#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 1.16 0.25 1.47 -4.23 -1.26 -4.33 115.64 108.70 2aw0 s THR 2 Ca 0.00 -0.75 0.01 0.00 -1.18 0.00 0.00 61.69 59.77 2aw0 s THR 2 Cb 0.00 -0.99 -0.05 0.00 1.34 0.00 0.00 72.50 72.80 2aw0 s THR 2 CO 0.00 0.23 0.11 -1.10 -0.54 0.00 0.00 174.62 173.32 2aw0 s GLN 3 N -0.59 1.39 -0.03 3.99 -1.52 -0.27 -4.98 119.66 117.64 2aw0 s GLN 3 Ca 0.05 -1.75 -0.01 0.00 -1.95 0.00 0.00 55.36 51.69 2aw0 s GLN 3 Cb -0.06 -0.14 0.03 0.00 -0.22 0.00 0.00 33.01 32.62 2aw0 s GLN 3 CO 0.00 -0.33 0.05 -2.00 -0.25 0.00 0.00 175.29 172.76 2aw0 s GLU 4 N -4.04 -0.06 -0.10 2.91 2.12 -1.26 -1.16 118.70 117.11 2aw0 s GLU 4 Ca 0.38 0.31 0.01 0.00 0.36 0.00 0.00 54.97 56.03 2aw0 s GLU 4 Cb 0.07 -0.40 -0.02 0.00 0.26 0.00 0.00 34.13 34.04 2aw0 s GLU 4 CO 0.14 -0.27 -0.12 -0.08 -0.54 0.00 0.00 175.26 174.39 2aw0 s THR 5 N 1.75 3.24 -0.23 -1.70 -1.32 -0.46 -4.97 115.64 111.93 2aw0 s THR 5 Ca -0.01 -0.63 -0.11 0.00 -1.21 0.00 0.00 61.69 59.74 2aw0 s THR 5 Cb -0.12 -2.33 -0.05 0.00 -1.51 0.00 0.00 72.50 68.49 2aw0 s THR 5 CO -0.03 0.55 0.18 -0.69 -2.21 0.00 0.00 174.62 172.42 2aw0 s VAL 6 N -0.19 5.35 -0.18 5.08 1.01 -1.26 -1.06 120.40 129.17 2aw0 s VAL 6 Ca 0.01 0.22 0.01 0.00 0.00 0.00 0.00 61.98 62.22 2aw0 s VAL 6 Cb -0.13 -3.52 0.02 0.00 0.00 0.00 0.00 36.38 32.75 2aw0 s VAL 6 CO 0.03 0.34 -0.19 -0.63 0.00 0.00 0.00 175.10 174.66 2aw0 s ILE 7 N 1.04 1.96 -0.03 2.22 1.01 -0.48 -1.00 121.20 125.92 2aw0 s ILE 7 Ca 0.08 -0.89 -0.30 0.00 0.00 0.00 0.00 60.65 59.54 2aw0 s ILE 7 Cb -0.13 -1.79 -0.04 0.00 0.01 0.00 0.00 42.46 40.50 2aw0 s ILE 7 CO 0.04 0.51 1.26 0.20 0.00 0.00 0.00 174.94 176.95 2aw0 s ASN 8 N 1.33 6.99 -0.30 3.58 0.01 0.20 -0.67 114.94 126.09 2aw0 s ASN 8 Ca 0.05 1.92 0.02 0.00 -0.71 0.00 0.00 52.86 54.13 2aw0 s ASN 8 Cb -0.13 -2.56 0.07 0.00 0.41 0.00 0.00 41.25 39.04 2aw0 s ASN 8 CO -0.12 -0.62 -0.03 -0.63 -1.51 0.00 0.00 177.10 174.19 2aw0 s ILE 9 N 2.18 2.47 -0.15 0.60 1.01 -0.32 -1.35 121.20 125.64 2aw0 s ILE 9 Ca 0.58 -1.74 -0.09 0.00 0.00 0.00 0.00 60.65 59.41 2aw0 s ILE 9 Cb -0.27 -2.53 -0.04 0.00 0.01 0.00 0.00 42.46 39.62 2aw0 s ILE 9 CO 0.24 -0.20 0.14 -1.81 0.00 0.00 0.00 174.94 173.31 2aw0 s ASP 10 N 1.15 6.32 0.00 3.58 1.01 -0.33 -4.22 116.67 124.18 