#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1h67 s PRO 28 N 0.00 4.13 -0.06 0.03 0.02 -1.26 -4.92 135.00 132.94 1h67 s PRO 28 Ca 0.00 2.60 -0.24 0.00 0.02 0.00 0.00 61.00 63.37 1h67 s PRO 28 Cb 0.00 -3.39 -0.25 0.00 0.02 0.00 0.00 34.50 30.88 1h67 s PRO 28 CO 0.00 -0.81 0.99 -0.56 -0.33 0.00 0.00 177.00 176.29 1h67 h GLN 29 N 7.89 0.18 -5.79 5.54 -0.00 -2.03 -3.45 115.11 117.44 1h67 h GLN 29 Ca -0.45 -0.21 -0.66 0.00 -0.00 0.00 0.00 58.65 57.34 1h67 h GLN 29 Cb 1.21 0.06 -0.07 0.00 -0.00 0.00 0.00 27.48 28.68 1h67 h GLN 29 CO 0.95 0.97 -0.51 0.99 -0.00 0.00 0.00 178.83 181.23 1h67 s THR 30 N -2.97 5.25 0.63 1.86 2.01 -1.26 -4.97 115.64 116.19 1h67 s THR 30 Ca -0.16 -0.08 0.34 0.00 0.31 0.00 0.00 61.69 62.11 1h67 s THR 30 Cb 0.01 -3.37 0.34 0.00 0.01 0.00 0.00 72.50 69.49 1h67 s THR 30 CO 0.75 0.45 2.05 1.05 -0.69 0.00 0.00 174.62 178.23 1h67 h GLU 31 N 4.37 0.00 -0.31 4.92 4.11 -2.02 -1.94 114.58 123.72 1h67 h GLU 31 Ca -0.51 0.00 0.04 0.00 0.07 0.00 0.00 59.36 58.96 1h67 h GLU 31 Cb 1.20 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 30.41 1h67 h GLU 31 CO 0.63 0.00 0.06 -0.09 0.07 0.00 0.00 179.01 179.68 1h67 h ARG 32 N 0.00 0.16 0.00 1.06 2.43 -1.98 -0.42 114.38 115.63 1h67 h ARG 32 Ca 0.00 -0.01 -0.00 0.00 -0.81 0.00 0.00 59.98 59.16 1h67 h ARG 32 Cb 0.42 -0.04 -0.00 0.00 -0.42 0.00 0.00 29.97 29.94 1h67 h ARG 32 CO 0.00 0.11 -0.00 1.96 -1.51 0.00 0.00 179.97 180.52 1h67 h GLN 33 N 0.17 0.00 0.05 0.20 1.08 -1.76 -1.39 115.11 113.46 1h67 h GLN 33 Ca 0.14 0.00 -0.00 0.00 -1.45 0.00 0.00 58.65 57.34 1h67 h GLN 33 Cb 0.15 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.58 1h67 h GLN 33 CO -0.19 0.00 -0.02 1.25 -0.95 0.00 0.00 178.83 178.92 1h67 h LEU 34 N 0.00 -0.06 -0.23 1.46 5.85 -1.20 -2.22 115.31 118.91 1h67 h LEU 34 Ca -0.00 -0.49 -0.03 0.00 0.84 0.00 0.00 57.88 58.20 1h67 h LEU 34 Cb 0.01 0.01 -0.01 0.00 0.37 0.00 0.00 40.66 41.05 1h67 h LEU 34 CO 0.00 0.49 0.03 0.08 -0.34 0.00 0.00 178.44 178.70 1h67 h ARG 35 N -0.62 0.39 -0.66 1.25 0.11 -1.00 -1.65 114.38 112.20 1h67 h ARG 35 Ca -0.01 -0.11 0.06 0.00 0.10 0.00 0.00 59.98 60.02 1h67 h ARG 35 Cb 0.55 -0.04 -0.05 0.00 1.11 0.00 0.00 29.97 31.53 1h67 h ARG 35 CO 0.01 0.54 0.36 -0.24 0.10 0.00 0.00 179.97 180.74 1h67 h VAL 36 N 0.19 0.97 0.00 0.08 3.04 -1.37 0.61 116.25 119.77 1h67 h VAL 36 Ca 0.07 -0.23 0.00 0.00 -1.01 0.00 0.00 66.70 65.53 1h67 h VAL 36 Cb 0.34 0.24 0.00 0.00 -2.01 0.00 0.00 31.29 29.86 1h67 h VAL 36 CO 0.01 0.12 0.00 1.87 -1.01 0.00 0.00 177.57 178.56 1h67 n TRP 37 N -4.80 0.00 -0.03 3.17 -0.00 -0.83 -0.76 117.44 114.19 1h67 n TRP 37 Ca 0.08 0.00 -0.08 0.00 -0.00 0.00 0.00 57.50 57.50 1h67 n TRP 37 Cb 0.17 -0.49 -0.02 0.00 -0.00 0.00 0.00 31.31 30.97 1h67 n TRP 37 CO 0.00 0.00 0.00 0.82 -0.00 0.00 0.00 177.69 178.51 1h67 h ILE 38 N 0.00 0.57 -0.57 5.87 2.04 -1.30 0.59 117.51 124.72 1h67 h ILE 38 Ca 0.00 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.86 1h67 h ILE 38 Cb 0.00 0.57 -0.03 0.00 -0.74 0.00 0.00 36.82 36.62 1h67 h ILE 38 CO 0.00 0.00 0.36 -0.33 0.00 0.00 0.00 178.15 178.18 1h67 h GLU 39 N -0.16 0.76 -0.55 2.37 5.08 -0.98 -2.59 114.58 118.50 1h67 h GLU 39 Ca 0.12 -0.06 -0.04 0.00 -1.00 0.00 0.00 59.36 58.38 1h67 h GLU 39 Cb 0.33 -0.17 -0.03 0.00 0.50 0.00 0.00 28.75 29.39 1h67 h GLU 39 CO -0.29 0.52 0.18 0.78 -1.00 0.00 0.00 179.01 179.20 1h67 h GLY 40 N 0.77 0.88 0.54 -3.84 0.00 -0.45 0.18 103.07 101.15 1h67 h GLY 40 Ca 0.21 -0.47 -0.01 0.00 0.00 0.00 0.00 47.33 47.06 1h67 h GLY 40 