#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1qpp s VAL 2 N 0.00 4.92 0.09 0.00 1.01 -1.26 -2.23 120.40 122.92 1qpp s VAL 2 Ca 0.00 1.12 0.08 0.00 0.00 0.00 0.00 61.98 63.19 1qpp s VAL 2 Cb 0.00 -3.87 -0.03 0.00 0.00 0.00 0.00 36.38 32.48 1qpp s VAL 2 CO 0.00 0.48 -0.22 -0.44 0.00 0.00 0.00 175.10 174.92 1qpp s SER 3 N -0.53 2.68 0.17 3.32 0.01 -0.54 -4.96 113.70 113.87 1qpp s SER 3 Ca 0.28 -0.64 0.01 0.00 1.31 0.00 0.00 55.95 56.91 1qpp s SER 3 Cb -0.18 -0.18 -0.04 0.00 0.21 0.00 0.00 66.02 65.83 1qpp s SER 3 CO 0.16 0.12 0.34 -0.76 0.41 0.00 0.00 173.24 173.51 1qpp s LEU 4 N -1.68 4.28 0.00 2.44 1.43 -1.26 -2.07 118.68 121.82 1qpp s LEU 4 Ca 0.08 0.29 0.17 0.00 -1.03 0.00 0.00 54.13 53.64 1qpp s LEU 4 Cb -0.10 -3.04 0.76 0.00 0.03 0.00 0.00 46.19 43.84 1qpp s LEU 4 CO 0.04 0.01 1.52 -0.90 0.23 0.00 0.00 176.35 177.24 1qpp n ASP 5 N -0.59 0.89 -3.50 2.29 5.75 -0.99 -4.91 116.55 115.48 1qpp n ASP 5 Ca -0.06 -1.66 -0.12 0.00 -0.01 0.00 0.00 54.79 52.94 1qpp n ASP 5 Cb 0.54 -0.07 -0.03 0.00 -1.03 0.00 0.00 41.12 40.53 1qpp n ASP 5 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1qpp s ARG 6 N -1.86 0.94 0.05 0.11 3.03 -1.26 -5.02 118.95 114.94 1qpp s ARG 6 Ca 0.26 -0.15 0.24 0.00 2.03 0.00 0.00 55.73 58.10 1qpp s ARG 6 Cb 0.13 0.44 0.20 0.00 -1.03 0.00 0.00 34.95 34.69 1qpp s ARG 6 CO 0.21 -0.37 1.17 0.25 -1.13 0.00 0.00 175.30 175.43 1qpp n THR 7 N 0.12 0.17 -3.57 4.99 -2.24 -1.26 -4.93 114.28 107.56 1qpp n THR 7 Ca -0.13 -0.18 -0.17 0.00 -2.27 0.00 0.00 64.05 61.30 1qpp n THR 7 Cb 0.61 0.18 -0.07 0.00 -2.10 0.00 0.00 70.33 68.96 1qpp n THR 7 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1qpp s ALA 8 N -3.14 -1.64 0.03 6.98 0.00 -1.26 -4.33 121.76 118.40 1qpp s ALA 8 Ca 0.06 1.29 0.05 0.00 0.00 0.00 0.00 51.96 53.36 1qpp s ALA 8 Cb 0.15 -0.15 -0.02 0.00 0.00 0.00 0.00 23.12 23.10 1qpp s ALA 8 CO 0.76 -0.35 -0.15 0.00 0.00 0.00 0.00 175.76 176.02 1qpp s ALA 9 N -0.98 1.27 -0.24 0.00 0.00 -0.38 -4.97 121.76 116.45 1qpp s ALA 9 Ca -0.10 -0.82 -0.05 0.00 0.00 0.00 0.00 51.96 50.99 1qpp s ALA 9 Cb -0.01 -0.23 -0.01 0.00 0.00 0.00 0.00 23.12 22.87 1qpp s ALA 9 CO 0.08 0.26 -0.00 0.08 0.00 0.00 0.00 175.76 176.18 1qpp s VAL 10 N -0.73 3.65 -0.38 0.00 1.01 -1.26 -1.74 120.40 120.94 1qpp s VAL 10 Ca 0.03 -0.47 -0.21 0.00 0.00 0.00 0.00 61.98 61.34 1qpp s VAL 10 Cb -0.07 -2.71 0.01 0.00 0.00 0.00 0.00 36.38 33.60 1qpp s VAL 10 CO 0.01 0.35 0.64 0.12 0.00 0.00 0.00 175.10 176.22 1qpp s PHE 11 N 1.51 3.12 -0.19 5.22 2.19 0.12 -4.96 117.98 124.99 1qpp s PHE 11 Ca 0.05 0.23 -0.29 0.00 0.33 0.00 0.00 56.93 57.25 1qpp s PHE 11 Cb -0.15 -3.21 -0.02 0.00 -1.31 0.00 0.00 43.02 38.33 1qpp s PHE 11 CO -0.01 -0.71 1.34 0.34 1.83 0.00 0.00 175.22 178.02 1qpp s ASP 12 N 1.86 6.80 0.55 6.13 -1.08 -1.26 0.21 116.67 129.89 1qpp s ASP 12 Ca 0.24 1.63 0.23 0.00 -0.52 0.00 0.00 52.55 54.13 1qpp s ASP 12 Cb -0.14 -2.54 1.50 0.00 -1.46 0.00 0.00 42.92 40.28 1qpp s ASP 12 CO 0.16 -0.89 2.15 1.23 0.52 0.00 0.00 175.17 178.34 1qpp h GLY 13 N 10.21 0.00 1.98 2.66 0.00 -0.50 -1.83 103.07 115.59 1qpp h GLY 13 Ca -0.28 0.00 -0.10 0.00 0.00 0.00 0.00 47.33 46.95 1qpp h GLY 13 CO 0.99 0.00 -0.45 1.48 0.00 0.00 0.00 176.54 178.56 1qpp h SER 14 N 0.00 0.03 -4.21 0.19 4.64 -1.90 -3.42 113.55 108.88 1qpp h SER 14 Ca 0.04 -0.01 -0.50 0.00 -0.47 0.00 0.00 61.79 60.85 1qpp h SER 14 Cb 0.19 -0.01 0.06 0.00 -0.31 0.00 0.00 62.40 62.33 1qpp h SER 14 CO -0.00 0.47 0.35 -1.61 -0.87 0.00 0.00 176.83 175.17 1qpp s GLU 15 N -4.02 3.45 -0.23 4.77 0.41 -0.69 -5.03 118.70 117.36 1qpp s GLU 15 Ca -0.03 0.58 0.09 0.00 -0.41 0.00 0.00 54.97 55.20 1qpp s GLU 15 Cb 0.14 -2.13 -0.20 0.00 -1.78 0.00 0.00 34.13 30.15 1qpp s GLU 15 CO 0.74 -0.58 -0.09 0.36 -0.49 0.00 0.00 175.26 175.20 1qpp n LYS 16 N -2.70 0.69 -4.46 1.61 2.85 -1.26 -4.92 118.16 109.97 1qpp n LYS 16 Ca 0.05 0.07 -0.24 0.00 -1.05 0.00 0.00 58.31 57.15 1qpp n LYS 16 Cb 0.55 -1.51 -0.08 0.00 -0.65 0.00 0.00 35.03 33.34 1qpp n LYS 16 CO 0.00 0.00 0.00 -1.12 -0.05 0.00 0.00 177.40 176.23 1qpp s SER 17 N -5.99 2.50 -0.26 -5.58 0.01 -1.26 -2.42 113.70 100.70 1qpp s SER 17 Ca -0.23 -1.67 -0.27 0.00 1.31 0.00 0.00 55.95 55.09 1qpp s SER 17 Cb 0.07 0.49 0.15 0.00 0.21 0.00 0.00 66.02 66.95 1qpp s SER 17 CO 0.69 -0.94 1.19 0.00 0.41 0.00 0.00 173.24 174.59 1qpp s MET 18 N -3.69 0.33 0.07 12.44 0.00 -0.59 -4.97 119.30 122.89 1qpp s MET 18 Ca 0.27 0.24 0.09 0.00 0.00 0.00 0.00 55.69 56.30 1qpp s MET 18 Cb 0.03 0.16 -0.03 0.00 0.00 0.00 0.00 34.83 34.98 1qpp s MET 18 CO 0.17 -0.07 -0.24 0.95 0.00 0.00 0.00 175.02 175.83 1qpp s THR 19 N -0.37 2.39 -0.03 3.16 -4.23 -1.26 -0.24 115.64 115.06 1qpp s THR 19 Ca 0.04 -1.45 0.01 0.00 -1.18 0.00 0.00 61.69 59.11 1qpp s THR 19 Cb -0.03 -2.00 -0.03 0.00 1.34 0.00 0.00 72.50 71.77 1qpp s THR 19 CO -0.07 0.26 -0.01 -0.76 -0.54 0.00 0.00 174.62 173.51 1qpp s LEU 20 N -1.58 3.50 -0.13 4.79 1.43 -0.41 -4.96 118.68 121.31 1qpp s LEU 20 Ca 0.14 0.03 -0.10 0.00 -1.03 0.00 0.00 54.13 53.16 1qpp s LEU 20 Cb -0.10 -1.93 -0.05 0.00 0.03 0.00 0.00 46.19 44.14 1qpp s LEU 20 CO 0.05 0.32 0.21 -1.81 0.23 0.00 0.00 176.35 175.34 1qpp s ASP 21 N -1.30 6.42 -0.02 2.29 1.01 -1.26 -1.12 116.67 122.69 1qpp s ASP 21 Ca 0.17 0.50 0.05 0.00 0.71 0.00 0.00 52.55 53.98 1qpp s ASP 21 Cb -0.11 -2.13 -0.01 0.00 1.01 0.00 0.00 42.92 41.68 1qpp s ASP 21 CO 0.07 0.27 -0.18 0.27 0.21 0.00 0.00 175.17 175.81 1qpp s ILE 22 N -0.37 1.44 0.03 0.77 -4.36 -0.50 -2.36 121.20 115.85 1qpp s ILE 22 Ca 0.15 -0.77 0.05 0.00 -0.26 0.00 0.00 60.65 59.81 1qpp s ILE 22 Cb -0.13 -1.21 -0.02 0.00 1.25 0.00 0.00 42.46 42.36 1qpp s ILE 22 CO 0.04 0.41 -0.14 -0.94 0.24 0.00 0.00 174.94 174.55 1qpp s SER 23 N -0.37 1.70 -0.74 4.36 1.04 -0.88 -0.33 113.70 118.48 1qpp s SER 23 Ca 0.06 -0.41 -0.19 0.00 0.48 0.00 0.00 55.95 55.89 1qpp s SER 23 Cb -0.08 -0.13 0.12 0.00 0.10 0.00 0.00 66.02 66.03 1qpp s SER 23 CO -0.00 0.07 0.90 0.21 0.98 0.00 0.00 173.24 175.40 1qpp s ASN 24 N -0.94 6.39 0.00 7.02 2.47 0.42 -1.46 114.94 128.84 1qpp s ASN 24 Ca 0.03 -1.68 0.15 0.00 0.42 0.00 0.00 52.86 51.78 1qpp s ASN 24 Cb -0.07 -2.35 0.76 0.00 -1.45 0.00 0.00 41.25 38.14 1qpp s ASN 24 CO 0.01 -1.11 1.42 0.47 -3.72 0.00 0.00 177.10 174.16 1qpp n ASP 25 N 6.43 0.00 -4.59 -4.21 8.00 -0.95 -2.71 116.55 118.53 1qpp n ASP 25 Ca 0.05 0.07 -0.43 0.00 0.71 0.00 0.00 54.79 55.19 1qpp n ASP 25 Cb 0.46 -0.28 -0.04 0.00 -0.02 0.00 0.00 41.12 41.23 1qpp n ASP 25 CO 0.00 0.00 0.00 0.21 -0.39 0.00 0.00 177.20 177.02 1qpp s ASN 26 N -2.57 6.58 -0.06 -2.24 3.84 -1.26 -4.88 114.94 114.35 1qpp s ASN 26 Ca 0.14 0.36 0.06 0.00 0.21 0.00 0.00 52.86 53.63 1qpp s ASN 26 Cb 0.10 -2.44 0.27 0.00 -0.55 0.00 0.00 41.25 38.63 1qpp s ASN 26 CO 0.23 -0.88 0.99 0.29 -2.79 0.00 0.00 177.10 174.93 1qpp n LYS 27 N 6.80 2.18 0.00 0.43 5.02 -1.26 -0.61 118.16 130.72 1qpp n LYS 27 Ca 0.06 -1.06 0.00 0.00 -2.02 0.00 0.00 58.31 55.29 1qpp n LYS 27 Cb 0.48 -1.64 0.00 0.00 -0.02 0.00 0.00 35.03 33.85 1qpp n LYS 27 CO 0.00 0.00 0.00 0.94 -0.52 0.00 0.00 177.40 177.82 1qpp n GLN 28 N 0.22 1.67 -5.03 1.97 7.27 -1.26 -4.66 117.38 117.57 1qpp n GLN 28 Ca 0.09 0.00 -0.30 0.00 0.07 0.00 0.00 57.00 56.87 1qpp n GLN 28 Cb 0.50 -0.71 -0.15 0.00 2.41 0.00 0.00 30.24 32.29 1qpp n GLN 28 CO 0.00 0.00 0.00 -0.51 0.07 0.00 0.00 177.06 176.62 1qpp s LEU 29 N -2.22 2.12 0.55 1.69 1.43 -1.26 -4.83 118.68 116.16 1qpp s LEU 29 Ca 0.00 -0.52 -0.18 0.00 -1.03 0.00 0.00 54.13 52.39 1qpp s LEU 29 Cb 0.00 -1.26 -0.06 0.00 0.03 0.00 0.00 46.19 44.91 1qpp s LEU 29 CO 0.00 0.27 1.07 -2.16 0.23 0.00 0.00 176.35 175.76 1qpp s PRO 30 N -0.95 3.45 0.02 1.29 0.04 -1.26 -3.95 135.00 133.63 1qpp s PRO 30 Ca 0.10 1.38 -0.03 0.00 0.04 0.00 0.00 61.00 62.49 1qpp s PRO 30 Cb -0.10 -2.04 -0.01 0.00 0.04 0.00 0.00 34.50 32.39 1qpp s PRO 30 CO 0.01 -0.73 0.04 0.71 0.04 0.00 0.00 177.00 177.07 1qpp s TYR 31 N -2.11 0.19 0.01 0.56 1.51 -0.43 -4.17 117.35 112.92 1qpp s TYR 31 Ca 0.67 -0.42 -0.08 0.00 -1.01 0.00 0.00 57.07 56.24 1qpp s TYR 31 Cb -0.18 -0.15 -0.05 0.00 -0.11 0.00 0.00 41.96 41.47 1qpp s TYR 31 CO 0.29 -0.25 0.29 -0.51 -1.11 0.00 0.00 175.55 174.26 1qpp s LEU 32 N -1.56 4.38 -0.21 -1.29 1.43 -0.80 0.34 118.68 120.96 1qpp s LEU 32 Ca -0.14 0.62 0.01 0.00 -1.03 0.00 0.00 54.13 53.59 1qpp s LEU 32 Cb -0.08 -2.68 0.03 0.00 0.03 0.00 0.00 46.19 43.50 1qpp s LEU 32 CO -0.01 0.25 -0.15 0.00 0.23 0.00 0.00 176.35 176.68 1qpp s ALA 33 N -1.28 2.46 -0.21 4.21 0.00 0.39 -1.09 121.76 126.25 1qpp s ALA 33 Ca 0.27 -1.41 -0.08 0.00 0.00 0.00 0.00 51.96 50.74 1qpp s ALA 33 Cb -0.13 -1.38 -0.04 0.00 0.00 0.00 0.00 23.12 21.56 1qpp s ALA 33 CO 0.15 -0.67 0.09 -1.14 0.00 0.00 0.00 175.76 174.20 1qpp s GLN 34 N 1.24 3.97 0.12 0.00 0.74 -0.09 -2.44 119.66 123.20 1qpp s GLN 34 Ca 0.00 -0.34 0.08 0.00 0.05 0.00 0.00 55.36 55.15 1qpp s GLN 34 Cb -0.16 -3.33 -0.04 0.00 1.10 0.00 0.00 33.01 30.58 1qpp s GLN 34 CO -0.09 0.15 -0.18 0.00 -0.55 0.00 0.00 175.29 174.61 1qpp s ALA 35 N 0.75 1.78 0.06 1.58 0.00 0.11 -0.16 121.76 125.88 1qpp s ALA 35 Ca 0.05 -1.32 -0.27 0.00 0.00 0.00 0.00 51.96 50.42 1qpp s ALA 35 Cb -0.13 -0.19 0.09 0.00 0.00 0.00 0.00 23.12 22.89 1qpp s ALA 35 CO 0.02 0.26 0.90 1.67 0.00 0.00 0.00 175.76 178.61 1qpp s TRP 36 N -1.63 -0.27 0.05 0.00 -2.14 -0.95 -4.61 118.94 109.39 1qpp s TRP 36 Ca 0.09 0.07 0.04 0.00 2.66 0.00 0.00 56.10 58.97 1qpp s TRP 36 Cb -0.08 0.58 -0.04 0.00 -3.10 0.00 0.00 33.47 30.83 1qpp s TRP 36 CO 0.05 -0.66 -0.05 0.42 -2.66 0.00 0.00 176.95 174.05 1qpp s ILE 37 N -3.21 3.73 0.12 0.66 -1.09 -1.26 -1.10 121.20 119.06 1qpp s ILE 37 Ca 0.07 -0.94 0.08 0.00 -2.23 0.00 0.00 60.65 57.63 1qpp s ILE 37 Cb -0.01 -2.70 -0.04 0.00 -1.58 0.00 0.00 42.46 38.13 1qpp s ILE 37 CO -0.05 0.25 -0.18 -1.61 -1.23 0.00 0.00 174.94 172.11 1qpp s GLU 38 N -1.87 1.12 0.00 2.79 2.02 -0.25 -1.74 118.70 120.76 1qpp s GLU 38 Ca 0.21 -1.23 0.00 0.00 0.02 0.00 0.00 54.97 53.97 1qpp s GLU 38 Cb -0.11 -1.22 0.00 0.00 0.10 0.00 0.00 34.13 32.90 1qpp s GLU 38 CO 0.12 0.26 0.00 0.27 0.02 0.00 0.00 175.26 175.94 1qpp n ASN 39 N 0.76 0.00 0.24 -0.19 0.23 0.38 -1.59 115.26 115.10 1qpp n ASN 39 Ca -0.17 -0.65 0.07 0.00 -0.53 0.00 0.00 54.58 53.30 1qpp n ASN 39 Cb 0.55 0.00 0.58 0.00 -2.08 0.00 0.00 39.78 38.84 1qpp n ASN 39 CO 0.00 0.00 0.00 -0.08 -0.93 0.00 0.00 177.26 176.25 1qpp h GLU 40 N 0.00 0.00 -0.49 -3.83 4.81 -1.85 -2.26 114.58 110.96 1qpp h GLU 40 Ca 0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 1qpp h GLU 40 Cb 0.00 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.38 1qpp h GLU 40 CO 0.00 0.10 0.00 0.09 -0.73 0.00 0.00 179.01 178.47 1qpp n ASN 41 N -4.37 2.51 -2.88 1.04 5.03 -1.26 -4.92 115.26 110.40 1qpp n ASN 41 Ca -0.03 -2.10 -0.17 0.00 0.87 0.00 0.00 54.58 53.15 1qpp n ASN 41 Cb 0.17 -0.34 0.06 0.00 -1.02 0.00 0.00 39.78 38.66 1qpp n ASN 41 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1qpp n GLN 42 N 0.65 -5.88 -4.72 3.52 6.02 -0.85 -5.02 117.38 111.10 1qpp n GLN 42 Ca 0.14 0.64 -0.33 0.00 -0.01 0.00 0.00 57.00 57.45 1qpp n GLN 42 Cb 0.44 -5.11 -0.14 0.00 1.02 0.00 0.00 30.24 26.45 1qpp n GLN 42 CO 0.00 0.00 0.00 -1.21 -1.01 0.00 0.00 177.06 174.84 1qpp s GLU 43 N -5.76 3.26 0.36 -1.09 2.02 -1.26 -4.86 118.70 111.38 1qpp s GLU 43 Ca 0.33 -0.65 -0.28 0.00 0.02 0.00 0.00 54.97 54.39 1qpp s GLU 43 Cb -0.15 -2.64 -0.11 0.00 0.10 0.00 0.00 34.13 31.33 1qpp s GLU 43 CO 0.56 0.31 1.51 0.21 0.02 0.00 0.00 175.26 177.87 1qpp s LYS 44 N 0.11 4.11 -0.11 1.61 2.20 -1.26 -0.47 119.74 125.92 1qpp s LYS 44 Ca -0.05 2.58 -0.00 0.00 -0.36 0.00 0.00 55.97 58.14 1qpp s LYS 44 Cb -0.14 -2.97 0.02 0.00 -1.51 0.00 0.00 37.83 33.23 1qpp s LYS 44 CO 0.04 -0.55 -0.08 0.96 -0.36 0.00 0.00 175.35 175.35 1qpp s ILE 45 N -0.95 1.07 -0.39 5.43 -4.36 -0.71 -4.85 121.20 116.44 1qpp s ILE 45 Ca 0.54 -0.32 0.18 0.00 -0.26 0.00 0.00 60.65 60.80 1qpp s ILE 45 Cb -0.47 -1.07 -0.24 0.00 1.25 0.00 0.00 42.46 41.93 1qpp s ILE 45 CO 0.61 0.37 0.55 2.30 0.24 0.00 0.00 174.94 179.02 1qpp n ILE 46 N 4.90 0.00 0.03 8.37 -5.35 -1.26 -4.50 119.36 121.55 1qpp n ILE 46 Ca -0.13 -0.27 0.05 0.00 -0.27 0.00 0.00 62.75 62.13 1qpp n ILE 46 Cb 0.50 0.49 0.23 0.00 -1.74 0.00 0.00 39.64 39.13 1qpp n ILE 46 CO 0.00 0.00 0.00 0.35 -1.76 0.00 0.00 176.55 175.14 1qpp n THR 47 N -1.81 1.41 -0.41 7.28 -2.24 -1.26 -5.01 114.28 112.23 1qpp n THR 47 Ca -0.00 -0.78 0.00 0.00 -2.27 0.00 0.00 64.05 60.99 1qpp n THR 47 Cb 0.38 -0.21 0.00 0.00 -2.10 0.00 0.00 70.33 68.41 1qpp n THR 47 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1qpp n GLY 48 N 0.58 -2.81 0.00 3.38 0.00 -1.26 -4.90 105.19 100.17 1qpp n GLY 48 Ca 0.16 -1.97 0.11 0.00 0.00 0.00 0.00 46.02 44.32 1qpp n GLY 48 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1qpp n PRO 49 N -0.09 0.20 -5.22 1.61 -0.04 -1.26 -4.96 135.00 125.24 1qpp n PRO 49 Ca 0.00 0.09 -0.32 0.00 -0.04 0.00 0.00 63.50 63.23 1qpp n PRO 49 Cb 0.00 -1.50 -0.16 0.00 -0.04 0.00 0.00 33.50 31.80 1qpp n PRO 49 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1qpp s VAL 50 N -2.74 2.17 0.12 0.52 1.01 -1.26 -1.99 120.40 118.23 1qpp s VAL 50 Ca 0.17 -1.03 0.04 0.00 0.00 0.00 0.00 61.98 61.17 1qpp s VAL 50 Cb 0.15 -1.79 -0.04 0.00 0.00 0.00 0.00 36.38 34.70 1qpp s VAL 50 CO 0.37 0.57 -0.09 0.27 0.00 0.00 0.00 175.10 176.22 1qpp s ILE 51 N -0.16 0.99 -0.14 2.22 -4.36 -0.21 -4.89 121.20 114.65 1qpp s ILE 51 Ca -0.03 -1.87 0.02 0.00 -0.26 0.00 0.00 60.65 58.50 1qpp s ILE 51 Cb -0.14 -1.63 0.02 0.00 1.25 0.00 0.00 42.46 41.96 1qpp s ILE 51 CO 0.04 -0.70 -0.18 0.00 0.24 0.00 0.00 174.94 174.34 1qpp s ALA 52 N -3.03 2.05 -0.09 2.27 0.00 -1.26 -1.46 121.76 120.24 1qpp s ALA 52 Ca 0.11 -0.99 0.04 0.00 0.00 0.00 0.00 51.96 51.13 1qpp s ALA 52 Cb 0.01 -0.99 -0.00 0.00 0.00 0.00 0.00 23.12 22.13 1qpp s ALA 52 CO -0.01 -0.16 -0.23 0.99 0.00 0.00 0.00 175.76 176.35 1qpp s THR 53 N 1.06 1.98 0.45 0.00 2.01 -0.23 -3.89 115.64 117.02 1qpp s THR 53 Ca -0.03 -0.98 -0.01 0.00 0.31 0.00 0.00 61.69 60.98 1qpp s THR 53 Cb -0.14 -1.70 -0.01 0.00 0.01 0.00 0.00 72.50 70.65 1qpp s THR 53 CO -0.05 0.54 0.69 -2.16 -0.69 0.00 0.00 174.62 172.95 1qpp s PRO 54 N 0.24 3.22 0.09 4.92 0.04 -1.26 -0.21 135.00 142.04 1qpp s PRO 54 Ca -0.15 -0.28 -0.19 0.00 0.04 0.00 0.00 61.00 60.42 1qpp s PRO 54 Cb -0.17 -2.52 -0.08 0.00 0.04 0.00 0.00 34.50 31.77 1qpp s PRO 54 CO 0.07 -0.21 1.56 -1.00 0.04 0.00 0.00 177.00 177.46 1qpp h PRO 55 N 0.38 0.40 -5.94 0.56 0.13 -1.82 -3.41 132.00 122.32 1qpp h PRO 55 Ca -0.47 -0.11 -0.52 0.00 -0.87 0.00 0.00 66.00 64.04 1qpp h PRO 55 Cb 1.24 -0.05 -0.21 0.00 0.13 0.00 0.00 31.00 32.11 1qpp h PRO 55 CO 0.59 0.53 -0.81 0.08 -0.23 0.00 0.00 178.00 178.16 1qpp s VAL 56 N -5.19 1.57 -0.14 1.56 1.01 -1.26 0.08 120.40 118.03 1qpp s VAL 56 Ca -0.14 -1.52 -0.29 0.00 0.00 0.00 0.00 61.98 60.04 1qpp s VAL 56 Cb 0.07 -1.46 0.09 0.00 0.00 0.00 0.00 36.38 35.08 1qpp s VAL 56 CO 0.73 -0.13 0.78 0.00 0.00 0.00 0.00 175.10 176.49 1qpp s GLN 57 N -1.95 0.87 -0.22 2.72 -2.07 -1.02 -4.96 119.66 113.02 1qpp s GLN 57 Ca 0.05 0.43 -0.19 0.00 -1.82 0.00 0.00 55.36 53.83 1qpp s GLN 57 Cb -0.10 0.41 -0.03 0.00 -1.09 0.00 0.00 33.01 32.21 1qpp s GLN 57 CO 0.04 -0.23 0.54 0.50 -1.32 0.00 0.00 175.29 174.82 1qpp s ARG 58 N -0.70 4.15 -0.42 9.60 3.52 -1.26 -0.46 118.95 133.37 1qpp s ARG 58 Ca -0.05 0.42 -0.09 0.00 -0.13 0.00 0.00 55.73 55.88 1qpp s ARG 58 Cb -0.02 -3.60 0.09 0.00 -1.56 0.00 0.00 34.95 29.86 1qpp s ARG 58 CO 0.05 -0.24 0.26 -0.51 -0.81 0.00 0.00 175.30 174.05 1qpp s LEU 59 N 1.94 5.22 0.91 -0.88 1.43 0.15 -4.97 118.68 122.49 1qpp s LEU 59 Ca 0.24 -1.61 -0.11 0.00 -1.03 0.00 0.00 54.13 51.62 1qpp s LEU 59 Cb -0.15 -1.97 0.11 0.00 0.03 0.00 0.00 46.19 44.20 1qpp s LEU 59 CO 0.09 -0.56 0.94 0.47 0.23 0.00 0.00 176.35 177.53 1qpp n ASP 60 N 4.88 -0.26 -4.56 2.29 9.92 -1.26 -1.31 116.55 126.25 1qpp n ASP 60 Ca -0.09 0.42 -0.55 0.00 -0.53 0.00 0.00 54.79 54.04 1qpp n ASP 60 Cb 0.42 -1.40 -0.07 0.00 -0.64 0.00 0.00 41.12 39.43 1qpp n ASP 60 CO 0.00 0.00 0.00 -2.65 0.13 0.00 0.00 177.20 174.68 1qpp n PRO 61 N -3.36 0.73 -0.84 -0.24 -0.02 -1.25 -1.08 135.00 128.94 1qpp n PRO 61 Ca 0.11 0.26 0.00 0.00 -2.02 0.00 0.00 63.50 61.85 1qpp n PRO 61 Cb 0.52 -1.85 0.00 0.00 -0.02 0.00 0.00 33.50 32.15 1qpp n PRO 61 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1qpp n GLY 62 N 2.18 0.12 3.80 -1.23 0.00 0.21 -4.87 105.19 105.40 1qpp n GLY 62 Ca 0.19 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.88 1qpp n GLY 62 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1qpp s ALA 63 N -1.32 2.67 -0.04 4.61 0.00 -0.24 -4.72 121.76 122.72 1qpp s ALA 63 Ca 0.00 0.42 0.05 0.00 0.00 0.00 0.00 51.96 52.43 1qpp s ALA 63 Cb 0.00 -3.25 -0.01 0.00 0.00 0.00 0.00 23.12 19.86 1qpp s ALA 63 CO 0.00 -0.94 -0.19 0.15 0.00 0.00 0.00 175.76 174.79 1qpp s LYS 64 N -4.11 1.84 0.00 0.00 1.02 -1.26 -0.44 119.74 116.79 1qpp s LYS 64 Ca 0.64 -0.66 0.00 0.00 0.02 0.00 0.00 55.97 55.97 1qpp s LYS 64 Cb -0.17 -1.62 0.00 0.00 -0.52 0.00 0.00 37.83 35.52 1qpp s LYS 64 CO 0.39 0.29 0.00 0.45 -0.92 0.00 0.00 175.35 175.56 1qpp n SER 65 N 3.02 0.05 -3.64 2.83 2.88 0.55 -5.01 113.62 114.30 1qpp n SER 65 Ca -0.17 -0.31 -0.13 0.00 -1.33 0.00 0.00 58.87 56.93 1qpp n SER 65 Cb 0.53 0.00 -0.06 0.00 -0.75 0.00 0.00 64.21 63.93 1qpp n SER 65 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1qpp s MET 66 N 0.06 0.96 -0.07 -1.46 0.23 -1.26 -1.40 119.30 116.36 1qpp s MET 66 Ca 0.00 -0.39 0.03 0.00 -1.03 0.00 0.00 55.69 54.30 1qpp s MET 66 Cb 0.00 0.43 -0.02 0.00 -1.53 0.00 0.00 34.83 33.71 1qpp s MET 66 CO 0.00 -0.34 -0.16 0.08 -2.03 0.00 0.00 175.02 172.57 1qpp s VAL 67 N -2.67 2.91 -0.19 5.16 1.01 -0.28 -4.73 120.40 121.62 1qpp s VAL 67 Ca -0.04 -0.76 -0.11 0.00 0.00 0.00 0.00 61.98 61.07 1qpp s VAL 67 Cb -0.00 -2.15 -0.05 0.00 0.00 0.00 0.00 36.38 34.18 1qpp s VAL 67 CO -0.04 0.57 0.18 -0.60 0.00 0.00 0.00 175.10 175.21 1qpp s ARG 68 N -0.43 4.21 -0.13 2.72 3.52 0.70 -1.29 118.95 128.26 1qpp s ARG 68 Ca 0.05 -0.13 -0.04 0.00 -0.13 0.00 0.00 55.73 55.48 1qpp s ARG 68 Cb -0.12 -3.42 -0.03 0.00 -1.56 0.00 0.00 34.95 29.81 1qpp s ARG 68 CO 0.02 0.28 0.02 -0.51 -0.81 0.00 0.00 175.30 174.30 1qpp s LEU 69 N 0.39 3.62 0.17 -0.88 1.43 0.67 -1.06 118.68 123.01 1qpp s LEU 69 Ca 0.10 0.09 -0.10 0.00 -1.03 0.00 0.00 54.13 53.19 1qpp s LEU 69 Cb -0.12 -1.86 -0.00 0.00 0.03 0.00 0.00 46.19 44.24 1qpp s LEU 69 CO -0.00 0.29 0.32 -0.94 0.23 0.00 0.00 176.35 176.24 1qpp s SER 70 N -0.33 -0.00 0.08 2.29 1.04 -0.54 -1.55 113.70 114.70 1qpp s SER 70 Ca 0.07 -0.81 0.03 0.00 0.48 0.00 0.00 55.95 55.72 1qpp s SER 70 Cb -0.12 0.46 -0.04 0.00 0.10 0.00 0.00 66.02 66.41 1qpp s SER 70 CO 0.02 -0.92 0.07 0.42 0.98 0.00 0.00 173.24 173.81 1qpp s THR 71 N -3.95 4.44 0.11 2.02 -4.23 -1.02 -1.05 115.64 111.96 1qpp s THR 71 Ca 0.16 -0.81 0.00 0.00 -1.18 0.00 0.00 61.69 59.86 1qpp s THR 71 Cb 0.03 -3.14 -0.04 0.00 1.34 0.00 0.00 72.50 70.69 1qpp s THR 71 CO -0.00 0.12 0.27 0.42 -0.54 0.00 0.00 174.62 174.89 1qpp s THR 72 N -1.38 5.33 0.08 3.99 -4.23 -0.84 -4.98 115.64 113.60 1qpp s THR 72 Ca 0.29 -0.43 0.13 0.00 -1.18 0.00 0.00 61.69 60.50 1qpp s THR 72 Cb -0.12 -3.67 0.13 0.00 1.34 0.00 0.00 72.50 70.18 1qpp s THR 72 CO 0.21 0.03 1.30 -0.65 -0.54 0.00 0.00 174.62 174.97 1qpp h PRO 73 N 2.66 0.00 0.00 3.99 0.11 -1.99 -0.45 132.00 136.32 1qpp h PRO 73 Ca -0.46 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.65 1qpp h PRO 73 Cb 1.17 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.28 1qpp h PRO 73 CO 0.73 0.00 0.00 -0.25 -0.21 0.00 0.00 178.00 178.27 1qpp n ASP 74 N -2.09 0.00 0.19 -2.05 10.43 -1.26 -3.12 116.55 118.64 1qpp n ASP 74 Ca -0.01 -1.07 0.03 0.00 2.57 0.00 0.00 54.79 56.31 1qpp n ASP 74 Cb 0.35 0.00 0.36 0.00 1.84 0.00 0.00 41.12 43.67 1qpp n ASP 74 CO 0.00 0.00 0.00 -0.29 -1.07 0.00 0.00 177.20 175.84 1qpp h ILE 75 N 0.00 1.26 0.00 0.53 6.09 -1.33 -2.88 117.51 121.17 1qpp h ILE 75 Ca 0.00 -1.26 -0.00 0.00 -1.37 0.00 0.00 64.86 62.23 1qpp h ILE 75 Cb 0.00 1.68 -0.00 0.00 0.47 0.00 0.00 36.82 38.97 1qpp h ILE 75 CO 0.00 0.36 -0.00 0.28 -3.07 0.00 0.00 178.15 175.72 1qpp h SER 76 N 0.00 0.00 1.03 2.19 0.02 -1.81 -2.49 113.55 112.48 1qpp h SER 76 Ca -0.00 0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 60.92 1qpp h SER 76 Cb 0.65 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.19 1qpp h SER 76 CO 0.05 0.00 -0.10 0.11 -1.14 0.00 0.00 176.83 175.75 1qpp h LYS 77 N 0.00 0.00 -7.09 3.45 1.57 -1.78 -3.45 116.57 109.26 1qpp h LYS 77 Ca -0.00 0.00 -0.47 0.00 -1.87 0.00 0.00 60.65 58.31 1qpp h LYS 77 Cb 0.10 0.00 0.02 0.00 0.08 0.00 0.00 32.23 32.43 1qpp h LYS 77 CO 0.00 0.10 0.38 -0.51 -0.57 0.00 0.00 179.45 178.85 1qpp s LEU 78 N -6.47 3.80 0.34 2.94 1.43 -0.94 -4.98 118.68 114.80 1qpp s LEU 78 Ca 0.01 1.86 -0.27 0.00 -1.03 0.00 0.00 54.13 54.70 1qpp s LEU 78 Cb 0.09 -4.55 -0.12 0.00 0.03 0.00 0.00 46.19 41.64 1qpp s LEU 78 CO 0.59 -0.76 1.14 -2.65 0.23 0.00 0.00 176.35 174.91 1qpp n PRO 79 N -1.09 1.71 0.00 1.29 -0.02 -1.26 -4.91 135.00 130.72 1qpp n PRO 79 Ca 0.09 0.60 0.09 0.00 -2.02 0.00 0.00 63.50 62.26 1qpp n PRO 79 Cb 0.53 -2.12 0.01 0.00 -0.02 0.00 0.00 33.50 31.90 1qpp n PRO 79 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 1qpp n GLN 80 N 0.50 1.53 0.01 -0.52 1.13 -1.26 -4.41 117.38 114.35 1qpp n