#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 -0.04 0.16 -5.08 -4.23 -1.26 -4.35 115.64 100.83 2aw0 s THR 2 Ca 0.00 0.15 -0.06 0.00 -1.18 0.00 0.00 61.69 60.60 2aw0 s THR 2 Cb 0.00 -0.08 -0.02 0.00 1.34 0.00 0.00 72.50 73.74 2aw0 s THR 2 CO 0.00 0.06 0.22 -1.10 -0.54 0.00 0.00 174.62 173.26 2aw0 s GLN 3 N 0.76 1.11 0.09 3.99 -1.52 -0.30 -4.92 119.66 118.87 2aw0 s GLN 3 Ca -0.06 -1.28 0.06 0.00 -1.95 0.00 0.00 55.36 52.13 2aw0 s GLN 3 Cb -0.09 0.34 -0.03 0.00 -0.22 0.00 0.00 33.01 33.01 2aw0 s GLN 3 CO -0.02 -0.39 -0.16 -1.21 -0.25 0.00 0.00 175.29 173.27 2aw0 s GLU 4 N -4.00 0.92 0.03 2.91 2.02 -1.26 -1.26 118.70 118.06 2aw0 s GLU 4 Ca 0.21 -1.06 -0.14 0.00 0.02 0.00 0.00 54.97 54.00 2aw0 s GLU 4 Cb 0.04 -0.96 0.02 0.00 0.10 0.00 0.00 34.13 33.34 2aw0 s GLU 4 CO 0.02 0.21 0.30 -0.08 0.02 0.00 0.00 175.26 175.72 2aw0 s THR 5 N -1.44 0.08 -0.12 3.63 -1.32 -0.42 -5.02 115.64 111.04 2aw0 s THR 5 Ca 0.02 -0.65 0.02 0.00 -1.21 0.00 0.00 61.69 59.87 2aw0 s THR 5 Cb -0.09 -0.86 0.01 0.00 -1.51 0.00 0.00 72.50 70.05 2aw0 s THR 5 CO 0.03 -0.36 -0.17 -0.69 -2.21 0.00 0.00 174.62 171.22 2aw0 s VAL 6 N -2.27 1.68 -0.16 5.08 1.01 -1.26 -1.10 120.40 123.38 2aw0 s VAL 6 Ca -0.07 -0.75 0.01 0.00 0.00 0.00 0.00 61.98 61.17 2aw0 s VAL 6 Cb -0.02 -1.51 0.02 0.00 0.00 0.00 0.00 36.38 34.87 2aw0 s VAL 6 CO -0.02 0.48 -0.19 -0.63 0.00 0.00 0.00 175.10 174.74 2aw0 s ILE 7 N 0.92 1.91 0.15 2.22 1.01 -0.39 -0.77 121.20 126.26 2aw0 s ILE 7 Ca -0.07 -0.86 -0.31 0.00 0.00 0.00 0.00 60.65 59.41 2aw0 s ILE 7 Cb -0.15 -1.73 -0.09 0.00 0.01 0.00 0.00 42.46 40.50 2aw0 s ILE 7 CO -0.01 0.52 1.43 0.20 0.00 0.00 0.00 174.94 177.07 2aw0 s ASN 8 N 1.19 6.76 -0.25 3.58 -0.87 0.73 -0.66 114.94 125.43 2aw0 s ASN 8 Ca 0.01 2.44 0.01 0.00 -1.57 0.00 0.00 52.86 53.76 2aw0 s ASN 8 Cb -0.14 -2.60 0.06 0.00 -0.02 0.00 0.00 41.25 38.56 2aw0 s ASN 8 CO -0.09 -0.68 -0.05 -0.63 -2.57 0.00 0.00 177.10 173.08 2aw0 s ILE 9 N 0.86 1.69 0.07 0.60 1.01 -0.41 -1.47 121.20 123.55 2aw0 s ILE 9 Ca 0.64 -1.40 0.00 0.00 0.00 0.00 0.00 60.65 59.89 2aw0 s ILE 9 Cb -0.39 -1.96 -0.04 0.00 0.01 0.00 0.00 42.46 40.09 2aw0 s ILE 9 CO 0.33 -0.15 0.22 -0.62 0.00 0.00 0.00 174.94 174.72 2aw0 s ASP 10 N 1.31 6.36 0.00 3.58 2.15 -0.97 -4.19 