#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 2.59 -0.06 0.03 -0.02 -1.26 -4.92 135.00 131.36 1h67 n PRO 28 Ca 0.00 0.93 -0.12 0.00 -2.02 0.00 0.00 63.50 62.29 1h67 n PRO 28 Cb 0.00 -2.74 -0.06 0.00 -0.02 0.00 0.00 33.50 30.69 1h67 n PRO 28 CO 0.00 0.00 0.00 0.37 1.98 0.00 0.00 175.50 177.85 1h67 h GLN 29 N 5.98 0.33 0.00 -0.52 4.15 -2.03 -3.46 115.11 119.56 1h67 h GLN 29 Ca -0.44 -0.12 0.00 0.00 0.77 0.00 0.00 58.65 58.85 1h67 h GLN 29 Cb 1.22 -0.02 0.00 0.00 0.21 0.00 0.00 27.48 28.89 1h67 h GLN 29 CO 0.89 0.59 0.00 -2.37 -1.93 0.00 0.00 178.83 176.01 1h67 n THR 30 N -4.67 0.00 0.00 2.39 5.66 -1.26 -5.00 114.28 111.39 1h67 n THR 30 Ca -0.05 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.95 1h67 n THR 30 Cb 0.26 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.04 1h67 n THR 30 CO 0.00 0.00 0.00 -1.84 -3.05 0.00 0.00 175.07 170.18 1h67 n GLU 31 N -0.58 0.00 -1.00 1.09 0.28 -1.26 -4.55 120.64 114.62 1h67 n GLU 31 Ca 0.00 0.00 -0.33 0.00 -0.16 0.00 0.00 57.16 56.67 1h67 n GLU 31 Cb 0.00 -0.43 0.14 0.00 1.43 0.00 0.00 31.44 32.58 1h67 n GLU 31 CO 0.00 0.00 0.00 -2.13 -0.16 0.00 0.00 177.13 174.84 1h67 n ARG 32 N -1.51 0.02 0.00 3.44 0.63 -1.26 -2.62 116.66 115.36 1h67 n ARG 32 Ca 0.00 0.09 0.00 0.00 -0.92 0.00 0.00 57.85 57.02 1h67 n ARG 32 Cb 0.00 -2.42 0.00 0.00 0.45 0.00 0.00 32.46 30.49 1h67 n ARG 32 CO 0.00 0.00 0.00 1.04 -2.51 0.00 0.00 177.63 176.16 1h67 n GLN 33 N -3.52 0.00 -0.13 -0.14 6.02 -1.26 -4.32 117.38 114.02 1h67 n GLN 33 Ca 0.13 0.00 -0.05 0.00 -0.01 0.00 0.00 57.00 57.07 1h67 n GLN 33 Cb 0.51 -0.27 0.04 0.00 1.02 0.00 0.00 30.24 31.53 1h67 n GLN 33 CO 0.00 0.00 0.00 -0.07 -1.01 0.00 0.00 177.06 175.98 1h67 h LEU 34 N 0.00 0.17 0.05 1.08 3.38 -1.91 0.13 115.31 118.20 1h67 h LEU 34 Ca 0.00 0.05 -0.00 0.00 0.09 0.00 0.00 57.88 58.01 1h67 h LEU 34 Cb 0.00 0.03 0.00 0.00 0.09 0.00 0.00 40.66 40.78 1h67 h LEU 34 CO 0.00 0.13 -0.02 0.08 0.09 0.00 0.00 178.44 178.72 1h67 h ARG 35 N 0.33 -0.06 -0.84 1.13 0.11 -1.85 -2.67 114.38 110.53 1h67 h ARG 35 Ca 0.20 0.00 0.10 0.00 0.10 0.00 0.00 59.98 60.38 1h67 h ARG 35 Cb 0.18 0.01 -0.06 0.00 1.11 0.00 0.00 29.97 31.21 1h67 h ARG 35 CO -0.20 0.31 0.55 0.28 0.10 0.00 0.00 179.97 181.02 1h67 h VAL 36 N -0.45 0.95 0.26 0.08 2.07 -1.89 0.82 116.25 118.10 1h67 h VAL 36 Ca -0.01 -0.27 -0.01 0.00 0.82 0.00 0.00 66.70 67.23 1h67 h VAL 36 Cb 0.40 0.08 0.00 0.00 -1.52 0.00 0.00 31.29 30.26 1h67 h VAL 36 CO 0.01 0.15 -0.12 -0.25 0.02 0.00 0.00 177.57 177.37 1h67 h TRP 37 N 0.80 -0.32 -0.18 1.57 7.01 -0.68 -2.11 115.95 122.04 1h67 h TRP 37 Ca 0.39 -0.01 -0.01 0.00 2.11 0.00 0.00 58.89 61.37 1h67 h TRP 37 Cb 0.44 0.11 -0.01 0.00 -2.10 0.00 0.00 29.16 27.60 1h67 h TRP 37 CO -0.00 -0.20 0.06 0.82 -2.79 0.00 0.00 178.44 176.33 1h67 h ILE 38 N -0.41 1.18 -0.53 2.65 2.04 -1.41 -0.47 117.51 120.56 1h67 h ILE 38 Ca -0.04 -0.54 0.07 0.00 1.00 0.00 0.00 64.86 65.36 1h67 h ILE 38 Cb 0.27 1.19 -0.06 0.00 -0.74 0.00 0.00 36.82 37.48 1h67 h ILE 38 CO 0.06 0.17 0.19 -0.33 0.00 0.00 0.00 178.15 178.24 1h67 h GLU 39 N 0.13 0.36 -0.09 2.37 5.08 -0.97 -1.40 114.58 120.07 1h67 h GLU 39 Ca 0.06 -0.02 -0.11 0.00 -1.00 0.00 0.00 59.36 58.29 1h67 h GLU 39 Cb 0.21 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.36 1h67 h GLU 39 CO -0.00 0.24 -0.44 0.78 -1.00 0.00 0.00 179.01 178.58 1h67 h GLY 40 N 0.37 0.22 0.08 -3.84 0.00 -1.28 0.37 103.07 98.99 1h67 h GLY 40 Ca 0.26 -0.22 -0.00 0.00 0.00 0.00 0.00 47.33 47.37 1h67 h GLY 