#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 2.90 -0.29 -0.89 2.01 -1.26 -5.10 118.68 116.06 1y00 s LEU 2 Ca 0.00 -1.19 -0.08 0.00 0.01 0.00 0.00 54.13 52.87 1y00 s LEU 2 Cb 0.00 -1.39 -0.01 0.00 0.01 0.00 0.00 46.19 44.80 1y00 s LEU 2 CO 0.00 -0.18 0.11 -0.51 1.01 0.00 0.00 176.35 176.78 1y00 s ILE 3 N 1.25 4.32 -0.13 -0.59 2.07 -1.26 -5.07 121.20 121.79 1y00 s ILE 3 Ca -0.06 -0.43 0.01 0.00 -1.41 0.00 0.00 60.65 58.77 1y00 s ILE 3 Cb -0.18 -3.16 0.02 0.00 0.13 0.00 0.00 42.46 39.26 1y00 s ILE 3 CO -0.07 0.15 -0.16 -0.22 -1.91 0.00 0.00 174.94 172.73 1y00 s LEU 4 N 1.58 1.79 -1.13 8.50 2.96 -1.26 -5.04 118.68 126.08 1y00 s LEU 4 Ca 0.05 -0.49 -0.25 0.00 -0.22 0.00 0.00 54.13 53.22 1y00 s LEU 4 Cb -0.16 -1.19 -0.18 0.00 0.50 0.00 0.00 46.19 45.15 1y00 s LEU 4 CO 0.04 0.00 2.05 -0.89 -1.32 0.00 0.00 176.35 176.24 1y00 s THR 5 N 1.13 3.20 0.31 3.68 2.01 -1.26 -4.90 115.64 119.81 1y00 s THR 5 Ca -0.03 -0.35 -0.27 0.00 0.31 0.00 0.00 61.69 61.36 1y00 s THR 5 Cb -0.14 -4.21 -0.10 0.00 0.01 0.00 0.00 72.50 68.06 1y00 s THR 5 CO -0.05 -0.37 0.97 -0.13 -0.69 0.00 0.00 174.62 174.36 1y00 s ARG 6 N 7.80 4.59 0.00 4.92 0.52 -1.26 -4.82 118.95 130.70 1y00 s ARG 6 Ca 0.77 1.44 0.00 0.00 -0.52 0.00 0.00 55.73 57.42 1y00 s ARG 6 Cb -0.03 -2.91 0.00 0.00 0.52 0.00 0.00 34.95 32.53 1y00 s ARG 6 CO 0.17 0.27 0.00 -2.13 0.02 0.00 0.00 175.30 173.63 1y00 n ARG 7 N 0.73 0.00 0.02 3.54 0.00 -1.26 -4.51 116.66 115.19 1y00 n ARG 7 Ca 0.01 0.00 -0.02 0.00 -0.00 0.00 0.00 57.85 57.84 1y00 n ARG 7 Cb 0.49 0.00 -0.01 0.00 0.00 0.00 0.00 32.46 32.94 1y00 n ARG 7 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.63 177.91 1y00 n VAL 8 N 0.00 1.15 -3.15 5.15 0.31 -1.26 -3.64 118.33 116.90 1y00 n VAL 8 Ca 0.00 0.31 0.05 0.00 -0.01 0.00 0.00 64.34 64.69 1y00 n VAL 8 Cb 0.00 -1.70 -0.01 0.00 -0.91 0.00 0.00 33.84 31.22 1y00 n VAL 8 CO 0.00 0.00 0.00 -0.83 -1.32 0.00 0.00 176.83 174.68 1y00 s GLY 9 N -4.27 -0.61 0.00 2.92 0.00 -1.26 -4.96 107.32 99.13 1y00 s GLY 9 Ca -0.05 2.44 0.00 0.00 0.00 0.00 0.00 44.72 47.11 1y00 s GLY 9 CO 0.07 3.93 0.00 1.18 0.00 0.00 0.00 173.10 178.28 1y00 n GLU 10 N 5.33 0.00 -1.99 2.90 4.71 -1.26 -5.13 120.64 125.20 1y00 n GLU 