#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 5.26 0.28 1.96 -4.23 -1.26 -4.43 115.64 113.22 1aw0 s THR 2 Ca 0.00 -0.67 0.03 0.00 -1.18 0.00 0.00 61.69 59.87 1aw0 s THR 2 Cb 0.00 -3.78 -0.06 0.00 1.34 0.00 0.00 72.50 70.00 1aw0 s THR 2 CO 0.00 -0.21 0.06 -1.10 -0.54 0.00 0.00 174.62 172.83 1aw0 s GLN 3 N -3.54 1.50 0.14 3.99 -1.52 -0.25 -4.99 119.66 114.99 1aw0 s GLN 3 Ca 0.36 -1.81 0.08 0.00 -1.95 0.00 0.00 55.36 52.04 1aw0 s GLN 3 Cb -0.10 -0.57 -0.04 0.00 -0.22 0.00 0.00 33.01 32.07 1aw0 s GLN 3 CO 0.29 -0.22 -0.19 -1.21 -0.25 0.00 0.00 175.29 173.71 1aw0 s GLU 4 N -3.95 1.21 -0.13 2.91 2.02 -1.26 -1.09 118.70 118.41 1aw0 s GLU 4 Ca 0.36 -1.30 -0.11 0.00 0.02 0.00 0.00 54.97 53.93 1aw0 s GLU 4 Cb 0.08 -1.36 0.04 0.00 0.10 0.00 0.00 34.13 32.99 1aw0 s GLU 4 CO 0.14 0.29 0.35 -0.08 0.02 0.00 0.00 175.26 175.98 1aw0 s THR 5 N -1.67 -0.01 -0.25 3.63 -1.32 -0.42 -5.01 115.64 110.60 1aw0 s THR 5 Ca 0.12 0.02 -0.11 0.00 -1.21 0.00 0.00 61.69 60.51 1aw0 s THR 5 Cb -0.08 -0.50 -0.05 0.00 -1.51 0.00 0.00 72.50 70.37 1aw0 s THR 5 CO 0.06 0.01 0.17 -0.69 -2.21 0.00 0.00 174.62 171.96 1aw0 s VAL 6 N 0.39 5.35 -0.18 5.08 1.01 -1.23 -1.12 120.40 129.69 1aw0 s VAL 6 Ca -0.02 0.19 0.01 0.00 0.00 0.00 0.00 61.98 62.17 1aw0 s VAL 6 Cb -0.04 -3.51 0.02 0.00 0.00 0.00 0.00 36.38 32.85 1aw0 s VAL 6 CO -0.02 0.33 -0.20 -0.63 0.00 0.00 0.00 175.10 174.58 1aw0 s ILE 7 N 1.18 2.09 -0.02 2.22 1.01 -0.44 -1.08 121.20 126.16 1aw0 s ILE 7 Ca 0.08 -0.93 -0.30 0.00 0.00 0.00 0.00 60.65 59.50 1aw0 s ILE 7 Cb -0.14 -1.87 -0.04 0.00 0.01 0.00 0.00 42.46 40.42 1aw0 s ILE 7 CO 0.06 0.54 1.17 0.20 0.00 0.00 0.00 174.94 176.90 1aw0 s ASN 8 N 1.28 7.10 -0.24 3.58 0.01 0.37 -0.64 114.94 126.40 1aw0 s ASN 8 Ca 0.05 1.83 0.02 0.00 -0.71 0.00 0.00 52.86 54.05 1aw0 s ASN 8 Cb -0.13 -2.56 0.05 0.00 0.41 0.00 0.00 41.25 39.02 1aw0 s ASN 8 CO -0.12 -0.52 -0.10 -0.63 -1.51 0.00 0.00 177.10 174.22 1aw0 s ILE 9 N 1.80 1.92 0.02 0.60 1.01 -0.38 -1.08 121.20 125.09 1aw0 s ILE 9 Ca 0.56 -1.39 -0.02 0.00 0.00 0.00 0.00 60.65 59.80 1aw0 s ILE 9 Cb -0.25 -2.04 -0.04 0.00 0.01 0.00 0.00 42.46 40.14 1aw0 s ILE 9 CO 0.24 0.02 0.21 -0.62 0.00 0.00 0.00 174.94 174.79 1aw0 s ASP 10 N 1.24 6.38 0.00 3.58 2.15 -0.42 -4.25 