#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 2.51 -1.80 2.12 -0.02 -1.26 -4.92 135.00 131.64 1h67 n PRO 28 Ca 0.00 0.89 -0.41 0.00 -2.02 0.00 0.00 63.50 61.96 1h67 n PRO 28 Cb 0.00 -2.64 -0.02 0.00 -0.02 0.00 0.00 33.50 30.83 1h67 n PRO 28 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 1h67 s GLN 29 N -0.58 4.14 0.00 -0.52 -1.52 -1.26 -4.86 119.66 115.06 1h67 s GLN 29 Ca 0.64 2.55 0.00 0.00 -1.95 0.00 0.00 55.36 56.60 1h67 s GLN 29 Cb -0.54 -3.03 0.00 0.00 -0.22 0.00 0.00 33.01 29.22 1h67 s GLN 29 CO 0.50 -0.61 1.35 0.25 -0.25 0.00 0.00 175.29 176.53 1h67 n THR 30 N 2.19 1.35 0.00 -0.19 -2.24 -1.26 -3.96 114.28 110.17 1h67 n THR 30 Ca 0.08 -0.20 0.00 0.00 -2.27 0.00 0.00 64.05 61.66 1h67 n THR 30 Cb 0.38 -1.19 0.00 0.00 -2.10 0.00 0.00 70.33 67.42 1h67 n THR 30 CO 0.00 0.00 0.00 -1.84 -0.57 0.00 0.00 175.07 172.66 1h67 n GLU 31 N 0.95 0.00 -2.31 -0.78 -0.00 -1.26 -5.01 120.64 112.24 1h67 n GLU 31 Ca 0.00 0.00 -0.29 0.00 -0.00 0.00 0.00 57.16 56.87 1h67 n GLU 31 Cb 0.47 0.00 0.00 0.00 -0.00 0.00 0.00 31.44 31.92 1h67 n GLU 31 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.13 177.63 1h67 s ARG 32 N 0.00 3.58 0.00 3.44 3.52 -1.25 -4.03 118.95 124.20 1h67 s ARG 32 Ca 0.00 0.45 0.00 0.00 -0.13 0.00 0.00 55.73 56.05 1h67 s ARG 32 Cb 0.00 -2.25 0.00 0.00 -1.56 0.00 0.00 34.95 31.14 1h67 s ARG 32 CO 0.00 -0.36 0.00 0.94 -0.81 0.00 0.00 175.30 175.07 1h67 n GLN 33 N -2.44 0.00 0.13 5.12 7.27 -1.26 -4.15 117.38 122.05 1h67 n GLN 33 Ca 0.03 0.00 -0.14 0.00 0.07 0.00 0.00 57.00 56.96 1h67 n GLN 33 Cb 0.55 -0.32 -0.08 0.00 2.41 0.00 0.00 30.24 32.80 1h67 n GLN 33 CO 0.00 0.00 0.00 -0.07 0.07 0.00 0.00 177.06 177.06 1h67 h LEU 34 N 0.00 -0.22 -0.25 1.69 3.38 -1.84 0.18 115.31 118.25 1h67 h LEU 34 Ca 0.00 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.98 1h67 h LEU 34 Cb 0.00 0.06 -0.01 0.00 0.09 0.00 0.00 40.66 40.80 1h67 h LEU 34 CO 0.00 -0.16 0.16 -0.09 0.09 0.00 0.00 178.44 178.45 1h67 h ARG 35 N -0.26 0.32 -0.87 1.13 2.43 -1.84 0.12 114.38 115.42 1h67 h ARG 35 Ca -0.02 -0.02 -0.00 0.00 -0.81 0.00 0.00 59.98 59.12 1h67 h ARG 35 Cb 0.20 -0.07 -0.04 0.00 -0.42 0.00 0.00 29.97 29.63 1h67 h ARG 35 CO 0.04 0.21 0.53 0.28 -1.51 0.00 0.00 179.97 179.52 1h67 h VAL 36 N 0.33 1.24 0.40 0.20 2.07 -1.90 -2.07 116.25 116.52 1h67 h VAL 36 Ca 0.09 -0.51 -0.02 0.00 0.82 0.00 0.00 66.70 67.08 1h67 h VAL 36 Cb -0.04 0.01 0.00 0.00 -1.52 0.00 0.00 31.29 29.75 1h67 h VAL 36 CO -0.02 0.25 -0.19 -0.25 0.02 0.00 0.00 177.57 177.37 1h67 h TRP 37 N 1.19 -0.50 -0.55 1.57 7.01 -0.18 0.38 115.95 124.87 1h67 h TRP 37 Ca 0.31 -0.01 0.11 0.00 2.11 0.00 0.00 58.89 61.41 1h67 h TRP 37 Cb -0.06 0.17 -0.11 0.00 -2.10 0.00 0.00 29.16 27.06 1h67 h TRP 37 CO 0.00 -0.31 -0.15 0.82 -2.79 0.00 0.00 178.44 176.01 1h67 h ILE 38 N -0.78 0.42 -0.31 2.65 1.08 -1.00 0.13 117.51 119.72 1h67 h ILE 38 Ca -0.06 0.00 -0.06 0.00 -0.39 0.00 0.00 64.86 64.35 1h67 h ILE 38 Cb 0.42 0.42 -0.01 0.00 -3.07 0.00 0.00 36.82 34.58 1h67 h ILE 38 CO 0.09 0.00 -0.06 -0.33 -0.69 0.00 0.00 178.15 177.16 1h67 h GLU 39 N -0.02 0.58 -0.58 2.37 5.08 -1.48 -3.11 114.58 117.43 1h67 h GLU 39 Ca 0.26 -0.22 0.01 0.00 -1.00 0.00 0.00 59.36 58.41 1h67 h GLU 39 Cb 0.42 -0.04 -0.03 0.00 0.50 0.00 0.00 28.75 29.61 1h67 h GLU 39 CO -0.58 0.76 0.38 0.78 -1.00 0.00 0.00 179.01 179.35 1h67 h GLY 40 N 0.35 0.81 0.15 -3.84 0.00 0.01 0.29 103.07 100.83 1h67 h GLY 40 Ca 0.08 -0.30 -0.01 0.00 0.00 0.00 0.00 47.33 47.10 1h67 h GLY 40 CO 0.03 0.30 -0.10 0.00 0.00 0.00 