00 57.88 57.84 1h67 h LEU 63 Cb 0.55 0.03 -0.04 0.00 -0.53 0.00 0.00 40.66 40.67 1h67 h LEU 63 CO 0.03 0.22 0.50 -0.29 -0.13 0.00 0.00 178.44 178.77 1h67 h ILE 64 N -0.46 1.23 -0.49 4.05 6.09 -0.86 -1.48 117.51 125.60 1h67 h ILE 64 Ca -0.01 -0.51 0.14 0.00 -1.37 0.00 0.00 64.86 63.11 1h67 h ILE 64 Cb 0.38 0.06 -0.02 0.00 0.47 0.00 0.00 36.82 37.71 1h67 h ILE 64 CO 0.02 0.24 0.38 0.78 -3.07 0.00 0.00 178.15 176.51 1h67 h ASN 65 N 1.14 0.00 0.08 2.19 2.35 -1.44 0.77 115.58 120.68 1h67 h ASN 65 Ca 0.30 0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 56.04 1h67 h ASN 65 Cb -0.04 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.33 1h67 h ASN 65 CO -0.06 0.00 -0.04 0.11 -1.65 0.00 0.00 177.43 175.79 1h67 h LYS 66 N 0.00 -0.11 0.33 0.81 1.79 -1.26 -3.37 116.57 114.76 1h67 h LYS 66 Ca 0.23 0.01 -0.02 0.00 -2.18 0.00 0.00 60.65 58.69 1h67 h LYS 66 Cb 0.99 0.02 0.00 0.00 -1.58 0.00 0.00 32.23 31.67 1h67 h LYS 66 CO -0.00 0.37 -0.16 -0.07 -1.08 0.00 0.00 179.45 178.51 1h67 h LEU 67 N -0.64 -0.38 -9.46 2.94 3.38 -1.19 -3.44 115.31 106.51 1h67 h LEU 67 Ca -0.01 -0.08 -0.61 0.00 0.09 0.00 0.00 57.88 57.27 1h67 h LEU 67 Cb 0.52 0.10 -0.08 0.00 0.09 0.00 0.00 40.66 41.29 1h67 h LEU 67 CO 0.02 0.09 -0.33 -1.58 0.09 0.00 0.00 178.44 176.73 1h67 s GLN 68 N -3.31 4.01 0.14 1.13 0.74 0.26 -5.07 119.66 117.56 1h67 s GLN 68 Ca -0.09 0.13 -0.30 0.00 0.05 0.00 0.00 55.36 55.14 1h67 s GLN 68 Cb 0.01 -3.33 -0.07 0.00 1.10 0.00 0.00 33.01 30.72 1h67 s GLN 68 CO 0.29 0.46 1.21 -1.25 -0.55 0.00 0.00 175.29 175.45 1h67 s PRO 69 N -0.22 4.47 -1.39 1.67 0.04 -1.26 -3.63 135.00 134.68 1h67 s PRO 69 Ca 0.18 1.85 -0.06 0.00 0.04 0.00 0.00 61.00 63.02 1h67 s PRO 69 Cb -0.14 -3.27 0.03 0.00 0.04 0.00 0.00 34.50 31.16 1h67 s PRO 69 CO 0.06 -0.15 0.84 0.41 0.04 0.00 0.00 177.00 178.19 1h67 n GLY 70 N 2.57 -0.38 0.12 0.56 0.00 -1.26 -4.90 105.19 101.89 1h67 n GLY 70 Ca 0.06 0.16 -0.13 0.00 0.00 0.00 0.00 46.02 46.11 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 -2.00 0.31 -3.67 1.61 0.02 -1.86 -3.45 113.55 104.51 1h67 h SER 71 Ca -0.60 -0.42 -0.24 0.00 -0.84 0.00 0.00 61.79 59.69 1h67 h SER 71 Cb 1.37 -0.08 -0.30 0.00 0.14 0.00 0.00 62.40 63.53 1h67 h SER 71 CO 0.60 0.66 -0.70 -0.69 -1.14 0.00 0.00 176.83 175.56 1h67 s VAL 72 N -4.55 -0.02 0.00 2.27 1.01 -1.26 -4.73 120.40 113.13 1h67 s VAL 72 Ca -0.14 0.06 0.00 0.00 0.00 0.00 0.00 61.98 61.90 