116.67 125.34 1aw0 s ASP 10 Ca -0.06 0.35 0.00 0.00 0.43 0.00 0.00 52.55 53.27 1aw0 s ASP 10 Cb -0.19 -2.00 0.00 0.00 -0.30 0.00 0.00 42.92 40.44 1aw0 s ASP 10 CO -0.06 0.22 0.00 0.61 -0.17 0.00 0.00 175.17 175.76 1aw0 n GLY 11 N 0.68 0.66 3.58 2.66 0.00 -1.26 -0.80 105.19 110.70 1aw0 n GLY 11 Ca -0.08 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.56 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 -0.89 3.46 0.17 1.61 -1.94 -1.26 -4.84 119.30 115.60 1aw0 s MET 12 Ca 0.00 -1.62 -0.18 0.00 -1.71 0.00 0.00 55.69 52.18 1aw0 s MET 12 Cb 0.00 -5.42 0.10 0.00 2.01 0.00 0.00 34.83 31.52 1aw0 s MET 12 CO 0.00 -2.81 1.65 1.15 -0.01 0.00 0.00 175.02 175.00 1aw0 h THR 13 N 5.91 0.48 -4.78 2.05 2.02 -1.96 -3.46 112.91 113.18 1aw0 h THR 13 Ca 0.35 0.00 -0.44 0.00 0.77 0.00 0.00 66.41 67.08 1aw0 h THR 13 Cb 0.91 0.48 -0.12 0.00 -1.74 0.00 0.00 68.15 67.68 1aw0 h THR 13 CO 1.38 0.00 -0.44 0.00 0.37 0.00 0.00 175.52 176.83 1aw0 h ASN 15 N 2.13 0.20 -0.28 0.00 4.21 -2.00 -1.81 115.58 118.04 1aw0 h ASN 15 Ca -0.25 0.01 0.06 0.00 1.21 0.00 0.00 56.30 57.32 1aw0 h ASN 15 Cb 1.23 -0.03 -0.06 0.00 -1.12 0.00 0.00 38.32 38.34 1aw0 h ASN 15 CO 0.37 0.11 -0.09 0.77 -1.29 0.00 0.00 177.43 177.30 1aw0 h SER 16 N 0.22 -0.31 -0.02 5.81 4.64 -1.97 -0.20 113.55 121.72 1aw0 h SER 16 Ca 0.29 0.09 0.01 0.00 -0.47 0.00 0.00 61.79 61.71 1aw0 h SER 16 Cb 0.85 0.19 -0.01 0.00 -0.31 0.00 0.00 62.40 63.12 1aw0 h SER 16 CO -0.06 -0.11 -0.03 0.00 -0.87 0.00 0.00 176.83 175.77 1aw0 h VAL 18 N -0.04 0.52 -0.42 0.00 2.07 -1.32 -0.86 116.25 116.21 1aw0 h VAL 18 Ca 0.02 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.55 1aw0 h VAL 18 Cb 0.06 0.52 -0.03 0.00 -1.52 0.00 0.00 31.29 30.33 1aw0 h VAL 18 CO -0.04 0.00 0.25 1.56 0.02 0.00 0.00 177.57 179.36 1aw0 h GLN 19 N -0.24 0.50 0.20 1.57 4.20 -0.91 -0.96 115.11 119.46 1aw0 h GLN 19 Ca 0.10 -0.03 -0.00 0.00 0.06 0.00 0.00 58.65 58.78 1aw0 h GLN 19 Cb 0.38 -0.11 -0.01 0.00 0.30 0.00 0.00 27.48 28.04 1aw0 h GLN 19 CO -0.27 0.33 -0.16 0.77 -0.67 0.00 0.00 178.83 178.83 1aw0 h SER 20 N 0.51 -0.40 0.14 1.46 0.02 -0.79 -0.78 113.55 113.70 1aw0 h SER 20 Ca 0.16 0.03 0.01 0.00 -0.84 0.00 0.00 61.79 61.16 1aw0 h SER 20 Cb -0.01 0.13 -0.03 0.00 0.14 0.00 0.00 