#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 0.15 0.15 -5.08 -4.23 -1.26 -4.38 115.64 101.00 2aw0 s THR 2 Ca 0.00 -1.26 -0.03 0.00 -1.18 0.00 0.00 61.69 59.22 2aw0 s THR 2 Cb 0.00 -0.75 -0.03 0.00 1.34 0.00 0.00 72.50 73.05 2aw0 s THR 2 CO 0.00 -0.69 0.14 -1.10 -0.54 0.00 0.00 174.62 172.43 2aw0 s GLN 3 N -2.42 1.05 0.04 3.99 -1.52 -0.24 -4.94 119.66 115.61 2aw0 s GLN 3 Ca -0.07 -1.40 0.09 0.00 -1.95 0.00 0.00 55.36 52.03 2aw0 s GLN 3 Cb -0.03 0.29 -0.03 0.00 -0.22 0.00 0.00 33.01 33.02 2aw0 s GLN 3 CO -0.05 -0.34 -0.25 -2.00 -0.25 0.00 0.00 175.29 172.40 2aw0 s GLU 4 N -4.05 1.77 -0.03 2.91 2.12 -1.26 -1.29 118.70 118.88 2aw0 s GLU 4 Ca 0.25 -1.06 -0.03 0.00 0.36 0.00 0.00 54.97 54.49 2aw0 s GLU 4 Cb 0.06 -1.91 0.01 0.00 0.26 0.00 0.00 34.13 32.55 2aw0 s GLU 4 CO 0.03 0.50 0.08 -0.08 -0.54 0.00 0.00 175.26 175.25 2aw0 s THR 5 N -0.78 -0.00 -0.30 -1.70 -1.32 -0.53 -5.01 115.64 106.00 2aw0 s THR 5 Ca 0.11 0.01 -0.12 0.00 -1.21 0.00 0.00 61.69 60.48 2aw0 s THR 5 Cb -0.10 -0.12 -0.04 0.00 -1.51 0.00 0.00 72.50 70.73 2aw0 s THR 5 CO 0.02 0.00 0.22 -0.69 -2.21 0.00 0.00 174.62 171.96 2aw0 s VAL 6 N 0.08 5.30 -0.18 5.08 1.01 0.36 -1.03 120.40 131.02 2aw0 s VAL 6 Ca -0.00 0.05 -0.08 0.00 0.00 0.00 0.00 61.98 61.95 2aw0 s VAL 6 Cb -0.01 -3.60 -0.04 0.00 0.00 0.00 0.00 36.38 32.72 2aw0 s VAL 6 CO -0.00 0.15 0.09 -0.63 0.00 0.00 0.00 175.10 174.71 2aw0 s ILE 7 N 1.76 5.04 -0.00 2.22 -1.09 -0.25 -1.15 121.20 127.73 2aw0 s ILE 7 Ca 0.07 0.06 -0.30 0.00 -2.23 0.00 0.00 60.65 58.24 2aw0 s ILE 7 Cb -0.16 -3.28 -0.05 0.00 -1.58 0.00 0.00 42.46 37.39 2aw0 s ILE 7 CO 0.11 0.46 1.36 0.20 -1.23 0.00 0.00 174.94 175.84 2aw0 s ASN 8 N 0.27 6.89 -0.47 3.58 -0.87 0.70 -0.70 114.94 124.34 2aw0 s ASN 8 Ca 0.06 2.07 0.03 0.00 -1.57 0.00 0.00 52.86 53.44 2aw0 s ASN 8 Cb -0.12 -2.56 0.14 0.00 -0.02 0.00 0.00 41.25 38.69 2aw0 s ASN 8 CO -0.01 -0.68 0.26 -0.63 -2.57 0.00 0.00 177.10 173.47 2aw0 s ILE 9 N 2.26 1.69 0.23 0.60 1.01 -0.35 -2.03 121.20 124.61 2aw0 s ILE 9 Ca 0.62 -2.81 0.04 0.00 0.00 0.00 0.00 60.65 58.50 2aw0 s