2aw0 s ASP 10 Ca -0.03 0.38 0.00 0.00 0.71 0.00 0.00 52.55 53.61 2aw0 s ASP 10 Cb -0.20 -2.08 0.00 0.00 1.01 0.00 0.00 42.92 41.65 2aw0 s ASP 10 CO -0.05 0.30 0.00 0.61 0.21 0.00 0.00 175.17 176.25 2aw0 n GLY 11 N 2.67 0.96 3.55 0.21 0.00 -1.26 -1.43 105.19 109.89 2aw0 n GLY 11 Ca -0.18 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.43 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 -0.17 3.12 -0.00 1.61 -1.94 -1.26 -4.84 119.30 115.81 2aw0 s MET 12 Ca 0.00 -0.12 -0.04 0.00 -1.71 0.00 0.00 55.69 53.83 2aw0 s MET 12 Cb 0.00 -4.21 -0.28 0.00 2.01 0.00 0.00 34.83 32.35 2aw0 s MET 12 CO 0.00 -2.22 0.85 1.15 -0.01 0.00 0.00 175.02 174.78 2aw0 h THR 13 N 6.15 1.14 -3.63 2.05 2.02 -1.98 -3.48 112.91 115.18 2aw0 h THR 13 Ca -0.28 -2.77 -0.17 0.00 0.77 0.00 0.00 66.41 63.96 2aw0 h THR 13 Cb 1.07 2.76 -0.04 0.00 -1.74 0.00 0.00 68.15 70.20 2aw0 h THR 13 CO 1.27 0.82 0.03 0.00 0.37 0.00 0.00 175.52 178.01 2aw0 h ASN 15 N 2.04 0.01 -0.70 0.00 2.35 -2.00 -1.58 115.58 115.70 2aw0 h ASN 15 Ca -0.30 0.00 0.08 0.00 -0.55 0.00 0.00 56.30 55.53 2aw0 h ASN 15 Cb 1.24 -0.00 -0.07 0.00 0.05 0.00 0.00 38.32 39.55 2aw0 h ASN 15 CO 0.40 0.01 0.37 0.28 -1.65 0.00 0.00 177.43 176.84 2aw0 h SER 16 N 0.01 0.51 0.29 5.81 0.02 -1.99 -0.63 113.55 117.58 2aw0 h SER 16 Ca 0.18 0.05 -0.01 0.00 -0.84 0.00 0.00 61.79 61.16 2aw0 h SER 16 Cb 0.70 -0.04 0.00 0.00 0.14 0.00 0.00 62.40 63.20 2aw0 h SER 16 CO -0.00 0.31 -0.14 0.00 -1.14 0.00 0.00 176.83 175.85 2aw0 h VAL 18 N -0.48 0.19 -0.25 0.00 2.07 -1.47 -1.15 116.25 115.16 2aw0 h VAL 18 Ca -0.04 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.46 2aw0 h VAL 18 Cb 0.36 0.19 -0.01 0.00 -1.52 0.00 0.00 31.29 30.31 2aw0 h VAL 18 CO 0.07 0.00 0.10 -0.61 0.02 0.00 0.00 177.57 177.14 2aw0 h GLN 19 N -0.42 0.38 -0.00 1.57 5.75 -1.11 -1.38 115.11 119.89 2aw0 h GLN 19 Ca 0.10 -0.07 -0.00 0.00 -0.15 0.00 0.00 58.65 58.53 2aw0 h GLN 19 Cb 0.59 -0.06 -0.00 0.00 1.07 0.00 0.00 27.48 29.08 2aw0 h GLN 19 CO -0.42 0.42 0.00 0.66 -2.65 0.00 0.00 178.83 176.84 2aw0 h SER 20 N 0.25 0.00 0.22 -0.69 4.64 -0.91 -0.54 113.55 116.52 2aw0 h SER 20 Ca 0.08 -0.05 0.01 0.00 -0.47 0.00 0.00 61.79 61.36 2aw0 h SER 20 Cb 0.19 -0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.25 