#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1qa7 h THR 2 N 0.00 1.24 -0.64 6.66 2.02 -1.90 -2.89 112.91 117.39 1qa7 h THR 2 Ca 0.00 -0.86 0.03 0.00 0.77 0.00 0.00 66.41 66.35 1qa7 h THR 2 Cb 0.00 1.09 -0.04 0.00 -1.74 0.00 0.00 68.15 67.46 1qa7 h THR 2 CO 0.00 0.29 0.40 -0.07 0.37 0.00 0.00 175.52 176.51 1qa7 h LEU 3 N 0.45 0.65 -0.52 2.58 3.38 -1.98 0.15 115.31 120.02 1qa7 h LEU 3 Ca 0.11 0.00 0.07 0.00 0.09 0.00 0.00 57.88 58.16 1qa7 h LEU 3 Cb 0.37 -0.14 -0.06 0.00 0.09 0.00 0.00 40.66 40.92 1qa7 h LEU 3 CO 0.01 0.45 0.19 -0.08 0.09 0.00 0.00 178.44 179.10 1qa7 h GLU 4 N 0.78 0.35 -0.12 1.13 4.81 -1.95 0.38 114.58 119.97 1qa7 h GLU 4 Ca 0.26 -0.02 -0.23 0.00 -0.13 0.00 0.00 59.36 59.23 1qa7 h GLU 4 Cb 0.02 -0.08 0.01 0.00 0.63 0.00 0.00 28.75 29.33 1qa7 h GLU 4 CO -0.10 0.23 -0.84 0.82 -0.73 0.00 0.00 179.01 178.39 1qa7 h ILE 5 N 0.36 1.28 -0.68 2.32 1.08 -1.22 -2.27 117.51 118.39 1qa7 h ILE 5 Ca 0.25 -2.04 0.13 0.00 -0.39 0.00 0.00 64.86 62.82 1qa7 h ILE 5 Cb 0.28 2.08 -0.10 0.00 -3.07 0.00 0.00 36.82 36.01 1qa7 h ILE 5 CO -0.26 0.64 0.17 0.00 -0.69 0.00 0.00 178.15 178.01 1qa7 h ALA 6 N 0.53 0.85 -0.17 1.87 0.00 -0.50 -1.56 119.26 120.27 1qa7 h ALA 6 Ca -0.07 0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.98 1qa7 h ALA 6 Cb 1.48 0.19 0.00 0.00 0.00 0.00 0.00 17.79 19.45 1qa7 h ALA 6 CO 0.17 -0.30 0.00 0.41 0.00 0.00 0.00 179.25 179.53 1qa7 n GLY 7 N -1.33 -3.01 0.33 0.00 0.00 0.13 -1.07 105.19 100.23 1qa7 n GLY 7 Ca 0.12 0.46 0.20 0.00 0.00 0.00 0.00 46.02 46.80 1qa7 n GLY 7 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1qa7 h LEU 8 N 0.00 0.43 -0.04 0.99 3.38 -1.03 -2.67 115.31 116.36 1qa7 h LEU 8 Ca 0.00 0.18 -0.01 0.00 0.09 0.00 0.00 57.88 58.14 1qa7 h LEU 8 Cb 0.00 0.15 -0.00 0.00 0.09 0.00 0.00 40.66 40.90 1qa7 h LEU 8 CO 0.00 -0.10 -0.01 0.58 0.09 0.00 0.00 178.44 179.00 1qa7 h VAL 9 N 0.34 1.28 -0.70 1.22 2.07 -0.63 -3.17 116.25 116.67 1qa7 h VAL 9 Ca 0.68 -0.87 0.10 0.00 0.82 0.00 0.00 66.70 67.43 1qa7 h VAL 9 Cb 1.46 1.79 -0.08 0.00 -1.52 0.00 0.00 31.29 32.94 1qa7 h VAL 9 CO -0.59 0.24 0.32 0.03 0.02 0.00 0.00 177.57 177.58 1qa7 h ARG 10 N -0.26 0.52 0.00 1.57 2.47 -0.78 0.21 114.38 118.11 1qa7 h ARG 10 Ca 0.01 -0.03 -0.00 0.00 -1.26 0.00 0.00 59.98 58.70 1qa7 h ARG 10 Cb 0.38 -0.12 -0.00 0.00 -1.65 0.00 0.00 29.97 28.58 1qa7 h ARG 10 CO 0.00 0.34 -0.00 0.87 0.56 0.00 0.00 179.97 181.74 1qa7 h LYS 11 N 0.53 0.00 -0.01 0.04 1.57 -1.51 -2.96 116.57 114.24 1qa7 h LYS 11 Ca 0.36 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.14 1qa7 h LYS 11 Cb 0.43 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.74 1qa7 h LYS 11 CO -0.31 0.00 -0.26 0.09 -0.57 0.00 0.00 179.45 178.41 1qa7 n ASN 12 N -3.14 1.31 -4.71 0.86 4.13 0.61 -4.98 115.26 109.34 1qa7 n ASN 12 Ca -0.02 -1.16 -0.42 0.00 1.68 0.00 0.00 54.58 54.66 1qa7 n ASN 12 Cb 0.12 0.49 -0.03 0.00 -1.54 0.00 0.00 39.78 38.82 1qa7 n ASN 12 CO 0.00 0.00 0.00 -0.22 0.28 0.00 0.00 177.26 177.32 1qa7 s LEU 13 N -1.78 4.36 0.35 3.41 2.96 -0.37 -0.76 118.68 126.86 1qa7 s LEU 13 Ca 0.10 1.62 0.07 0.00 -0.22 0.00 0.00 54.13 55.69 1qa7 s LEU 13 Cb 0.10 -3.53 -0.07 0.00 0.50 0.00 0.00 46.19 43.19 1qa7 s LEU 13 CO 0.31 -0.26 -0.01 0.68 -1.32 0.00 0.00 176.35 175.75 1qa7 s VAL 14 N 1.03 1.78 0.15 1.68 -7.23 0.30 -4.97 120.40 113.13 1qa7 s VAL 14 Ca 0.51 -2.07 -0.12 0.00 -1.81 0.00 0.00 61.98 58.49 1qa7 s VAL 14 Cb -0.21 -2.76 -0.07 0.00 0.56 0.00 0.00 36.38 33.90 1qa7 s VAL 14 CO 0.27 -0.10 0.50 -1.10 -0.31 0.00 0.00 175.10 174.36 1qa7 s GLN 15 N -3.74 3.87 -0.04 4.82 -0.21 -1.21 -1.10 119.66 122.05 1qa7 s GLN 15 Ca 0.34 0.34 0.07 0.00 0.02 0.00 0.00 55.36 56.12 1qa7 s GLN 15 Cb 0.07 -2.89 -0.01 0.00 1.00 0.00 0.00 33.01 31.18 1qa7 s GLN 15 CO 0.16 0.47 -0.25 0.12 -2.12 0.00 0.00 175.29 173.66 1qa7 s PHE 16 N -1.53 2.40 0.23 0.91 2.19 0.70 -2.39 117.98 120.50 1qa7 s PHE 16 Ca 0.39 -0.61 -0.07 0.00 0.33 0.00 0.00 56.93 56.97 1qa7 s PHE 16 Cb -0.14 -1.56 -0.02 0.00 -1.31 0.00 0.00 43.02 39.99 1qa7 s PHE 16 CO 0.19 -0.14 0.32 0.20 1.83 0.00 0.00 175.22 177.62 1qa7 s GLY 17 N -0.34 1.02 0.07 13.12 0.00 -0.20 -0.55 107.32 120.45 1qa7 s GLY 17 Ca 0.02 -1.30 0.06 0.00 0.00 0.00 0.00 44.72 43.50 1qa7 s GLY 17 CO 0.02 -1.01 -0.17 -1.34 0.00 0.00 0.00 173.10 170.60 1qa7 s VAL 18 N -4.03 1.33 -0.14 1.40 -7.23 0.11 0.62 120.40 112.45 1qa7 s VAL 18 Ca 0.31 -1.29 -0.34 0.00 -1.81 0.00 0.00 61.98 58.85 1qa7 s VAL 18 Cb 0.03 -1.22 0.15 0.00 0.56 0.00 0.00 36.38 35.90 1qa7 s VAL 18 CO 0.11 -0.08 1.41 -0.83 -0.31 0.00 0.00 175.10 175.39 1qa7 s GLY 19 N -1.59 -0.41 0.54 2.32 0.00 -1.04 -0.91 107.32 106.23 1qa7 s GLY 19 Ca 0.02 1.21 -0.19 0.00 0.00 0.00 0.00 44.72 45.76 1qa7 s GLY 19 CO 0.02 0.30 1.11 -0.54 0.00 0.00 0.00 173.10 173.99 1qa7 s GLU 20 N -2.07 3.41 0.26 2.90 2.02 -1.26 -0.79 118.70 123.18 1qa7 s GLU 20 Ca 0.14 1.53 -0.05 0.00 0.02 0.00 0.00 54.97 56.60 1qa7 s GLU 20 Cb 0.05 -2.02 0.50 0.00 0.10 0.00 0.00 34.13 32.76 1qa7 s GLU 20 CO -0.05 -0.78 1.62 -0.22 0.02 0.00 0.00 175.26 175.84 1qa7 h LYS 21 N 1.17 0.08 -0.31 1.61 1.63 -1.95 -2.14 116.57 116.66 1qa7 h LYS 21 Ca -0.50 -0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.30 1qa7 h LYS 21 Cb 1.25 -0.02 0.00 0.00 -0.60 0.00 0.00 32.23 32.86 1qa7 h LYS 21 CO 0.57 0.05 0.00 0.09 -3.45 0.00 0.00 179.45 176.71 1qa7 n ASN 22 N -5.39 4.01 -3.35 4.20 4.13 -1.26 -5.02 115.26 112.57 1qa7 n ASN 22 Ca 0.16 -2.89 -0.11 0.00 1.68 0.00 0.00 54.58 53.42 1qa7 n ASN 22 Cb 0.53 -0.53 0.02 0.00 -1.54 0.00 0.00 39.78 38.26 1qa7 n ASN 22 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1qa7 n GLY 23 N -0.24 2.43 3.73 7.41 0.00 -0.81 -5.08 105.19 112.63 1qa7 n GLY 23 Ca 0.21 -2.20 -0.42 0.00 0.00 0.00 0.00 46.02 43.61 1qa7 n GLY 23 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1qa7 s SER 24 N -2.60 6.63 -0.00 1.61 0.15 -1.26 -4.71 113.70 113.51 1qa7 s SER 24 Ca 0.22 2.60 -0.24 0.00 0.70 0.00 0.00 55.95 59.22 1qa7 s SER 24 Cb -0.02 -2.60 -0.05 0.00 -1.71 0.00 0.00 66.02 61.64 1qa7 s SER 24 CO 0.14 -0.77 0.73 -0.69 1.20 0.00 0.00 173.24 173.85 1qa7 s VAL 25 N 0.81 4.87 -0.37 4.45 1.01 -1.26 -4.49 120.40 125.41 1qa7 s VAL 25 Ca 0.66 1.54 -0.12 0.00 0.00 0.00 0.00 61.98 64.07 1qa7 s VAL 25 Cb -0.42 -4.08 0.02 0.00 0.00 0.00 0.00 36.38 31.90 1qa7 s VAL 25 CO 0.35 0.32 0.22 -0.60 0.00 0.00 0.00 175.10 175.39 1qa7 s ARG 26 N 0.29 2.92 -0.08 2.72 3.52 -0.09 -4.94 118.95 123.30 1qa7 s ARG 26 Ca 0.38 -1.02 -0.29 0.00 -0.13 0.00 0.00 55.73 54.67 1qa7 s ARG 26 Cb -0.19 -3.77 -0.02 0.00 -1.56 0.00 0.00 34.95 29.41 1qa7 s ARG 26 CO 0.21 -0.67 0.99 -1.58 -0.81 0.00 0.00 175.30 173.43 1qa7 s TRP 27 N 1.59 3.54 -0.22 5.12 0.52 -1.26 0.06 118.94 128.29 1qa7 s TRP 27 Ca 0.03 1.60 -0.02 0.00 0.02 0.00 0.00 56.10 57.73 1qa7 s TRP 27 Cb -0.19 -3.16 -0.13 0.00 -1.15 0.00 0.00 33.47 28.85 1qa7 s TRP 27 CO 0.07 -0.17 -0.22 0.28 0.02 0.00 0.00 176.95 176.93 1qa7 n VAL 28 N 4.39 1.24 -1.93 4.03 0.31 0.29 -4.94 118.33 121.72 1qa7 n VAL 28 Ca 0.08 -0.43 0.00 0.00 -0.01 0.00 0.00 64.34 63.98 1qa7 n VAL 28 Cb 0.49 -1.42 0.00 0.00 -0.91 0.00 