#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2aw0 s THR 2 N 0.00 0.22 0.17 1.96 -4.23 -1.26 -4.41 115.64 108.09 2aw0 s THR 2 Ca 0.00 -1.84 -0.03 0.00 -1.18 0.00 0.00 61.69 58.64 2aw0 s THR 2 Cb 0.00 -1.65 -0.03 0.00 1.34 0.00 0.00 72.50 72.16 2aw0 s THR 2 CO 0.00 -0.87 0.15 -1.10 -0.54 0.00 0.00 174.62 172.25 2aw0 s GLN 3 N -3.94 1.09 0.12 3.99 -0.21 -0.34 -4.93 119.66 115.44 2aw0 s GLN 3 Ca 0.11 -1.44 0.06 0.00 0.02 0.00 0.00 55.36 54.11 2aw0 s GLN 3 Cb 0.08 0.29 -0.04 0.00 1.00 0.00 0.00 33.01 34.34 2aw0 s GLN 3 CO -0.07 -0.35 -0.15 -1.21 -2.12 0.00 0.00 175.29 171.39 2aw0 s GLU 4 N -4.07 1.01 -0.06 2.91 2.02 -1.26 -1.18 118.70 118.07 2aw0 s GLU 4 Ca 0.27 -1.21 -0.11 0.00 0.02 0.00 0.00 54.97 53.95 2aw0 s GLU 4 Cb 0.06 -0.94 0.02 0.00 0.10 0.00 0.00 34.13 33.37 2aw0 s GLU 4 CO 0.05 0.19 0.28 -0.08 0.02 0.00 0.00 175.26 175.71 2aw0 s THR 5 N -1.97 0.03 -0.39 3.63 -1.32 -0.44 -5.02 115.64 110.17 2aw0 s THR 5 Ca 0.08 -0.24 -0.09 0.00 -1.21 0.00 0.00 61.69 60.22 2aw0 s THR 5 Cb -0.06 -0.48 0.06 0.00 -1.51 0.00 0.00 72.50 70.51 2aw0 s THR 5 CO 0.03 -0.13 0.21 -0.69 -2.21 0.00 0.00 174.62 171.82 2aw0 s VAL 6 N -0.52 4.20 -0.33 5.08 1.01 -1.26 -1.19 120.40 127.39 2aw0 s VAL 6 Ca -0.06 -1.20 -0.13 0.00 0.00 0.00 0.00 61.98 60.59 2aw0 s VAL 6 Cb -0.04 -3.47 -0.02 0.00 0.00 0.00 0.00 36.38 32.86 2aw0 s VAL 6 CO 0.02 -0.36 0.24 -0.63 0.00 0.00 0.00 175.10 174.38 2aw0 s ILE 7 N 1.45 5.28 -0.17 2.22 1.01 -0.26 -2.07 121.20 128.67 2aw0 s ILE 7 Ca 0.02 -0.13 -0.29 0.00 0.00 0.00 0.00 60.65 60.24 2aw0 s ILE 7 Cb -0.21 -3.70 -0.01 0.00 0.01 0.00 0.00 42.46 38.55 2aw0 s ILE 7 CO 0.03 0.02 1.19 0.20 0.00 0.00 0.00 174.94 176.39 2aw0 s ASN 8 N 1.73 7.00 -0.30 3.58 0.01 0.85 -0.42 114.94 127.40 2aw0 s ASN 8 Ca 0.07 1.62 -0.02 0.00 -0.71 0.00 0.00 52.86 53.82 2aw0 s ASN 8 Cb -0.17 -2.54 0.04 0.00 0.41 0.00 0.00 41.25 38.99 2aw0 s ASN 8 CO 0.11 -0.71 -0.00 -0.63 -1.51 0.00 0.00 177.10 174.36 2aw0 s ILE 9 N 3.23 3.05 0.02 0.60 1.01 -0.50 -1.42 121.20 127.20 2aw0 s ILE 9 Ca 0.52 -1.30 -0.02 0.00 0.00 0.00 0.00 60.65 59.84 2aw0 s ILE 9 Cb -0.20 -2.72 -0.04 0.00 0.01 0.00 0.00 42.46 39.51 2aw0 s ILE 9 CO 0.13 -0.07 0.21 -0.62 0.00 0.00 0.00 174.94 174.60 2aw0 s ASP 10 N 1.28 6.38 0.00 3.58 2.15 -0.40 -4.29 116.67 125.37 2aw0 