GLN 80 Ca 0.07 -1.00 0.11 0.00 -1.94 0.00 0.00 57.00 54.24 1qpp n GLN 80 Cb 0.35 -1.36 -0.07 0.00 0.11 0.00 0.00 30.24 29.27 1qpp n GLN 80 CO 0.00 0.00 0.00 -0.40 -1.44 0.00 0.00 177.06 175.22 1qpp n ASP 81 N 0.09 0.57 -4.07 1.08 5.75 -1.26 -4.48 116.55 114.23 1qpp n ASP 81 Ca 0.08 -0.39 -0.17 0.00 -0.01 0.00 0.00 54.79 54.31 1qpp n ASP 81 Cb 0.41 1.16 -0.10 0.00 -1.03 0.00 0.00 41.12 41.57 1qpp n ASP 81 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1qpp s ARG 82 N -3.22 1.49 0.49 0.11 1.04 -1.26 -4.71 118.95 112.88 1qpp s ARG 82 Ca 0.02 -1.83 -0.05 0.00 -1.04 0.00 0.00 55.73 52.83 1qpp s ARG 82 Cb 0.15 -0.04 -0.03 0.00 -2.04 0.00 0.00 34.95 32.99 1qpp s ARG 82 CO 0.85 -0.42 0.79 -1.21 -0.04 0.00 0.00 175.30 175.27 1qpp s GLU 83 N -3.91 3.45 -0.04 3.89 2.02 -0.54 -4.60 118.70 118.96 1qpp s GLU 83 Ca 0.37 0.13 0.07 0.00 0.02 0.00 0.00 54.97 55.56 1qpp s GLU 83 Cb 0.06 -2.38 -0.01 0.00 0.10 0.00 0.00 34.13 31.89 1qpp s GLU 83 CO 0.16 -0.26 -0.25 -1.12 0.02 0.00 0.00 175.26 173.81 1qpp s SER 84 N -4.13 3.04 -0.23 -0.19 0.01 -0.98 -4.91 113.70 106.31 1qpp s SER 84 Ca 0.48 -0.49 -0.14 0.00 1.31 0.00 0.00 55.95 57.11 1qpp s SER 84 Cb -0.10 -0.65 -0.04 0.00 0.21 0.00 0.00 66.02 65.44 1qpp s SER 84 CO 0.44 0.27 0.32 -0.22 0.41 0.00 0.00 173.24 174.46 1qpp s LEU 85 N -0.33 4.11 0.25 2.44 2.96 -1.26 -1.25 118.68 125.60 1qpp s LEU 85 Ca 0.01 0.33 0.09 0.00 -0.22 0.00 0.00 54.13 54.34 1qpp s LEU 85 Cb -0.12 -2.37 -0.05 0.00 0.50 0.00 0.00 46.19 44.15 1qpp s LEU 85 CO 0.02 -0.06 -0.13 -0.36 -1.32 0.00 0.00 176.35 174.50 1qpp s PHE 86 N 1.42 1.94 -0.14 5.38 0.08 0.01 -2.62 117.98 124.04 1qpp s PHE 86 Ca 0.14 -0.54 0.02 0.00 0.12 0.00 0.00 56.93 56.68 1qpp s PHE 86 Cb -0.15 -0.95 0.01 0.00 -0.57 0.00 0.00 43.02 41.37 1qpp s PHE 86 CO 0.07 0.43 -0.21 0.71 -0.10 0.00 0.00 175.22 176.12 1qpp s TYR 87 N -2.86 2.61 -0.15 0.36 2.02 -0.62 0.22 117.35 118.93 1qpp s TYR 87 Ca 0.26 -1.31 -0.20 0.00 -0.37 0.00 0.00 57.07 55.45 1qpp s TYR 87 Cb -0.00 -1.78 -0.03 0.00 -0.40 0.00 0.00 41.96 39.74 1qpp s TYR 87 CO 0.10 -0.60 0.56 0.12 -1.57 0.00 0.00 175.55 174.16 1qpp s PHE 88 N 0.83 3.45 0.00 2.71 5.36 -0.72 -1.09 117.98 128.52 1qpp s PHE 88 Ca -0.07 0.92 0.03 0.00 -0.96 0.00 0.00 56.93 56.85 1qpp s PHE 88 Cb -0.15 -2.68 -0.03 0.00 -0.34 0.00 0.00 43.02 39.81 1qpp s PHE 88 CO -0.02 0.00 -0.06 -0.80 -1.46 0.00 0.00 175.22 172.89 1qpp s ASN 89 N 0.93 4.70 -0.03 6.13 0.01 -0.26 -1.66 114.94 124.75 1qpp s ASN 89 Ca 0.28 -0.12 0.00 0.00 -0.71 0.00 0.00 52.86 52.31 1qpp s ASN 89 Cb -0.16 -1.12 0.03 0.00 0.41 0.00 0.00 41.25 40.41 1qpp s ASN 89 CO 0.11 0.28 -0.01 -0.22 -1.51 0.00 0.00 177.10 175.76 1qpp s LEU 90 N -1.43 1.13 -0.17 0.60 0.20 -0.43 -2.24 118.68 116.33 1qpp s LEU 90 Ca 0.17 -0.04 0.01 0.00 0.69 0.00 0.00 54.13 54.96 1qpp s LEU 90 Cb -0.11 -0.27 0.03 0.00 -0.43 0.00 0.00 46.19 45.41 1qpp s LEU 90 CO 0.08 -0.10 -0.14 -0.60 -0.29 0.00 0.00 176.35 175.30 1qpp s ARG 91 N 1.09 2.35 -0.08 1.98 3.52 0.78 -1.22 118.95 127.36 1qpp s ARG 91 Ca -0.09 -0.72 -0.22 0.00 -0.13 0.00 0.00 55.73 54.57 1qpp s ARG 91 Cb -0.14 -2.31 -0.04 0.00 -1.56 0.00 0.00 34.95 30.91 1qpp s ARG 91 CO -0.02 -0.30 0.66 -1.83 -0.81 0.00 0.00 175.30 173.00 1qpp s GLU 92 N 1.41 4.41 -0.27 5.12 -1.05 0.07 -0.91 118.70 127.49 1qpp s GLU 92 Ca 0.03 0.79 -0.01 0.00 -0.15 0.00 0.00 54.97 55.63 1qpp s GLU 92 Cb -0.14 -3.45 0.04 0.00 -0.44 0.00 0.00 34.13 30.14 1qpp s GLU 92 CO -0.10 0.07 -0.05 0.42 0.95 0.00 0.00 175.26 176.55 1qpp s ILE 93 N 0.80 2.79 0.55 1.83 1.01 -0.25 -2.90 121.20 125.04 1qpp s ILE 93 Ca 0.35 -1.23 -0.18 0.00 0.00 0.00 0.00 60.65 59.60 1qpp s ILE 93 Cb -0.17 -2.51 -0.06 0.00 0.01 0.00 0.00 42.46 39.74 1qpp s ILE 93 CO 0.16 0.07 1.05 -2.16 0.00 0.00 0.00 174.94 174.07 1qpp s PRO 94 N 1.27 3.51 0.70 2.79 0.04 -1.26 -1.91 135.00 140.13 1qpp s PRO 94 Ca -0.03 1.29 -0.11 0.00 0.04 0.00 0.00 61.00 62.19 1qpp s PRO 94 Cb -0.18 -2.05 0.01 0.00 0.04 0.00 0.00 34.50 32.31 1qpp s PRO 94 CO -0.04 -0.67 1.09 -1.25 0.04 0.00 0.00 177.00 176.18 1qpp s PRO 95 N -3.70 2.92 0.25 0.56 0.04 -1.26 -4.95 135.00 128.86 1qpp s PRO 95 Ca 0.66 0.49 -0.30 0.00 0.04 0.00 0.00 61.00 61.89 1qpp s PRO 95 Cb -0.17 -2.03 -0.09 0.00 0.04 0.00 0.00 34.50 32.25 1qpp s PRO 95 CO 0.30 -1.00 1.31 0.50 0.04 0.00 0.00 177.00 178.15 1qpp s ARG 96 N -5.34 4.38 0.08 4.56 3.00 -1.26 -4.96 118.95 119.40 1qpp s ARG 96 Ca 0.58 2.12 -0.10 0.00 -1.00 0.00 0.00 55.73 57.33 1qpp s ARG 96 Cb -0.11 -3.14 0.01 0.00 0.00 0.00 0.00 34.95 31.70 1qpp s ARG 96 CO 0.52 -0.22 0.23 0.45 0.00 0.00 0.00 175.30 176.28 1qpp s SER 97 N 0.01 0.03 0.00 -2.12 0.15 -1.26 -5.04 113.70 105.47 1qpp s SER 97 Ca 0.54 -0.51 0.15 0.00 0.70 0.00 0.00 55.95 56.83 1qpp s SER 97 Cb -0.38 0.35 0.02 0.00 -1.71 0.00 0.00 66.02 64.30 1qpp s SER 97 CO 0.43 -0.71 0.85 -0.62 1.20 0.00 0.00 173.24 174.40 1qpp n GLU 98 N 0.11 1.65 -1.85 5.44 -0.58 -1.26 -4.97 120.64 119.17 1qpp n GLU 98 Ca -0.16 -0.89 -0.42 0.00 -0.42 0.00 0.00 57.16 55.27 1qpp n GLU 98 Cb 0.62 -1.25 -0.03 0.00 -0.57 0.00 0.00 31.44 30.20 1qpp n GLU 98 CO 0.00 0.00 0.00 0.15 -0.48 0.00 0.00 177.13 176.80 1qpp s LYS 99 N -1.73 4.18 0.29 3.49 1.02 -1.26 -4.91 119.74 120.81 1qpp s LYS 99 Ca 0.14 2.42 0.01 0.00 0.02 0.00 0.00 55.97 58.55 1qpp s LYS 99 Cb 0.12 -3.58 0.52 0.00 -0.52 0.00 0.00 37.83 34.38 1qpp s LYS 99 CO 0.35 -0.77 1.88 0.00 -0.92 0.00 0.00 175.35 175.89 1qpp h ALA 100 N 8.35 1.51 0.00 5.17 0.00 -2.05 -2.98 119.26 129.27 1qpp h ALA 100 Ca -0.44 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.46 1qpp h ALA 100 Cb 1.21 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 18.74 1qpp h ALA 100 CO 0.94 0.32 0.00 0.27 0.00 0.00 0.00 179.25 180.77 1qpp n ASN 101 N -4.53 0.48 -4.64 0.00 6.94 -1.26 -4.82 115.26 107.44 1qpp n ASN 101 Ca 0.16 0.56 -0.41 0.00 -0.02 0.00 0.00 54.58 54.87 1qpp n ASN 101 Cb 0.26 -0.68 -0.06 0.00 -2.36 0.00 0.00 39.78 36.94 1qpp n ASN 101 CO 0.00 0.00 0.00 -0.69 -1.03 0.00 0.00 177.26 175.54 1qpp s VAL 102 N -3.09 4.95 0.22 3.53 1.01 -1.13 -5.04 120.40 120.85 1qpp s VAL 102 Ca 0.11 1.28 -0.30 0.00 0.00 0.00 0.00 61.98 63.06 1qpp s VAL 102 Cb 0.14 -3.99 -0.09 0.00 0.00 0.00 0.00 36.38 32.43 1qpp s VAL 102 CO 0.53 0.01 1.36 -0.76 0.00 0.00 0.00 175.10 176.24 1qpp s LEU 103 N 2.49 4.40 -0.43 3.92 1.43 -1.26 -4.91 118.68 124.32 1qpp s LEU 103 Ca 0.29 2.50 0.04 0.00 -1.03 0.00 0.00 54.13 55.94 1qpp s LEU 103 Cb -0.16 -3.61 0.48 0.00 0.03 0.00 0.00 46.19 42.93 1qpp s LEU 103 CO 0.09 -0.59 1.60 0.00 0.23 0.00 0.00 176.35 177.67 1qpp n GLN 104 N 2.53 2.77 -3.98 1.70 1.13 -1.26 -4.84 117.38 115.43 1qpp n GLN 104 Ca 0.06 -3.55 -0.09 0.00 -1.94 0.00 0.00 57.00 51.49 1qpp n GLN 104 Cb 0.42 -2.17 -0.10 0.00 0.11 0.00 0.00 30.24 28.51 1qpp n GLN 104 CO 0.00 0.00 0.00 0.96 -1.44 0.00 0.00 177.06 176.58 1qpp s ILE 105 N -4.26 0.16 0.30 5.09 -4.36 -1.26 -5.03 121.20 111.83 1qpp s ILE 105 Ca 0.55 -1.29 -0.28 0.00 -0.26 0.00 0.00 60.65 59.38 1qpp s ILE 105 Cb 0.45 -1.03 -0.09 0.00 1.25 0.00 0.00 42.46 43.03 1qpp s ILE 105 CO 0.02 -0.71 1.00 0.00 0.24 0.00 0.00 174.94 175.49 1qpp s ALA 