40 CO -0.26 0.20 -0.13 0.00 0.00 0.00 0.00 176.54 176.35 1h67 h ALA 41 N 1.38 -0.77 0.00 3.60 0.00 0.06 -3.35 119.26 120.18 1h67 h ALA 41 Ca 0.01 -0.04 -0.06 0.00 0.00 0.00 0.00 54.91 54.82 1h67 h ALA 41 Cb 0.86 0.45 -0.01 0.00 0.00 0.00 0.00 17.79 19.08 1h67 h ALA 41 CO 0.07 -0.79 -0.33 1.79 0.00 0.00 0.00 179.25 179.99 1h67 h THR 42 N -0.22 1.57 0.00 0.00 1.35 -1.62 -3.49 112.91 110.50 1h67 h THR 42 Ca -0.01 -2.30 0.00 0.00 -0.55 0.00 0.00 66.41 63.55 1h67 h THR 42 Cb 0.20 3.09 0.00 0.00 -1.73 0.00 0.00 68.15 69.71 1h67 h THR 42 CO -0.04 0.53 0.00 0.61 -0.25 0.00 0.00 175.52 176.37 1h67 n GLY 43 N 1.56 0.89 2.98 5.82 0.00 0.06 -5.12 105.19 111.38 1h67 n GLY 43 Ca -0.16 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.63 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 1.37 -0.02 1.61 1.81 -0.83 -5.01 118.95 117.88 1h67 s ARG 44 Ca 0.00 -0.30 0.00 0.00 -1.72 0.00 0.00 55.73 53.71 1h67 s ARG 44 Cb 0.00 -1.19 0.03 0.00 -0.45 0.00 0.00 34.95 33.34 1h67 s ARG 44 CO 0.00 -0.01 1.18 0.54 -0.68 0.00 0.00 175.30 176.33 1h67 n ARG 45 N 3.88 1.05 0.00 3.54 5.12 -1.26 -4.19 116.66 124.80 1h67 n ARG 45 Ca -0.24 -0.12 0.00 0.00 -1.93 0.00 0.00 57.85 55.56 1h67 n ARG 45 Cb 0.51 -1.05 0.00 0.00 -1.16 0.00 0.00 32.46 30.77 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 0.57 0.00 0.00 0.55 5.41 -1.26 -4.76 119.36 119.87 1h67 n ILE 46 Ca 0.02 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.77 1h67 n ILE 46 Cb 0.54 0.00 0.00 0.00 -0.71 0.00 0.00 39.64 39.47 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 -0.31 0.00 7.39 0.00 -1.26 -4.91 105.19 106.10 1h67 n GLY 47 Ca 0.00 -0.42 0.00 0.00 0.00 0.00 0.00 46.02 45.60 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 0.00 0.00 -4.63 1.61 8.00 -1.26 -4.85 116.55 115.42 1h67 n ASP 48 Ca 0.00 0.00 -0.41 0.00 0.71 0.00 0.00 54.79 55.09 1h67 n ASP 48 Cb 0.00 0.00 0.01 0.00 -0.02 0.00 0.00 41.12 41.11 1h67 n ASP 48 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 1h67 n ASN 49 N 0.00 1.48 -0.11 -2.24 4.13 -1.26 -4.76 115.26 112.51 1h67 n ASN 49 Ca 0.00 1.04 -0.06 0.00 1.68 0.00 0.00 54.58 57.25 1h67 n ASN 49 Cb 0.00 -1.38 0.02 0.00 -1.54 0.00 0.00 39.78 36.88 1h67 n ASN 49 CO 0.00 0.00 0.00 0.15 0.28 0.00 0.00 177.26 177.69 1h67 h PHE 50 N 1.61 0.10 -0.05 3.10 3.57 -1.99 0.13 116.94 123.41 1h67 h PHE 50 Ca -0.45 0.02 -0.03 0.00 3.53 0.00 0.00 57.97 61.04 1h67 h PHE 50 Cb 1.33 0.01 -0.00 0.00 2.79 0.00 0.00 35.95 40.08 1h67 h PHE 50 CO 0.44 0.01 -0.08 0.52 -2.23 0.00 0.00 178.31 176.97 1h67 h MET 51 N 0.18 0.15 -0.99 1.11 0.00 -1.98 -2.90 114.93 110.49 1h67 h MET 51 Ca 0.17 -0.09 0.12 0.00 0.00 0.00 0.00 59.70 59.90 1h67 h MET 51 Cb 0.21 0.01 -0.08 0.00 0.00 0.00 0.00 31.60 31.73 1h67 h MET 51 CO -0.24 0.65 0.62 0.22 0.00 0.00 0.00 176.91 178.16 1h67 h ASP 52 N -0.34 0.91 -0.07 1.22 1.82 -1.87 -2.35 116.42 115.74 1h67 h ASP 52 Ca 0.00 0.05 -0.01 0.00 -0.39 0.00 0.00 57.03 56.68 1h67 h ASP 52 Cb 0.64 -0.14 -0.00 0.00 0.68 0.00 0.00 39.33 40.51 1h67 h ASP 52 CO 0.02 0.49 0.02 1.23 -1.61 0.00 0.00 179.24 179.38 1h67 h GLY 53 N 0.99 0.11 0.67 -0.78 0.00 -0.75 -2.80 103.07 100.51 1h67 h GLY 53 Ca 0.49 -0.07 0.19 0.00 0.00 0.00 0.00 47.33 47.94 1h67 h GLY 53 CO -0.26 0.07 0.48 1.41 0.00 0.00 0.00 176.54 178.24 1h67 h LEU 54 N -0.11 0.00 -1.47 3.11 3.38 -1.22 -1.76 115.31 117.24 1h67 h LEU 54 Ca 0.02 0.00 0.26 0.00 0.09 0.00 0.00 57.88 58.25 1h67 h LEU 54 Cb 0.24 0.00 -0.08 0.00 0.09 0.00 0.00 40.66 40.91 1h67 