s ASP 10 Ca -0.04 0.35 0.00 0.00 0.43 0.00 0.00 52.55 53.29 2aw0 s ASP 10 Cb -0.19 -2.00 0.00 0.00 -0.30 0.00 0.00 42.92 40.43 2aw0 s ASP 10 CO -0.01 0.22 0.00 0.61 -0.17 0.00 0.00 175.17 175.82 2aw0 n GLY 11 N 0.70 0.79 3.61 2.66 0.00 -1.26 -0.90 105.19 110.78 2aw0 n GLY 11 Ca -0.09 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.50 2aw0 n GLY 11 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2aw0 s MET 12 N -0.93 3.75 -0.03 1.61 -1.94 -1.26 -4.90 119.30 115.60 2aw0 s MET 12 Ca 0.00 0.67 -0.11 0.00 -1.71 0.00 0.00 55.69 54.55 2aw0 s MET 12 Cb 0.00 -3.90 -0.31 0.00 2.01 0.00 0.00 34.83 32.63 2aw0 s MET 12 CO 0.00 -1.34 0.75 1.79 -0.01 0.00 0.00 175.02 176.21 2aw0 h THR 13 N 6.19 1.02 -3.27 2.05 1.35 -1.99 -3.50 112.91 114.77 2aw0 h THR 13 Ca -0.23 -2.58 -0.11 0.00 -0.55 0.00 0.00 66.41 62.94 2aw0 h THR 13 Cb 1.06 2.81 -0.01 0.00 -1.73 0.00 0.00 68.15 70.28 2aw0 h THR 13 CO 1.11 0.85 0.14 0.00 -0.25 0.00 0.00 175.52 177.36 2aw0 h ASN 15 N 1.91 0.25 -1.00 0.00 -1.24 -2.00 -1.53 115.58 111.96 2aw0 h ASN 15 Ca -0.30 0.01 0.16 0.00 0.71 0.00 0.00 56.30 56.87 2aw0 h ASN 15 Cb 1.18 -0.04 -0.09 0.00 0.73 0.00 0.00 38.32 40.10 2aw0 h ASN 15 CO 0.39 0.14 0.62 0.28 -1.29 0.00 0.00 177.43 177.57 2aw0 h SER 16 N 0.27 0.85 -0.11 1.15 0.02 -1.99 -0.42 113.55 113.32 2aw0 h SER 16 Ca 0.30 0.07 -0.02 0.00 -0.84 0.00 0.00 61.79 61.30 2aw0 h SER 16 Cb 0.79 -0.09 -0.00 0.00 0.14 0.00 0.00 62.40 63.24 2aw0 h SER 16 CO -0.07 0.38 -0.01 0.00 -1.14 0.00 0.00 176.83 176.00 2aw0 h VAL 18 N -0.09 0.31 -0.04 0.00 2.07 -1.39 -0.39 116.25 116.73 2aw0 h VAL 18 Ca 0.03 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.58 2aw0 h VAL 18 Cb 0.40 0.31 -0.04 0.00 -1.52 0.00 0.00 31.29 30.44 2aw0 h VAL 18 CO 0.01 0.00 -0.20 -0.61 0.02 0.00 0.00 177.57 176.79 2aw0 h GLN 19 N -0.44 -0.29 0.32 1.57 -0.00 -1.12 -1.43 115.11 113.72 2aw0 h GLN 19 Ca 0.07 0.02 -0.00 0.00 -0.00 0.00 0.00 58.65 58.74 2aw0 h GLN 19 Cb 0.55 0.07 -0.02 0.00 0.00 0.00 0.00 27.48 28.07 2aw0 h GLN 19 CO -0.28 -0.19 -0.32 1.03 0.00 0.00 0.00 178.83 179.07 2aw0 h SER 20 N -0.30 -0.85 0.26 -0.69 0.87 -0.77 -0.38 113.55 111.69 2aw0 h SER 20 Ca 0.07 0.07 0.00 0.00 -1.23 0.00 0.00 61.79 60.71 2aw0 h SER 20 Cb 0.39 0.29 -0.02 0.00 -0.44 0.00 0.00 62.40 62.62 2aw0 h SER 