0.00 33.84 32.00 1qa7 n VAL 28 CO 0.00 0.00 0.00 1.15 -1.32 0.00 0.00 176.83 176.66 1qa7 n MET 29 N -3.39 0.00 -4.08 5.55 0.00 -0.88 -4.47 117.12 109.86 1qa7 n MET 29 Ca -0.40 0.00 -0.22 0.00 0.00 0.00 0.00 57.70 57.08 1qa7 n MET 29 Cb 0.88 0.00 -0.04 0.00 0.00 0.00 0.00 33.22 34.06 1qa7 n MET 29 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 175.97 175.17 1qa7 s ASN 30 N 2.00 5.69 0.03 3.17 0.01 -0.39 0.25 114.94 125.70 1qa7 s ASN 30 Ca 0.00 -0.17 0.02 0.00 -0.71 0.00 0.00 52.86 52.00 1qa7 s ASN 30 Cb 0.00 -1.51 -0.02 0.00 0.41 0.00 0.00 41.25 40.13 1qa7 s ASN 30 CO 0.00 -0.03 -0.06 0.00 -1.51 0.00 0.00 177.10 175.50 1qa7 s ALA 31 N -2.05 0.44 -0.19 0.60 0.00 -0.26 -4.08 121.76 116.22 1qa7 s ALA 31 Ca 0.33 -0.63 -0.00 0.00 0.00 0.00 0.00 51.96 51.66 1qa7 s ALA 31 Cb -0.08 0.04 0.01 0.00 0.00 0.00 0.00 23.12 23.09 1qa7 s ALA 31 CO 0.26 -0.03 -0.15 -1.17 0.00 0.00 0.00 175.76 174.67 1qa7 s LEU 32 N -1.29 2.38 0.38 0.00 2.96 -0.62 -0.54 118.68 121.94 1qa7 s LEU 32 Ca -0.09 -0.56 -0.25 0.00 -0.22 0.00 0.00 54.13 53.00 1qa7 s LEU 32 Cb -0.08 -1.56 -0.09 0.00 0.50 0.00 0.00 46.19 44.95 1qa7 s LEU 32 CO 0.00 -0.00 1.09 -0.83 -1.32 0.00 0.00 176.35 175.29 1qa7 s GLY 33 N 1.32 2.83 -0.01 7.98 0.00 0.06 0.76 107.32 120.27 1qa7 s GLY 33 Ca 0.05 0.80 0.02 0.00 0.00 0.00 0.00 44.72 45.58 1qa7 s GLY 33 CO -0.09 1.28 0.03 3.33 0.00 0.00 0.00 173.10 177.65 1qa7 n VAL 34 N 0.20 0.03 0.00 1.40 0.24 0.11 -4.82 118.33 115.49 1qa7 n VAL 34 Ca 0.04 -0.05 0.00 0.00 -2.04 0.00 0.00 64.34 62.29 1qa7 n VAL 34 Cb 0.48 0.14 0.00 0.00 -1.47 0.00 0.00 33.84 32.99 1qa7 n VAL 34 CO 0.00 0.00 0.00 2.29 -2.14 0.00 0.00 176.83 176.98 1qa7 n LYS 35 N -1.67 0.00 0.00 7.34 2.85 -1.22 -0.71 118.16 124.74 1qa7 n LYS 35 Ca -0.01 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.25 1qa7 n LYS 35 Cb 0.16 0.00 0.00 0.00 -0.65 0.00 0.00 35.03 34.54 1qa7 n LYS 35 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 177.40 177.10 1qa7 n ASP 36 N 0.00 0.00 -1.60 -5.58 8.00 -1.09 -1.93 116.55 114.35 1qa7 n ASP 36 Ca 0.00 0.00 -0.14 0.00 0.71 0.00 0.00 54.79 55.36 1qa7 n ASP 36 Cb 0.00 0.00 0.15 0.00 -0.02 0.00 0.00 41.12 41.25 1qa7 n ASP 36 CO 0.00 0.00 0.00 -0.90 -0.39 0.00 0.00 177.20 175.91 1qa7 n ASP 37 N 4.22 3.68 -4.58 -2.24 5.68 -1.26 -1.87 116.55 120.18 1qa7 n ASP 37 Ca 0.00 -3.77 -0.34 0.00 -0.50 0.00 0.00 54.79 50.18 1qa7 n ASP 37 Cb 0.00 -0.67 -0.11 0.00 -1.14 0.00 0.00 41.12 39.20 1qa7 n ASP 37 CO 0.00 0.00 0.00 0.26 -1.33 0.00 0.00 177.20 176.13 1qa7 s TRP 38 N -3.39 3.06 0.15 2.11 0.52 -0.81 -0.51 118.94 120.06 1qa7 s TRP 38 Ca 0.50 -0.05 0.05 0.00 0.02 0.00 0.00 56.10 56.62 1qa7 s TRP 38 Cb 0.43 -1.85 -0.04 0.00 -1.15 0.00 0.00 33.47 30.86 1qa7 s TRP 38 CO 0.02 0.22 -0.12 -0.51 0.02 0.00 0.00 176.95 176.57 1qa7 s LEU 39 N -0.31 2.48 -0.03 2.99 1.02 -0.06 -0.71 118.68 124.07 1qa7 s LEU 39 Ca 0.05 -0.93 -0.18 0.00 0.02 0.00 0.00 54.13 53.09 1qa7 s LEU 39 Cb -0.12 -0.47 -0.05 0.00 0.02 0.00 0.00 46.19 45.56 1qa7 s LEU 39 CO 0.02 -0.23 0.51 -0.76 0.02 0.00 0.00 176.35 175.91 1qa7 s LEU 40 N -2.90 4.40 -0.03 1.79 1.43 0.23 -0.90 118.68 122.69 1qa7 s LEU 40 Ca 0.14 1.01 -0.01 0.00 -1.03 0.00 0.00 54.13 54.25 1qa7 s LEU 40 Cb -0.01 -2.77 0.03 0.00 0.03 0.00 0.00 46.19 43.48 1qa7 s LEU 40 CO 0.02 0.14 0.06 -0.69 0.23 0.00 0.00 176.35 176.12 1qa7 s VAL 41 N -0.24 -0.07 0.09 -1.59 1.01 -0.61 -1.60 120.40 117.39 1qa7 s VAL 41 Ca 0.27 0.24 -0.31 0.00 0.00 0.00 0.00 61.98 62.19 1qa7 s VAL 41 Cb -0.17 -0.13 -0.09 0.00 0.00 0.00 0.00 36.38 35.99 1qa7 s VAL 41 CO 0.14 0.10 1.67 -2.84 0.00 0.00 0.00 175.10 174.17 1qa7 s PRO 42 N 1.29 4.19 0.49 2.72 0.02 -1.26 -1.55 135.00 140.90 1qa7 s PRO 42 Ca -0.07 2.38 0.30 0.00 0.02 0.00 0.00 61.00 63.63 1qa7 s PRO 42 Cb -0.13 -3.52 1.63 0.00 0.02 0.00 0.00 34.50 32.50 1qa7 s PRO 42 CO -0.04 -0.73 1.91 0.66 -0.33 0.00 0.00 177.00 178.47 1qa7 h SER 43 N 8.12 0.00 1.14 2.53 4.64 -0.04 0.75 113.55 130.68 1qa7 h SER 43 Ca -0.43 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.89 1qa7 h SER 43 Cb 1.20 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.29 1qa7 h SER 43 CO 0.93 0.00 0.00 0.45 -0.87 0.00 0.00 176.83 177.34 1qa7 h HIS 44 N 0.00 0.00 0.00 4.77 3.86 -1.88 -1.18 115.15 120.72 1qa7 h HIS 44 Ca 0.00 0.00 -0.02 0.00 -1.16 0.00 0.00 60.37 59.19 1qa7 h HIS 44 Cb 0.16 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 28.63 1qa7 h HIS 44 CO 0.00 0.00 -0.10 0.00 0.86 0.00 0.00 177.93 178.69 1qa7 h ALA 45 N 2.21 1.21 0.00 2.45 0.00 -1.21 -3.33 119.26 120.59 1qa7 h ALA 45 Ca 0.00 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.82 1qa7 h ALA 45 Cb 0.57 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.34 1qa7 h ALA 45 CO 0.00 0.12 -0.05 2.48 0.00 0.00 0.00 179.25 181.80 1qa7 n TYR 46 N -3.51 0.00 0.05 0.00 0.18 -1.18 -4.90 117.16 107.80 1qa7 n TYR 46 Ca -0.02 0.00 0.04 0.00 1.88 0.00 0.00 57.90 59.80 1qa7 n TYR 46 Cb 0.23 0.00 0.19 0.00 -0.38 0.00 0.00 39.34 39.38 1qa7 n TYR 46 CO 0.00 0.00 0.00 0.36 -2.08 0.00 0.00 176.86 175.14 1qa7 n LYS 47 N -0.21 0.04 -0.02 -3.48 2.85 -0.45 -1.33 118.16 115.56 1qa7 n LYS 47 Ca 0.00 0.54 0.01 0.00 -1.05 0.00 0.00 58.31 57.81 1qa7 n LYS 47 Cb 0.00 -1.65 0.02 0.00 -0.65 0.00 0.00 35.03 32.75 1qa7 n LYS 47 CO 0.00 0.00 0.00 1.19 -0.05 0.00 0.00 177.40 178.54 1qa7 n PHE 48 N -1.74 0.05 -1.24 5.58 3.72 -1.26 -5.01 117.46 117.56 1qa7 n PHE 48 Ca -0.00 -0.29 -0.34 0.00 -0.05 0.00 0.00 57.45 56.76 1qa7 n PHE 48 Cb 0.01 -0.03 0.11 0.00 -0.94 0.00 0.00 39.48 38.64 1qa7 n PHE 48 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 176.76 177.10 1qa7 n GLU 49 N -0.14 0.38 -0.11 -1.08 -0.58 -0.44 -4.95 120.64 113.73 1qa7 n GLU 49 Ca 0.02 0.20 -0.19 0.00 -0.42 0.00 0.00 57.16 56.77 1qa7 n GLU 49 Cb 0.18 -2.45 -0.07 0.00 -0.57 0.00 0.00 31.44 28.53 1qa7 n GLU 49 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 1qa7 n LYS 50 N -2.94 0.55 -3.79 3.49 4.01 -1.26 -4.88 118.16 113.33 1qa7 n LYS 50 Ca 0.14 0.38 -0.37 0.00 -0.51 0.00 0.00 58.31 57.95 1qa7 n LYS 50 Cb 0.50 -1.58 -0.12 0.00 -0.51 0.00 0.00 35.03 33.32 1qa7 n LYS 50 CO 0.00 0.00 0.00 0.34 -1.11 0.00 0.00 177.40 176.63 1qa7 s ASP 51 N -6.69 5.20 0.14 4.39 -1.08 -1.26 -4.90 116.67 112.46 1qa7 s ASP 51 Ca -0.30 -1.44 0.24 0.00 -0.52 0.00 0.00 52.55 50.53 1qa7 s ASP 51 Cb 0.08 -1.82 0.38 0.00 -1.46 0.00 0.00 42.92 40.10 1qa7 s ASP 51 CO 0.46 -0.38 1.36 1.88 0.52 0.00 0.00 175.17 179.00 1qa7 h TYR 52 N 8.13 0.00 -0.84 -5.34 0.05 -1.94 -3.33 116.97 113.69 1qa7 h TYR 52 Ca -0.20 0.00 0.03 0.00 0.05 0.00 0.00 58.73 58.61 1qa7 h TYR 52 Cb 1.07 0.00 -0.05 0.00 1.01 0.00 0.00 36.73 38.76 1qa7 h TYR 52 CO 0.59 0.00 0.54 1.49 -1.05 0.00 0.00 178.16 179.73 1qa7 h GLU 53 N 0.00 1.01 -0.65 4.88 4.81 -2.01 -3.18 114.58 119.43 1qa7 h GLU 53 Ca 0.00 -0.06 -0.47 0.00 -0.13 0.00 0.00 59.36 58.70 1qa7 h GLU 53 Cb 0.76 -0.23 -0.41 0.00 0.63 0.00 0.00 28.75 29.50 1qa7 h GLU 53 CO 0.00 0.67 -0.86 -1.33 -0.73 0.00 0.00 179.01 176.76 1qa7 n MET 54 N -4.57 3.17 -4.42 1.92 2.81 -1.26 -5.00 117.12 109.78 1qa7 n MET 54 Ca 0.10 -4.00 -0.34 0.00 -1.81 0.00 