#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1y00 s LEU 2 N 0.00 2.66 -0.51 -0.89 1.02 -1.26 -5.08 118.68 114.62 1y00 s LEU 2 Ca 0.00 -0.94 -0.20 0.00 0.02 0.00 0.00 54.13 53.01 1y00 s LEU 2 Cb 0.00 -1.51 0.05 0.00 0.02 0.00 0.00 46.19 44.75 1y00 s LEU 2 CO 0.00 -0.08 0.67 -0.63 0.02 0.00 0.00 176.35 176.34 1y00 s ILE 3 N 1.22 4.80 0.22 -0.59 -1.09 -1.26 -5.04 121.20 119.47 1y00 s ILE 3 Ca -0.00 -0.36 0.10 0.00 -2.23 0.00 0.00 60.65 58.16 1y00 s ILE 3 Cb -0.16 -4.33 -0.04 0.00 -1.58 0.00 0.00 42.46 36.35 1y00 s ILE 3 CO -0.10 -0.84 -0.14 -0.76 -1.23 0.00 0.00 174.94 171.87 1y00 s LEU 4 N 2.83 2.80 -0.13 2.97 2.01 -1.26 -5.13 118.68 122.77 1y00 s LEU 4 Ca 0.18 -0.77 -0.12 0.00 0.01 0.00 0.00 54.13 53.43 1y00 s LEU 4 Cb -0.18 -1.42 -0.05 0.00 0.01 0.00 0.00 46.19 44.55 1y00 s LEU 4 CO 0.13 0.07 0.26 -0.89 1.01 0.00 0.00 176.35 176.93 1y00 s THR 5 N -2.01 5.32 -0.05 5.49 2.01 -1.26 -5.08 115.64 120.06 1y00 s THR 5 Ca 0.26 0.48 -0.17 0.00 0.31 0.00 0.00 61.69 62.57 1y00 s THR 5 Cb -0.07 -3.58 0.03 0.00 0.01 0.00 0.00 72.50 68.90 1y00 s THR 5 CO 0.15 0.47 0.38 -0.13 -0.69 0.00 0.00 174.62 174.80 1y00 s ARG 6 N -0.09 0.69 0.00 4.92 3.00 -1.26 -5.00 118.95 121.21 1y00 s ARG 6 Ca 0.16 0.02 0.00 0.00 0.00 0.00 0.00 55.73 55.91 1y00 s ARG 6 Cb -0.13 0.31 0.00 0.00 0.00 0.00 0.00 34.95 35.13 1y00 s ARG 6 CO 0.05 -0.18 0.00 -2.13 0.00 0.00 0.00 175.30 173.03 1y00 n ARG 7 N 1.52 0.00 0.01 3.54 0.63 -1.26 -4.68 116.66 116.42 1y00 n ARG 7 Ca -0.20 0.00 -0.03 0.00 -0.92 0.00 0.00 57.85 56.70 1y00 n ARG 7 Cb 0.56 0.00 -0.01 0.00 0.45 0.00 0.00 32.46 33.46 1y00 n ARG 7 CO 0.00 0.00 0.00 0.28 -2.51 0.00 0.00 177.63 175.40 1y00 n VAL 8 N 0.00 1.03 0.00 5.15 0.31 -1.26 -3.60 118.33 119.96 1y00 n VAL 8 Ca 0.00 0.23 0.00 0.00 -0.01 0.00 0.00 64.34 64.56 1y00 n VAL 8 Cb 0.00 -1.71 0.00 0.00 -0.91 0.00 0.00 33.84 31.22 1y00 n VAL 8 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1y00 n GLY 9 N 2.94 -1.72 0.00 2.92 0.00 -1.26 -4.90 105.19 103.18 1y00 n GLY 9 Ca -0.05 1.01 0.00 0.00 0.00 0.00 0.00 46.02 46.98 1y00 n GLY 9 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1y00 n GLU 10 N 0.00 0.00 -1.57 1.61 0.00 -1.26 -5.11 120.64 114.30 1y00 n GLU 10 Ca 0.00 0.07 -0.01 0.00 0.00 0.00 0.00 57.16 57.23 