ILE 9 Cb -0.30 -2.17 -0.03 0.00 0.01 0.00 0.00 42.46 39.96 2aw0 s ILE 9 CO 0.26 -0.90 0.35 -1.81 0.00 0.00 0.00 174.94 172.84 2aw0 s ASP 10 N 0.10 6.32 0.00 3.58 1.01 -0.80 -3.83 116.67 123.06 2aw0 s ASP 10 Ca 0.18 0.10 0.00 0.00 0.71 0.00 0.00 52.55 53.54 2aw0 s ASP 10 Cb -0.22 -1.87 0.00 0.00 1.01 0.00 0.00 42.92 41.83 2aw0 s ASP 10 CO -0.02 -0.05 0.00 0.61 0.21 0.00 0.00 175.17 175.92 2aw0 n GLY 11 N -1.27 0.55 3.70 0.21 0.00 -1.26 -1.19 105.19 105.93 2aw0 n GLY 11 Ca -0.09 -0.83 -0.42 0.00 0.00 0.00 0.00 46.02 44.69 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 -1.75 4.51 -0.07 1.61 -1.94 -1.26 -4.91 119.30 115.49 2aw0 s MET 12 Ca 0.00 1.43 -0.15 0.00 -1.71 0.00 0.00 55.69 55.26 2aw0 s MET 12 Cb 0.00 -3.48 -0.30 0.00 2.01 0.00 0.00 34.83 33.06 2aw0 s MET 12 CO 0.00 -0.14 0.68 1.79 -0.01 0.00 0.00 175.02 177.33 2aw0 h THR 13 N 4.88 1.09 -3.04 2.05 1.35 -1.99 -3.50 112.91 113.75 2aw0 h THR 13 Ca -0.38 -2.48 -0.04 0.00 -0.55 0.00 0.00 66.41 62.96 2aw0 h THR 13 Cb 1.20 2.83 0.01 0.00 -1.73 0.00 0.00 68.15 70.45 2aw0 h THR 13 CO 0.79 0.76 0.26 0.00 -0.25 0.00 0.00 175.52 177.08 2aw0 h ASN 15 N 2.00 0.09 -0.96 0.00 7.08 -2.01 -1.63 115.58 120.16 2aw0 h ASN 15 Ca -0.34 0.01 0.12 0.00 -3.08 0.00 0.00 56.30 53.01 2aw0 h ASN 15 Cb 1.25 -0.01 -0.08 0.00 -2.08 0.00 0.00 38.32 37.40 2aw0 h ASN 15 CO 0.43 0.05 0.61 0.28 -2.08 0.00 0.00 177.43 176.72 2aw0 h SER 16 N 0.10 0.84 -0.06 6.14 0.02 -1.99 -1.00 113.55 117.60 2aw0 h SER 16 Ca 0.30 0.04 -0.00 0.00 -0.84 0.00 0.00 61.79 61.29 2aw0 h SER 16 Cb 1.07 -0.12 -0.00 0.00 0.14 0.00 0.00 62.40 63.48 2aw0 h SER 16 CO -0.03 0.45 0.02 0.00 -1.14 0.00 0.00 176.83 176.12 2aw0 h VAL 18 N -0.09 0.51 -0.24 0.00 2.07 -1.44 -0.25 116.25 116.81 2aw0 h VAL 18 Ca 0.02 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.56 2aw0 h VAL 18 Cb 0.21 0.51 -0.02 0.00 -1.52 0.00 0.00 31.29 30.46 2aw0 h VAL 18 CO -0.00 0.00 0.10 -0.61 0.02 0.00 0.00 177.57 177.08 2aw0 h GLN 19 N -0.15 0.21 0.08 1.57 4.15 -1.15 -1.85 115.11 117.96 2aw0 h GLN 19 Ca 0.15 -0.01 -0.00 0.00 0.77 0.00 0.00 