#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1aw0 s THR 2 N 0.00 5.32 0.44 1.47 -4.23 -1.26 -4.77 115.64 112.61 1aw0 s THR 2 Ca 0.00 -0.51 0.06 0.00 -1.18 0.00 0.00 61.69 60.07 1aw0 s THR 2 Cb 0.00 -3.70 -0.04 0.00 1.34 0.00 0.00 72.50 70.10 1aw0 s THR 2 CO 0.00 -0.02 0.17 -1.10 -0.54 0.00 0.00 174.62 173.13 1aw0 s GLN 3 N -2.98 2.20 0.00 3.99 1.11 -0.50 -4.95 119.66 118.52 1aw0 s GLN 3 Ca 0.36 -1.96 0.02 0.00 0.01 0.00 0.00 55.36 53.79 1aw0 s GLN 3 Cb -0.12 -1.91 -0.01 0.00 -1.01 0.00 0.00 33.01 29.97 1aw0 s GLN 3 CO 0.28 -0.20 -0.07 -2.00 0.01 0.00 0.00 175.29 173.31 1aw0 s GLU 4 N -3.93 0.56 0.03 2.91 2.12 -1.26 -0.84 118.70 118.29 1aw0 s GLU 4 Ca 0.35 -0.31 0.04 0.00 0.36 0.00 0.00 54.97 55.41 1aw0 s GLU 4 Cb 0.03 -0.52 -0.02 0.00 0.26 0.00 0.00 34.13 33.89 1aw0 s GLU 4 CO 0.20 0.14 -0.12 -0.08 -0.54 0.00 0.00 175.26 174.85 1aw0 s THR 5 N -0.31 0.94 -0.21 -1.70 -1.32 -0.61 -5.00 115.64 107.42 1aw0 s THR 5 Ca 0.01 -0.85 -0.06 0.00 -1.21 0.00 0.00 61.69 59.58 1aw0 s THR 5 Cb -0.04 -0.85 -0.03 0.00 -1.51 0.00 0.00 72.50 70.08 1aw0 s THR 5 CO -0.00 0.01 0.02 -0.69 -2.21 0.00 0.00 174.62 171.74 1aw0 s VAL 6 N -0.75 4.04 -0.18 5.08 1.01 0.24 -1.29 120.40 128.53 1aw0 s VAL 6 Ca 0.01 -0.28 -0.01 0.00 0.00 0.00 0.00 61.98 61.70 1aw0 s VAL 6 Cb -0.07 -2.84 0.00 0.00 0.00 0.00 0.00 36.38 33.48 1aw0 s VAL 6 CO 0.01 0.41 -0.14 -0.63 0.00 0.00 0.00 175.10 174.75 1aw0 s ILE 7 N 1.12 2.65 -0.14 2.22 1.01 -0.51 -0.80 121.20 126.75 1aw0 s ILE 7 Ca 0.03 -0.75 -0.29 0.00 0.00 0.00 0.00 60.65 59.64 1aw0 s ILE 7 Cb -0.14 -2.15 -0.03 0.00 0.01 0.00 0.00 42.46 40.14 1aw0 s ILE 7 CO 0.02 0.50 1.54 0.20 0.00 0.00 0.00 174.94 177.20 1aw0 s ASN 8 N 1.19 6.63 -0.41 3.58 -0.87 0.80 -0.80 114.94 125.08 1aw0 s ASN 8 Ca 0.02 1.88 -0.05 0.00 -1.57 0.00 0.00 52.86 53.14 1aw0 s ASN 8 Cb -0.14 -2.53 0.10 0.00 -0.02 0.00 0.00 41.25 38.65 1aw0 s ASN 8 CO -0.06 -1.00 0.22 -0.63 -2.57 0.00 0.00 177.10 173.05 1aw0 s ILE 9 N 4.31 3.62 0.05 0.60 1.01 -0.30 -1.62 121.20 128.87 1aw0 s ILE 9 Ca 0.68 -1.78 -0.01 0.00 0.00 0.00 0.00 60.65 59.54 1aw0 s ILE 9 Cb -0.27 -3.35 -0.04 0.00 0.01 0.00 0.00 42.46 38.80 1aw0 s ILE 9 CO 0.26 -0.59 0.22 -0.62 0.00 0.00 0.00 174.94 174.20 1aw0 s ASP 10 N 1.96 6.37 0.00 3.58 2.15 -0.52 -4.35 116.67 125.86 1aw0 s