62.40 62.64 1aw0 h SER 20 CO -0.07 -0.24 -0.21 0.40 -1.14 0.00 0.00 176.83 175.57 1aw0 h ILE 21 N -0.36 0.53 0.00 3.27 2.04 -1.05 -1.34 117.51 120.59 1aw0 h ILE 21 Ca -0.01 0.00 0.03 0.00 1.00 0.00 0.00 64.86 65.88 1aw0 h ILE 21 Cb 0.33 0.53 -0.05 0.00 -0.74 0.00 0.00 36.82 36.88 1aw0 h ILE 21 CO -0.01 0.00 -0.33 -0.08 0.00 0.00 0.00 178.15 177.73 1aw0 h GLU 22 N -0.41 -0.47 0.06 2.37 4.81 -1.05 -0.76 114.58 119.12 1aw0 h GLU 22 Ca 0.02 0.03 0.01 0.00 -0.13 0.00 0.00 59.36 59.30 1aw0 h GLU 22 Cb 0.42 0.11 -0.02 0.00 0.63 0.00 0.00 28.75 29.89 1aw0 h GLU 22 CO -0.10 -0.31 -0.13 0.78 -0.73 0.00 0.00 179.01 178.52 1aw0 h GLY 23 N -0.48 -0.21 0.96 1.92 0.00 -1.06 -1.43 103.07 102.78 1aw0 h GLY 23 Ca 0.06 0.15 -0.03 0.00 0.00 0.00 0.00 47.33 47.51 1aw0 h GLY 23 CO -0.27 -0.13 -0.29 -2.08 0.00 0.00 0.00 176.54 173.77 1aw0 h VAL 24 N -0.25 0.40 -0.63 4.60 2.07 -1.05 -3.14 116.25 118.25 1aw0 h VAL 24 Ca 0.03 -0.08 -0.02 0.00 0.82 0.00 0.00 66.70 67.45 1aw0 h VAL 24 Cb 0.27 0.43 -0.03 0.00 -1.52 0.00 0.00 31.29 30.44 1aw0 h VAL 24 CO -0.09 0.01 0.29 0.40 0.02 0.00 0.00 177.57 178.21 1aw0 h ILE 25 N -0.85 1.21 -0.97 4.57 1.08 -1.16 -2.96 117.51 118.43 1aw0 h ILE 25 Ca -0.08 -0.59 0.22 0.00 -0.39 0.00 0.00 64.86 64.01 1aw0 h ILE 25 Cb 0.64 0.41 -0.12 0.00 -3.07 0.00 0.00 36.82 34.68 1aw0 h ILE 25 CO 0.13 0.25 0.55 -1.28 -0.69 0.00 0.00 178.15 177.11 1aw0 h SER 26 N 0.89 0.63 0.31 1.72 0.87 -1.20 -2.05 113.55 114.72 1aw0 h SER 26 Ca 0.22 0.13 0.00 0.00 -1.23 0.00 0.00 61.79 60.90 1aw0 h SER 26 Cb 0.10 0.03 0.00 0.00 -0.44 0.00 0.00 62.40 62.09 1aw0 h SER 26 CO -0.03 0.14 -0.29 0.29 -0.53 0.00 0.00 176.83 176.42 1aw0 n LYS 27 N -4.88 0.64 -2.54 2.24 4.76 -1.12 -4.48 118.16 112.78 1aw0 n LYS 27 Ca 0.24 -0.36 -0.35 0.00 -2.87 0.00 0.00 58.31 54.97 1aw0 n LYS 27 Cb 0.66 -1.49 -0.04 0.00 -1.84 0.00 0.00 35.03 32.32 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 -2.61 3.95 0.12 1.97 1.02 -0.77 -4.95 119.74 118.46 1aw0 s LYS 28 Ca 0.22 1.42 -0.34 0.00 0.02 0.00 0.00 55.97 57.29 1aw0 s LYS 28 Cb 0.19 -2.27 -0.17 0.00 -0.52 0.00 0.00 37.83 35.05 1aw0 s LYS 28 CO 0.55 -0.31 1.02 -2.30 -0.92 0.00 0.00 175.35 173.39 1aw0 n PRO 29 N -0.60 0.57 0.00 -1.68 -0.02 -1.26 -2.14 135.00 129.87 1aw0 