20 CO -0.21 -0.45 -0.25 0.40 -0.53 0.00 0.00 176.83 175.79 2aw0 h ILE 21 N -0.66 0.47 -0.07 2.23 2.04 -1.04 -0.65 117.51 119.83 2aw0 h ILE 21 Ca -0.02 0.00 0.03 0.00 1.00 0.00 0.00 64.86 65.88 2aw0 h ILE 21 Cb 0.60 0.47 -0.04 0.00 -0.74 0.00 0.00 36.82 37.11 2aw0 h ILE 21 CO -0.06 0.00 -0.17 -0.08 0.00 0.00 0.00 178.15 177.84 2aw0 h GLU 22 N -0.54 -0.24 0.01 2.37 4.81 -1.17 -0.39 114.58 119.44 2aw0 h GLU 22 Ca -0.01 0.02 0.01 0.00 -0.13 0.00 0.00 59.36 59.25 2aw0 h GLU 22 Cb 0.49 0.05 -0.02 0.00 0.63 0.00 0.00 28.75 29.91 2aw0 h GLU 22 CO -0.05 -0.16 -0.08 0.78 -0.73 0.00 0.00 179.01 178.78 2aw0 h GLY 23 N -0.25 -0.09 0.62 1.92 0.00 -0.95 -2.35 103.07 101.97 2aw0 h GLY 23 Ca 0.08 0.09 -0.02 0.00 0.00 0.00 0.00 47.33 47.47 2aw0 h GLY 23 CO -0.21 -0.08 -0.22 -2.08 0.00 0.00 0.00 176.54 173.95 2aw0 h VAL 24 N -0.14 0.36 -0.45 4.60 2.07 -0.94 -3.30 116.25 118.46 2aw0 h VAL 24 Ca 0.03 -0.53 0.00 0.00 0.82 0.00 0.00 66.70 67.02 2aw0 h VAL 24 Cb 0.17 0.53 -0.02 0.00 -1.52 0.00 0.00 31.29 30.45 2aw0 h VAL 24 CO -0.07 0.06 0.28 0.40 0.02 0.00 0.00 177.57 178.26 2aw0 h ILE 25 N -0.99 1.12 -0.46 4.57 1.08 -1.14 -1.98 117.51 119.71 2aw0 h ILE 25 Ca -0.06 -0.26 0.13 0.00 -0.39 0.00 0.00 64.86 64.28 2aw0 h ILE 25 Cb 0.57 0.48 -0.02 0.00 -3.07 0.00 0.00 36.82 34.78 2aw0 h ILE 25 CO 0.10 0.13 0.39 0.77 -0.69 0.00 0.00 178.15 178.85 2aw0 h SER 26 N 0.61 0.00 1.08 1.72 4.64 -1.50 -1.97 113.55 118.14 2aw0 h SER 26 Ca 0.16 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.48 2aw0 h SER 26 Cb -0.04 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.05 2aw0 h SER 26 CO -0.03 0.00 -0.92 0.11 -0.87 0.00 0.00 176.83 175.12 2aw0 h LYS 27 N 0.00 0.00 -6.90 4.77 1.79 -1.49 -3.44 116.57 111.30 2aw0 h LYS 27 Ca 0.22 0.00 -0.52 0.00 -2.18 0.00 0.00 60.65 58.17 2aw0 h LYS 27 Cb 1.01 0.00 0.06 0.00 -1.58 0.00 0.00 32.23 31.72 2aw0 h LYS 27 CO -0.00 0.00 0.57 0.15 -1.08 0.00 0.00 179.45 179.09 2aw0 s LYS 28 N -3.35 4.22 0.31 3.15 1.02 -0.74 -4.92 119.74 119.43 2aw0 s LYS 28 Ca 0.00 2.04 -0.29 0.00 0.02 0.00 0.00 55.97 57.74 2aw0 s LYS 28 Cb 0.09 -2.91 -0.11 0.00 -0.52 0.00 0.00 37.83 34.39 2aw0 s LYS 28 CO 0.78 -0.24 1.51 -1.25 -0.92 0.00 0.00 175.35 175.23 2aw0 s PRO 29 N -1.99 4.17 0.00 -1.68 0.04 -1.26 -2.42 135.00 131.86 2aw0 s PRO 