116.67 124.90 2aw0 s ASP 10 Ca -0.04 0.27 0.00 0.00 0.43 0.00 0.00 52.55 53.21 2aw0 s ASP 10 Cb -0.19 -1.96 0.00 0.00 -0.30 0.00 0.00 42.92 40.47 2aw0 s ASP 10 CO -0.07 0.15 0.00 0.61 -0.17 0.00 0.00 175.17 175.69 2aw0 n GLY 11 N 0.20 0.83 3.64 2.66 0.00 -1.26 -2.74 105.19 108.51 2aw0 n GLY 11 Ca -0.05 -0.11 -0.43 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 -0.67 4.10 -0.07 1.61 -1.94 -1.26 -4.93 119.30 116.14 2aw0 s MET 12 Ca 0.00 1.16 -0.16 0.00 -1.71 0.00 0.00 55.69 54.98 2aw0 s MET 12 Cb 0.00 -3.73 -0.29 0.00 2.01 0.00 0.00 34.83 32.82 2aw0 s MET 12 CO 0.00 -0.85 0.68 1.15 -0.01 0.00 0.00 175.02 175.99 2aw0 h THR 13 N 5.68 1.14 -3.12 2.05 2.02 -1.99 -3.50 112.91 115.19 2aw0 h THR 13 Ca -0.21 -2.47 -0.08 0.00 0.77 0.00 0.00 66.41 64.42 2aw0 h THR 13 Cb 1.06 2.85 -0.01 0.00 -1.74 0.00 0.00 68.15 70.32 2aw0 h THR 13 CO 1.02 0.74 0.16 0.00 0.37 0.00 0.00 175.52 177.81 2aw0 h ASN 15 N 1.80 0.00 -0.62 0.00 -1.07 -2.00 -1.75 115.58 111.94 2aw0 h ASN 15 Ca -0.29 0.00 0.05 0.00 0.07 0.00 0.00 56.30 56.13 2aw0 h ASN 15 Cb 1.12 0.00 -0.05 0.00 -2.07 0.00 0.00 38.32 37.32 2aw0 h ASN 15 CO 0.38 0.00 0.35 -1.28 0.07 0.00 0.00 177.43 176.94 2aw0 h SER 16 N 0.00 0.53 0.10 6.14 0.87 -1.99 -0.70 113.55 118.50 2aw0 h SER 16 Ca 0.07 0.02 -0.00 0.00 -1.23 0.00 0.00 61.79 60.65 2aw0 h SER 16 Cb 0.37 -0.08 0.00 0.00 -0.44 0.00 0.00 62.40 62.25 2aw0 h SER 16 CO -0.00 0.35 -0.05 0.00 -0.53 0.00 0.00 176.83 176.60 2aw0 h VAL 18 N -0.20 0.36 0.00 0.00 2.07 -1.51 -0.43 116.25 116.54 2aw0 h VAL 18 Ca -0.01 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.53 2aw0 h VAL 18 Cb 0.16 0.36 -0.03 0.00 -1.52 0.00 0.00 31.29 30.27 2aw0 h VAL 18 CO 0.02 0.00 -0.12 -0.61 0.02 0.00 0.00 177.57 176.88 2aw0 h GLN 19 N -0.22 -0.20 0.37 1.57 4.15 -1.00 -1.11 115.11 118.67 2aw0 h GLN 19 Ca 0.16 0.01 -0.01 0.00 0.77 0.00 0.00 58.65 59.58 2aw0 h GLN 19 Cb 0.47 0.04 -0.00 0.00 0.21 0.00 0.00 27.48 28.20 2aw0 h GLN 19 CO -0.44 -0.13 -0.22 0.77 -1.93 0.00 0.00 178.83 176.87 2aw0 h SER 20 N -0.20 -0.56 0.15 -0.69 0.02 -0.82 -0.53 113.55 110.92 2aw0 h SER 20 Ca 0.04 0.03 0.02 0.00 -0.84 0.00 0.00 61.79 61.04 2aw0 h SER 20 Cb 0.26 0.17 -0.04 0.00 0.14 0.00 0.00 62.40 62.92 2aw0 h SER 20 CO -0.12 -0.36 -0.35 