CO -0.04 0.44 -0.45 0.00 0.00 0.00 0.00 176.54 176.49 1h67 h ALA 41 N 1.40 -0.98 0.00 3.60 0.00 -0.49 -3.36 119.26 119.42 1h67 h ALA 41 Ca 0.18 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1h67 h ALA 41 Cb 0.22 0.65 0.00 0.00 0.00 0.00 0.00 17.79 18.66 1h67 h ALA 41 CO -0.01 -1.09 -0.07 1.79 0.00 0.00 0.00 179.25 179.86 1h67 h THR 42 N -0.90 0.00 0.00 0.00 1.35 -1.52 -3.50 112.91 108.35 1h67 h THR 42 Ca -0.04 -0.40 0.00 0.00 -0.55 0.00 0.00 66.41 65.42 1h67 h THR 42 Cb 0.79 0.00 0.00 0.00 -1.73 0.00 0.00 68.15 67.21 1h67 h THR 42 CO -0.07 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.81 1h67 n GLY 43 N 1.83 2.50 3.74 5.82 0.00 0.61 -5.11 105.19 114.58 1h67 n GLY 43 Ca -0.01 -0.29 -0.42 0.00 0.00 0.00 0.00 46.02 45.30 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 4.22 -0.09 1.61 1.81 -1.25 -4.84 118.95 120.41 1h67 s ARG 44 Ca 0.00 2.38 0.01 0.00 -1.72 0.00 0.00 55.73 56.40 1h67 s ARG 44 Cb 0.00 -3.10 0.11 0.00 -0.45 0.00 0.00 34.95 31.52 1h67 s ARG 44 CO 0.00 -0.51 1.30 0.54 -0.68 0.00 0.00 175.30 175.95 1h67 n ARG 45 N 2.63 1.23 0.00 3.54 5.12 -1.26 -4.44 116.66 123.48 1h67 n ARG 45 Ca 0.09 -0.54 0.00 0.00 -1.93 0.00 0.00 57.85 55.47 1h67 n ARG 45 Cb 0.39 -1.21 0.00 0.00 -1.16 0.00 0.00 32.46 30.48 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 0.35 0.00 -0.87 0.55 5.41 -1.26 -4.78 119.36 118.76 1h67 n ILE 46 Ca 0.11 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.86 1h67 n ILE 46 Cb 0.68 0.00 0.00 0.00 -0.71 0.00 0.00 39.64 39.61 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 -3.94 7.00 7.39 0.00 -1.26 -4.60 105.19 109.78 1h67 n GLY 47 Ca 0.00 -0.87 0.00 0.00 0.00 0.00 0.00 46.02 45.15 1h67 n GLY 47 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1h67 n ASP 48 N -0.71 0.00 -4.76 1.61 9.92 -1.26 -4.19 116.55 117.16 1h67 n ASP 48 Ca 0.00 0.00 -0.37 0.00 -0.53 0.00 0.00 54.79 53.89 1h67 n ASP 48 Cb 0.00 0.00 0.01 0.00 -0.64 0.00 0.00 41.12 40.49 1h67 n ASP 48 CO 0.00 0.00 0.00 0.20 0.13 0.00 0.00 177.20 177.53 1h67 s ASN 49 N -4.00 5.71 0.15 -2.24 -0.87 -1.26 -4.88 114.94 107.55 1h67 s ASN 49 Ca 0.00 2.47 -0.17 0.00 -1.57 0.00 0.00 52.86 53.59 1h67 s ASN 49 Cb 0.00 -2.61 0.03 0.00 -0.02 0.00 0.00 41.25 38.65 1h67 s ASN 49 CO 0.00 -1.25 1.77 0.15 -2.57 0.00 0.00 177.10 175.20 1h67 h PHE 50 N 1.66 0.27 0.01 2.20 3.57 -1.96 -0.81 116.94 121.88 1h67 h PHE 50 Ca -0.50 0.01 -0.08 0.00 3.53 0.00 0.00 57.97 60.94 1h67 h PHE 50 Cb 1.27 -0.08 0.01 0.00 2.79 0.00 0.00 35.95 39.94 1h67 h PHE 50 CO 0.50 0.14 -0.30 0.52 -2.23 0.00 0.00 178.31 176.94 1h67 h MET 51 N 0.32 0.19 -0.58 1.11 0.00 -1.95 -3.31 114.93 110.70 1h67 h MET 51 Ca 0.14 -0.21 0.11 0.00 0.00 0.00 0.00 59.70 59.74 1h67 h MET 51 Cb 0.08 0.06 -0.08 0.00 0.00 0.00 0.00 31.60 31.66 1h67 h MET 51 CO -0.11 0.97 0.13 0.22 0.00 0.00 0.00 176.91 178.11 1h67 h ASP 52 N -0.50 0.02 -0.59 1.22 3.58 -1.91 -0.26 116.42 117.97 1h67 h ASP 52 Ca -0.04 0.10 0.13 0.00 0.42 0.00 0.00 57.03 57.64 1h67 h ASP 52 Cb 1.08 0.14 -0.03 0.00 1.72 0.00 0.00 39.33 42.23 1h67 h ASP 52 CO 0.06 0.02 0.40 1.23 -2.88 0.00 0.00 179.24 178.08 1h67 h GLY 53 N 0.27 0.39 1.42 -0.78 0.00 -1.25 -1.05 103.07 102.06 1h67 h GLY 53 Ca 0.30 -0.11 -0.13 0.00 0.00 0.00 0.00 47.33 47.39 1h67 h GLY 53 CO -0.38 0.05 -0.38 1.41 0.00 0.00 0.00 176.54 177.24 1h67 h LEU 54 N 0.25 0.68 -0.15 3.11 3.38 -1.13 -3.27 115.31 118.17 1h67 h LEU 54 Ca 0.28 -0.30 0.05 0.00 0.09 0.00 0.00 57.88 58.00 1h67 h LEU 54 Cb 0.76 -0.19 -0.05 0.00 0.09 0.00 0.00 40.66 41.27 