#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 -0.11 0.20 -5.08 -4.23 -1.26 -4.42 115.64 100.73 2aw0 s THR 2 Ca 0.00 0.40 -0.01 0.00 -1.18 0.00 0.00 61.69 60.90 2aw0 s THR 2 Cb 0.00 -0.15 -0.04 0.00 1.34 0.00 0.00 72.50 73.65 2aw0 s THR 2 CO 0.00 0.17 0.13 -1.10 -0.54 0.00 0.00 174.62 173.28 2aw0 s GLN 3 N 2.07 1.20 0.00 3.99 -1.52 -0.40 -4.97 119.66 120.03 2aw0 s GLN 3 Ca 0.03 -1.62 -0.00 0.00 -1.95 0.00 0.00 55.36 51.82 2aw0 s GLN 3 Cb -0.12 0.27 -0.01 0.00 -0.22 0.00 0.00 33.01 32.93 2aw0 s GLN 3 CO -0.03 -0.39 -0.00 -2.00 -0.25 0.00 0.00 175.29 172.62 2aw0 s GLU 4 N -4.15 0.12 0.00 2.91 2.12 -1.26 -1.00 118.70 117.44 2aw0 s GLU 4 Ca 0.38 -0.21 0.02 0.00 0.36 0.00 0.00 54.97 55.53 2aw0 s GLU 4 Cb 0.07 0.05 -0.01 0.00 0.26 0.00 0.00 34.13 34.50 2aw0 s GLU 4 CO 0.12 -0.02 -0.08 -0.08 -0.54 0.00 0.00 175.26 174.66 2aw0 s THR 5 N -0.53 0.61 -0.39 -1.70 -1.32 -0.52 -5.00 115.64 106.79 2aw0 s THR 5 Ca -0.06 -0.45 -0.08 0.00 -1.21 0.00 0.00 61.69 59.89 2aw0 s THR 5 Cb -0.04 -0.53 0.06 0.00 -1.51 0.00 0.00 72.50 70.48 2aw0 s THR 5 CO -0.00 0.09 0.20 -0.69 -2.21 0.00 0.00 174.62 172.00 2aw0 s VAL 6 N -0.36 4.08 -0.24 5.08 1.01 -1.26 -1.30 120.40 127.42 2aw0 s VAL 6 Ca 0.01 -1.27 -0.09 0.00 0.00 0.00 0.00 61.98 60.63 2aw0 s VAL 6 Cb -0.04 -3.42 -0.04 0.00 0.00 0.00 0.00 36.38 32.87 2aw0 s VAL 6 CO -0.00 -0.37 0.13 -0.63 0.00 0.00 0.00 175.10 174.22 2aw0 s ILE 7 N 1.42 4.98 0.08 2.22 1.01 -0.28 -0.85 121.20 129.78 2aw0 s ILE 7 Ca 0.02 0.05 -0.31 0.00 0.00 0.00 0.00 60.65 60.41 2aw0 s ILE 7 Cb -0.21 -3.32 -0.07 0.00 0.01 0.00 0.00 42.46 38.86 2aw0 s ILE 7 CO 0.03 0.34 1.39 0.20 0.00 0.00 0.00 174.94 176.90 2aw0 s ASN 8 N 1.21 6.84 -0.50 3.58 0.01 0.74 -0.70 114.94 126.12 2aw0 s ASN 8 Ca 0.06 2.26 0.03 0.00 -0.71 0.00 0.00 52.86 54.50 2aw0 s ASN 8 Cb -0.14 -2.58 0.15 0.00 0.41 0.00 0.00 41.25 39.09 2aw0 s ASN 8 CO 0.05 -0.67 0.31 -0.63 -1.51 0.00 0.00 177.10 174.65 2aw0 s ILE 9 N 1.51 1.77 0.04 0.60 1.01 -0.31 -2.35 121.20 123.46 2aw0 s ILE 9 Ca 0.64 -3.05 -0.01 0.00 0.00 0.00 0.00 60.65 58.23 2aw0 s ILE 9 Cb -0.35 -2.21 -0.04 0.00 0.01 0.00 0.00 42.46 39.87 2aw0 s ILE 9 CO 0.29 -0.95 0.20 -0.62 0.00 0.00 0.00 174.94 173.87 2aw0 s ASP 10 N -0.17 6.37 0.00 3.58 2.15 -0.94 -3.94 116.67 123.72 2aw0 s ASP 10 Ca 0.21 0.30 0.00 0.00 0.43 0.00 0.00 52.55 53.49 2aw0 s ASP 10 Cb -0.17 -1.98 0.00 0.00 -0.30 0.00 0.00 42.92 40.48 2aw0 s ASP 10 CO -0.06 0.20 0.00 0.61 -0.17 0.00 0.00 175.17 175.75 2aw0 n GLY 11 N 0.50 1.20 3.74 2.66 0.00 -1.26 -1.37 105.19 110.66 2aw0 n GLY 11 Ca -0.07 -0.33 -0.41 0.00 0.00 0.00 0.00 46.02 45.21 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 -1.51 4.74 -0.13 1.61 -1.94 -1.26 -4.93 119.30 115.88 2aw0 s MET 12 Ca 0.00 1.49 -0.21 0.00 -1.71 0.00 0.00 55.69 55.25 2aw0 s MET 12 Cb 0.00 -3.34 -0.26 0.00 2.01 0.00 0.00 34.83 33.24 2aw0 s MET 12 CO 0.00 0.29 0.58 1.15 -0.01 0.00 0.00 175.02 177.03 2aw0 h THR 13 N 3.76 1.27 -3.36 2.05 2.02 -1.99 -3.50 112.91 113.16 2aw0 h THR 13 Ca -0.44 -2.35 -0.08 0.00 0.77 0.00 0.00 66.41 64.30 2aw0 h THR 13 Cb 1.21 2.85 -0.03 0.00 -1.74 0.00 0.00 68.15 70.43 2aw0 h THR 13 CO 0.71 0.59 0.11 0.00 0.37 0.00 0.00 175.52 177.30 2aw0 h ASN 15 N 2.05 0.00 -0.87 0.00 -0.73 -2.01 -1.71 115.58 112.31 2aw0 h ASN 15 Ca -0.29 0.00 0.16 0.00 1.87 0.00 0.00 56.30 58.03 2aw0 h ASN 15 Cb 1.25 0.00 -0.07 0.00 0.27 0.00 0.00 38.32 39.77 2aw0 h ASN 15 CO 0.38 0.02 0.56 0.28 -0.37 0.00 0.00 177.43 178.30 2aw0 h SER 16 N 0.00 0.55 0.65 1.15 0.02 -1.99 -0.86 113.55 113.08 2aw0 h SER 16 Ca -0.00 0.04 -0.03 0.00 -0.84 0.00 0.00 61.79 60.96 2aw0 h SER 16 Cb 0.05 -0.07 0.01 0.00 0.14 0.00 0.00 62.40 62.53 2aw0 h SER 16 CO 0.00 0.27 -0.31 0.00 -1.14 0.00 0.00 176.83 175.64 2aw0 h VAL 18 N -0.89 0.37 0.27 0.00 2.07 -1.46 -0.42 116.25 116.19 2aw0 h VAL 18 Ca -0.09 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.43 2aw0 h VAL 18 Cb 0.68 0.37 -0.02 0.00 -1.52 0.00 0.00 31.29 30.80 2aw0 h VAL 18 CO 0.15 0.00 -0.25 1.56 0.02 0.00 0.00 177.57 179.05 2aw0 h GLN 19 N -0.18 -0.52 -0.02 1.57 4.20 -1.16 -1.48 115.11 117.53 2aw0 h GLN 19 Ca 0.18 0.04 -0.00 0.00 0.06 0.00 0.00 58.65 58.93 2aw0 h GLN 19 Cb 0.46 0.12 -0.00 0.00 0.30 0.00 0.00 27.48 28.36 2aw0 h GLN 19 CO -0.48 -0.35 0.01 0.66 -0.67 0.00 0.00 178.83 178.00 2aw0 h SER 20 N -0.54 0.02 0.06 1.46 4.64 -0.85 -0.64 113.55 117.69 2aw0 h SER 20 Ca -0.01 -0.12 0.03 0.00 -0.47 0.00 0.00 61.79 61.22 2aw0 h SER 20 Cb 0.49 -0.01 -0.05 0.00 -0.31 0.00 0.00 