0.00 57.70 51.66 1qa7 n MET 54 Cb 0.09 -2.11 -0.13 0.00 -0.71 0.00 0.00 33.22 30.36 1qa7 n MET 54 CO 0.00 0.00 0.00 1.41 1.51 0.00 0.00 175.97 178.89 1qa7 s MET 55 N -3.59 3.59 0.14 0.03 0.00 -1.20 -4.03 119.30 114.24 1qa7 s MET 55 Ca 0.46 -0.56 0.07 0.00 0.00 0.00 0.00 55.69 55.66 1qa7 s MET 55 Cb 0.39 -2.88 -0.04 0.00 0.00 0.00 0.00 34.83 32.30 1qa7 s MET 55 CO 0.02 0.19 -0.02 -1.21 0.00 0.00 0.00 175.02 174.00 1qa7 s GLU 56 N 0.48 2.39 -0.16 4.11 0.41 0.03 -2.72 118.70 123.25 1qa7 s GLU 56 Ca -0.04 -1.01 -0.07 0.00 -0.41 0.00 0.00 54.97 53.44 1qa7 s GLU 56 Cb -0.15 -2.40 -0.04 0.00 -1.78 0.00 0.00 34.13 29.76 1qa7 s GLU 56 CO 0.03 0.49 0.07 -0.06 -0.49 0.00 0.00 175.26 175.30 1qa7 s PHE 57 N -1.50 3.29 -0.05 1.61 0.08 0.01 -2.51 117.98 118.91 1qa7 s PHE 57 Ca 0.26 0.16 0.02 0.00 0.12 0.00 0.00 56.93 57.49 1qa7 s PHE 57 Cb -0.10 -2.02 -0.03 0.00 -0.57 0.00 0.00 43.02 40.29 1qa7 s PHE 57 CO 0.18 0.28 -0.10 0.71 -0.10 0.00 0.00 175.22 176.19 1qa7 s TYR 58 N 0.01 2.83 -0.09 0.36 2.02 0.20 -2.63 117.35 120.05 1qa7 s TYR 58 Ca 0.06 -0.06 0.00 0.00 -0.37 0.00 0.00 57.07 56.71 1qa7 s TYR 58 Cb -0.12 -1.66 0.02 0.00 -0.40 0.00 0.00 41.96 39.80 1qa7 s TYR 58 CO 0.01 0.28 -0.08 -0.06 -1.57 0.00 0.00 175.55 174.13 1qa7 s PHE 59 N -0.80 1.38 -0.51 2.71 0.40 -0.20 -1.03 117.98 119.93 1qa7 s PHE 59 Ca 0.13 -0.62 -0.18 0.00 -0.60 0.00 0.00 56.93 55.65 1qa7 s PHE 59 Cb -0.11 -1.13 0.07 0.00 0.51 0.00 0.00 43.02 42.36 1qa7 s PHE 59 CO 0.02 -0.42 0.59 1.21 0.70 0.00 0.00 175.22 177.32 1qa7 s ASN 60 N 1.37 6.20 -0.41 1.36 2.47 -1.00 -0.72 114.94 124.21 1qa7 s ASN 60 Ca -0.02 -1.07 0.03 0.00 0.42 0.00 0.00 52.86 52.23 1qa7 s ASN 60 Cb -0.14 -2.27 0.11 0.00 -1.45 0.00 0.00 41.25 37.51 1qa7 s ASN 60 CO -0.04 -0.87 0.15 -0.60 -3.72 0.00 0.00 177.10 172.02 1qa7 s ARG 61 N 2.43 1.57 -0.35 0.43 3.52 -0.53 -3.28 118.95 122.74 1qa7 s ARG 61 Ca 0.12 -2.09 -0.00 0.00 -0.13 0.00 0.00 55.73 53.63 1qa7 s ARG 61 Cb -0.21 -3.05 0.00 0.00 -1.56 0.00 0.00 34.95 30.13 1qa7 s ARG 61 CO 0.10 -1.03 0.29 0.41 -0.81 0.00 0.00 175.30 174.27 1qa7 n GLY 62 N 3.81 0.23 3.57 8.12 0.00 -1.26 -3.23 105.19 116.43 1qa7 n GLY 62 Ca 0.04 -0.32 0.00 0.00 0.00 0.00 0.00 46.02 45.75 1qa7 n GLY 62 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1qa7 n GLY 63 N -1.03 0.38 3.57 -0.02 0.00 -1.26 -4.98 105.19 101.85 1qa7 n GLY 63 Ca -0.08 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.60 1qa7 n GLY 63 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1qa7 s THR 64 N -2.12 3.76 -0.48 2.61 2.01 -1.20 -5.08 115.64 115.14 1qa7 s THR 64 Ca 0.00 -0.45 -0.17 0.00 0.31 0.00 0.00 61.69 61.38 1qa7 s THR 64 Cb 0.00 -2.56 0.06 0.00 0.01 0.00 0.00 72.50 70.01 1qa7 s THR 64 CO 0.00 0.58 0.49 -0.31 -0.69 0.00 0.00 174.62 174.69 1qa7 s TYR 65 N -0.62 3.16 0.24 4.92 2.02 -1.26 -1.46 117.35 124.36 1qa7 s TYR 65 Ca 0.09 -0.70 -0.09 0.00 -0.37 0.00 0.00 57.07 56.00 1qa7 s TYR 65 Cb -0.12 -3.27 -0.07 0.00 -0.40 0.00 0.00 41.96 38.11 1qa7 s TYR 65 CO 0.02 -0.87 0.56 0.71 -1.57 0.00 0.00 175.55 174.40 1qa7 s TYR 66 N 2.09 3.43 0.16 2.71 1.51 0.10 -4.88 117.35 122.47 1qa7 s TYR 66 Ca 0.09 0.87 -0.07 0.00 -1.01 0.00 0.00 57.07 56.95 1qa7 s TYR 66 Cb -0.21 -2.26 -0.02 0.00 -0.11 0.00 0.00 41.96 39.36 1qa7 s TYR 66 CO 0.10 0.24 0.24 -1.54 -1.11 0.00 0.00 175.55 173.47 1qa7 s SER 67 N -2.46 0.10 -0.26 2.29 1.04 -1.26 -1.03 113.70 112.12 1qa7 s SER 67 Ca 0.47 -0.98 -0.21 0.00 0.48 0.00 0.00 55.95 55.72 1qa7 s SER 67 Cb -0.11 0.41 0.07 0.00 0.10 0.00 0.00 66.02 66.49 1qa7 s SER 67 CO 0.22 -0.87 0.67 -0.51 0.98 0.00 0.00 173.24 173.74 1qa7 s ILE 68 N -4.00 -0.00 0.31 -1.02 1.10 -1.08 -4.89 121.20 111.62 1qa7 s ILE 68 Ca 0.20 0.00 -0.29 0.00 -0.51 0.00 0.00 60.65 60.06 1qa7 s ILE 68 Cb 0.04 -0.95 -0.10 0.00 0.15 0.00 0.00 42.46 41.60 1qa7 s ILE 68 CO 0.02 0.00 1.38 -0.55 -2.11 0.00 0.00 174.94 173.67 1qa7 s SER 69 N 0.76 6.67 0.64 4.50 0.15 -1.26 -0.81 113.70 124.35 1qa7 s SER 69 Ca -0.03 2.73 0.36 0.00 0.70 0.00 0.00 55.95 59.71 1qa7 s SER 69 Cb -0.05 -2.64 2.03 0.00 -1.71 0.00 0.00 66.02 63.65 1qa7 s SER 69 CO -0.05 -0.64 2.22 0.00 1.20 0.00 0.00 173.24 175.97 1qa7 h ALA 70 N 3.92 1.33 0.00 5.45 0.00 -1.81 0.23 119.26 128.38 1qa7 h ALA 70 Ca -0.48 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.43 1qa7 h ALA 70 Cb 1.22 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.02 1qa7 h ALA 70 CO 0.70 -0.12 -0.22 0.41 0.00 0.00 0.00 179.25 180.02 1qa7 n GLY 71 N -1.22 -1.48 0.00 0.00 0.00 -1.26 -3.88 105.19 97.35 1qa7 n GLY 71 Ca -0.02 -0.16 0.00 0.00 0.00 0.00 0.00 46.02 45.84 1qa7 n GLY 71 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1qa7 n ASN 72 N -1.79 0.47 -4.76 1.61 3.02 0.58 -5.03 115.26 109.35 1qa7 n ASN 72 Ca 0.06 -0.74 -0.40 0.00 -0.03 0.00 0.00 54.58 53.47 1qa7 n ASN 72 Cb 0.38 0.51 -0.03 0.00 -0.61 0.00 0.00 39.78 40.03 1qa7 n ASN 72 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1qa7 s VAL 73 N -0.51 3.17 -0.35 2.41 1.01 0.15 -4.90 120.40 121.38 1qa7 s VAL 73 Ca 0.00 1.14 -0.15 0.00 0.00 0.00 0.00 61.98 62.98 1qa7 s VAL 73 Cb 0.00 -3.71 -0.01 0.00 0.00 0.00 0.00 36.38 32.66 1qa7 s VAL 73 CO 0.00 0.25 0.33 -0.69 0.00 0.00 0.00 175.10 174.99 1qa7 s VAL 74 N -1.20 5.20 -0.17 2.92 1.01 -1.26 -5.02 120.40 121.88 1qa7 s VAL 74 Ca 0.48 -0.05 -0.01 0.00 0.00 0.00 0.00 61.98 62.40 1qa7 s VAL 74 Cb -0.34 -3.80 -0.01 0.00 0.00 0.00 0.00 36.38 32.23 1qa7 s VAL 74 CO 0.45 -0.09 -0.12 -0.63 0.00 0.00 0.00 175.10 174.71 1qa7 s ILE 75 N 1.93 2.95 -0.08 2.22 1.01 -1.26 -1.70 121.20 126.28 1qa7 s ILE 75 Ca 0.10 -0.67 0.03 0.00 0.00 0.00 0.00 60.65 60.11 1qa7 s ILE 75 Cb -0.17 -2.27 -0.02 0.00 0.01 0.00 0.00 42.46 40.01 1qa7 s ILE 75 CO 0.11 0.50 -0.15 -1.10 0.00 0.00 0.00 174.94 174.30 1qa7 s GLN 76 N 0.86 2.79 0.40 2.79 -1.52 0.31 -4.94 119.66 120.35 1qa7 s GLN 76 Ca -0.03 -0.72 -0.24 0.00 -1.95 0.00 0.00 55.36 52.41 1qa7 s GLN 76 Cb -0.15 -2.43 -0.09 0.00 -0.22 0.00 0.00 33.01 30.12 1qa7 s GLN 76 CO 0.00 0.46 1.09 -1.54 -0.25 0.00 0.00 175.29 175.05 1qa7 s SER 77 N -0.31 6.68 -0.03 5.90 1.04 -1.26 0.59 113.70 126.32 1qa7 s SER 77 Ca 0.02 2.15 -0.15 0.00 0.48 0.00 0.00 55.95 58.45 1qa7 s SER 77 Cb -0.13 -2.60 -0.32 0.00 0.10 0.00 0.00 66.02 63.07 1qa7 s SER 77 CO 0.03 -0.55 0.81 -0.07 0.98 0.00 0.00 173.24 174.43 1qa7 h LEU 78 N 2.57 0.66 0.00 2.42 3.38 -1.88 -3.46 115.31 119.00 1qa7 h LEU 78 Ca -0.48 -0.92 0.00 0.00 0.09 0.00 0.00 57.88 56.56 1qa7 h LEU 78 Cb 1.22 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 41.76 1qa7 h LEU 78 CO 0.62 1.69 0.00 -0.67 0.09 0.00 0.00 178.44 180.18 1qa7 n ASP 79 N -3.75 0.00 -4.94 -0.43 -0.08 -1.26 -4.65 116.55 101.44 1qa7 n ASP 79 Ca -0.20 -0.18 -0.25 0.00 -1.51 0.00 0.00 54.79 52.64 1qa7 n ASP 79 Cb 1.03 0.00 0.02 0.00 2.34 0.00 0.00 41.12 44.51 1qa7 n ASP 79 CO 0.00 0.00 0.00 0.68 0.12 0.00 0.00 177.20 178.00 1qa7 s VAL 80 N -1.82 3.87 0.00 5.18 -7.23 -1.26 -4.91 120.40 114.23 1qa7 s VAL 80 Ca 0.00 -0.25 0.00 0.00 -1.81 0.00 0.00 61.98 59.92 1qa7 s VAL 80 Cb 0.00 -3.48 0.00 0.00 0.56 0.00 0.00 36.38 33.46 1qa7 s VAL 80 CO 0.00 -0.41 0.00 0.61 -0.31 0.00 0.00 175.10 174.99 1qa7 n GLY 81 N -2.31 -0.57 0.00 2.32 0.00 -1.26 -4.77 105.19 98.60 1qa7 n GLY 81 Ca 0.03 -1.28 0.00 0.00 0.00 0.00 0.00 46.02 44.76 1qa7 n GLY 81 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1qa7 n ALA 82 N 3.63 0.00 -0.89 4.61 0.00 -1.26 -4.96 120.51 121.64 1qa7 n ALA 82 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1qa7 n ALA 82 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 1qa7 n ALA 82 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1qa7 n GLN 83 N -0.20 0.00 -0.00 0.00 1.13 -1.26 -5.04 117.38 112.00 1qa7 n GLN 83 Ca 0.00 0.30 0.11 0.00 -1.94 0.00 0.00 57.00 55.46 1qa7 n GLN 83 Cb 0.00 -0.89 -0.14 0.00 0.11 0.00 0.00 30.24 29.32 1qa7 n GLN 83 CO 0.00 0.00 0.00 -0.25 -1.44 0.00 0.00 177.06 175.37 1qa7 n ASP 84 N -0.49 0.46 -3.85 1.08 8.00 -1.26 -4.73 116.55 115.75 1qa7 n ASP 84 Ca 0.00 -0.43 -0.13 0.00 0.71 0.00 0.00 54.79 54.94 1qa7 n ASP 84 Cb 0.20 1.51 -0.15 0.00 -0.02 0.00 0.00 41.12 42.66 1qa7 n ASP 84 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1qa7 s VAL 85 N -3.28 0.03 0.35 2.53 1.01 -1.26 0.67 120.40 120.45 1qa7 s VAL 85 Ca -0.01 0.03 0.03 0.00 0.00 0.00 0.00 61.98 62.04 1qa7 s VAL 85 Cb 0.15 -0.06 -0.04 0.00 0.00 0.00 0.00 36.38 36.43 1qa7 s VAL 85 CO 0.89 0.03 0.12 0.68 0.00 0.00 0.00 175.10 176.82 1qa7 s VAL 86 N 0.27 0.65 -0.11 2.92 -7.23 -0.59 -4.40 120.40 111.92 1qa7 s VAL 86 Ca -0.02 -2.00 -0.01 0.00 -1.81 0.00 0.00 61.98 58.14 1qa7 s VAL 86 Cb -0.04 -2.51 -0.03 0.00 0.56 0.00 0.00 36.38 34.37 1qa7 s VAL 86 CO -0.01 0.00 -0.07 -0.76 -0.31 0.00 0.00 175.10 173.95 1qa7 s LEU 87 N -3.50 3.09 -0.02 1.32 1.43 0.20 -1.57 118.68 119.63 1qa7 s LEU 87 Ca 0.31 -0.12 0.05 0.00 -1.03 0.00 0.00 54.13 53.33 1qa7 s LEU 87 Cb 0.05 -1.70 -0.01 0.00 0.03 0.00 0.00 46.19 44.56 1qa7 s LEU 87 CO 0.16 0.26 -0.17 -0.32 0.23 0.00 0.00 176.35 176.51 1qa7 s MET 88 N -0.21 1.40 -0.10 1.70 1.75 -0.07 0.11 119.30 123.88 1qa7 s MET 88 Ca 0.02 -0.59 -0.03 0.00 -1.25 0.00 0.00 55.69 53.84 1qa7 s MET 88 Cb -0.13 -1.33 -0.03 0.00 2.84 0.00 0.00 34.83 36.17 1qa7 s MET 88 CO 0.03 0.34 0.02 0.21 -0.65 0.00 0.00 175.02 174.97 1qa7 s LYS 89 N -0.31 3.15 -0.39 4.11 2.20 -0.69 -0.88 119.74 126.92 1qa7 s LYS 89 Ca 0.05 -0.37 0.01 0.00 -0.36 0.00 0.00 55.97 55.30 1qa7 s LYS 89 Cb -0.07 -2.88 0.15 0.00 -1.51 0.00 0.00 37.83 33.51 1qa7 s LYS 89 CO -0.00 0.66 0.25 0.08 -0.36 0.00 0.00 175.35 175.98 1qa7 s VAL 90 N -0.75 0.52 0.67 4.02 1.01 0.33 -4.38 120.40 121.81 1qa7 s VAL 90 Ca 0.12 -2.16 0.35 0.00 0.00 0.00 0.00 61.98 60.29 1qa7 s VAL 90 Cb -0.12 -1.38 0.35 0.00 0.00 0.00 0.00 36.38 35.24 1qa7 s VAL 90 CO 0.02 -1.03 2.08 -0.65 0.00 0.00 0.00 175.10 175.53 1qa7 h PRO 91 N 6.61 0.00 -0.02 2.72 0.11 -1.94 -0.63 132.00 138.85 1qa7 h PRO 91 Ca 0.09 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.20 1qa7 h PRO 91 Cb 0.94 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.05 1qa7 h PRO 91 CO 0.34 0.00 -0.16 0.25 -0.21 0.00 0.00 178.00 178.23 1qa7 n THR 92 N -2.97 0.00 -2.16 -1.15 -2.24 -1.26 -4.95 114.28 99.54 1qa7 n THR 92 Ca -0.02 -0.38 -0.41 0.00 -2.27 0.00 0.00 64.05 60.97 1qa7 n THR 92 Cb 0.27 1.24 -0.03 0.00 -2.10 0.00 0.00 70.33 69.72 1qa7 n THR 92 CO 0.00 0.00 0.00 -0.51 -0.57 0.00 0.00 175.07 173.99 1qa7 s ILE 93 N -2.17 2.94 0.08 2.28 2.07 -0.25 -4.94 121.20 121.20 1qa7 s ILE 93 Ca 0.26 0.85 -0.31 0.00 -1.41 0.00 0.00 60.65 60.05 1qa7 s ILE 93 Cb 0.20 -3.54 -0.10 0.00 0.13 0.00 0.00 42.46 39.14 1qa7 s ILE 93 CO 0.40 0.17 1.91 -2.65 -1.91 0.00 0.00 174.94 172.86 1qa7 n PRO 94 N 1.69 2.82 -1.69 3.50 -0.02 -1.26 -4.85 135.00 135.20 1qa7 n PRO 94 Ca 0.03 1.03 -0.38 0.00 -2.02 0.00 0.00 63.50 62.16 1qa7 n PRO 94 Cb 0.42 -2.96 0.04 0.00 -0.02 0.00 0.00 33.50 30.99 1qa7 n PRO 94 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 1qa7 n LYS 95 N 6.61 1.39 -3.90 -0.52 5.02 -1.26 -4.98 118.16 120.52 1qa7 n LYS 95 Ca 0.19 0.52 -0.34 0.00 -2.02 0.00 0.00 58.31 56.66 1qa7 n LYS 95 Cb 0.39 -2.40 -0.05 0.00 -0.02 0.00 0.00 35.03 32.95 1qa7 n LYS 95 CO 0.00 0.00 0.00 -0.06 -0.52 0.00 0.00 177.40 176.82 1qa7 s PHE 96 N -1.35 3.56 0.14 2.13 0.08 -0.78 -4.93 117.98 116.82 1qa7 s PHE 96 Ca 0.73 0.39 -0.31 0.00 0.12 0.00 0.00 56.93 57.86 1qa7 s PHE 96 Cb -0.43 -1.85 -0.08 0.00 -0.57 0.00 0.00 43.02 40.09 1qa7 s PHE 96 CO 0.49 0.66 1.31 0.50 -0.10 0.00 0.00 175.22 178.07 1qa7 s ARG 97 N -1.81 4.38 -0.17 0.44 3.52 -1.26 -2.67 118.95 121.38 1qa7 s ARG 97 Ca 0.26 1.99 -0.29 0.00 -0.13 0.00 0.00 55.73 57.56 1qa7 s ARG 97 Cb -0.13 -3.25 -0.05 0.00 -1.56 0.00 0.00 34.95 29.97 1qa7 s ARG 97 CO 0.17 -0.31 2.01 0.34 -0.81 0.00 0.00 175.30 176.70 1qa7 s ASP 98 N 0.73 5.91 -0.13 -2.12 -1.08 -1.26 -4.37 116.67 114.36 1qa7 s ASP 98 Ca 0.60 1.98 0.15 0.00 -0.52 0.00 0.00 52.55 54.76 1qa7 s ASP 98 Cb -0.35 -2.52 0.40 0.00 -1.46 0.00 0.00 42.92 38.99 1qa7 s ASP 98 CO 0.33 -1.58 1.30 2.30 0.52 0.00 0.00 175.17 178.04 1qa7 n ILE 99 N 6.93 1.94 -0.33 4.11 -5.35 0.11 -4.73 119.36 122.04 1qa7 n ILE 99 Ca 0.25 -1.82 0.06 0.00 -0.27 0.00 0.00 62.75 60.96 1qa7 n ILE 99 Cb 0.44 -0.11 0.25 0.00 -1.74 0.00 0.00 39.64 38.48 1qa7 n ILE 99 CO 0.00 0.00 0.00 0.71 -1.76 0.00 0.00 176.55 175.50 1qa7 h THR 100 N 1.20 0.99 0.00 7.28 1.35 -1.87 -1.98 112.91 119.87 1qa7 h THR 100 Ca 0.00 -0.34 0.00 0.00 -0.55 0.00 0.00 66.41 65.52 1qa7 h THR 100 Cb 1.17 -0.09 0.00 0.00 -1.73 0.00 0.00 68.15 67.50 1qa7 h THR 100 CO 0.12 0.18 0.00 0.00 -0.25 0.00 0.00 175.52 175.57 1qa7 n GLN 101 N -4.54 0.21 0.00 4.72 3.00 -1.26 -1.78 117.38 117.73 1qa7 n GLN 101 Ca 0.16 0.12 0.13 0.00 -0.01 0.00 0.00 57.00 57.41 1qa7 n GLN 101 Cb 0.29 -1.50 0.42 0.00 0.00 0.00 0.00 30.24 29.45 1qa7 n GLN 101 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.06 177.78 1qa7 n HIS 102 N -1.33 0.00 -2.87 1.08 8.25 -0.74 -4.85 115.22 114.75 1qa7 n HIS 102 Ca 0.08 0.00 -0.40 0.00 -0.26 0.00 0.00 57.72 57.14 1qa7 n HIS 102 Cb 0.16 -0.09 -0.05 0.00 1.12 0.00 0.00 29.99 31.13 1qa7 n HIS 102 CO 0.00 0.00 0.00 -0.06 0.64 0.00 0.00 176.34 176.92 1qa7 s PHE 103 N -2.36 3.81 0.36 4.41 0.40 -0.73 -0.15 117.98 123.71 1qa7 s PHE 103 Ca 0.28 1.65 -0.28 0.00 -0.60 0.00 0.00 56.93 57.98 1qa7 s PHE 103 Cb 0.20 -2.91 -0.12 0.00 0.51 0.00 0.00 43.02 40.70 1qa7 s PHE 103 CO 0.47 0.30 1.40 1.51 0.70 0.00 0.00 175.22 179.60 1qa7 n ILE 104 N 2.52 1.95 -2.70 0.64 3.06 -0.04 -4.04 119.36 120.75 1qa7 n ILE 104 Ca -0.01 -0.49 -0.39 0.00 -2.50 0.00 0.00 62.75 59.36 1qa7 n ILE 104 Cb 0.49 -1.78 -0.06 0.00 0.54 0.00 0.00 39.64 38.84 1qa7 n ILE 104 CO 0.00 0.00 0.00 -0.54 -2.50 0.00 0.00 176.55 173.51 1qa7 s LYS 105 N -1.92 4.66 0.38 9.51 1.02 -1.26 -1.33 119.74 130.79 1qa7 s LYS 105 Ca 0.55 1.48 0.16 0.00 0.02 0.00 0.00 55.97 58.19 1qa7 s LYS 105 Cb -0.52 -3.02 1.06 0.00 -0.52 0.00 0.00 37.83 34.83 1qa7 s LYS 105 CO 0.62 0.32 1.74 -0.22 -0.92 0.00 0.00 175.35 176.90 1qa7 h LYS 106 N 3.58 0.41 -0.00 1.68 1.63 -1.94 0.47 116.57 122.39 1qa7 h LYS 106 Ca -0.46 -0.02 0.00 0.00 -0.85 0.00 0.00 60.65 59.31 1qa7 h LYS 106 Cb 1.20 -0.09 0.00 0.00 -0.60 0.00 0.00 32.23 32.74 1qa7 h LYS 106 CO 0.66 