1h67 h LEU 54 CO -0.06 0.99 -0.16 0.11 0.09 0.00 0.00 178.44 179.41 1h67 h LYS 55 N 0.53 -0.18 -0.76 1.13 1.57 -0.98 -1.32 116.57 116.57 1h67 h LYS 55 Ca 0.05 0.01 0.18 0.00 -1.87 0.00 0.00 60.65 59.02 1h67 h LYS 55 Cb 0.90 0.04 -0.05 0.00 0.08 0.00 0.00 32.23 33.20 1h67 h LYS 55 CO 0.08 -0.12 0.52 0.38 -0.57 0.00 0.00 179.45 179.74 1h67 h ASP 56 N -0.18 0.25 -4.45 0.86 3.04 -1.61 -3.42 116.42 110.91 1h67 h ASP 56 Ca 0.10 0.02 0.00 0.00 -3.24 0.00 0.00 57.03 53.91 1h67 h ASP 56 Cb 0.33 -0.03 -0.03 0.00 -1.04 0.00 0.00 39.33 38.57 1h67 h ASP 56 CO -0.26 0.12 -0.93 0.61 -2.04 0.00 0.00 179.24 176.74 1h67 n GLY 57 N -1.58 -5.18 2.16 7.15 0.00 -0.50 -4.29 105.19 102.95 1h67 n GLY 57 Ca 0.15 0.33 0.00 0.00 0.00 0.00 0.00 46.02 46.50 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 1.46 0.00 0.00 1.61 0.31 -1.26 -4.75 118.33 115.69 1h67 n VAL 58 Ca -0.09 0.00 -0.18 0.00 -0.01 0.00 0.00 64.34 64.06 1h67 n VAL 58 Cb 0.14 -0.09 -0.09 0.00 -0.91 0.00 0.00 33.84 32.89 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 1.33 -0.48 2.52 5.03 -1.96 -2.59 117.51 121.36 1h67 h ILE 59 Ca 0.00 -2.05 0.05 0.00 -0.12 0.00 0.00 64.86 62.74 1h67 h ILE 59 Cb 0.00 2.28 -0.04 0.00 -3.03 0.00 0.00 36.82 36.02 1h67 h ILE 59 CO 0.00 0.63 0.23 -0.07 -0.68 0.00 0.00 178.15 178.25 1h67 h LEU 60 N 0.27 0.31 -0.25 1.44 3.38 -1.93 0.64 115.31 119.18 1h67 h LEU 60 Ca -0.08 0.03 -0.01 0.00 0.09 0.00 0.00 57.88 57.92 1h67 h LEU 60 Cb 1.42 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 42.14 1h67 h LEU 60 CO 0.15 0.22 0.13 0.00 0.09 0.00 0.00 178.44 179.03 1h67 h GLU 62 N 0.28 0.44 -0.04 0.00 5.08 -0.95 -1.46 114.58 117.93 1h67 h GLU 62 Ca 0.09 -0.04 -0.01 0.00 -1.00 0.00 0.00 59.36 58.40 1h67 h GLU 62 Cb 0.07 -0.09 -0.00 0.00 0.50 0.00 0.00 28.75 29.23 1h67 h GLU 62 CO -0.01 0.33 -0.01 1.25 -1.00 0.00 0.00 179.01 179.57 1h67 h LEU 63 N 0.45 0.08 -0.87 1.33 7.12 0.98 -2.83 115.31 121.56 1h67 h LEU 63 Ca 0.12 -0.35 -0.07 0.00 0.13 0.00 0.00 57.88 57.72 1h67 h LEU 63 Cb 0.02 -0.02 -0.03 0.00 -0.53 0.00 0.00 40.66 40.10 1h67 h LEU 63 CO -0.02 0.40 0.10 -0.29 -0.13 0.00 0.00 178.44 178.51 1h67 h ILE 64 N -0.25 1.25 -0.06 4.05 6.09 -0.99 -1.61 117.51 125.98 1h67 h ILE 64 Ca 0.01 -0.94 0.02 0.00 -1.37 0.00 0.00 64.86 62.57 1h67 h ILE 64 Cb 0.37 0.69 -0.00 0.00 0.47 0.00 0.00 36.82 38.34 1h67 h ILE 64 CO 0.00 0.35 0.07 0.78 -3.07 0.00 0.00 178.15 176.29 1h67 h ASN 65 N 0.89 0.00 0.01 2.19 2.35 -1.22 0.41 115.58 120.21 1h67 h ASN 65 Ca 0.18 0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 55.93 1h67 h ASN 65 Cb 0.38 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.75 1h67 h ASN 65 CO 0.01 0.00 -0.00 0.11 -1.65 0.00 0.00 177.43 175.89 1h67 h LYS 66 N 0.00 -0.01 0.43 0.81 1.79 -1.04 -3.37 116.57 115.18 1h67 h LYS 66 Ca 0.03 0.00 -0.02 0.00 -2.18 0.00 0.00 60.65 58.48 1h67 h LYS 66 Cb 0.18 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.83 1h67 h LYS 66 CO -0.00 0.61 -0.21 -0.07 -1.08 0.00 0.00 179.45 178.71 1h67 h LEU 67 N -0.65 -0.49 -9.67 2.94 3.38 -1.19 -3.44 115.31 106.20 1h67 h LEU 67 Ca -0.00 -0.02 -0.51 0.00 0.09 0.00 0.00 57.88 57.44 1h67 h LEU 67 Cb 0.63 0.13 -0.02 0.00 0.09 0.00 0.00 40.66 41.48 1h67 h LEU 67 CO 0.00 -0.06 0.31 -1.58 0.09 0.00 0.00 178.44 177.21 1h67 s GLN 68 N -3.60 4.73 0.31 1.13 0.74 0.14 -4.94 119.66 118.17 1h67 s GLN 68 Ca -0.10 1.39 0.13 0.00 0.05 0.00 0.00 55.36 56.84 1h67 s GLN 68 Cb 0.01 -3.32 1.02 0.00 1.10 0.00 0.00 33.01 31.82 1h67 s GLN 68 CO 0.30 0.41 1.38 -2.30 -0.55 