1y00 n GLU 10 Cb 0.00 -0.55 -0.01 0.00 0.00 0.00 0.00 31.44 30.88 1y00 n GLU 10 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.13 179.54 1y00 n THR 11 N -2.36 -4.86 -4.16 6.31 -1.04 -1.26 -5.06 114.28 101.85 1y00 n THR 11 Ca 0.00 0.62 -0.27 0.00 -2.04 0.00 0.00 64.05 62.36 1y00 n THR 11 Cb 0.00 -3.97 -0.07 0.00 -1.82 0.00 0.00 70.33 64.47 1y00 n THR 11 CO 0.00 0.00 0.00 -1.48 -0.64 0.00 0.00 175.07 172.95 1y00 s LEU 12 N -0.13 3.49 -0.31 -4.42 2.34 -1.07 -4.90 118.68 113.68 1y00 s LEU 12 Ca -0.04 -0.29 0.01 0.00 0.06 0.00 0.00 54.13 53.87 1y00 s LEU 12 Cb 0.00 -2.13 0.10 0.00 -0.56 0.00 0.00 46.19 43.60 1y00 s LEU 12 CO 0.11 0.09 0.08 -0.32 -1.06 0.00 0.00 176.35 175.24 1y00 s MET 13 N -2.96 0.98 -0.19 1.48 -2.45 -1.26 -1.56 119.30 113.33 1y00 s MET 13 Ca 0.29 -1.30 -0.03 0.00 -1.25 0.00 0.00 55.69 53.39 1y00 s MET 13 Cb -0.10 -2.38 -0.01 0.00 1.25 0.00 0.00 34.83 33.59 1y00 s MET 13 CO 0.20 -0.95 -0.07 -1.50 1.05 0.00 0.00 175.02 173.75 1y00 s ILE 14 N 1.39 3.24 0.00 10.11 1.10 -1.26 -4.90 121.20 130.89 1y00 s ILE 14 Ca 0.09 -0.55 0.00 0.00 -0.51 0.00 0.00 60.65 59.68 1y00 s ILE 14 Cb -0.18 -2.44 0.00 0.00 0.15 0.00 0.00 42.46 39.99 1y00 s ILE 14 CO -0.19 0.46 0.00 0.61 -2.11 0.00 0.00 174.94 173.71 1y00 n GLY 15 N 4.41 1.02 0.08 1.50 0.00 -1.26 -4.67 105.19 106.27 1y00 n GLY 15 Ca -0.18 -0.56 0.00 0.00 0.00 0.00 0.00 46.02 45.28 1y00 n GLY 15 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1y00 n ASP 16 N 0.00 0.00 0.00 1.61 2.03 -1.26 -5.01 116.55 113.92 1y00 n ASP 16 Ca 0.00 -1.00 0.00 0.00 0.52 0.00 0.00 54.79 54.31 1y00 n ASP 16 Cb 0.00 -0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.40 1y00 n ASP 16 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 1y00 n GLU 17 N 0.00 0.00 0.00 -0.67 -0.58 -1.26 -5.14 120.64 112.99 1y00 n GLU 17 Ca 0.00 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.74 1y00 n GLU 17 Cb 0.50 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 31.37 1y00 n GLU 17 CO 0.00 0.00 0.00 1.33 -0.48 0.00 0.00 177.13 177.98 1y00 n VAL 18 N 0.00 0.00 0.00 2.62 0.24 -1.26 -4.36 118.33 115.57 1y00 n VAL 18 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.30 1y00 n VAL 18 Cb 0.00 -0.04 0.00 0.00 -1.47 0.00 0.00 33.84 32.33 1y00 n VAL 18 CO 0.00 