n PRO 29 Ca 0.08 0.20 0.00 0.00 -2.02 0.00 0.00 63.50 61.76 1aw0 n PRO 29 Cb 0.51 -1.61 0.00 0.00 -0.02 0.00 0.00 33.50 32.38 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 1.88 2.24 3.74 -1.23 0.00 -1.26 -4.41 105.19 106.15 1aw0 n GLY 30 Ca 0.17 -0.51 -0.41 0.00 0.00 0.00 0.00 46.02 45.27 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 -0.55 3.03 0.00 1.61 1.01 -0.91 -1.56 120.40 123.03 1aw0 s VAL 31 Ca 0.00 0.86 0.00 0.00 0.00 0.00 0.00 61.98 62.84 1aw0 s VAL 31 Cb 0.00 -3.55 0.00 0.00 0.00 0.00 0.00 36.38 32.83 1aw0 s VAL 31 CO 0.00 0.14 0.00 0.29 0.00 0.00 0.00 175.10 175.53 1aw0 n LYS 32 N 2.44 0.00 -3.10 2.72 5.02 -0.35 -4.79 118.16 120.10 1aw0 n LYS 32 Ca 0.06 0.00 -0.31 0.00 -2.02 0.00 0.00 58.31 56.04 1aw0 n LYS 32 Cb 0.42 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 -0.07 6.61 -0.15 4.39 1.04 -1.26 -4.87 113.70 119.39 1aw0 s SER 33 Ca 0.00 1.09 -0.12 0.00 0.48 0.00 0.00 55.95 57.41 1aw0 s SER 33 Cb 0.00 -2.30 0.04 0.00 0.10 0.00 0.00 66.02 63.86 1aw0 s SER 33 CO 0.00 -0.26 0.38 -0.51 0.98 0.00 0.00 173.24 173.83 1aw0 s ILE 34 N -2.12 -0.01 -0.31 -1.02 2.07 -1.26 -1.06 121.20 117.50 1aw0 s ILE 34 Ca 0.51 0.03 0.01 0.00 -1.41 0.00 0.00 60.65 59.79 1aw0 s ILE 34 Cb -0.10 -0.54 0.09 0.00 0.13 0.00 0.00 42.46 42.04 1aw0 s ILE 34 CO 0.25 0.01 0.07 -0.13 -1.91 0.00 0.00 174.94 173.23 1aw0 s ARG 35 N 0.59 1.01 -0.24 3.50 0.52 -0.41 -5.00 118.95 118.92 1aw0 s ARG 35 Ca -0.03 -1.25 -0.14 0.00 -0.52 0.00 0.00 55.73 53.79 1aw0 s ARG 35 Cb -0.05 -2.38 -0.04 0.00 0.52 0.00 0.00 34.95 33.00 1aw0 s ARG 35 CO -0.04 -0.92 0.30 0.08 0.02 0.00 0.00 175.30 174.75 1aw0 s VAL 36 N 1.41 5.25 -0.16 3.52 1.01 -1.26 -1.23 120.40 128.94 1aw0 s VAL 36 Ca 0.08 0.47 -0.05 0.00 0.00 0.00 0.00 61.98 62.48 1aw0 s VAL 36 Cb -0.18 -3.64 -0.03 0.00 0.00 0.00 0.00 36.38 32.53 1aw0 s VAL 36 CO -0.18 0.25 0.00 -0.55 0.00 0.00 0.00 175.10 174.62 1aw0 s SER 37 N 1.32 5.12 -0.02 3.32 0.15 -0.29 -4.93 113.70 118.36 1aw0 s SER 37 Ca 0.13 -0.03 -0.24 0.00 0.70 0.00 0.00 55.95 56.50 1aw0 s SER 37 Cb -0.15 -1.83 -0.18 0.00 -1.71 0.00 0.00 66.02 62.16 1aw0 s SER 37 CO 0.08 0.19 1.16 0.25 1.20 0.00 0.00 173.24 176.12 1aw0 h LEU 38 N 6.58 -0.14 -0.49 3.45 5.85 -1.96 -1.55 115.31 127.05 1aw0 