0.40 -1.14 0.00 0.00 176.83 175.26 2aw0 h ILE 21 N -0.57 0.27 0.02 3.27 2.04 -1.04 -1.16 117.51 120.34 2aw0 h ILE 21 Ca -0.04 0.00 0.03 0.00 1.00 0.00 0.00 64.86 65.85 2aw0 h ILE 21 Cb 0.47 0.27 -0.04 0.00 -0.74 0.00 0.00 36.82 36.78 2aw0 h ILE 21 CO 0.04 0.00 -0.22 -0.08 0.00 0.00 0.00 178.15 177.90 2aw0 h GLU 22 N -0.60 -0.34 0.21 2.37 4.81 -1.14 -1.44 114.58 118.45 2aw0 h GLU 22 Ca 0.02 0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.28 2aw0 h GLU 22 Cb 0.62 0.08 -0.02 0.00 0.63 0.00 0.00 28.75 30.06 2aw0 h GLU 22 CO -0.19 -0.23 -0.21 0.78 -0.73 0.00 0.00 179.01 178.43 2aw0 h GLY 23 N -0.35 -0.46 0.95 1.92 0.00 -0.94 -0.93 103.07 103.26 2aw0 h GLY 23 Ca 0.06 0.24 -0.01 0.00 0.00 0.00 0.00 47.33 47.61 2aw0 h GLY 23 CO -0.19 -0.20 -0.17 -2.08 0.00 0.00 0.00 176.54 173.90 2aw0 h VAL 24 N -0.46 0.64 -0.77 4.60 2.07 -1.14 -3.14 116.25 118.04 2aw0 h VAL 24 Ca -0.00 0.00 -0.05 0.00 0.82 0.00 0.00 66.70 67.47 2aw0 h VAL 24 Cb 0.43 0.64 -0.03 0.00 -1.52 0.00 0.00 31.29 30.80 2aw0 h VAL 24 CO -0.05 0.00 0.28 0.40 0.02 0.00 0.00 177.57 178.22 2aw0 h ILE 25 N -0.46 1.26 -1.01 4.57 2.04 -1.22 -2.28 117.51 120.43 2aw0 h ILE 25 Ca -0.04 -0.87 0.26 0.00 1.00 0.00 0.00 64.86 65.21 2aw0 h ILE 25 Cb 0.37 0.37 -0.08 0.00 -0.74 0.00 0.00 36.82 36.74 2aw0 h ILE 25 CO 0.05 0.35 0.67 -1.28 0.00 0.00 0.00 178.15 177.94 2aw0 h SER 26 N 1.14 0.34 0.54 1.72 0.87 -1.12 -1.93 113.55 115.11 2aw0 h SER 26 Ca 0.25 0.05 0.00 0.00 -1.23 0.00 0.00 61.79 60.87 2aw0 h SER 26 Cb 0.26 -0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.22 2aw0 h SER 26 CO -0.01 0.09 -0.44 0.29 -0.53 0.00 0.00 176.83 176.22 2aw0 n LYS 27 N -4.51 0.03 -2.38 2.24 5.02 -0.86 -4.70 118.16 113.01 2aw0 n LYS 27 Ca 0.23 -0.02 -0.41 0.00 -2.02 0.00 0.00 58.31 56.09 2aw0 n LYS 27 Cb 0.88 -1.50 -0.04 0.00 -0.02 0.00 0.00 35.03 34.35 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 -2.98 4.53 0.19 1.97 1.02 -0.73 -4.97 119.74 118.77 2aw0 s LYS 28 Ca 0.12 1.89 -0.32 0.00 0.02 0.00 0.00 55.97 57.69 2aw0 s LYS 28 Cb 0.18 -3.20 -0.16 0.00 -0.52 0.00 0.00 37.83 34.13 2aw0 s LYS 28 CO 0.68 0.02 1.05 -2.30 -0.92 0.00 0.00 175.35 173.88 2aw0 n PRO 29 N 1.77 1.01 0.00 -1.68 -0.02 -1.26 -2.26 135.00 132.56 2aw0 n PRO 29 Ca 0.02 0.36 