62.40 62.53 2aw0 h SER 20 CO -0.04 0.13 -0.36 0.40 -0.87 0.00 0.00 176.83 176.09 2aw0 h ILE 21 N -0.09 0.25 -0.06 0.95 2.04 -1.08 -1.08 117.51 118.43 2aw0 h ILE 21 Ca 0.01 0.00 0.02 0.00 1.00 0.00 0.00 64.86 65.89 2aw0 h ILE 21 Cb 0.12 0.25 -0.02 0.00 -0.74 0.00 0.00 36.82 36.42 2aw0 h ILE 21 CO -0.00 0.00 -0.06 -0.08 0.00 0.00 0.00 178.15 178.01 2aw0 h GLU 22 N -0.55 -0.08 -0.27 2.37 4.81 -1.16 -1.08 114.58 118.62 2aw0 h GLU 22 Ca 0.04 0.01 0.06 0.00 -0.13 0.00 0.00 59.36 59.34 2aw0 h GLU 22 Cb 0.61 0.02 -0.06 0.00 0.63 0.00 0.00 28.75 29.94 2aw0 h GLU 22 CO -0.25 -0.05 -0.15 0.78 -0.73 0.00 0.00 179.01 178.61 2aw0 h GLY 23 N -0.08 0.05 0.98 1.92 0.00 -0.92 -0.52 103.07 104.50 2aw0 h GLY 23 Ca 0.05 0.19 -0.03 0.00 0.00 0.00 0.00 47.33 47.54 2aw0 h GLY 23 CO -0.11 -0.16 -0.25 -2.08 0.00 0.00 0.00 176.54 173.94 2aw0 h VAL 24 N -0.12 0.49 -0.54 4.60 2.07 -0.99 -3.25 116.25 118.51 2aw0 h VAL 24 Ca 0.14 -0.05 -0.06 0.00 0.82 0.00 0.00 66.70 67.55 2aw0 h VAL 24 Cb 0.34 0.52 -0.02 0.00 -1.52 0.00 0.00 31.29 30.60 2aw0 h VAL 24 CO -0.35 0.01 0.09 0.40 0.02 0.00 0.00 177.57 177.74 2aw0 h ILE 25 N -0.72 1.24 -1.01 4.57 2.04 -0.99 -1.49 117.51 121.16 2aw0 h ILE 25 Ca -0.07 -0.90 0.26 0.00 1.00 0.00 0.00 64.86 65.16 2aw0 h ILE 25 Cb 0.54 0.72 -0.07 0.00 -0.74 0.00 0.00 36.82 37.28 2aw0 h ILE 25 CO 0.12 0.33 0.68 0.28 0.00 0.00 0.00 178.15 179.56 2aw0 h SER 26 N 0.81 0.27 0.64 1.72 0.02 -1.13 -1.58 113.55 114.31 2aw0 h SER 26 Ca 0.17 0.04 0.00 0.00 -0.84 0.00 0.00 61.79 61.16 2aw0 h SER 26 Cb 0.36 -0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.89 2aw0 h SER 26 CO 0.01 0.07 -0.57 0.29 -1.14 0.00 0.00 176.83 175.49 2aw0 n LYS 27 N -4.45 0.13 -2.28 3.45 5.02 -0.57 -4.83 118.16 114.63 2aw0 n LYS 27 Ca 0.23 0.03 -0.41 0.00 -2.02 0.00 0.00 58.31 56.14 2aw0 n LYS 27 Cb 0.92 -1.57 -0.03 0.00 -0.02 0.00 0.00 35.03 34.32 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 -3.07 4.48 0.21 1.97 1.02 -0.60 -4.96 119.74 118.79 2aw0 s LYS 28 Ca 0.09 2.03 -0.31 0.00 0.02 0.00 0.00 55.97 57.80 2aw0 s LYS 28 Cb 0.16 -3.13 -0.10 0.00 -0.52 0.00 0.00 37.83 34.24 2aw0 s LYS 28 CO 0.71 -0.02 1.48 -1.25 -0.92 0.00 0.00 175.35 175.35 2aw0 s PRO 29 N -1.50 4.25 0.00 -1.68 0.04 -1.26 -2.49 