1h67 s VAL 72 Cb 0.05 -0.06 0.00 0.00 0.00 0.00 0.00 36.38 36.37 1h67 s VAL 72 CO 0.73 0.03 0.00 1.67 0.00 0.00 0.00 175.10 177.53 1h67 n GLN 73 N 3.40 1.29 -2.29 2.72 7.27 -1.26 -4.88 117.38 123.64 1h67 n GLN 73 Ca -0.17 0.00 -0.42 0.00 0.07 0.00 0.00 57.00 56.48 1h67 n GLN 73 Cb 0.57 0.00 -0.03 0.00 2.41 0.00 0.00 30.24 33.19 1h67 n GLN 73 CO 0.00 0.00 0.00 0.15 0.07 0.00 0.00 177.06 177.28 1h67 s LYS 74 N 0.00 4.37 -0.06 3.69 1.02 -1.26 -4.98 119.74 122.52 1h67 s LYS 74 Ca 0.00 1.93 -0.30 0.00 0.02 0.00 0.00 55.97 57.62 1h67 s LYS 74 Cb 0.00 -3.31 -0.03 0.00 -0.52 0.00 0.00 37.83 33.97 1h67 s LYS 74 CO 0.00 -0.37 1.14 0.08 -0.92 0.00 0.00 175.35 175.28 1h67 s VAL 75 N 1.16 4.41 0.03 3.17 1.01 -1.26 -5.02 120.40 123.90 1h67 s VAL 75 Ca 0.62 1.72 -0.25 0.00 0.00 0.00 0.00 61.98 64.07 1h67 s VAL 75 Cb -0.33 -4.10 -0.05 0.00 0.00 0.00 0.00 36.38 31.89 1h67 s VAL 75 CO 0.29 0.01 0.76 0.20 0.00 0.00 0.00 175.10 176.36 1h67 s ASN 76 N 1.33 7.18 0.29 3.32 0.01 -1.26 -5.02 114.94 120.79 1h67 s ASN 76 Ca 0.54 1.42 -0.30 0.00 -0.71 0.00 0.00 52.86 53.81 1h67 s ASN 76 Cb -0.23 -2.46 -0.11 0.00 0.41 0.00 0.00 41.25 38.86 1h67 s ASN 76 CO 0.22 0.00 1.49 -1.81 -1.51 0.00 0.00 177.10 175.48 1h67 s ASP 77 N 0.04 6.52 0.00 -1.22 1.01 -1.26 -4.74 116.67 117.02 1h67 s ASP 77 Ca 0.38 2.83 0.00 0.00 0.71 0.00 0.00 52.55 56.48 1h67 s ASP 77 Cb -0.20 -2.64 0.00 0.00 1.01 0.00 0.00 42.92 41.09 1h67 s ASP 77 CO 0.22 -0.79 1.18 -0.81 0.21 0.00 0.00 175.17 175.19 1h67 n PRO 78 N 1.83 0.65 0.04 8.23 -0.04 -1.26 -4.18 135.00 140.27 1h67 n PRO 78 Ca 0.06 0.00 -0.09 0.00 -0.04 0.00 0.00 63.50 63.43 1h67 n PRO 78 Cb 0.39 -1.17 -0.06 0.00 -0.04 0.00 0.00 33.50 32.62 1h67 n PRO 78 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 1h67 h VAL 79 N 1.16 0.66 0.00 0.52 2.07 -1.98 -3.47 116.25 115.22 1h67 h VAL 79 Ca 0.00 -1.19 0.00 0.00 0.82 0.00 0.00 66.70 66.33 1h67 h VAL 79 Cb 0.65 1.17 0.00 0.00 -1.52 0.00 0.00 31.29 31.59 1h67 h VAL 79 CO 0.00 0.19 0.00 0.00 0.02 0.00 0.00 177.57 177.78 1h67 n GLN 80 N -4.88 3.54 -0.01 1.57 1.13 -1.26 -5.07 117.38 112.40 1h67 n GLN 80 Ca -0.06 0.00 -0.02 0.00 -1.94 0.00 0.00 57.00 54.97 1h67 n GLN 80 Cb 0.23 0.00 -0.01 0.00 0.11 0.00 0.00 30.24 30.57 1h67 n GLN 80 CO 0.00 0.00 0.00 0.09 -1.44 0.00 0.00 177.06 175.71 1h67 n ASN 81 N 0.00 0.30 0.26 1.08 5.03 -1.26 -4.71 115.26 115.95 1h67 n ASN 81 Ca 0.00 0.03 0.14 