2aw0 h SER 20 CO -0.01 0.05 -0.29 0.40 -0.87 0.00 0.00 176.83 176.11 2aw0 h ILE 21 N -0.04 0.38 -0.12 0.95 2.04 -1.20 -1.24 117.51 118.28 2aw0 h ILE 21 Ca 0.00 0.00 0.05 0.00 1.00 0.00 0.00 64.86 65.91 2aw0 h ILE 21 Cb 0.05 0.38 -0.06 0.00 -0.74 0.00 0.00 36.82 36.45 2aw0 h ILE 21 CO -0.00 0.00 -0.28 -0.08 0.00 0.00 0.00 178.15 177.78 2aw0 h GLU 22 N -0.57 -0.35 0.21 2.37 4.81 -1.05 -0.68 114.58 119.31 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 0.55 0.08 0.00 0.00 0.63 0.00 0.00 28.75 30.01 2aw0 h GLU 22 CO -0.11 -0.23 -0.10 0.78 -0.73 0.00 0.00 179.01 178.62 2aw0 h GLY 23 N -0.36 -0.29 0.82 1.92 0.00 -1.05 -2.18 103.07 101.92 2aw0 h GLY 23 Ca 0.09 0.11 -0.00 0.00 0.00 0.00 0.00 47.33 47.53 2aw0 h GLY 23 CO -0.32 -0.11 0.02 -2.08 0.00 0.00 0.00 176.54 174.05 2aw0 h VAL 24 N -0.34 1.17 -0.27 4.60 2.07 -1.05 -3.02 116.25 119.42 2aw0 h VAL 24 Ca -0.03 -0.51 -0.06 0.00 0.82 0.00 0.00 66.70 66.93 2aw0 h VAL 24 Cb 0.26 1.41 -0.02 0.00 -1.52 0.00 0.00 31.29 31.42 2aw0 h VAL 24 CO 0.05 0.14 -0.08 0.40 0.02 0.00 0.00 177.57 178.10 2aw0 h ILE 25 N -0.11 1.20 -0.30 4.57 1.08 -1.18 -2.64 117.51 120.14 2aw0 h ILE 25 Ca 0.02 -0.87 0.09 0.00 -0.39 0.00 0.00 64.86 63.70 2aw0 h ILE 25 Cb 0.21 1.09 -0.01 0.00 -3.07 0.00 0.00 36.82 35.04 2aw0 h ILE 25 CO -0.00 0.29 0.38 -1.28 -0.69 0.00 0.00 178.15 176.85 2aw0 h SER 26 N 0.41 0.00 0.48 1.72 0.87 -1.25 -2.12 113.55 113.66 2aw0 h SER 26 Ca 0.08 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.64 2aw0 h SER 26 Cb 0.40 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.36 2aw0 h SER 26 CO 0.02 0.00 -0.36 0.29 -0.53 0.00 0.00 176.83 176.25 2aw0 n LYS 27 N -3.59 0.26 -2.41 2.24 5.02 -0.99 -4.76 118.16 113.93 2aw0 n LYS 27 Ca 0.05 -0.14 -0.42 0.00 -2.02 0.00 0.00 58.31 55.78 2aw0 n LYS 27 Cb 0.52 -1.50 -0.03 0.00 -0.02 0.00 0.00 35.03 34.01 2aw0 n LYS 27 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 2aw0 s LYS 28 N -2.83 4.39 0.14 1.97 3.01 -0.80 -4.97 119.74 120.66 2aw0 s LYS 28 Ca 0.16 1.77 -0.34 0.00 -1.01 0.00 0.00 55.97 56.55 2aw0 s LYS 28 Cb 0.18 -3.43 -0.16 0.00 -1.01 0.00 0.00 37.83 33.41 2aw0 s LYS 28 CO 0.62 -0.35 1.13 -2.30 0.51 0.00 0.00 175.35 174.96 2aw0 n PRO 29 N 4.43 0.94 0.00 -1.68 -0.02 -1.26 -1.86 135.00 135.55 2aw0 