135.00 132.36 2aw0 s PRO 29 Ca 0.48 2.30 0.00 0.00 0.04 0.00 0.00 61.00 63.82 2aw0 s PRO 29 Cb -0.36 -3.14 0.00 0.00 0.04 0.00 0.00 34.50 31.04 2aw0 s PRO 29 CO 0.47 -0.49 0.00 0.41 0.04 0.00 0.00 177.00 177.43 2aw0 n GLY 30 N 2.86 2.56 3.74 0.56 0.00 -1.26 -4.02 105.19 109.63 2aw0 n GLY 30 Ca 0.10 -0.35 -0.41 0.00 0.00 0.00 0.00 46.02 45.35 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 -1.79 3.26 0.00 1.61 1.01 -1.04 -1.39 120.40 122.06 2aw0 s VAL 31 Ca 0.00 1.07 0.00 0.00 0.00 0.00 0.00 61.98 63.05 2aw0 s VAL 31 Cb 0.00 -3.68 0.00 0.00 0.00 0.00 0.00 36.38 32.70 2aw0 s VAL 31 CO 0.00 0.18 0.00 0.29 0.00 0.00 0.00 175.10 175.57 2aw0 n LYS 32 N 2.37 0.00 -3.17 2.72 5.02 -0.46 -4.93 118.16 119.71 2aw0 n LYS 32 Ca 0.05 0.00 -0.35 0.00 -2.02 0.00 0.00 58.31 55.99 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 0.15 6.93 -0.09 4.39 1.04 -1.26 -4.95 113.70 119.91 2aw0 s SER 33 Ca 0.00 1.30 -0.14 0.00 0.48 0.00 0.00 55.95 57.59 2aw0 s SER 33 Cb 0.00 -2.37 0.03 0.00 0.10 0.00 0.00 66.02 63.78 2aw0 s SER 33 CO 0.00 -0.02 0.36 -0.51 0.98 0.00 0.00 173.24 174.05 2aw0 s ILE 34 N -1.64 0.02 -0.02 -1.02 2.07 -1.26 -1.04 121.20 118.31 2aw0 s ILE 34 Ca 0.45 -0.17 0.01 0.00 -1.41 0.00 0.00 60.65 59.53 2aw0 s ILE 34 Cb -0.15 -0.56 0.01 0.00 0.13 0.00 0.00 42.46 41.89 2aw0 s ILE 34 CO 0.20 -0.09 -0.05 -0.60 -1.91 0.00 0.00 174.94 172.48 2aw0 s ARG 35 N -0.39 0.55 0.02 3.50 3.00 -0.69 -5.04 118.95 119.90 2aw0 s ARG 35 Ca -0.05 -0.15 0.07 0.00 -1.00 0.00 0.00 55.73 54.59 2aw0 s ARG 35 Cb -0.03 -0.56 -0.02 0.00 0.00 0.00 0.00 34.95 34.34 2aw0 s ARG 35 CO 0.02 0.05 -0.21 0.08 0.00 0.00 0.00 175.30 175.24 2aw0 s VAL 36 N 0.24 1.65 -0.06 7.11 1.01 -1.26 -0.91 120.40 128.18 2aw0 s VAL 36 Ca -0.03 -1.09 -0.03 0.00 0.00 0.00 0.00 61.98 60.84 2aw0 s VAL 36 Cb -0.07 -1.41 0.04 0.00 0.00 0.00 0.00 36.38 34.94 2aw0 s VAL 36 CO -0.00 0.29 0.14 -0.55 0.00 0.00 0.00 175.10 174.98 2aw0 s SER 37 N -0.94 -0.11 -0.04 3.32 0.15 -0.43 -5.00 113.70 110.65 2aw0 s SER 37 Ca 0.08 0.29 -0.22 0.00 0.70 0.00 0.00 55.95 56.79 2aw0 s SER 37 Cb -0.08 0.19 -0.26 0.00 -1.71 0.00 0.00 66.02 64.15 2aw0 s SER 37 CO 0.01 -0.14 1.00 0.25 1.20 0.00 0.00 173.24 175.56 2aw0 h LEU 38 N 7.13 0.39 -0.62 3.45 6.46 -1.95 -0.68 115.31 129.49 2aw0 h LEU 38 Ca -0.42 -0.84 0.12 0.00 -0.12 0.00 0.00 57.88 56.62 2aw0 h LEU 38 Cb 1.14 -0.12 -0.09 0.00 -0.73 0.00 0.00 40.66 40.86 2aw0 h LEU 38 CO 0.43 1.18 0.13 0.00 -0.62 0.00 0.00 178.44 179.56 2aw0 h ALA 39 N 0.21 0.74 -0.00 1.25 0.00 -1.97 -0.44 119.26 119.06 2aw0 h ALA 39 Ca -0.08 0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.97 2aw0 h ALA 39 Cb 1.30 0.18 0.00 0.00 0.00 0.00 0.00 17.79 19.27 2aw0 h ALA 39 CO 0.10 -0.31 -0.47 0.09 0.00 0.00 0.00 179.25 178.66 2aw0 n ASN 40 N -5.13 0.52 -3.66 0.00 3.02 -1.25 -4.99 115.26 103.76 2aw0 n ASN 40 Ca 0.10 -0.28 -0.25 0.00 -0.03 0.00 0.00 54.58 54.12 2aw0 n ASN 40 Cb 0.34 0.22 0.04 0.00 -0.61 0.00 0.00 39.78 39.76 2aw0 n ASN 40 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 2aw0 n SER 41 N -1.44 -3.56 -3.78 6.41 7.64 -0.17 -4.92 113.62 113.79 2aw0 n SER 41 Ca 0.06 -0.91 -0.07 0.00 1.01 0.00 0.00 58.87 58.95 2aw0 n SER 41 Cb 0.34 -3.80 -0.02 0.00 -1.01 0.00 0.00 64.21 59.72 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 -3.85 -0.29 -0.12 6.43 4.22 -0.64 -1.16 114.94 119.52 2aw0 s ASN 42 Ca 0.27 -0.49 -0.02 0.00 -2.14 0.00 0.00 52.86 50.47 2aw0 s ASN 42 Cb -0.08 0.68 0.04 0.00 1.28 0.00 0.00 41.25 43.17 2aw0 s ASN 42 CO 0.83 -1.24 0.01 -0.83 -2.04 0.00 0.00 177.10 173.84 2aw0 s GLY 43 N -2.89 0.56 -0.42 0.45 0.00 0.12 -1.32 107.32 103.83 2aw0 s GLY 43 Ca 0.10 -0.35 -0.16 0.00 0.00 0.00 0.00 44.72 44.31 2aw0 s GLY 43 CO 0.03 1.25 0.33 -1.59 0.00 0.00 0.00 173.10 173.13 2aw0 s THR 44 N 1.93 5.22 -0.16 0.90 2.01 -0.09 -1.13 115.64 124.32 2aw0 s THR 44 Ca 0.03 -0.62 0.01 0.00 0.31 0.00 0.00 61.69 61.43 2aw0 s THR 44 Cb -0.14 -3.96 0.01 0.00 0.01 0.00 0.00 72.50 68.42 2aw0 s THR 44 CO -0.06 -0.35 -0.20 -0.69 -0.69 0.00 0.00 174.62 172.63 2aw0 s VAL 45 N 1.78 2.18 -0.08 3.82 1.01 -0.42 -1.70 120.40 126.99 2aw0 s VAL 45 Ca 0.06 -0.92 -0.20 0.00 0.00 0.00 0.00 61.98 60.93 2aw0 s VAL 45 Cb -0.19 -1.90 -0.04 0.00 0.00 0.00 0.00 36.38 34.24 2aw0 s VAL 45 CO 0.11 0.54 0.55 -0.70 0.00 0.00 0.00 175.10 175.60 2aw0 s GLU 46 N 1.07 4.35 0.17 2.72 2.12 -0.21 -1.44 118.70 127.48 2aw0 s GLU 46 Ca -0.01 0.61 -0.12 0.00 0.36 0.00 0.00 54.97 55.82 2aw0 s GLU 46 Cb -0.14 -3.41 0.00 0.00 0.26 0.00 