0.00 0.00 175.29 174.53 1h67 n PRO 69 N 2.04 -0.06 0.00 1.67 -0.02 -1.26 -4.31 135.00 133.06 1h67 n PRO 69 Ca -0.01 1.25 0.00 0.00 -2.02 0.00 0.00 63.50 62.71 1h67 n PRO 69 Cb 0.48 -2.15 0.00 0.00 -0.02 0.00 0.00 33.50 31.81 1h67 n PRO 69 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1h67 n GLY 70 N -1.30 -1.54 0.00 -1.23 0.00 -1.26 -4.95 105.19 94.90 1h67 n GLY 70 Ca 0.29 1.00 0.00 0.00 0.00 0.00 0.00 46.02 47.31 1h67 n GLY 70 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1h67 n SER 71 N 0.00 0.00 -4.75 1.61 7.64 -1.26 -4.91 113.62 111.95 1h67 n SER 71 Ca 0.00 0.00 -0.40 0.00 1.01 0.00 0.00 58.87 59.48 1h67 n SER 71 Cb 0.00 0.00 -0.05 0.00 -1.01 0.00 0.00 64.21 63.15 1h67 n SER 71 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 1h67 s VAL 72 N 0.00 3.98 0.01 0.44 1.01 -1.26 -4.98 120.40 119.59 1h67 s VAL 72 Ca 0.00 1.90 -0.25 0.00 0.00 0.00 0.00 61.98 63.63 1h67 s VAL 72 Cb 0.00 -4.21 -0.19 0.00 0.00 0.00 0.00 36.38 31.98 1h67 s VAL 72 CO 0.00 0.42 1.36 -0.61 0.00 0.00 0.00 175.10 176.27 1h67 h GLN 73 N 4.39 0.04 -1.29 2.72 5.75 -1.98 -3.47 115.11 121.28 1h67 h GLN 73 Ca -0.45 -0.02 0.15 0.00 -0.15 0.00 0.00 58.65 58.19 1h67 h GLN 73 Cb 1.21 -0.00 -0.30 0.00 1.07 0.00 0.00 27.48 29.45 1h67 h GLN 73 CO 0.69 0.43 0.62 0.21 -2.65 0.00 0.00 178.83 178.13 1h67 s LYS 74 N -4.62 0.22 0.11 1.69 2.47 -1.26 -5.15 119.74 113.20 1h67 s LYS 74 Ca -0.15 0.33 -0.30 0.00 -1.56 0.00 0.00 55.97 54.28 1h67 s LYS 74 Cb 0.03 0.07 -0.06 0.00 -1.46 0.00 0.00 37.83 36.40 1h67 s LYS 74 CO 0.68 -0.04 1.12 0.14 0.16 0.00 0.00 175.35 177.42 1h67 s VAL 75 N 0.80 4.04 0.08 4.02 -7.23 -1.26 -4.98 120.40 115.87 1h67 s VAL 75 Ca -0.03 1.61 -0.22 0.00 -1.81 0.00 0.00 61.98 61.52 1h67 s VAL 75 Cb -0.04 -4.03 -0.07 0.00 0.56 0.00 0.00 36.38 32.81 1h67 s VAL 75 CO -0.12 0.20 0.65 0.20 -0.31 0.00 0.00 175.10 175.72 1h67 s ASN 76 N 0.46 7.15 0.01 4.85 0.01 -1.26 -5.00 114.94 121.15 1h67 s ASN 76 Ca 0.53 1.36 -0.31 0.00 -0.71 0.00 0.00 52.86 53.73 1h67 s ASN 76 Cb -0.28 -2.41 -0.10 0.00 0.41 0.00 0.00 41.25 38.87 1h67 s ASN 76 CO 0.32 0.19 1.94 0.47 -1.51 0.00 0.00 177.10 178.50 1h67 n ASP 77 N 2.06 3.96 -4.72 -1.22 8.00 -1.26 -4.74 116.55 118.62 1h67 n ASP 77 Ca -0.07 0.93 -0.42 0.00 0.71 0.00 0.00 54.79 55.94 1h67 n ASP 77 Cb 0.50 -1.48 -0.03 0.00 -0.02 0.00 0.00 41.12 40.09 1h67 n ASP 77 CO 0.00 0.00 0.00 -2.16 -0.39 0.00 0.00 177.20 174.65 1h67 s PRO 78 N 4.17 4.29 0.31 -0.24 0.04 -1.26 -4.82 135.00 137.50 1h67 s PRO 78 Ca 0.89 2.16 0.00 0.00 0.04 0.00 0.00 61.00 64.09 1h67 s PRO 78 Cb -0.51 -3.21 0.00 0.00 0.04 0.00 0.00 34.50 30.81 1h67 s PRO 78 CO 0.44 -0.47 0.00 0.28 0.04 0.00 0.00 177.00 177.29 1h67 n VAL 79 N 3.83 0.00 0.00 -0.36 0.31 -1.26 -5.05 118.33 115.80 1h67 n VAL 79 Ca 0.12 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.45 1h67 n VAL 79 Cb 0.41 -0.24 0.00 0.00 -0.91 0.00 0.00 33.84 33.10 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 -3.28 0.00 0.00 5.55 6.02 -1.26 -5.06 117.38 119.35 1h67 n GLN 80 Ca 0.00 0.14 0.00 0.00 -0.01 0.00 0.00 57.00 57.13 1h67 n GLN 80 Cb 0.00 -0.55 0.00 0.00 1.02 0.00 0.00 30.24 30.71 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 -1.41 0.00 -0.20 1.08 6.94 -1.26 -4.97 115.26 115.43 1h67 n ASN 81 Ca 0.00 0.00 0.11 0.00 -0.02 0.00 0.00 54.58 54.67 1h67 n ASN 81 Cb 0.00 0.00 0.40 0.00 -2.36 0.00 0.00 39.78 37.82 1h67 n ASN 81 CO 0.00 0.00 0.00 4.11 -1.03 0.00 0.00 177.26 180.34 1h67 h TRP 82 N 0.00 0.70 -0.67 -2.53 5.08 -1.99 -1.17 115.95 115.37 