n PRO 29 Ca 0.10 0.34 0.00 0.00 -2.02 0.00 0.00 63.50 61.92 2aw0 n PRO 29 Cb 0.46 -1.81 0.00 0.00 -0.02 0.00 0.00 33.50 32.12 2aw0 n PRO 29 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2aw0 n GLY 30 N 2.01 3.08 3.72 -1.23 0.00 -1.26 -4.18 105.19 107.33 2aw0 n GLY 30 Ca 0.16 -0.89 -0.42 0.00 0.00 0.00 0.00 46.02 44.87 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 -0.67 3.03 0.00 1.61 1.01 -0.78 -1.47 120.40 123.13 2aw0 s VAL 31 Ca 0.00 0.75 0.00 0.00 0.00 0.00 0.00 61.98 62.73 2aw0 s VAL 31 Cb 0.00 -3.48 0.00 0.00 0.00 0.00 0.00 36.38 32.90 2aw0 s VAL 31 CO 0.00 0.06 0.00 0.29 0.00 0.00 0.00 175.10 175.45 2aw0 n LYS 32 N 3.81 0.00 -3.15 2.72 5.02 -0.35 -4.87 118.16 121.34 2aw0 n LYS 32 Ca 0.12 0.00 -0.29 0.00 -2.02 0.00 0.00 58.31 56.12 2aw0 n LYS 32 Cb 0.41 0.00 -0.03 0.00 -0.02 0.00 0.00 35.03 35.39 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 -0.46 6.46 -0.15 4.39 1.04 -1.25 -4.95 113.70 118.78 2aw0 s SER 33 Ca 0.00 0.86 -0.11 0.00 0.48 0.00 0.00 55.95 57.18 2aw0 s SER 33 Cb 0.00 -2.21 0.04 0.00 0.10 0.00 0.00 66.02 63.96 2aw0 s SER 33 CO 0.00 -0.28 0.37 -0.51 0.98 0.00 0.00 173.24 173.80 2aw0 s ILE 34 N -2.21 -0.01 -0.38 -1.02 2.07 -1.26 -1.03 121.20 117.35 2aw0 s ILE 34 Ca 0.46 0.05 0.01 0.00 -1.41 0.00 0.00 60.65 59.76 2aw0 s ILE 34 Cb -0.11 -0.53 0.12 0.00 0.13 0.00 0.00 42.46 42.07 2aw0 s ILE 34 CO 0.31 0.02 0.18 -0.13 -1.91 0.00 0.00 174.94 173.41 2aw0 s ARG 35 N 0.73 0.99 -0.00 3.50 0.52 -0.58 -5.00 118.95 119.11 2aw0 s ARG 35 Ca -0.04 -1.57 -0.11 0.00 -0.52 0.00 0.00 55.73 53.49 2aw0 s ARG 35 Cb -0.05 -2.10 -0.05 0.00 0.52 0.00 0.00 34.95 33.26 2aw0 s ARG 35 CO -0.05 -1.10 0.34 0.08 0.02 0.00 0.00 175.30 174.59 2aw0 s VAL 36 N 0.92 5.17 -0.09 3.52 1.01 -1.26 -1.36 120.40 128.31 2aw0 s VAL 36 Ca 0.15 0.54 -0.04 0.00 0.00 0.00 0.00 61.98 62.62 2aw0 s VAL 36 Cb -0.22 -3.62 0.05 0.00 0.00 0.00 0.00 36.38 32.59 2aw0 s VAL 36 CO -0.09 0.48 0.20 -0.55 0.00 0.00 0.00 175.10 175.14 2aw0 s SER 37 N -1.33 0.14 0.06 3.32 0.15 -0.49 -4.99 113.70 110.56 2aw0 s SER 37 Ca 0.25 0.43 -0.18 0.00 0.70 0.00 0.00 55.95 57.15 2aw0 s SER 37 Cb -0.15 0.37 -0.14 0.00 -1.71 0.00 0.00 66.02 64.39 2aw0 s SER 37 CO 0.13 -0.19 1.31 0.25 1.20 0.00 0.00 173.24 175.94 2aw0 h LEU 38 