ASP 10 Ca 0.05 0.31 0.00 0.00 0.43 0.00 0.00 52.55 53.34 1aw0 s ASP 10 Cb -0.23 -1.98 0.00 0.00 -0.30 0.00 0.00 42.92 40.41 1aw0 s ASP 10 CO -0.02 0.18 0.00 0.61 -0.17 0.00 0.00 175.17 175.78 1aw0 n GLY 11 N 0.44 1.22 3.71 2.66 0.00 -1.26 -1.07 105.19 110.89 1aw0 n GLY 11 Ca -0.06 -0.31 -0.40 0.00 0.00 0.00 0.00 46.02 45.25 1aw0 n GLY 11 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1aw0 s MET 12 N -1.43 4.43 -0.01 1.61 -1.94 -1.26 -4.93 119.30 115.77 1aw0 s MET 12 Ca 0.00 0.89 -0.03 0.00 -1.71 0.00 0.00 55.69 54.84 1aw0 s MET 12 Cb 0.00 -3.45 -0.02 0.00 2.01 0.00 0.00 34.83 33.37 1aw0 s MET 12 CO 0.00 0.05 0.38 1.79 -0.01 0.00 0.00 175.02 177.23 1aw0 h THR 13 N 4.78 0.00 -0.67 2.05 1.35 -1.98 -3.51 112.91 114.93 1aw0 h THR 13 Ca -0.41 -0.15 0.00 0.00 -0.55 0.00 0.00 66.41 65.30 1aw0 h THR 13 Cb 1.19 0.00 0.00 0.00 -1.73 0.00 0.00 68.15 67.61 1aw0 h THR 13 CO 0.76 0.00 0.00 0.00 -0.25 0.00 0.00 175.52 176.03 1aw0 n ASN 15 N 0.00 3.67 0.13 0.00 5.15 -1.26 -2.87 115.26 120.08 1aw0 n ASN 15 Ca 0.00 -2.78 0.00 0.00 -0.60 0.00 0.00 54.58 51.20 1aw0 n ASN 15 Cb 0.00 -1.65 0.00 0.00 -0.53 0.00 0.00 39.78 37.60 1aw0 n ASN 15 CO 0.00 0.00 0.00 -1.54 1.40 0.00 0.00 177.26 177.12 1aw0 n SER 16 N 10.88 -2.30 -0.30 1.20 3.41 -1.26 -4.82 113.62 120.43 1aw0 n SER 16 Ca 0.47 0.60 -0.05 0.00 -0.26 0.00 0.00 58.87 59.63 1aw0 n SER 16 Cb 0.45 2.33 0.07 0.00 -0.26 0.00 0.00 64.21 66.80 1aw0 n SER 16 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1aw0 h VAL 18 N 1.16 0.03 -0.43 0.00 2.07 -1.89 -0.31 116.25 116.89 1aw0 h VAL 18 Ca 0.28 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.80 1aw0 h VAL 18 Cb 0.11 0.03 -0.02 0.00 -1.52 0.00 0.00 31.29 29.89 1aw0 h VAL 18 CO -0.04 0.00 0.26 -0.61 0.02 0.00 0.00 177.57 177.20 1aw0 h GLN 19 N -0.63 0.58 0.76 1.57 4.15 -1.84 -1.59 115.11 118.12 1aw0 h GLN 19 Ca 0.03 -0.05 -0.04 0.00 0.77 0.00 0.00 58.65 59.36 1aw0 h GLN 19 Cb 0.70 -0.12 0.00 0.00 0.21 0.00 0.00 27.48 28.27 1aw0 h GLN 19 CO -0.37 0.43 -0.39 1.03 -1.93 0.00 0.00 178.83 177.60 1aw0 h SER 20 N 0.57 -0.94 0.12 -0.69 0.87 -0.92 -0.13 113.55 112.43 1aw0 h SER 20 Ca 0.15 0.04 0.02 0.00 -1.23 0.00 0.00 61.79 60.77 1aw0 h SER 20 Cb -0.00 0.25 -0.03 0.00 -0.44 0.00 0.00 62.40 62.18 1aw0 h SER 20 CO -0.03 -0.64 -0.26 0.40 -0.53 0.00 0.00 176.83 175.77 1aw0 h ILE 21 N -1.05 0.43 -0.31 2.23 2.04 -1.03 -1.25 117.51 118.57 1aw0 h ILE 21 Ca -0.10 0.00 0.05 0.00 1.00 0.00 0.00 64.86 65.81 1aw0 h ILE 21 Cb 0.82 0.43 -0.05 0.00 -0.74 0.00 0.00 36.82 37.28 1aw0 h ILE 21 CO 0.16 0.00 0.01 -0.08 0.00 0.00 0.00 178.15 178.24 1aw0 h GLU 22 N -0.46 0.10 -0.75 2.37 4.81 -1.28 -0.75 114.58 118.61 1aw0 h GLU 22 Ca 0.03 -0.01 0.02 0.00 -0.13 0.00 0.00 59.36 59.28 1aw0 h GLU 22 Cb 0.49 -0.02 -0.04 0.00 0.63 0.00 0.00 28.75 29.81 1aw0 h GLU 22 CO -0.15 0.07 0.50 0.78 -0.73 0.00 0.00 179.01 179.47 1aw0 h GLY 23 N 0.10 1.05 0.11 1.92 0.00 -0.71 -1.87 103.07 103.67 1aw0 h GLY 23 Ca 0.15 -0.38 -0.00 0.00 0.00 0.00 0.00 47.33 47.10 1aw0 h GLY 23 CO -0.24 0.35 -0.04 -2.08 0.00 0.00 0.00 176.54 174.53 1aw0 h VAL 24 N 0.96 0.37 -0.81 4.60 2.07 -0.76 -3.38 116.25 119.32 1aw0 h VAL 24 Ca 0.29 -1.16 0.04 0.00 0.82 0.00 0.00 66.70 66.70 1aw0 h VAL 24 Cb -0.03 0.69 -0.05 0.00 -1.52 0.00 0.00 31.29 30.38 1aw0 h VAL 24 CO -0.07 0.12 0.53 0.40 0.02 0.00 0.00 177.57 178.57 1aw0 h ILE 25 N -1.01 1.10 -0.85 4.57 5.03 -1.16 -2.26 117.51 122.93 1aw0 h ILE 25 Ca -0.01 -0.33 0.24 0.00 -0.12 0.00 0.00 64.86 64.64 1aw0 h ILE 25 Cb 0.28 0.06 -0.04 0.00 -3.03 0.00 0.00 36.82 34.09 1aw0 h ILE 25 CO 0.02 0.18 0.61 0.77 -0.68 0.00 0.00 178.15 179.04 1aw0 h SER 26 N 0.96 0.06 0.44 1.72 4.64 -1.50 -1.33 113.55 118.54 1aw0 h SER 26 Ca 0.33 0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.66 1aw0 h SER 26 Cb 0.10 -0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.19 1aw0 h SER 26 CO -0.10 0.02 -0.39 0.29 -0.87 0.00 0.00 176.83 175.78 1aw0 n LYS 27 N -4.32 0.28 -2.40 4.77 4.76 -0.85 -4.78 118.16 115.62 1aw0 n LYS 27 Ca 0.18 -0.16 -0.38 0.00 -2.87 0.00 0.00 58.31 55.08 1aw0 n LYS 27 Cb 0.88 -1.50 -0.03 0.00 -1.84 0.00 0.00 35.03 32.54 1aw0 n LYS 27 CO 0.00 0.00 0.00 0.15 -1.37 0.00 0.00 177.40 176.18 1aw0 s LYS 28 N -2.83 4.22 0.16 1.97 -0.14 -0.50 -4.95 119.74 117.66 1aw0 s LYS 28 Ca 0.16 1.75 -0.33 0.00 -1.36 0.00 0.00 55.97 56.19 1aw0 s LYS 28 Cb 0.18 -2.76 -0.16 0.00 -1.68 0.00 0.00 37.83 33.41 1aw0 s LYS 28 CO 0.63 -0.15 1.13 -2.30 -0.76 0.00 0.00 175.35 173.90 1aw0 n PRO 29 N 0.29 1.04 0.00 -1.68 -0.02 -1.26 -2.29 135.00 131.08 1aw0 n PRO 29 Ca 0.03 0.37 0.00 0.00 -2.02 