1h67 h TRP 82 Ca 0.00 0.02 0.02 0.00 1.08 0.00 0.00 58.89 60.01 1h67 h TRP 82 Cb 0.00 -0.23 -0.04 0.00 -3.00 0.00 0.00 29.16 25.89 1h67 h TRP 82 CO 0.00 0.31 0.42 0.45 -1.28 0.00 0.00 178.44 178.35 1h67 h HIS 83 N 0.64 0.80 0.20 0.12 3.86 -1.92 0.23 115.15 119.07 1h67 h HIS 83 Ca 0.37 0.02 -0.01 0.00 -1.16 0.00 0.00 60.37 59.59 1h67 h HIS 83 Cb 0.56 -0.26 0.00 0.00 1.06 0.00 0.00 27.41 28.77 1h67 h HIS 83 CO -0.00 0.46 -0.10 0.87 0.86 0.00 0.00 177.93 180.02 1h67 h LYS 84 N 0.84 -0.26 -0.33 2.45 1.57 -1.42 -2.78 116.57 116.63 1h67 h LYS 84 Ca 0.27 0.02 0.07 0.00 -1.87 0.00 0.00 60.65 59.13 1h67 h LYS 84 Cb -0.00 0.06 -0.02 0.00 0.08 0.00 0.00 32.23 32.35 1h67 h LYS 84 CO -0.10 0.01 0.23 -0.07 -0.57 0.00 0.00 179.45 178.95 1h67 h LEU 85 N -0.52 0.12 0.24 2.94 3.38 -1.21 -1.59 115.31 118.66 1h67 h LEU 85 Ca -0.03 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.93 1h67 h LEU 85 Cb 0.39 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.12 1h67 h LEU 85 CO 0.05 0.08 -0.12 -0.08 0.09 0.00 0.00 178.44 178.46 1h67 h GLU 86 N 0.13 -0.31 -0.67 1.13 4.81 -0.77 -0.71 114.58 118.19 1h67 h GLU 86 Ca 0.15 0.02 -0.02 0.00 -0.13 0.00 0.00 59.36 59.39 1h67 h GLU 86 Cb 0.43 0.07 -0.03 0.00 0.63 0.00 0.00 28.75 29.85 1h67 h GLU 86 CO -0.02 -0.01 0.35 -0.91 -0.73 0.00 0.00 179.01 177.69 1h67 h ASN 87 N -0.62 0.84 -0.02 1.04 2.35 -1.19 -1.97 115.58 116.01 1h67 h ASN 87 Ca -0.03 -0.07 -0.00 0.00 -0.55 0.00 0.00 56.30 55.64 1h67 h ASN 87 Cb 0.44 -0.21 -0.00 0.00 0.05 0.00 0.00 38.32 38.60 1h67 h ASN 87 CO 0.05 0.69 0.01 0.40 -1.65 0.00 0.00 177.43 176.93 1h67 h ILE 88 N 0.94 1.13 -0.49 2.81 2.04 -1.23 -2.07 117.51 120.65 1h67 h ILE 88 Ca 0.24 -0.39 0.05 0.00 1.00 0.00 0.00 64.86 65.76 1h67 h ILE 88 Cb 0.05 1.35 -0.05 0.00 -0.74 0.00 0.00 36.82 37.43 1h67 h ILE 88 CO -0.04 0.10 0.22 1.23 0.00 0.00 0.00 178.15 179.66 1h67 h GLY 89 N -0.12 0.67 1.02 5.37 0.00 -0.80 -1.44 103.07 107.77 1h67 h GLY 89 Ca 0.01 -0.14 0.02 0.00 0.00 0.00 0.00 47.33 47.22 1h67 h GLY 89 CO -0.00 0.06 0.62 3.43 0.00 0.00 0.00 176.54 180.65 1h67 h ASN 90 N 0.43 1.05 0.61 0.19 2.35 -1.27 -0.08 115.58 118.87 1h67 h ASN 90 Ca 0.23 -0.02 -0.03 0.00 -0.55 0.00 0.00 56.30 55.93 1h67 h ASN 90 Cb 0.18 -0.25 0.01 0.00 0.05 0.00 0.00 38.32 38.31 1h67 h ASN 90 CO -0.19 0.74 -0.29 0.15 -1.65 0.00 0.00 177.43 176.19 1h67 h PHE 91 N 1.23 -0.76 -0.15 1.19 3.57 -0.61 -1.21 116.94 120.20 1h67 h PHE 91 Ca 0.36 -0.02 -0.00 0.00 3.53 0.00 0.00 57.97 61.84 1h67 h PHE 91 Cb -0.08 0.25 -0.01 0.00 2.79 0.00 0.00 35.95 38.91 1h67 h PHE 91 CO -0.00 -0.43 0.09 -0.07 -2.23 0.00 0.00 178.31 175.67 1h67 h LEU 92 N -1.03 0.18 -0.97 0.59 4.07 -1.19 -1.63 115.31 115.33 1h67 h LEU 92 Ca -0.08 -0.05 0.01 0.00 0.08 0.00 0.00 57.88 57.83 1h67 h LEU 92 Cb 0.68 -0.04 -0.05 0.00 1.08 0.00 0.00 40.66 42.33 1h67 h LEU 92 CO 0.14 0.17 0.63 0.03 -1.08 0.00 0.00 178.44 178.33 1h67 h ARG 93 N 0.16 1.28 -0.25 1.13 2.47 -1.08 0.25 114.38 118.34 1h67 h ARG 93 Ca 0.05 -0.09 -0.01 0.00 -1.26 0.00 0.00 59.98 58.67 1h67 h ARG 93 Cb 0.03 -0.28 -0.01 0.00 -1.65 0.00 0.00 29.97 28.06 1h67 h ARG 93 CO -0.01 0.86 0.10 0.00 0.56 0.00 0.00 179.97 181.48 1h67 h ALA 94 N 1.34 0.33 -0.14 0.04 0.00 -0.98 -2.52 119.26 117.33 1h67 h ALA 94 Ca 0.35 -0.12 -0.20 0.00 0.00 0.00 0.00 54.91 54.94 1h67 h ALA 94 Cb -0.13 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.57 1h67 h ALA 94 CO -0.07 -0.08 -0.73 -0.84 0.00 0.00 0.00 179.25 177.53 1h67 h ILE 95 N 0.26 1.31 -0.93 0.00 3.07 -1.02 0.28 117.51 120.48 