0.00 0.00 0.35 -2.14 0.00 0.00 176.83 175.04 1y00 n THR 19 N 0.00 0.00 -4.07 3.34 -2.24 0.47 -4.84 114.28 106.94 1y00 n THR 19 Ca 0.00 0.00 -0.32 0.00 -2.27 0.00 0.00 64.05 61.46 1y00 n THR 19 Cb 0.00 0.00 -0.15 0.00 -2.10 0.00 0.00 70.33 68.08 1y00 n THR 19 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 1y00 s VAL 20 N 0.00 2.20 -0.38 2.28 1.01 -0.60 -0.33 120.40 124.57 1y00 s VAL 20 Ca 0.00 -1.54 -0.19 0.00 0.00 0.00 0.00 61.98 60.25 1y00 s VAL 20 Cb 0.00 -2.25 0.01 0.00 0.00 0.00 0.00 36.38 34.14 1y00 s VAL 20 CO 0.00 0.04 0.55 -0.89 0.00 0.00 0.00 175.10 174.79 1y00 s THR 21 N 1.13 4.96 -1.45 3.92 2.01 0.63 -2.59 115.64 124.25 1y00 s THR 21 Ca -0.07 0.22 -0.09 0.00 0.31 0.00 0.00 61.69 62.06 1y00 s THR 21 Cb -0.19 -4.05 0.04 0.00 0.01 0.00 0.00 72.50 68.31 1y00 s THR 21 CO -0.06 -0.35 2.51 1.33 -0.69 0.00 0.00 174.62 177.36 1y00 n VAL 22 N 5.55 4.51 -1.70 3.82 0.24 -1.26 -1.37 118.33 128.12 1y00 n VAL 22 Ca -0.04 -3.48 -0.60 0.00 -2.04 0.00 0.00 64.34 58.18 1y00 n VAL 22 Cb 0.48 -2.40 -0.08 0.00 -1.47 0.00 0.00 33.84 30.38 1y00 n VAL 22 CO 0.00 0.00 0.00 -0.11 -2.14 0.00 0.00 176.83 174.58 1y00 n LEU 23 N 3.37 1.83 -0.00 1.34 -0.00 -1.26 -4.39 117.00 117.89 1y00 n LEU 23 Ca 0.64 1.12 0.11 0.00 -0.00 0.00 0.00 56.01 57.87 1y00 n LEU 23 Cb 0.28 -1.06 -0.14 0.00 -0.00 0.00 0.00 43.42 42.50 1y00 n LEU 23 CO 0.80 -0.71 -0.42 0.61 -0.00 0.00 0.00 177.39 177.67 1y00 n GLY 24 N 3.78 -1.02 3.68 -3.96 0.00 -1.24 -4.36 105.19 102.08 1y00 n GLY 24 Ca 0.26 -0.54 -0.41 0.00 0.00 0.00 0.00 46.02 45.34 1y00 n GLY 24 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1y00 s VAL 25 N -3.29 4.95 0.00 1.61 1.01 -1.24 -4.95 120.40 118.49 1y00 s VAL 25 Ca -0.01 1.54 0.00 0.00 0.00 0.00 0.00 61.98 63.51 1y00 s VAL 25 Cb 0.15 -4.09 0.00 0.00 0.00 0.00 0.00 36.38 32.44 1y00 s VAL 25 CO 0.89 0.11 0.00 1.17 0.00 0.00 0.00 175.10 177.27 1y00 n LYS 26 N 4.71 0.00 -3.05 2.72 3.00 -1.26 -4.57 118.16 119.71 1y00 n LYS 26 Ca 0.02 0.00 -0.43 0.00 -0.00 0.00 0.00 58.31 57.90 1y00 n LYS 26 Cb 0.50 0.00 -0.06 0.00 0.00 0.00 0.00 35.03 35.47 1y00 n LYS 26 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.40 177.60 1y00 s GLY 27 N 0.00 1.66 0.00 3.14 0.00 -1.26 -4.72 107.32 106.14 1y00 s GLY 27 Ca 0.00 -1.29 0.00 