106 N -2.96 3.27 0.17 2.27 0.00 -1.26 -4.69 121.76 118.56 1qpp s ALA 106 Ca -0.02 0.68 0.10 0.00 0.00 0.00 0.00 51.96 52.72 1qpp s ALA 106 Cb 0.01 -3.24 -0.04 0.00 0.00 0.00 0.00 23.12 19.84 1qpp s ALA 106 CO -0.06 0.02 -0.16 -0.51 0.00 0.00 0.00 175.76 175.05 1qpp s LEU 107 N -1.78 2.75 0.23 0.00 1.43 -1.14 -4.97 118.68 115.20 1qpp s LEU 107 Ca 0.48 -0.66 -0.06 0.00 -1.03 0.00 0.00 54.13 52.86 1qpp s LEU 107 Cb -0.25 -1.49 -0.02 0.00 0.03 0.00 0.00 46.19 44.46 1qpp s LEU 107 CO 0.31 0.13 0.30 0.00 0.23 0.00 0.00 176.35 177.32 1qpp s GLN 108 N -2.61 1.41 0.19 1.70 -2.07 -1.26 -0.75 119.66 116.26 1qpp s GLN 108 Ca 0.22 -1.49 -0.21 0.00 -1.82 0.00 0.00 55.36 52.05 1qpp s GLN 108 Cb -0.09 0.37 0.05 0.00 -1.09 0.00 0.00 33.01 32.25 1qpp s GLN 108 CO 0.12 -0.53 0.61 -0.08 -1.32 0.00 0.00 175.29 174.10 1qpp s THR 109 N -4.01 0.01 -0.01 3.63 -1.32 -0.36 -5.00 115.64 108.57 1qpp s THR 109 Ca 0.32 -0.38 -0.00 0.00 -1.21 0.00 0.00 61.69 60.41 1qpp s THR 109 Cb 0.03 -1.34 0.02 0.00 -1.51 0.00 0.00 72.50 69.70 1qpp s THR 109 CO 0.12 -0.03 0.02 -1.59 -2.21 0.00 0.00 174.62 170.93 1qpp s LYS 110 N -3.81 -0.01 0.15 7.08 -2.85 -1.26 -1.31 119.74 117.72 1qpp s LYS 110 Ca 0.05 0.11 0.05 0.00 -1.00 0.00 0.00 55.97 55.18 1qpp s LYS 110 Cb -0.02 -0.13 -0.04 0.00 -2.06 0.00 0.00 37.83 35.58 1qpp s LYS 110 CO -0.06 -0.09 0.10 0.96 0.10 0.00 0.00 175.35 176.35 1qpp s ILE 111 N 0.58 4.34 0.30 3.79 -4.36 -0.67 -4.96 121.20 120.23 1qpp s ILE 111 Ca -0.05 -1.08 -0.29 0.00 -0.26 0.00 0.00 60.65 58.98 1qpp s ILE 111 Cb -0.07 -3.18 -0.10 0.00 1.25 0.00 0.00 42.46 40.36 1qpp s ILE 111 CO -0.02 -0.05 1.23 -0.54 0.24 0.00 0.00 174.94 175.80 1qpp s LYS 112 N -2.90 4.46 -0.39 0.37 1.02 -1.26 -1.75 119.74 119.29 1qpp s LYS 112 Ca 0.30 2.06 0.02 0.00 0.02 0.00 0.00 55.97 58.36 1qpp s LYS 112 Cb -0.10 -3.12 0.12 0.00 -0.52 0.00 0.00 37.83 34.20 1qpp s LYS 112 CO 0.22 -0.05 0.16 -1.17 -0.92 0.00 0.00 175.35 173.59 1qpp s LEU 113 N -1.54 3.11 -0.31 3.17 2.96 0.59 -1.25 118.68 125.42 1qpp s LEU 113 Ca 0.48 -2.26 -0.27 0.00 -0.22 0.00 0.00 54.13 51.87 1qpp s LEU 113 Cb -0.37 -1.16 0.01 0.00 0.50 0.00 0.00 46.19 45.18 1qpp s LEU 113 CO 0.48 -0.33 0.95 -0.36 -1.32 0.00 0.00 176.35 175.76 1qpp s PHE 114 N 0.80 3.19 -0.21 5.38 0.08 -0.71 -0.81 117.98 125.70 1qpp s PHE 114 Ca 0.14 1.05 -0.28 0.00 0.12 0.00 0.00 56.93 57.95 1qpp s PHE 114 Cb -0.21 -3.45 0.00 0.00 -0.57 0.00 0.00 43.02 38.79 1qpp s PHE 114 CO -0.10 -0.66 0.99 -0.47 -0.10 0.00 0.00 175.22 174.89 1qpp s TYR 115 N 3.31 3.37 -0.33 0.36 5.04 -0.38 0.15 117.35 128.87 1qpp s TYR 115 Ca 0.40 1.43 0.03 0.00 -2.44 0.00 0.00 57.07 56.49 1qpp s TYR 115 Cb -0.13 -3.21 0.09 0.00 0.35 0.00 0.00 41.96 39.06 1qpp s TYR 115 CO 0.13 -0.41 0.03 0.50 -1.34 0.00 0.00 175.55 174.47 1qpp s ARG 116 N 2.89 1.69 0.48 4.97 3.52 0.13 -2.31 118.95 130.32 1qpp s ARG 116 Ca 0.43 -1.76 -0.21 0.00 -0.13 0.00 0.00 55.73 54.06 1qpp s ARG 116 Cb -0.16 -3.19 -0.10 0.00 -1.56 0.00 0.00 34.95 29.95 1qpp s ARG 116 CO 0.09 -0.88 0.75 -2.30 -0.81 0.00 0.00 175.30 172.15 1qpp n PRO 117 N 4.32 0.85 -0.34 5.12 -0.02 -1.26 0.21 135.00 143.89 1qpp n PRO 117 Ca -0.00 0.32 0.21 0.00 -2.02 0.00 0.00 63.50 62.00 1qpp n PRO 117 Cb 0.42 -1.82 0.43 0.00 -0.02 0.00 0.00 33.50 32.51 1qpp n PRO 117 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1qpp h ALA 118 N 0.85 1.88 -0.10 3.55 0.00 -1.90 -2.44 119.26 121.10 1qpp h ALA 118 Ca -0.44 0.16 0.01 0.00 0.00 0.00 0.00 54.91 54.63 1qpp h ALA 118 Cb 1.37 0.09 -0.01 0.00 0.00 0.00 0.00 17.79 19.24 1qpp h ALA 118 CO 0.52 -0.43 0.04 0.00 0.00 0.00 0.00 179.25 179.39 1qpp h ALA 119 N 1.79 0.11 -0.45 0.00 0.00 -1.90 -3.06 119.26 115.76 1qpp h ALA 119 Ca 0.69 0.00 -0.24 0.00 0.00 0.00 0.00 54.91 55.37 1qpp h ALA 119 Cb 1.46 -0.01 -0.14 0.00 0.00 0.00 0.00 17.79 19.10 1qpp h ALA 119 CO -0.54 -0.41 0.30 0.44 0.00 0.00 0.00 179.25 179.03 1qpp n ILE 120 N -5.05 2.00 -2.46 0.00 -5.35 -0.92 -4.93 119.36 102.65 1qpp n ILE 120 Ca -0.05 -0.87 -0.34 0.00 -0.27 0.00 0.00 62.75 61.22 1qpp n ILE 120 Cb 0.04 -0.76 -0.03 0.00 -1.74 0.00 0.00 39.64 37.16 1qpp n ILE 120 CO 0.00 0.00 0.00 -0.54 -1.76 0.00 0.00 176.55 174.25 1qpp s LYS 121 N -1.50 3.69 0.00 6.28 -0.14 -1.16 -4.93 119.74 121.98 1qpp s LYS 121 Ca 0.26 1.39 0.00 0.00 -1.36 0.00 0.00 55.97 56.26 1qpp s LYS 121 Cb 0.22 -2.08 0.00 0.00 -1.68 0.00 0.00 37.83 34.29 1qpp s LYS 121 CO 0.05 -0.53 0.00 0.25 -0.76 0.00 0.00 175.35 174.36 1qpp n THR 122 N -1.11 0.00 0.00 2.17 -2.24 -1.26 -5.12 114.28 106.72 1qpp n THR 122 Ca 0.10 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.88 1qpp n THR 122 Cb 0.52 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.75 1qpp n THR 122 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 1qpp n ASN 125 N 0.00 0.00 -4.76 3.42 3.02 -1.26 -5.18 115.26 110.51 1qpp n ASN 125 Ca 0.00 0.00 -0.40 0.00 -0.03 0.00 0.00 54.58 54.15 1qpp n ASN 125 Cb 0.00 0.00 -0.05 0.00 -0.61 0.00 0.00 39.78 39.12 1qpp n ASN 125 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 1qpp s GLU 126 N 0.00 4.67 -0.58 3.52 8.01 -1.26 -5.02 118.70 128.05 1qpp s GLU 126 Ca 0.00 1.70 -0.03 0.00 0.01 0.00 0.00 54.97 56.65 1qpp s GLU 126 Cb 0.00 -3.17 0.15 0.00 -4.31 0.00 0.00 34.13 26.80 1qpp s GLU 126 CO 0.00 0.28 0.39 0.08 0.01 0.00 0.00 175.26 176.02 1qpp s VAL 127 N -1.20 3.65 -0.69 2.63 1.01 -1.26 -4.94 120.40 119.59 1qpp s VAL 127 Ca 0.44 -2.73 0.26 0.00 0.00 0.00 0.00 61.98 59.95 1qpp s VAL 127 Cb -0.30 -3.40 0.29 0.00 0.00 0.00 0.00 36.38 32.97 1qpp s VAL 127 CO 0.38 -0.84 1.74 4.11 0.00 0.00 0.00 175.10 180.49 1qpp h TRP 128 N 7.29 0.00 0.00 5.22 0.09 -2.03 -3.26 115.95 123.25 1qpp h TRP 128 Ca -0.04 0.00 0.00 0.00 0.09 0.00 0.00 58.89 58.94 1qpp h TRP 128 Cb 0.98 0.00 0.00 0.00 0.08 0.00 0.00 29.16 30.22 1qpp h TRP 128 CO 0.67 0.00 0.00 1.04 0.09 0.00 0.00 178.44 180.24 1qpp n GLN 129 N -2.36 0.24 0.20 0.12 3.00 -1.26 -2.25 117.38 115.07 1qpp n GLN 129 Ca 0.05 0.13 0.06 0.00 -0.01 0.00 0.00 57.00 57.23 1qpp n GLN 129 Cb 0.44 -1.50 0.43 0.00 0.00 0.00 0.00 30.24 29.61 1qpp n GLN 129 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.06 176.62 1qpp h ASP 130 N 0.00 0.00 0.56 1.08 5.19 -2.01 -2.96 116.42 118.28 1qpp h ASP 130 Ca 0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 1qpp h ASP 130 Cb 0.16 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.67 1qpp h ASP 130 CO 0.00 0.32 0.00 0.00 -3.12 0.00 0.00 179.24 176.44 1qpp n GLN 131 N -3.70 0.02 -1.71 3.56 3.00 -0.95 -4.40 117.38 113.19 1qpp n GLN 131 Ca -0.01 0.20 -0.43 0.00 -0.01 0.00 0.00 57.00 56.76 1qpp n GLN 131 Cb 0.42 -1.50 -0.02 0.00 0.00 0.00 0.00 30.24 29.14 1qpp n GLN 131 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.06 178.34 1qpp n LEU 132 N -1.48 3.78 -4.26 1.08 4.77 -1.12 -4.62 117.00 115.15 1qpp n LEU 132 Ca 0.04 1.16 -0.31 0.00 -0.03 0.00 0.00 56.01 56.88 1qpp n LEU 132 Cb 0.19 -1.51 -0.16 0.00 -2.33 0.00 0.00 43.42 39.60 1qpp n LEU 132 CO 0.15 -0.21 -0.56 -0.63 -1.33 0.00 0.00 177.39 174.82 1qpp s ILE 133 N -0.32 1.99 -0.23 -0.08 -1.09 -1.11 -4.50 121.20 115.85 1qpp s ILE 133 Ca 0.63 -1.04 -0.02 