#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 2.38 -0.45 3.17 0.20 -1.26 -5.09 118.68 117.63 1y00 s LEU 2 Ca 0.00 -0.86 -0.14 0.00 0.69 0.00 0.00 54.13 53.82 1y00 s LEU 2 Cb 0.00 -1.36 0.07 0.00 -0.43 0.00 0.00 46.19 44.47 1y00 s LEU 2 CO 0.00 -0.10 0.35 -0.51 -0.29 0.00 0.00 176.35 175.80 1y00 s ILE 3 N 1.32 4.97 -0.13 6.68 2.07 -1.26 -5.05 121.20 129.80 1y00 s ILE 3 Ca 0.00 -1.12 0.01 0.00 -1.41 0.00 0.00 60.65 58.14 1y00 s ILE 3 Cb -0.15 -3.96 0.02 0.00 0.13 0.00 0.00 42.46 38.49 1y00 s ILE 3 CO -0.09 -0.53 -0.15 -0.22 -1.91 0.00 0.00 174.94 172.03 1y00 s LEU 4 N 1.59 1.74 0.45 8.50 1.98 -1.26 -5.12 118.68 126.57 1y00 s LEU 4 Ca 0.04 -0.46 -0.25 0.00 -2.89 0.00 0.00 54.13 50.57 1y00 s LEU 4 Cb -0.23 -1.15 -0.08 0.00 0.66 0.00 0.00 46.19 45.38 1y00 s LEU 4 CO 0.06 -0.00 1.35 -0.89 -1.89 0.00 0.00 176.35 174.97 1y00 s THR 5 N 1.14 2.35 -0.05 3.68 2.01 -1.26 -5.02 115.64 118.49 1y00 s THR 5 Ca -0.03 0.30 -0.20 0.00 0.31 0.00 0.00 61.69 62.08 1y00 s THR 5 Cb -0.14 -3.17 0.04 0.00 0.01 0.00 0.00 72.50 69.24 1y00 s THR 5 CO -0.05 0.03 0.44 -0.13 -0.69 0.00 0.00 174.62 174.23 1y00 s ARG 6 N -2.47 0.76 0.00 4.92 0.52 -1.26 -5.01 118.95 116.41 1y00 s ARG 6 Ca 0.61 0.09 0.00 0.00 -0.52 0.00 0.00 55.73 55.91 1y00 s ARG 6 Cb -0.40 0.35 0.00 0.00 0.52 0.00 0.00 34.95 35.42 1y00 s ARG 6 CO 0.50 -0.20 0.00 -2.13 0.02 0.00 0.00 175.30 173.49 1y00 n ARG 7 N 1.44 0.00 -3.64 3.54 0.63 -1.26 -5.06 116.66 112.31 1y00 n ARG 7 Ca -0.19 0.00 -0.05 0.00 -0.92 0.00 0.00 57.85 56.69 1y00 n ARG 7 Cb 0.56 0.00 -0.07 0.00 0.45 0.00 0.00 32.46 33.41 1y00 n ARG 7 CO 0.00 0.00 0.00 0.14 -2.51 0.00 0.00 177.63 175.26 1y00 s VAL 8 N 0.00 0.00 -1.23 5.15 -7.23 -1.26 -4.74 120.40 111.08 1y00 s VAL 8 Ca 0.00 0.00 -0.02 0.00 -1.81 0.00 0.00 61.98 60.15 1y00 s VAL 8 Cb 0.00 -1.00 0.00 0.00 0.56 0.00 0.00 36.38 35.94 1y00 s VAL 8 CO 0.00 0.00 1.04 0.61 -0.31 0.00 0.00 175.10 176.44 1y00 n GLY 9 N 3.02 -0.40 3.74 2.32 0.00 -1.26 -5.02 105.19 107.59 1y00 n GLY 9 Ca -0.16 0.13 -0.24 0.00 0.00 0.00 0.00 46.02 45.76 1y00 n GLY 9 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1y00 s GLU 10 N -5.57 2.30 0.00 1.61 0.41 -1.26 -5.12 118.70 111.08 1y00 s GLU 10 Ca 0.13 -1.69 0.00 0.00 -0.41 