h LEU 38 Ca -0.34 -0.36 0.08 0.00 0.84 0.00 0.00 57.88 58.10 1aw0 h LEU 38 Cb 1.18 0.04 -0.07 0.00 0.37 0.00 0.00 40.66 42.18 1aw0 h LEU 38 CO 0.65 0.32 0.10 0.00 -0.34 0.00 0.00 178.44 179.17 1aw0 h ALA 39 N 0.11 0.55 -0.00 1.25 0.00 -1.97 -1.39 119.26 117.81 1aw0 h ALA 39 Ca -0.02 0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.00 1aw0 h ALA 39 Cb 0.50 0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.43 1aw0 h ALA 39 CO 0.03 -0.31 -0.45 0.09 0.00 0.00 0.00 179.25 178.61 1aw0 n ASN 40 N -5.12 0.49 -3.64 0.00 3.02 -1.26 -4.98 115.26 103.78 1aw0 n ASN 40 Ca 0.05 -0.23 -0.26 0.00 -0.03 0.00 0.00 54.58 54.12 1aw0 n ASN 40 Cb 0.24 0.19 0.04 0.00 -0.61 0.00 0.00 39.78 39.64 1aw0 n ASN 40 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 1aw0 n SER 41 N -1.45 -3.99 -3.80 6.41 7.64 -0.53 -4.90 113.62 113.00 1aw0 n SER 41 Ca 0.06 -0.91 -0.09 0.00 1.01 0.00 0.00 58.87 58.94 1aw0 n SER 41 Cb 0.34 -3.84 -0.04 0.00 -1.01 0.00 0.00 64.21 59.66 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 -3.77 -0.23 -0.20 6.43 2.20 -0.98 -1.25 114.94 117.13 1aw0 s ASN 42 Ca 0.31 -0.57 0.01 0.00 -0.94 0.00 0.00 52.86 51.66 1aw0 s ASN 42 Cb -0.09 0.60 0.04 0.00 -2.00 0.00 0.00 41.25 39.80 1aw0 s ASN 42 CO 0.83 -1.11 -0.11 -0.83 -2.94 0.00 0.00 177.10 172.94 1aw0 s GLY 43 N -2.90 1.30 -0.58 0.45 0.00 0.19 -1.14 107.32 104.62 1aw0 s GLY 43 Ca 0.12 -1.23 -0.16 0.00 0.00 0.00 0.00 44.72 43.45 1aw0 s GLY 43 CO 0.01 0.65 0.56 -1.59 0.00 0.00 0.00 173.10 172.72 1aw0 s THR 44 N 1.37 5.20 -0.16 0.90 2.01 -0.36 -1.33 115.64 123.28 1aw0 s THR 44 Ca -0.01 -1.55 -0.05 0.00 0.31 0.00 0.00 61.69 60.39 1aw0 s THR 44 Cb -0.16 -4.38 -0.03 0.00 0.01 0.00 0.00 72.50 67.94 1aw0 s THR 44 CO -0.08 -0.92 0.01 -0.69 -0.69 0.00 0.00 174.62 172.25 1aw0 s VAL 45 N 1.58 4.37 -0.19 3.82 1.01 -0.28 -1.28 120.40 129.44 1aw0 s VAL 45 Ca 0.06 -0.19 -0.11 0.00 0.00 0.00 0.00 61.98 61.74 1aw0 s VAL 45 Cb -0.27 -2.93 -0.05 0.00 0.00 0.00 0.00 36.38 33.13 1aw0 s VAL 45 CO 0.02 0.49 0.17 -0.70 0.00 0.00 0.00 175.10 175.09 1aw0 s GLU 46 N 0.19 4.18 0.15 2.72 2.12 -0.22 -1.30 118.70 126.54 1aw0 s GLU 46 Ca 0.01 -0.14 -0.12 0.00 0.36 0.00 0.00 54.97 55.09 1aw0 s GLU 46 Cb -0.13 -3.41 0.01 0.00 0.26 0.00 0.00 34.13 30.85 