0.00 176.54 176.76 1h67 h ALA 41 N 1.64 -0.93 0.00 3.60 0.00 -0.70 -3.39 119.26 119.47 1h67 h ALA 41 Ca 0.21 -0.05 -0.04 0.00 0.00 0.00 0.00 54.91 55.03 1h67 h ALA 41 Cb -0.09 0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 1h67 h ALA 41 CO -0.05 -0.93 -0.52 1.79 0.00 0.00 0.00 179.25 179.55 1h67 h THR 42 N -0.24 0.29 0.00 0.00 1.35 -1.60 -3.50 112.91 109.21 1h67 h THR 42 Ca -0.02 -1.31 0.00 0.00 -0.55 0.00 0.00 66.41 64.53 1h67 h THR 42 Cb 0.19 0.64 0.00 0.00 -1.73 0.00 0.00 68.15 67.25 1h67 h THR 42 CO 0.01 0.10 0.00 0.61 -0.25 0.00 0.00 175.52 175.99 1h67 n GLY 43 N 1.61 0.80 2.96 5.82 0.00 0.10 -5.10 105.19 111.38 1h67 n GLY 43 Ca -0.11 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.69 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 1.26 0.08 1.61 1.81 -1.22 -5.05 118.95 117.43 1h67 s ARG 44 Ca 0.00 -0.26 -0.30 0.00 -1.72 0.00 0.00 55.73 53.45 1h67 s ARG 44 Cb 0.00 -1.11 -0.06 0.00 -0.45 0.00 0.00 34.95 33.33 1h67 s ARG 44 CO 0.00 -0.03 1.19 1.03 -0.68 0.00 0.00 175.30 176.81 1h67 s ARG 45 N 0.79 4.45 0.13 3.54 1.81 -1.26 -4.34 118.95 124.06 1h67 s ARG 45 Ca -0.13 1.77 -0.24 0.00 -1.72 0.00 0.00 55.73 55.41 1h67 s ARG 45 Cb -0.15 -3.34 -0.03 0.00 -0.45 0.00 0.00 34.95 30.98 1h67 s ARG 45 CO 0.02 -0.22 1.64 0.82 -0.68 0.00 0.00 175.30 176.88 1h67 h ILE 46 N 4.41 0.46 0.00 1.52 1.08 -1.94 -3.49 117.51 119.55 1h67 h ILE 46 Ca -0.42 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.05 1h67 h ILE 46 Cb 1.21 0.46 0.00 0.00 -3.07 0.00 0.00 36.82 35.42 1h67 h ILE 46 CO 0.80 0.00 0.00 0.61 -0.69 0.00 0.00 178.15 178.87 1h67 n GLY 47 N -1.36 0.50 0.07 5.37 0.00 -1.26 -4.70 105.19 103.82 1h67 n GLY 47 Ca -0.04 -1.36 -0.07 0.00 0.00 0.00 0.00 46.02 44.55 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 -0.03 -2.93 1.61 3.32 -1.97 -3.45 116.42 112.97 1h67 h ASP 48 Ca 0.00 -0.45 -0.63 0.00 0.02 0.00 0.00 57.03 55.97 1h67 h ASP 48 Cb 0.00 0.01 -0.08 0.00 0.22 0.00 0.00 39.33 39.48 1h67 h ASP 48 CO 0.00 0.67 -0.39 0.21 -1.72 0.00 0.00 179.24 178.02 1h67 s ASN 49 N -5.80 6.48 0.03 6.45 3.84 -1.26 -5.01 114.94 119.66 1h67 s ASN 49 Ca -0.09 0.56 -0.24 0.00 0.21 0.00 0.00 52.86 53.30 1h67 s ASN 49 Cb -0.01 -2.14 -0.17 0.00 -0.55 0.00 0.00 41.25 38.38 1h67 s ASN 49 CO 0.34 0.30 1.45 0.15 -2.79 0.00 0.00 177.10 176.56 1h67 h PHE 50 N 5.45 0.07 0.16 0.43 3.57 -1.93 0.12 116.94 124.80 1h67 h PHE 50 Ca -0.50 -0.01 -0.01 0.00 3.53 0.00 0.00 57.97 60.98 1h67 h PHE 50 Cb 1.21 -0.02 0.00 0.00 2.79 0.00 0.00 35.95 39.93 1h67 h PHE 50 CO 0.70 0.35 -0.08 0.52 -2.23 0.00 0.00 178.31 177.57 1h67 h MET 51 N -0.23 -0.21 -0.49 1.11 0.00 -1.99 -3.27 114.93 109.85 1h67 h MET 51 Ca 0.01 0.01 0.02 0.00 0.00 0.00 0.00 59.70 59.74 1h67 h MET 51 Cb 0.32 0.05 -0.03 0.00 0.00 0.00 0.00 31.60 31.94 1h67 h MET 51 CO 0.00 0.22 0.32 -0.44 0.00 0.00 0.00 176.91 177.02 1h67 h ASP 52 N -0.83 0.51 0.00 1.22 3.32 -1.95 -2.65 116.42 116.05 1h67 h ASP 52 Ca -0.02 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.02 1h67 h ASP 52 Cb 0.53 -0.12 0.00 0.00 0.22 0.00 0.00 39.33 39.95 1h67 h ASP 52 CO 0.04 0.36 0.00 0.61 -1.72 0.00 0.00 179.24 178.53 1h67 n GLY 53 N -1.47 1.82 0.00 2.75 0.00 0.41 -2.39 105.19 106.31 1h67 n GLY 53 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.07 1h67 n GLY 53 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1h67 n LEU 54 N 1.21 0.00 -0.28 0.99 4.77 -1.00 -4.73 117.00 117.95 1h67 n LEU 54 Ca 0.00 0.00 0.18 0.00 -0.03 0.00 0.00 56.01 56.16 1h67 n LEU 54 Cb 0.38 0.00 0.46 0.00 -2.33 0.00 0.00 43.42 41.93 1h67 n LEU 54 CO 0.00 0.00 1.22 0.11 -1.33 0.00 0.00 177.39 177.39 1h67 h LYS 55 N 0.00 0.49 -0.90 3.23 1.57 -1.63 0.12 116.57 119.45 1h67 h LYS 55 Ca 0.00 -0.03 0.09 0.00 -1.87 0.00 0.00 60.65 58.84 1h67 h LYS 55 Cb 0.08 -0.11 -0.06 0.00 0.08 0.00 0.00 32.23 32.22 1h67 h LYS 55 CO 0.00 0.33 0.58 0.38 -0.57 0.00 0.00 179.45 180.17 1h67 h ASP 56 N 0.51 0.85 -4.43 0.86 2.03 -1.87 -3.44 116.42 110.93 1h67 h ASP 56 Ca 0.51 0.02 -0.36 0.00 -0.73 0.00 0.00 57.03 56.47 1h67 h ASP 56 Cb 1.14 -0.16 0.08 0.00 -0.83 0.00 0.00 39.33 39.56 1h67 h ASP 56 CO -0.24 0.51 -0.56 0.61 -1.03 0.00 0.00 179.24 178.52 1h67 n GLY 57 N -1.40 -0.40 0.40 7.15 0.00 0.42 -4.40 105.19 106.97 1h67 n GLY 57 Ca 0.15 0.07 -0.14 0.00 0.00 0.00 0.00 46.02 46.10 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 -4.50 1.22 -0.20 1.61 0.31 -1.26 -3.74 118.33 111.77 1h67 n VAL 58 Ca -0.07 -0.04 -0.07 0.00 -0.01 0.00 0.00 64.34 64.15 1h67 n VAL 58 Cb 0.59 -1.93 0.03 0.00 -0.91 0.00 0.00 33.84 31.62 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 -0.69 1.21 -0.45 2.52 2.04 -1.94 0.10 117.51 120.30 1h67 h ILE 59 Ca -0.26 -0.59 -0.06 0.00 1.00 0.00 0.00 64.86 64.96 1h67 h ILE 59 Cb 1.08 0.54 -0.02 0.00 -0.74 0.00 0.00 36.82 37.68 1h67 h ILE 59 CO -0.16 0.24 0.06 -0.07 0.00 0.00 0.00 178.15 178.22 1h67 h LEU 60 N 0.77 0.72 -1.09 1.44 3.38 -1.93 0.72 115.31 119.33 1h67 h LEU 60 Ca 0.20 -0.27 0.06 0.00 0.09 0.00 0.00 57.88 57.95 1h67 h LEU 60 Cb 0.12 -0.19 -0.06 0.00 0.09 0.00 0.00 40.66 40.62 1h67 h LEU 60 CO -0.02 0.81 0.62 0.00 0.09 0.00 0.00 178.44 179.93 1h67 h GLU 62 N 1.12 0.54 0.54 0.00 4.39 -0.27 -1.65 114.58 119.25 1h67 h GLU 62 Ca 0.40 -0.24 -0.02 0.00 0.34 0.00 0.00 59.36 59.84 1h67 h GLU 62 Cb 0.14 -0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 28.76 1h67 h GLU 62 CO -0.15 0.80 -0.43 1.25 -1.16 0.00 0.00 179.01 179.32 1h67 h LEU 63 N 0.47 -1.15 -1.23 1.33 5.85 0.95 -2.73 115.31 118.80 1h67 h LEU 63 Ca 0.06 0.08 -0.07 0.00 0.84 0.00 0.00 57.88 58.79 1h67 h LEU 63 Cb 0.78 0.36 -0.01 0.00 0.37 0.00 0.00 40.66 42.17 1h67 h LEU 63 CO 0.06 -0.61 -0.21 -0.29 -0.34 0.00 0.00 178.44 177.05 1h67 h ILE 64 N -0.95 1.22 -0.95 4.05 6.09 -1.52 -2.52 117.51 122.93 1h67 h ILE 64 Ca -0.07 -1.04 0.27 0.00 -1.37 0.00 0.00 64.86 62.65 1h67 h ILE 64 Cb 0.79 1.35 -0.05 0.00 0.47 0.00 0.00 36.82 39.39 1h67 h ILE 64 CO 0.01 0.32 0.67 -1.13 -3.07 0.00 0.00 178.15 174.95 1h67 h ASN 65 N 0.24 0.08 0.01 2.19 -0.73 -1.00 0.64 115.58 117.00 1h67 h ASN 65 Ca 0.04 0.01 -0.00 0.00 1.87 0.00 0.00 56.30 58.22 1h67 h ASN 65 Cb 0.52 -0.00 0.00 0.00 0.27 0.00 0.00 38.32 39.11 1h67 h ASN 65 CO 0.04 0.02 -0.00 0.11 -0.37 0.00 0.00 177.43 177.23 1h67 h LYS 66 N 0.07 -0.01 0.62 6.67 1.79 -1.20 -3.39 116.57 121.12 1h67 h LYS 66 Ca 0.46 0.00 -0.03 0.00 -2.18 0.00 0.00 60.65 58.90 1h67 h LYS 66 Cb 1.72 0.00 0.01 0.00 -1.58 0.00 0.00 32.23 32.38 1h67 h LYS 66 CO -0.05 0.78 -0.30 -0.07 -1.08 0.00 0.00 179.45 178.74 1h67 h LEU 67 N -0.97 -0.70 -9.01 2.94 3.38 -1.25 -3.42 115.31 106.28 1h67 h LEU 67 Ca -0.00 -0.01 -0.61 0.00 0.09 0.00 0.00 57.88 57.36 1h67 h LEU 67 Cb 0.79 0.18 -0.11 0.00 0.09 0.00 0.00 40.66 41.61 1h67 h LEU 67 CO 0.00 -0.32 0.09 -1.58 0.09 0.00 0.00 178.44 176.72 1h67 s GLN 68 N -4.53 4.12 0.01 1.13 0.74 0.21 -5.02 119.66 116.32 1h67 s GLN 68 Ca -0.13 0.48 -0.36 0.00 0.05 0.00 0.00 55.36 55.40 1h67 s GLN 68 Cb 0.01 -3.64 -0.14 0.00 1.10 0.00 0.00 33.01 30.35 1h67 s GLN 68 CO 0.42 -0.36 1.62 -2.30 -0.55 0.00 0.00 175.29 