0.00 0.00 -2.02 0.00 0.00 63.50 61.86 2aw0 n PRO 29 Cb 0.44 -1.77 0.00 0.00 -0.02 0.00 0.00 33.50 32.15 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 1.82 3.02 3.73 -1.23 0.00 -1.26 -4.42 105.19 106.84 2aw0 n GLY 30 Ca 0.14 -0.82 -0.41 0.00 0.00 0.00 0.00 46.02 44.93 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 -0.66 3.26 0.00 1.61 1.01 -0.96 -1.41 120.40 123.26 2aw0 s VAL 31 Ca 0.00 1.01 0.00 0.00 0.00 0.00 0.00 61.98 62.99 2aw0 s VAL 31 Cb 0.00 -3.65 0.00 0.00 0.00 0.00 0.00 36.38 32.73 2aw0 s VAL 31 CO 0.00 0.14 0.00 0.29 0.00 0.00 0.00 175.10 175.53 2aw0 n LYS 32 N 2.83 0.00 -3.37 2.72 5.02 -0.35 -4.85 118.16 120.16 2aw0 n LYS 32 Ca 0.07 0.00 -0.33 0.00 -2.02 0.00 0.00 58.31 56.03 2aw0 n LYS 32 Cb 0.43 0.00 -0.06 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 -0.27 6.68 -0.10 4.39 1.04 -1.24 -4.91 113.70 119.28 2aw0 s SER 33 Ca 0.00 0.99 -0.14 0.00 0.48 0.00 0.00 55.95 57.28 2aw0 s SER 33 Cb 0.00 -2.25 0.03 0.00 0.10 0.00 0.00 66.02 63.90 2aw0 s SER 33 CO 0.00 -0.05 0.37 -0.51 0.98 0.00 0.00 173.24 174.02 2aw0 s ILE 34 N -1.77 0.02 -0.07 -1.02 2.07 -1.26 -1.18 121.20 117.99 2aw0 s ILE 34 Ca 0.46 -0.14 -0.02 0.00 -1.41 0.00 0.00 60.65 59.55 2aw0 s ILE 34 Cb -0.12 -0.57 0.03 0.00 0.13 0.00 0.00 42.46 41.94 2aw0 s ILE 34 CO 0.20 -0.08 0.05 -0.60 -1.91 0.00 0.00 174.94 172.60 2aw0 s ARG 35 N -0.28 0.15 0.04 3.50 3.52 -0.36 -5.03 118.95 120.48 2aw0 s ARG 35 Ca -0.04 0.24 0.03 0.00 -0.13 0.00 0.00 55.73 55.82 2aw0 s ARG 35 Cb -0.03 -0.81 -0.04 0.00 -1.56 0.00 0.00 34.95 32.51 2aw0 s ARG 35 CO 0.02 -0.36 0.00 0.08 -0.81 0.00 0.00 175.30 174.23 2aw0 s VAL 36 N 2.10 4.10 -0.03 7.11 1.01 -1.26 -1.05 120.40 132.38 2aw0 s VAL 36 Ca 0.05 -0.77 -0.00 0.00 0.00 0.00 0.00 61.98 61.25 2aw0 s VAL 36 Cb -0.13 -2.89 0.03 0.00 0.00 0.00 0.00 36.38 33.40 2aw0 s VAL 36 CO -0.04 0.26 0.03 -0.55 0.00 0.00 0.00 175.10 174.80 2aw0 s SER 37 N -1.89 0.38 -0.00 3.32 0.15 -0.54 -4.99 113.70 110.13 2aw0 s SER 37 Ca 0.22 0.04 -0.25 0.00 0.70 0.00 0.00 55.95 56.66 2aw0 s SER 37 Cb -0.12 -0.11 -0.19 0.00 -1.71 0.00 0.00 66.02 63.89 2aw0 s SER 37 CO 0.14 -0.16 1.32 0.25 1.20 0.00 0.00 173.24 176.00 2aw0 h LEU 38 N 7.58 -0.03 -0.58 3.45 5.85 -1.94 -0.59 115.31 129.04 2aw0 h LEU 38 Ca -0.37 -0.39 0.09 0.00 0.84 0.00 0.00 57.88 58.05 2aw0 h LEU 38 Cb 1.12 0.01 -0.07 0.00 0.37 0.00 0.00 40.66 42.09 2aw0 h LEU 38 CO 0.40 0.37 0.18 0.00 -0.34 0.00 0.00 178.44 179.06 2aw0 h ALA 39 N 0.50 0.72 0.00 1.25 0.00 -1.97 -1.16 119.26 118.59 2aw0 h ALA 39 Ca -0.00 0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.00 2aw0 h ALA 39 Cb 0.42 0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.30 2aw0 h ALA 39 CO 0.01 -0.24 -0.49 0.09 0.00 0.00 0.00 179.25 178.62 2aw0 n ASN 40 N -5.04 0.49 -3.64 0.00 4.13 -1.25 -4.99 115.26 104.97 2aw0 n ASN 40 Ca 0.08 -0.17 -0.24 0.00 1.68 0.00 0.00 54.58 55.92 2aw0 n ASN 40 Cb 0.27 0.21 0.04 0.00 -1.54 0.00 0.00 39.78 38.76 2aw0 n ASN 40 CO 0.00 0.00 0.00 -1.20 0.28 0.00 0.00 177.26 176.34 2aw0 n SER 41 N -1.57 -3.47 -3.73 6.41 7.64 -0.28 -4.92 113.62 113.70 2aw0 n SER 41 Ca 0.05 -0.89 -0.08 0.00 1.01 0.00 0.00 58.87 58.97 2aw0 n SER 41 Cb 0.35 -3.94 -0.02 0.00 -1.01 0.00 0.00 64.21 59.59 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 -3.89 -0.18 -0.14 6.43 4.22 -0.88 -1.29 114.94 119.21 2aw0 s ASN 42 Ca 0.25 -0.74 -0.01 0.00 -2.14 0.00 0.00 52.86 50.22 2aw0 s ASN 42 Cb -0.07 0.73 0.04 0.00 1.28 0.00 0.00 41.25 43.23 2aw0 s ASN 42 CO 0.82 -1.38 -0.03 -0.83 -2.04 0.00 0.00 177.10 173.65 2aw0 s GLY 43 N -2.96 0.80 -0.38 0.45 0.00 0.16 -1.47 107.32 103.93 2aw0 s GLY 43 Ca 0.13 -0.63 -0.15 0.00 0.00 0.00 0.00 44.72 44.08 2aw0 s GLY 43 CO 0.08 1.04 0.30 -1.59 0.00 0.00 0.00 173.10 172.94 2aw0 s THR 44 N 1.75 5.24 -0.05 0.90 2.01 -0.22 -1.26 115.64 124.01 2aw0 s THR 44 Ca 0.02 -0.42 0.07 0.00 0.31 0.00 0.00 61.69 61.67 2aw0 s THR 44 Cb -0.15 -3.87 -0.01 0.00 0.01 0.00 0.00 72.50 68.49 2aw0 s THR 44 CO -0.07 -0.21 -0.25 -0.69 -0.69 0.00 0.00 174.62 172.70 2aw0 s VAL 45 N 1.78 2.05 -0.17 3.82 1.01 -0.26 -1.23 120.40 127.41 2aw0 s VAL 45 Ca 0.07 -1.08 -0.04 0.00 0.00 0.00 0.00 61.98 60.94 2aw0 s VAL 45 Cb -0.18 -1.73 -0.02 0.00 0.00 0.00 0.00 36.38 34.45 2aw0 s VAL 45 CO 0.11 0.57 -0.04 -1.61 0.00 0.00 0.00 175.10 174.13 2aw0 s GLU 46 N -0.25 3.61 0.28 2.72 2.02 -0.32 -1.30 118.70 125.46 2aw0 s GLU 46 Ca -0.01 -0.54 -0.09 0.00 0.02 0.00 0.00 54.97 54.35 2aw0 s GLU 46 Cb -0.13 -2.92 -0.00 0.00 0.10 0.00 0.00 34.13 31.18 2aw0 s GLU 46 