1h67 h ILE 95 Ca 0.08 -2.00 0.10 0.00 1.55 0.00 0.00 64.86 64.59 1h67 h ILE 95 Cb 0.18 1.98 -0.08 0.00 -0.27 0.00 0.00 36.82 38.64 1h67 h ILE 95 CO -0.01 0.62 0.57 0.11 -1.05 0.00 0.00 178.15 178.40 1h67 h LYS 96 N 0.45 0.92 0.09 0.16 1.57 -0.46 -1.49 116.57 117.82 1h67 h LYS 96 Ca -0.04 -0.06 -0.30 0.00 -1.87 0.00 0.00 60.65 58.39 1h67 h LYS 96 Cb 1.33 -0.21 -0.02 0.00 0.08 0.00 0.00 32.23 33.42 1h67 h LYS 96 CO 0.14 0.61 -1.52 1.25 -0.57 0.00 0.00 179.45 179.36 1h67 h HIS 97 N 0.95 0.34 -0.75 -1.35 2.76 -1.43 -3.35 115.15 112.33 1h67 h HIS 97 Ca 0.44 -0.25 0.15 0.00 -2.20 0.00 0.00 60.37 58.51 1h67 h HIS 97 Cb 0.36 -0.01 -0.10 0.00 1.55 0.00 0.00 27.41 29.21 1h67 h HIS 97 CO -0.03 1.31 0.26 -0.92 -1.30 0.00 0.00 177.93 177.25 1h67 h TYR 98 N 0.05 0.44 0.00 5.26 3.20 0.42 -3.45 116.97 122.89 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 1.99 -0.08 0.00 0.00 1.54 0.00 0.00 36.73 40.18 1h67 h TYR 98 CO 0.05 0.01 0.00 0.41 -1.64 0.00 0.00 178.16 176.98 1h67 n GLY 99 N -1.33 0.70 3.67 1.82 0.00 -0.64 -5.06 105.19 104.34 1h67 n GLY 99 Ca 0.15 -0.05 -0.47 0.00 0.00 0.00 0.00 46.02 45.64 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 0.19 -2.15 1.61 0.31 -1.04 -4.91 118.33 112.35 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 -1.58 -0.03 0.00 -0.91 0.00 0.00 33.84 31.32 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 1.96 4.37 0.61 5.55 1.02 -1.26 -4.24 119.74 127.75 1h67 s LYS 101 Ca 0.84 2.16 0.29 0.00 0.02 0.00 0.00 55.97 59.28 1h67 s LYS 101 Cb -0.71 -3.12 1.51 0.00 -0.52 0.00 0.00 37.83 34.98 1h67 s LYS 101 CO 0.44 -0.23 1.90 -1.35 -0.92 0.00 0.00 175.35 175.20 1h67 h PRO 102 N 4.31 0.00 -2.01 -1.68 0.11 -1.91 -2.51 132.00 128.31 1h67 h PRO 102 Ca -0.47 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.63 1h67 h PRO 102 Cb 1.22 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.33 1h67 h PRO 102 CO 0.71 0.00 -0.01 0.72 -0.21 0.00 0.00 178.00 179.22 1h67 n HIS 103 N -3.52 0.00 0.00 0.65 8.25 -1.26 -2.92 115.22 116.42 1h67 n HIS 103 Ca 0.06 -0.79 0.00 0.00 -0.26 0.00 0.00 57.72 56.73 1h67 n HIS 103 Cb 0.59 -0.48 0.00 0.00 1.12 0.00 0.00 29.99 31.22 1h67 n HIS 103 CO 0.00 0.00 0.00 -3.47 0.64 0.00 0.00 176.34 173.51 1h67 n ASP 104 N 1.65 0.00 -4.74 0.41 -0.08 -0.95 -5.12 116.55 107.73 1h67 n ASP 104 Ca 0.01 0.00 -0.41 0.00 -1.51 0.00 0.00 54.79 52.88 1h67 n ASP 104 Cb 0.40 0.12 -0.04 0.00 2.34 0.00 0.00 41.12 43.94 1h67 n ASP 104 CO 0.00 0.00 0.00 -0.63 0.12 0.00 0.00 177.20 176.69 1h67 s ILE 105 N -1.24 3.84 0.00 5.18 1.01 -1.15 -4.13 121.20 124.71 1h67 s ILE 105 Ca 0.00 1.55 0.00 0.00 0.00 0.00 0.00 60.65 62.20 1h67 s ILE 105 Cb 0.00 -3.99 0.00 0.00 0.01 0.00 0.00 42.46 38.48 1h67 s ILE 105 CO 0.00 0.25 0.00 2.22 0.00 0.00 0.00 174.94 177.41 1h67 n PHE 106 N 2.56 0.00 -3.91 3.97 1.16 -1.26 -4.94 117.46 115.04 1h67 n PHE 106 Ca 0.04 0.00 -0.10 0.00 -1.87 0.00 0.00 57.45 55.51 1h67 n PHE 106 Cb 0.46 0.00 -0.10 0.00 -1.61 0.00 0.00 39.48 38.23 1h67 n PHE 106 CO 0.00 0.00 0.00 -1.21 -1.87 0.00 0.00 176.76 173.68 1h67 s GLU 107 N 0.00 0.49 0.64 3.97 2.02 -1.26 -5.01 118.70 119.55 1h67 s GLU 107 Ca 0.00 -0.56 0.25 0.00 0.02 0.00 0.00 54.97 54.68 1h67 s GLU 107 Cb 0.00 0.20 1.28 0.00 0.10 0.00 0.00 34.13 35.71 1h67 s GLU 107 CO 0.00 -0.11 1.72 0.00 0.02 0.00 0.00 175.26 176.89 1h67 h ALA 108 N 4.13 1.82 0.23 5.21 0.00 -1.95 0.33 119.26 129.02 1h67 h ALA 108 Ca -0.32 -0.01 -0.35 0.00 0.00 0.00 0.00 54.91 54.24 1h67 h ALA 108 Cb 1.19 0.02 0.03 0.00 0.00 0.00 0.00 17.79 