174.12 1h67 n PRO 69 N 5.52 1.74 -3.76 1.67 -0.02 -1.26 -2.32 135.00 136.57 1h67 n PRO 69 Ca -0.02 0.63 -0.23 0.00 -2.02 0.00 0.00 63.50 61.86 1h67 n PRO 69 Cb 0.49 -2.37 0.02 0.00 -0.02 0.00 0.00 33.50 31.62 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 3.56 -0.30 0.22 -1.23 0.00 -1.26 -4.89 105.19 101.28 1h67 n GLY 70 Ca 0.20 0.13 -0.09 0.00 0.00 0.00 0.00 46.02 46.27 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 -1.88 0.65 -3.62 1.61 0.02 -1.68 -3.43 113.55 105.22 1h67 h SER 71 Ca -0.61 -0.20 -0.34 0.00 -0.84 0.00 0.00 61.79 59.81 1h67 h SER 71 Cb 1.36 -0.17 -0.32 0.00 0.14 0.00 0.00 62.40 63.41 1h67 h SER 71 CO 0.58 0.68 -0.75 -0.69 -1.14 0.00 0.00 176.83 175.51 1h67 s VAL 72 N -5.44 0.27 0.00 2.27 1.01 -1.26 -4.73 120.40 112.51 1h67 s VAL 72 Ca -0.13 -0.03 0.00 0.00 0.00 0.00 0.00 61.98 61.82 1h67 s VAL 72 Cb 0.11 -0.30 0.00 0.00 0.00 0.00 0.00 36.38 36.18 1h67 s VAL 72 CO 0.77 0.13 0.00 0.00 0.00 0.00 0.00 175.10 176.00 1h67 n GLN 73 N 3.70 3.05 -1.80 2.72 6.02 -1.26 -4.80 117.38 125.01 1h67 n GLN 73 Ca -0.22 0.00 -0.42 0.00 -0.01 0.00 0.00 57.00 56.35 1h67 n GLN 73 Cb 0.53 0.00 -0.03 0.00 1.02 0.00 0.00 30.24 31.76 1h67 n GLN 73 CO 0.00 0.00 0.00 0.15 -1.01 0.00 0.00 177.06 176.20 1h67 s LYS 74 N 0.00 4.08 -0.14 -1.09 1.02 -1.26 -4.93 119.74 117.41 1h67 s LYS 74 Ca 0.00 2.39 -0.29 0.00 0.02 0.00 0.00 55.97 58.09 1h67 s LYS 74 Cb 0.00 -4.11 -0.01 0.00 -0.52 0.00 0.00 37.83 33.19 1h67 s LYS 74 CO 0.00 -1.01 1.12 0.08 -0.92 0.00 0.00 175.35 174.62 1h67 s VAL 75 N 4.59 4.52 0.03 3.17 1.01 -1.26 -5.01 120.40 127.45 1h67 s VAL 75 Ca 0.83 1.82 -0.27 0.00 0.00 0.00 0.00 61.98 64.37 1h67 s VAL 75 Cb -0.38 -4.18 -0.04 0.00 0.00 0.00 0.00 36.38 31.78 1h67 s VAL 75 CO 0.37 -0.08 0.86 0.20 0.00 0.00 0.00 175.10 176.45 1h67 s ASN 76 N 1.40 7.29 -0.02 3.32 0.01 -1.26 -5.00 114.94 120.67 1h67 s ASN 76 Ca 0.50 1.55 -0.30 0.00 -0.71 0.00 0.00 52.86 53.90 1h67 s ASN 76 Cb -0.20 -2.52 -0.06 0.00 0.41 0.00 0.00 41.25 38.89 1h67 s ASN 76 CO 0.15 -0.11 1.61 -1.81 -1.51 0.00 0.00 177.10 175.43 1h67 s ASP 77 N 0.44 6.68 -0.14 -1.22 1.01 -1.26 -4.78 116.67 117.40 1h67 s ASP 77 Ca 0.44 2.26 -0.29 0.00 0.71 0.00 0.00 52.55 55.67 1h67 s ASP 77 Cb -0.21 -2.54 -0.04 0.00 1.01 0.00 0.00 42.92 41.14 1h67 s ASP 77 CO 0.25 -0.89 1.64 -2.16 0.21 0.00 0.00 175.17 174.23 1h67 s PRO 78 N 3.53 3.97 0.36 8.23 0.04 -1.26 -4.68 135.00 145.19 1h67 s PRO 78 Ca 0.72 1.93 0.00 0.00 0.04 0.00 0.00 61.00 63.69 1h67 s PRO 78 Cb -0.34 -4.01 0.00 0.00 0.04 0.00 0.00 34.50 30.18 1h67 s PRO 78 CO 0.29 -1.09 0.00 0.28 0.04 0.00 0.00 177.00 176.52 1h67 n VAL 79 N 5.98 0.00 0.00 -0.36 0.31 -1.26 -5.06 118.33 117.94 1h67 n VAL 79 Ca 0.18 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.51 1h67 n VAL 79 Cb 0.44 -0.15 0.00 0.00 -0.91 0.00 0.00 33.84 33.22 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 -3.33 1.05 -2.66 5.55 6.02 -1.26 -5.01 117.38 117.74 1h67 n GLN 80 Ca 0.00 0.00 -0.09 0.00 -0.01 0.00 0.00 57.00 56.90 1h67 n GLN 80 Cb 0.00 0.00 0.03 0.00 1.02 0.00 0.00 30.24 31.29 1h67 n GLN 80 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 1h67 n ASN 81 N 0.00 1.66 0.00 1.08 4.13 -1.26 -4.83 115.26 116.04 1h67 n ASN 81 Ca 0.00 -2.70 0.00 0.00 1.68 0.00 0.00 54.58 53.56 1h67 n ASN 81 Cb 0.00 -0.52 0.00 0.00 -1.54 0.00 0.00 39.78 37.72 1h67 n ASN 81 CO 0.00 0.00 0.00 -2.67 0.28 0.00 0.00 177.26 174.87 1h67 n TRP 82 N -0.14 0.00 -0.21 3.10 4.27 -1.26 -4.87 117.44 118.33 1h67 n TRP 82 Ca 0.11 0.00 -0.01 0.00 -3.89 