0.00 34.13 30.84 2aw0 s GLU 46 CO -0.07 0.19 0.36 1.52 -0.54 0.00 0.00 175.26 176.72 2aw0 s TYR 47 N 0.46 0.24 -0.36 5.30 1.13 -0.17 -1.35 117.35 122.60 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 40.78 2aw0 s TYR 47 CO 0.14 -0.78 0.24 0.34 -2.51 0.00 0.00 175.55 172.98 2aw0 s ASP 48 N -2.94 5.98 0.36 -0.18 2.15 -0.49 -1.27 116.67 120.28 2aw0 s ASP 48 Ca 0.15 -0.63 0.18 0.00 0.43 0.00 0.00 52.55 52.68 2aw0 s ASP 48 Cb 0.02 -2.12 1.19 0.00 -0.30 0.00 0.00 42.92 41.72 2aw0 s ASP 48 CO -0.01 -0.31 1.64 -0.65 -0.17 0.00 0.00 175.17 175.68 2aw0 h PRO 49 N 8.51 0.22 -0.31 4.34 0.11 -1.77 -0.84 132.00 142.25 2aw0 h PRO 49 Ca -0.30 -0.01 -0.08 0.00 0.11 0.00 0.00 66.00 65.72 2aw0 h PRO 49 Cb 1.14 -0.05 -0.02 0.00 0.11 0.00 0.00 31.00 32.19 2aw0 h PRO 49 CO 0.66 0.14 -0.13 -0.07 -0.21 0.00 0.00 178.00 178.39 2aw0 h LEU 50 N 0.22 0.53 0.00 2.35 4.07 -1.95 -3.31 115.31 117.22 2aw0 h LEU 50 Ca 0.77 -0.14 -0.35 0.00 0.08 0.00 0.00 57.88 58.24 2aw0 h LEU 50 Cb 1.92 -0.14 -0.07 0.00 1.08 0.00 0.00 40.66 43.45 2aw0 h LEU 50 CO -0.61 0.69 -2.33 0.18 -1.08 0.00 0.00 178.44 175.29 2aw0 n LEU 51 N -4.19 0.00 -4.01 1.67 4.77 -0.62 -5.03 117.00 109.58 2aw0 n LEU 51 Ca 0.01 0.00 -0.11 0.00 -0.03 0.00 0.00 56.01 55.87 2aw0 n LEU 51 Cb 0.34 0.47 -0.04 0.00 -2.33 0.00 0.00 43.42 41.85 2aw0 n LEU 51 CO 0.41 0.47 0.20 0.28 -1.33 0.00 0.00 177.39 177.42 2aw0 s THR 52 N -2.51 0.00 0.13 -5.08 -1.32 -0.42 -4.73 115.64 101.70 2aw0 s THR 52 Ca -0.10 -1.44 -0.10 0.00 -1.21 0.00 0.00 61.69 58.84 2aw0 s THR 52 Cb 0.06 -2.47 -0.00 0.00 -1.51 0.00 0.00 72.50 68.58 2aw0 s THR 52 CO 0.81 0.00 0.26 -0.94 -2.21 0.00 0.00 174.62 172.54 2aw0 s SER 53 N -3.11 0.04 0.42 8.08 1.04 -1.26 -3.63 113.70 115.27 2aw0 s SER 53 Ca 0.25 -0.72 0.15 0.00 0.48 0.00 0.00 55.95 56.12 2aw0 s SER 53 Cb -0.01 0.40 1.03 0.00 0.10 0.00 0.00 66.02 67.55 2aw0 s SER 53 CO 0.14 -0.83 1.91 -0.65 0.98 0.00 0.00 173.24 174.79 2aw0 h PRO 54 N 2.60 0.43 -0.06 4.02 0.11 -1.98 -0.82 132.00 136.29 2aw0 h PRO 54 Ca -0.33 -0.03 -0.00 0.00 0.11 0.00 0.00 66.00 65.75 2aw0 h PRO 54 Cb 1.22 -0.10 -0.00 0.00 0.11 0.00 0.00 31.00 32.23 2aw0 h PRO 54 CO 0.51 0.28 0.02 0.93 -0.21 0.00 0.00 178.00 179.54 2aw0 h GLU 55 N 0.44 0.09 -0.40 1.05 