CO 0.03 0.17 0.47 1.52 0.02 0.00 0.00 175.26 177.47 2aw0 s TYR 47 N 0.55 0.63 -0.34 1.61 1.13 -0.39 -1.21 117.35 119.34 2aw0 s TYR 47 Ca -0.03 -0.96 -0.10 0.00 -1.41 0.00 0.00 57.07 54.57 2aw0 s TYR 47 Cb -0.14 0.09 0.01 0.00 -1.10 0.00 0.00 41.96 40.82 2aw0 s TYR 47 CO 0.03 -1.06 0.16 0.34 -2.51 0.00 0.00 175.55 172.51 2aw0 s ASP 48 N -3.10 5.55 0.37 -0.18 2.15 -0.50 -1.15 116.67 119.80 2aw0 s ASP 48 Ca 0.26 -0.81 0.20 0.00 0.43 0.00 0.00 52.55 52.63 2aw0 s ASP 48 Cb -0.00 -1.98 1.27 0.00 -0.30 0.00 0.00 42.92 41.91 2aw0 s ASP 48 CO 0.13 -0.29 1.61 -0.65 -0.17 0.00 0.00 175.17 175.80 2aw0 h PRO 49 N 8.36 0.11 -0.26 4.34 0.11 -1.77 -0.82 132.00 142.07 2aw0 h PRO 49 Ca -0.28 -0.01 -0.03 0.00 0.11 0.00 0.00 66.00 65.79 2aw0 h PRO 49 Cb 1.12 -0.02 -0.01 0.00 0.11 0.00 0.00 31.00 32.19 2aw0 h PRO 49 CO 0.63 0.07 0.03 -0.07 -0.21 0.00 0.00 178.00 178.46 2aw0 h LEU 50 N 0.11 0.35 0.00 2.35 3.38 -1.95 -3.30 115.31 116.25 2aw0 h LEU 50 Ca 0.81 -0.05 -0.25 0.00 0.09 0.00 0.00 57.88 58.48 2aw0 h LEU 50 Cb 2.10 -0.09 -0.05 0.00 0.09 0.00 0.00 40.66 42.71 2aw0 h LEU 50 CO -0.69 0.39 -1.96 0.18 0.09 0.00 0.00 178.44 176.45 2aw0 n LEU 51 N -4.36 0.45 -4.03 1.67 4.77 -0.53 -5.06 117.00 109.92 2aw0 n LEU 51 Ca 0.01 -0.01 -0.12 0.00 -0.03 0.00 0.00 56.01 55.85 2aw0 n LEU 51 Cb 0.19 0.19 -0.04 0.00 -2.33 0.00 0.00 43.42 41.43 2aw0 n LEU 51 CO 0.37 0.41 0.18 0.28 -1.33 0.00 0.00 177.39 177.30 2aw0 s THR 52 N -2.34 0.00 0.16 -5.08 -1.32 -0.43 -4.76 115.64 101.88 2aw0 s THR 52 Ca -0.09 -1.49 -0.11 0.00 -1.21 0.00 0.00 61.69 58.79 2aw0 s THR 52 Cb 0.04 -2.52 -0.00 0.00 -1.51 0.00 0.00 72.50 68.51 2aw0 s THR 52 CO 0.54 0.00 0.32 -0.94 -2.21 0.00 0.00 174.62 172.33 2aw0 s SER 53 N -3.15 -0.01 0.30 8.08 1.04 -1.26 -3.61 113.70 115.09 2aw0 s SER 53 Ca 0.27 -0.77 0.03 0.00 0.48 0.00 0.00 55.95 55.95 2aw0 s SER 53 Cb -0.01 0.45 0.62 0.00 0.10 0.00 0.00 66.02 67.18 2aw0 s SER 53 CO 0.15 -0.91 1.84 -0.65 0.98 0.00 0.00 173.24 174.65 2aw0 h PRO 54 N 2.49 0.90 -0.42 4.02 0.11 -1.99 -1.11 132.00 136.00 2aw0 h PRO 54 Ca -0.31 -0.05 -0.13 0.00 0.11 0.00 0.00 66.00 65.61 2aw0 h PRO 54 Cb 1.23 -0.20 -0.01 0.00 0.11 0.00 0.00 31.00 32.13 2aw0 h PRO 54 CO 0.47 0.60 -0.27 0.93 -0.21 0.00 0.00 178.00 179.52 2aw0 h