0.00 0.87 0.00 0.00 54.58 55.62 1h67 n ASN 81 Cb 0.00 -0.06 0.67 0.00 -1.02 0.00 0.00 39.78 39.37 1h67 n ASN 81 CO 0.00 0.00 0.00 4.11 -1.83 0.00 0.00 177.26 179.54 1h67 h TRP 82 N -0.07 0.00 -0.51 3.10 5.08 -1.98 -3.03 115.95 118.53 1h67 h TRP 82 Ca -0.05 0.00 0.07 0.00 1.08 0.00 0.00 58.89 59.99 1h67 h TRP 82 Cb 1.05 0.00 -0.06 0.00 -3.00 0.00 0.00 29.16 27.15 1h67 h TRP 82 CO -0.01 0.11 0.17 0.45 -1.28 0.00 0.00 178.44 177.88 1h67 h HIS 83 N 0.00 0.29 -0.23 0.12 3.86 -1.86 -0.54 115.15 116.78 1h67 h HIS 83 Ca -0.00 0.03 -0.01 0.00 -1.16 0.00 0.00 60.37 59.22 1h67 h HIS 83 Cb 0.49 -0.05 -0.01 0.00 1.06 0.00 0.00 27.41 28.90 1h67 h HIS 83 CO 0.00 0.08 0.09 0.87 0.86 0.00 0.00 177.93 179.83 1h67 h LYS 84 N 0.33 0.35 -0.28 2.45 1.57 -1.69 -2.61 116.57 116.69 1h67 h LYS 84 Ca 0.25 -0.06 0.06 0.00 -1.87 0.00 0.00 60.65 59.02 1h67 h LYS 84 Cb 0.29 -0.06 -0.01 0.00 0.08 0.00 0.00 32.23 32.53 1h67 h LYS 84 CO -0.27 0.39 0.20 -0.07 -0.57 0.00 0.00 179.45 179.13 1h67 h LEU 85 N 0.23 0.11 0.14 2.94 3.38 -1.47 -1.38 115.31 119.25 1h67 h LEU 85 Ca 0.08 -0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.04 1h67 h LEU 85 Cb 0.17 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 40.90 1h67 h LEU 85 CO -0.01 0.07 -0.07 -0.08 0.09 0.00 0.00 178.44 178.45 1h67 h GLU 86 N 0.12 -0.18 -0.78 1.13 4.22 -0.73 0.17 114.58 118.52 1h67 h GLU 86 Ca 0.13 0.01 -0.03 0.00 0.08 0.00 0.00 59.36 59.55 1h67 h GLU 86 Cb 0.35 0.04 -0.04 0.00 0.50 0.00 0.00 28.75 29.61 1h67 h GLU 86 CO -0.02 0.08 0.36 -0.91 -2.18 0.00 0.00 179.01 176.35 1h67 h ASN 87 N -0.44 1.03 -0.45 1.04 2.35 -1.30 -2.54 115.58 115.27 1h67 h ASN 87 Ca -0.02 -0.13 -0.07 0.00 -0.55 0.00 0.00 56.30 55.53 1h67 h ASN 87 Cb 0.35 -0.27 -0.02 0.00 0.05 0.00 0.00 38.32 38.44 1h67 h ASN 87 CO 0.03 0.88 -0.01 0.40 -1.65 0.00 0.00 177.43 177.09 1h67 h ILE 88 N 1.12 1.26 0.04 2.81 2.04 -1.18 -2.22 117.51 121.38 1h67 h ILE 88 Ca 0.27 -1.06 0.00 0.00 1.00 0.00 0.00 64.86 65.07 1h67 h ILE 88 Cb 0.14 1.05 -0.00 0.00 -0.74 0.00 0.00 36.82 37.26 1h67 h ILE 88 CO -0.03 0.37 -0.04 1.23 0.00 0.00 0.00 178.15 179.67 1h67 h GLY 89 N 0.65 -0.08 1.01 5.37 0.00 -0.69 -1.02 103.07 108.31 1h67 h GLY 89 Ca 0.13 0.05 -0.01 0.00 0.00 0.00 0.00 47.33 47.49 1h67 h GLY 89 CO 0.02 -0.05 0.43 3.43 0.00 0.00 0.00 176.54 180.38 1h67 h ASN 90 N -0.10 0.98 -0.20 0.19 2.35 -1.47 -0.63 115.58 116.70 1h67 h ASN 90 Ca 0.00 -0.10 -0.00 0.00 -0.55 0.00 0.00 56.30 55.66 1h67 h ASN 90 Cb 0.10 -0.25 -0.01 0.00 0.05 0.00 0.00 38.32 38.21 1h67 h ASN 90 CO -0.01 0.79 0.12 0.15 -1.65 0.00 0.00 177.43 176.83 1h67 h PHE 91 N 1.08 0.26 -0.08 1.19 3.57 -1.16 -0.36 116.94 121.44 1h67 h PHE 91 Ca 0.28 -0.00 -0.02 0.00 3.53 0.00 0.00 57.97 61.76 1h67 h PHE 91 Cb 0.03 -0.09 -0.00 0.00 2.79 0.00 0.00 35.95 38.68 1h67 h PHE 91 CO 0.00 0.20 -0.02 -0.07 -2.23 0.00 0.00 178.31 176.19 1h67 h LEU 92 N 0.24 0.16 -1.34 0.59 3.38 -1.00 -0.99 115.31 116.35 1h67 h LEU 92 Ca 0.07 -0.38 0.04 0.00 0.09 0.00 0.00 57.88 57.71 1h67 h LEU 92 Cb 0.02 -0.04 -0.04 0.00 0.09 0.00 0.00 40.66 40.68 1h67 h LEU 92 CO -0.01 0.50 0.47 0.03 0.09 0.00 0.00 178.44 179.52 1h67 h ARG 93 N -0.18 0.82 -0.22 1.13 2.47 -1.09 0.19 114.38 117.49 1h67 h ARG 93 Ca 0.02 -0.05 -0.08 0.00 -1.26 0.00 0.00 59.98 58.61 1h67 h ARG 93 Cb 0.43 -0.18 -0.00 0.00 -1.65 0.00 0.00 29.97 28.56 1h67 h ARG 93 CO 0.01 0.54 -0.17 0.00 0.56 0.00 0.00 179.97 180.91 1h67 h ALA 94 N 1.59 0.32 -0.16 0.04 0.00 -0.93 -2.95 119.26 117.16 1h67 h ALA 94 Ca 0.29 -0.34 -0.17 0.00 0.00 0.00 0.00 54.91 54.70 1h67 h ALA 94 Cb 0.11 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 1h67 h ALA 94 CO -0.09 0.23 -0.59 -0.84 0.00 0.00 0.00 179.25 177.96 1h67 h ILE 95 N 0.21 1.33 -0.81 0.00 3.07 -0.60 0.28 117.51 120.99 1h67 h ILE 95 Ca 0.04 -1.86 0.03 0.00 1.55 0.00 0.00 64.86 64.61 1h67 h ILE 95 Cb 0.70 1.84 -0.05 0.00 -0.27 0.00 0.00 36.82 39.04 1h67 h ILE 95 CO 0.04 0.58 0.52 0.11 -1.05 0.00 0.00 178.15 178.35 1h67 h LYS 96 N 0.40 1.00 0.09 0.16 1.57 -0.67 -2.24 116.57 116.89 1h67 h LYS 96 Ca -0.00 -0.06 -0.30 0.00 -1.87 0.00 0.00 60.65 58.42 1h67 h LYS 96 Cb 1.14 -0.23 -0.01 0.00 0.08 0.00 0.00 32.23 33.21 1h67 h LYS 96 CO 0.11 0.66 -1.54 1.25 -0.57 0.00 0.00 179.45 179.36 1h67 h HIS 97 N 1.03 0.36 -0.77 -1.35 2.76 -1.49 -3.35 115.15 112.34 1h67 h HIS 97 Ca 0.32 -0.27 0.14 0.00 -2.20 0.00 0.00 60.37 58.37 1h67 h HIS 97 Cb -0.02 -0.01 -0.10 0.00 1.55 0.00 0.00 27.41 28.83 1h67 h HIS 97 CO -0.02 1.33 0.33 -0.92 -1.30 0.00 0.00 177.93 177.35 1h67 h TYR 98 N 0.05 0.56 0.00 5.26 3.20 -0.16 -3.45 116.97 122.44 1h67 h TYR 98 Ca -0.24 0.04 0.00 0.00 3.14 0.00 0.00 58.73 61.66 1h67 h TYR 98 Cb 2.00 -0.13 0.00 0.00 1.54 0.00 0.00 36.73 40.14 1h67 h TYR 98 CO 0.05 0.08 0.00 0.41 -1.64 0.00 0.00 178.16 177.06 1h67 n GLY 99 N -1.33 0.35 3.69 