1aw0 s GLU 46 CO 0.02 0.30 0.34 1.52 -0.54 0.00 0.00 175.26 176.89 1aw0 s TYR 47 N 0.34 0.14 -0.36 5.30 1.13 -0.25 -1.21 117.35 122.44 1aw0 s TYR 47 Ca 0.10 -0.51 -0.15 0.00 -1.41 0.00 0.00 57.07 55.11 1aw0 s TYR 47 Cb -0.12 0.09 -0.00 0.00 -1.10 0.00 0.00 41.96 40.83 1aw0 s TYR 47 CO -0.00 -0.73 0.34 0.34 -2.51 0.00 0.00 175.55 172.99 1aw0 s ASP 48 N -2.90 6.14 0.41 -0.18 2.15 -0.60 -1.09 116.67 120.60 1aw0 s ASP 48 Ca 0.11 -0.43 0.24 0.00 0.43 0.00 0.00 52.55 52.89 1aw0 s ASP 48 Cb 0.02 -2.18 1.27 0.00 -0.30 0.00 0.00 42.92 41.73 1aw0 s ASP 48 CO -0.05 -0.37 1.67 -0.65 -0.17 0.00 0.00 175.17 175.61 1aw0 h PRO 49 N 8.53 0.21 -0.46 4.34 0.11 -1.77 -0.86 132.00 142.09 1aw0 h PRO 49 Ca -0.29 -0.01 -0.06 0.00 0.11 0.00 0.00 66.00 65.74 1aw0 h PRO 49 Cb 1.14 -0.05 -0.02 0.00 0.11 0.00 0.00 31.00 32.18 1aw0 h PRO 49 CO 0.70 0.14 0.04 -0.07 -0.21 0.00 0.00 178.00 178.59 1aw0 h LEU 50 N 0.21 0.70 0.00 2.35 3.38 -1.94 -3.32 115.31 116.69 1aw0 h LEU 50 Ca 0.74 -0.15 -0.38 0.00 0.09 0.00 0.00 57.88 58.19 1aw0 h LEU 50 Cb 2.10 -0.18 -0.07 0.00 0.09 0.00 0.00 40.66 42.59 1aw0 h LEU 50 CO -0.43 0.74 -2.42 0.18 0.09 0.00 0.00 178.44 176.61 1aw0 n LEU 51 N -4.25 0.88 -4.06 1.67 4.77 -0.55 -5.04 117.00 110.42 1aw0 n LEU 51 Ca 0.03 -0.04 -0.14 0.00 -0.03 0.00 0.00 56.01 55.82 1aw0 n LEU 51 Cb 0.27 0.08 -0.03 0.00 -2.33 0.00 0.00 43.42 41.41 1aw0 n LEU 51 CO 0.40 0.63 0.19 0.28 -1.33 0.00 0.00 177.39 177.56 1aw0 s THR 52 N -2.50 0.00 0.15 -5.08 -1.32 -0.44 -4.73 115.64 101.72 1aw0 s THR 52 Ca -0.17 -1.53 -0.12 0.00 -1.21 0.00 0.00 61.69 58.65 1aw0 s THR 52 Cb 0.07 -2.68 0.01 0.00 -1.51 0.00 0.00 72.50 68.39 1aw0 s THR 52 CO 0.76 0.00 0.33 -0.94 -2.21 0.00 0.00 174.62 172.56 1aw0 s SER 53 N -3.23 -0.05 0.20 8.08 1.04 -1.26 -3.69 113.70 114.79 1aw0 s SER 53 Ca 0.29 -0.63 -0.11 0.00 0.48 0.00 0.00 55.95 55.97 1aw0 s SER 53 Cb -0.01 0.45 0.24 0.00 0.10 0.00 0.00 66.02 66.80 1aw0 s SER 53 CO 0.20 -0.88 1.72 -0.65 0.98 0.00 0.00 173.24 174.61 1aw0 h PRO 54 N 2.49 0.27 -0.24 4.02 0.11 -1.98 -0.93 132.00 135.74 1aw0 h PRO 54 Ca -0.32 -0.02 -0.08 0.00 0.11 0.00 0.00 66.00 65.69 1aw0 h PRO 54 Cb 1.23 -0.06 -0.01 0.00 0.11 0.00 0.00 31.00 32.27 1aw0 h PRO 54 CO 0.48 0.18 -0.20 1.05 -0.21 0.00 0.00 