10 Ca 0.00 0.00 -0.02 0.00 -0.01 0.00 0.00 57.16 57.13 1y00 n GLU 10 Cb 0.55 -0.10 -0.02 0.00 -1.01 0.00 0.00 31.44 30.86 1y00 n GLU 10 CO 0.00 0.00 0.00 2.41 0.09 0.00 0.00 177.13 179.63 1y00 n THR 11 N -1.99 -8.25 -4.18 2.62 -1.04 -1.25 -5.03 114.28 95.15 1y00 n THR 11 Ca 0.00 1.54 -0.27 0.00 -2.04 0.00 0.00 64.05 63.28 1y00 n THR 11 Cb 0.00 -5.02 -0.07 0.00 -1.82 0.00 0.00 70.33 63.42 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 -0.34 3.40 -0.32 -4.42 2.34 -1.08 -4.92 118.68 113.33 1y00 s LEU 12 Ca -0.12 -0.35 0.01 0.00 0.06 0.00 0.00 54.13 53.73 1y00 s LEU 12 Cb 0.01 -2.05 0.10 0.00 -0.56 0.00 0.00 46.19 43.69 1y00 s LEU 12 CO 0.32 0.09 0.08 -0.32 -1.06 0.00 0.00 176.35 175.46 1y00 s MET 13 N -2.96 1.02 -0.06 1.48 -2.45 -1.26 -1.70 119.30 113.38 1y00 s MET 13 Ca 0.28 -1.39 0.04 0.00 -1.25 0.00 0.00 55.69 53.37 1y00 s MET 13 Cb -0.09 -2.47 -0.02 0.00 1.25 0.00 0.00 34.83 33.49 1y00 s MET 13 CO 0.19 -0.97 -0.17 -1.50 1.05 0.00 0.00 175.02 173.62 1y00 s ILE 14 N 1.33 2.77 0.00 10.11 -1.16 -1.26 -4.93 121.20 128.06 1y00 s ILE 14 Ca 0.10 -0.82 0.00 0.00 -0.51 0.00 0.00 60.65 59.42 1y00 s ILE 14 Cb -0.18 -2.07 0.00 0.00 0.61 0.00 0.00 42.46 40.82 1y00 s ILE 14 CO -0.18 0.58 0.00 0.61 -2.81 0.00 0.00 174.94 173.13 1y00 n GLY 15 N 2.56 1.41 0.00 1.50 0.00 -1.26 -4.48 105.19 104.93 1y00 n GLY 15 Ca -0.17 -0.92 0.00 0.00 0.00 0.00 0.00 46.02 44.93 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 1.02 -1.26 -5.15 120.64 114.58 1y00 n GLU 17 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 1y00 n GLU 17 Cb 0.44 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.86 1y00 n GLU 17 CO 0.00 0.00 0.00 1.33 1.18 0.00 0.00 177.13 179.64 1y00 n VAL 18 N 0.00 0.00 0.00 2.62 0.24 -1.26 -4.48 118.33 115.44 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 -0.16 0.00 0.00 -1.47 0.00 0.00 33.84 32.21 1y00 n VAL 18 CO 0.00 0.00 0.00 1.07 -2.14 0.00 0.00 176.83 175.76 1y00 n THR 19 N 0.00 0.00 -3.72 3.34 5.66 -0.50 -4.88 114.28 114.18 1y00 n THR 19 Ca 0.00 0.00 -0.38 0.00 -3.05 0.00 0.00 64.05 60.62 1y00 n THR 19 Cb 0.00 0.00 -0.11 0.00 -1.55 0.00 0.00 70.33 68.67 1y00 n THR 19 CO 0.00 0.00 0.00 -0.69 -3.05 0.00 0.00 175.07 171.33 