29 Ca 0.52 2.49 0.00 0.00 0.04 0.00 0.00 61.00 64.05 2aw0 s PRO 29 Cb -0.36 -3.03 0.00 0.00 0.04 0.00 0.00 34.50 31.15 2aw0 s PRO 29 CO 0.46 -0.53 0.00 0.41 0.04 0.00 0.00 177.00 177.39 2aw0 n GLY 30 N 1.66 3.10 3.72 0.56 0.00 -1.26 -4.47 105.19 108.51 2aw0 n GLY 30 Ca 0.05 -0.91 -0.42 0.00 0.00 0.00 0.00 46.02 44.74 2aw0 n GLY 30 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2aw0 s VAL 31 N -0.82 3.26 0.00 1.61 1.01 -1.01 -1.48 120.40 122.97 2aw0 s VAL 31 Ca 0.00 0.95 0.00 0.00 0.00 0.00 0.00 61.98 62.93 2aw0 s VAL 31 Cb 0.00 -3.61 0.00 0.00 0.00 0.00 0.00 36.38 32.77 2aw0 s VAL 31 CO 0.00 0.10 0.00 0.29 0.00 0.00 0.00 175.10 175.49 2aw0 n LYS 32 N 3.49 0.00 -3.17 2.72 5.02 -0.25 -4.85 118.16 121.11 2aw0 n LYS 32 Ca 0.10 0.00 -0.31 0.00 -2.02 0.00 0.00 58.31 56.07 2aw0 n LYS 32 Cb 0.42 0.00 -0.05 0.00 -0.02 0.00 0.00 35.03 35.38 2aw0 n LYS 32 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 2aw0 s SER 33 N -0.88 6.64 -0.14 4.39 1.04 -1.25 -4.91 113.70 118.59 2aw0 s SER 33 Ca 0.00 1.09 -0.12 0.00 0.48 0.00 0.00 55.95 57.40 2aw0 s SER 33 Cb 0.00 -2.30 0.04 0.00 0.10 0.00 0.00 66.02 63.86 2aw0 s SER 33 CO 0.00 -0.21 0.37 -0.51 0.98 0.00 0.00 173.24 173.87 2aw0 s ILE 34 N -2.03 -0.01 -0.18 -1.02 2.07 -1.26 -1.15 121.20 117.62 2aw0 s ILE 34 Ca 0.51 0.02 -0.01 0.00 -1.41 0.00 0.00 60.65 59.76 2aw0 s ILE 34 Cb -0.11 -0.52 0.05 0.00 0.13 0.00 0.00 42.46 42.01 2aw0 s ILE 34 CO 0.23 0.01 -0.02 -0.60 -1.91 0.00 0.00 174.94 172.65 2aw0 s ARG 35 N 0.44 1.17 0.03 3.50 3.52 -0.59 -5.01 118.95 122.00 2aw0 s ARG 35 Ca -0.02 -0.54 -0.01 0.00 -0.13 0.00 0.00 55.73 55.03 2aw0 s ARG 35 Cb -0.04 -2.09 -0.04 0.00 -1.56 0.00 0.00 34.95 31.22 2aw0 s ARG 35 CO -0.02 -0.52 0.16 0.08 -0.81 0.00 0.00 175.30 174.19 2aw0 s VAL 36 N 1.68 5.19 -0.12 7.11 1.01 -1.26 -0.99 120.40 133.02 2aw0 s VAL 36 Ca -0.01 -0.36 -0.05 0.00 0.00 0.00 0.00 61.98 61.56 2aw0 s VAL 36 Cb -0.16 -3.47 0.05 0.00 0.00 0.00 0.00 36.38 32.80 2aw0 s VAL 36 CO -0.07 0.24 0.26 -0.55 0.00 0.00 0.00 175.10 174.98 2aw0 s SER 37 N -2.17 -0.10 0.04 3.32 0.15 -0.49 -4.99 113.70 109.46 2aw0 s SER 37 Ca 0.30 0.57 -0.20 0.00 0.70 0.00 0.00 55.95 57.32 2aw0 s SER 37 Cb -0.13 0.53 -0.15 0.00 -1.71 0.00 0.00 66.02 64.56 2aw0 s SER 37 CO 0.22 -0.19 1.32 0.25 1.20 0.00 0.00 