0.00 0.00 54.97 53.00 1y00 s GLU 10 Cb -0.06 -2.09 0.00 0.00 -1.78 0.00 0.00 34.13 30.20 1y00 s GLU 10 CO 0.73 -0.01 0.00 -2.37 -0.49 0.00 0.00 175.26 173.12 1y00 n THR 11 N -1.21 0.00 -4.32 3.63 5.66 -1.26 -4.72 114.28 112.06 1y00 n THR 11 Ca -0.02 0.00 -0.27 0.00 -3.05 0.00 0.00 64.05 60.71 1y00 n THR 11 Cb 0.63 0.00 -0.10 0.00 -1.55 0.00 0.00 70.33 69.31 1y00 n THR 11 CO 0.00 0.00 0.00 -1.48 -3.05 0.00 0.00 175.07 170.54 1y00 s LEU 12 N 0.00 2.83 -0.31 1.09 2.34 -1.08 -4.93 118.68 118.62 1y00 s LEU 12 Ca 0.00 -0.65 -0.00 0.00 0.06 0.00 0.00 54.13 53.54 1y00 s LEU 12 Cb 0.00 -1.54 0.10 0.00 -0.56 0.00 0.00 46.19 44.19 1y00 s LEU 12 CO 0.00 0.11 0.08 -0.32 -1.06 0.00 0.00 176.35 175.16 1y00 s MET 13 N -2.76 0.84 -0.20 1.48 -2.45 -1.26 -1.67 119.30 113.29 1y00 s MET 13 Ca 0.24 -1.14 -0.03 0.00 -1.25 0.00 0.00 55.69 53.50 1y00 s MET 13 Cb -0.09 -2.17 -0.01 0.00 1.25 0.00 0.00 34.83 33.81 1y00 s MET 13 CO 0.14 -0.95 -0.07 -1.50 1.05 0.00 0.00 175.02 173.68 1y00 s ILE 14 N 1.53 3.19 0.00 10.11 1.10 -1.26 -4.91 121.20 130.96 1y00 s ILE 14 Ca 0.09 -0.56 0.00 0.00 -0.51 0.00 0.00 60.65 59.67 1y00 s ILE 14 Cb -0.18 -2.43 0.00 0.00 0.15 0.00 0.00 42.46 40.01 1y00 s ILE 14 CO -0.22 0.45 0.00 0.61 -2.11 0.00 0.00 174.94 173.68 1y00 n GLY 15 N 4.55 0.98 0.00 1.50 0.00 -1.26 -4.68 105.19 106.28 1y00 n GLY 15 Ca -0.18 -0.58 0.00 0.00 0.00 0.00 0.00 46.02 45.25 1y00 n GLY 15 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1y00 n ASP 16 N 0.00 0.00 0.00 1.61 8.00 -1.26 -5.01 116.55 119.89 1y00 n ASP 16 Ca 0.00 -1.00 0.00 0.00 0.71 0.00 0.00 54.79 54.50 1y00 n ASP 16 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.10 1y00 n ASP 16 CO 0.00 0.00 0.00 1.21 -0.39 0.00 0.00 177.20 178.02 1y00 n GLU 17 N 0.00 0.00 0.00 -1.24 0.00 -1.26 -5.12 120.64 113.02 1y00 n GLU 17 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.16 1y00 n GLU 17 Cb 0.42 0.00 0.00 0.00 0.00 0.00 0.00 31.44 31.86 1y00 n GLU 17 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.13 178.46 1y00 n VAL 18 N 0.00 0.00 0.00 6.31 0.24 -1.26 -4.36 118.33 119.26 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 -0.03 0.00 0.00 -1.47 0.00 0.00 33.84 32.34 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 -4.00 3.34 -2.24 0.49 -4.84 114.28 107.03 1y00 n THR 19 Ca 0.00 0.00 -0.33 0.00 -2.27 0.00 0.00 64.05 61.45 1y00 n THR 19 Cb 0.00 0.00 -0.14 0.00 -2.10 0.00 0.00 70.33 68.09 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 2.57 -0.28 2.28 1.01 -0.67 -0.31 120.40 125.00 1y00 s VAL 20 Ca 0.00 -1.45 -0.08 0.00 0.00 0.00 0.00 61.98 60.46 1y00 s VAL 20 Cb 0.00 -2.46 -0.01 0.00 0.00 0.00 0.00 36.38 33.91 1y00 s VAL 20 CO 0.00 -0.02 0.09 -0.89 0.00 0.00 0.00 175.10 174.29 1y00 s THR 21 N 1.19 4.22 -1.44 3.92 2.01 0.48 -2.65 115.64 123.36 1y00 s THR 21 Ca -0.06 -0.47 -0.12 0.00 0.31 0.00 0.00 61.69 61.35 1y00 s THR 21 Cb -0.19 -3.11 0.05 0.00 0.01 0.00 0.00 72.50 69.26 1y00 s THR 21 CO -0.04 0.16 2.26 1.33 -0.69 0.00 0.00 174.62 177.64 1y00 n VAL 22 N 4.91 3.80 -0.03 3.82 0.24 -1.25 -1.31 118.33 128.50 1y00 n VAL 22 Ca -0.15 -3.28 0.00 0.00 -2.04 0.00 0.00 64.34 58.87 1y00 n VAL 22 Cb 0.49 -2.54 0.00 0.00 -1.47 0.00 0.00 33.84 30.32 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 5.19 0.00 -3.07 1.34 7.94 -1.25 -4.19 117.00 122.97 1y00 n LEU 23 Ca 0.53 0.00 -0.07 0.00 -1.11 0.00 0.00 56.01 55.36 1y00 n LEU 23 Cb 0.36 0.00 0.01 0.00 0.53 0.00 0.00 43.42 44.32 1y00 n LEU 23 CO 0.87 0.00 0.16 0.61 -1.11 0.00 0.00 177.39 177.92 1y00 n GLY 24 N 5.00 -1.19 3.54 -3.96 0.00 -1.10 -4.30 105.19 103.17 1y00 n GLY 24 Ca 0.00 0.82 -0.43 0.00 0.00 0.00 0.00 46.02 46.41 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 -2.77 4.42 0.22 1.61 1.01 -1.26 -2.75 120.40 120.88 1y00 s VAL 25 Ca 0.11 0.50 -0.20 0.00 0.00 0.00 0.00 61.98 62.40 1y00 s VAL 25 Cb -0.03 -4.49 0.03 0.00 0.00 0.00 0.00 36.38 31.89 1y00 s VAL 25 CO 0.78 -0.99 0.60 -0.75 0.00 0.00 0.00 175.10 174.74 1y00 s LYS 26 N 3.88 1.49 0.46 2.72 2.20 -1.26 -5.04 119.74 124.19 1y00 s LYS 26 Ca 0.34 -0.82 -0.00 0.00 -0.36 0.00 0.00 55.97 55.12 1y00 s LYS 26 Cb -0.11 0.56 -0.00 0.00 -1.51 0.00 0.00 37.83 36.77 1y00 s LYS 26 CO 0.23 -0.65 0.69 0.20 -0.36 0.00 0.00 175.35 175.45 1y00 s GLY 27 N -2.86 1.58 0.00 5.54 0.00 -1.26 -4.52 107.32 105.79 1y00 s GLY 27 Ca 0.08 -1.03 0.00 0.00 0.00 0.00 0.00 44.72 43.77 1y00 s GLY 27 CO -0.02 -0.85 0.00 -2.01 0.00 0.00 0.00 173.10 170.22 1y00 n ASN 28 N -2.12 0.00 -4.24 