19.03 1h67 h ALA 108 CO 0.44 -0.66 -1.60 -0.91 0.00 0.00 0.00 179.25 176.51 1h67 h ASN 109 N 0.00 0.76 -0.21 0.00 -0.26 -1.98 -2.79 115.58 111.10 1h67 h ASN 109 Ca 0.10 -0.92 0.03 0.00 -0.56 0.00 0.00 56.30 54.95 1h67 h ASN 109 Cb 1.20 -0.25 -0.03 0.00 -1.06 0.00 0.00 38.32 38.19 1h67 h ASN 109 CO -0.00 1.75 0.02 0.44 -1.06 0.00 0.00 177.43 178.57 1h67 h ASP 110 N 0.13 -0.04 -0.06 5.81 3.32 -0.73 0.27 116.42 125.11 1h67 h ASP 110 Ca -0.30 0.04 -0.05 0.00 0.02 0.00 0.00 57.03 56.75 1h67 h ASP 110 Cb 2.15 0.07 0.00 0.00 0.22 0.00 0.00 39.33 41.76 1h67 h ASP 110 CO 0.24 0.01 -0.15 0.25 -1.72 0.00 0.00 179.24 177.86 1h67 h LEU 111 N 0.09 0.24 -0.58 1.55 5.85 -1.65 -1.42 115.31 119.40 1h67 h LEU 111 Ca 0.10 -0.58 -0.01 0.00 0.84 0.00 0.00 57.88 58.23 1h67 h LEU 111 Cb 0.11 -0.07 -0.03 0.00 0.37 0.00 0.00 40.66 41.04 1h67 h LEU 111 CO -0.15 0.78 0.34 0.15 -0.34 0.00 0.00 178.44 179.22 1h67 h PHE 112 N -0.28 0.77 0.00 1.25 3.57 -1.41 -1.95 116.94 118.88 1h67 h PHE 112 Ca -0.00 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.49 1h67 h PHE 112 Cb 0.75 -0.25 0.00 0.00 2.79 0.00 0.00 35.95 39.24 1h67 h PHE 112 CO 0.12 0.53 0.00 0.93 -2.23 0.00 0.00 178.31 177.66 1h67 h GLU 113 N 0.78 0.00 -3.03 1.11 5.08 -0.54 -3.47 114.58 114.51 1h67 h GLU 113 Ca 0.21 0.00 -0.31 0.00 -1.00 0.00 0.00 59.36 58.25 1h67 h GLU 113 Cb -0.00 0.00 0.02 0.00 0.50 0.00 0.00 28.75 29.27 1h67 h GLU 113 CO -0.04 0.00 -0.44 0.09 -1.00 0.00 0.00 179.01 177.62 1h67 n ASN 114 N -2.61 -4.95 -0.07 1.42 4.13 -0.62 -4.92 115.26 107.64 1h67 n ASN 114 Ca 0.04 -0.14 -0.22 0.00 1.68 0.00 0.00 54.58 55.93 1h67 n ASN 114 Cb 0.40 -3.91 -0.12 0.00 -1.54 0.00 0.00 39.78 34.61 1h67 n ASN 114 CO 0.00 0.00 0.00 1.07 0.28 0.00 0.00 177.26 178.61 1h67 n THR 115 N -4.14 1.62 -2.12 3.41 5.66 -0.72 -4.49 114.28 113.51 1h67 n THR 115 Ca -0.13 -0.37 -0.38 0.00 -3.05 0.00 0.00 64.05 60.12 1h67 n THR 115 Cb 0.61 -1.84 -0.00 0.00 -1.55 0.00 0.00 70.33 67.56 1h67 n THR 115 CO 0.00 0.00 0.00 0.59 -3.05 0.00 0.00 175.07 172.61 1h67 n ASN 116 N -3.93 7.54 -0.12 1.09 4.13 -1.18 -4.76 115.26 118.03 1h67 n ASN 116 Ca -0.37 -3.40 -0.05 0.00 1.68 0.00 0.00 54.58 52.44 1h67 n ASN 116 Cb 0.88 -1.25 0.03 0.00 -1.54 0.00 0.00 39.78 37.90 1h67 n ASN 116 CO 0.00 0.00 0.00 0.45 0.28 0.00 0.00 177.26 177.99 1h67 h HIS 117 N 4.06 0.01 -0.49 3.10 3.86 -1.84 -0.01 115.15 123.83 1h67 h HIS 117 Ca 0.59 0.03 -0.02 0.00 -1.16 0.00 0.00 60.37 59.81 1h67 h HIS 117 Cb 0.34 0.06 -0.02 0.00 1.06 0.00 0.00 27.41 28.84 1h67 h HIS 117 CO 1.45 -0.06 0.24 1.15 0.86 0.00 0.00 177.93 181.57 1h67 h THR 118 N 0.13 1.19 -0.59 2.45 2.02 -1.98 -2.66 112.91 113.47 1h67 h THR 118 Ca 0.19 -0.54 -0.01 0.00 0.77 0.00 0.00 66.41 66.83 1h67 h THR 118 Cb 0.27 0.64 -0.03 0.00 -1.74 0.00 0.00 68.15 67.29 1h67 h THR 118 CO -0.31 0.21 0.34 -0.61 0.37 0.00 0.00 175.52 175.52 1h67 h GLN 119 N 0.65 0.80 -0.43 6.66 5.75 -1.78 -2.58 115.11 124.16 1h67 h GLN 119 Ca 0.17 -0.07 0.08 0.00 -0.15 0.00 0.00 58.65 58.67 1h67 h GLN 119 Cb 0.12 -0.17 -0.07 0.00 1.07 0.00 0.00 27.48 28.43 1h67 h GLN 119 CO -0.02 0.57 0.04 0.28 -2.65 0.00 0.00 178.83 177.05 1h67 h VAL 120 N 0.81 0.71 -0.43 2.39 2.07 -0.65 -0.53 116.25 120.62 1h67 h VAL 120 Ca 0.21 -0.05 -0.11 0.00 0.82 0.00 0.00 66.70 67.56 1h67 h VAL 120 Cb -0.01 0.54 -0.01 0.00 -1.52 0.00 0.00 31.29 30.29 1h67 h VAL 120 CO -0.04 0.03 -0.17 1.56 0.02 0.00 0.00 177.57 178.97 1h67 h GLN 121 N 0.16 0.88 -0.62 1.57 4.20 -1.49 -3.03 115.11 116.78 1h67 h GLN 121 Ca 0.22 -0.37 0.05 