178.00 179.29 1aw0 h GLU 55 N 0.27 0.42 -0.24 1.05 -0.00 -1.98 -0.39 114.58 113.71 1aw0 h GLU 55 Ca 0.28 -0.14 -0.06 0.00 -0.00 0.00 0.00 59.36 59.44 1aw0 h GLU 55 Cb 0.38 -0.04 -0.01 0.00 -0.00 0.00 0.00 28.75 29.09 1aw0 h GLU 55 CO -0.35 0.61 -0.08 1.15 -0.00 0.00 0.00 179.01 180.35 1aw0 h THR 56 N 0.38 1.29 -0.25 -1.06 2.02 -1.81 -0.56 112.91 112.92 1aw0 h THR 56 Ca 0.06 -1.11 -0.00 0.00 0.77 0.00 0.00 66.41 66.13 1aw0 h THR 56 Cb 0.58 1.51 -0.01 0.00 -1.74 0.00 0.00 68.15 68.49 1aw0 h THR 56 CO 0.04 0.34 0.14 -0.07 0.37 0.00 0.00 175.52 176.35 1aw0 h LEU 57 N 0.21 0.31 -0.56 2.58 3.38 -0.96 0.19 115.31 120.46 1aw0 h LEU 57 Ca 0.06 -0.07 0.10 0.00 0.09 0.00 0.00 57.88 58.06 1aw0 h LEU 57 Cb 0.55 -0.08 -0.08 0.00 0.09 0.00 0.00 40.66 41.15 1aw0 h LEU 57 CO 0.03 0.28 0.12 -0.09 0.09 0.00 0.00 178.44 178.87 1aw0 h ARG 58 N 0.30 0.25 -0.55 1.13 2.43 -1.08 -1.20 114.38 115.65 1aw0 h ARG 58 Ca 0.09 -0.01 0.07 0.00 -0.81 0.00 0.00 59.98 59.31 1aw0 h ARG 58 Cb 0.04 -0.06 -0.06 0.00 -0.42 0.00 0.00 29.97 29.47 1aw0 h ARG 58 CO -0.02 0.16 0.24 0.78 -1.51 0.00 0.00 179.97 179.62 1aw0 h GLY 59 N 0.26 0.77 0.89 2.80 0.00 -0.29 0.09 103.07 107.58 1aw0 h GLY 59 Ca 0.29 -0.14 -0.02 0.00 0.00 0.00 0.00 47.33 47.45 1aw0 h GLY 59 CO -0.37 0.04 0.07 0.00 0.00 0.00 0.00 176.54 176.29 1aw0 h ALA 60 N 1.35 0.35 -0.56 3.60 0.00 -0.38 0.63 119.26 124.25 1aw0 h ALA 60 Ca 0.26 -0.16 -0.02 0.00 0.00 0.00 0.00 54.91 55.00 1aw0 h ALA 60 Cb 0.26 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 17.92 1aw0 h ALA 60 CO -0.23 -0.00 0.27 0.82 0.00 0.00 0.00 179.25 180.10 1aw0 h ILE 61 N 0.26 1.21 -0.71 0.00 2.04 -1.03 -1.27 117.51 118.00 1aw0 h ILE 61 Ca 0.08 -0.58 -0.03 0.00 1.00 0.00 0.00 64.86 65.34 1aw0 h ILE 61 Cb 0.26 0.56 -0.03 0.00 -0.74 0.00 0.00 36.82 36.87 1aw0 h ILE 61 CO -0.00 0.23 0.35 -0.08 0.00 0.00 0.00 178.15 178.65 1aw0 h GLU 62 N 0.76 1.03 -0.55 2.37 4.81 -0.87 -1.45 114.58 120.67 1aw0 h GLU 62 Ca 0.19 -0.15 -0.01 0.00 -0.13 0.00 0.00 59.36 59.26 1aw0 h GLU 62 Cb 0.12 -0.19 -0.03 0.00 0.63 0.00 0.00 28.75 29.29 1aw0 h GLU 62 CO -0.02 0.81 0.30 0.22 -0.73 0.00 0.00 179.01 179.59 1aw0 h ASP 63 N 1.00 0.69 0.05 1.04 3.58 -0.47 -2.64 116.42 119.68 1aw0 h ASP 63 Ca 0.25 -0.09 0.00 0.00 