1.64 2.85 -1.26 -4.75 115.26 107.38 1y00 n ASN 28 Ca 0.02 0.00 -0.30 0.00 -0.11 0.00 0.00 54.58 54.19 1y00 n ASN 28 Cb 0.58 0.00 -0.16 0.00 1.24 0.00 0.00 39.78 41.43 1y00 n ASN 28 CO 0.00 0.00 0.00 -1.10 -2.11 0.00 0.00 177.26 174.05 1y00 s GLN 29 N 0.00 2.26 -0.32 1.20 -0.21 -1.26 -5.11 119.66 116.21 1y00 s GLN 29 Ca 0.00 -0.84 -0.12 0.00 0.02 0.00 0.00 55.36 54.43 1y00 s GLN 29 Cb 0.00 -1.97 -0.02 0.00 1.00 0.00 0.00 33.01 32.02 1y00 s GLN 29 CO 0.00 0.39 0.21 0.08 -2.12 0.00 0.00 175.29 173.84 1y00 s VAL 30 N -0.22 5.10 -0.75 1.09 1.01 -1.26 -4.45 120.40 120.91 1y00 s VAL 30 Ca -0.01 -0.20 -0.27 0.00 0.00 0.00 0.00 61.98 61.50 1y00 s VAL 30 Cb -0.12 -3.58 0.03 0.00 0.00 0.00 0.00 36.38 32.71 1y00 s VAL 30 CO 0.02 0.06 1.31 -0.13 0.00 0.00 0.00 175.10 176.37 1y00 s ARG 31 N 1.70 3.19 -0.03 2.72 0.52 -1.11 -4.99 118.95 120.95 1y00 s ARG 31 Ca 0.06 -0.26 -0.22 0.00 -0.52 0.00 0.00 55.73 54.79 1y00 s ARG 31 Cb -0.17 -4.26 -0.05 0.00 0.52 0.00 0.00 34.95 30.99 1y00 s ARG 31 CO 0.09 -2.18 0.64 0.42 0.02 0.00 0.00 175.30 174.29 1y00 s ILE 32 N 5.83 4.96 -0.26 1.52 -1.09 -1.26 -2.73 121.20 128.17 1y00 s ILE 32 Ca 0.37 1.33 -0.07 0.00 -2.23 0.00 0.00 60.65 60.05 1y00 s ILE 32 Cb -0.08 -3.98 -0.01 0.00 -1.58 0.00 0.00 42.46 36.81 1y00 s ILE 32 CO 0.14 0.35 0.06 -0.83 -1.23 0.00 0.00 174.94 173.43 1y00 s GLY 33 N 0.22 1.75 -0.15 6.18 0.00 -0.43 -4.89 107.32 110.00 1y00 s GLY 33 Ca 0.34 -1.25 -0.01 0.00 0.00 0.00 0.00 44.72 43.80 1y00 s GLY 33 CO 0.18 0.56 -0.12 0.14 0.00 0.00 0.00 173.10 173.86 1y00 s VAL 34 N 1.56 3.04 -0.27 1.40 1.01 -1.26 -0.39 120.40 125.49 1y00 s VAL 34 Ca 0.05 -0.66 0.02 0.00 0.00 0.00 0.00 61.98 61.39 1y00 s VAL 34 Cb -0.16 -2.29 0.07 0.00 0.00 0.00 0.00 36.38 34.00 1y00 s VAL 34 CO 0.02 0.51 -0.04 0.21 0.00 0.00 0.00 175.10 175.81 1y00 s ASN 35 N 0.57 4.18 -0.03 3.32 3.84 0.58 -4.95 114.94 122.45 1y00 s ASN 35 Ca -0.08 -1.44 -0.04 0.00 0.21 0.00 0.00 52.86 51.51 1y00 s ASN 35 Cb -0.16 -1.33 0.01 0.00 -0.55 0.00 0.00 41.25 39.22 1y00 s ASN 35 CO 0.03 -0.26 0.10 0.00 -2.79 0.00 0.00 177.10 174.18 1y00 s ALA 36 N 1.25 -0.24 0.57 1.71 0.00 -1.26 -0.38 121.76 123.41 1y00 s ALA 36 Ca -0.03 0.13 -0.14 0.00 0.00 0.00 0.00 51.96 51.93 1y00 s ALA 36 Cb -0.19 -0.09 -0.05 0.00 0.00 0.00 0.00 23.12 22.78 1y00 s ALA 36 CO -0.08 -0.09 1.01 -1.25 0.00 0.00 0.00 175.76 175.36 1y00 s PRO 37 N -0.35 3.69 -0.14 0.00 0.04 -1.26 -4.96 135.00 132.02 1y00 s PRO 37 Ca -0.04 0.92 0.03 0.00 0.04 0.00 0.00 61.00 61.95 1y00 s PRO 37 Cb -0.03 -2.09 0.27 0.00 0.04 0.00 0.00 34.50 32.69 1y00 s PRO 37 CO 0.00 -0.49 1.22 1.63 0.04 0.00 0.00 177.00 179.39 1y00 n LYS 38 N -2.12 1.81 -0.12 4.56 5.02 -1.26 -3.89 118.16 122.16 1y00 n LYS 38 Ca 0.07 -1.14 -0.19 0.00 -2.02 0.00 0.00 58.31 55.03 1y00 n LYS 38 Cb 0.54 -1.56 -0.11 0.00 -0.02 0.00 0.00 35.03 33.88 1y00 n LYS 38 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 1y00 n GLU 39 N 0.00 0.60 -2.94 1.97 1.02 -1.26 -4.98 120.64 115.05 1y00 n GLU 39 Ca 0.18 0.16 -0.33 0.00 -0.02 0.00 0.00 57.16 57.15 1y00 n GLU 39 Cb 0.83 -1.47 -0.06 0.00 -0.02 0.00 0.00 31.44 30.71 1y00 n GLU 39 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 1y00 s VAL 40 N -2.48 4.52 -0.58 2.62 1.01 -1.25 -4.94 120.40 119.29 1y00 s VAL 40 Ca -0.33 1.24 -0.26 0.00 0.00 0.00 0.00 61.98 62.63 1y00 s VAL 40 Cb 0.09 -3.61 -0.07 0.00 0.00 0.00 0.00 36.38 32.79 1y00 s VAL 40 CO 0.54 -0.28 2.28 -0.55 0.00 0.00 0.00 175.10 177.10 1y00 s SER 41 N -2.26 4.54 -0.16 3.32 0.15 -1.26 -4.92 113.70 113.11 1y00 s SER 41 Ca 0.59 0.69 0.01 0.00 0.70 0.00 0.00 55.95 57.93 1y00 s SER 41 Cb -0.10 -2.52 0.02 0.00 -1.71 0.00 0.00 66.02 61.72 1y00 s SER 41 CO 0.16 -2.94 -0.17 0.54 1.20 0.00 0.00 173.24 172.02 1y00 s VAL 42 N 11.94 1.80 -0.03 4.45 0.11 -1.26 -5.12 120.40 132.29 1y00 s VAL 42 Ca 0.90 -0.78 0.04 0.00 -2.93 0.00 0.00 61.98 59.20 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 0.21 0.50 -0.14 -2.28 -3.33 0.00 0.00 175.10 170.05 1y00 s HIS 43 N 1.34 1.41 0.00 1.54 2.46 -1.26 -4.92 115.29 115.85 1y00 s HIS 43 Ca 0.04 -0.37 0.00 0.00 0.47 0.00 0.00 55.06 55.20 1y00 s HIS 43 Cb -0.13 -0.96 0.00 0.00 -0.13 0.00 0.00 32.58 31.36 1y00 s HIS 43 CO -0.11 -0.12 0.00 2.89 -2.47 0.00 0.00 174.74 174.93 1y00 n ARG 44 N 3.12 0.00 0.00 2.88 1.85 -1.26 -5.10 116.66 118.15 1y00 n ARG 44 Ca -0.18 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.67 1y00 n ARG 44 Cb 0.54 0.00 0.00 0.00 -1.05 0.00 0.00 32.46 31.95 1y00 n ARG 44 