1y00 s VAL 20 N 0.00 3.66 -0.52 1.08 1.01 -0.69 -1.10 120.40 123.84 1y00 s VAL 20 Ca 0.00 -1.64 -0.22 0.00 0.00 0.00 0.00 61.98 60.12 1y00 s VAL 20 Cb 0.00 -3.31 0.04 0.00 0.00 0.00 0.00 36.38 33.11 1y00 s VAL 20 CO 0.00 -0.50 0.81 -0.89 0.00 0.00 0.00 175.10 174.52 1y00 s THR 21 N 1.29 4.59 0.00 3.92 2.01 0.59 -2.65 115.64 125.39 1y00 s THR 21 Ca 0.03 0.05 0.00 0.00 0.31 0.00 0.00 61.69 62.08 1y00 s THR 21 Cb -0.22 -4.42 0.00 0.00 0.01 0.00 0.00 72.50 67.86 1y00 s THR 21 CO -0.01 -0.95 0.00 1.33 -0.69 0.00 0.00 174.62 174.30 1y00 n VAL 22 N 5.99 0.00 -3.64 3.82 0.24 -1.26 -1.34 118.33 122.15 1y00 n VAL 22 Ca -0.01 0.00 -0.06 0.00 -2.04 0.00 0.00 64.34 62.23 1y00 n VAL 22 Cb 0.47 -1.67 -0.07 0.00 -1.47 0.00 0.00 33.84 31.10 1y00 n VAL 22 CO 0.00 0.00 0.00 -0.22 -2.14 0.00 0.00 176.83 174.47 1y00 s LEU 23 N 0.00 -0.24 0.00 1.34 1.98 -1.26 -4.58 118.68 115.91 1y00 s LEU 23 Ca 0.00 0.45 0.00 0.00 -2.89 0.00 0.00 54.13 51.69 1y00 s LEU 23 Cb 0.00 1.49 0.00 0.00 0.66 0.00 0.00 46.19 48.34 1y00 s LEU 23 CO 0.00 -0.10 0.00 0.61 -1.89 0.00 0.00 176.35 174.97 1y00 n GLY 24 N 1.73 0.00 3.72 7.98 0.00 -1.24 -4.80 105.19 112.59 1y00 n GLY 24 Ca -0.11 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.52 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 -1.59 4.99 0.00 1.61 1.01 -1.25 -4.90 120.40 120.27 1y00 s VAL 25 Ca 0.00 1.51 0.00 0.00 0.00 0.00 0.00 61.98 63.49 1y00 s VAL 25 Cb 0.00 -4.07 0.00 0.00 0.00 0.00 0.00 36.38 32.31 1y00 s VAL 25 CO 0.00 0.27 0.00 1.17 0.00 0.00 0.00 175.10 176.54 1y00 n LYS 26 N 3.62 0.00 0.00 2.72 3.00 -1.26 -4.69 118.16 121.55 1y00 n LYS 26 Ca -0.01 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.30 1y00 n LYS 26 Cb 0.51 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.54 1y00 n LYS 26 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1y00 n GLY 27 N -0.35 -1.33 0.10 3.14 0.00 -1.26 -4.70 105.19 100.79 1y00 n GLY 27 Ca 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.92 1y00 n GLY 27 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1y00 n ASN 28 N 0.00 0.50 -4.28 1.61 6.94 -1.26 -4.94 115.26 113.83 1y00 n ASN 28 Ca 0.00 -0.01 -0.31 0.00 -0.02 0.00 0.00 54.58 54.23 1y00 n ASN 28 Cb 