0.00 -2.23 0.00 0.00 60.65 58.00 1qpp s ILE 133 Cb -0.56 -1.68 0.02 0.00 -1.58 0.00 0.00 42.46 38.66 1qpp s ILE 133 CO 0.53 0.55 -0.08 -0.76 -1.23 0.00 0.00 174.94 173.96 1qpp s LEU 134 N -0.21 2.97 -0.23 2.97 1.43 -0.87 -1.49 118.68 123.25 1qpp s LEU 134 Ca -0.01 -0.73 -0.02 0.00 -1.03 0.00 0.00 54.13 52.33 1qpp s LEU 134 Cb -0.13 -1.65 0.01 0.00 0.03 0.00 0.00 46.19 44.45 1qpp s LEU 134 CO 0.03 -0.09 -0.06 0.20 0.23 0.00 0.00 176.35 176.66 1qpp s ASN 135 N 1.35 4.22 0.23 2.29 0.01 -0.93 0.60 114.94 122.70 1qpp s ASN 135 Ca 0.02 -0.67 -0.32 0.00 -0.71 0.00 0.00 52.86 51.18 1qpp s ASN 135 Cb -0.16 -1.68 -0.12 0.00 0.41 0.00 0.00 41.25 39.70 1qpp s ASN 135 CO -0.05 -0.08 1.64 0.29 -1.51 0.00 0.00 177.10 177.39 1qpp n LYS 136 N 4.72 2.60 -4.20 -0.60 5.02 -0.66 -1.37 118.16 123.67 1qpp n LYS 136 Ca -0.17 0.93 -0.16 0.00 -2.02 0.00 0.00 58.31 56.89 1qpp n LYS 136 Cb 0.49 -2.74 -0.07 0.00 -0.02 0.00 0.00 35.03 32.69 1qpp n LYS 136 CO 0.00 0.00 0.00 0.14 -0.52 0.00 0.00 177.40 177.02 1qpp s VAL 137 N 0.73 0.00 0.09 -0.18 -7.23 -0.77 -4.90 120.40 108.15 1qpp s VAL 137 Ca 0.72 -1.87 -0.31 0.00 -1.81 0.00 0.00 61.98 58.71 1qpp s VAL 137 Cb -0.54 -2.52 -0.10 0.00 0.56 0.00 0.00 36.38 33.78 1qpp s VAL 137 CO 0.39 0.00 1.86 -0.44 -0.31 0.00 0.00 175.10 176.60 1qpp s SER 138 N -3.27 6.44 -1.16 4.85 0.01 -1.26 -2.82 113.70 116.48 1qpp s SER 138 Ca 0.37 2.72 -0.03 0.00 1.31 0.00 0.00 55.95 60.32 1qpp s SER 138 Cb 0.03 -2.56 0.00 0.00 0.21 0.00 0.00 66.02 63.70 1qpp s SER 138 CO 0.21 -1.02 0.40 0.61 0.41 0.00 0.00 173.24 173.86 1qpp n GLY 139 N 4.32 -0.21 0.00 3.44 0.00 -1.26 -4.82 105.19 106.65 1qpp n GLY 139 Ca 0.18 -0.13 0.00 0.00 0.00 0.00 0.00 46.02 46.08 1qpp n GLY 139 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1qpp n GLY 140 N -1.29 0.41 3.42 -0.02 0.00 -1.12 -2.15 105.19 104.45 1qpp n GLY 140 Ca -0.09 -1.41 -0.21 0.00 0.00 0.00 0.00 46.02 44.31 1qpp n GLY 140 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1qpp s TYR 141 N -3.85 1.89 -0.30 1.61 2.02 -1.04 -1.85 117.35 115.83 1qpp s TYR 141 Ca 0.00 -0.92 0.03 0.00 -0.37 0.00 0.00 57.07 55.81 1qpp s TYR 141 Cb 0.00 -1.19 0.08 0.00 -0.40 0.00 0.00 41.96 40.45 1qpp s TYR 141 CO 0.00 0.03 -0.01 0.50 -1.57 0.00 0.00 175.55 174.50 1qpp s ARG 142 N -3.87 1.74 -0.18 -0.62 3.52 -0.47 -1.07 118.95 118.00 1qpp s ARG 142 Ca 0.34 -1.59 -0.23 0.00 -0.13 0.00 0.00 55.73 54.12 1qpp s ARG 142 Cb 0.08 -3.00 -0.02 0.00 -1.56 0.00 0.00 34.95 30.44 1qpp s ARG 142 CO 0.14 -0.78 0.72 0.42 -0.81 0.00 0.00 175.30 174.99 1qpp s ILE 143 N 1.04 4.96 -0.13 4.11 1.01 0.23 -2.19 121.20 130.22 1qpp s ILE 143 Ca 0.02 1.40 -0.04 0.00 0.00 0.00 0.00 60.65 62.04 1qpp s ILE 143 Cb -0.19 -4.04 -0.03 0.00 0.01 0.00 0.00 42.46 38.21 1qpp s ILE 143 CO -0.07 0.08 -0.00 -1.61 0.00 0.00 0.00 174.94 173.33 1qpp s GLU 144 N 1.95 3.46 -0.46 2.79 2.02 -0.55 -0.71 118.70 127.19 1qpp s GLU 144 Ca 0.33 -0.44 -0.01 0.00 0.02 0.00 0.00 54.97 54.87 1qpp s GLU 144 Cb -0.16 -2.92 0.12 0.00 0.10 0.00 0.00 34.13 31.27 1qpp s GLU 144 CO 0.12 0.43 0.24 1.21 0.02 0.00 0.00 175.26 177.27 1qpp s ASN 145 N -0.12 5.07 0.41 -0.19 2.47 0.29 -2.76 114.94 120.11 1qpp s ASN 145 Ca 0.04 -2.35 0.22 0.00 0.42 0.00 0.00 52.86 51.19 1qpp s ASN 145 Cb -0.13 -1.78 0.73 0.00 -1.45 0.00 0.00 41.25 38.62 1qpp s ASN 145 CO 0.02 -0.44 1.74 1.55 -3.72 0.00 0.00 177.10 176.25 1qpp h PRO 146 N 7.57 0.00 -7.63 0.43 0.13 -1.81 -1.92 132.00 128.77 1qpp h PRO 146 Ca -0.08 0.00 -0.46 0.00 -0.87 0.00 0.00 66.00 64.58 1qpp h PRO 146 Cb 1.00 0.00 0.11 0.00 0.13 0.00 0.00 31.00 32.25 1qpp h PRO 146 CO 0.67 0.26 0.39 0.95 -0.23 0.00 0.00 178.00 180.04 1qpp s THR 147 N -3.49 1.99 -2.01 1.56 -4.23 -1.26 -4.57 115.64 103.62 1qpp s THR 147 Ca 0.02 0.00 0.11 0.00 -1.18 0.00 0.00 61.69 60.63 1qpp s THR 147 Cb 0.09 -2.96 0.30 0.00 1.34 0.00 0.00 72.50 71.28 1qpp s THR 147 CO 0.66 0.00 1.26 -0.81 -0.54 0.00 0.00 174.62 175.19 1qpp n PRO 148 N -3.46 1.75 -3.91 3.99 -0.04 -1.26 -1.12 135.00 130.94 1qpp n PRO 148 Ca 0.09 -1.16 -0.22 0.00 -0.04 0.00 0.00 63.50 62.16 1qpp n PRO 148 Cb 0.61 -1.26 -0.05 0.00 -0.04 0.00 0.00 33.50 32.75 1qpp n PRO 148 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 1qpp s TYR 149 N -1.58 2.76 0.10 0.54 2.02 -1.26 -1.47 117.35 118.45 1qpp s TYR 149 Ca 0.22 -0.40 -0.22 0.00 -0.37 0.00 0.00 57.07 56.30 1qpp s TYR 149 Cb 0.12 -1.82 -0.07 0.00 -0.40 0.00 0.00 41.96 39.79 1qpp s TYR 149 CO 0.16 0.19 0.68 0.71 -1.57 0.00 0.00 175.55 175.71 1qpp s TYR 150 N -2.42 3.82 -0.12 2.71 1.51 -1.26 -3.59 117.35 118.01 1qpp s TYR 150 Ca 0.41 1.43 0.01 0.00 -1.01 0.00 0.00 57.07 57.91 1qpp s TYR 150 Cb -0.03 -2.65 0.02 0.00 -0.11 0.00 0.00 41.96 39.18 1qpp s TYR 150 CO 0.25 0.49 -0.15 0.08 -1.11 0.00 0.00 175.55 175.11 1qpp s VAL 151 N -0.88 1.55 -0.33 0.71 1.01 -0.92 -4.96 120.40 116.57 1qpp s VAL 151 Ca 0.33 -0.66 -0.15 0.00 0.00 0.00 0.00 61.98 61.50 1qpp s VAL 151 Cb -0.21 -1.42 -0.02 0.00 0.00 0.00 0.00 36.38 34.73 1qpp s VAL 151 CO 0.22 0.45 0.35 -0.89 0.00 0.00 0.00 175.10 175.24 1qpp s THR 152 N 1.10 5.18 -0.30 3.92 2.01 -1.26 0.40 115.64 126.69 1qpp s THR 152 Ca -0.04 0.08 -0.13 0.00 0.31 0.00 0.00 61.69 61.91 1qpp s THR 152 Cb -0.14 -3.80 -0.03 0.00 0.01 0.00 0.00 72.50 68.53 1qpp s THR 152 CO -0.04 -0.06 0.28 -0.69 -0.69 0.00 0.00 174.62 173.42 1qpp s VAL 153 N 2.00 5.24 -1.20 3.82 1.01 0.62 -2.10 120.40 129.79 1qpp s VAL 153 Ca 0.12 0.20 0.15 0.00 0.00 0.00 0.00 61.98 62.44 1qpp s VAL 153 Cb -0.16 -3.66 -0.04 0.00 0.00 0.00 0.00 36.38 32.51 1qpp s VAL 153 CO 0.11 0.12 0.76 2.30 0.00 0.00 0.00 175.10 178.39 1qpp n ILE 154 N 5.12 0.00 -3.62 2.22 -5.35 -0.30 0.18 119.36 117.62 1qpp n ILE 154 Ca -0.11 -0.30 -0.11 0.00 -0.27 0.00 0.00 62.75 61.96 1qpp n ILE 154 Cb 0.51 1.13 -0.07 0.00 -1.74 0.00 0.00 39.64 39.47 1qpp n ILE 154 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 1qpp s GLY 155 N -1.93 -0.26 -0.05 3.28 0.00 -1.12 -4.50 107.32 102.74 1qpp s GLY 155 Ca 0.11 2.36 -0.01 0.00 0.00 0.00 0.00 44.72 47.18 1qpp s GLY 155 CO 0.43 1.62 0.01 -2.27 0.00 0.00 0.00 173.10 172.89 1qpp s LEU 156 N -0.08 0.78 0.00 0.66 2.96 -1.26 0.22 118.68 121.95 1qpp s LEU 156 Ca 0.01 -0.03 -0.02 0.00 -0.22 0.00 0.00 54.13 53.87 1qpp s LEU 156 Cb -0.04 -0.29 0.01 0.00 0.50 0.00 0.00 46.19 46.38 1qpp s LEU 156 CO -0.03 -0.16 0.26 0.61 -1.32 0.00 0.00 176.35 175.71 1qpp n GLY 157 N 4.69 2.40 0.11 7.98 0.00 -0.10 -4.74 105.19 115.53 1qpp n GLY 157 Ca -0.15 -1.40 0.01 0.00 0.00 0.00 0.00 46.02 44.47 1qpp n GLY 157 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1qpp h GLY 158 N 0.91 0.00 -2.37 -0.02 0.00 -1.86 0.32 103.07 100.04 1qpp h GLY 158 Ca -0.13 0.00 -0.32 0.00 0.00 0.00 0.00 47.33 46.88 1qpp h GLY 158 CO 0.18 0.00 -0.59 -1.35 0.00 0.00 0.00 176.54 174.77 1qpp s SER 159 N -6.16 0.77 0.27 0.19 1.04 -1.26 -4.65 113.70 103.90 1qpp s SER 159 Ca 0.01 -1.45 0.00 0.00 0.48 0.00 0.00 55.95 54.98 1qpp s SER 159 Cb 0.08 0.35 0.52 0.00 0.10 0.00 0.00 66.02 67.07 1qpp s SER 159 CO 0.78 -0.85 1.83 -0.08 0.98 0.00 0.00 173.24 175.91 1qpp h GLU 160 N 2.45 0.94 0.03 4.02 4.81 -1.94 -0.29 