58.65 59.55 2aw0 h GLN 19 Cb 0.37 -0.05 0.00 0.00 0.21 0.00 0.00 27.48 28.02 2aw0 h GLN 19 CO -0.36 0.14 -0.04 0.77 -1.93 0.00 0.00 178.83 177.41 2aw0 h SER 20 N 0.22 -0.09 0.54 -0.69 0.02 -0.64 -2.23 113.55 110.70 2aw0 h SER 20 Ca 0.10 -0.04 -0.03 0.00 -0.84 0.00 0.00 61.79 60.99 2aw0 h SER 20 Cb 0.05 0.02 0.01 0.00 0.14 0.00 0.00 62.40 62.62 2aw0 h SER 20 CO -0.09 -0.02 -0.26 0.40 -1.14 0.00 0.00 176.83 175.72 2aw0 h ILE 21 N -0.15 0.46 -0.54 3.27 2.04 -0.98 -0.93 117.51 120.68 2aw0 h ILE 21 Ca -0.01 -0.03 0.04 0.00 1.00 0.00 0.00 64.86 65.86 2aw0 h ILE 21 Cb 0.12 0.48 -0.04 0.00 -0.74 0.00 0.00 36.82 36.63 2aw0 h ILE 21 CO 0.02 0.01 0.29 1.05 0.00 0.00 0.00 178.15 179.51 2aw0 h GLU 22 N -0.75 0.54 0.64 2.37 4.11 -1.37 -0.32 114.58 119.79 2aw0 h GLU 22 Ca -0.07 -0.03 -0.03 0.00 0.07 0.00 0.00 59.36 59.30 2aw0 h GLU 22 Cb 0.57 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 29.69 2aw0 h GLU 22 CO 0.12 0.36 -0.42 0.78 0.07 0.00 0.00 179.01 179.92 2aw0 h GLY 23 N 0.56 -1.19 0.99 1.06 0.00 -1.29 -2.39 103.07 100.81 2aw0 h GLY 23 Ca 0.24 0.50 -0.03 0.00 0.00 0.00 0.00 47.33 48.03 2aw0 h GLY 23 CO -0.15 -0.40 -0.31 -2.08 0.00 0.00 0.00 176.54 173.60 2aw0 h VAL 24 N -1.00 0.36 -0.30 4.60 2.07 -1.03 -3.20 116.25 117.75 2aw0 h VAL 24 Ca -0.08 0.00 -0.04 0.00 0.82 0.00 0.00 66.70 67.40 2aw0 h VAL 24 Cb 0.81 0.36 -0.02 0.00 -1.52 0.00 0.00 31.29 30.92 2aw0 h VAL 24 CO 0.07 0.00 0.03 0.40 0.02 0.00 0.00 177.57 178.09 2aw0 h ILE 25 N -0.87 1.17 -0.95 4.57 1.08 -1.14 -2.42 117.51 118.95 2aw0 h ILE 25 Ca -0.09 -0.63 0.22 0.00 -0.39 0.00 0.00 64.86 63.98 2aw0 h ILE 25 Cb 0.67 0.91 -0.07 0.00 -3.07 0.00 0.00 36.82 35.25 2aw0 h ILE 25 CO 0.14 0.22 0.63 -1.28 -0.69 0.00 0.00 178.15 177.16 2aw0 h SER 26 N 0.44 0.41 0.29 1.72 0.87 -1.41 -1.44 113.55 114.42 2aw0 h SER 26 Ca 0.10 0.05 0.00 0.00 -1.23 0.00 0.00 61.79 60.71 2aw0 h SER 26 Cb 0.25 -0.02 0.00 0.00 -0.44 0.00 0.00 62.40 62.18 2aw0 h SER 26 CO 0.00 0.14 -0.26 0.29 -0.53 0.00 0.00 176.83 176.47 2aw0 n LYS 27 N -4.53 0.72 -2.18 2.24 4.01 -0.91 -4.26 118.16 113.25 