0.27 -0.04 0.41 -3.45 0.00 0.00 179.45 177.30 1qa7 n GLY 107 N -1.42 -1.17 0.00 5.01 0.00 -1.26 -2.96 105.19 103.39 1qa7 n GLY 107 Ca 0.27 -0.19 0.11 0.00 0.00 0.00 0.00 46.02 46.21 1qa7 n GLY 107 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1qa7 n ASP 108 N -1.18 0.81 -0.35 1.61 8.00 0.16 -4.50 116.55 121.12 1qa7 n ASP 108 Ca 0.14 -0.73 0.24 0.00 0.71 0.00 0.00 54.79 55.15 1qa7 n ASP 108 Cb 0.25 0.86 0.48 0.00 -0.02 0.00 0.00 41.12 42.69 1qa7 n ASP 108 CO 0.00 0.00 0.00 0.58 -0.39 0.00 0.00 177.20 177.39 1qa7 h VAL 109 N 0.00 0.37 0.00 2.53 2.07 -1.41 0.31 116.25 120.12 1qa7 h VAL 109 Ca 0.00 -0.13 0.00 0.00 0.82 0.00 0.00 66.70 67.39 1qa7 h VAL 109 Cb 0.54 -0.03 0.00 0.00 -1.52 0.00 0.00 31.29 30.28 1qa7 h VAL 109 CO 0.00 0.07 0.00 1.55 0.02 0.00 0.00 177.57 179.21 1qa7 h PRO 110 N 0.37 0.00 0.00 1.57 0.13 -1.84 -2.32 132.00 129.91 1qa7 h PRO 110 Ca 0.70 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.83 1qa7 h PRO 110 Cb 1.65 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.78 1qa7 h PRO 110 CO -0.51 0.00 0.00 0.54 -0.23 0.00 0.00 178.00 177.80 1qa7 n ARG 111 N -3.08 0.20 0.02 0.86 5.12 0.11 -3.08 116.66 116.81 1qa7 n ARG 111 Ca -0.00 0.31 0.06 0.00 -1.93 0.00 0.00 57.85 56.29 1qa7 n ARG 111 Cb 0.26 -1.81 -0.10 0.00 -1.16 0.00 0.00 32.46 29.65 1qa7 n ARG 111 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1qa7 n ALA 112 N -1.75 2.39 -1.72 7.54 0.00 -0.87 -4.87 120.51 121.22 1qa7 n ALA 112 Ca 0.04 -0.53 -0.36 0.00 0.00 0.00 0.00 53.44 52.59 1qa7 n ALA 112 Cb 0.32 -0.84 0.06 0.00 0.00 0.00 0.00 19.45 18.98 1qa7 n ALA 112 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1qa7 s LEU 113 N -5.16 3.59 -1.87 0.00 1.43 -1.18 -2.52 118.68 112.98 1qa7 s LEU 113 Ca -0.05 2.54 0.00 0.00 -1.03 0.00 0.00 54.13 55.59 1qa7 s LEU 113 Cb 0.11 -4.61 0.00 0.00 0.03 0.00 0.00 46.19 41.71 1qa7 s LEU 113 CO 0.84 -1.88 0.00 0.59 0.23 0.00 0.00 176.35 176.13 1qa7 n ASN 114 N -1.83 -5.01 -4.58 2.29 3.02 0.74 -4.83 115.26 105.05 1qa7 n ASN 114 Ca 0.15 0.35 -0.24 0.00 -0.03 0.00 0.00 54.58 54.81 1qa7 n ASN 114 Cb 0.49 -4.40 -0.09 0.00 -0.61 0.00 0.00 39.78 35.17 1qa7 n ASN 114 CO 0.00 0.00 0.00 -0.13 -2.62 0.00 0.00 177.26 174.51 1qa7 s ARG 115 N -3.96 1.99 0.88 3.52 3.00 -1.05 -4.72 118.95 118.61 1qa7 s ARG 115 Ca 0.00 -1.71 -0.13 0.00 0.00 0.00 0.00 55.73 53.89 1qa7 s ARG 115 Cb 0.00 -1.91 0.12 0.00 0.00 0.00 0.00 34.95 33.16 1qa7 s ARG 115 CO 0.00 0.24 1.20 -0.51 0.00 0.00 0.00 175.30 176.23 1qa7 s LEU 116 N -3.64 2.40 0.31 2.53 1.43 -1.26 0.11 118.68 120.55 1qa7 s LEU 116 Ca 0.33 0.69 -0.15 0.00 -1.03 0.00 0.00 54.13 53.97 1qa7 s LEU 116 Cb -0.02 -3.02 0.02 0.00 0.03 0.00 0.00 46.19 43.19 1qa7 s LEU 116 CO 0.18 -2.29 0.64 0.00 0.23 0.00 0.00 176.35 175.11 1qa7 s ALA 117 N -3.58 -0.57 -0.14 4.21 0.00 0.76 -3.26 121.76 119.18 1qa7 s ALA 117 Ca 0.65 -0.73 -0.00 0.00 0.00 0.00 0.00 51.96 51.88 1qa7 s ALA 117 Cb -0.10 0.90 0.03 0.00 0.00 0.00 0.00 23.12 23.95 1qa7 s ALA 117 CO 0.51 -0.94 -0.10 0.99 0.00 0.00 0.00 175.76 176.21 1qa7 s THR 118 N -3.42 1.31 -0.44 0.00 2.01 0.20 -0.62 115.64 114.68 1qa7 s THR 118 Ca 0.18 -0.52 -0.28 0.00 0.31 0.00 0.00 61.69 61.37 1qa7 s THR 118 Cb -0.04 -1.30 0.03 0.00 0.01 0.00 0.00 72.50 71.20 1qa7 s THR 118 CO 0.10 0.37 1.09 -0.22 -0.69 0.00 0.00 174.62 175.27 1qa7 s LEU 119 N 1.58 3.75 -0.52 4.42 2.96 0.77 -1.49 118.68 130.16 1qa7 s LEU 119 Ca 0.04 0.52 -0.18 0.00 -0.22 0.00 0.00 54.13 54.30 1qa7 s LEU 119 Cb -0.13 -3.49 0.08 0.00 0.50 0.00 0.00 46.19 43.15 1qa7 s LEU 119 CO -0.09 -1.14 0.57 -0.69 -1.32 0.00 0.00 176.35 173.67 1qa7 s VAL 120 N 4.18 5.00 0.00 1.68 1.01 -0.03 -0.78 120.40 131.46 1qa7 s VAL 120 Ca 0.46 -0.89 0.00 0.00 0.00 0.00 0.00 61.98 61.55 1qa7 s VAL 120 Cb -0.09 -4.30 0.00 0.00 0.00 0.00 0.00 36.38 31.99 1qa7 s VAL 120 CO 0.28 -0.83 0.00 0.41 0.00 0.00 0.00 175.10 174.96 1qa7 n THR 121 N 5.44 0.00 -3.80 3.92 -1.04 -0.98 -2.41 114.28 115.42 1qa7 n THR 121 Ca -0.10 0.00 -0.13 0.00 -2.04 0.00 0.00 64.05 61.79 1qa7 n THR 121 Cb 0.44 0.00 -0.12 0.00 -1.82 0.00 0.00 70.33 68.83 1qa7 n THR 121 CO 0.00 0.00 0.00 -0.89 -0.64 0.00 0.00 175.07 173.54 1qa7 s THR 122 N -0.03 0.01 -0.13 12.58 2.01 -1.26 -1.13 115.64 127.69 1qa7 s THR 122 Ca 0.00 -0.05 -0.00 0.00 0.31 0.00 0.00 61.69 61.94 1qa7 s THR 122 Cb 0.00 -0.34 0.03 0.00 0.01 0.00 0.00 72.50 72.21 1qa7 s THR 122 CO 0.00 -0.03 -0.07 -0.69 -0.69 0.00 0.00 174.62 173.14 1qa7 s VAL 123 N -0.01 1.04 0.00 3.82 1.01 0.43 -4.23 120.40 122.47 1qa7 s VAL 123 Ca -0.01 -0.41 0.00 0.00 0.00 0.00 0.00 61.98 61.56 1qa7 s VAL 123 Cb -0.02 -1.13 0.00 0.00 0.00 0.00 0.00 36.38 35.23 1qa7 s VAL 123 CO 0.01 0.27 0.00 -3.20 0.00 0.00 0.00 175.10 172.18 1qa7 n ASN 124 N 4.92 0.00 0.00 3.32 2.85 -1.26 -0.12 115.26 124.97 1qa7 n ASN 124 Ca -0.12 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.35 1qa7 n ASN 124 Cb 0.49 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.51 1qa7 n ASN 124 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1qa7 n GLY 125 N 0.03 1.88 3.61 8.20 0.00 -1.26 -4.98 105.19 112.68 1qa7 n GLY 125 Ca 0.00 -0.62 -0.44 0.00 0.00 0.00 0.00 46.02 44.96 1qa7 n GLY 125 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1qa7 n THR 126 N 0.00 0.48 -2.52 2.61 -2.24 0.82 -4.90 114.28 108.53 1qa7 n THR 126 Ca 0.00 -0.33 -0.39 0.00 -2.27 0.00 0.00 64.05 61.05 1qa7 n THR 126 Cb 0.00 -2.40 -0.04 0.00 -2.10 0.00 0.00 70.33 65.79 1qa7 n THR 126 CO 0.00 0.00 0.00 -2.84 -0.57 0.00 0.00 175.07 171.66 1qa7 s PRO 127 N 5.66 4.56 0.26 -0.78 0.02 -1.26 0.16 135.00 143.62 1qa7 s PRO 127 Ca 0.97 1.71 0.04 0.00 0.02 0.00 0.00 61.00 63.74 1qa7 s PRO 127 Cb -0.42 -3.06 -0.05 0.00 0.02 0.00 0.00 34.50 30.99 1qa7 s PRO 127 CO 0.39 0.17 0.01 -1.64 -0.33 0.00 0.00 177.00 175.60 1qa7 s MET 128 N -1.65 1.43 -0.30 5.54 1.00 -0.28 -4.88 119.30 120.16 1qa7 s MET 128 Ca 0.47 -1.74 0.00 0.00 0.00 0.00 0.00 55.69 54.42 1qa7 s MET 128 Cb -0.29 -0.72 0.09 0.00 0.00 0.00 0.00 34.83 33.92 1qa7 s MET 128 CO 0.37 -0.11 0.07 -0.51 0.00 0.00 0.00 175.02 174.85 1qa7 s LEU 129 N -3.36 2.65 -0.28 -0.03 1.43 -1.26 -2.30 118.68 115.52 1qa7 s LEU 129 Ca 0.31 -1.63 -0.12 0.00 -1.03 0.00 0.00 54.13 51.65 1qa7 s LEU 129 Cb 0.06 -1.01 -0.05 0.00 0.03 0.00 0.00 46.19 45.22 1qa7 s LEU 129 CO 0.11 -0.39 0.24 -0.63 0.23 0.00 0.00 176.35 175.91 1qa7 s ILE 130 N 1.49 5.28 0.22 -0.59 1.09 0.04 -4.92 121.20 123.80 1qa7 s ILE 130 Ca 0.08 0.25 -0.30 0.00 -1.10 0.00 0.00 60.65 59.58 1qa7 s ILE 130 Cb -0.18 -3.58 -0.09 0.00 -1.06 0.00 0.00 42.46 37.55 1qa7 s ILE 130 CO -0.19 0.22 1.28 -0.55 -0.10 0.00 0.00 174.94 175.59 1qa7 s SER 131 N 1.73 6.93 0.32 3.58 0.15 -1.26 -0.16 113.70 124.99 1qa7 s SER 131 Ca 0.09 2.42 0.05 0.00 0.70 0.00 0.00 55.95 59.20 1qa7 s SER 131 Cb -0.16 -2.62 -0.02 0.00 -1.71 0.00 0.00 66.02 61.51 1qa7 s SER 131 CO 0.11 -0.48 0.31 -1.61 1.20 0.00 0.00 173.24 172.77 1qa7 s GLU 132 N -0.48 1.75 0.00 5.44 2.02 0.21 -4.69 118.70 122.96 1qa7 s GLU 132 Ca 0.54 -1.94 0.00 0.00 0.02 0.00 0.00 54.97 53.60 1qa7 s GLU 132 Cb -0.36 0.35 0.00 0.00 0.10 0.00 0.00 34.13 34.22 1qa7 