173.24 176.04 2aw0 h LEU 38 N 7.52 0.40 -0.78 3.45 5.85 -1.95 0.43 115.31 130.23 2aw0 h LEU 38 Ca -0.33 -0.51 0.13 0.00 0.84 0.00 0.00 57.88 58.02 2aw0 h LEU 38 Cb 1.14 -0.11 -0.09 0.00 0.37 0.00 0.00 40.66 41.97 2aw0 h LEU 38 CO 0.30 0.83 0.37 0.00 -0.34 0.00 0.00 178.44 179.60 2aw0 h ALA 39 N 0.59 1.13 0.00 1.25 0.00 -1.97 -1.12 119.26 119.14 2aw0 h ALA 39 Ca 0.02 0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.01 2aw0 h ALA 39 Cb 0.73 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.53 2aw0 h ALA 39 CO 0.04 -0.11 -0.92 -0.91 0.00 0.00 0.00 179.25 177.35 2aw0 h ASN 40 N 0.57 0.00 -5.76 0.00 2.35 -1.99 -3.48 115.58 107.26 2aw0 h ASN 40 Ca 0.42 -0.00 -0.34 0.00 -0.55 0.00 0.00 56.30 55.83 2aw0 h ASN 40 Cb 0.57 0.00 0.14 0.00 0.05 0.00 0.00 38.32 39.08 2aw0 h ASN 40 CO -0.35 0.00 -0.83 -1.20 -1.65 0.00 0.00 177.43 173.40 2aw0 n SER 41 N -2.70 -3.44 -3.67 5.81 7.64 0.06 -4.94 113.62 112.38 2aw0 n SER 41 Ca 0.00 -0.74 -0.10 0.00 1.01 0.00 0.00 58.87 59.05 2aw0 n SER 41 Cb 0.55 -4.70 -0.03 0.00 -1.01 0.00 0.00 64.21 59.01 2aw0 n SER 41 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 2aw0 s ASN 42 N -4.00 0.08 -0.15 6.43 2.20 -0.73 -1.40 114.94 117.36 2aw0 s ASN 42 Ca 0.18 -1.01 -0.02 0.00 -0.94 0.00 0.00 52.86 51.06 2aw0 s ASN 42 Cb -0.03 0.67 0.05 0.00 -2.00 0.00 0.00 41.25 39.93 2aw0 s ASN 42 CO 0.77 -1.29 0.02 -0.83 -2.94 0.00 0.00 177.10 172.82 2aw0 s GLY 43 N -3.05 0.62 -0.49 0.45 0.00 0.44 -1.40 107.32 103.89 2aw0 s GLY 43 Ca 0.21 -0.48 -0.16 0.00 0.00 0.00 0.00 44.72 44.29 2aw0 s GLY 43 CO 0.11 1.31 0.46 -1.59 0.00 0.00 0.00 173.10 173.39 2aw0 s THR 44 N 1.90 5.16 -0.11 0.90 2.01 -0.17 -1.10 115.64 124.23 2aw0 s THR 44 Ca 0.01 -1.04 -0.01 0.00 0.31 0.00 0.00 61.69 60.97 2aw0 s THR 44 Cb -0.15 -4.19 -0.02 0.00 0.01 0.00 0.00 72.50 68.14 2aw0 s THR 44 CO -0.07 -0.67 -0.08 -0.69 -0.69 0.00 0.00 174.62 172.41 2aw0 s VAL 45 N 1.82 3.50 -0.15 3.82 1.01 -0.33 -1.53 120.40 128.53 2aw0 s VAL 45 Ca 0.06 -0.52 -0.06 0.00 0.00 0.00 0.00 61.98 61.45 2aw0 s VAL 45 Cb -0.24 -2.47 -0.04 0.00 0.00 0.00 0.00 36.38 33.62 2aw0 s VAL 45 CO 0.07 0.54 0.07 -0.70 0.00 0.00 0.00 175.10 175.07 2aw0 s GLU 46 N -0.05 3.72 0.25 2.72 2.12 -0.30 -1.32 118.70 125.84 2aw0 s GLU 46 Ca -0.01 -0.32 -0.11 0.00 0.36 0.00 0.00 