2aw0 n LYS 27 Ca 0.21 -0.40 -0.36 0.00 -0.51 0.00 0.00 58.31 57.25 2aw0 n LYS 27 Cb 0.76 -1.49 0.00 0.00 -0.51 0.00 0.00 35.03 33.80 2aw0 n LYS 27 CO 0.00 0.00 0.00 0.15 -1.11 0.00 0.00 177.40 176.44 2aw0 s LYS 28 N -2.56 3.47 0.10 1.97 -0.14 -0.54 -4.92 119.74 117.12 2aw0 s LYS 28 Ca 0.23 1.78 -0.36 0.00 -1.36 0.00 0.00 55.97 56.27 2aw0 s LYS 28 Cb 0.19 -2.21 -0.17 0.00 -1.68 0.00 0.00 37.83 33.96 2aw0 s LYS 28 CO 0.53 -0.79 1.16 -2.30 -0.76 0.00 0.00 175.35 173.19 2aw0 n PRO 29 N -0.93 0.80 0.00 -1.68 -0.02 -1.26 -1.88 135.00 130.03 2aw0 n PRO 29 Ca 0.10 0.29 0.00 0.00 -2.02 0.00 0.00 63.50 61.87 2aw0 n PRO 29 Cb 0.49 -1.81 0.00 0.00 -0.02 0.00 0.00 33.50 32.16 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 2.07 1.79 3.77 -1.23 0.00 -1.26 -4.44 105.19 105.88 2aw0 n GLY 30 Ca 0.18 -0.28 -0.39 0.00 0.00 0.00 0.00 46.02 45.53 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 -0.39 2.80 0.00 1.61 1.01 -0.79 -1.52 120.40 123.12 2aw0 s VAL 31 Ca 0.00 0.69 0.00 0.00 0.00 0.00 0.00 61.98 62.67 2aw0 s VAL 31 Cb 0.00 -3.40 0.00 0.00 0.00 0.00 0.00 36.38 32.98 2aw0 s VAL 31 CO 0.00 0.09 0.00 0.29 0.00 0.00 0.00 175.10 175.48 2aw0 n LYS 32 N 0.09 0.00 -3.09 2.72 5.02 -0.34 -4.73 118.16 117.83 2aw0 n LYS 32 Ca 0.04 0.00 -0.27 0.00 -2.02 0.00 0.00 58.31 56.06 2aw0 n LYS 32 Cb 0.45 0.00 -0.02 0.00 -0.02 0.00 0.00 35.03 35.44 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 0.76 6.37 -0.08 4.39 1.04 -1.25 -4.70 113.70 120.23 2aw0 s SER 33 Ca 0.00 0.76 -0.15 0.00 0.48 0.00 0.00 55.95 57.04 2aw0 s SER 33 Cb 0.00 -2.17 0.03 0.00 0.10 0.00 0.00 66.02 63.99 2aw0 s SER 33 CO 0.00 -0.35 0.37 -0.51 0.98 0.00 0.00 173.24 173.73 2aw0 s ILE 34 N -2.36 0.03 -0.23 -1.02 2.07 -1.26 -1.22 121.20 117.20 2aw0 s ILE 34 Ca 0.45 -0.21 -0.02 0.00 -1.41 0.00 0.00 60.65 59.46 2aw0 s ILE 34 Cb -0.10 -0.60 0.07 0.00 0.13 0.00 0.00 42.46 41.96 2aw0 s ILE 34 CO 0.36 -0.12 0.03 -0.60 -1.91 0.00 0.00 174.94 172.70 2aw0 s ARG 35 N -0.57 0.88 0.10 3.50 6.06 -0.35 -4.98 118.95 123.61 2aw0 s ARG 35 Ca -0.07 -0.69 -0.03 0.00 -2.50 0.00 