s GLU 132 CO 0.40 -0.66 0.00 0.41 0.02 0.00 0.00 175.26 175.43 1qa7 n GLY 133 N -0.58 0.66 3.77 -1.39 0.00 -1.21 -0.17 105.19 106.27 1qa7 n GLY 133 Ca 0.06 -2.21 -0.36 0.00 0.00 0.00 0.00 46.02 43.51 1qa7 n GLY 133 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1qa7 s PRO 134 N -1.03 3.32 0.17 1.61 0.05 -1.25 -4.21 135.00 133.66 1qa7 s PRO 134 Ca 0.00 1.74 -0.30 0.00 0.05 0.00 0.00 61.00 62.49 1qa7 s PRO 134 Cb 0.00 -2.08 -0.07 0.00 0.05 0.00 0.00 34.50 32.40 1qa7 s PRO 134 CO 0.00 -0.91 1.05 -0.51 0.05 0.00 0.00 177.00 176.69 1qa7 s LEU 135 N -3.71 4.51 0.45 -3.56 1.43 0.29 -4.58 118.68 113.51 1qa7 s LEU 135 Ca 0.72 2.02 0.07 0.00 -1.03 0.00 0.00 54.13 55.91 1qa7 s LEU 135 Cb -0.28 -3.60 -0.02 0.00 0.03 0.00 0.00 46.19 42.33 1qa7 s LEU 135 CO 0.31 -0.14 0.30 -0.54 0.23 0.00 0.00 176.35 176.51 1qa7 s LYS 136 N -0.43 2.33 -0.02 1.70 -0.14 -0.47 -0.19 119.74 122.53 1qa7 s LYS 136 Ca 0.48 -1.80 -0.07 0.00 -1.36 0.00 0.00 55.97 53.22 1qa7 s LYS 136 Cb -0.28 -2.13 0.01 0.00 -1.68 0.00 0.00 37.83 33.75 1qa7 s LYS 136 CO 0.34 -0.28 0.14 1.41 -0.76 0.00 0.00 175.35 176.20 1qa7 s MET 137 N -4.08 0.39 -0.03 1.68 -2.45 -1.26 -2.06 119.30 111.49 1qa7 s MET 137 Ca 0.41 -0.20 0.02 0.00 -1.25 0.00 0.00 55.69 54.66 1qa7 s MET 137 Cb -0.00 0.16 0.01 0.00 1.25 0.00 0.00 34.83 36.26 1qa7 s MET 137 CO 0.23 -0.08 -0.06 -2.00 1.05 0.00 0.00 175.02 174.16 1qa7 s GLU 138 N -0.91 0.85 0.16 4.11 2.56 -1.07 -5.01 118.70 119.38 1qa7 s GLU 138 Ca -0.10 -0.20 -0.11 0.00 0.00 0.00 0.00 54.97 54.56 1qa7 s GLU 138 Cb -0.06 -0.82 0.04 0.00 2.00 0.00 0.00 34.13 35.30 1qa7 s GLU 138 CO 0.01 0.02 1.63 1.49 -0.56 0.00 0.00 175.26 177.85 1qa7 h GLU 139 N 6.73 0.95 -2.60 4.30 4.81 -1.91 -2.28 114.58 124.58 1qa7 h GLU 139 Ca -0.35 -0.29 -0.10 0.00 -0.13 0.00 0.00 59.36 58.49 1qa7 h GLU 139 Cb 1.17 -0.09 -0.25 0.00 0.63 0.00 0.00 28.75 30.20 1qa7 h GLU 139 CO 0.48 0.94 -0.25 0.21 -0.73 0.00 0.00 179.01 179.66 1qa7 s LYS 140 N -5.08 0.44 0.14 1.92 2.20 -1.26 -1.38 119.74 116.73 1qa7 s LYS 140 Ca -0.12 0.78 -0.25 0.00 -0.36 0.00 0.00 55.97 56.02 1qa7 s LYS 140 Cb 0.12 0.05 0.07 0.00 -1.51 0.00 0.00 37.83 36.56 1qa7 s LYS 140 CO 0.83 -0.14 0.84 0.00 -0.36 0.00 0.00 175.35 176.52 1qa7 s ALA 141 N 1.16 -1.60 -0.22 3.13 0.00 -1.14 -5.02 121.76 118.08 1qa7 s ALA 141 Ca -0.07 0.32 -0.03 0.00 0.00 0.00 0.00 51.96 52.17 1qa7 s ALA 141 Cb -0.07 0.67 0.00 0.00 0.00 0.00 0.00 23.12 23.72 1qa7 s ALA 141 CO -0.10 -0.91 -0.07 0.99 0.00 0.00 0.00 175.76 175.66 1qa7 s THR 142 N -3.45 3.08 -0.02 0.00 2.01 -1.26 -0.32 115.64 115.68 1qa7 s THR 142 Ca 0.08 -0.62 0.03 0.00 0.31 0.00 0.00 61.69 61.49 1qa7 s THR 142 Cb -0.02 -2.40 -0.03 0.00 0.01 0.00 0.00 72.50 70.06 1qa7 s THR 142 CO -0.02 0.42 -0.10 -0.31 -0.69 0.00 0.00 174.62 173.93 1qa7 s TYR 143 N 1.43 2.81 0.38 4.92 2.02 1.06 -4.79 117.35 125.18 1qa7 s TYR 143 Ca 0.05 -0.08 -0.24 0.00 -0.37 0.00 0.00 57.07 56.43 1qa7 s TYR 143 Cb -0.14 -1.62 -0.10 0.00 -0.40 0.00 0.00 41.96 39.70 1qa7 s TYR 143 CO -0.05 0.31 0.97 0.08 -1.57 0.00 0.00 175.55 175.29 1qa7 s VAL 144 N -0.89 4.13 0.00 0.71 1.01 -1.26 0.38 120.40 124.48 1qa7 s VAL 144 Ca 0.14 1.59 0.00 0.00 0.00 0.00 0.00 61.98 63.72 1qa7 s VAL 144 Cb -0.11 -3.80 0.00 0.00 0.00 0.00 0.00 36.38 32.47 1qa7 s VAL 144 CO 0.04 -0.03 0.00 1.57 0.00 0.00 0.00 175.10 176.68 1qa7 n HIS 145 N 0.03 0.00 -4.68 5.22 -0.00 0.52 -3.39 115.22 112.91 1qa7 n HIS 145 Ca 0.04 0.00 -0.31 0.00 0.46 0.00 0.00 57.72 57.91 1qa7 n HIS 145 Cb 0.51 0.00 -0.17 0.00 -0.12 0.00 0.00 29.99 30.22 1qa7 n HIS 145 CO 0.00 0.00 0.00 0.21 0.46 0.00 0.00 176.34 177.01 1qa7 s LYS 146 N 1.54 2.77 0.00 1.57 2.36 -1.26 -4.29 119.74 122.43 1qa7 s LYS 146 Ca 0.00 -0.77 0.00 0.00 -2.55 0.00 0.00 55.97 52.65 1qa7 s LYS 146 Cb 0.00 -2.24 0.00 0.00 -1.05 0.00 0.00 37.83 34.54 1qa7 s LYS 146 CO 0.00 -0.00 0.00 1.63 1.55 0.00 0.00 175.35 178.53 1qa7 n LYS 147 N 4.03 0.00 -0.12 4.03 4.76 -1.26 -4.70 118.16 124.90 1qa7 n LYS 147 Ca -0.20 0.00 0.04 0.00 -2.87 0.00 0.00 58.31 55.29 1qa7 n LYS 147 Cb 0.52 0.00 0.11 0.00 -1.84 0.00 0.00 35.03 33.81 1qa7 n LYS 147 CO 0.00 0.00 0.00 0.09 -1.37 0.00 0.00 177.40 176.12 1qa7 n ASN 148 N 0.00 2.57 0.00 4.39 5.03 -1.26 -3.45 115.26 122.54 1qa7 n ASN 148 Ca 0.00 -1.90 0.00 0.00 0.87 0.00 0.00 54.58 53.55 1qa7 n ASN 148 Cb 0.00 -0.15 0.00 0.00 -1.02 0.00 0.00 39.78 38.61 1qa7 n ASN 148 CO 0.00 0.00 0.00 -0.90 -1.83 0.00 0.00 177.26 174.53 1qa7 n ASP 149 N 0.31 3.01 -0.07 6.41 5.75 -1.26 -4.92 116.55 125.79 1qa7 n ASP 149 Ca 0.08 0.00 -0.12 0.00 -0.01 0.00 0.00 54.79 54.74 1qa7 n ASP 149 Cb 0.36 0.00 -0.06 0.00 -1.03 0.00 0.00 41.12 40.39 1qa7 n ASP 149 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1qa7 n GLY 150 N 3.31 -0.21 3.42 6.12 0.00 -1.26 -5.07 105.19 111.49 1qa7 n GLY 150 Ca 0.00 -0.08 -0.07 0.00 0.00 0.00 0.00 46.02 45.87 1qa7 n GLY 150 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1qa7 s THR 151 N -2.27 -0.50 1.09 2.61 -4.23 -1.26 -5.17 115.64 105.90 1qa7 s THR 151 Ca -0.19 0.08 -0.16 0.00 -1.18 0.00 0.00 61.69 60.24 1qa7 s THR 151 Cb 0.06 -0.79 0.23 0.00 1.34 0.00 0.00 72.50 73.34 1qa7 s THR 151 CO 0.29 0.03 1.12 0.28 -0.54 0.00 0.00 174.62 175.81 1qa7 s THR 152 N 2.27 1.81 -0.34 3.99 -1.32 -1.22 -4.57 115.64 116.26 1qa7 s THR 152 Ca -0.06 0.00 0.03 0.00 -1.21 0.00 0.00 61.69 60.45 1qa7 s THR 152 Cb -0.10 -2.56 0.10 0.00 -1.51 0.00 0.00 72.50 68.43 1qa7 s THR 152 CO -0.15 0.00 0.06 0.68 -2.21 0.00 0.00 174.62 173.00 1qa7 s VAL 153 N -3.09 2.00 -0.15 5.08 -7.23 -1.26 -4.91 120.40 110.85 1qa7 s VAL 153 Ca 0.68 -2.17 -0.07 0.00 -1.81 0.00 0.00 61.98 58.61 1qa7 s VAL 153 Cb -0.13 -2.49 -0.04 0.00 0.56 0.00 0.00 36.38 34.28 1qa7 s VAL 153 CO 0.56 -0.62 0.10 -1.81 -0.31 0.00 0.00 175.10 173.02 1qa7 s ASP 154 N 1.03 6.02 -0.11 4.85 1.11 -1.25 0.19 116.67 128.51 1qa7 s ASP 154 Ca 0.11 0.28 0.02 0.00 0.18 0.00 0.00 52.55 53.14 1qa7 s ASP 154 Cb -0.19 -1.97 0.01 0.00 1.07 0.00 0.00 42.92 41.85 1qa7 s ASP 154 CO -0.11 0.30 -0.16 -0.76 1.18 0.00 0.00 175.17 175.62 1qa7 s LEU 155 N -0.37 1.74 -0.35 1.23 1.43 1.23 -4.81 118.68 118.77 1qa7 s LEU 155 Ca 0.10 -0.44 -0.23 0.00 -1.03 0.00 0.00 54.13 52.54 1qa7 s LEU 155 Cb -0.12 -1.11 0.01 0.00 0.03 0.00 0.00 46.19 45.00 1qa7 s LEU 155 CO 0.01 0.02 0.78 -0.89 0.23 0.00 0.00 176.35 176.50 1qa7 s THR 156 N 0.97 4.75 -0.04 5.49 2.01 -1.25 0.34 115.64 127.92 1qa7 s THR 156 Ca -0.07 0.94 0.07 0.00 0.31 0.00 0.00 61.69 62.94 1qa7 s THR 156 Cb -0.15 -4.19 -0.01 0.00 0.01 0.00 0.00 72.50 68.16 1qa7 s THR 156 CO -0.01 -0.39 -0.24 -0.69 -0.69 0.00 0.00 174.62 172.60 1qa7 s VAL 157 N 3.06 1.94 0.17 3.82 1.01 0.56 -4.95 120.40 126.01 1qa7 s VAL 157 Ca 0.31 -1.03 0.01 0.00 0.00 0.00 0.00 61.98 61.28 1qa7 s VAL 157 Cb -0.13 -1.63 -0.04 0.00 0.00 0.00 0.00 36.38 34.58 1qa7 s VAL 157 CO 0.16 0.55 0.33 -1.81 0.00 0.00 0.00 175.10 174.32 1qa7 s ASP 158 N -0.33 6.36 -1.07 3.32 1.01 -1.26 -2.89 116.67 121.81 1qa7 s ASP 158 Ca 0.02 0.27 -0.21 0.00 0.71 0.00 0.00 52.55 53.35 1qa7 s ASP 158 Cb -0.12 -1.96 0.02 0.00 1.01 0.00 0.00 42.92 41.88 1qa7 s ASP 158 CO 0.01 