5.08 -1.98 -0.82 114.58 118.04 2aw0 h GLU 55 Ca 0.39 -0.02 -0.01 0.00 -1.00 0.00 0.00 59.36 58.72 2aw0 h GLU 55 Cb 0.87 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 30.09 2aw0 h GLU 55 CO -0.13 0.22 0.20 1.15 -1.00 0.00 0.00 179.01 179.45 2aw0 h THR 56 N -0.06 1.17 0.01 1.13 2.02 -1.74 0.11 112.91 115.56 2aw0 h THR 56 Ca 0.02 -0.49 -0.00 0.00 0.77 0.00 0.00 66.41 66.71 2aw0 h THR 56 Cb 0.17 0.75 0.00 0.00 -1.74 0.00 0.00 68.15 67.33 2aw0 h THR 56 CO -0.00 0.19 -0.01 -0.07 0.37 0.00 0.00 175.52 176.00 2aw0 h LEU 57 N 0.51 -0.01 -0.86 2.58 3.38 -1.16 -1.01 115.31 118.74 2aw0 h LEU 57 Ca 0.14 -0.02 0.09 0.00 0.09 0.00 0.00 57.88 58.18 2aw0 h LEU 57 Cb 0.12 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 40.80 2aw0 h LEU 57 CO -0.02 0.01 0.51 0.03 0.09 0.00 0.00 178.44 179.06 2aw0 h ARG 58 N -0.04 0.83 -0.65 1.13 3.08 -1.04 -1.77 114.38 115.93 2aw0 h ARG 58 Ca -0.00 -0.05 0.12 0.00 0.07 0.00 0.00 59.98 60.12 2aw0 h ARG 58 Cb 0.04 -0.19 -0.09 0.00 0.08 0.00 0.00 29.97 29.81 2aw0 h ARG 58 CO 0.00 0.55 0.17 0.78 -1.07 0.00 0.00 179.97 180.40 2aw0 h GLY 59 N 0.86 0.87 0.93 0.04 0.00 -0.21 0.65 103.07 106.21 2aw0 h GLY 59 Ca 0.41 -0.05 -0.00 0.00 0.00 0.00 0.00 47.33 47.68 2aw0 h GLY 59 CO -0.24 -0.12 0.08 0.00 0.00 0.00 0.00 176.54 176.26 2aw0 h ALA 60 N 1.51 0.18 -0.92 3.60 0.00 -0.35 -0.59 119.26 122.69 2aw0 h ALA 60 Ca 0.35 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 55.19 2aw0 h ALA 60 Cb 0.52 -0.06 -0.04 0.00 0.00 0.00 0.00 17.79 18.21 2aw0 h ALA 60 CO -0.41 -0.27 0.55 0.82 0.00 0.00 0.00 179.25 179.93 2aw0 h ILE 61 N 0.13 1.25 -0.40 0.00 1.08 -0.91 -0.69 117.51 117.98 2aw0 h ILE 61 Ca 0.05 -0.55 -0.03 0.00 -0.39 0.00 0.00 64.86 63.93 2aw0 h ILE 61 Cb 0.08 -0.04 -0.02 0.00 -3.07 0.00 0.00 36.82 33.78 2aw0 h ILE 61 CO -0.01 0.27 0.11 -0.08 -0.69 0.00 0.00 178.15 177.75 2aw0 h GLU 62 N 1.27 0.63 -0.44 2.37 4.81 -0.69 0.07 114.58 122.59 2aw0 h GLU 62 Ca 0.33 -0.14 0.00 0.00 -0.13 0.00 0.00 59.36 59.42 2aw0 h GLU 62 Cb -0.05 -0.09 -0.02 0.00 0.63 0.00 0.00 28.75 29.22 2aw0 h GLU 62 CO -0.06 0.64 0.29 0.22 -0.73 0.00 0.00 179.01 179.37 2aw0 h ASP 63 N 0.50 0.51 -0.61 1.04 3.58 -0.72 -2.51 116.42 118.21 2aw0 h ASP 63 Ca 0.13 -0.01 0.01 0.00 0.42 0.00 