0.00 0.06 0.00 0.00 58.65 58.61 1h67 h GLN 121 Cb 0.30 -0.03 -0.05 0.00 0.30 0.00 0.00 27.48 27.99 1h67 h GLN 121 CO -0.32 1.01 0.35 0.77 -0.67 0.00 0.00 178.83 179.97 1h67 h SER 122 N 0.71 0.53 -0.37 1.46 0.02 -1.02 -2.12 113.55 112.75 1h67 h SER 122 Ca 0.10 0.02 0.01 0.00 -0.84 0.00 0.00 61.79 61.08 1h67 h SER 122 Cb 0.73 -0.08 -0.02 0.00 0.14 0.00 0.00 62.40 63.17 1h67 h SER 122 CO 0.06 0.35 0.23 0.74 -1.14 0.00 0.00 176.83 177.07 1h67 h THR 123 N 0.66 1.07 -0.81 -2.27 2.02 -1.07 -2.46 112.91 110.05 1h67 h THR 123 Ca 0.27 -0.16 0.05 0.00 0.77 0.00 0.00 66.41 67.34 1h67 h THR 123 Cb 0.14 0.56 -0.06 0.00 -1.74 0.00 0.00 68.15 67.05 1h67 h THR 123 CO -0.16 0.09 0.50 -0.07 0.37 0.00 0.00 175.52 176.25 1h67 h LEU 124 N 0.47 0.79 -0.78 2.58 3.38 -1.34 -1.90 115.31 118.51 1h67 h LEU 124 Ca 0.14 0.01 0.06 0.00 0.09 0.00 0.00 57.88 58.19 1h67 h LEU 124 Cb -0.03 -0.15 -0.06 0.00 0.09 0.00 0.00 40.66 40.51 1h67 h LEU 124 CO -0.05 0.52 0.47 0.40 0.09 0.00 0.00 178.44 179.87 1h67 h ILE 125 N 0.93 1.01 -0.78 1.22 2.04 -0.95 -1.87 117.51 119.11 1h67 h ILE 125 Ca 0.35 -0.29 0.02 0.00 1.00 0.00 0.00 64.86 65.93 1h67 h ILE 125 Cb 0.13 0.08 -0.04 0.00 -0.74 0.00 0.00 36.82 36.24 1h67 h ILE 125 CO -0.16 0.16 0.50 0.00 0.00 0.00 0.00 178.15 178.65 1h67 h ALA 126 N 1.38 1.00 -0.64 1.87 0.00 -0.99 -2.40 119.26 119.49 1h67 h ALA 126 Ca 0.35 -0.04 0.01 0.00 0.00 0.00 0.00 54.91 55.22 1h67 h ALA 126 Cb 0.18 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 17.66 1h67 h ALA 126 CO -0.18 0.34 0.42 1.25 0.00 0.00 0.00 179.25 181.09 1h67 h LEU 127 N 1.00 0.73 -0.44 0.00 5.85 -1.04 -2.18 115.31 119.23 1h67 h LEU 127 Ca 0.30 -0.02 0.02 0.00 0.84 0.00 0.00 57.88 59.02 1h67 h LEU 127 Cb -0.04 -0.18 -0.03 0.00 0.37 0.00 0.00 40.66 40.77 1h67 h LEU 127 CO -0.09 0.53 0.26 0.00 -0.34 0.00 0.00 178.44 178.80 1h67 h ALA 128 N 1.23 0.56 -0.77 1.25 0.00 -0.98 -1.82 119.26 118.74 1h67 h ALA 128 Ca 0.23 -0.01 0.02 0.00 0.00 0.00 0.00 54.91 55.16 1h67 h ALA 128 Cb -0.10 -0.12 -0.04 0.00 0.00 0.00 0.00 17.79 17.53 1h67 h ALA 128 CO -0.05 -0.06 0.51 0.77 0.00 0.00 0.00 179.25 180.42 1h67 h SER 129 N 0.52 0.85 -0.24 0.00 0.02 -1.12 -2.06 113.55 111.53 1h67 h SER 129 Ca 0.18 -0.02 -0.02 0.00 -0.84 0.00 0.00 61.79 61.09 1h67 h SER 129 Cb 0.02 -0.21 -0.01 0.00 0.14 0.00 0.00 62.40 62.34 1h67 h SER 129 CO -0.09 0.61 0.07 -0.61 -1.14 0.00 0.00 176.83 175.68 1h67 h GLN 130 N 1.00 0.38 -0.74 3.45 5.75 -0.75 -3.11 115.11 121.09 1h67 h GLN 130 Ca 0.29 -0.08 -0.01 0.00 -0.15 0.00 0.00 58.65 58.70 1h67 h GLN 130 Cb -0.05 -0.05 -0.04 0.00 1.07 0.00 0.00 27.48 28.41 1h67 h GLN 130 CO -0.07 0.46 0.43 0.00 -2.65 0.00 0.00 178.83 177.00 1h67 h ALA 131 N 0.90 0.95 0.00 3.38 0.00 -0.91 -3.01 119.26 120.57 1h67 h ALA 131 Ca 0.08 -0.10 -0.06 0.00 0.00 0.00 0.00 54.91 54.83 1h67 h ALA 131 Cb 0.24 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.71 1h67 h ALA 131 CO -0.00 0.44 -0.09 0.36 0.00 0.00 0.00 179.25 179.95 1h67 n LYS 132 N -4.49 1.15 -2.35 0.00 2.85 -0.81 -3.34 118.16 111.17 1h67 n LYS 132 Ca 0.07 -0.32 -0.02 0.00 -1.05 0.00 0.00 58.31 56.98 1h67 n LYS 132 Cb 0.07 -1.41 -0.02 0.00 -0.65 0.00 0.00 35.03 33.02 1h67 n LYS 132 CO 0.00 0.00 0.00 -2.37 -0.05 0.00 0.00 177.40 174.98 1h67 n THR 133 N 1.98 0.00 -0.98 0.58 5.66 -1.14 -5.01 114.28 115.37 1h67 n THR 133 Ca 0.14 -0.40 0.00 0.00 -3.05 0.00 0.00 64.05 60.74 1h67 n THR 133 Cb 0.55 0.52 0.00 0.00 -1.55 0.00 0.00 70.33 69.85 1h67 n THR 133 CO 0.00 0.00 0.00 0.29 -3.05 0.00 0.00 175.07 172.31