h LEU 54 CO 0.00 0.00 0.67 0.11 0.09 0.00 0.00 178.44 179.31 1h67 h LYS 55 N 0.00 0.34 -0.97 1.13 1.57 -1.20 -0.21 116.57 117.24 1h67 h LYS 55 Ca 0.31 -0.02 0.11 0.00 -1.87 0.00 0.00 60.65 59.18 1h67 h LYS 55 Cb 1.28 -0.08 -0.08 0.00 0.08 0.00 0.00 32.23 33.43 1h67 h LYS 55 CO -0.00 0.23 0.60 0.38 -0.57 0.00 0.00 179.45 180.08 1h67 h ASP 56 N 0.35 0.89 0.00 0.86 2.03 -1.48 -3.44 116.42 115.63 1h67 h ASP 56 Ca 0.56 0.04 0.00 0.00 -0.73 0.00 0.00 57.03 56.90 1h67 h ASP 56 Cb 1.50 -0.14 0.00 0.00 -0.83 0.00 0.00 39.33 39.86 1h67 h ASP 56 CO -0.23 0.50 0.00 0.61 -1.03 0.00 0.00 179.24 179.08 1h67 n GLY 57 N -1.34 2.50 0.47 7.15 0.00 -0.09 -4.37 105.19 109.50 1h67 n GLY 57 Ca 0.17 -0.00 -0.16 0.00 0.00 0.00 0.00 46.02 46.03 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 0.00 -0.37 1.61 2.07 -1.87 0.94 116.25 118.63 1h67 h VAL 58 Ca 0.00 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.57 1h67 h VAL 58 Cb 0.00 0.00 -0.05 0.00 -1.52 0.00 0.00 31.29 29.72 1h67 h VAL 58 CO 0.00 0.00 0.08 0.40 0.02 0.00 0.00 177.57 178.07 1h67 h ILE 59 N -0.81 0.83 -0.56 4.57 2.04 -1.93 0.50 117.51 122.14 1h67 h ILE 59 Ca -0.03 -0.07 -0.01 0.00 1.00 0.00 0.00 64.86 65.75 1h67 h ILE 59 Cb 0.77 0.59 -0.03 0.00 -0.74 0.00 0.00 36.82 37.42 1h67 h ILE 59 CO -0.20 0.04 0.29 -0.07 0.00 0.00 0.00 178.15 178.21 1h67 h LEU 60 N 0.21 0.69 -1.18 1.44 3.38 -1.84 0.79 115.31 118.82 1h67 h LEU 60 Ca 0.18 -0.05 -0.07 0.00 0.09 0.00 0.00 57.88 58.02 1h67 h LEU 60 Cb 0.20 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.76 1h67 h LEU 60 CO -0.22 0.57 -0.17 0.00 0.09 0.00 0.00 178.44 178.71 1h67 h GLU 62 N 0.34 0.73 -0.11 0.00 5.08 0.21 -3.03 114.58 117.79 1h67 h GLU 62 Ca 0.06 -0.42 -0.04 0.00 -1.00 0.00 0.00 59.36 57.97 1h67 h GLU 62 Cb 0.50 0.03 -0.00 0.00 0.50 0.00 0.00 28.75 29.78 1h67 h GLU 62 CO 0.03 1.04 -0.07 1.25 -1.00 0.00 0.00 179.01 180.26 1h67 h LEU 63 N 0.58 0.26 -1.33 1.33 7.12 -0.37 -3.15 115.31 119.75 1h67 h LEU 63 Ca 0.03 -0.43 0.10 0.00 0.13 0.00 0.00 57.88 57.71 1h67 h LEU 63 Cb 1.03 -0.07 -0.06 0.00 -0.53 0.00 0.00 40.66 41.03 1h67 h LEU 63 CO 0.10 0.63 0.53 -0.29 -0.13 0.00 0.00 178.44 179.28 1h67 h ILE 64 N -0.12 0.95 -0.69 4.05 6.09 -1.16 -0.27 117.51 126.36 1h67 h ILE 64 Ca 0.02 -0.26 0.01 0.00 -1.37 0.00 0.00 64.86 63.27 1h67 h ILE 64 Cb 0.54 0.13 -0.03 0.00 0.47 0.00 0.00 36.82 37.93 1h67 h ILE 64 CO 0.02 0.14 0.46 0.78 -3.07 0.00 0.00 178.15 176.47 1h67 h ASN 65 N 0.75 0.79 0.04 2.19 2.35 -1.49 0.19 115.58 120.40 1h67 h ASN 65 Ca 0.37 -0.02 -0.00 0.00 -0.55 0.00 0.00 56.30 56.10 1h67 h ASN 65 Cb 0.45 -0.20 0.00 0.00 0.05 0.00 0.00 38.32 38.62 1h67 h ASN 65 CO -0.15 0.57 -0.02 0.11 -1.65 0.00 0.00 177.43 176.29 1h67 h LYS 66 N 0.93 -0.05 -0.31 0.81 1.79 -1.05 -3.16 116.57 115.52 1h67 h LYS 66 Ca 0.25 0.00 -0.04 0.00 -2.18 0.00 0.00 60.65 58.69 1h67 h LYS 66 Cb -0.09 0.01 -0.01 0.00 -1.58 0.00 0.00 32.23 30.55 1h67 h LYS 66 CO -0.06 0.13 0.06 -0.07 -1.08 0.00 0.00 179.45 178.44 1h67 h LEU 67 N -0.23 0.49 -7.96 2.94 3.38 -1.17 -3.41 115.31 109.35 1h67 h LEU 67 Ca -0.01 -0.25 -0.64 0.00 0.09 0.00 0.00 57.88 57.07 1h67 h LEU 67 Cb 0.21 -0.13 -0.36 0.00 0.09 0.00 0.00 40.66 40.47 1h67 h LEU 67 CO 0.01 0.62 -0.84 -1.58 0.09 0.00 0.00 178.44 176.74 1h67 s GLN 68 N -5.21 2.59 -0.06 1.13 0.74 0.63 -5.00 119.66 114.49 1h67 s GLN 68 Ca -0.13 -0.80 -0.37 0.00 0.05 0.00 0.00 55.36 54.10 1h67 s GLN 68 Cb 0.09 -2.45 -0.15 0.00 1.10 0.00 0.00 33.01 31.59 1h67 s GLN 68 CO 0.75 -0.28 1.57 -2.30 -0.55 0.00 0.00 175.29 174.48 1h67 n PRO 69 N 4.65 1.37 -3.74 1.67 -0.02 -1.21 -2.23 135.00 135.49 1h67 n PRO 69 Ca -0.18 0.50 -0.22 0.00 -2.02 0.00 0.00 63.50 61.57 1h67 n PRO 69 Cb 0.49 -2.19 0.02 0.00 -0.02 0.00 0.00 33.50 31.80 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 3.43 -0.33 0.24 -1.23 0.00 -1.26 -4.93 105.19 101.11 1h67 n GLY 70 Ca 0.22 0.16 -0.09 0.00 0.00 0.00 0.00 46.02 46.30 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 -1.85 -0.50 -3.38 1.61 0.02 -1.69 -3.43 113.55 104.33 1h67 h SER 71 Ca -0.62 0.02 -0.55 0.00 -0.84 0.00 0.00 61.79 59.79 1h67 h SER 71 Cb 1.36 0.13 -0.05 0.00 0.14 0.00 0.00 62.40 63.99 1h67 h SER 71 CO 0.57 -0.32 0.09 -0.69 -1.14 0.00 0.00 176.83 175.34 1h67 s VAL 72 N -4.03 4.85 0.19 2.27 1.01 -1.26 -4.90 120.40 118.54 1h67 s VAL 72 Ca -0.09 1.48 -0.11 0.00 0.00 0.00 0.00 61.98 63.26 1h67 s VAL 72 Cb 0.01 -4.04 0.11 0.00 0.00 0.00 0.00 36.38 32.46 1h67 s VAL 72 CO 0.26 0.35 1.81 0.06 0.00 0.00 0.00 175.10 177.58 1h67 h GLN 73 N 5.90 0.94 -0.90 2.72 3.07 -1.95 -3.44 115.11 121.45 1h67 h GLN 73 Ca -0.44 -0.11 0.19 0.00 0.09 0.00 0.00 58.65 58.38 1h67 h GLN 73 Cb 1.20 -0.18 -0.26 0.00 0.08 0.00 0.00 27.48 28.32 1h67 h GLN 73 CO 0.71 0.71 0.34 0.21 0.09 0.00 0.00 178.83 180.89 1h67 s LYS 74 N -5.85 0.24 -0.12 0.06 2.47 -1.26 -5.15 119.74 110.12 1h67 s LYS 74 Ca -0.13 0.56 -0.17 0.00 -1.56 0.00 0.00 55.97 54.67 1h67 s LYS 74 Cb 0.14 0.29 -0.04 0.00 -1.46 0.00 0.00 37.83 36.76 1h67 s LYS 74 CO 0.79 -0.07 0.41 0.54 0.16 0.00 0.00 175.35 177.18 1h67 s VAL 75 N 2.15 5.22 0.06 4.02 0.11 -1.26 -4.92 120.40 125.77 1h67 s VAL 75 Ca -0.03 0.82 -0.14 0.00 -2.93 0.00 0.00 61.98 59.70 1h67 s VAL 75 Cb -0.04 -3.75 -0.06 0.00 -1.53 0.00 0.00 36.38 30.99 1h67 s VAL 75 CO -0.16 0.36 0.45 0.20 -3.33 0.00 0.00 175.10 172.62 1h67 s ASN 76 N 0.46 6.78 0.35 3.54 0.01 -1.26 -5.05 114.94 119.78 1h67 s ASN 76 Ca 0.23 0.96 -0.29 0.00 -0.71 0.00 0.00 52.86 53.05 1h67 s ASN 76 Cb -0.15 -2.25 -0.11 0.00 0.41 0.00 0.00 41.25 39.16 1h67 s ASN 76 CO 0.08 0.23 1.48 0.47 -1.51 0.00 0.00 177.10 177.86 1h67 n ASP 77 N 1.33 3.65 -1.56 -1.22 8.00 -1.26 -4.77 116.55 120.72 1h67 n ASP 77 Ca -0.10 1.21 0.00 0.00 0.71 0.00 0.00 54.79 56.61 1h67 n ASP 77 Cb 0.52 -1.59 0.00 0.00 -0.02 0.00 0.00 41.12 40.03 1h67 n ASP 77 CO 0.00 0.00 0.00 -0.81 -0.39 0.00 0.00 177.20 176.00 1h67 n PRO 78 N 0.85 0.82 0.06 -0.24 -0.04 -1.26 -4.28 135.00 130.92 1h67 n PRO 78 Ca 0.03 0.00 -0.10 0.00 -0.04 0.00 0.00 63.50 63.40 1h67 n PRO 78 Cb 0.38 -1.09 -0.07 0.00 -0.04 0.00 0.00 33.50 32.68 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 1.12 0.66 0.00 0.52 2.07 -2.00 -3.46 116.25 115.17 1h67 h VAL 79 Ca 0.00 -1.07 0.00 0.00 0.82 0.00 0.00 66.70 66.45 1h67 h VAL 79 Cb 0.82 1.13 0.00 0.00 -1.52 0.00 0.00 31.29 31.73 1h67 h VAL 79 CO 0.00 0.18 0.00 0.00 0.02 0.00 0.00 177.57 177.77 1h67 n GLN 80 N -4.94 0.37 0.00 1.57 1.13 -1.26 -5.07 117.38 109.18 1h67 n GLN 80 Ca -0.07 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 54.99 1h67 n GLN 80 Cb 0.24 0.00 0.00 0.00 0.11 0.00 0.00 30.24 30.59 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 0.15 0.26 1.08 4.13 -1.26 -4.83 115.26 114.78 1h67 n ASN 81 Ca 0.00 0.00 0.12 0.00 1.68 0.00 0.00 54.58 56.38 1h67 n ASN 81 Cb 0.00 0.00 0.68 0.00 -1.54 0.00 0.00 39.78 38.92 1h67 n ASN 81 CO 0.00 0.00 0.00 4.11 0.28 0.00 0.00 177.26 181.65 1h67 h TRP 82 N 0.00 0.00 -0.50 3.10 5.08 -1.98 -2.85 115.95 118.81 1h67 h TRP 