0.00 57.03 57.57 2aw0 h ASP 63 Cb 0.28 -0.13 -0.03 0.00 1.72 0.00 0.00 39.33 41.17 2aw0 h ASP 63 CO -0.00 0.37 0.40 0.24 -2.88 0.00 0.00 179.24 177.37 2aw0 h MET 64 N 0.60 0.78 0.00 0.28 2.86 -0.99 -3.48 114.93 114.98 2aw0 h MET 64 Ca 0.16 -0.05 0.00 0.00 -2.06 0.00 0.00 59.70 57.76 2aw0 h MET 64 Cb -0.07 -0.18 0.00 0.00 0.06 0.00 0.00 31.60 31.41 2aw0 h MET 64 CO -0.04 0.52 0.00 0.41 1.06 0.00 0.00 176.91 178.86 2aw0 n GLY 65 N -1.26 0.54 3.12 8.32 0.00 -0.04 -5.10 105.19 110.77 2aw0 n GLY 65 Ca 0.05 -0.81 -0.08 0.00 0.00 0.00 0.00 46.02 45.18 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 -0.62 0.66 -0.55 1.61 0.08 -0.90 -4.99 117.98 113.27 2aw0 s PHE 66 Ca 0.00 -1.14 -0.27 0.00 0.12 0.00 0.00 56.93 55.64 2aw0 s PHE 66 Cb 0.00 -0.42 -0.00 0.00 -0.57 0.00 0.00 43.02 42.02 2aw0 s PHE 66 CO 0.00 -0.44 1.62 0.34 -0.10 0.00 0.00 175.22 176.64 2aw0 s ASP 67 N -2.98 5.80 -0.39 1.36 2.15 -0.47 -4.23 116.67 117.92 2aw0 s ASP 67 Ca 0.14 0.43 -0.12 0.00 0.43 0.00 0.00 52.55 53.43 2aw0 s ASP 67 Cb 0.08 -2.54 0.03 0.00 -0.30 0.00 0.00 42.92 40.18 2aw0 s ASP 67 CO -0.05 -1.94 0.24 0.00 -0.17 0.00 0.00 175.17 173.25 2aw0 s ALA 68 N 7.19 3.34 -0.07 3.66 0.00 -1.26 -2.21 121.76 132.42 2aw0 s ALA 68 Ca 0.61 -1.72 -0.15 0.00 0.00 0.00 0.00 51.96 50.69 2aw0 s ALA 68 Cb -0.13 -2.69 0.03 0.00 0.00 0.00 0.00 23.12 20.33 2aw0 s ALA 68 CO 0.24 -1.42 0.35 -0.08 0.00 0.00 0.00 175.76 174.86 2aw0 s THR 69 N 1.59 0.03 0.38 0.00 -1.32 -0.99 -5.01 115.64 110.32 2aw0 s THR 69 Ca 0.03 -0.26 -0.25 0.00 -1.21 0.00 0.00 61.69 60.00 2aw0 s THR 69 Cb -0.19 -0.60 -0.09 0.00 -1.51 0.00 0.00 72.50 70.11 2aw0 s THR 69 CO 0.08 -0.14 1.07 -0.76 -2.21 0.00 0.00 174.62 172.66 2aw0 s LEU 70 N -0.70 4.23 -0.24 9.08 1.43 -1.26 -0.18 118.68 131.04 2aw0 s LEU 70 Ca -0.08 2.12 -0.16 0.00 -1.03 0.00 0.00 54.13 54.98 2aw0 s LEU 70 Cb -0.04 -4.06 -0.12 0.00 0.03 0.00 0.00 46.19 42.01 2aw0 s LEU 70 CO 0.03 -0.45 -0.21 -0.24 0.23 0.00 0.00 176.35 175.71 2aw0 n SER 71 N 0.19 1.92 0.00 2.29 2.88 -0.03 -4.77 113.62 116.10 2aw0 n SER 71 Ca 0.04 0.38 0.00 0.00 -1.33 0.00 0.00 58.87 57.96 2aw0 n SER 71 Cb 0.48 -0.85 0.00 0.00 -0.75 0.00 0.00 64.21 63.10 2aw0 n SER 71 CO 0.00 0.00 0.00 -0.90 -1.23 0.00 0.00 175.04 172.91