0.00 0.00 0.00 0.00 44.72 43.43 1y00 s GLY 27 CO 0.00 1.64 0.00 0.70 0.00 0.00 0.00 173.10 175.44 1y00 n ASN 28 N 6.50 0.00 -4.76 1.64 4.13 -1.26 -4.74 115.26 116.77 1y00 n ASN 28 Ca -0.01 0.00 -0.40 0.00 1.68 0.00 0.00 54.58 55.85 1y00 n ASN 28 Cb 0.47 0.00 -0.05 0.00 -1.54 0.00 0.00 39.78 38.66 1y00 n ASN 28 CO 0.00 0.00 0.00 -1.10 0.28 0.00 0.00 177.26 176.44 1y00 s GLN 29 N 0.00 4.50 -0.27 3.52 -0.21 -1.26 -5.04 119.66 120.91 1y00 s GLN 29 Ca 0.00 1.07 -0.17 0.00 0.02 0.00 0.00 55.36 56.28 1y00 s GLN 29 Cb 0.00 -3.32 -0.03 0.00 1.00 0.00 0.00 33.01 30.66 1y00 s GLN 29 CO 0.00 0.39 0.49 0.08 -2.12 0.00 0.00 175.29 174.14 1y00 s VAL 30 N -0.46 5.08 -0.76 1.09 1.01 -1.26 -4.64 120.40 120.46 1y00 s VAL 30 Ca 0.37 0.80 -0.25 0.00 0.00 0.00 0.00 61.98 62.90 1y00 s VAL 30 Cb -0.21 -3.81 0.05 0.00 0.00 0.00 0.00 36.38 32.40 1y00 s VAL 30 CO 0.24 0.08 1.20 -0.13 0.00 0.00 0.00 175.10 176.49 1y00 s ARG 31 N 2.28 3.24 -0.16 2.72 0.52 -1.26 -4.99 118.95 121.29 1y00 s ARG 31 Ca 0.20 -0.61 -0.17 0.00 -0.52 0.00 0.00 55.73 54.63 1y00 s ARG 31 Cb -0.16 -4.38 -0.04 0.00 0.52 0.00 0.00 34.95 30.89 1y00 s ARG 31 CO 0.10 -2.04 0.44 0.42 0.02 0.00 0.00 175.30 174.23 1y00 s ILE 32 N 4.99 5.19 -0.36 1.52 -1.09 -1.26 -4.14 121.20 126.05 1y00 s ILE 32 Ca 0.32 0.83 -0.11 0.00 -2.23 0.00 0.00 60.65 59.46 1y00 s ILE 32 Cb -0.09 -3.77 0.01 0.00 -1.58 0.00 0.00 42.46 37.02 1y00 s ILE 32 CO 0.09 0.29 0.21 -0.83 -1.23 0.00 0.00 174.94 173.47 1y00 s GLY 33 N 0.82 1.93 -0.43 6.18 0.00 -0.47 -4.95 107.32 110.39 1y00 s GLY 33 Ca 0.22 -1.58 -0.10 0.00 0.00 0.00 0.00 44.72 43.27 1y00 s GLY 33 CO 0.09 0.81 0.29 0.14 0.00 0.00 0.00 173.10 174.42 1y00 s VAL 34 N 1.61 4.28 -0.45 1.40 1.01 -1.26 -0.27 120.40 126.72 1y00 s VAL 34 Ca 0.04 -1.48 -0.16 0.00 0.00 0.00 0.00 61.98 60.38 1y00 s VAL 34 Cb -0.18 -3.67 0.05 0.00 0.00 0.00 0.00 36.38 32.58 1y00 s VAL 34 CO 0.08 -0.58 0.42 0.21 0.00 0.00 0.00 175.10 175.23 1y00 s ASN 35 N 2.28 6.16 0.02 3.32 3.04 0.55 -4.97 114.94 125.35 1y00 s ASN 35 Ca 0.04 -1.03 0.01 0.00 0.04 0.00 0.00 52.86 51.92 1y00 s ASN 35 Cb -0.24 -2.20 -0.01 0.00 -1.54 0.00 0.00 41.25 37.25 1y00 s ASN 35 CO 0.02 -0.63 -0.05 0.00 -3.04 0.00 0.00 177.10 173.39 1y00 s ALA 36 N 1.92 0.39 0.48 1.71 0.00 -1.26 -0.39 121.76 