0.00 0.00 57.50 53.71 1h67 n TRP 82 Cb 0.81 0.00 0.10 0.00 -1.36 0.00 0.00 31.31 30.86 1h67 n TRP 82 CO 0.00 0.00 0.00 0.45 -2.29 0.00 0.00 177.69 175.85 1h67 h HIS 83 N 0.00 0.48 -0.60 -2.67 3.86 -1.88 -1.00 115.15 113.35 1h67 h HIS 83 Ca 0.00 0.03 -0.06 0.00 -1.16 0.00 0.00 60.37 59.18 1h67 h HIS 83 Cb 0.00 -0.12 -0.03 0.00 1.06 0.00 0.00 27.41 28.32 1h67 h HIS 83 CO 0.00 0.17 0.14 0.87 0.86 0.00 0.00 177.93 179.97 1h67 h LYS 84 N 0.49 0.93 -0.96 2.45 1.57 -1.86 -1.84 116.57 117.34 1h67 h LYS 84 Ca 0.30 -0.20 0.12 0.00 -1.87 0.00 0.00 60.65 59.00 1h67 h LYS 84 Cb 0.31 -0.13 -0.08 0.00 0.08 0.00 0.00 32.23 32.41 1h67 h LYS 84 CO -0.26 0.83 0.59 -0.07 -0.57 0.00 0.00 179.45 179.98 1h67 h LEU 85 N 0.89 0.85 0.08 2.94 3.38 -1.48 0.19 115.31 122.16 1h67 h LEU 85 Ca 0.19 0.05 -0.21 0.00 0.09 0.00 0.00 57.88 58.00 1h67 h LEU 85 Cb 0.33 -0.11 0.02 0.00 0.09 0.00 0.00 40.66 40.99 1h67 h LEU 85 CO 0.00 0.44 -0.88 -0.08 0.09 0.00 0.00 178.44 178.01 1h67 h GLU 86 N 0.92 0.46 -0.97 1.13 4.81 -1.20 -2.46 114.58 117.28 1h67 h GLU 86 Ca 0.48 -0.60 0.08 0.00 -0.13 0.00 0.00 59.36 59.19 1h67 h GLU 86 Cb 0.51 0.20 -0.07 0.00 0.63 0.00 0.00 28.75 30.01 1h67 h GLU 86 CO -0.28 1.24 0.62 -0.91 -0.73 0.00 0.00 179.01 178.96 1h67 h ASN 87 N -0.03 0.97 -0.07 1.04 -0.26 -0.67 -1.91 115.58 114.64 1h67 h ASN 87 Ca -0.13 0.02 -0.14 0.00 -0.56 0.00 0.00 56.30 55.48 1h67 h ASN 87 Cb 1.61 -0.19 0.01 0.00 -1.06 0.00 0.00 38.32 38.69 1h67 h ASN 87 CO 0.17 0.60 -0.50 0.40 -1.06 0.00 0.00 177.43 177.04 1h67 h ILE 88 N 1.08 1.39 0.05 2.81 2.04 -0.70 -3.07 117.51 121.11 1h67 h ILE 88 Ca 0.43 -1.87 0.02 0.00 1.00 0.00 0.00 64.86 64.44 1h67 h ILE 88 Cb 0.25 2.31 -0.03 0.00 -0.74 0.00 0.00 36.82 38.60 1h67 h ILE 88 CO -0.18 0.55 -0.19 1.23 0.00 0.00 0.00 178.15 179.56 1h67 h GLY 89 N 0.03 -0.31 0.93 5.37 0.00 -0.97 -0.44 103.07 107.68 1h67 h GLY 89 Ca -0.04 0.23 0.02 0.00 0.00 0.00 0.00 47.33 47.54 1h67 h GLY 89 CO 0.10 -0.18 0.59 3.43 0.00 0.00 0.00 176.54 180.48 1h67 h ASN 90 N -0.34 0.99 0.26 0.19 2.35 -1.48 0.14 115.58 117.69 1h67 h ASN 90 Ca 0.04 -0.01 -0.01 0.00 -0.55 0.00 0.00 56.30 55.77 1h67 h ASN 90 Cb 0.39 -0.23 0.00 0.00 0.05 0.00 0.00 38.32 38.53 1h67 h ASN 90 CO -0.15 0.70 -0.12 0.15 -1.65 0.00 0.00 177.43 176.35 1h67 h PHE 91 N 1.16 -0.32 -0.35 1.19 3.57 -1.37 -1.55 116.94 119.27 1h67 h PHE 91 Ca 0.35 -0.01 -0.05 0.00 3.53 0.00 0.00 57.97 61.79 1h67 h PHE 91 Cb -0.05 0.11 -0.01 0.00 2.79 0.00 0.00 35.95 38.78 1h67 h PHE 91 CO -0.01 -0.09 0.02 -0.07 -2.23 0.00 0.00 178.31 175.92 1h67 h LEU 92 N -0.51 0.60 -0.62 0.59 3.38 -0.96 -1.26 115.31 116.53 1h67 h LEU 92 Ca -0.04 -0.30 0.02 0.00 0.09 0.00 0.00 57.88 57.65 1h67 h LEU 92 Cb 0.38 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 40.94 1h67 h LEU 92 CO 0.06 0.74 0.40 0.03 0.09 0.00 0.00 178.44 179.76 1h67 h ARG 93 N 0.43 0.78 -0.21 1.13 3.08 -1.00 0.40 114.38 118.98 1h67 h ARG 93 Ca 0.10 -0.05 -0.02 0.00 0.07 0.00 0.00 59.98 60.09 1h67 h ARG 93 Cb 0.43 -0.18 -0.01 0.00 0.08 0.00 0.00 29.97 30.30 1h67 h ARG 93 CO 0.01 0.51 0.07 0.00 -1.07 0.00 0.00 179.97 179.50 1h67 h ALA 94 N 1.25 0.28 -0.28 0.04 0.00 -1.17 -2.67 119.26 116.70 1h67 h ALA 94 Ca 0.24 -0.13 -0.18 0.00 0.00 0.00 0.00 54.91 54.83 1h67 h ALA 94 Cb -0.04 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 17.67 1h67 h ALA 94 CO -0.07 -0.10 -0.55 -0.84 0.00 0.00 0.00 179.25 177.69 1h67 h ILE 95 N 0.18 1.28 -0.96 0.00 3.07 -0.97 0.40 117.51 120.50 1h67 h ILE 95 Ca 0.07 -1.73 0.08 0.00 1.55 0.00 0.00 64.86 