82 Ca 0.00 0.00 0.07 0.00 1.08 0.00 0.00 58.89 60.04 1h67 h TRP 82 Cb 0.09 0.00 -0.06 0.00 -3.00 0.00 0.00 29.16 26.20 1h67 h TRP 82 CO 0.00 0.14 0.17 0.45 -1.28 0.00 0.00 178.44 177.92 1h67 h HIS 83 N 0.00 0.30 -0.58 0.12 3.86 -1.88 -1.84 115.15 115.14 1h67 h HIS 83 Ca -0.00 0.03 0.02 0.00 -1.16 0.00 0.00 60.37 59.25 1h67 h HIS 83 Cb 0.40 -0.06 -0.03 0.00 1.06 0.00 0.00 27.41 28.78 1h67 h HIS 83 CO 0.00 0.10 0.37 0.87 0.86 0.00 0.00 177.93 180.13 1h67 h LYS 84 N 0.35 0.72 -0.67 2.45 1.57 -1.70 -1.03 116.57 118.25 1h67 h LYS 84 Ca 0.24 -0.04 0.11 0.00 -1.87 0.00 0.00 60.65 59.08 1h67 h LYS 84 Cb 0.26 -0.16 -0.04 0.00 0.08 0.00 0.00 32.23 32.36 1h67 h LYS 84 CO -0.25 0.48 0.45 -0.07 -0.57 0.00 0.00 179.45 179.49 1h67 h LEU 85 N 0.74 0.44 -0.00 2.94 3.38 -1.42 0.31 115.31 121.70 1h67 h LEU 85 Ca 0.22 0.01 -0.11 0.00 0.09 0.00 0.00 57.88 58.09 1h67 h LEU 85 Cb -0.04 -0.08 0.01 0.00 0.09 0.00 0.00 40.66 40.64 1h67 h LEU 85 CO -0.07 0.26 -0.45 -0.08 0.09 0.00 0.00 178.44 178.19 1h67 h GLU 86 N 0.48 0.31 -0.62 1.13 4.57 -0.74 -2.73 114.58 116.99 1h67 h GLU 86 Ca 0.32 -0.33 0.03 0.00 -1.18 0.00 0.00 59.36 58.20 1h67 h GLU 86 Cb 0.58 0.09 -0.04 0.00 -0.16 0.00 0.00 28.75 29.22 1h67 h GLU 86 CO -0.10 1.02 0.37 -0.91 -1.18 0.00 0.00 179.01 178.22 1h67 h ASN 87 N -0.28 0.60 -0.69 1.04 -0.26 -0.50 -1.91 115.58 113.59 1h67 h ASN 87 Ca -0.05 0.01 -0.05 0.00 -0.56 0.00 0.00 56.30 55.65 1h67 h ASN 87 Cb 1.18 -0.12 -0.03 0.00 -1.06 0.00 0.00 38.32 38.28 1h67 h ASN 87 CO 0.09 0.42 0.26 0.40 -1.06 0.00 0.00 177.43 177.53 1h67 h ILE 88 N 0.73 1.25 -0.26 2.81 2.04 -1.03 -2.22 117.51 120.82 1h67 h ILE 88 Ca 0.25 -0.80 0.03 0.00 1.00 0.00 0.00 64.86 65.34 1h67 h ILE 88 Cb 0.05 0.42 -0.03 0.00 -0.74 0.00 0.00 36.82 36.52 1h67 h ILE 88 CO -0.11 0.32 0.08 1.23 0.00 0.00 0.00 178.15 179.67 1h67 h GLY 89 N 1.09 0.31 1.00 5.37 0.00 -1.03 -0.07 103.07 109.74 1h67 h GLY 89 Ca 0.24 -0.05 -0.03 0.00 0.00 0.00 0.00 47.33 47.49 1h67 h GLY 89 CO -0.02 0.02 0.28 3.43 0.00 0.00 0.00 176.54 180.26 1h67 h ASN 90 N 0.20 0.84 -0.38 0.19 2.35 -1.26 -1.05 115.58 116.47 1h67 h ASN 90 Ca 0.11 -0.15 0.00 0.00 -0.55 0.00 0.00 56.30 55.72 1h67 h ASN 90 Cb 0.09 -0.22 -0.02 0.00 0.05 0.00 0.00 38.32 38.22 1h67 h ASN 90 CO -0.12 0.76 0.25 0.15 -1.65 0.00 0.00 177.43 176.82 1h67 h PHE 91 N 0.88 0.48 -0.01 1.19 3.57 -0.99 -0.20 116.94 121.86 1h67 h PHE 91 Ca 0.21 0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.72 1h67 h PHE 91 Cb 0.15 -0.16 -0.00 0.00 2.79 0.00 0.00 35.95 38.73 1h67 h PHE 91 CO 0.01 0.31 -0.00 -0.07 -2.23 0.00 0.00 178.31 176.32 1h67 h LEU 92 N 0.52 0.02 -1.29 0.59 3.38 -0.83 -0.37 115.31 117.33 1h67 h LEU 92 Ca 0.14 -0.33 0.05 0.00 0.09 0.00 0.00 57.88 57.83 1h67 h LEU 92 Cb -0.05 -0.00 -0.05 0.00 0.09 0.00 0.00 40.66 40.65 1h67 h LEU 92 CO -0.03 0.34 0.51 0.03 0.09 0.00 0.00 178.44 179.38 1h67 h ARG 93 N -0.31 0.87 -0.18 1.13 2.47 -1.12 0.37 114.38 117.60 1h67 h ARG 93 Ca 0.00 -0.05 -0.07 0.00 -1.26 0.00 0.00 59.98 58.60 1h67 h ARG 93 Cb 0.33 -0.20 -0.00 0.00 -1.65 0.00 0.00 29.97 28.45 1h67 h ARG 93 CO 0.00 0.57 -0.15 0.00 0.56 0.00 0.00 179.97 180.96 1h67 h ALA 94 N 1.56 0.26 -0.17 0.04 0.00 -0.90 -2.76 119.26 117.30 1h67 h ALA 94 Ca 0.33 -0.32 -0.21 0.00 0.00 0.00 0.00 54.91 54.70 1h67 h ALA 94 Cb 0.15 -0.06 0.01 0.00 0.00 0.00 0.00 17.79 17.89 1h67 h ALA 94 CO -0.11 0.14 -0.74 -0.84 0.00 0.00 0.00 179.25 177.71 1h67 h ILE 95 N 0.08 1.29 -0.99 0.00 3.07 -0.54 0.28 117.51 120.70 1h67 h