124.60 1y00 s ALA 36 Ca 0.08 -0.50 -0.12 0.00 0.00 0.00 0.00 51.96 51.42 1y00 s ALA 36 Cb -0.21 0.01 -0.06 0.00 0.00 0.00 0.00 23.12 22.87 1y00 s ALA 36 CO 0.10 -0.01 0.88 -1.25 0.00 0.00 0.00 175.76 175.48 1y00 s PRO 37 N -0.97 3.77 0.00 0.00 0.04 -1.26 -4.97 135.00 131.61 1y00 s PRO 37 Ca -0.07 0.63 0.28 0.00 0.04 0.00 0.00 61.00 61.88 1y00 s PRO 37 Cb -0.07 -2.26 1.54 0.00 0.04 0.00 0.00 34.50 33.75 1y00 s PRO 37 CO -0.00 -0.22 2.00 0.36 0.04 0.00 0.00 177.00 179.18 1y00 n LYS 38 N -1.75 0.61 -0.08 4.56 2.85 -1.26 -3.53 118.16 119.57 1y00 n LYS 38 Ca 0.04 0.01 -0.14 0.00 -1.05 0.00 0.00 58.31 57.18 1y00 n LYS 38 Cb 0.54 -1.50 -0.05 0.00 -0.65 0.00 0.00 35.03 33.37 1y00 n LYS 38 CO 0.00 0.00 0.00 1.49 -0.05 0.00 0.00 177.40 178.84 1y00 h GLU 39 N 0.00 0.68 -6.50 -1.58 4.81 -1.98 -3.45 114.58 106.56 1y00 h GLU 39 Ca 0.00 -0.39 -0.52 0.00 -0.13 0.00 0.00 59.36 58.31 1y00 h GLU 39 Cb 0.15 0.03 -0.02 0.00 0.63 0.00 0.00 28.75 29.54 1y00 h GLU 39 CO 0.00 1.01 -0.10 0.08 -0.73 0.00 0.00 179.01 179.26 1y00 s VAL 40 N -4.22 4.96 -0.53 0.32 1.01 -1.23 -5.02 120.40 115.68 1y00 s VAL 40 Ca -0.12 0.30 -0.28 0.00 0.00 0.00 0.00 61.98 61.88 1y00 s VAL 40 Cb 0.08 -3.68 0.01 0.00 0.00 0.00 0.00 36.38 32.80 1y00 s VAL 40 CO 0.83 -0.23 1.41 -0.55 0.00 0.00 0.00 175.10 176.57 1y00 s SER 41 N -2.79 6.17 -0.17 3.32 0.15 -1.26 -4.92 113.70 114.19 1y00 s SER 41 Ca 0.46 0.39 0.01 0.00 0.70 0.00 0.00 55.95 57.51 1y00 s SER 41 Cb -0.11 -2.54 0.02 0.00 -1.71 0.00 0.00 66.02 61.68 1y00 s SER 41 CO 0.26 -1.65 -0.19 0.54 1.20 0.00 0.00 173.24 173.40 1y00 s VAL 42 N 5.94 1.94 -0.04 4.45 0.11 -1.26 -5.11 120.40 126.43 1y00 s VAL 42 Ca 0.54 -0.87 0.03 0.00 -2.93 0.00 0.00 61.98 58.75 1y00 s VAL 42 Cb -0.11 -1.77 0.00 0.00 -1.53 0.00 0.00 36.38 32.97 1y00 s VAL 42 CO 0.27 0.52 -0.13 -1.00 -3.33 0.00 0.00 175.10 171.42 1y00 s HIS 43 N 1.32 1.40 0.00 1.54 3.76 -1.26 -4.98 115.29 117.06 1y00 s HIS 43 Ca 0.04 -0.41 0.00 0.00 -0.15 0.00 0.00 55.06 54.54 1y00 s HIS 43 Cb -0.13 -0.98 0.00 0.00 1.11 0.00 0.00 32.58 32.58 1y00 s HIS 43 CO -0.12 -0.17 0.00 2.89 -0.85 0.00 0.00 174.74 176.49 1y00 n ARG 44 N 3.34 0.00 -3.63 1.40 1.85 -1.26 -5.13 116.66 113.23 1y00 n ARG 44 Ca -0.19 0.00 -0.03 0.00 -1.00 0.00 0.00 57.85 56.63 1y00 n