GLU 55 N 0.93 0.90 -0.27 1.05 5.08 -1.98 -0.31 114.58 119.97 2aw0 h GLU 55 Ca 0.49 -0.40 -0.01 0.00 -1.00 0.00 0.00 59.36 58.44 2aw0 h GLU 55 Cb 0.56 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.77 2aw0 h GLU 55 CO -0.26 1.05 0.12 1.15 -1.00 0.00 0.00 179.01 180.07 2aw0 h THR 56 N 0.77 1.16 0.04 1.13 2.02 -1.79 -0.49 112.91 115.75 2aw0 h THR 56 Ca 0.09 -0.49 -0.00 0.00 0.77 0.00 0.00 66.41 66.78 2aw0 h THR 56 Cb 0.83 0.99 -0.00 0.00 -1.74 0.00 0.00 68.15 68.23 2aw0 h THR 56 CO 0.07 0.17 -0.02 -0.07 0.37 0.00 0.00 175.52 176.04 2aw0 h LEU 57 N 0.29 -0.06 -0.52 2.58 3.38 -1.12 -0.02 115.31 119.84 2aw0 h LEU 57 Ca 0.09 0.00 0.10 0.00 0.09 0.00 0.00 57.88 58.16 2aw0 h LEU 57 Cb 0.16 0.02 -0.08 0.00 0.09 0.00 0.00 40.66 40.84 2aw0 h LEU 57 CO -0.01 -0.04 0.01 -0.09 0.09 0.00 0.00 178.44 178.40 2aw0 h ARG 58 N -0.06 0.12 -0.53 1.13 2.43 -1.01 -0.95 114.38 115.51 2aw0 h ARG 58 Ca -0.00 -0.01 0.04 0.00 -0.81 0.00 0.00 59.98 59.20 2aw0 h ARG 58 Cb 0.05 -0.03 -0.04 0.00 -0.42 0.00 0.00 29.97 29.53 2aw0 h ARG 58 CO 0.00 0.08 0.29 0.78 -1.51 0.00 0.00 179.97 179.62 2aw0 h GLY 59 N 0.13 0.75 0.92 2.80 0.00 -0.64 -0.75 103.07 106.28 2aw0 h GLY 59 Ca 0.26 -0.21 -0.01 0.00 0.00 0.00 0.00 47.33 47.37 2aw0 h GLY 59 CO -0.43 0.15 0.13 0.00 0.00 0.00 0.00 176.54 176.39 2aw0 h ALA 60 N 1.27 0.38 -0.60 3.60 0.00 -0.34 0.14 119.26 123.71 2aw0 h ALA 60 Ca 0.23 -0.11 0.01 0.00 0.00 0.00 0.00 54.91 55.03 2aw0 h ALA 60 Cb 0.10 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 17.74 2aw0 h ALA 60 CO -0.14 -0.04 0.40 0.82 0.00 0.00 0.00 179.25 180.29 2aw0 h ILE 61 N 0.33 1.15 -0.71 0.00 2.04 -1.00 -0.80 117.51 118.52 2aw0 h ILE 61 Ca 0.10 -0.28 -0.01 0.00 1.00 0.00 0.00 64.86 65.67 2aw0 h ILE 61 Cb 0.15 0.27 -0.03 0.00 -0.74 0.00 0.00 36.82 36.47 2aw0 h ILE 61 CO -0.01 0.15 0.42 -0.08 0.00 0.00 0.00 178.15 178.63 2aw0 h GLU 62 N 0.81 0.97 -0.59 2.37 4.81 -0.92 -1.29 114.58 120.74 2aw0 h GLU 62 Ca 0.22 -0.09 -0.01 0.00 -0.13 0.00 0.00 59.36 59.34 2aw0 h GLU 62 Cb -0.09 -0.20 -0.03 0.00 0.63 0.00 0.00 28.75 29.06 2aw0 h GLU 62 CO -0.05 0.69 0.32 0.22 -0.73 0.00 0.00 179.01 179.47 2aw0 h ASP 63 N 0.97 0.75 -0.50 1.04 3.58 -0.47 -2.62 116.42 119.17 2aw0 h ASP 63 Ca 0.25 -0.10 0.01 0.00 0.42 0.00 