0.42 0.00 0.00 57.03 57.61 1aw0 h ASP 63 Cb 0.12 -0.18 -0.01 0.00 1.72 0.00 0.00 39.33 40.98 1aw0 h ASP 63 CO -0.03 0.58 -0.05 0.24 -2.88 0.00 0.00 179.24 177.10 1aw0 h MET 64 N 0.75 -0.11 0.00 0.28 2.86 -1.09 -3.48 114.93 114.14 1aw0 h MET 64 Ca 0.20 0.01 0.00 0.00 -2.06 0.00 0.00 59.70 57.84 1aw0 h MET 64 Cb 0.04 0.03 0.00 0.00 0.06 0.00 0.00 31.60 31.73 1aw0 h MET 64 CO -0.03 -0.07 0.00 0.41 1.06 0.00 0.00 176.91 178.27 1aw0 n GLY 65 N -1.16 -0.01 2.89 8.32 0.00 -0.59 -5.12 105.19 109.53 1aw0 n GLY 65 Ca -0.07 -0.45 -0.11 0.00 0.00 0.00 0.00 46.02 45.39 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 0.05 -0.94 1.61 0.08 -0.96 -5.00 117.98 112.81 1aw0 s PHE 66 Ca 0.00 -0.09 -0.24 0.00 0.12 0.00 0.00 56.93 56.72 1aw0 s PHE 66 Cb 0.00 -0.04 0.01 0.00 -0.57 0.00 0.00 43.02 42.42 1aw0 s PHE 66 CO 0.00 -0.04 1.64 -0.51 -0.10 0.00 0.00 175.22 176.22 1aw0 s ASP 67 N -0.28 5.91 -0.15 1.36 1.01 0.02 -3.67 116.67 120.87 1aw0 s ASP 67 Ca -0.03 -1.02 -0.09 0.00 0.71 0.00 0.00 52.55 52.12 1aw0 s ASP 67 Cb -0.02 -2.56 -0.05 0.00 1.01 0.00 0.00 42.92 41.30 1aw0 s ASP 67 CO -0.00 -2.03 0.16 0.00 0.21 0.00 0.00 175.17 173.51 1aw0 s ALA 68 N 7.13 3.76 -0.07 5.23 0.00 -1.26 -1.31 121.76 135.25 1aw0 s ALA 68 Ca 0.55 -0.63 -0.04 0.00 0.00 0.00 0.00 51.96 51.85 1aw0 s ALA 68 Cb -0.04 -2.11 0.03 0.00 0.00 0.00 0.00 23.12 21.00 1aw0 s ALA 68 CO -0.04 0.37 0.16 0.99 0.00 0.00 0.00 175.76 177.24 1aw0 s THR 69 N -0.30 -0.03 0.13 0.00 2.01 -0.24 -4.97 115.64 112.24 1aw0 s THR 69 Ca 0.12 0.11 -0.31 0.00 0.31 0.00 0.00 61.69 61.92 1aw0 s THR 69 Cb -0.12 -0.25 -0.09 0.00 0.01 0.00 0.00 72.50 72.05 1aw0 s THR 69 CO 0.02 0.04 1.58 -0.76 -0.69 0.00 0.00 174.62 174.81 1aw0 s LEU 70 N 0.77 4.37 -0.19 4.42 1.43 -1.26 -0.48 118.68 127.74 1aw0 s LEU 70 Ca -0.06 2.55 -0.17 0.00 -1.03 0.00 0.00 54.13 55.42 1aw0 s LEU 70 Cb -0.07 -3.58 -0.07 0.00 0.03 0.00 0.00 46.19 42.50 1aw0 s LEU 70 CO -0.04 -0.83 -0.33 -0.24 0.23 0.00 0.00 176.35 175.14 1aw0 n SER 71 N 4.47 1.93 0.00 2.29 2.88 -0.24 -4.81 113.62 120.14 1aw0 n SER 71 Ca 0.14 0.35 0.00 0.00 -1.33 0.00 0.00 58.87 58.04 1aw0 n SER 71 Cb 0.39 -0.76 0.00 0.00 -0.75 0.00 0.00 64.21 63.09 1aw0 n SER 71 CO 0.00 0.00 0.00 -0.67 -1.23 0.00 0.00 175.04 173.14