N 7.70 0.59 -0.82 3.45 6.46 -1.93 0.90 115.31 131.65 2aw0 h LEU 38 Ca -0.30 -0.55 0.14 0.00 -0.12 0.00 0.00 57.88 57.05 2aw0 h LEU 38 Cb 1.13 -0.17 -0.09 0.00 -0.73 0.00 0.00 40.66 40.80 2aw0 h LEU 38 CO 0.29 1.03 0.40 0.00 -0.62 0.00 0.00 178.44 179.54 2aw0 h ALA 39 N 0.57 1.22 0.00 1.25 0.00 -1.96 -0.88 119.26 119.46 2aw0 h ALA 39 Ca 0.01 0.09 -0.02 0.00 0.00 0.00 0.00 54.91 54.99 2aw0 h ALA 39 Cb 0.93 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.73 2aw0 h ALA 39 CO 0.07 -0.12 -1.00 -0.91 0.00 0.00 0.00 179.25 177.30 2aw0 h ASN 40 N 0.58 0.00 -5.72 0.00 2.35 -1.99 -3.48 115.58 107.31 2aw0 h ASN 40 Ca 0.45 0.00 -0.33 0.00 -0.55 0.00 0.00 56.30 55.87 2aw0 h ASN 40 Cb 0.64 0.00 0.15 0.00 0.05 0.00 0.00 38.32 39.16 2aw0 h ASN 40 CO -0.37 0.08 -0.83 -1.20 -1.65 0.00 0.00 177.43 173.46 2aw0 n SER 41 N -2.73 -3.89 -3.82 5.81 7.64 0.21 -4.93 113.62 111.90 2aw0 n SER 41 Ca -0.01 -0.73 -0.09 0.00 1.01 0.00 0.00 58.87 59.05 2aw0 n SER 41 Cb 0.59 -4.77 -0.04 0.00 -1.01 0.00 0.00 64.21 58.98 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 -3.91 -0.07 -0.16 6.43 2.20 -0.63 -1.17 114.94 117.63 2aw0 s ASN 42 Ca 0.22 -0.89 -0.01 0.00 -0.94 0.00 0.00 52.86 51.24 2aw0 s ASN 42 Cb -0.04 0.66 0.05 0.00 -2.00 0.00 0.00 41.25 39.91 2aw0 s ASN 42 CO 0.76 -1.26 -0.03 -0.83 -2.94 0.00 0.00 177.10 172.81 2aw0 s GLY 43 N -3.01 0.86 -0.66 0.45 0.00 0.16 -1.40 107.32 103.72 2aw0 s GLY 43 Ca 0.19 -0.74 -0.15 0.00 0.00 0.00 0.00 44.72 44.01 2aw0 s GLY 43 CO 0.09 1.08 0.63 -1.59 0.00 0.00 0.00 173.10 173.31 2aw0 s THR 44 N 1.71 5.33 -0.26 0.90 2.01 -0.46 -1.38 115.64 123.49 2aw0 s THR 44 Ca 0.00 -1.85 -0.10 0.00 0.31 0.00 0.00 61.69 60.05 2aw0 s THR 44 Cb -0.15 -4.41 -0.05 0.00 0.01 0.00 0.00 72.50 67.90 2aw0 s THR 44 CO -0.07 -0.96 0.16 -0.69 -0.69 0.00 0.00 174.62 172.37 2aw0 s VAL 45 N 1.14 5.21 -0.13 3.82 1.01 -0.22 -1.52 120.40 129.71 2aw0 s VAL 45 Ca 0.10 0.13 -0.20 0.00 0.00 0.00 0.00 61.98 62.01 2aw0 s VAL 45 Cb -0.21 -3.46 -0.04 0.00 0.00 0.00 0.00 36.38 32.67 2aw0 s VAL 45 CO -0.02 0.30 0.57 -0.70 0.00 0.00 0.00 175.10 175.25 2aw0 s GLU 46 N 1.46 4.33 0.18 2.72 2.12 -0.20 -1.35 118.70 127.95 2aw0 s GLU 46 Ca 0.07 0.60 -0.12 0.00 0.36 0.00 0.00 54.97 55.88 2aw0 s GLU 46 Cb -0.15 -3.48 0.00 0.00 