0.00 57.03 57.62 2aw0 h ASP 63 Cb -0.02 -0.19 -0.03 0.00 1.72 0.00 0.00 39.33 40.81 2aw0 h ASP 63 CO -0.05 0.63 0.32 0.24 -2.88 0.00 0.00 179.24 177.50 2aw0 h MET 64 N 0.80 0.63 0.00 0.28 2.86 -0.89 -3.47 114.93 115.14 2aw0 h MET 64 Ca 0.21 -0.04 0.00 0.00 -2.06 0.00 0.00 59.70 57.81 2aw0 h MET 64 Cb 0.05 -0.14 0.00 0.00 0.06 0.00 0.00 31.60 31.57 2aw0 h MET 64 CO -0.03 0.42 0.00 0.41 1.06 0.00 0.00 176.91 178.76 2aw0 n GLY 65 N -1.23 0.35 2.82 8.32 0.00 -0.52 -5.11 105.19 109.81 2aw0 n GLY 65 Ca 0.03 -0.17 -0.14 0.00 0.00 0.00 0.00 46.02 45.73 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 -0.00 -0.53 1.61 0.40 -0.98 -5.00 117.98 113.48 2aw0 s PHE 66 Ca 0.00 0.14 -0.28 0.00 -0.60 0.00 0.00 56.93 56.19 2aw0 s PHE 66 Cb 0.00 -0.15 -0.00 0.00 0.51 0.00 0.00 43.02 43.38 2aw0 s PHE 66 CO 0.00 -0.07 1.61 0.16 0.70 0.00 0.00 175.22 177.61 2aw0 s ASP 67 N 0.77 5.85 -0.10 1.36 -4.77 -1.11 -3.41 116.67 115.26 2aw0 s ASP 67 Ca -0.06 0.49 -0.04 0.00 -3.30 0.00 0.00 52.55 49.63 2aw0 s ASP 67 Cb -0.09 -2.54 -0.04 0.00 -1.09 0.00 0.00 42.92 39.17 2aw0 s ASP 67 CO -0.02 -1.89 0.07 0.00 0.70 0.00 0.00 175.17 174.02 2aw0 s ALA 68 N 7.03 3.58 -0.01 2.11 0.00 -1.26 -2.30 121.76 130.91 2aw0 s ALA 68 Ca 0.61 -0.72 -0.03 0.00 0.00 0.00 0.00 51.96 51.82 2aw0 s ALA 68 Cb -0.13 -1.72 -0.00 0.00 0.00 0.00 0.00 23.12 21.26 2aw0 s ALA 68 CO 0.25 0.60 0.07 0.95 0.00 0.00 0.00 175.76 177.63 2aw0 s THR 69 N -0.94 0.05 0.03 0.00 -4.23 -0.54 -5.00 115.64 105.01 2aw0 s THR 69 Ca 0.14 -0.43 -0.30 0.00 -1.18 0.00 0.00 61.69 59.92 2aw0 s THR 69 Cb -0.12 -0.24 -0.06 0.00 1.34 0.00 0.00 72.50 73.43 2aw0 s THR 69 CO 0.03 -0.23 1.32 -0.76 -0.54 0.00 0.00 174.62 174.44 2aw0 s LEU 70 N -0.73 4.33 -0.15 4.79 1.43 -1.26 -0.19 118.68 126.90 2aw0 s LEU 70 Ca -0.08 2.09 -0.22 0.00 -1.03 0.00 0.00 54.13 54.89 2aw0 s LEU 70 Cb -0.05 -3.57 -0.19 0.00 0.03 0.00 0.00 46.19 42.41 2aw0 s LEU 70 CO 0.00 -0.62 0.48 0.28 0.23 0.00 0.00 176.35 176.72 2aw0 h SER 71 N 7.31 0.00 0.00 2.29 0.02 -1.28 -3.45 113.55 118.45 2aw0 h SER 71 Ca -0.39 -0.69 0.00 0.00 -0.84 0.00 0.00 61.79 59.87 2aw0 h SER 71 Cb 1.19 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.73 2aw0 h SER 71 CO 0.87 1.03 0.00 -0.67 -1.14 0.00 0.00 176.83 176.92