114.58 124.59 1qpp h GLU 160 Ca -0.35 -0.06 -0.22 0.00 -0.13 0.00 0.00 59.36 58.60 1qpp h GLU 160 Cb 1.25 -0.21 -0.01 0.00 0.63 0.00 0.00 28.75 30.41 1qpp h GLU 160 CO 0.53 0.62 -0.97 0.87 -0.73 0.00 0.00 179.01 179.33 1qpp h LYS 161 N 0.97 0.25 0.00 1.92 1.79 -1.97 -3.05 116.57 116.47 1qpp h LYS 161 Ca 0.48 -0.30 0.00 0.00 -2.18 0.00 0.00 60.65 58.65 1qpp h LYS 161 Cb 0.45 0.09 0.00 0.00 -1.58 0.00 0.00 32.23 31.19 1qpp h LYS 161 CO -0.26 1.04 0.00 1.96 -1.08 0.00 0.00 179.45 181.11 1qpp h GLN 162 N 0.12 0.00 0.00 3.15 1.08 -1.71 -1.31 115.11 116.43 1qpp h GLN 162 Ca -0.07 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.13 1qpp h GLN 162 Cb 1.63 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 29.06 1qpp h GLN 162 CO 0.15 0.00 -0.06 0.00 -0.95 0.00 0.00 178.83 177.97 1qpp h ALA 163 N 2.13 0.96 -0.21 3.87 0.00 -0.99 -3.16 119.26 121.87 1qpp h ALA 163 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1qpp h ALA 163 Cb 0.58 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.37 1qpp h ALA 163 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 179.25 179.64 1qpp n GLU 164 N -2.52 1.90 0.00 0.00 1.02 -0.59 -4.40 120.64 116.05 1qpp n GLU 164 Ca 0.05 -1.70 0.13 0.00 -0.02 0.00 0.00 57.16 55.62 1qpp n GLU 164 Cb 0.46 -1.26 0.39 0.00 -0.02 0.00 0.00 31.44 31.02 1qpp n GLU 164 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 1qpp n GLU 165 N 0.61 0.43 -1.97 3.49 1.02 -0.62 -4.90 120.64 118.69 1qpp n GLU 165 Ca 0.10 -0.22 -0.41 0.00 -0.02 0.00 0.00 57.16 56.60 1qpp n GLU 165 Cb 0.37 -1.50 -0.02 0.00 -0.02 0.00 0.00 31.44 30.28 1qpp n GLU 165 CO 0.00 0.00 0.00 0.20 1.18 0.00 0.00 177.13 178.51 1qpp s GLY 166 N -2.72 2.58 -0.08 0.62 0.00 -1.26 -4.97 107.32 101.49 1qpp s GLY 166 Ca 0.19 1.39 -0.08 0.00 0.00 0.00 0.00 44.72 46.22 1qpp s GLY 166 CO 0.58 2.22 -0.16 1.18 0.00 0.00 0.00 173.10 176.92 1qpp n GLU 167 N 1.59 0.24 -0.90 2.90 1.02 -1.26 -4.88 120.64 119.36 1qpp n GLU 167 Ca 0.04 0.10 0.05 0.00 -0.02 0.00 0.00 57.16 57.33 1qpp n GLU 167 Cb 0.40 -0.91 0.13 0.00 -0.02 0.00 0.00 31.44 31.04 1qpp n GLU 167 CO 0.00 0.00 0.00 1.19 1.18 0.00 0.00 177.13 179.50 1qpp n PHE 168 N -3.42 0.00 -1.20 -0.32 3.72 -1.26 -4.91 117.46 110.07 1qpp n PHE 168 Ca -0.06 -1.03 -0.27 0.00 -0.05 0.00 0.00 57.45 56.03 1qpp n PHE 168 Cb 0.24 -0.20 0.05 0.00 -0.94 0.00 0.00 39.48 38.63 1qpp n PHE 168 CO 0.00 0.00 0.00 -0.85 -0.05 0.00 0.00 176.76 175.86 1qpp n GLU 169 N -0.49 2.32 -1.95 -1.08 -0.00 -1.26 -4.99 120.64 113.19 1qpp n GLU 169 Ca 0.13 -2.55 -0.42 0.00 -0.00 0.00 0.00 57.16 54.33 1qpp n GLU 169 Cb 0.86 -2.01 -0.02 0.00 -0.00 0.00 0.00 31.44 30.27 1qpp n GLU 169 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.13 178.12 1qpp s THR 170 N -3.66 2.56 -0.24 3.84 2.01 -1.26 -4.64 115.64 114.25 1qpp s THR 170 Ca 0.50 0.44 -0.02 0.00 0.31 0.00 0.00 61.69 62.92 1qpp s THR 170 Cb 0.39 -3.28 0.08 0.00 0.01 0.00 0.00 72.50 69.69 1qpp s THR 170 CO -0.04 0.06 0.06 -0.69 -0.69 0.00 0.00 174.62 173.32 1qpp s VAL 171 N 0.41 0.55 -0.13 3.82 1.01 0.13 -4.98 120.40 121.21 1qpp s VAL 171 Ca 0.64 -0.81 -0.19 0.00 0.00 0.00 0.00 61.98 61.61 1qpp s VAL 171 Cb -0.43 -1.20 -0.04 0.00 0.00 0.00 0.00 36.38 34.71 1qpp s VAL 171 CO 0.40 -0.40 0.53 -0.32 0.00 0.00 0.00 175.10 175.31 1qpp s MET 172 N 1.82 4.33 -0.27 2.72 1.75 -1.26 -0.28 119.30 128.11 1qpp s MET 172 Ca 0.03 0.53 -0.09 0.00 -1.25 0.00 0.00 55.69 54.91 1qpp s MET 172 Cb -0.17 -3.46 -0.03 0.00 2.84 0.00 0.00 34.83 34.00 1qpp s MET 172 CO -0.16 0.07 0.12 -0.51 -0.65 0.00 0.00 175.02 173.89 1qpp s LEU 173 N 0.88 3.72 0.63 4.11 1.43 0.16 -4.96 118.68 124.65 1qpp s LEU 173 Ca 0.28 -0.18 -0.18 0.00 -1.03 0.00 0.00 54.13 53.02 1qpp s LEU 173 Cb -0.16 -2.00 -0.01 0.00 0.03 0.00 0.00 46.19 44.05 1qpp s LEU 173 CO 0.11 -0.06 1.20 -0.44 0.23 0.00 0.00 176.35 177.40 1qpp s SER 174 N 1.66 4.94 0.22 2.29 0.01 -1.26 -2.17 113.70 119.40 1qpp s SER 174 Ca 0.06 2.35 -0.31 0.00 1.31 0.00 0.00 55.95 59.36 1qpp s SER 174 Cb -0.16 -2.59 -0.14 0.00 0.21 0.00 0.00 66.02 63.34 1qpp s SER 174 CO 0.06 -1.76 1.30 -2.65 0.41 0.00 0.00 173.24 170.60 1qpp n PRO 175 N -1.93 1.71 -3.80 12.44 -0.02 -1.24 -2.46 135.00 139.71 1qpp n PRO 175 Ca 0.13 0.61 -0.27 0.00 -2.02 0.00 0.00 63.50 61.96 1qpp n PRO 175 Cb 0.50 -2.19 0.04 0.00 -0.02 0.00 0.00 33.50 31.82 1qpp n PRO 175 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 1qpp n ARG 176 N 1.81 -5.67 -3.20 -0.52 1.74 -0.28 -4.97 116.66 105.57 1qpp n ARG 176 Ca 0.12 0.64 -0.13 0.00 -0.77 0.00 0.00 57.85 57.71 1qpp n ARG 176 Cb 0.29 -5.45 -0.03 0.00 -1.02 0.00 0.00 32.46 26.25 1qpp n ARG 176 CO 0.00 0.00 0.00 0.43 -1.52 0.00 0.00 177.63 176.54 1qpp n SER 177 N -2.93 1.60 -3.71 0.55 7.64 -1.03 -4.92 113.62 110.82 1qpp n SER 177 Ca -0.07 -2.05 -0.14 0.00 1.01 0.00 0.00 58.87 57.62 1qpp n SER 177 Cb 0.58 0.39 -0.09 0.00 -1.01 0.00 0.00 64.21 64.08 1qpp n SER 177 CO 0.00 0.00 0.00 -1.83 -3.01 0.00 0.00 175.04 170.20 1qpp s GLU 178 N -2.79 0.59 -0.02 1.43 -1.05 -1.26 0.10 118.70 115.70 1qpp s GLU 178 Ca 0.07 0.53 0.03 0.00 -0.15 0.00 0.00 54.97 55.45 1qpp s GLU 178 Cb 0.00 0.28 -0.00 0.00 -0.44 0.00 0.00 34.13 33.98 1qpp s GLU 178 CO 0.05 -0.09 -0.09 -0.65 0.95 0.00 0.00 175.26 175.42 1qpp s GLN 179 N -0.01 0.92 -0.20 -4.83 -1.52 0.11 -4.95 119.66 109.19 1qpp s GLN 179 Ca -0.02 -0.32 -0.19 0.00 -1.95 0.00 0.00 55.36 52.88 1qpp s GLN 179 Cb -0.03 -0.87 -0.03 0.00 -0.22 0.00 0.00 33.01 31.86 1qpp s GLN 179 CO 0.02 0.15 0.54 0.99 -0.25 0.00 0.00 175.29 176.73 1qpp s THR 180 N 0.06 5.09 -0.14 -0.19 2.01 -1.26 0.74 115.64 121.95 1qpp s THR 180 Ca -0.01 1.01 -0.02 0.00 0.31 0.00 0.00 61.69 62.98 1qpp s THR 180 Cb -0.07 -3.86 -0.02 0.00 0.01 0.00 0.00 72.50 68.55 1qpp s THR 180 CO 0.00 0.17 -0.09 0.68 -0.69 0.00 0.00 174.62 174.69 1qpp s VAL 181 N 1.67 3.46 0.11 3.82 -7.23 -0.23 -4.97 120.40 117.02 1qpp s VAL 181 Ca 0.25 -0.52 -0.30 0.00 -1.81 0.00 0.00 61.98 59.60 1qpp s VAL 181 Cb -0.16 -2.48 -0.07 0.00 0.56 0.00 0.00 36.38 34.23 1qpp s VAL 181 CO 0.10 0.51 1.22 -1.59 -0.31 0.00 0.00 175.10 175.03 1qpp s LYS 182 N 0.33 4.44 -0.03 4.82 -2.85 -1.26 -2.50 119.74 122.69 1qpp s LYS 182 Ca -0.07 1.84 -0.31 0.00 -1.00 0.00 0.00 55.97 56.43 1qpp s LYS 182 Cb -0.15 -3.30 0.12 0.00 -2.06 0.00 0.00 37.83 32.44 1qpp s LYS 182 CO 0.04 -0.22 1.21 -1.54 0.10 0.00 0.00 175.35 174.94 1qpp s SER 183 N 0.76 -0.10 0.38 0.03 1.04 -0.91 -4.95 113.70 109.94 1qpp s SER 183 Ca 0.57 -0.13 -0.24 0.00 0.48 0.00 0.00 55.95 56.63 1qpp s SER 183 Cb -0.31 0.21 -0.10 0.00 0.10 0.00 0.00 66.02 65.91 1qpp s SER 183 CO 0.32 -0.38 0.95 0.00 0.98 0.00 0.00 173.24 175.11 1qpp s ALA 184 N -2.56 3.12 -0.18 5.32 0.00 -1.26 -2.80 121.76 123.39 1qpp s ALA 184 Ca 0.12 0.48 -0.29 0.00 0.00 0.00 0.00 51.96 52.27 1qpp s ALA 184 Cb 0.03 -3.17 -0.02 0.00 0.00 0.00 0.00 23.12 19.96 1qpp s ALA 184 CO -0.03 0.13 1.34 1.21 0.00 0.00 0.00 175.76 178.40 1qpp s ASN 185 N -1.87 6.82 -0.04 0.00 3.84 -1.26 -4.93 114.94 117.50 1qpp s ASN 185 Ca 0.56 1.65 0.02 0.00 0.21 0.00 0.00 52.86 55.30 1qpp s ASN 185 Cb -0.14 -2.54 -0.03 0.00 -0.55 0.00 0.00 41.25 37.99 1qpp