64.83 1h67 h ILE 95 Cb 0.22 1.64 -0.07 0.00 -0.27 0.00 0.00 36.82 38.34 1h67 h ILE 95 CO -0.00 0.56 0.61 0.50 -1.05 0.00 0.00 178.15 178.77 1h67 h LYS 96 N 0.65 1.02 0.00 0.16 3.64 -0.19 -2.01 116.57 119.84 1h67 h LYS 96 Ca 0.01 -0.06 -0.24 0.00 -1.27 0.00 0.00 60.65 59.09 1h67 h LYS 96 Cb 1.15 -0.23 -0.04 0.00 -0.41 0.00 0.00 32.23 32.70 1h67 h LYS 96 CO 0.12 0.68 -1.53 0.45 -2.27 0.00 0.00 179.45 176.90 1h67 h HIS 97 N 1.06 0.00 -0.82 1.91 3.86 -1.45 -3.37 115.15 116.34 1h67 h HIS 97 Ca 0.44 0.00 0.12 0.00 -1.16 0.00 0.00 60.37 59.77 1h67 h HIS 97 Cb 0.27 0.00 -0.08 0.00 1.06 0.00 0.00 27.41 28.66 1h67 h HIS 97 CO -0.01 0.87 0.43 -0.92 0.86 0.00 0.00 177.93 179.16 1h67 h TYR 98 N 0.00 0.77 0.00 2.45 3.20 0.51 -3.45 116.97 120.46 1h67 h TYR 98 Ca -0.22 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.68 1h67 h TYR 98 Cb 1.86 -0.22 0.00 0.00 1.54 0.00 0.00 36.73 39.90 1h67 h TYR 98 CO 0.00 0.24 0.00 0.41 -1.64 0.00 0.00 178.16 177.17 1h67 n GLY 99 N -1.32 0.36 3.65 1.82 0.00 -0.94 -5.06 105.19 103.70 1h67 n GLY 99 Ca 0.15 -0.03 -0.47 0.00 0.00 0.00 0.00 46.02 45.67 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 0.22 -1.82 1.61 0.31 -1.12 -4.89 118.33 112.65 1h67 n VAL 100 Ca 0.00 -0.06 -0.41 0.00 -0.01 0.00 0.00 64.34 63.86 1h67 n VAL 100 Cb 0.00 -1.33 -0.01 0.00 -0.91 0.00 0.00 33.84 31.59 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 0.50 4.14 0.23 5.55 1.02 -1.26 -4.50 119.74 125.42 1h67 s LYS 101 Ca 0.78 2.54 -0.06 0.00 0.02 0.00 0.00 55.97 59.24 1h67 s LYS 101 Cb -0.74 -3.01 0.34 0.00 -0.52 0.00 0.00 37.83 33.90 1h67 s LYS 101 CO 0.43 -0.55 1.82 -1.35 -0.92 0.00 0.00 175.35 174.78 1h67 h PRO 102 N 4.02 0.79 -0.84 -1.68 0.11 -1.90 -0.86 132.00 131.64 1h67 h PRO 102 Ca -0.49 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.58 1h67 h PRO 102 Cb 1.23 -0.18 0.00 0.00 0.11 0.00 0.00 31.00 32.16 1h67 h PRO 102 CO 0.72 0.52 0.00 0.72 -0.21 0.00 0.00 178.00 179.75 1h67 n HIS 103 N -4.72 0.00 -2.73 0.65 8.25 -1.26 -2.65 115.22 112.76 1h67 n HIS 103 Ca 0.12 -0.08 -0.01 0.00 -0.26 0.00 0.00 57.72 57.49 1h67 n HIS 103 Cb 0.22 -0.10 0.08 0.00 1.12 0.00 0.00 29.99 31.31 1h67 n HIS 103 CO 0.00 0.00 0.00 -0.25 0.64 0.00 0.00 176.34 176.73 1h67 n ASP 104 N 0.27 0.13 -3.73 0.41 9.92 -0.33 -5.10 116.55 118.12 1h67 n ASP 104 Ca 0.00 -2.11 -0.12 0.00 -0.53 0.00 0.00 54.79 52.03 1h67 n ASP 104 Cb 0.22 0.07 -0.12 0.00 -0.64 0.00 0.00 41.12 40.65 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 -1.82 -0.02 0.35 0.53 1.01 -1.08 -4.56 121.20 115.61 1h67 s ILE 105 Ca 0.18 0.08 -0.26 0.00 0.00 0.00 0.00 60.65 60.65 1h67 s ILE 105 Cb 0.37 -0.47 -0.09 0.00 0.01 0.00 0.00 42.46 42.28 1h67 s ILE 105 CO -0.08 0.03 1.07 0.72 0.00 0.00 0.00 174.94 176.68 1h67 s PHE 106 N 0.95 3.42 0.64 3.97 -0.12 -1.26 -5.03 117.98 120.54 1h67 s PHE 106 Ca -0.06 1.68 -0.04 0.00 -0.05 0.00 0.00 56.93 58.45 1h67 s PHE 106 Cb -0.07 -3.19 0.04 0.00 -0.63 0.00 0.00 43.02 39.18 1h67 s PHE 106 CO -0.07 -0.56 0.92 -1.21 -0.05 0.00 0.00 175.22 174.26 1h67 s GLU 107 N -2.02 2.43 0.62 1.99 2.02 -1.26 -4.89 118.70 117.59 1h67 s GLU 107 Ca 0.52 -0.35 0.28 0.00 0.02 0.00 0.00 54.97 55.44 1h67 s GLU 107 Cb -0.26 -2.28 1.46 0.00 0.10 0.00 0.00 34.13 33.15 1h67 s GLU 107 CO 0.33 -0.99 1.85 0.00 0.02 0.00 0.00 175.26 176.48 1h67 h ALA 108 N -0.33 1.86 0.10 5.21 0.00 -1.96 -0.57 119.26 123.57 1h67 h ALA 108 Ca -0.44 -0.01 -0.35 0.00 0.00 0.00 0.00 54.91 54.11 1h67 h ALA 108 Cb 1.30 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 