CO 0.00 0.00 0.00 0.39 -0.01 0.00 0.00 177.63 178.01 1y00 n GLU 45 N -0.34 0.00 0.25 2.89 1.02 -1.26 -5.01 120.64 118.19 1y00 n GLU 45 Ca 0.00 0.00 0.15 0.00 -0.02 0.00 0.00 57.16 57.29 1y00 n GLU 45 Cb 0.00 0.00 0.83 0.00 -0.02 0.00 0.00 31.44 32.25 1y00 n GLU 45 CO 0.00 0.00 0.00 1.49 1.18 0.00 0.00 177.13 179.80 1y00 h GLU 46 N 0.00 0.00 0.12 3.49 4.81 -1.99 -1.96 114.58 119.05 1y00 h GLU 46 Ca 0.00 0.00 -0.19 0.00 -0.13 0.00 0.00 59.36 59.04 1y00 h GLU 46 Cb 0.00 0.00 0.02 0.00 0.63 0.00 0.00 28.75 29.40 1y00 h GLU 46 CO 0.00 0.00 -0.80 0.82 -0.73 0.00 0.00 179.01 178.30 1y00 h ILE 47 N 0.00 1.49 -0.71 2.32 1.08 -1.96 -2.11 117.51 117.63 1y00 h ILE 47 Ca 0.04 -2.46 0.13 0.00 -0.39 0.00 0.00 64.86 62.18 1y00 h ILE 47 Cb 0.21 3.08 -0.09 0.00 -3.07 0.00 0.00 36.82 36.95 1y00 h ILE 47 CO -0.00 0.70 0.27 1.88 -0.69 0.00 0.00 178.15 180.31 1y00 h TYR 48 N -0.30 0.46 0.01 1.37 -1.99 -1.75 0.14 116.97 114.90 1y00 h TYR 48 Ca -0.13 0.03 -0.00 0.00 2.00 0.00 0.00 58.73 60.63 1y00 h TYR 48 Cb 1.60 -0.10 0.00 0.00 2.00 0.00 0.00 36.73 40.24 1y00 h TYR 48 CO 0.19 0.07 -0.00 0.37 -0.00 0.00 0.00 178.16 178.78 1y00 h GLN 49 N 0.42 -0.01 0.00 4.88 4.15 -1.61 -0.60 115.11 122.34 1y00 h GLN 49 Ca 0.38 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.80 1y00 h GLN 49 Cb 0.54 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.24 1y00 h GLN 49 CO -0.38 -0.01 0.20 0.00 -1.93 0.00 0.00 178.83 176.71 1y00 h ARG 50 N -0.96 0.00 0.00 1.69 3.08 -1.36 0.52 114.38 117.35 1y00 h ARG 50 Ca -0.00 0.00 -0.20 0.00 0.07 0.00 0.00 59.98 59.85 1y00 h ARG 50 Cb 0.01 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.03 1y00 h ARG 50 CO 0.00 0.00 -1.54 -0.89 -1.07 0.00 0.00 179.97 176.47 1y00 n ILE 51 N -2.25 1.02 0.15 2.04 2.08 0.48 -2.05 119.36 120.84 1y00 n ILE 51 Ca -0.01 -0.09 -0.08 0.00 0.56 0.00 0.00 62.75 63.12 1y00 n ILE 51 Cb 0.23 -1.81 -0.04 0.00 -0.75 0.00 0.00 39.64 37.27 1y00 n ILE 51 CO 0.00 0.00 0.00 1.56 0.56 0.00 0.00 176.55 178.67 1y00 h GLN 52 N -0.58 -0.45 0.00 0.38 1.08 -0.97 -3.33 115.11 111.24 1y00 h GLN 52 Ca -0.30 0.03 -0.09 0.00 -1.45 0.00 0.00 58.65 56.85 1y00 h GLN 52 Cb 1.15 0.10 -0.01 0.00 -0.05 0.00 0.00 27.48 28.66 1y00 h GLN 52 CO -0.18 -0.24 -0.41 