0.00 55.73 52.44 2aw0 s ARG 35 Cb -0.04 -2.20 -0.05 0.00 0.06 0.00 0.00 34.95 32.73 2aw0 s ARG 35 CO 0.03 -0.71 0.31 0.08 -2.50 0.00 0.00 175.30 172.51 2aw0 s VAL 36 N 1.70 5.26 -0.10 7.11 1.01 -1.26 -1.11 120.40 133.00 2aw0 s VAL 36 Ca 0.00 -0.11 -0.04 0.00 0.00 0.00 0.00 61.98 61.83 2aw0 s VAL 36 Cb -0.18 -3.62 0.05 0.00 0.00 0.00 0.00 36.38 32.64 2aw0 s VAL 36 CO -0.11 0.10 0.21 -0.55 0.00 0.00 0.00 175.10 174.75 2aw0 s SER 37 N -2.40 0.33 0.06 3.32 0.15 -0.61 -5.00 113.70 109.54 2aw0 s SER 37 Ca 0.38 0.45 -0.20 0.00 0.70 0.00 0.00 55.95 57.28 2aw0 s SER 37 Cb -0.13 0.43 -0.12 0.00 -1.71 0.00 0.00 66.02 64.50 2aw0 s SER 37 CO 0.25 -0.22 1.46 0.25 1.20 0.00 0.00 173.24 176.18 2aw0 h LEU 38 N 7.99 0.32 -0.79 3.45 5.85 -1.95 0.12 115.31 130.29 2aw0 h LEU 38 Ca -0.22 -0.35 0.13 0.00 0.84 0.00 0.00 57.88 58.28 2aw0 h LEU 38 Cb 1.12 -0.09 -0.09 0.00 0.37 0.00 0.00 40.66 41.98 2aw0 h LEU 38 CO 0.22 0.59 0.39 0.00 -0.34 0.00 0.00 178.44 179.30 2aw0 h ALA 39 N 0.74 1.15 0.00 1.25 0.00 -1.97 -1.41 119.26 119.02 2aw0 h ALA 39 Ca 0.04 0.08 -0.03 0.00 0.00 0.00 0.00 54.91 55.00 2aw0 h ALA 39 Cb 0.45 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.22 2aw0 h ALA 39 CO 0.01 -0.09 -0.99 -0.91 0.00 0.00 0.00 179.25 177.27 2aw0 h ASN 40 N 0.59 0.00 -5.69 0.00 2.35 -1.99 -3.48 115.58 107.36 2aw0 h ASN 40 Ca 0.42 0.00 -0.31 0.00 -0.55 0.00 0.00 56.30 55.85 2aw0 h ASN 40 Cb 0.55 0.00 0.16 0.00 0.05 0.00 0.00 38.32 39.08 2aw0 h ASN 40 CO -0.34 0.10 -0.86 -1.20 -1.65 0.00 0.00 177.43 173.49 2aw0 n SER 41 N -2.75 -5.07 -3.82 5.81 7.64 0.34 -4.93 113.62 110.84 2aw0 n SER 41 Ca -0.01 -0.76 -0.09 0.00 1.01 0.00 0.00 58.87 59.01 2aw0 n SER 41 Cb 0.60 -4.74 -0.04 0.00 -1.01 0.00 0.00 64.21 59.02 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 -3.67 0.02 -0.12 6.43 2.20 -0.82 -1.21 114.94 117.77 2aw0 s ASN 42 Ca 0.34 -0.98 -0.03 0.00 -0.94 0.00 0.00 52.86 51.25 2aw0 s ASN 42 Cb -0.06 0.63 0.05 0.00 -2.00 0.00 0.00 41.25 39.86 2aw0 s ASN 42 CO 0.77 -1.22 0.04 -0.83 -2.94 0.00 0.00 177.10 172.92 2aw0 s GLY 43 N -3.04 0.46 -0.55 0.45 0.00 0.12 -1.57 107.32 103.18 2aw0 s GLY 43 Ca 0.22 -0.27 -0.16 0.00 0.00 0.00 0.00 44.72 44.50 2aw0 s GLY 43 CO 0.10 1.42 0.54 -1.59 0.00 0.00 0.00 173.10 173.57 2aw0 s THR 44 N 2.02 5.15 -0.16 0.90 2.01 -0.27 -1.09 115.64 124.20 2aw0 s THR 44 Ca 0.03 -1.42 -0.07 0.00 0.31 0.00 0.00 61.69 60.53 2aw0 s THR 44 Cb -0.14 -4.37 -0.04 0.00 0.01 0.00 0.00 72.50 67.96 2aw0 s THR 44 CO -0.07 -0.92 0.07 -0.69 -0.69 0.00 0.00 174.62 172.33 2aw0 s VAL 45 N 1.77 4.89 -0.22 3.82 1.01 -0.20 -1.21 120.40 130.26 2aw0 s VAL 45 Ca 0.05 -0.01 -0.08 0.00 0.00 0.00 0.00 61.98 61.94 2aw0 s VAL 45 Cb -0.29 -3.17 -0.04 0.00 0.00 0.00 0.00 36.38 32.88 2aw0 s VAL 45 CO 0.03 0.51 0.10 -1.61 0.00 0.00 0.00 175.10 174.13 2aw0 s GLU 46 N -0.06 3.91 0.25 2.72 8.01 -0.36 -1.46 118.70 131.71 2aw0 s GLU 46 Ca 0.07 -0.36 -0.10 0.00 0.01 0.00 0.00 54.97 54.58 2aw0 s GLU 46 Cb -0.12 -3.36 -0.01 0.00 -4.31 0.00 0.00 34.13 26.33 2aw0 s GLU 46 CO 0.01 0.06 0.44 1.52 0.01 0.00 0.00 175.26 177.30 2aw0 s TYR 47 N 1.00 0.52 -0.36 1.61 1.13 -0.41 -1.20 117.35 119.64 2aw0 s TYR 47 Ca 0.05 -0.86 -0.13 0.00 -1.41 0.00 0.00 57.07 54.72 2aw0 s TYR 47 Cb -0.14 0.08 0.00 0.00 -1.10 0.00 0.00 41.96 40.81 2aw0 s TYR 47 CO 0.03 -0.98 0.24 0.34 -2.51 0.00 0.00 175.55 172.68 2aw0 s ASP 48 N -3.06 5.95 0.34 -0.18 -1.08 -0.57 -1.08 116.67 116.99 2aw0 s ASP 48 Ca 0.25 -0.65 0.15 0.00 -0.52 0.00 0.00 52.55 51.78 2aw0 s ASP 48 Cb 0.00 -2.11 1.11 0.00 -1.46 0.00 0.00 42.92 40.46 2aw0 s ASP 48 CO 0.11 -0.31 1.65 -0.65 0.52 0.00 0.00 175.17 176.49 2aw0 h PRO 49 N 8.50 0.27 -0.39 4.34 0.11 -1.76 -1.01 132.00 142.06 2aw0 h PRO 49 Ca -0.29 -0.02 -0.04 0.00 0.11 0.00 0.00 66.00 65.76 2aw0 h PRO 49 Cb 1.14 -0.06 -0.02 0.00 0.11 0.00 0.00 31.00 32.17 2aw0 h PRO 49 CO 0.66 0.18 0.07 -0.07 -0.21 0.00 0.00 178.00 178.64 2aw0 h LEU 50 N 0.28 0.54 0.00 2.35 3.38 -1.95 -3.26 115.31 116.65 2aw0 h LEU 50 Ca 0.74 -0.08 -0.34 0.00 0.09 0.00 0.00 57.88 58.29 2aw0 h LEU 50 Cb 1.72 -0.14 -0.06 0.00 0.09 0.00 0.00 40.66 42.27 2aw0 h LEU 50 CO -0.63 0.55 -2.36 0.18 0.09 0.00 