0.01 0.70 0.00 0.21 0.00 0.00 175.17 176.11 1qa7 n GLN 159 N -0.57 -0.90 -5.11 8.23 6.02 -0.48 -4.64 117.38 119.93 1qa7 n GLN 159 Ca -0.06 0.44 -0.32 0.00 -0.01 0.00 0.00 57.00 57.05 1qa7 n GLN 159 Cb 0.54 -3.14 -0.17 0.00 1.02 0.00 0.00 30.24 28.49 1qa7 n GLN 159 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1qa7 s ALA 160 N -3.35 2.25 0.45 -1.58 0.00 -0.86 -1.01 121.76 117.67 1qa7 s ALA 160 Ca 0.34 -0.96 -0.23 0.00 0.00 0.00 0.00 51.96 51.11 1qa7 s ALA 160 Cb -0.16 -0.89 -0.07 0.00 0.00 0.00 0.00 23.12 21.99 1qa7 s ALA 160 CO 0.91 0.26 1.20 -1.58 0.00 0.00 0.00 175.76 176.55 1qa7 s TRP 161 N 0.37 2.84 -0.04 0.00 0.52 0.67 -2.60 118.94 120.71 1qa7 s TRP 161 Ca -0.17 1.51 -0.00 0.00 0.02 0.00 0.00 56.10 57.46 1qa7 s TRP 161 Cb -0.18 -3.45 0.03 0.00 -1.15 0.00 0.00 33.47 28.72 1qa7 s TRP 161 CO 0.08 -1.67 0.01 1.03 0.02 0.00 0.00 176.95 176.42 1qa7 s ARG 162 N -2.60 0.27 -0.01 4.98 0.52 -0.87 -1.32 118.95 119.91 1qa7 s ARG 162 Ca 0.63 0.13 0.01 0.00 -0.52 0.00 0.00 55.73 55.98 1qa7 s ARG 162 Cb -0.31 -0.54 0.01 0.00 0.52 0.00 0.00 34.95 34.62 1qa7 s ARG 162 CO 0.38 -0.19 -0.01 0.20 0.02 0.00 0.00 175.30 175.70 1qa7 s GLY 163 N 1.34 0.13 0.33 -3.53 0.00 0.73 -1.36 107.32 104.96 1qa7 s GLY 163 Ca -0.05 -0.01 -0.29 0.00 0.00 0.00 0.00 44.72 44.36 1qa7 s GLY 163 CO -0.02 0.10 1.56 1.17 0.00 0.00 0.00 173.10 175.91 1qa7 n LYS 164 N 3.32 2.72 0.00 2.90 0.00 -1.26 0.17 118.16 126.01 1qa7 n LYS 164 Ca -0.16 0.96 0.00 0.00 0.00 0.00 0.00 58.31 59.11 1qa7 n LYS 164 Cb 0.57 -2.73 0.00 0.00 0.00 0.00 0.00 35.03 32.87 1qa7 n LYS 164 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1qa7 n GLY 165 N 1.39 0.89 3.06 3.14 0.00 0.33 -3.29 105.19 110.72 1qa7 n GLY 165 Ca 0.05 -0.82 -0.30 0.00 0.00 0.00 0.00 46.02 44.95 1qa7 n GLY 165 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1qa7 s GLU 166 N -2.00 2.42 0.00 1.61 8.01 -1.26 -3.33 118.70 124.15 1qa7 s GLU 166 Ca 0.00 -0.62 0.00 0.00 0.01 0.00 0.00 54.97 54.36 1qa7 s GLU 166 Cb 0.00 -2.10 0.00 0.00 -4.31 0.00 0.00 34.13 27.72 1qa7 s GLU 166 CO 0.00 -0.14 0.00 0.41 0.01 0.00 0.00 175.26 175.54 1qa7 n GLY 167 N 4.45 5.33 3.08 -1.39 0.00 -1.26 -4.96 105.19 110.43 1qa7 n GLY 167 Ca -0.18 -1.72 -0.08 0.00 0.00 0.00 0.00 46.02 44.04 1qa7 n GLY 167 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1qa7 s LEU 168 N 0.00 2.44 0.73 0.99 1.43 -1.26 -5.08 118.68 117.93 1qa7 s LEU 168 Ca 0.00 -0.91 -0.14 0.00 -1.03 0.00 0.00 54.13 52.05 1qa7 s LEU 168 Cb 0.00 0.15 0.04 0.00 0.03 0.00 0.00 46.19 46.41 1qa7 s LEU 168 CO 0.00 -0.53 1.17 -2.84 0.23 0.00 0.00 176.35 174.38 1qa7 s PRO 169 N -3.45 2.24 0.00 1.29 0.02 -1.26 -2.51 135.00 131.33 1qa7 s PRO 169 Ca 0.03 1.61 0.00 0.00 0.02 0.00 0.00 61.00 62.66 1qa7 s PRO 169 Cb 0.04 -1.86 0.00 0.00 0.02 0.00 0.00 34.50 32.70 1qa7 s PRO 169 CO -0.08 -1.73 0.00 0.41 -0.33 0.00 0.00 177.00 175.27 1qa7 n GLY 170 N 0.04 2.70 0.24 0.52 0.00 -1.26 -4.90 105.19 102.52 1qa7 n GLY 170 Ca 0.12 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.30 1qa7 n GLY 170 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 1qa7 h MET 171 N 2.78 0.00 -6.98 1.61 2.86 -1.66 -3.36 114.93 110.19 1qa7 h MET 171 Ca 0.00 0.00 -0.55 0.00 -2.06 0.00 0.00 59.70 57.09 1qa7 h MET 171 Cb 0.00 0.00 0.13 0.00 0.06 0.00 0.00 31.60 31.79 1qa7 h MET 171 CO 0.00 0.00 0.65 0.00 1.06 0.00 0.00 176.91 178.62 1qa7 n GLY 173 N 0.65 0.65 3.87 0.00 0.00 0.32 -1.26 105.19 109.42 1qa7 n GLY 173 Ca 0.07 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.78 1qa7 n GLY 173 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1qa7 s GLY 174 N -1.81 1.73 -0.08 -0.02 0.00 -1.00 -4.20 107.32 101.95 1qa7 s GLY 174 Ca 0.00 -0.08 -0.10 0.00 0.00 0.00 0.00 44.72 44.54 1qa7 s GLY 174 CO 0.00 0.18 0.24 0.00 0.00 0.00 0.00 173.10 173.51 1qa7 s ALA 175 N -3.00 3.81 -0.20 3.20 0.00 -1.01 -0.19 121.76 124.38 1qa7 s ALA 175 Ca 0.55 -0.49 -0.14 0.00 0.00 0.00 0.00 51.96 51.88 1qa7 s ALA 175 Cb -0.11 -2.12 -0.04 0.00 0.00 0.00 0.00 23.12 20.85 1qa7 s ALA 175 CO 0.48 0.57 0.30 -1.17 0.00 0.00 0.00 175.76 175.94 1qa7 s LEU 176 N -1.04 4.17 -0.16 0.00 2.96 -0.68 -0.85 118.68 123.08 1qa7 s LEU 176 Ca 0.18 0.41 0.01 0.00 -0.22 0.00 0.00 54.13 54.52 1qa7 s LEU 176 Cb -0.14 -2.37 0.02 0.00 0.50 0.00 0.00 46.19 44.20 1qa7 s LEU 176 CO 0.07 0.02 -0.20 -0.69 -1.32 0.00 0.00 176.35 174.23 1qa7 s VAL 177 N 0.97 2.01 0.42 1.68 1.01 -0.56 -0.25 120.40 125.68 1qa7 s VAL 177 Ca 0.15 -0.92 -0.24 0.00 0.00 0.00 0.00 61.98 60.97 1qa7 s VAL 177 Cb -0.14 -1.81 -0.08 0.00 0.00 0.00 0.00 36.38 34.35 1qa7 s VAL 177 CO 0.06 0.53 1.16 -0.55 0.00 0.00 0.00 175.10 176.30 1qa7 s SER 178 N 1.15 6.43 0.04 3.32 0.15 -0.43 -0.63 113.70 123.73 1qa7 s SER 178 Ca 0.01 2.30 0.26 0.00 0.70 0.00 0.00 55.95 59.22 1qa7 s SER 178 Cb -0.14 -2.61 0.73 0.00 -1.71 0.00 0.00 66.02 62.29 1qa7 s SER 178 CO -0.09 -0.74 1.59 -1.54 1.20 0.00 0.00 173.24 173.66 1qa7 n SER 179 N -0.12 0.42 -4.57 5.45 3.41 -1.20 -4.14 113.62 112.86 1qa7 n SER 179 Ca 0.05 0.13 -0.39 0.00 -0.26 0.00 0.00 58.87 58.40 1qa7 n SER 179 Cb 0.47 -0.09 -0.03 0.00 -0.26 0.00 0.00 64.21 64.30 1qa7 n SER 179 CO 0.00 0.00 0.00 0.21 -0.16 0.00 0.00 175.04 175.09 1qa7 s ASN 180 N -3.38 4.94 0.08 4.04 3.84 -1.26 -4.79 114.94 118.41 1qa7 s ASN 180 Ca 0.11 1.22 0.19 0.00 0.21 0.00 0.00 52.86 54.59 1qa7 s ASN 180 Cb 0.17 -2.51 0.78 0.00 -0.55 0.00 0.00 41.25 39.14 1qa7 s ASN 180 CO 0.64 -2.47 1.58 0.00 -2.79 0.00 0.00 177.10 174.06 1qa7 n GLN 181 N 8.92 0.07 0.16 0.43 6.02 -1.26 -2.06 117.38 129.66 1qa7 n GLN 181 Ca 0.32 0.28 0.13 0.00 -0.01 0.00 0.00 57.00 57.72 1qa7 n GLN 181 Cb 0.51 -1.62 0.46 0.00 1.02 0.00 0.00 30.24 30.61 1qa7 n GLN 181 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 177.06 176.71 1qa7 h SER 182 N 0.00 0.00 -0.25 1.08 4.64 -1.98 -2.52 113.55 114.52 1qa7 h SER 182 Ca 0.00 0.00 -0.12 0.00 -0.47 0.00 0.00 61.79 61.20 1qa7 h SER 182 Cb 0.32 0.00 -0.07 0.00 -0.31 0.00 0.00 62.40 62.34 1qa7 h SER 182 CO 0.00 0.00 -0.16 2.30 -0.87 0.00 0.00 176.83 178.10 1qa7 n ILE 183 N -2.52 2.42 -3.74 0.95 -5.35 -1.10 -4.97 119.36 105.06 1qa7 n ILE 183 Ca 0.03 -2.75 -0.26 0.00 -0.27 0.00 0.00 62.75 59.50 1qa7 n ILE 183 Cb 0.34 -0.29 0.05 0.00 -1.74 0.00 0.00 39.64 38.00 1qa7 n ILE 183 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1qa7 n GLN 184 N -1.09 -6.55 -4.20 6.28 3.00 -0.95 -2.87 117.38 111.00 1qa7 n GLN 184 Ca 0.28 0.71 -0.32 0.00 -0.01 0.00 0.00 57.00 57.66 1qa7 n GLN 184 Cb 0.93 -5.65 -0.05 0.00 0.00 0.00 0.00 30.24 25.47 1qa7 n GLN 184 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.06 177.15 1qa7 n ASN 185 N -2.95 -1.09 -4.58 1.08 4.13 -0.87 -4.82 115.26 106.16 1qa7 n ASN 185 Ca -0.03 -1.11 -0.40 0.00 1.68 0.00 0.00 54.58 54.72 1qa7 n ASN 185 Cb 0.56 -2.42 0.02 0.00 -1.54 0.00 0.00 39.78 36.41 1qa7 n ASN 185 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1qa7 n ALA 186 N -4.40 -0.12 -2.35 5.41 0.00 -1.14 -4.06 120.51 113.86 1qa7 n ALA 186 Ca -0.14 0.16 -0.42 0.00 0.00 0.00 0.00 53.44 53.04 1qa7 n ALA 186 Cb 0.60 -2.03 -0.03 0.00 0.00 0.00 0.00 19.45 17.99 1qa7 n