0.00 0.00 63.50 61.88 1aw0 n PRO 29 Cb 0.47 -1.85 0.00 0.00 -0.02 0.00 0.00 33.50 32.10 1aw0 n PRO 29 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1aw0 n GLY 30 N 2.00 2.69 3.74 -1.23 0.00 -1.26 -4.01 105.19 107.11 1aw0 n GLY 30 Ca 0.16 -0.09 -0.41 0.00 0.00 0.00 0.00 46.02 45.67 1aw0 n GLY 30 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1aw0 s VAL 31 N -1.53 2.91 0.00 1.61 1.01 -0.97 -1.64 120.40 121.79 1aw0 s VAL 31 Ca 0.00 0.74 0.00 0.00 0.00 0.00 0.00 61.98 62.72 1aw0 s VAL 31 Cb 0.00 -3.47 0.00 0.00 0.00 0.00 0.00 36.38 32.91 1aw0 s VAL 31 CO 0.00 0.11 0.00 0.29 0.00 0.00 0.00 175.10 175.50 1aw0 n LYS 32 N 2.69 0.00 -2.62 2.72 5.02 -0.24 -4.90 118.16 120.83 1aw0 n LYS 32 Ca 0.07 0.00 -0.32 0.00 -2.02 0.00 0.00 58.31 56.05 1aw0 n LYS 32 Cb 0.41 0.00 -0.04 0.00 -0.02 0.00 0.00 35.03 35.38 1aw0 n LYS 32 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 1aw0 s SER 33 N 0.39 6.61 -0.07 4.39 1.04 -1.26 -4.92 113.70 119.88 1aw0 s SER 33 Ca 0.00 1.41 -0.15 0.00 0.48 0.00 0.00 55.95 57.70 1aw0 s SER 33 Cb 0.00 -2.44 0.03 0.00 0.10 0.00 0.00 66.02 63.71 1aw0 s SER 33 CO 0.00 -0.49 0.35 -0.51 0.98 0.00 0.00 173.24 173.57 1aw0 s ILE 34 N -2.48 0.03 -0.25 -1.02 2.07 -1.26 -1.09 121.20 117.20 1aw0 s ILE 34 Ca 0.56 -0.23 -0.04 0.00 -1.41 0.00 0.00 60.65 59.52 1aw0 s ILE 34 Cb -0.10 -0.59 0.09 0.00 0.13 0.00 0.00 42.46 41.99 1aw0 s ILE 34 CO 0.29 -0.13 0.12 -0.60 -1.91 0.00 0.00 174.94 172.71 1aw0 s ARG 35 N -0.61 0.15 -0.46 3.50 3.00 -0.22 -5.02 118.95 119.28 1aw0 s ARG 35 Ca -0.07 -0.38 -0.21 0.00 -1.00 0.00 0.00 55.73 54.07 1aw0 s ARG 35 Cb -0.04 -1.39 0.03 0.00 0.00 0.00 0.00 34.95 33.55 1aw0 s ARG 35 CO 0.03 -0.90 0.67 0.08 0.00 0.00 0.00 175.30 175.18 1aw0 s VAL 36 N 2.11 4.79 -0.11 7.11 1.01 -1.26 -1.20 120.40 132.85 1aw0 s VAL 36 Ca 0.07 0.01 -0.20 0.00 0.00 0.00 0.00 61.98 61.85 1aw0 s VAL 36 Cb -0.16 -4.26 -0.04 0.00 0.00 0.00 0.00 36.38 31.92 1aw0 s VAL 36 CO -0.27 -0.70 0.58 -0.55 0.00 0.00 0.00 175.10 174.16 1aw0 s SER 37 N 2.24 6.80 -0.06 3.32 0.15 -0.06 -4.97 113.70 121.12 1aw0 s SER 37 Ca 0.22 0.96 -0.16 0.00 0.70 0.00 0.00 55.95 57.67 1aw0 s SER 37 Cb -0.15 -2.34 -0.11 0.00 -1.71 0.00 0.00 66.02 61.71 1aw0 s SER 37 CO 0.18 -0.08 0.65 0.25 1.20 0.00 0.00 173.24 175.44 1aw0 h LEU 38 N 