ARG 44 Cb 0.53 -0.01 -0.05 0.00 -1.05 0.00 0.00 32.46 31.88 1y00 n ARG 44 CO 0.00 0.00 0.00 -1.21 -0.01 0.00 0.00 177.63 176.41 1y00 s GLU 45 N -1.96 0.60 0.08 2.89 0.41 -1.26 -5.05 118.70 114.42 1y00 s GLU 45 Ca 0.00 1.27 -0.35 0.00 -0.41 0.00 0.00 54.97 55.48 1y00 s GLU 45 Cb 0.00 0.51 -0.17 0.00 -1.78 0.00 0.00 34.13 32.69 1y00 s GLU 45 CO 0.00 -0.17 1.58 0.93 -0.49 0.00 0.00 175.26 177.11 1y00 h GLU 46 N 7.46 -0.98 -0.78 1.61 4.39 -2.00 -2.72 114.58 121.55 1y00 h GLU 46 Ca -0.23 0.07 0.04 0.00 0.34 0.00 0.00 59.36 59.58 1y00 h GLU 46 Cb 1.16 0.22 -0.05 0.00 -0.10 0.00 0.00 28.75 29.98 1y00 h GLU 46 CO 0.13 -0.66 0.49 0.97 -1.16 0.00 0.00 179.01 178.78 1y00 h ILE 47 N -1.02 1.08 -0.61 3.13 2.10 -1.97 0.10 117.51 120.32 1y00 h ILE 47 Ca -0.07 -0.32 0.08 0.00 1.08 0.00 0.00 64.86 65.63 1y00 h ILE 47 Cb 0.86 0.07 -0.10 0.00 -1.09 0.00 0.00 36.82 36.56 1y00 h ILE 47 CO 0.00 0.17 -0.50 1.88 -1.08 0.00 0.00 178.15 178.63 1y00 h TYR 48 N 0.93 -1.50 0.00 2.19 -1.99 -1.91 0.31 116.97 114.99 1y00 h TYR 48 Ca 0.32 0.09 -0.03 0.00 2.00 0.00 0.00 58.73 61.12 1y00 h TYR 48 Cb 0.07 0.74 -0.00 0.00 2.00 0.00 0.00 36.73 39.54 1y00 h TYR 48 CO -0.04 -0.44 -0.14 -0.56 -0.00 0.00 0.00 178.16 176.99 1y00 h GLN 49 N -0.23 0.00 0.00 4.88 3.07 -1.27 -2.33 115.11 119.22 1y00 h GLN 49 Ca 0.15 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.89 1y00 h GLN 49 Cb 0.55 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.11 1y00 h GLN 49 CO -0.71 0.14 0.00 -0.09 0.09 0.00 0.00 178.83 178.25 1y00 h ARG 50 N 0.00 0.00 0.00 0.06 9.65 0.22 0.70 114.38 125.01 1y00 h ARG 50 Ca -0.00 0.00 -0.05 0.00 -1.10 0.00 0.00 59.98 58.83 1y00 h ARG 50 Cb 0.94 0.00 -0.01 0.00 -1.39 0.00 0.00 29.97 29.51 1y00 h ARG 50 CO 0.02 0.00 -1.25 -0.89 2.80 0.00 0.00 179.97 180.65 1y00 n ILE 51 N -2.30 0.18 -0.08 1.20 2.08 -0.34 -4.41 119.36 115.69 1y00 n ILE 51 Ca 0.01 -0.14 -0.10 0.00 0.56 0.00 0.00 62.75 63.07 1y00 n ILE 51 Cb 0.18 -0.43 -0.03 0.00 -0.75 0.00 0.00 39.64 38.61 1y00 n ILE 51 CO 0.00 0.00 0.00 1.67 0.56 0.00 0.00 176.55 178.78 1y00 n GLN 52 N -1.97 0.47 0.31 0.38 -0.06 -0.89 -4.40 117.38 111.21 1y00 n GLN 52 Ca -0.04 0.19 -0.12 0.00 -2.00 0.00 0.00 57.00 55.03 1y00 n GLN 52 Cb 0.45 -1.32 -0.06 0.00 -4.06 0.00 0.00 30.24 25.25 