0.26 0.00 0.00 34.13 30.77 2aw0 s GLU 46 CO 0.08 0.03 0.37 1.52 -0.54 0.00 0.00 175.26 176.71 2aw0 s TYR 47 N 1.02 0.24 -0.35 5.30 1.13 -0.31 -1.21 117.35 123.16 2aw0 s TYR 47 Ca 0.30 -0.60 -0.13 0.00 -1.41 0.00 0.00 57.07 55.23 2aw0 s TYR 47 Cb -0.16 0.09 -0.00 0.00 -1.10 0.00 0.00 41.96 40.79 2aw0 s TYR 47 CO 0.12 -0.79 0.23 0.34 -2.51 0.00 0.00 175.55 172.95 2aw0 s ASP 48 N -2.94 5.95 0.36 -0.18 -1.08 -0.54 -1.12 116.67 117.11 2aw0 s ASP 48 Ca 0.15 -0.61 0.16 0.00 -0.52 0.00 0.00 52.55 51.74 2aw0 s ASP 48 Cb 0.02 -2.11 1.10 0.00 -1.46 0.00 0.00 42.92 40.48 2aw0 s ASP 48 CO -0.00 -0.29 1.68 -0.65 0.52 0.00 0.00 175.17 176.43 2aw0 h PRO 49 N 8.49 0.33 0.00 4.34 0.11 -1.75 -1.51 132.00 142.01 2aw0 h PRO 49 Ca -0.30 -0.02 -0.04 0.00 0.11 0.00 0.00 66.00 65.75 2aw0 h PRO 49 Cb 1.14 -0.07 -0.01 0.00 0.11 0.00 0.00 31.00 32.17 2aw0 h PRO 49 CO 0.65 0.22 -0.17 -0.07 -0.21 0.00 0.00 178.00 178.42 2aw0 h LEU 50 N 0.34 0.00 0.00 2.35 3.38 -1.95 -3.25 115.31 116.19 2aw0 h LEU 50 Ca 0.71 0.00 -0.40 0.00 0.09 0.00 0.00 57.88 58.28 2aw0 h LEU 50 Cb 1.70 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 42.38 2aw0 h LEU 50 CO -0.52 0.17 -2.47 0.18 0.09 0.00 0.00 178.44 175.90 2aw0 n LEU 51 N -4.17 2.78 -3.94 1.67 7.99 -0.65 -5.04 117.00 115.65 2aw0 n LEU 51 Ca -0.02 -0.04 -0.09 0.00 -0.01 0.00 0.00 56.01 55.85 2aw0 n LEU 51 Cb 0.25 -0.90 -0.09 0.00 -0.11 0.00 0.00 43.42 42.56 2aw0 n LEU 51 CO 0.35 0.87 -0.21 0.28 -1.51 0.00 0.00 177.39 177.17 2aw0 s THR 52 N -2.52 0.15 0.31 -5.08 -1.32 -0.73 -4.84 115.64 101.61 2aw0 s THR 52 Ca -0.35 -1.24 0.10 0.00 -1.21 0.00 0.00 61.69 58.99 2aw0 s THR 52 Cb 0.10 -1.11 -0.05 0.00 -1.51 0.00 0.00 72.50 69.92 2aw0 s THR 52 CO 0.59 -0.69 -0.08 -0.94 -2.21 0.00 0.00 174.62 171.29 2aw0 s SER 53 N -2.44 3.96 0.28 8.08 1.04 -1.26 -3.71 113.70 119.65 2aw0 s SER 53 Ca -0.00 -1.00 0.02 0.00 0.48 0.00 0.00 55.95 55.45 2aw0 s SER 53 Cb 0.02 -0.47 0.64 0.00 0.10 0.00 0.00 66.02 66.31 2aw0 s SER 53 CO -0.07 -0.11 1.75 -0.65 0.98 0.00 0.00 173.24 175.14 2aw0 h PRO 54 N 2.01 0.61 -0.68 4.02 0.11 -1.96 -1.88 132.00 134.21 2aw0 h PRO 54 Ca -0.42 -0.04 -0.04 0.00 0.11 0.00 0.00 66.00 65.61 2aw0 h PRO 54 Cb 1.25 -0.14 -0.03 0.00 0.11 0.00 0.00 31.00 32.20 2aw0 h PRO 54 CO 0.65 