0.00 0.84 -0.16 0.00 -2.36 0.00 0.00 39.78 38.10 1y00 n ASN 28 CO 0.00 0.00 0.00 -1.58 -1.03 0.00 0.00 177.26 174.65 1y00 s GLN 29 N -2.46 2.44 -0.15 -3.83 2.00 -1.26 -5.12 119.66 111.27 1y00 s GLN 29 Ca -0.11 -0.91 -0.17 0.00 -2.00 0.00 0.00 55.36 52.17 1y00 s GLN 29 Cb 0.06 -2.14 -0.04 0.00 0.80 0.00 0.00 33.01 31.69 1y00 s GLN 29 CO 0.75 0.43 0.43 0.08 -0.50 0.00 0.00 175.29 176.49 1y00 s VAL 30 N -0.29 5.21 -0.74 1.34 1.01 -1.26 -4.74 120.40 120.92 1y00 s VAL 30 Ca 0.00 0.82 -0.26 0.00 0.00 0.00 0.00 61.98 62.54 1y00 s VAL 30 Cb -0.13 -3.76 0.04 0.00 0.00 0.00 0.00 36.38 32.52 1y00 s VAL 30 CO 0.02 0.31 1.26 -0.60 0.00 0.00 0.00 175.10 176.09 1y00 s ARG 31 N 0.85 3.20 -0.13 2.72 3.52 -1.26 -5.00 118.95 122.85 1y00 s ARG 31 Ca 0.22 -0.34 -0.21 0.00 -0.13 0.00 0.00 55.73 55.27 1y00 s ARG 31 Cb -0.15 -4.24 -0.03 0.00 -1.56 0.00 0.00 34.95 28.97 1y00 s ARG 31 CO 0.08 -2.12 0.62 0.42 -0.81 0.00 0.00 175.30 173.50 1y00 s ILE 32 N 5.54 5.07 -0.37 4.11 -1.09 -1.26 -4.53 121.20 128.66 1y00 s ILE 32 Ca 0.34 1.23 -0.10 0.00 -2.23 0.00 0.00 60.65 59.89 1y00 s ILE 32 Cb -0.08 -3.95 0.03 0.00 -1.58 0.00 0.00 42.46 36.87 1y00 s ILE 32 CO 0.13 0.21 0.20 -0.83 -1.23 0.00 0.00 174.94 173.42 1y00 s GLY 33 N 0.91 1.92 -0.39 6.18 0.00 -0.45 -5.02 107.32 110.47 1y00 s GLY 33 Ca 0.31 -1.73 -0.04 0.00 0.00 0.00 0.00 44.72 43.26 1y00 s GLY 33 CO 0.13 0.84 0.18 0.14 0.00 0.00 0.00 173.10 174.40 1y00 s VAL 34 N 1.53 3.48 -0.49 1.40 1.01 -1.26 -0.30 120.40 125.77 1y00 s VAL 34 Ca 0.01 -1.77 -0.21 0.00 0.00 0.00 0.00 61.98 60.01 1y00 s VAL 34 Cb -0.19 -3.25 0.04 0.00 0.00 0.00 0.00 36.38 32.98 1y00 s VAL 34 CO 0.06 -0.55 0.70 0.21 0.00 0.00 0.00 175.10 175.52 1y00 s ASN 35 N 1.82 6.29 -0.02 3.32 3.84 -0.26 -4.97 114.94 124.96 1y00 s ASN 35 Ca 0.04 -0.56 0.05 0.00 0.21 0.00 0.00 52.86 52.61 1y00 s ASN 35 Cb -0.22 -2.33 -0.01 0.00 -0.55 0.00 0.00 41.25 38.13 1y00 s ASN 35 CO -0.02 -0.91 -0.17 0.00 -2.79 0.00 0.00 177.10 173.21 1y00 s ALA 36 N 2.98 1.41 0.58 1.71 0.00 -1.26 -1.41 121.76 125.76 1y00 s ALA 36 Ca 0.21 -0.70 -0.15 0.00 0.00 0.00 0.00 51.96 51.32 1y00 s ALA 36 Cb -0.16 -0.39 -0.05 0.00 0.00 0.00 0.00 23.12 22.52 1y00 s ALA 36 CO 0.16 0.32 1.02 -1.25 