1y00 n GLN 52 CO 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 177.06 176.86 1y00 h ALA 53 N -0.87 -1.17 -3.04 1.69 0.00 -0.83 -3.38 119.26 111.66 1y00 h ALA 53 Ca -0.08 -0.17 -0.67 0.00 0.00 0.00 0.00 54.91 53.99 1y00 h ALA 53 Cb 0.96 0.30 -0.27 0.00 0.00 0.00 0.00 17.79 18.78 1y00 h ALA 53 CO -0.05 -1.11 -0.65 -1.83 0.00 0.00 0.00 179.25 175.60 1y00 s GLU 54 N -4.63 3.17 0.00 0.00 1.03 0.21 -4.49 118.70 113.99 1y00 s GLU 54 Ca -0.11 -0.79 0.00 0.00 0.03 0.00 0.00 54.97 54.09 1y00 s GLU 54 Cb 0.01 -3.26 0.00 0.00 -0.80 0.00 0.00 34.13 30.08 1y00 s GLU 54 CO 0.34 -0.37 0.00 1.63 -1.33 0.00 0.00 175.26 175.53 1y00 n LYS 55 N 4.83 0.00 -1.14 -4.83 5.02 -1.26 -3.54 118.16 117.24 1y00 n LYS 55 Ca -0.16 0.00 0.15 0.00 -2.02 0.00 0.00 58.31 56.29 1y00 n LYS 55 Cb 0.49 0.00 -0.04 0.00 -0.02 0.00 0.00 35.03 35.45 1y00 n LYS 55 CO 0.00 0.00 0.00 0.43 -0.52 0.00 0.00 177.40 177.31 1y00 n SER 56 N 0.00 -6.77 0.01 4.39 7.64 -1.26 -5.04 113.62 112.59 1y00 n SER 56 Ca 0.00 0.56 0.00 0.00 1.01 0.00 0.00 58.87 60.44 1y00 n SER 56 Cb 0.00 -3.51 0.00 0.00 -1.01 0.00 0.00 64.21 59.69 1y00 n SER 56 CO 0.00 0.00 0.00 1.67 -3.01 0.00 0.00 175.04 173.70 1y00 n GLN 57 N -3.67 0.00 -2.21 1.43 -0.06 -1.26 -4.96 117.38 106.65 1y00 n GLN 57 Ca -0.00 0.00 -0.10 0.00 -2.00 0.00 0.00 57.00 54.89 1y00 n GLN 57 Cb 0.52 0.00 0.02 0.00 -4.06 0.00 0.00 30.24 26.72 1y00 n GLN 57 CO 0.00 0.00 0.00 1.04 -0.20 0.00 0.00 177.06 177.90 1y00 n GLN 58 N -2.41 0.95 -4.44 3.69 1.13 -1.26 -5.15 117.38 109.89 1y00 n GLN 58 Ca 0.00 -1.52 -0.24 0.00 -1.94 0.00 0.00 57.00 53.31 1y00 n GLN 58 Cb 0.00 0.01 -0.10 0.00 0.11 0.00 0.00 30.24 30.26 1y00 n GLN 58 CO 0.00 0.00 0.00 -1.54 -1.44 0.00 0.00 177.06 174.08 1y00 s SER 59 N -2.60 3.41 -0.12 1.08 1.04 -1.26 -5.14 113.70 110.11 1y00 s SER 59 Ca 0.22 -1.00 -0.02 0.00 0.48 0.00 0.00 55.95 55.64 1y00 s SER 59 Cb -0.02 -0.27 -0.03 0.00 0.10 0.00 0.00 66.02 65.81 1y00 s SER 59 CO 0.14 0.02 -0.06 -0.44 0.98 0.00 0.00 173.24 173.88 1y00 s SER 60 N -3.33 4.64 0.00 7.02 0.01 -1.26 -5.31 113.70 115.48 1y00 s SER 60 Ca 0.27 -0.11 0.00 0.00 1.31 0.00 0.00 55.95 57.42 1y00 s SER 60 Cb -0.05 -1.54 0.00 0.00 0.21 0.00 0.00 66.02 64.64 1y00 s SER 60 CO 0.13 0.24 0.00 0.00 0.41 0.00 0.00 173.24 174.02