54.97 54.90 2aw0 s GLU 46 Cb -0.14 -3.14 -0.01 0.00 0.26 0.00 0.00 34.13 31.11 2aw0 s GLU 46 CO 0.03 0.44 0.44 1.52 -0.54 0.00 0.00 175.26 177.15 2aw0 s TYR 47 N -0.09 0.48 -0.35 5.30 1.13 -0.32 -1.10 117.35 122.40 2aw0 s TYR 47 Ca 0.07 -0.82 -0.11 0.00 -1.41 0.00 0.00 57.07 54.79 2aw0 s TYR 47 Cb -0.12 0.10 0.01 0.00 -1.10 0.00 0.00 41.96 40.85 2aw0 s TYR 47 CO 0.01 -0.97 0.20 0.34 -2.51 0.00 0.00 175.55 172.62 2aw0 s ASP 48 N -3.04 5.76 0.37 -0.18 2.15 -0.55 -1.19 116.67 119.99 2aw0 s ASP 48 Ca 0.25 -0.73 0.20 0.00 0.43 0.00 0.00 52.55 52.69 2aw0 s ASP 48 Cb 0.00 -2.05 1.23 0.00 -0.30 0.00 0.00 42.92 41.80 2aw0 s ASP 48 CO 0.10 -0.30 1.64 -0.65 -0.17 0.00 0.00 175.17 175.79 2aw0 h PRO 49 N 8.44 0.19 -0.40 4.34 0.11 -1.77 -0.74 132.00 142.17 2aw0 h PRO 49 Ca -0.29 -0.01 -0.03 0.00 0.11 0.00 0.00 66.00 65.78 2aw0 h PRO 49 Cb 1.13 -0.04 -0.02 0.00 0.11 0.00 0.00 31.00 32.18 2aw0 h PRO 49 CO 0.65 0.13 0.13 -0.07 -0.21 0.00 0.00 178.00 178.63 2aw0 h LEU 50 N 0.20 0.53 0.00 2.35 3.38 -1.95 -3.28 115.31 116.54 2aw0 h LEU 50 Ca 0.78 -0.06 -0.34 0.00 0.09 0.00 0.00 57.88 58.34 2aw0 h LEU 50 Cb 2.00 -0.14 -0.06 0.00 0.09 0.00 0.00 40.66 42.55 2aw0 h LEU 50 CO -0.59 0.51 -2.28 0.18 0.09 0.00 0.00 178.44 176.35 2aw0 n LEU 51 N -4.35 0.64 -4.00 1.67 4.77 -0.49 -5.06 117.00 110.18 2aw0 n LEU 51 Ca 0.03 -0.03 -0.12 0.00 -0.03 0.00 0.00 56.01 55.86 2aw0 n LEU 51 Cb 0.17 0.18 -0.03 0.00 -2.33 0.00 0.00 43.42 41.41 2aw0 n LEU 51 CO 0.38 0.55 0.24 0.28 -1.33 0.00 0.00 177.39 177.51 2aw0 s THR 52 N -2.45 0.00 0.18 -5.08 -1.32 -0.40 -4.76 115.64 101.80 2aw0 s THR 52 Ca -0.14 -1.40 -0.12 0.00 -1.21 0.00 0.00 61.69 58.83 2aw0 s THR 52 Cb 0.06 -2.55 0.00 0.00 -1.51 0.00 0.00 72.50 68.50 2aw0 s THR 52 CO 0.71 0.00 0.36 -0.94 -2.21 0.00 0.00 174.62 172.54 2aw0 s SER 53 N -3.13 -0.05 0.22 8.08 1.04 -1.26 -3.63 113.70 114.97 2aw0 s SER 53 Ca 0.24 -0.76 -0.08 0.00 0.48 0.00 0.00 55.95 55.84 2aw0 s SER 53 Cb -0.02 0.48 0.36 0.00 0.10 0.00 0.00 66.02 66.95 2aw0 s SER 53 CO 0.15 -0.95 1.70 -0.65 0.98 0.00 0.00 173.24 174.47 2aw0 h PRO 54 N 2.43 0.28 -0.22 4.02 0.11 -1.98 -0.87 132.00 135.77 2aw0 h PRO 54 Ca -0.31 -0.02 -0.11 0.00 0.11 0.00 0.00 66.00 65.67 2aw0 h PRO 54 Cb 1.24 -0.06 -0.01 0.00 0.11 0.00 0.00 31.00 32.27 2aw0 h PRO 54 CO 