0.00 0.00 0.00 175.76 176.02 1y00 s PRO 37 N -0.26 3.58 0.00 0.00 0.04 -1.26 -4.96 135.00 132.15 1y00 s PRO 37 Ca 0.03 1.00 0.25 0.00 0.04 0.00 0.00 61.00 62.32 1y00 s PRO 37 Cb -0.08 -2.08 1.36 0.00 0.04 0.00 0.00 34.50 33.74 1y00 s PRO 37 CO 0.00 -0.58 1.89 1.17 0.04 0.00 0.00 177.00 179.52 1y00 n LYS 38 N -2.09 1.14 0.09 4.56 4.81 -1.26 -3.63 118.16 121.79 1y00 n LYS 38 Ca 0.07 -0.21 -0.23 0.00 -0.87 0.00 0.00 58.31 57.08 1y00 n LYS 38 Cb 0.54 -1.40 -0.15 0.00 0.02 0.00 0.00 35.03 34.04 1y00 n LYS 38 CO 0.00 0.00 0.00 1.05 1.17 0.00 0.00 177.40 179.62 1y00 h GLU 39 N 0.47 0.41 -6.58 1.64 4.11 -1.98 -3.46 114.58 109.19 1y00 h GLU 39 Ca 0.00 -0.71 -0.52 0.00 0.07 0.00 0.00 59.36 58.20 1y00 h GLU 39 Cb 0.10 0.26 -0.03 0.00 0.50 0.00 0.00 28.75 29.58 1y00 h GLU 39 CO 0.00 1.33 0.06 0.08 0.07 0.00 0.00 179.01 180.55 1y00 s VAL 40 N -2.59 4.68 -0.54 -1.06 1.01 -1.24 -4.97 120.40 115.69 1y00 s VAL 40 Ca -0.13 1.04 -0.26 0.00 0.00 0.00 0.00 61.98 62.63 1y00 s VAL 40 Cb 0.05 -3.74 -0.05 0.00 0.00 0.00 0.00 36.38 32.64 1y00 s VAL 40 CO 0.88 0.06 2.19 -0.44 0.00 0.00 0.00 175.10 177.79 1y00 s SER 41 N -1.93 4.76 -0.15 3.32 0.01 -1.26 -4.92 113.70 113.54 1y00 s SER 41 Ca 0.46 0.79 0.01 0.00 1.31 0.00 0.00 55.95 58.52 1y00 s SER 41 Cb -0.14 -2.51 0.02 0.00 0.21 0.00 0.00 66.02 63.60 1y00 s SER 41 CO 0.19 -2.68 -0.18 0.54 0.41 0.00 0.00 173.24 171.52 1y00 s VAL 42 N 10.98 1.81 -0.03 3.43 0.11 -1.26 -5.12 120.40 130.32 1y00 s VAL 42 Ca 0.86 -0.80 0.04 0.00 -2.93 0.00 0.00 61.98 59.14 1y00 s VAL 42 Cb -0.15 -1.65 -0.00 0.00 -1.53 0.00 0.00 36.38 33.05 1y00 s VAL 42 CO 0.24 0.50 -0.15 -1.00 -3.33 0.00 0.00 175.10 171.36 1y00 s HIS 43 N 1.17 1.44 0.20 1.54 3.76 -1.26 -5.14 115.29 117.00 1y00 s HIS 43 Ca -0.00 -0.37 0.03 0.00 -0.15 0.00 0.00 55.06 54.56 1y00 s HIS 43 Cb -0.14 -0.97 -0.01 0.00 1.11 0.00 0.00 32.58 32.57 1y00 s HIS 43 CO -0.07 -0.12 0.21 0.54 -0.85 0.00 0.00 174.74 174.45 1y00 n ARG 44 N 3.09 0.30 -1.69 1.40 3.00 -1.26 -5.14 116.66 116.37 1y00 n ARG 44 Ca -0.17 -1.88 -0.39 0.00 -0.01 0.00 0.00 57.85 55.40 1y00 n ARG 44 Cb 0.54 1.62 0.03 0.00 0.00 0.00 0.00 32.46 34.65 1y00 n ARG 44 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.63 