s ASN 185 CO 0.19 -0.88 -0.10 -0.31 -2.79 0.00 0.00 177.10 173.22 1qpp s TYR 186 N 3.85 2.84 0.29 0.43 1.51 -1.26 -5.00 117.35 120.01 1qpp s TYR 186 Ca 0.58 -0.06 0.08 0.00 -1.01 0.00 0.00 57.07 56.66 1qpp s TYR 186 Cb -0.22 -1.65 0.43 0.00 -0.11 0.00 0.00 41.96 40.40 1qpp s TYR 186 CO 0.19 0.29 1.67 -0.97 -1.11 0.00 0.00 175.55 175.62 1qpp h ASN 187 N 5.10 0.15 -3.05 2.29 -0.00 -1.95 -3.35 115.58 114.76 1qpp h ASN 187 Ca -0.48 -0.07 -0.59 0.00 -0.00 0.00 0.00 56.30 55.16 1qpp h ASN 187 Cb 1.16 -0.04 -0.40 0.00 -0.00 0.00 0.00 38.32 39.05 1qpp h ASN 187 CO 0.52 0.63 -0.78 -0.89 -0.00 0.00 0.00 177.43 176.90 1qpp s THR 188 N -3.93 0.73 0.01 -3.57 2.01 -1.26 -4.71 115.64 104.92 1qpp s THR 188 Ca -0.03 -1.91 -0.30 0.00 0.31 0.00 0.00 61.69 59.75 1qpp s THR 188 Cb 0.13 -1.53 -0.03 0.00 0.01 0.00 0.00 72.50 71.07 1qpp s THR 188 CO 0.77 -0.88 1.00 -2.16 -0.69 0.00 0.00 174.62 172.66 1qpp s PRO 189 N 0.96 4.55 0.01 4.92 0.04 -1.26 -4.48 135.00 139.74 1qpp s PRO 189 Ca 0.16 1.46 0.05 0.00 0.04 0.00 0.00 61.00 62.71 1qpp s PRO 189 Cb -0.22 -3.44 -0.03 0.00 0.04 0.00 0.00 34.50 30.84 1qpp s PRO 189 CO -0.06 -0.06 -0.13 0.71 0.04 0.00 0.00 177.00 177.50 1qpp s TYR 190 N 0.97 2.72 -0.03 0.56 1.51 0.10 -1.74 117.35 121.44 1qpp s TYR 190 Ca 0.52 -0.15 0.02 0.00 -1.01 0.00 0.00 57.07 56.46 1qpp s TYR 190 Cb -0.22 -1.56 0.01 0.00 -0.11 0.00 0.00 41.96 40.08 1qpp s TYR 190 CO 0.28 0.28 -0.08 -1.17 -1.11 0.00 0.00 175.55 173.76 1qpp s LEU 191 N -1.27 1.73 -0.05 -1.29 0.20 -0.91 -0.93 118.68 116.17 1qpp s LEU 191 Ca 0.15 -0.16 0.03 0.00 0.69 0.00 0.00 54.13 54.83 1qpp s LEU 191 Cb -0.11 -0.49 -0.03 0.00 -0.43 0.00 0.00 46.19 45.14 1qpp s LEU 191 CO 0.05 0.04 -0.11 -0.55 -0.29 0.00 0.00 176.35 175.49 1qpp s SER 192 N 0.29 4.28 0.08 3.68 0.15 0.13 -0.48 113.70 121.83 1qpp s SER 192 Ca -0.04 -0.14 -0.01 0.00 0.70 0.00 0.00 55.95 56.46 1qpp s SER 192 Cb -0.09 -0.96 -0.04 0.00 -1.71 0.00 0.00 66.02 63.22 1qpp s SER 192 CO 0.00 0.34 -0.01 -0.72 1.20 0.00 0.00 173.24 174.06 1qpp s TYR 193 N -0.79 0.69 -0.21 3.44 1.13 -1.08 -1.15 117.35 119.39 1qpp s TYR 193 Ca 0.12 -1.09 -0.17 0.00 -1.41 0.00 0.00 57.07 54.52 1qpp s TYR 193 Cb -0.11 -0.44 -0.04 0.00 -1.10 0.00 0.00 41.96 40.27 1qpp s TYR 193 CO 0.02 -0.38 0.46 0.42 -2.51 0.00 0.00 175.55 173.55 1qpp s ILE 194 N -3.91 5.15 0.57 -3.49 1.01 -0.89 -3.19 121.20 116.45 1qpp s ILE 194 Ca 0.13 0.82 0.02 0.00 0.00 0.00 0.00 60.65 61.62 1qpp s ILE 194 Cb 0.07 -3.78 0.05 0.00 0.01 0.00 0.00 42.46 38.81 1qpp s ILE 194 CO -0.06 0.20 0.80 0.54 0.00 0.00 0.00 174.94 176.43 1qpp s ASN 195 N 1.16 5.13 0.32 3.58 2.20 -1.01 -4.53 114.94 121.79 1qpp s ASN 195 Ca 0.21 -0.14 0.08 0.00 -0.94 0.00 0.00 52.86 52.08 1qpp s ASN 195 Cb -0.15 -0.65 0.82 0.00 -2.00 0.00 0.00 41.25 39.26 1qpp s ASN 195 CO 0.09 -1.25 1.78 0.44 -2.94 0.00 0.00 177.10 175.21 1qpp h ASP 196 N 0.01 0.71 0.65 3.54 3.32 -1.98 -1.32 116.42 121.34 1qpp h ASP 196 Ca -0.40 0.10 0.00 0.00 0.02 0.00 0.00 57.03 56.74 1qpp h ASP 196 Cb 1.29 -0.03 0.00 0.00 0.22 0.00 0.00 39.33 40.81 1qpp h ASP 196 CO 0.49 0.23 0.00 -1.22 -1.72 0.00 0.00 179.24 177.02 1qpp n TYR 197 N -4.74 0.00 0.00 4.55 4.01 -1.26 -4.86 117.16 114.85 1qpp n TYR 197 Ca 0.24 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.98 1qpp n TYR 197 Cb 0.63 -0.40 0.00 0.00 -0.31 0.00 0.00 39.34 39.26 1qpp n TYR 197 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1qpp n GLY 198 N 0.88 0.76 3.40 2.72 0.00 -0.50 -4.98 105.19 107.48 1qpp n GLY 198 Ca 0.09 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.82 1qpp n GLY 198 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1qpp n GLY 199 N -1.46 -2.36 2.21 -0.02 0.00 -1.26 -4.76 105.19 97.54 1qpp n GLY 199 Ca 0.00 -1.18 -0.24 0.00 0.00 0.00 0.00 46.02 44.60 1qpp n GLY 199 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1qpp n ARG 200 N -4.59 0.84 -0.64 1.61 1.74 -1.26 -2.41 116.66 111.95 1qpp n ARG 200 Ca 0.03 -3.32 -0.29 0.00 -0.77 0.00 0.00 57.85 53.50 1qpp n ARG 200 Cb 0.56 -1.31 0.23 0.00 -1.02 0.00 0.00 32.46 30.92 1qpp n ARG 200 CO 0.00 0.00 0.00 -2.14 -1.52 0.00 0.00 177.63 173.97 1qpp s PRO 201 N -1.36 -0.46 0.04 5.56 0.02 -1.19 -4.77 135.00 132.84 1qpp s PRO 201 Ca 0.36 0.92 0.04 0.00 0.02 0.00 0.00 61.00 62.34 1qpp s PRO 201 Cb 0.18 -1.60 -0.02 0.00 0.02 0.00 0.00 34.50 33.08 1qpp s PRO 201 CO -0.10 -3.44 -0.12 0.08 -0.33 0.00 0.00 177.00 173.09 1qpp s VAL 202 N -2.55 0.94 0.20 3.83 1.01 -1.26 -2.62 120.40 119.95 1qpp s VAL 202 Ca 0.68 -0.98 0.11 0.00 0.00 0.00 0.00 61.98 61.78 1qpp s VAL 202 Cb -0.24 -0.88 -0.04 0.00 0.00 0.00 0.00 36.38 35.22 1qpp s VAL 202 CO 0.63 -0.09 -0.18 -0.76 0.00 0.00 0.00 175.10 174.70 1qpp s LEU 203 N -1.21 2.66 -0.18 3.92 1.43 0.37 -4.95 118.68 120.72 1qpp s LEU 203 Ca -0.01 -0.78 -0.02 0.00 -1.03 0.00 0.00 54.13 52.29 1qpp s LEU 203 Cb -0.08 -1.34 -0.01 0.00 0.03 0.00 0.00 46.19 44.79 1qpp s LEU 203 CO 0.01 0.10 -0.10 -0.94 0.23 0.00 0.00 176.35 175.65 1qpp s SER 204 N -2.84 4.01 -0.11 2.29 1.04 -1.26 -2.14 113.70 114.69 1qpp s SER 204 Ca 0.23 -0.41 -0.06 0.00 0.48 0.00 0.00 55.95 56.19 1qpp s SER 204 Cb -0.08 -1.65 -0.04 0.00 0.10 0.00 0.00 66.02 64.35 1qpp s SER 204 CO 0.12 0.05 0.12 -0.36 0.98 0.00 0.00 173.24 174.16 1qpp s PHE 205 N 1.05 3.54 -0.29 5.02 0.40 -0.71 -4.32 117.98 122.67 1qpp s PHE 205 Ca -0.00 0.48 -0.03 0.00 -0.60 0.00 0.00 56.93 56.77 1qpp s PHE 205 Cb -0.15 -1.91 0.03 0.00 0.51 0.00 0.00 43.02 41.50 1qpp s PHE 205 CO -0.02 0.70 0.01 0.42 0.70 0.00 0.00 175.22 177.03 1qpp s ILE 206 N -1.02 3.24 -0.30 0.64 1.09 -0.29 -4.28 121.20 120.27 1qpp s ILE 206 Ca 0.15 -1.12 -0.13 0.00 -1.10 0.00 0.00 60.65 58.45 1qpp s ILE 206 Cb -0.12 -2.76 -0.03 0.00 -1.06 0.00 0.00 42.46 38.49 1qpp s ILE 206 CO 0.04 0.01 0.30 0.00 -0.10 0.00 0.00 174.94 175.19 1qpp n ASN 208 N 5.23 5.01 0.00 0.00 3.02 -0.95 -4.93 115.26 122.64 1qpp n ASN 208 Ca -0.11 -3.09 0.00 0.00 -0.03 0.00 0.00 54.58 51.35 1qpp n ASN 208 Cb 0.51 -1.24 0.00 0.00 -0.61 0.00 0.00 39.78 38.44 1qpp n ASN 208 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1qpp n GLY 209 N 2.47 1.38 0.01 7.41 0.00 -1.26 -3.83 105.19 111.37 1qpp n GLY 209 Ca 0.23 -0.61 0.07 0.00 0.00 0.00 0.00 46.02 45.71 1qpp n GLY 209 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1qpp n SER 210 N 5.41 0.71 -4.62 1.61 7.64 -1.26 -4.93 113.62 118.18 1qpp n SER 210 Ca 0.00 -0.86 -0.35 0.00 1.01 0.00 0.00 58.87 58.67 1qpp n SER 210 Cb 0.00 0.99 -0.10 0.00 -1.01 0.00 0.00 64.21 64.09 1qpp n SER 210 CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 1qpp s ARG 211 N -2.38 3.98 0.08 1.43 3.00 -1.25 -1.66 118.95 122.15 1qpp s ARG 211 Ca 0.06 -0.33 0.07 0.00 0.00 0.00 0.00 55.73 55.53 1qpp s ARG 211 Cb 0.11 -3.35 -0.04 0.00 0.00 0.00 0.00 34.95 31.67 1qpp s ARG 211 CO 0.60 0.14 -0.16 0.00 0.00 0.00 0.00 175.30 175.88 1qpp s SER 213 N -1.85 -0.10 0.00 0.00 1.04 -1.03 -2.05 113.70 109.71 1qpp s SER 213 Ca 0.17 -0.82 0.12 0.00 0.48 0.00 0.00 55.95 55.90 1qpp s SER 213 Cb -0.11 0.55 0.71 0.00 0.10 0.00 0.00 66.02 67.28 1qpp s SER 213 CO 0.09 -1.07 1.14 0.55 0.98 0.00 0.00 173.24 174.93