1.82 0.00 -0.89 -5.07 105.19 103.77 1h67 n GLY 99 Ca 0.15 -0.03 -0.44 0.00 0.00 0.00 0.00 46.02 45.71 1h67 n GLY 99 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1h67 n VAL 100 N 0.00 0.15 -2.08 1.61 0.31 -0.90 -4.93 118.33 112.50 1h67 n VAL 100 Ca 0.00 -0.03 -0.41 0.00 -0.01 0.00 0.00 64.34 63.89 1h67 n VAL 100 Cb 0.00 -1.91 -0.02 0.00 -0.91 0.00 0.00 33.84 31.00 1h67 n VAL 100 CO 0.00 0.00 0.00 -0.54 -1.32 0.00 0.00 176.83 174.97 1h67 s LYS 101 N 1.77 4.32 0.26 5.55 1.02 -1.26 -4.01 119.74 127.39 1h67 s LYS 101 Ca 0.79 2.25 -0.02 0.00 0.02 0.00 0.00 55.97 59.01 1h67 s LYS 101 Cb -0.55 -3.08 0.48 0.00 -0.52 0.00 0.00 37.83 34.15 1h67 s LYS 101 CO 0.36 -0.27 1.79 -1.35 -0.92 0.00 0.00 175.35 174.97 1h67 h PRO 102 N 3.83 0.73 -0.07 -1.68 0.11 -1.92 0.13 132.00 133.13 1h67 h PRO 102 Ca -0.48 -0.04 0.02 0.00 0.11 0.00 0.00 66.00 65.61 1h67 h PRO 102 Cb 1.22 -0.16 -0.00 0.00 0.11 0.00 0.00 31.00 32.17 1h67 h PRO 102 CO 0.69 0.48 0.11 0.45 -0.21 0.00 0.00 178.00 179.52 1h67 h HIS 103 N 0.75 0.00 -0.77 0.65 3.86 -2.00 0.94 115.15 118.58 1h67 h HIS 103 Ca 0.44 0.00 -0.50 0.00 -1.16 0.00 0.00 60.37 59.15 1h67 h HIS 103 Cb 0.51 0.00 -0.29 0.00 1.06 0.00 0.00 27.41 28.69 1h67 h HIS 103 CO -0.06 0.00 0.12 -0.25 0.86 0.00 0.00 177.93 178.59 1h67 n ASP 104 N -3.58 5.19 -3.73 2.45 8.00 0.45 -4.93 116.55 120.39 1h67 n ASP 104 Ca -0.01 -3.76 -0.13 0.00 0.71 0.00 0.00 54.79 51.59 1h67 n ASP 104 Cb 0.20 -0.69 -0.14 0.00 -0.02 0.00 0.00 41.12 40.47 1h67 n ASP 104 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1h67 s ILE 105 N -4.22 -0.08 0.34 0.53 1.01 0.32 -4.57 121.20 114.54 1h67 s ILE 105 Ca 0.55 0.19 -0.26 0.00 0.00 0.00 0.00 60.65 61.13 1h67 s ILE 105 Cb 0.45 -0.30 -0.10 0.00 0.01 0.00 0.00 42.46 42.52 1h67 s ILE 105 CO 0.02 0.08 0.98 0.72 0.00 0.00 0.00 174.94 176.73 1h67 s PHE 106 N 1.37 3.58 0.56 3.97 -0.12 -1.26 -4.93 117.98 121.14 1h67 s PHE 106 Ca -0.08 1.74 -0.09 0.00 -0.05 0.00 0.00 56.93 58.46 1h67 s PHE 106 Cb -0.11 -2.99 -0.04 0.00 -0.63 0.00 0.00 43.02 39.25 1h67 s PHE 106 CO -0.07 -0.04 0.92 -1.21 -0.05 0.00 0.00 175.22 174.78 1h67 s GLU 107 N -2.16 3.58 0.45 1.99 8.01 -1.26 -4.92 118.70 124.39 1h67 s GLU 107 Ca 0.52 0.51 0.24 0.00 0.01 0.00 0.00 54.97 56.25 1h67 s GLU 107 Cb -0.20 -2.21 1.24 0.00 -4.31 0.00 0.00 34.13 28.65 1h67 s GLU 107 CO 0.25 -0.40 1.79 0.00 0.01 0.00 0.00 175.26 176.91 1h67 h ALA 108 N -0.05 2.50 -0.19 5.21 0.00 -1.96 0.28 119.26 125.04 1h67 h ALA 108 Ca -0.45 0.03 -0.14 0.00 0.00 0.00 0.00 54.91 54.35 1h67 h ALA 108 Cb 1.20 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 19.02 1h67 h ALA 108 CO 0.62 -0.87 -0.46 -2.95 0.00 0.00 0.00 179.25 175.59 1h67 h ASN 109 N 0.26 0.51 -0.27 0.00 7.08 -1.97 -1.19 115.58 120.00 1h67 h ASN 109 Ca 0.57 -0.24 0.03 0.00 -3.08 0.00 0.00 56.30 53.57 1h67 h ASN 109 Cb 1.69 -0.15 -0.03 0.00 -2.08 0.00 0.00 38.32 37.76 1h67 h ASN 109 CO -0.20 0.90 0.10 0.44 -2.08 0.00 0.00 177.43 176.59 1h67 h ASP 110 N 0.39 0.11 0.00 6.14 5.19 -0.80 0.30 116.42 127.75 1h67 h ASP 110 Ca 0.02 0.03 -0.08 0.00 -0.62 0.00 0.00 57.03 56.39 1h67 h ASP 110 Cb 0.95 0.01 0.01 0.00 0.18 0.00 0.00 39.33 40.48 1h67 h ASP 110 CO 0.08 0.10 -0.30 0.25 -3.12 0.00 0.00 179.24 176.25 1h67 h LEU 111 N 0.22 0.26 0.73 1.55 5.85 -1.53 -1.24 115.31 121.15 1h67 h LEU 111 Ca 0.12 -0.78 -0.04 0.00 0.84 0.00 0.00 57.88 58.02 1h67 h LEU 111 Cb 0.08 -0.08 0.01 0.00 0.37 0.00 0.00 40.66 41.04 1h67 h LEU 111 CO -0.12 1.01 -0.35 0.15 -0.34 0.00 0.00 178.44 178.79 1h67 h PHE 112 N -0.46 -0.91 0.00 1.25 3.57 -1.16 -2.99 116.94 116.24 1h67 h PHE 112 Ca -0.04 -0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.44 1h67 h PHE 112 Cb 1.06 0.30 0.00 0.00 2.79 0.00 0.00 35.95 40.10 1h67 h PHE 112 CO 0.18 -0.56 0.00 0.39 -2.23 0.00 0.00 178.31 176.08 1h67 n GLU 113 N -5.00 0.15 -2.22 1.11 -0.58 0.10 -4.86 120.64 109.34 1h67 n GLU 113 Ca -0.12 0.13 -0.20 0.00 -0.42 0.00 0.00 57.16 56.54 1h67 n GLU 113 Cb 0.39 -1.50 -0.03 0.00 -0.57 0.00 0.00 31.44 29.73 1h67 n GLU 113 CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74 1h67 n ASN 114 N -1.39 -5.70 0.13 1.62 3.02 -0.58 -4.87 115.26 107.50 1h67 n ASN 114 Ca 0.07 0.09 -0.02 0.00 -0.03 0.00 0.00 54.58 54.69 1h67 n ASN 114 Cb 0.19 -4.77 0.14 0.00 -0.61 0.00 0.00 39.78 34.73 1h67 n ASN 114 CO 0.00 0.00 0.00 0.71 -2.62 0.00 0.00 177.26 175.35 1h67 h THR 115 N 0.00 1.46 -0.84 3.41 1.35 -1.41 -3.36 112.91 113.53 1h67 h THR 115 Ca -0.47 -2.22 -0.34 0.00 -0.55 0.00 0.00 66.41 62.83 1h67 h THR 115 Cb 1.35 2.20 -0.34 0.00 -1.73 0.00 0.00 68.15 69.63 1h67 h THR 115 CO 0.58 0.64 -0.98 -3.20 -0.25 0.00 0.00 175.52 172.30 1h67 n ASN 116 N -3.77 0.49 -0.05 5.36 4.05 -1.06 -4.94 115.26 115.34 1h67 n ASN 116 Ca -0.01 -2.72 0.05 0.00 0.45 0.00 0.00 54.58 52.34 1h67 n ASN 116 Cb 0.64 -0.11 0.41 