ILE 95 Ca 0.03 -1.95 0.03 0.00 1.55 0.00 0.00 64.86 64.52 1h67 h ILE 95 Cb 0.67 1.94 -0.06 0.00 -0.27 0.00 0.00 36.82 39.10 1h67 h ILE 95 CO 0.04 0.62 0.65 0.11 -1.05 0.00 0.00 178.15 178.52 1h67 h LYS 96 N 0.53 1.23 0.10 0.16 1.57 -0.35 -1.99 116.57 117.82 1h67 h LYS 96 Ca -0.04 -0.07 -0.30 0.00 -1.87 0.00 0.00 60.65 58.37 1h67 h LYS 96 Cb 1.35 -0.28 -0.01 0.00 0.08 0.00 0.00 32.23 33.38 1h67 h LYS 96 CO 0.15 0.81 -1.48 1.25 -0.57 0.00 0.00 179.45 179.61 1h67 h HIS 97 N 1.27 0.39 -0.68 -1.35 2.76 -1.48 -3.35 115.15 112.71 1h67 h HIS 97 Ca 0.39 -0.29 0.12 0.00 -2.20 0.00 0.00 60.37 58.39 1h67 h HIS 97 Cb -0.02 -0.02 -0.08 0.00 1.55 0.00 0.00 27.41 28.84 1h67 h HIS 97 CO -0.00 1.32 0.26 -0.92 -1.30 0.00 0.00 177.93 177.29 1h67 h TYR 98 N 0.06 0.45 0.00 5.26 3.20 0.05 -3.46 116.97 122.53 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 1.99 -0.10 0.00 0.00 1.54 0.00 0.00 36.73 40.17 1h67 h TYR 98 CO 0.05 0.08 0.00 0.41 -1.64 0.00 0.00 178.16 177.07 1h67 n GLY 99 N -1.31 0.58 3.68 1.82 0.00 -0.79 -5.06 105.19 104.10 1h67 n GLY 99 Ca 0.11 -0.04 -0.45 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 0.09 -2.21 1.61 0.31 -1.00 -4.93 118.33 112.20 1h67 n VAL 100 Ca 0.00 -0.02 -0.41 0.00 -0.01 0.00 0.00 64.34 63.91 1h67 n VAL 100 Cb 0.00 -1.69 -0.03 0.00 -0.91 0.00 0.00 33.84 31.21 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 1.42 4.42 0.29 5.55 1.02 -1.26 -4.09 119.74 127.09 1h67 s LYS 101 Ca 0.80 2.10 0.01 0.00 0.02 0.00 0.00 55.97 58.90 1h67 s LYS 101 Cb -0.64 -3.12 0.54 0.00 -0.52 0.00 0.00 37.83 34.10 1h67 s LYS 101 CO 0.38 -0.11 1.88 -1.35 -0.92 0.00 0.00 175.35 175.23 1h67 h PRO 102 N 3.80 0.99 -0.62 -1.68 0.11 -1.88 0.11 132.00 132.84 1h67 h PRO 102 Ca -0.48 -0.06 0.14 0.00 0.11 0.00 0.00 66.00 65.71 1h67 h PRO 102 Cb 1.22 -0.22 -0.03 0.00 0.11 0.00 0.00 31.00 32.07 1h67 h PRO 102 CO 0.68 0.65 0.43 1.25 -0.21 0.00 0.00 178.00 180.80 1h67 h HIS 103 N 1.02 0.26 0.07 0.65 2.76 -1.97 -0.66 115.15 117.28 1h67 h HIS 103 Ca 0.44 0.01 -0.32 0.00 -2.20 0.00 0.00 60.37 58.29 1h67 h HIS 103 Cb 0.33 -0.08 -0.03 0.00 1.55 0.00 0.00 27.41 29.18 1h67 h HIS 103 CO -0.00 0.10 -1.76 -0.44 -1.30 0.00 0.00 177.93 174.53 1h67 h ASP 104 N 0.23 0.24 -3.22 3.26 3.32 -1.56 -3.46 116.42 115.22 1h67 h ASP 104 Ca 0.30 -0.47 -0.53 0.00 0.02 0.00 0.00 57.03 56.35 1h67 h ASP 104 Cb 0.86 -0.08 0.02 0.00 0.22 0.00 0.00 39.33 40.35 1h67 h ASP 104 CO -0.06 1.42 0.62 -0.63 -1.72 0.00 0.00 179.24 178.87 1h67 s ILE 105 N -2.59 3.62 0.00 0.35 1.01 -0.11 -4.45 121.20 119.03 1h67 s ILE 105 Ca -0.12 1.22 0.00 0.00 0.00 0.00 0.00 60.65 61.75 1h67 s ILE 105 Cb 0.07 -3.78 0.00 0.00 0.01 0.00 0.00 42.46 38.76 1h67 s ILE 105 CO 0.81 0.13 0.00 2.22 0.00 0.00 0.00 174.94 178.10 1h67 n PHE 106 N 3.45 -0.00 -3.79 3.97 1.16 -1.26 -4.83 117.46 116.16 1h67 n PHE 106 Ca 0.08 0.00 -0.11 0.00 -1.87 0.00 0.00 57.45 55.55 1h67 n PHE 106 Cb 0.44 0.00 -0.08 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 0.75 0.59 3.97 2.02 -1.26 -5.01 118.70 119.75 1h67 s GLU 107 Ca 0.00 -0.54 0.29 0.00 0.02 0.00 0.00 54.97 54.74 1h67 s GLU 107 Cb 0.00 0.32 1.42 0.00 0.10 0.00 0.00 34.13 35.97 1h67 s GLU 107 CO 0.00 -0.23 1.82 0.00 0.02 0.00 0.00 175.26 176.87 1h67 h ALA 108 N 3.36 2.39 0.04 5.21 0.00 -1.95 0.19 119.26 128.50 1h67 h ALA 108 Ca -0.32 -0.02 -0.23 0.00 0.00 0.00 0.00 54.91 54.34 1h67 h ALA 108 Cb 1.19 0.05 0.02 0.00 0.00 0.00 0.00 17.79 19.05 1h67 h ALA 108 CO 0.47 -0.92 -0.93 -0.91 0.00 0.00 0.00 