0.44 0.19 -0.35 0.93 -0.21 0.00 0.00 178.00 179.00 2aw0 h GLU 55 N 0.29 0.46 -0.29 1.05 5.08 -1.98 -0.31 114.58 118.88 2aw0 h GLU 55 Ca 0.36 -0.21 -0.04 0.00 -1.00 0.00 0.00 59.36 58.46 2aw0 h GLU 55 Cb 0.55 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.78 2aw0 h GLU 55 CO -0.43 0.75 0.02 1.15 -1.00 0.00 0.00 179.01 179.50 2aw0 h THR 56 N 0.40 1.25 -0.39 1.13 2.02 -1.75 -0.19 112.91 115.37 2aw0 h THR 56 Ca 0.04 -0.88 -0.04 0.00 0.77 0.00 0.00 66.41 66.31 2aw0 h THR 56 Cb 0.80 1.25 -0.02 0.00 -1.74 0.00 0.00 68.15 68.44 2aw0 h THR 56 CO 0.06 0.28 0.10 -0.07 0.37 0.00 0.00 175.52 176.27 2aw0 h LEU 57 N 0.30 0.59 -0.27 2.58 3.38 -1.03 0.55 115.31 121.42 2aw0 h LEU 57 Ca 0.09 -0.23 0.06 0.00 0.09 0.00 0.00 57.88 57.89 2aw0 h LEU 57 Cb 0.39 -0.16 -0.06 0.00 0.09 0.00 0.00 40.66 40.93 2aw0 h LEU 57 CO 0.01 0.66 -0.11 -0.09 0.09 0.00 0.00 178.44 179.01 2aw0 h ARG 58 N 0.49 -0.06 -0.72 1.13 2.43 -1.05 -1.51 114.38 115.10 2aw0 h ARG 58 Ca 0.12 0.00 0.12 0.00 -0.81 0.00 0.00 59.98 59.42 2aw0 h ARG 58 Cb 0.30 0.01 -0.08 0.00 -0.42 0.00 0.00 29.97 29.78 2aw0 h ARG 58 CO 0.00 -0.04 0.30 0.78 -1.51 0.00 0.00 179.97 179.51 2aw0 h GLY 59 N -0.06 1.08 0.97 2.80 0.00 -0.50 0.02 103.07 107.37 2aw0 h GLY 59 Ca 0.14 -0.16 -0.03 0.00 0.00 0.00 0.00 47.33 47.28 2aw0 h GLY 59 CO -0.31 -0.04 0.20 0.00 0.00 0.00 0.00 176.54 176.39 2aw0 h ALA 60 N 1.49 0.63 -0.62 3.60 0.00 -0.38 0.48 119.26 124.46 2aw0 h ALA 60 Ca 0.38 -0.15 -0.09 0.00 0.00 0.00 0.00 54.91 55.05 2aw0 h ALA 60 Cb 0.51 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.09 2aw0 h ALA 60 CO -0.35 0.23 0.02 0.82 0.00 0.00 0.00 179.25 179.97 2aw0 h ILE 61 N 0.64 1.26 -0.75 0.00 2.04 -0.74 -1.68 117.51 118.29 2aw0 h ILE 61 Ca 0.16 -1.13 -0.04 0.00 1.00 0.00 0.00 64.86 64.86 2aw0 h ILE 61 Cb 0.18 0.76 -0.03 0.00 -0.74 0.00 0.00 36.82 36.99 2aw0 h ILE 61 CO -0.01 0.41 0.33 -0.33 0.00 0.00 0.00 178.15 178.55 2aw0 h GLU 62 N 0.98 1.09 -0.74 2.37 5.08 -0.78 -1.17 114.58 121.41 2aw0 h GLU 62 Ca 0.18 -0.17 -0.03 0.00 -1.00 0.00 0.00 59.36 58.34 2aw0 h GLU 62 Cb 0.53 -0.19 -0.03 0.00 0.50 0.00 0.00 28.75 29.56 2aw0 h GLU 62 CO 0.03 0.86 0.35 0.22 -1.00 0.00 0.00 179.01 179.47 2aw0 h ASP 63 N 1.07 0.97 -0.16 1.42 3.58 -0.50 -2.50 116.42 120.31 2aw0 h ASP 63 Ca 0.26 -0.14 0.00 