ALA 186 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1qa7 s ILE 187 N -1.38 4.01 -0.09 0.00 1.01 0.79 -1.31 121.20 124.23 1qa7 s ILE 187 Ca 0.66 1.51 0.21 0.00 0.00 0.00 0.00 60.65 63.02 1qa7 s ILE 187 Cb -0.53 -3.96 -0.30 0.00 0.01 0.00 0.00 42.46 37.68 1qa7 s ILE 187 CO 0.55 0.15 0.37 0.18 0.00 0.00 0.00 174.94 176.19 1qa7 n LEU 188 N 3.54 0.04 0.00 2.97 4.77 0.65 -0.86 117.00 128.11 1qa7 n LEU 188 Ca 0.07 0.02 0.00 0.00 -0.03 0.00 0.00 56.01 56.07 1qa7 n LEU 188 Cb 0.46 0.15 0.00 0.00 -2.33 0.00 0.00 43.42 41.71 1qa7 n LEU 188 CO 0.55 0.15 0.00 0.61 -1.33 0.00 0.00 177.39 177.37 1qa7 n GLY 189 N 1.41 -0.92 3.27 -0.72 0.00 -1.26 -1.33 105.19 105.65 1qa7 n GLY 189 Ca -0.13 -1.25 -0.32 0.00 0.00 0.00 0.00 46.02 44.32 1qa7 n GLY 189 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1qa7 s ILE 190 N -2.94 2.07 0.08 -0.61 -1.09 -0.54 -1.69 121.20 116.48 1qa7 s ILE 190 Ca 0.00 -1.06 -0.31 0.00 -2.23 0.00 0.00 60.65 57.05 1qa7 s ILE 190 Cb 0.00 -1.75 -0.07 0.00 -1.58 0.00 0.00 42.46 39.07 1qa7 s ILE 190 CO 0.00 0.57 1.32 -2.28 -1.23 0.00 0.00 174.94 173.32 1qa7 s HIS 191 N -0.16 3.27 0.00 3.97 5.65 0.74 -0.78 115.29 127.98 1qa7 s HIS 191 Ca -0.04 1.07 0.00 0.00 0.25 0.00 0.00 55.06 56.34 1qa7 s HIS 191 Cb -0.14 -3.58 0.00 0.00 -1.18 0.00 0.00 32.58 27.68 1qa7 s HIS 191 CO 0.04 -1.96 0.00 1.33 -0.65 0.00 0.00 174.74 173.50 1qa7 n VAL 192 N 4.04 0.00 -3.60 0.89 0.24 0.64 -0.52 118.33 120.02 1qa7 n VAL 192 Ca 0.11 -0.26 -0.11 0.00 -2.04 0.00 0.00 64.34 62.04 1qa7 n VAL 192 Cb 0.44 0.84 -0.06 0.00 -1.47 0.00 0.00 33.84 33.59 1qa7 n VAL 192 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1qa7 s ALA 193 N -0.88 -1.94 -0.27 2.33 0.00 -0.95 -4.99 121.76 115.07 1qa7 s ALA 193 Ca 0.00 1.68 -0.03 0.00 0.00 0.00 0.00 51.96 53.62 1qa7 s ALA 193 Cb 0.00 -0.94 0.16 0.00 0.00 0.00 0.00 23.12 22.33 1qa7 s ALA 193 CO 0.00 -0.29 0.50 0.20 0.00 0.00 0.00 175.76 176.17 1qa7 s GLY 194 N -0.60 -0.69 -0.17 0.00 0.00 -1.25 -0.37 107.32 104.24 1qa7 s GLY 194 Ca -0.00 1.48 -0.29 0.00 0.00 0.00 0.00 44.72 45.90 1qa7 s GLY 194 CO -0.01 2.99 0.97 -0.32 0.00 0.00 0.00 173.10 176.73 1qa7 s GLY 195 N 2.72 -0.28 -1.10 0.20 0.00 -1.04 -4.52 107.32 103.30 1qa7 s GLY 195 Ca 0.14 2.08 -0.07 0.00 0.00 0.00 0.00 44.72 46.87 1qa7 s GLY 195 CO -0.18 1.19 0.96 0.70 0.00 0.00 0.00 173.10 175.77 1qa7 n ASN 196 N 1.06 -5.50 -2.03 1.64 3.02 -1.26 -2.60 115.26 109.58 1qa7 n ASN 196 Ca -0.12 -0.44 -0.17 0.00 -0.03 0.00 0.00 54.58 53.82 1qa7 n ASN 196 Cb 0.57 -4.18 -0.04 0.00 -0.61 0.00 0.00 39.78 35.52 1qa7 n ASN 196 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 1qa7 n SER 197 N -2.18 -4.81 -4.23 6.41 7.64 -1.25 -4.95 113.62 110.24 1qa7 n SER 197 Ca 0.00 0.22 -0.28 0.00 1.01 0.00 0.00 58.87 59.82 1qa7 n SER 197 Cb 0.55 -4.15 -0.16 0.00 -1.01 0.00 0.00 64.21 59.44 1qa7 n SER 197 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 1qa7 s ILE 198 N -2.68 1.73 -0.09 0.44 -1.09 -1.07 0.12 121.20 118.56 1qa7 s ILE 198 Ca 0.00 -0.92 0.04 0.00 -2.23 0.00 0.00 60.65 57.54 1qa7 s ILE 198 Cb 0.00 -1.45 -0.00 0.00 -1.58 0.00 0.00 42.46 39.43 1qa7 s ILE 198 CO 0.00 0.49 -0.23 -0.76 -1.23 0.00 0.00 174.94 173.21 1qa7 s LEU 199 N -0.40 2.06 -0.06 2.97 1.43 0.45 -2.49 118.68 122.63 1qa7 s LEU 199 Ca 0.05 -0.53 0.05 0.00 -1.03 0.00 0.00 54.13 52.67 1qa7 s LEU 199 Cb -0.09 -1.36 -0.01 0.00 0.03 0.00 0.00 46.19 44.75 1qa7 s LEU 199 CO 0.00 0.17 -0.23 -0.69 0.23 0.00 0.00 176.35 175.83 1qa7 s VAL 200 N 0.25 2.26 -0.03 -1.59 1.01 0.50 -0.19 120.40 122.61 1qa7 s VAL 200 Ca -0.15 -0.99 0.02 0.00 0.00 0.00 0.00 61.98 60.85 1qa7 s VAL 200 Cb -0.17 -1.84 0.01 0.00 0.00 0.00 0.00 36.38 34.38 1qa7 s VAL 200 CO 0.07 0.57 -0.06 0.00 0.00 0.00 0.00 175.10 175.69 1qa7 s ALA 201 N -0.16 0.63 0.26 5.51 0.00 -0.44 -0.26 121.76 127.30 1qa7 s ALA 201 Ca -0.03 -0.15 -0.30 0.00 0.00 0.00 0.00 51.96 51.48 1qa7 s ALA 201 Cb -0.14 -0.30 -0.09 0.00 0.00 0.00 0.00 23.12 22.59 1qa7 s ALA 201 CO 0.04 0.06 1.07 0.21 0.00 0.00 0.00 175.76 177.14 1qa7 s LYS 202 N 0.44 4.67 0.16 0.00 2.47 0.04 -0.23 119.74 127.29 1qa7 s LYS 202 Ca -0.06 1.74 -0.30 0.00 -1.56 0.00 0.00 55.97 55.80 1qa7 s LYS 202 Cb -0.10 -3.21 -0.08 0.00 -1.46 0.00 0.00 37.83 32.99 1qa7 s LYS 202 CO 0.00 0.25 1.21 -1.17 0.16 0.00 0.00 175.35 175.80 1qa7 s LEU 203 N -1.29 4.43 -0.09 5.43 2.96 -0.18 -1.47 118.68 128.48 1qa7 s LEU 203 Ca 0.44 2.19 0.01 0.00 -0.22 0.00 0.00 54.13 56.55 1qa7 s LEU 203 Cb -0.31 -3.60 0.02 0.00 0.50 0.00 0.00 46.19 42.80 1qa7 s LEU 203 CO 0.39 -0.40 -0.08 -0.69 -1.32 0.00 0.00 176.35 174.25 1qa7 s VAL 204 N 0.20 0.97 0.25 1.68 1.01 -0.44 -4.89 120.40 119.18 1qa7 s VAL 204 Ca 0.54 -0.31 0.09 0.00 0.00 0.00 0.00 61.98 62.31 1qa7 s VAL 204 Cb -0.32 -0.96 -0.04 0.00 0.00 0.00 0.00 36.38 35.06 1qa7 s VAL 204 CO 0.35 0.34 -0.01 0.42 0.00 0.00 0.00 175.10 176.20 1qa7 s THR 205 N 1.30 3.45 0.32 3.92 -4.23 -1.26 -4.17 115.64 114.97 1qa7 s THR 205 Ca -0.03 -1.84 0.07 0.00 -1.18 0.00 0.00 61.69 58.71 1qa7 s THR 205 Cb -0.14 -2.82 0.31 0.00 1.34 0.00 0.00 72.50 71.19 1qa7 s THR 205 CO -0.03 -0.32 1.79 -0.61 -0.54 0.00 0.00 174.62 174.90 1qa7 h GLN 206 N 2.06 0.71 -0.74 3.99 4.15 -1.35 -2.22 115.11 121.72 1qa7 h GLN 206 Ca -0.45 -0.04 -0.05 0.00 0.77 0.00 0.00 58.65 58.88 1qa7 h GLN 206 Cb 1.24 -0.16 -0.03 0.00 0.21 0.00 0.00 27.48 28.74 1qa7 h GLN 206 CO 0.59 0.47 0.27 0.93 -1.93 0.00 0.00 178.83 179.17 1qa7 h GLU 207 N 0.73 1.12 0.00 1.69 3.07 -1.92 -2.65 114.58 116.62 1qa7 h GLU 207 Ca 0.56 -0.21 0.00 0.00 -0.50 0.00 0.00 59.36 59.21 1qa7 h GLU 207 Cb 0.91 -0.18 0.00 0.00 -0.84 0.00 0.00 28.75 28.64 1qa7 h GLU 207 CO -0.35 0.92 0.21 0.52 -1.40 0.00 0.00 179.01 178.92 1qa7 h MET 208 N 1.09 0.00 -0.14 2.33 2.86 -1.66 -0.52 114.93 118.88 1qa7 h MET 208 Ca 0.25 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.89 1qa7 h MET 208 Cb 0.24 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.90 1qa7 h MET 208 CO -0.02 0.00 0.00 1.19 1.06 0.00 0.00 176.91 179.14 1qa7 n PHE 209 N -2.53 0.18 0.23 -0.22 3.72 -1.00 -3.76 117.46 114.08 1qa7 n PHE 209 Ca -0.02 -0.09 0.12 0.00 -0.05 0.00 0.00 57.45 57.41 1qa7 n PHE 209 Cb 0.25 0.00 0.38 0.00 -0.94 0.00 0.00 39.48 39.17 1qa7 n PHE 209 CO 0.00 0.00 0.00 1.96 -0.05 0.00 0.00 176.76 178.67 1qa7 h GLN 210 N 1.82 0.00 -1.76 -1.08 4.20 -1.28 -3.35 115.11 113.66 1qa7 h GLN 210 Ca 0.00 0.00 -0.41 0.00 0.06 0.00 0.00 58.65 58.30 1qa7 h GLN 210 Cb 0.40 0.00 -0.16 0.00 0.30 0.00 0.00 27.48 28.02 1qa7 h GLN 210 CO 0.00 0.11 0.38 0.27 -0.67 0.00 0.00 178.83 178.92 1qa7 n ASN 211 N -3.18 6.45 0.05 1.46 6.94 -1.25 -4.45 115.26 121.29 1qa7 n ASN 211 Ca 0.02 -3.12 0.00 0.00 -0.02 0.00 0.00 54.58 51.46 1qa7 n ASN 211 Cb 0.46 -1.15 0.00 0.00 -2.36 0.00 0.00 39.78 36.73 1qa7 n ASN 211 CO 0.00 0.00 0.00 2.30 -1.03 0.00 0.00 177.26 178.53 1qa7 n ILE 212 N 0.66 1.19 0.00 1.53 -5.35 -1.26 -4.89 119.36 111.24 1qa7 n ILE 212 Ca 0.40 0.39 0.00 0.00 -0.27 0.00 0.00 62.75 63.27 1qa7 n ILE 212 Cb 0.58 -1.57 0.00 0.00 -1.74 0.00 0.00 39.64 36.91 1qa7 n ILE 212 CO 0.00 0.00 0.00 0.47 -1.76 0.00 0.00 176.55 175.26