178.02 1y00 n GLU 45 N -0.37 1.55 0.04 5.56 4.71 -1.26 -4.85 120.64 126.03 1y00 n GLU 45 Ca 0.03 0.57 -0.08 0.00 -0.01 0.00 0.00 57.16 57.67 1y00 n GLU 45 Cb 0.36 -2.39 -0.05 0.00 -1.01 0.00 0.00 31.44 28.35 1y00 n GLU 45 CO 0.00 0.00 0.00 0.93 0.09 0.00 0.00 177.13 178.15 1y00 h GLU 46 N 1.41 -0.33 -0.96 3.49 4.39 -2.00 -2.22 114.58 118.35 1y00 h GLU 46 Ca -0.49 0.02 0.17 0.00 0.34 0.00 0.00 59.36 59.40 1y00 h GLU 46 Cb 1.32 0.08 -0.10 0.00 -0.10 0.00 0.00 28.75 29.94 1y00 h GLU 46 CO 0.56 -0.22 0.56 0.97 -1.16 0.00 0.00 179.01 179.73 1y00 h ILE 47 N -0.34 0.75 -0.07 3.13 -0.00 -1.95 0.14 117.51 119.17 1y00 h ILE 47 Ca -0.00 -0.26 0.01 0.00 -0.00 0.00 0.00 64.86 64.61 1y00 h ILE 47 Cb 0.35 -0.08 -0.02 0.00 -0.00 0.00 0.00 36.82 37.07 1y00 h ILE 47 CO -0.15 0.14 -0.13 0.22 -0.00 0.00 0.00 178.15 178.23 1y00 h TYR 48 N 0.76 -0.39 0.00 2.19 5.03 -1.77 -0.55 116.97 122.24 1y00 h TYR 48 Ca 0.53 0.02 -0.03 0.00 2.58 0.00 0.00 58.73 61.83 1y00 h TYR 48 Cb 0.76 0.18 -0.00 0.00 1.55 0.00 0.00 36.73 39.21 1y00 h TYR 48 CO -0.03 -0.12 -0.12 1.96 -1.32 0.00 0.00 178.16 178.53 1y00 h GLN 49 N -0.11 0.00 0.00 1.82 4.20 -1.26 -2.29 115.11 117.46 1y00 h GLN 49 Ca 0.01 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.72 1y00 h GLN 49 Cb 0.15 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.93 1y00 h GLN 49 CO -0.12 0.12 0.00 0.00 -0.67 0.00 0.00 178.83 178.16 1y00 h ARG 50 N 0.00 0.00 0.00 1.46 3.08 0.13 0.78 114.38 119.84 1y00 h ARG 50 Ca -0.00 0.00 -0.08 0.00 0.07 0.00 0.00 59.98 59.97 1y00 h ARG 50 Cb 0.69 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.73 1y00 h ARG 50 CO 0.02 0.00 -1.47 1.51 -1.07 0.00 0.00 179.97 178.95 1y00 n ILE 51 N -2.45 0.28 -0.06 2.04 3.06 -0.29 0.38 119.36 122.32 1y00 n ILE 51 Ca 0.02 -0.27 -0.12 0.00 -2.50 0.00 0.00 62.75 59.88 1y00 n ILE 51 Cb 0.26 -0.26 -0.04 0.00 0.54 0.00 0.00 39.64 40.14 1y00 n ILE 51 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 1y00 n GLN 52 N -2.06 0.37 0.00 9.51 3.00 -0.88 -4.75 117.38 122.57 1y00 n GLN 52 Ca -0.07 0.15 0.00 0.00 -0.01 0.00 0.00 57.00 57.07 1y00 n GLN 52 Cb 0.50 -1.13 0.00 0.00 0.00 0.00 0.00 30.24 29.61 1y00 n GLN 52 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1y00 