0.00 1.23 0.00 0.00 39.78 41.95 1h67 n ASN 116 CO 0.00 0.00 0.00 1.12 -3.05 0.00 0.00 177.26 175.33 1h67 h HIS 117 N 2.78 0.58 -0.88 1.20 2.07 -1.71 -1.98 115.15 117.21 1h67 h HIS 117 Ca -0.12 0.01 0.11 0.00 -2.85 0.00 0.00 60.37 57.53 1h67 h HIS 117 Cb 1.18 -0.19 -0.08 0.00 2.57 0.00 0.00 27.41 30.89 1h67 h HIS 117 CO 0.41 0.35 0.51 0.00 -3.07 0.00 0.00 177.93 176.12 1h67 h THR 118 N 0.61 0.87 -0.29 6.12 1.03 -1.92 0.18 112.91 119.52 1h67 h THR 118 Ca 0.19 -0.28 0.03 0.00 -0.01 0.00 0.00 66.41 66.34 1h67 h THR 118 Cb 0.02 -0.01 -0.01 0.00 -1.07 0.00 0.00 68.15 67.08 1h67 h THR 118 CO -0.05 0.15 0.19 -0.61 -0.01 0.00 0.00 175.52 175.19 1h67 h GLN 119 N 0.81 0.26 -0.43 0.00 5.75 -1.78 -2.39 115.11 117.34 1h67 h GLN 119 Ca 0.44 -0.02 0.05 0.00 -0.15 0.00 0.00 58.65 58.97 1h67 h GLN 119 Cb 0.46 -0.06 -0.05 0.00 1.07 0.00 0.00 27.48 28.90 1h67 h GLN 119 CO -0.28 0.18 0.16 0.28 -2.65 0.00 0.00 178.83 176.52 1h67 h VAL 120 N 0.27 0.88 -0.29 2.39 2.07 -0.65 0.15 116.25 121.08 1h67 h VAL 120 Ca 0.12 -0.11 -0.00 0.00 0.82 0.00 0.00 66.70 67.52 1h67 h VAL 120 Cb 0.13 0.51 -0.01 0.00 -1.52 0.00 0.00 31.29 30.41 1h67 h VAL 120 CO -0.02 0.06 0.17 -0.61 0.02 0.00 0.00 177.57 177.19 1h67 h GLN 121 N 0.33 0.39 -0.61 1.57 4.15 -1.42 -2.60 115.11 116.93 1h67 h GLN 121 Ca 0.20 -0.04 -0.08 0.00 0.77 0.00 0.00 58.65 59.50 1h67 h GLN 121 Cb 0.18 -0.08 -0.02 0.00 0.21 0.00 0.00 27.48 27.77 1h67 h GLN 121 CO -0.20 0.31 0.05 0.66 -1.93 0.00 0.00 178.83 177.72 1h67 h SER 122 N 0.36 0.98 -0.37 -0.69 4.64 -1.41 -3.10 113.55 113.97 1h67 h SER 122 Ca 0.10 -0.25 0.04 0.00 -0.47 0.00 0.00 61.79 61.21 1h67 h SER 122 Cb 0.02 -0.26 -0.04 0.00 -0.31 0.00 0.00 62.40 61.81 1h67 h SER 122 CO -0.02 1.01 0.15 0.74 -0.87 0.00 0.00 176.83 177.84 1h67 h THR 123 N 0.95 0.93 -1.00 2.95 2.02 -0.48 -2.05 112.91 116.23 1h67 h THR 123 Ca 0.18 -0.11 0.10 0.00 0.77 0.00 0.00 66.41 67.35 1h67 h THR 123 Cb 0.47 0.58 -0.08 0.00 -1.74 0.00 0.00 68.15 67.38 1h67 h THR 123 CO 0.02 0.06 0.64 -0.07 0.37 0.00 0.00 175.52 176.53 1h67 h LEU 124 N 0.32 0.97 -0.61 2.58 3.38 -1.40 -1.59 115.31 118.97 1h67 h LEU 124 Ca 0.17 0.03 -0.00 0.00 0.09 0.00 0.00 57.88 58.17 1h67 h LEU 124 Cb 0.12 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 40.67 1h67 h LEU 124 CO -0.15 0.56 0.37 0.40 0.09 0.00 0.00 178.44 179.72 1h67 h ILE 125 N 1.07 1.17 -0.73 1.22 2.04 -1.35 -2.73 117.51 118.21 1h67 