0.00 -0.95 0.00 0.00 178.83 177.05 1y00 h ALA 53 N -1.00 0.87 -4.53 3.87 0.00 -0.96 -3.44 119.26 114.06 1y00 h ALA 53 Ca -0.05 -0.37 -0.66 0.00 0.00 0.00 0.00 54.91 53.83 1y00 h ALA 53 Cb 0.41 -0.06 -0.30 0.00 0.00 0.00 0.00 17.79 17.84 1y00 h ALA 53 CO 0.08 0.51 -0.88 -1.21 0.00 0.00 0.00 179.25 177.75 1y00 s GLU 54 N -3.36 1.94 -0.78 0.00 0.41 0.16 -4.98 118.70 112.09 1y00 s GLU 54 Ca 0.02 -0.87 -0.25 0.00 -0.41 0.00 0.00 54.97 53.46 1y00 s GLU 54 Cb 0.10 -1.88 -0.21 0.00 -1.78 0.00 0.00 34.13 30.36 1y00 s GLU 54 CO 0.70 0.51 1.89 0.36 -0.49 0.00 0.00 175.26 178.24 1y00 n LYS 55 N 2.46 0.87 0.00 1.61 2.85 -1.26 -2.84 118.16 121.86 1y00 n LYS 55 Ca -0.16 -1.79 0.00 0.00 -1.05 0.00 0.00 58.31 55.31 1y00 n LYS 55 Cb 0.52 -3.27 0.00 0.00 -0.65 0.00 0.00 35.03 31.62 1y00 n LYS 55 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 177.40 177.78 1y00 n SER 56 N 12.53 -3.64 -3.55 -5.58 7.64 -0.87 -4.95 113.62 115.20 1y00 n SER 56 Ca 0.46 0.00 -0.16 0.00 1.01 0.00 0.00 58.87 60.18 1y00 n SER 56 Cb 0.44 0.00 -0.06 0.00 -1.01 0.00 0.00 64.21 63.58 1y00 n SER 56 CO 0.00 0.00 0.00 -1.58 -3.01 0.00 0.00 175.04 170.45 1y00 s GLN 57 N 0.00 1.04 -0.28 1.43 -0.44 -1.26 -4.69 119.66 115.46 1y00 s GLN 57 Ca 0.00 0.03 -0.06 0.00 -2.50 0.00 0.00 55.36 52.83 1y00 s GLN 57 Cb 0.00 0.48 0.00 0.00 -1.64 0.00 0.00 33.01 31.86 1y00 s GLN 57 CO 0.00 -0.35 0.05 -0.65 0.50 0.00 0.00 175.29 174.84 1y00 s GLN 58 N -1.74 3.16 -0.33 1.67 -1.52 -1.26 -4.97 119.66 114.67 1y00 s GLN 58 Ca -0.09 -0.80 -0.06 0.00 -1.95 0.00 0.00 55.36 52.46 1y00 s GLN 58 Cb -0.01 -3.28 0.23 0.00 -0.22 0.00 0.00 33.01 29.73 1y00 s GLN 58 CO 0.05 -0.38 1.15 0.43 -0.25 0.00 0.00 175.29 176.28 1y00 n SER 59 N 4.84 -1.34 -4.15 5.90 7.64 -1.26 -5.15 113.62 120.10 1y00 n SER 59 Ca -0.15 -1.08 -0.31 0.00 1.01 0.00 0.00 58.87 58.34 1y00 n SER 59 Cb 0.49 0.69 -0.17 0.00 -1.01 0.00 0.00 64.21 64.20 1y00 n SER 59 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 1y00 s SER 60 N 0.68 2.82 0.00 6.43 0.01 -1.26 -5.35 113.70 117.03 1y00 s SER 60 Ca 0.24 -0.52 0.24 0.00 1.31 0.00 0.00 55.95 57.22 1y00 s SER 60 Cb 0.15 -1.29 0.19 0.00 0.21 0.00 0.00 66.02 65.28 1y00 s SER 60 CO -0.10 0.09 1.26 0.00 0.41 0.00 0.00 173.24 174.90