6.91 -0.25 -0.55 3.45 6.46 -1.96 -1.79 115.31 127.58 1aw0 h LEU 38 Ca -0.40 -0.20 0.07 0.00 -0.12 0.00 0.00 57.88 57.23 1aw0 h LEU 38 Cb 1.18 0.06 -0.06 0.00 -0.73 0.00 0.00 40.66 41.12 1aw0 h LEU 38 CO 0.76 0.28 0.25 0.00 -0.62 0.00 0.00 178.44 179.10 1aw0 h ALA 39 N -0.69 0.71 0.00 1.25 0.00 -1.98 -1.30 119.26 117.26 1aw0 h ALA 39 Ca -0.03 0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1aw0 h ALA 39 Cb 0.43 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.20 1aw0 h ALA 39 CO 0.05 -0.13 -0.48 0.09 0.00 0.00 0.00 179.25 178.78 1aw0 n ASN 40 N -4.93 0.48 -3.44 0.00 4.13 -1.26 -4.99 115.26 105.25 1aw0 n ASN 40 Ca 0.06 -0.15 -0.21 0.00 1.68 0.00 0.00 54.58 55.96 1aw0 n ASN 40 Cb 0.19 0.19 0.06 0.00 -1.54 0.00 0.00 39.78 38.68 1aw0 n ASN 40 CO 0.00 0.00 0.00 -1.20 0.28 0.00 0.00 177.26 176.34 1aw0 n SER 41 N -1.57 -5.31 -3.96 6.41 7.64 -0.49 -4.90 113.62 111.44 1aw0 n SER 41 Ca 0.05 -0.81 -0.09 0.00 1.01 0.00 0.00 58.87 59.03 1aw0 n SER 41 Cb 0.35 -4.52 -0.08 0.00 -1.01 0.00 0.00 64.21 58.95 1aw0 n SER 41 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 1aw0 s ASN 42 N -3.59 0.12 -0.32 6.43 2.20 -0.75 -1.15 114.94 117.88 1aw0 s ASN 42 Ca 0.38 -0.86 -0.01 0.00 -0.94 0.00 0.00 52.86 51.43 1aw0 s ASN 42 Cb -0.08 0.38 0.06 0.00 -2.00 0.00 0.00 41.25 39.61 1aw0 s ASN 42 CO 0.78 -0.81 0.03 -0.83 -2.94 0.00 0.00 177.10 173.33 1aw0 s GLY 43 N -2.95 1.80 -0.55 0.45 0.00 0.02 -0.88 107.32 105.21 1aw0 s GLY 43 Ca 0.14 -1.95 -0.16 0.00 0.00 0.00 0.00 44.72 42.75 1aw0 s GLY 43 CO -0.03 0.76 0.54 -1.59 0.00 0.00 0.00 173.10 172.78 1aw0 s THR 44 N 1.20 5.15 -0.16 0.90 2.01 -0.34 -1.42 115.64 122.98 1aw0 s THR 44 Ca -0.02 -1.43 -0.01 0.00 0.31 0.00 0.00 61.69 60.54 1aw0 s THR 44 Cb -0.20 -4.37 -0.01 0.00 0.01 0.00 0.00 72.50 67.93 1aw0 s THR 44 CO -0.02 -0.92 -0.13 -0.69 -0.69 0.00 0.00 174.62 172.17 1aw0 s VAL 45 N 1.76 2.90 -0.07 3.82 1.01 -0.42 -1.06 120.40 128.35 1aw0 s VAL 45 Ca 0.05 -0.69 -0.20 0.00 0.00 0.00 0.00 61.98 61.14 1aw0 s VAL 45 Cb -0.29 -2.24 -0.04 0.00 0.00 0.00 0.00 36.38 33.81 1aw0 s VAL 45 CO 0.03 0.50 0.56 -0.70 0.00 0.00 0.00 175.10 175.49 1aw0 s GLU 46 N 0.77 4.34 0.07 2.72 2.12 -0.25 -1.58 118.70 126.89 1aw0 s GLU 46 Ca -0.05 0.62 -0.14 0.00 0.36 0.00 0.00 54.97 55.76 1aw0 s GLU 46 Cb -0.15 -3.41 0.02 0.00 0.26 0.00 0.00 34.13 30.85 1aw0 s GLU 46 CO 0.01 0.21 0.31 1.52 -0.54 0.00 0.00 175.26 176.77 1aw0 s TYR 47 N 0.40 -0.09 -0.26 5.30 1.13 -0.02 -1.08 117.35 122.72 1aw0 s TYR 47 Ca 0.30 -0.13 -0.17 0.00 -1.41 0.00 0.00 57.07 55.66 1aw0 s TYR 47 Cb -0.17 0.11 -0.03 0.00 -1.10 0.00 0.00 41.96 40.78 1aw0 s TYR 47 CO 0.14 -0.56 0.46 0.34 -2.51 0.00 0.00 175.55 173.42 1aw0 s ASP 48 N -2.37 6.37 0.30 -0.18 2.15 -0.65 -1.42 116.67 120.88 1aw0 s ASP 48 Ca -0.01 0.44 0.06 0.00 0.43 0.00 0.00 52.55 53.47 1aw0 s ASP 48 Cb 0.01 -2.26 0.81 0.00 -0.30 0.00 0.00 42.92 41.18 1aw0 s ASP 48 CO -0.07 -0.25 1.70 -0.65 -0.17 0.00 0.00 175.17 175.73 1aw0 h PRO 49 N 8.06 0.41 0.00 4.34 0.11 -1.86 -1.42 132.00 141.65 1aw0 h PRO 49 Ca -0.30 -0.02 -0.09 0.00 0.11 0.00 0.00 66.00 65.70 1aw0 h PRO 49 Cb 1.15 -0.09 -0.01 0.00 0.11 0.00 0.00 31.00 32.15 1aw0 h PRO 49 CO 0.69 0.27 -0.41 -0.07 -0.21 0.00 0.00 178.00 178.27 1aw0 h LEU 50 N 0.42 0.00 0.00 2.35 3.38 -1.96 -3.29 115.31 116.22 1aw0 h LEU 50 Ca 0.60 0.00 -0.37 0.00 0.09 0.00 0.00 57.88 58.20 1aw0 h LEU 50 Cb 1.18 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 41.86 1aw0 h LEU 50 CO -0.53 0.41 -2.39 0.18 0.09 0.00 0.00 178.44 176.20 1aw0 n LEU 51 N -4.01 0.81 -3.97 1.67 4.77 -0.90 -5.04 117.00 110.33 1aw0 n LEU 51 Ca -0.02 -0.02 -0.11 0.00 -0.03 0.00 0.00 56.01 55.83 1aw0 n LEU 51 Cb 0.45 0.11 -0.02 0.00 -2.33 0.00 0.00 43.42 41.63 1aw0 n LEU 51 CO 0.39 0.61 0.29 0.28 -1.33 0.00 0.00 177.39 177.63 1aw0 s THR 52 N -2.50 0.00 0.14 -5.08 -1.32 -0.58 -4.70 115.64 101.60 1aw0 s THR 52 Ca -0.16 -1.34 -0.12 0.00 -1.21 0.00 0.00 61.69 58.86 1aw0 s THR 52 Cb 0.07 -2.58 0.01 0.00 -1.51 0.00 0.00 72.50 68.49 1aw0 s THR 52 CO 0.77 0.00 0.32 -0.94 -2.21 0.00 0.00 174.62 172.56 1aw0 s SER 53 N -3.12 -0.05 0.23 8.08 1.04 -1.26 -3.69 113.70 114.93 1aw0 s SER 53 Ca 0.23 -0.63 -0.06 0.00 0.48 0.00 0.00 55.95 55.97 1aw0 s SER 53 Cb -0.02 0.44 0.38 0.00 0.10 0.00 0.00 66.02 66.92 1aw0 s SER 53 CO 0.14 -0.87 1.76 -0.65 0.98 0.00 0.00 173.24 174.60 1aw0 h PRO 54 N 2.50 0.50 -0.31 4.02 0.11 -1.99 -1.26 132.00 135.57 1aw0 h PRO 54 Ca -0.32 -0.03 -0.05 0.00 0.11 0.00 0.00 66.00 65.71 1aw0 h PRO 54 Cb 1.23 -0.11 -0.02 0.00 0.11 0.00 0.00 31.00 32.21 1aw0 h PRO 54 CO 0.48 0.33 -0.02 1.05 -0.21 0.00 0.00 178.00 179.63 1aw0 h GLU 55 N 0.52 0.48 -0.07 1.05 4.11 -1.98 -0.18 114.58 118.51 1aw0 h GLU 55 Ca 0.37 -0.10 -0.04 0.00 0.07 0.00 0.00 59.36 59.65 1aw0 h GLU 55 Cb 0.47 -0.07 -0.00 0.00 0.50 0.00 0.00 28.75 29.65 1aw0 h GLU 55 CO -0.33 0.53 -0.12 1.15 0.07 0.00 0.00 179.01 180.31 1aw0 h THR 56 N 0.46 1.40 -0.05 -1.06 2.02 -1.69 -0.46 112.91 113.53 1aw0 h THR 56 Ca 0.10 -1.38 0.01 0.00 0.77 0.00 0.00 66.41 65.91 1aw0 h THR 56 Cb 0.34 2.14 -0.02 0.00 -1.74 0.00 0.00 68.15 68.87 1aw0 h THR 56 CO 0.01 0.39 -0.04 -0.07 0.37 0.00 0.00 175.52 176.18 1aw0 h LEU 57 N -0.25 -0.11 -0.55 2.58 3.38 -1.15 -0.52 115.31 118.69 1aw0 h LEU 57 Ca 0.01 0.03 0.10 0.00 0.09 0.00 0.00 57.88 58.10 1aw0 h LEU 57 Cb 0.68 0.06 -0.08 0.00 0.09 0.00 0.00 40.66 41.41 1aw0 h LEU 57 CO 0.03 -0.05 0.09 -0.09 0.09 0.00 0.00 178.44 178.51 1aw0 h ARG 58 N -0.04 0.21 -0.38 1.13 2.43 -1.07 -1.51 114.38 115.16 1aw0 h ARG 58 Ca 0.03 -0.01 0.05 0.00 -0.81 0.00 0.00 59.98 59.24 1aw0 h ARG 58 Cb 0.09 -0.05 -0.05 0.00 -0.42 0.00 0.00 29.97 29.54 1aw0 h ARG 58 CO -0.08 0.14 0.10 0.78 -1.51 0.00 0.00 179.97 179.40 1aw0 h GLY 59 N 0.22 0.46 0.93 2.80 0.00 -0.43 0.00 103.07 107.05 1aw0 h GLY 59 Ca 0.28 -0.04 -0.01 0.00 0.00 0.00 0.00 47.33 47.56 1aw0 h GLY 59 CO -0.38 -0.01 0.13 0.00 0.00 0.00 0.00 176.54 176.27 1aw0 h ALA 60 N 1.27 0.36 -0.57 3.60 0.00 -0.60 0.47 119.26 123.79 1aw0 h ALA 60 Ca 0.18 -0.10 -0.00 0.00 0.00 0.00 0.00 54.91 54.99 1aw0 h ALA 60 Cb 0.19 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 17.85 1aw0 h ALA 60 CO -0.22 -0.08 0.34 0.82 0.00 0.00 0.00 179.25 180.11 1aw0 h ILE 61 N 0.31 1.17 -0.67 0.00 2.04 -1.10 -1.49 117.51 117.77 1aw0 h ILE 61 Ca 0.09 -0.39 -0.04 0.00 1.00 0.00 0.00 64.86 65.52 1aw0 h ILE 61 Cb 0.13 0.40 -0.03 0.00 -0.74 0.00 0.00 36.82 36.58 1aw0 h ILE 61 CO -0.01 0.18 0.28 -0.08 0.00 0.00 0.00 178.15 178.51 1aw0 h GLU 62 N 0.77 1.01 -0.61 2.37 4.57 -0.80 -2.05 114.58 119.83 1aw0 h GLU 62 Ca 0.20 -0.18 -0.01 0.00 -1.18 0.00 0.00 59.36 58.20 1aw0 h GLU 62 Cb -0.01 -0.16 -0.03 0.00 -0.16 0.00 0.00 28.75 28.39 1aw0 h GLU 62 CO -0.04 0.83 0.36 0.22 -1.18 0.00 0.00 179.01 179.20 1aw0 h ASP 63 N 0.95 0.74 -0.07 1.04 3.58 -0.54 -2.55 116.42 119.58 1aw0 h ASP 63 Ca 0.23 -0.07 0.02 0.00 0.42 0.00 0.00 57.03 