19.09 1h67 h ALA 108 CO 0.58 -0.61 -1.95 0.27 0.00 0.00 0.00 179.25 177.55 1h67 n ASN 109 N -3.33 1.87 -0.33 0.00 0.23 -1.26 -2.59 115.26 109.85 1h67 n ASN 109 Ca 0.04 0.25 0.04 0.00 -0.53 0.00 0.00 54.58 54.38 1h67 n ASN 109 Cb 0.59 -0.69 0.19 0.00 -2.08 0.00 0.00 39.78 37.79 1h67 n ASN 109 CO 0.00 0.00 0.00 0.44 -0.93 0.00 0.00 177.26 176.77 1h67 h ASP 110 N 0.06 0.82 0.00 0.53 5.19 -1.44 0.61 116.42 122.19 1h67 h ASP 110 Ca -0.40 0.04 -0.06 0.00 -0.62 0.00 0.00 57.03 55.99 1h67 h ASP 110 Cb 2.03 -0.13 -0.01 0.00 0.18 0.00 0.00 39.33 41.41 1h67 h ASP 110 CO 0.09 0.47 -0.34 0.25 -3.12 0.00 0.00 179.24 176.59 1h67 h LEU 111 N 0.93 0.01 0.58 1.55 5.85 -1.67 -1.41 115.31 121.15 1h67 h LEU 111 Ca 0.43 -0.87 -0.03 0.00 0.84 0.00 0.00 57.88 58.25 1h67 h LEU 111 Cb 0.36 -0.00 0.01 0.00 0.37 0.00 0.00 40.66 41.39 1h67 h LEU 111 CO -0.24 1.13 -0.28 0.15 -0.34 0.00 0.00 178.44 178.87 1h67 h PHE 112 N -0.99 -0.72 0.00 1.25 3.57 -1.37 -3.03 116.94 115.64 1h67 h PHE 112 Ca -0.09 -0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.39 1h67 h PHE 112 Cb 1.09 0.24 0.00 0.00 2.79 0.00 0.00 35.95 40.07 1h67 h PHE 112 CO 0.23 -0.45 0.00 0.39 -2.23 0.00 0.00 178.31 176.25 1h67 n GLU 113 N -4.65 0.14 -3.28 1.11 1.02 0.21 -4.86 120.64 110.32 1h67 n GLU 113 Ca -0.10 0.14 -0.23 0.00 -0.02 0.00 0.00 57.16 56.95 1h67 n GLU 113 Cb 0.31 -1.50 0.05 0.00 -0.02 0.00 0.00 31.44 30.28 1h67 n GLU 113 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 1h67 n ASN 114 N -1.39 -6.07 -0.78 1.62 3.02 -0.91 -4.86 115.26 105.89 1h67 n ASN 114 Ca 0.07 -0.41 0.03 0.00 -0.03 0.00 0.00 54.58 54.24 1h67 n ASN 114 Cb 0.18 -4.85 0.13 0.00 -0.61 0.00 0.00 39.78 34.63 1h67 n ASN 114 CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 1h67 n THR 115 N -4.68 0.71 -2.65 3.41 -2.24 -0.58 -4.41 114.28 103.84 1h67 n THR 115 Ca -0.06 -0.44 -0.04 0.00 -2.27 0.00 0.00 64.05 61.25 1h67 n THR 115 Cb 0.59 -0.16 0.09 0.00 -2.10 0.00 0.00 70.33 68.75 1h67 n THR 115 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 1h67 n ASN 116 N 0.25 -1.00 -0.27 3.42 2.85 -1.15 -4.87 115.26 114.49 1h67 n ASN 116 Ca 0.10 -1.50 -0.03 0.00 -0.11 0.00 0.00 54.58 53.03 1h67 n ASN 116 Cb 0.43 0.60 0.08 0.00 1.24 0.00 0.00 39.78 42.13 1h67 n ASN 116 CO 0.00 0.00 0.00 0.45 -2.11 0.00 0.00 177.26 175.60 1h67 h HIS 117 N 2.81 0.92 -0.69 1.20 3.86 -1.77 -2.88 115.15 118.61 1h67 h HIS 117 Ca -0.27 0.02 0.15 0.00 -1.16 0.00 0.00 60.37 59.11 1h67 h HIS 117 Cb 1.24 -0.31 -0.11 0.00 1.06 0.00 0.00 27.41 29.29 1h67 h HIS 117 CO -0.17 0.55 0.06 1.15 0.86 0.00 0.00 177.93 180.39 1h67 h THR 118 N 0.97 0.46 -0.84 2.45 2.02 -1.96 -0.31 112.91 115.71 1h67 h THR 118 Ca 0.29 -0.06 -0.02 0.00 0.77 0.00 0.00 66.41 67.39 1h67 h THR 118 Cb -0.04 0.28 -0.04 0.00 -1.74 0.00 0.00 68.15 66.62 1h67 h THR 118 CO -0.09 0.03 0.43 -0.61 0.37 0.00 0.00 175.52 175.65 1h67 h GLN 119 N 0.17 1.18 -0.65 6.66 5.75 -1.93 -2.62 115.11 123.67 1h67 h GLN 119 Ca 0.38 -0.15 0.08 0.00 -0.15 0.00 0.00 58.65 58.81 1h67 h GLN 119 Cb 0.64 -0.22 -0.07 0.00 1.07 0.00 0.00 27.48 28.90 1h67 h GLN 119 CO -0.55 0.88 0.30 0.28 -2.65 0.00 0.00 178.83 177.09 1h67 h VAL 120 N 1.18 0.85 -0.17 2.39 2.07 -1.03 0.23 116.25 121.76 1h67 h VAL 120 Ca 0.29 -0.18 -0.03 0.00 0.82 0.00 0.00 66.70 67.60 1h67 h VAL 120 Cb 0.07 0.27 -0.01 0.00 -1.52 0.00 0.00 31.29 30.10 1h67 h VAL 120 CO -0.04 0.10 -0.01 -0.61 0.02 0.00 0.00 177.57 177.03 1h67 h GLN 121 N 0.53 0.31 -0.39 1.57 4.15 -1.24 -3.17 115.11 116.88 1h67 h GLN 121 Ca 0.31 -0.10 -0.08 0.00 0.77 0.00 0.00 58.65 59.55 1h67 h GLN 121 Cb 0.33 -0.03 -0.02 0.00 0.21 0.00 0.00 27.48 27.97 1h67 h GLN 121 CO -0.26 0.54 -0.09 1.03 -1.93 0.00 0.00 178.83 178.12 1h67 h SER 122 N 0.05 0.66 -0.70 -0.69 0.87 -1.10 -3.12 113.55 109.52 1h67 h SER 122 Ca 0.05 -0.18 0.13 0.00 -1.23 0.00 0.00 61.79 60.56 1h67 h SER 122 Cb 0.40 -0.18 -0.09 0.00 -0.44 0.00 0.00 62.40 62.10 1h67 h SER 122 CO 0.01 0.78 0.25 0.74 -0.53 0.00 0.00 176.83 178.09 1h67 h THR 123 N 0.62 0.67 -0.66 2.23 2.02 -0.51 -1.17 112.91 116.11 1h67 h THR 123 Ca 0.11 -0.14 0.03 0.00 0.77 0.00 0.00 66.41 67.19 1h67 h THR 123 Cb 0.52 0.24 -0.04 0.00 -1.74 0.00 0.00 68.15 67.13 1h67 h THR 123 CO 0.03 0.07 0.40 -0.07 0.37 0.00 0.00 175.52 176.33 1h67 h LEU 124 N 0.40 0.65 -0.75 2.58 3.38 -1.59 -1.44 115.31 118.55 1h67 h LEU 124 Ca 0.37 0.00 0.04 0.00 0.09 0.00 0.00 57.88 58.39 1h67 h LEU 124 Cb 0.55 -0.13 -0.05 0.00 0.09 0.00 0.00 40.66 41.11 1h67 h LEU 124 CO -0.39 0.45 0.46 0.40 0.09 0.00 0.00 178.44 179.46 1h67 h ILE 125 N 0.79 1.08 -0.30 1.22 2.04 -1.32 -0.61 117.51 120.41 1h67 h ILE 125 Ca 0.27 -0.30 -0.03 0.00 1.00 0.00 0.00 64.86 65.79 1h67 h ILE 125 Cb 0.04 0.11 -0.01 0.00 -0.74 0.00 0.00 36.82 36.22 1h67 h ILE 125 CO -0.11 0.16 0.07 0.00 0.00 0.00 0.00 178.15 178.27 1h67 h ALA 126 N 1.33 0.39 -0.79 1.87 0.00 -0.84 -2.94 119.26 118.29 1h67 h ALA 126 Ca 0.31 -0.17 -0.02 0.00 0.00 0.00 0.00 54.91 55.03 1h67 h ALA 126 Cb 0.06 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 17.70 1h67 h ALA 126 CO -0.13 0.05 0.42 1.25 0.00 0.00 0.00 179.25 180.85 1h67 h LEU 127 N 0.32 0.98 -1.26 0.00 5.85 -0.90 -2.24 115.31 118.06 1h67 h LEU 127 Ca 0.09 -0.08 0.08 0.00 0.84 0.00 0.00 57.88 58.81 1h67 h LEU 127 Cb 0.29 -0.25 -0.06 0.00 0.37 0.00 0.00 40.66 41.02 1h67 h LEU 127 CO 0.00 0.79 0.54 0.00 -0.34 0.00 0.00 178.44 179.44 1h67 h ALA 128 N 1.37 1.64 -0.85 1.25 0.00 -0.95 -0.76 119.26 120.96 1h67 h ALA 128 Ca 0.28 -0.02 0.14 0.00 0.00 0.00 0.00 54.91 55.32 1h67 h ALA 128 Cb 0.03 -0.21 -0.06 0.00 0.00 0.00 0.00 17.79 17.55 1h67 h ALA 128 CO -0.04 0.21 0.55 0.77 0.00 0.00 0.00 179.25 180.74 1h67 h SER 129 N 0.87 0.57 -0.18 0.00 0.02 -1.25 -1.59 113.55 111.98 1h67 h SER 129 Ca 0.37 0.03 -0.03 0.00 -0.84 0.00 0.00 61.79 61.32 1h67 h SER 129 Cb 0.31 -0.08 -0.01 0.00 0.14 0.00 0.00 62.40 62.77 1h67 h SER 129 CO -0.14 0.29 -0.00 1.56 -1.14 0.00 0.00 176.83 177.40 1h67 h GLN 130 N 0.61 0.33 -1.80 3.45 4.20 -1.21 -3.05 115.11 117.64 1h67 h GLN 130 Ca 0.42 -0.11 0.00 0.00 0.06 0.00 0.00 58.65 59.02 1h67 h GLN 130 Cb 0.75 -0.03 0.00 0.00 0.30 0.00 0.00 27.48 28.50 1h67 h GLN 130 CO -0.18 0.54 0.00 0.00 -0.67 0.00 0.00 178.83 178.53 1h67 n ALA 131 N -2.33 3.05 -0.02 3.87 0.00 -0.60 -4.06 120.51 120.42 1h67 n ALA 131 Ca -0.05 0.00 -0.16 0.00 0.00 0.00 0.00 53.44 53.24 1h67 n ALA 131 Cb 0.23 -1.19 -0.12 0.00 0.00 0.00 0.00 19.45 18.37 1h67 n ALA 131 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 177.50 179.07 1h67 h LYS 132 N 1.45 0.19 0.00 0.00 2.10 -1.58 -3.43 116.57 115.30 1h67 h LYS 132 Ca 0.00 -0.22 -0.16 0.00 -2.00 0.00 0.00 60.65 58.27 1h67 h LYS 132 Cb 0.74 0.07 -0.13 0.00 -0.90 0.00 0.00 32.23 32.01 1h67 h LYS 132 CO 0.00 0.98 -0.21 2.41 -2.00 0.00 0.00 179.45 180.63 1h67 n THR 133 N -4.45 0.00 0.53 0.07 -1.04 -1.26 -5.17 114.28 102.97 1h67 n THR 133 Ca -0.10 -1.04 0.04 0.00 -2.04 0.00 0.00 64.05 60.91 1h67 n THR 133 Cb 0.55 0.89 0.25 0.00 -1.82 0.00 0.00 70.33 70.20 1h67 n THR 133 CO 0.00 0.00 0.00 0.29 -0.64 0.00 0.00 175.07 174.72