0.40 0.26 0.93 -0.21 0.00 0.00 178.00 180.03 2aw0 h GLU 55 N 0.62 1.03 -0.10 1.05 4.39 -1.98 0.12 114.58 119.72 2aw0 h GLU 55 Ca 0.52 -0.19 0.00 0.00 0.34 0.00 0.00 59.36 60.03 2aw0 h GLU 55 Cb 0.81 -0.16 -0.01 0.00 -0.10 0.00 0.00 28.75 29.29 2aw0 h GLU 55 CO -0.40 0.86 0.05 1.15 -1.16 0.00 0.00 179.01 179.51 2aw0 h THR 56 N 0.98 1.00 -0.36 1.13 2.02 -1.77 -0.28 112.91 115.64 2aw0 h THR 56 Ca 0.23 -0.04 -0.02 0.00 0.77 0.00 0.00 66.41 67.35 2aw0 h THR 56 Cb 0.22 0.88 -0.02 0.00 -1.74 0.00 0.00 68.15 67.50 2aw0 h THR 56 CO -0.02 0.02 0.16 -0.07 0.37 0.00 0.00 175.52 175.99 2aw0 h LEU 57 N 0.11 0.48 -0.21 2.58 3.38 -1.19 -0.78 115.31 119.68 2aw0 h LEU 57 Ca 0.04 -0.14 0.05 0.00 0.09 0.00 0.00 57.88 57.91 2aw0 h LEU 57 Cb 0.00 -0.12 -0.05 0.00 0.09 0.00 0.00 40.66 40.58 2aw0 h LEU 57 CO -0.02 0.49 -0.09 -0.09 0.09 0.00 0.00 178.44 178.82 2aw0 h ARG 58 N 0.44 -0.05 -0.80 1.13 2.43 -0.88 -1.57 114.38 115.08 2aw0 h ARG 58 Ca 0.12 0.00 0.08 0.00 -0.81 0.00 0.00 59.98 59.38 2aw0 h ARG 58 Cb 0.14 0.01 -0.07 0.00 -0.42 0.00 0.00 29.97 29.64 2aw0 h ARG 58 CO -0.01 -0.03 0.46 0.78 -1.51 0.00 0.00 179.97 179.65 2aw0 h GLY 59 N -0.05 1.22 1.12 2.80 0.00 -0.71 0.05 103.07 107.50 2aw0 h GLY 59 Ca 0.11 -0.31 -0.05 0.00 0.00 0.00 0.00 47.33 47.08 2aw0 h GLY 59 CO -0.25 0.16 0.28 0.00 0.00 0.00 0.00 176.54 176.73 2aw0 h ALA 60 N 1.42 1.09 -0.26 3.60 0.00 -0.68 -0.60 119.26 123.84 2aw0 h ALA 60 Ca 0.37 -0.20 -0.14 0.00 0.00 0.00 0.00 54.91 54.95 2aw0 h ALA 60 Cb 0.29 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 2aw0 h ALA 60 CO -0.22 0.64 -0.42 0.82 0.00 0.00 0.00 179.25 180.07 2aw0 h ILE 61 N 1.08 1.30 -0.90 0.00 2.04 -0.48 -1.01 117.51 119.54 2aw0 h ILE 61 Ca 0.25 -1.59 0.01 0.00 1.00 0.00 0.00 64.86 64.53 2aw0 h ILE 61 Cb 0.23 1.54 -0.05 0.00 -0.74 0.00 0.00 36.82 37.81 2aw0 h ILE 61 CO -0.02 0.51 0.60 -0.33 0.00 0.00 0.00 178.15 178.90 2aw0 h GLU 62 N 0.52 1.17 -0.65 2.37 4.39 -0.70 -0.94 114.58 120.74 2aw0 h GLU 62 Ca 0.04 -0.07 -0.04 0.00 0.34 0.00 0.00 59.36 59.63 2aw0 h GLU 62 Cb 0.94 -0.26 -0.03 0.00 -0.10 0.00 0.00 28.75 29.29 2aw0 h GLU 62 CO 0.08 0.78 0.26 0.22 -1.16 0.00 0.00 179.01 179.19 2aw0 h ASP 63 N 1.21 0.90 -0.95 1.42 3.58 -0.73 -2.22 116.42 119.63 2aw0 h ASP 63 Ca 0.33 -0.17 