179.25 176.95 1h67 h ASN 109 N 0.00 0.74 -0.32 0.00 4.21 -1.97 -1.47 115.58 116.77 1h67 h ASN 109 Ca 0.29 -0.79 0.00 0.00 1.21 0.00 0.00 56.30 57.02 1h67 h ASN 109 Cb 1.51 -0.23 -0.02 0.00 -1.12 0.00 0.00 38.32 38.46 1h67 h ASN 109 CO -0.00 1.44 0.21 0.44 -1.29 0.00 0.00 177.43 178.23 1h67 h ASP 110 N 0.13 0.37 -0.03 5.81 3.32 -1.01 0.19 116.42 125.20 1h67 h ASP 110 Ca -0.13 -0.01 -0.06 0.00 0.02 0.00 0.00 57.03 56.85 1h67 h ASP 110 Cb 1.62 -0.09 0.00 0.00 0.22 0.00 0.00 39.33 41.08 1h67 h ASP 110 CO 0.18 0.27 -0.20 0.25 -1.72 0.00 0.00 179.24 178.02 1h67 h LEU 111 N 0.44 0.23 0.21 1.55 5.85 -1.55 0.15 115.31 122.18 1h67 h LEU 111 Ca 0.12 -0.69 -0.01 0.00 0.84 0.00 0.00 57.88 58.14 1h67 h LEU 111 Cb -0.05 -0.07 0.00 0.00 0.37 0.00 0.00 40.66 40.92 1h67 h LEU 111 CO -0.03 0.88 -0.10 0.15 -0.34 0.00 0.00 178.44 179.00 1h67 h PHE 112 N -0.41 -0.26 0.00 1.25 3.57 -1.23 -2.21 116.94 117.65 1h67 h PHE 112 Ca -0.02 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.48 1h67 h PHE 112 Cb 0.88 0.09 0.00 0.00 2.79 0.00 0.00 35.95 39.71 1h67 h PHE 112 CO 0.15 -0.12 0.00 0.39 -2.23 0.00 0.00 178.31 176.50 1h67 n GLU 113 N -5.19 0.10 -2.46 1.11 -0.58 0.65 -4.88 120.64 109.40 1h67 n GLU 113 Ca -0.09 0.21 -0.18 0.00 -0.42 0.00 0.00 57.16 56.68 1h67 n GLU 113 Cb 0.15 -1.65 0.00 0.00 -0.57 0.00 0.00 31.44 29.37 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 -1.84 -5.23 0.00 1.62 4.13 -0.26 -4.92 115.26 108.77 1h67 n ASN 114 Ca 0.05 -0.07 -0.12 0.00 1.68 0.00 0.00 54.58 56.12 1h67 n ASN 114 Cb 0.29 -4.25 -0.09 0.00 -1.54 0.00 0.00 39.78 34.18 1h67 n ASN 114 CO 0.00 0.00 0.00 0.71 0.28 0.00 0.00 177.26 178.25 1h67 h THR 115 N -0.26 1.23 -3.73 3.41 1.35 -1.00 -3.43 112.91 110.48 1h67 h THR 115 Ca -0.43 -1.38 -0.63 0.00 -0.55 0.00 0.00 66.41 63.42 1h67 h THR 115 Cb 1.31 2.08 -0.15 0.00 -1.73 0.00 0.00 68.15 69.66 1h67 h THR 115 CO 0.49 0.32 -0.25 0.20 -0.25 0.00 0.00 175.52 176.04 1h67 s ASN 116 N -5.71 6.24 -0.25 5.36 -0.87 -1.16 -4.95 114.94 113.61 1h67 s ASN 116 Ca -0.15 0.27 -0.15 0.00 -1.57 0.00 0.00 52.86 51.26 1h67 s ASN 116 Cb 0.00 -2.21 -0.10 0.00 -0.02 0.00 0.00 41.25 38.92 1h67 s ASN 116 CO 0.59 -0.18 -0.35 1.41 -2.57 0.00 0.00 177.10 175.99 1h67 n HIS 117 N 5.32 0.00 -0.17 2.20 8.25 -1.26 -4.19 115.22 125.37 1h67 n HIS 117 Ca -0.09 0.00 -0.10 0.00 -0.26 0.00 0.00 57.72 57.27 1h67 n HIS 117 Cb 0.51 -0.84 0.00 0.00 1.12 0.00 0.00 29.99 30.78 1h67 n HIS 117 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1h67 h THR 118 N -0.98 1.27 -0.94 1.59 1.03 -1.98 -2.98 112.91 109.91 1h67 h THR 118 Ca -0.50 -1.13 0.11 0.00 -0.01 0.00 0.00 66.41 64.88 1h67 h THR 118 Cb 1.43 1.00 -0.08 0.00 -1.07 0.00 0.00 68.15 69.43 1h67 h THR 118 CO -0.30 0.40 0.57 -0.61 -0.01 0.00 0.00 175.52 175.57 1h67 h GLN 119 N 0.76 0.89 -0.32 0.00 5.75 -1.97 -0.54 115.11 119.69 1h67 h GLN 119 Ca 0.14 -0.05 -0.00 0.00 -0.15 0.00 0.00 58.65 58.58 1h67 h GLN 119 Cb 0.56 -0.20 -0.02 0.00 1.07 0.00 0.00 27.48 28.90 1h67 h GLN 119 CO 0.03 0.59 0.19 0.28 -2.65 0.00 0.00 178.83 177.27 1h67 h VAL 120 N 0.92 1.12 -0.36 2.39 2.07 -1.69 -1.38 116.25 119.31 1h67 h VAL 120 Ca 0.47 -0.28 -0.05 0.00 0.82 0.00 0.00 66.70 67.65 1h67 h VAL 120 Cb 0.46 0.73 -0.01 0.00 -1.52 0.00 0.00 31.29 30.95 1h67 h VAL 120 CO -0.27 0.12 0.01 1.56 0.02 0.00 0.00 177.57 179.01 1h67 h GLN 121 N 0.40 0.63 -0.79 1.57 4.20 -1.33 -2.86 115.11 116.93 1h67 h GLN 121 Ca 0.11 -0.19 0.02 0.00 0.06 0.00 0.00 58.65 58.65 1h67 h GLN 121 Cb 0.02 -0.06 -0.04 0.00 0.30 0.00 0.00 27.48 27.70 1h67 h GLN 121 CO -0.02 0.73 0.51 0.66 -0.67 0.00 0.00 178.83 180.04 1h67 h SER 122 N 0.45 0.86 -0.74 1.46 4.64 -0.99 -2.38 113.55 116.86 1h67 h SER 122 Ca 0.10 -0.01 0.02 0.00 -0.47 0.00 0.00 61.79 61.44 1h67 h SER 122 Cb 0.44 -0.20 -0.04 0.00 -0.31 0.00 0.00 62.40 62.28 1h67 h SER 122 CO 0.02 0.61 0.47 0.74 -0.87 0.00 0.00 176.83 177.79 1h67 h THR 123 N 1.02 1.13 -0.84 2.95 2.02 -1.15 -2.21 112.91 115.82 1h67 h THR 123 Ca 0.31 -0.32 0.07 0.00 0.77 0.00 0.00 66.41 67.23 1h67 h THR 123 Cb -0.04 0.11 -0.06 0.00 -1.74 0.00 0.00 68.15 66.42 1h67 h THR 123 CO -0.09 0.17 0.51 -0.07 0.37 0.00 0.00 175.52 176.41 1h67 h LEU 124 N 0.93 0.79 -0.58 2.58 3.38 -1.20 -2.04 115.31 119.17 1h67 h LEU 124 Ca 0.29 0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.28 1h67 h LEU 124 Cb -0.02 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 40.56 1h67 h LEU 124 CO -0.09 0.50 0.38 0.40 0.09 0.00 0.00 178.44 179.71 1h67 h ILE 125 N 0.92 1.16 -0.63 1.22 2.04 -1.17 -2.74 117.51 118.31 1h67 h ILE 125 Ca 0.37 -0.30 -0.00 0.00 1.00 0.00 0.00 64.86 65.93 1h67 h ILE 125 Cb 0.21 0.31 -0.03 0.00 -0.74 0.00 0.00 36.82 36.56 1h67 h ILE 125 CO -0.19 0.15 0.38 0.00 0.00 0.00 0.00 178.15 178.49 1h67 h ALA 126 N 1.21 0.80 -0.85 1.87 0.00 -1.09 -2.45 119.26 118.74 1h67 h ALA 126 Ca 0.21 -0.08 0.10 0.00 0.00 0.00 0.00 54.91 55.14 1h67 h ALA 126 Cb -0.08 -0.25 -0.06 0.00 0.00 0.00 0.00 17.79 17.40 1h67 h ALA 126 CO -0.04 0.28 0.55 1.25 0.00 0.00 0.00 179.25 181.28 1h67 h LEU 127 N 0.85 0.74 -0.58 0.00 5.85 -1.12 -1.68 115.31 119.37 1h67 h LEU 127 Ca 0.22 0.02 -0.05 0.00 0.84 0.00 0.00 57.88 58.92 1h67 h LEU 127 Cb -0.02 -0.13 -0.02 0.00 0.37 0.00 0.00 40.66 40.85 1h67 h LEU 127 CO -0.04 0.44 0.18 0.00 -0.34 0.00 0.00 178.44 178.67 1h67 h ALA 128 N 1.57 0.77 -0.88 1.25 0.00 -1.22 -2.03 119.26 118.72 1h67 h ALA 128 Ca 0.39 -0.20 0.02 0.00 0.00 0.00 0.00 54.91 55.12 1h67 h ALA 128 Cb 0.43 -0.23 -0.05 0.00 0.00 0.00 0.00 17.79 17.95 1h67 h ALA 128 CO -0.16 0.44 0.57 1.03 0.00 0.00 0.00 179.25 181.13 1h67 h SER 129 N 0.83 0.97 0.08 0.00 0.87 -1.15 -0.28 113.55 114.86 1h67 h SER 129 Ca 0.19 -0.01 -0.00 0.00 -1.23 0.00 0.00 61.79 60.73 1h67 h SER 129 Cb 0.29 -0.23 0.00 0.00 -0.44 0.00 0.00 62.40 62.03 1h67 h SER 129 CO -0.00 0.68 -0.04 1.56 -0.53 0.00 0.00 176.83 178.50 1h67 h GLN 130 N 1.14 -0.10 -0.97 2.24 7.50 -1.29 -2.44 115.11 121.19 1h67 h GLN 130 Ca 0.34 0.01 0.03 0.00 0.50 0.00 0.00 58.65 59.53 1h67 h GLN 130 Cb -0.05 0.02 -0.05 0.00 0.05 0.00 0.00 27.48 27.44 1h67 h GLN 130 CO -0.10 0.25 0.63 0.00 -1.50 0.00 0.00 178.83 178.12 1h67 h ALA 131 N 0.42 1.37 -0.23 3.87 0.00 -1.21 -1.65 119.26 121.82 1h67 h ALA 131 Ca -0.01 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.84 1h67 h ALA 131 Cb 0.40 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 1h67 h ALA 131 CO 0.02 0.55 0.11 -0.22 0.00 0.00 0.00 179.25 179.70 1h67 h LYS 132 N 1.23 0.33 -0.49 0.00 3.64 -1.03 -3.04 116.57 117.22 1h67 h LYS 132 Ca 0.38 -0.05 -0.02 0.00 -1.27 0.00 0.00 60.65 59.69 1h67 h LYS 132 Cb -0.02 -0.06 -0.02 0.00 -0.41 0.00 0.00 32.23 31.72 1h67 h LYS 132 CO -0.11 0.34 0.24 1.79 -2.27 0.00 0.00 179.45 179.44 1h67 h THR 133 N 0.24 1.18 0.00 1.00 1.35 -1.05 -3.51 112.91 112.11 1h67 h THR 133 Ca 0.08 -0.51 0.00 0.00 -0.55 0.00 0.00 66.41 65.43 1h67 h THR 133 Cb 0.12 0.63 0.00 0.00 -1.73 0.00 0.00 68.15 67.17 1h67 h THR 133 CO -0.01 0.20 0.00 0.29 -0.25 0.00 0.00 175.52 175.75