0.00 0.42 0.00 0.00 57.03 57.57 2aw0 h ASP 63 Cb 0.16 -0.25 -0.01 0.00 1.72 0.00 0.00 39.33 40.95 2aw0 h ASP 63 CO -0.03 0.83 0.10 0.24 -2.88 0.00 0.00 179.24 177.51 2aw0 h MET 64 N 1.04 0.21 0.00 0.28 2.86 -1.03 -3.48 114.93 114.81 2aw0 h MET 64 Ca 0.25 -0.02 0.00 0.00 -2.06 0.00 0.00 59.70 57.88 2aw0 h MET 64 Cb 0.12 -0.05 0.00 0.00 0.06 0.00 0.00 31.60 31.74 2aw0 h MET 64 CO -0.03 0.17 0.00 0.41 1.06 0.00 0.00 176.91 178.51 2aw0 n GLY 65 N -1.06 0.05 2.99 8.32 0.00 -0.47 -5.11 105.19 109.91 2aw0 n GLY 65 Ca -0.04 -0.52 -0.09 0.00 0.00 0.00 0.00 46.02 45.37 2aw0 n GLY 65 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2aw0 s PHE 66 N 0.00 0.24 -1.10 1.61 0.08 -1.06 -5.00 117.98 112.75 2aw0 s PHE 66 Ca 0.00 -0.50 -0.21 0.00 0.12 0.00 0.00 56.93 56.34 2aw0 s PHE 66 Cb 0.00 -0.18 0.06 0.00 -0.57 0.00 0.00 43.02 42.33 2aw0 s PHE 66 CO 0.00 -0.20 1.52 -0.51 -0.10 0.00 0.00 175.22 175.94 2aw0 s ASP 67 N -1.45 6.60 -0.10 1.36 1.01 -0.08 -3.87 116.67 120.15 2aw0 s ASP 67 Ca -0.16 -1.75 -0.07 0.00 0.71 0.00 0.00 52.55 51.28 2aw0 s ASP 67 Cb -0.10 -2.57 -0.04 0.00 1.01 0.00 0.00 42.92 41.22 2aw0 s ASP 67 CO -0.01 -1.40 0.16 0.00 0.21 0.00 0.00 175.17 174.14 2aw0 s ALA 68 N 4.69 3.88 0.11 5.23 0.00 -1.26 -1.28 121.76 133.13 2aw0 s ALA 68 Ca 0.48 -0.63 -0.12 0.00 0.00 0.00 0.00 51.96 51.69 2aw0 s ALA 68 Cb 0.01 -1.99 0.02 0.00 0.00 0.00 0.00 23.12 21.16 2aw0 s ALA 68 CO -0.05 0.63 0.30 -0.08 0.00 0.00 0.00 175.76 176.56 2aw0 s THR 69 N -1.07 0.10 0.61 0.00 -1.32 -0.51 -4.98 115.64 108.47 2aw0 s THR 69 Ca 0.17 -0.89 -0.09 0.00 -1.21 0.00 0.00 61.69 59.68 2aw0 s THR 69 Cb -0.12 -1.27 -0.01 0.00 -1.51 0.00 0.00 72.50 69.58 2aw0 s THR 69 CO 0.06 -0.48 0.97 -0.76 -2.21 0.00 0.00 174.62 172.21 2aw0 s LEU 70 N -2.84 3.22 -1.42 9.08 2.01 -1.26 -0.11 118.68 127.36 2aw0 s LEU 70 Ca 0.04 1.10 -0.14 0.00 0.01 0.00 0.00 54.13 55.14 2aw0 s LEU 70 Cb 0.03 -4.02 0.01 0.00 0.01 0.00 0.00 46.19 42.23 2aw0 s LEU 70 CO -0.11 -0.98 2.27 -1.20 1.01 0.00 0.00 176.35 177.34 2aw0 n SER 71 N -2.69 4.22 0.00 2.29 7.64 -0.88 -4.71 113.62 119.50 2aw0 n SER 71 Ca 0.05 -2.80 0.00 0.00 1.01 0.00 0.00 58.87 57.13 2aw0 n SER 71 Cb 0.56 -1.61 0.00 0.00 -1.01 0.00 0.00 64.21 62.15 2aw0 n SER 71 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50