0.05 0.00 0.42 0.00 0.00 57.03 57.67 2aw0 h ASP 63 Cb -0.12 -0.23 -0.06 0.00 1.72 0.00 0.00 39.33 40.63 2aw0 h ASP 63 CO -0.08 0.83 0.61 0.24 -2.88 0.00 0.00 179.24 177.96 2aw0 h MET 64 N 0.92 1.10 0.00 0.28 2.86 -0.84 -3.47 114.93 115.78 2aw0 h MET 64 Ca 0.22 -0.07 0.00 0.00 -2.06 0.00 0.00 59.70 57.79 2aw0 h MET 64 Cb 0.20 -0.25 0.00 0.00 0.06 0.00 0.00 31.60 31.62 2aw0 h MET 64 CO -0.02 0.73 0.00 0.41 1.06 0.00 0.00 176.91 179.09 2aw0 n GLY 65 N -1.35 0.65 3.00 8.32 0.00 -0.39 -5.10 105.19 110.32 2aw0 n GLY 65 Ca 0.14 -0.47 -0.09 0.00 0.00 0.00 0.00 46.02 45.60 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 -0.25 0.27 -0.87 1.61 0.40 -1.05 -5.02 117.98 113.07 2aw0 s PHE 66 Ca 0.00 -0.55 -0.25 0.00 -0.60 0.00 0.00 56.93 55.53 2aw0 s PHE 66 Cb 0.00 -0.20 0.02 0.00 0.51 0.00 0.00 43.02 43.35 2aw0 s PHE 66 CO 0.00 -0.22 1.53 0.34 0.70 0.00 0.00 175.22 177.57 2aw0 s ASP 67 N -1.61 6.03 -0.16 1.36 2.15 -0.51 -3.95 116.67 119.98 2aw0 s ASP 67 Ca -0.14 -0.81 -0.09 0.00 0.43 0.00 0.00 52.55 51.94 2aw0 s ASP 67 Cb -0.08 -2.56 -0.05 0.00 -0.30 0.00 0.00 42.92 39.93 2aw0 s ASP 67 CO -0.02 -1.91 0.14 0.00 -0.17 0.00 0.00 175.17 173.22 2aw0 s ALA 68 N 6.52 3.76 -0.08 3.66 0.00 -1.26 -1.18 121.76 133.18 2aw0 s ALA 68 Ca 0.49 -0.65 -0.08 0.00 0.00 0.00 0.00 51.96 51.72 2aw0 s ALA 68 Cb -0.05 -2.10 0.02 0.00 0.00 0.00 0.00 23.12 20.99 2aw0 s ALA 68 CO 0.03 0.35 0.23 -0.08 0.00 0.00 0.00 175.76 176.28 2aw0 s THR 69 N -0.21 0.00 0.20 0.00 -1.32 -0.45 -4.98 115.64 108.87 2aw0 s THR 69 Ca 0.11 -0.03 -0.30 0.00 -1.21 0.00 0.00 61.69 60.26 2aw0 s THR 69 Cb -0.12 -0.33 -0.09 0.00 -1.51 0.00 0.00 72.50 70.46 2aw0 s THR 69 CO 0.01 -0.02 1.30 -0.76 -2.21 0.00 0.00 174.62 172.94 2aw0 s LEU 70 N 0.05 4.42 -0.15 9.08 1.43 -1.26 -0.63 118.68 131.61 2aw0 s LEU 70 Ca -0.01 2.40 -0.07 0.00 -1.03 0.00 0.00 54.13 55.42 2aw0 s LEU 70 Cb -0.02 -3.61 -0.24 0.00 0.03 0.00 0.00 46.19 42.35 2aw0 s LEU 70 CO 0.00 -0.51 0.24 -1.20 0.23 0.00 0.00 176.35 175.11 2aw0 n SER 71 N 2.54 2.08 0.00 2.29 7.64 -0.17 -4.82 113.62 123.17 2aw0 n SER 71 Ca 0.06 0.18 0.00 0.00 1.01 0.00 0.00 58.87 60.12 2aw0 n SER 71 Cb 0.43 -0.80 0.00 0.00 -1.01 0.00 0.00 64.21 62.83 2aw0 n SER 71 CO 0.00 0.00 0.00 -0.90 -3.01 0.00 0.00 175.04 171.13