57.62 1aw0 h ASP 63 Cb 0.20 -0.19 -0.01 0.00 1.72 0.00 0.00 39.33 41.05 1aw0 h ASP 63 CO -0.02 0.60 -0.02 0.24 -2.88 0.00 0.00 179.24 177.16 1aw0 h MET 64 N 0.83 -0.01 0.00 0.28 2.86 -1.11 -3.47 114.93 114.31 1aw0 h MET 64 Ca 0.22 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.86 1aw0 h MET 64 Cb 0.00 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.66 1aw0 h MET 64 CO -0.04 -0.00 0.00 0.41 1.06 0.00 0.00 176.91 178.34 1aw0 n GLY 65 N -1.13 0.05 2.91 8.32 0.00 -0.79 -5.12 105.19 109.43 1aw0 n GLY 65 Ca -0.05 -0.43 -0.11 0.00 0.00 0.00 0.00 46.02 45.42 1aw0 n GLY 65 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1aw0 s PHE 66 N 0.00 0.07 -0.82 1.61 0.08 -1.11 -5.02 117.98 112.79 1aw0 s PHE 66 Ca 0.00 -0.14 -0.25 0.00 0.12 0.00 0.00 56.93 56.66 1aw0 s PHE 66 Cb 0.00 -0.05 -0.03 0.00 -0.57 0.00 0.00 43.02 42.37 1aw0 s PHE 66 CO 0.00 -0.06 1.84 0.34 -0.10 0.00 0.00 175.22 177.24 1aw0 s ASP 67 N -0.43 5.36 -0.27 1.36 2.15 -0.23 -3.90 116.67 120.71 1aw0 s ASP 67 Ca -0.05 -0.43 -0.11 0.00 0.43 0.00 0.00 52.55 52.39 1aw0 s ASP 67 Cb -0.03 -2.55 -0.05 0.00 -0.30 0.00 0.00 42.92 39.99 1aw0 s ASP 67 CO -0.00 -2.47 0.19 0.00 -0.17 0.00 0.00 175.17 172.72 1aw0 s ALA 68 N 9.07 3.54 -0.00 3.66 0.00 -1.26 -1.44 121.76 135.33 1aw0 s ALA 68 Ca 0.65 -1.06 0.01 0.00 0.00 0.00 0.00 51.96 51.56 1aw0 s ALA 68 Cb -0.08 -2.46 -0.00 0.00 0.00 0.00 0.00 23.12 20.58 1aw0 s ALA 68 CO 0.06 -0.50 -0.02 0.95 0.00 0.00 0.00 175.76 176.24 1aw0 s THR 69 N 1.67 0.18 0.01 0.00 -4.23 -0.64 -4.94 115.64 107.69 1aw0 s THR 69 Ca 0.07 -0.12 -0.30 0.00 -1.18 0.00 0.00 61.69 60.16 1aw0 s THR 69 Cb -0.16 -0.16 -0.06 0.00 1.34 0.00 0.00 72.50 73.46 1aw0 s THR 69 CO 0.10 0.04 1.53 -0.76 -0.54 0.00 0.00 174.62 174.99 1aw0 s LEU 70 N -0.09 4.33 -0.18 4.79 1.43 -1.26 -0.14 118.68 127.56 1aw0 s LEU 70 Ca 0.00 2.25 -0.24 0.00 -1.03 0.00 0.00 54.13 55.11 1aw0 s LEU 70 Cb -0.01 -3.55 -0.22 0.00 0.03 0.00 0.00 46.19 42.43 1aw0 s LEU 70 CO -0.00 -0.82 0.45 -1.28 0.23 0.00 0.00 176.35 174.92 1aw0 h SER 71 N 8.37 0.02 0.00 2.29 0.87 -1.29 -3.45 113.55 120.36 1aw0 h SER 71 Ca -0.39 -0.72 0.00 0.00 -1.23 0.00 0.00 61.79 59.45 1aw0 h SER 71 Cb 1.18 -0.01 0.00 0.00 -0.44 0.00 0.00 62.40 63.14 1aw0 h SER 71 CO 0.93 1.31 0.00 -0.67 -0.53 0.00 0.00 176.83 177.87