n ALA 53 N -4.00 -0.33 -3.17 -1.58 0.00 0.54 -4.67 120.51 107.29 1y00 n ALA 53 Ca -0.21 0.00 -0.37 0.00 0.00 0.00 0.00 53.44 52.87 1y00 n ALA 53 Cb 0.52 0.00 -0.13 0.00 0.00 0.00 0.00 19.45 19.84 1y00 n ALA 53 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 1y00 s GLU 54 N -2.30 3.27 -0.43 0.00 2.56 0.24 -5.00 118.70 117.03 1y00 s GLU 54 Ca 0.00 -0.74 -0.37 0.00 0.00 0.00 0.00 54.97 53.86 1y00 s GLU 54 Cb 0.00 -3.33 -0.14 0.00 2.00 0.00 0.00 34.13 32.66 1y00 s GLU 54 CO 0.00 -0.36 2.21 1.63 -0.56 0.00 0.00 175.26 178.19 1y00 n LYS 55 N 4.88 0.70 0.11 4.30 4.76 -1.26 -3.79 118.16 127.86 1y00 n LYS 55 Ca -0.15 0.18 -0.09 0.00 -2.87 0.00 0.00 58.31 55.38 1y00 n LYS 55 Cb 0.49 -2.16 -0.05 0.00 -1.84 0.00 0.00 35.03 31.47 1y00 n LYS 55 CO 0.00 0.00 0.00 1.03 -1.37 0.00 0.00 177.40 177.06 1y00 h SER 56 N 11.64 -0.74 -2.86 4.39 0.87 -0.37 -3.33 113.55 123.15 1y00 h SER 56 Ca -0.21 0.07 -0.72 0.00 -1.23 0.00 0.00 61.79 59.70 1y00 h SER 56 Cb 1.35 0.26 -0.20 0.00 -0.44 0.00 0.00 62.40 63.36 1y00 h SER 56 CO 1.07 -0.32 0.53 -1.58 -0.53 0.00 0.00 176.83 176.00 1y00 s GLN 57 N -4.41 3.51 0.66 2.24 2.00 -1.26 -5.03 119.66 117.36 1y00 s GLN 57 Ca -0.09 -1.85 -0.16 0.00 -2.00 0.00 0.00 55.36 51.27 1y00 s GLN 57 Cb 0.02 -4.67 0.00 0.00 0.80 0.00 0.00 33.01 29.17 1y00 s GLN 57 CO 0.30 -1.62 1.15 -1.14 -0.50 0.00 0.00 175.29 173.48 1y00 s GLN 58 N 2.08 2.68 -0.54 1.67 0.74 -1.25 -5.00 119.66 120.04 1y00 s GLN 58 Ca 0.25 1.55 -0.06 0.00 0.05 0.00 0.00 55.36 57.16 1y00 s GLN 58 Cb -0.09 -1.92 0.14 0.00 1.10 0.00 0.00 33.01 32.24 1y00 s GLN 58 CO -0.06 -1.38 0.37 0.45 -0.55 0.00 0.00 175.29 174.12 1y00 s SER 59 N -2.28 5.50 -0.08 6.67 0.15 -1.26 -5.06 113.70 117.34 1y00 s SER 59 Ca 0.70 -2.34 0.03 0.00 0.70 0.00 0.00 55.95 55.05 1y00 s SER 59 Cb -0.24 -1.92 -0.02 0.00 -1.71 0.00 0.00 66.02 62.13 1y00 s SER 59 CO 0.40 -0.53 -0.18 -0.44 1.20 0.00 0.00 173.24 173.70 1y00 s SER 60 N 1.71 3.65 0.00 5.45 0.01 -1.26 -5.31 113.70 117.95 1y00 s SER 60 Ca 0.11 -0.36 0.00 0.00 1.31 0.00 0.00 55.95 57.01 1y00 s SER 60 Cb -0.22 -1.14 0.00 0.00 0.21 0.00 0.00 66.02 64.88 1y00 s SER 60 CO -0.03 0.24 0.00 -1.22 0.41 0.00 0.00 173.24 172.64