h ILE 125 Ca 0.47 -0.38 0.01 0.00 1.00 0.00 0.00 64.86 65.96 1h67 h ILE 125 Cb 0.35 0.33 -0.04 0.00 -0.74 0.00 0.00 36.82 36.72 1h67 h ILE 125 CO -0.23 0.18 0.48 0.00 0.00 0.00 0.00 178.15 178.58 1h67 h ALA 126 N 1.19 0.93 -0.56 1.87 0.00 -0.88 -2.05 119.26 119.77 1h67 h ALA 126 Ca 0.22 -0.05 0.08 0.00 0.00 0.00 0.00 54.91 55.17 1h67 h ALA 126 Cb -0.04 -0.29 -0.03 0.00 0.00 0.00 0.00 17.79 17.43 1h67 h ALA 126 CO -0.04 0.33 0.38 1.25 0.00 0.00 0.00 179.25 181.16 1h67 h LEU 127 N 0.98 0.37 -0.93 0.00 5.85 -1.13 -1.57 115.31 118.88 1h67 h LEU 127 Ca 0.27 0.01 0.09 0.00 0.84 0.00 0.00 57.88 59.09 1h67 h LEU 127 Cb -0.09 -0.07 -0.07 0.00 0.37 0.00 0.00 40.66 40.79 1h67 h LEU 127 CO -0.07 0.23 0.57 0.00 -0.34 0.00 0.00 178.44 178.84 1h67 h ALA 128 N 1.71 1.34 -0.63 1.25 0.00 -1.21 -0.32 119.26 121.39 1h67 h ALA 128 Ca 0.25 0.01 0.07 0.00 0.00 0.00 0.00 54.91 55.24 1h67 h ALA 128 Cb 0.45 -0.21 -0.04 0.00 0.00 0.00 0.00 17.79 17.99 1h67 h ALA 128 CO -0.07 0.23 0.42 0.77 0.00 0.00 0.00 179.25 180.60 1h67 h SER 129 N 0.96 0.53 -0.02 0.00 0.02 -1.34 -0.55 113.55 113.14 1h67 h SER 129 Ca 0.44 0.00 -0.03 0.00 -0.84 0.00 0.00 61.79 61.36 1h67 h SER 129 Cb 0.35 -0.11 0.00 0.00 0.14 0.00 0.00 62.40 62.78 1h67 h SER 129 CO -0.23 0.34 -0.12 1.56 -1.14 0.00 0.00 176.83 177.23 1h67 h GLN 130 N 0.60 0.11 -0.61 3.45 7.50 -1.16 -3.20 115.11 121.80 1h67 h GLN 130 Ca 0.28 -0.10 -0.00 0.00 0.50 0.00 0.00 58.65 59.32 1h67 h GLN 130 Cb 0.31 0.02 -0.03 0.00 0.05 0.00 0.00 27.48 27.84 1h67 h GLN 130 CO -0.08 0.79 0.38 0.00 -1.50 0.00 0.00 178.83 178.41 1h67 h ALA 131 N 0.33 0.78 -0.89 3.87 0.00 -0.92 -2.27 119.26 120.16 1h67 h ALA 131 Ca -0.01 -0.07 0.06 0.00 0.00 0.00 0.00 54.91 54.90 1h67 h ALA 131 Cb 0.82 -0.25 -0.06 0.00 0.00 0.00 0.00 17.79 18.30 1h67 h ALA 131 CO 0.03 0.25 0.56 1.57 0.00 0.00 0.00 179.25 181.66 1h67 h LYS 132 N 0.83 0.98 -0.40 0.00 2.10 -1.22 -1.01 116.57 117.85 1h67 h LYS 132 Ca 0.22 -0.06 -0.07 0.00 -2.00 0.00 0.00 60.65 58.75 1h67 h LYS 132 Cb -0.04 -0.22 -0.02 0.00 -0.90 0.00 0.00 32.23 31.05 1h67 h LYS 132 CO -0.04 0.65 -0.02 1.15 -2.00 0.00 0.00 179.45 179.19 1h67 h THR 133 N 1.01 1.23 0.00 0.07 2.02 -1.46 -3.52 112.91 112.26 1h67 h THR 133 Ca 0.39 -0.94 0.00 0.00 0.77 0.00 0.00 66.41 66.63 1h67 h THR 133 Cb 0.18 0.94 0.00 0.00 -1.74 0.00 0.00 68.15 67.53 1h67 h THR 133 CO -0.18 0.32 0.00 2.29 0.37 0.00 0.00 175.52 178.33