0.00 178.44 176.28 2aw0 n LEU 51 N -4.31 0.00 -3.66 1.67 4.77 -0.63 -5.02 117.00 109.82 2aw0 n LEU 51 Ca 0.02 0.00 -0.10 0.00 -0.03 0.00 0.00 56.01 55.90 2aw0 n LEU 51 Cb 0.21 0.46 -0.05 0.00 -2.33 0.00 0.00 43.42 41.71 2aw0 n LEU 51 CO 0.38 0.46 0.14 0.28 -1.33 0.00 0.00 177.39 177.33 2aw0 s THR 52 N -2.57 0.07 0.24 -5.08 -1.32 -0.48 -4.68 115.64 101.83 2aw0 s THR 52 Ca -0.10 -0.65 0.07 0.00 -1.21 0.00 0.00 61.69 59.81 2aw0 s THR 52 Cb 0.07 -1.21 -0.05 0.00 -1.51 0.00 0.00 72.50 69.80 2aw0 s THR 52 CO 0.84 -0.34 -0.11 -0.94 -2.21 0.00 0.00 174.62 171.86 2aw0 s SER 53 N -2.81 2.68 0.40 8.08 1.04 -1.26 -3.66 113.70 118.17 2aw0 s SER 53 Ca 0.04 -1.09 0.18 0.00 0.48 0.00 0.00 55.95 55.55 2aw0 s SER 53 Cb 0.02 -0.15 1.08 0.00 0.10 0.00 0.00 66.02 67.07 2aw0 s SER 53 CO -0.11 -0.23 1.80 -0.65 0.98 0.00 0.00 173.24 175.02 2aw0 h PRO 54 N 2.44 0.41 -0.30 4.02 0.11 -1.99 -1.00 132.00 135.68 2aw0 h PRO 54 Ca -0.39 -0.02 -0.08 0.00 0.11 0.00 0.00 66.00 65.62 2aw0 h PRO 54 Cb 1.23 -0.09 -0.01 0.00 0.11 0.00 0.00 31.00 32.24 2aw0 h PRO 54 CO 0.64 0.27 -0.11 0.93 -0.21 0.00 0.00 178.00 179.51 2aw0 h GLU 55 N 0.42 0.61 -0.36 1.05 3.07 -1.98 -0.12 114.58 117.27 2aw0 h GLU 55 Ca 0.56 -0.25 -0.02 0.00 -0.50 0.00 0.00 59.36 59.15 2aw0 h GLU 55 Cb 1.38 -0.03 -0.02 0.00 -0.84 0.00 0.00 28.75 29.25 2aw0 h GLU 55 CO -0.26 0.82 0.16 1.15 -1.40 0.00 0.00 179.01 179.48 2aw0 h THR 56 N 0.37 1.18 -0.10 1.13 2.02 -1.71 -0.80 112.91 114.99 2aw0 h THR 56 Ca 0.07 -0.52 -0.00 0.00 0.77 0.00 0.00 66.41 66.73 2aw0 h THR 56 Cb 0.62 0.86 -0.00 0.00 -1.74 0.00 0.00 68.15 67.88 2aw0 h THR 56 CO 0.04 0.19 0.05 -0.07 0.37 0.00 0.00 175.52 176.10 2aw0 h LEU 57 N 0.44 0.13 -0.63 2.58 3.38 -1.16 -0.66 115.31 119.39 2aw0 h LEU 57 Ca 0.12 -0.09 0.13 0.00 0.09 0.00 0.00 57.88 58.13 2aw0 h LEU 57 Cb 0.15 -0.03 -0.10 0.00 0.09 0.00 0.00 40.66 40.77 2aw0 h LEU 57 CO -0.01 0.19 0.06 -0.09 0.09 0.00 0.00 178.44 178.68 2aw0 h ARG 58 N 0.06 0.17 -0.34 1.13 2.43 -0.97 -1.25 114.38 115.61 2aw0 h ARG 58 Ca 0.04 -0.01 0.07 0.00 -0.81 0.00 0.00 59.98 59.27 2aw0 h ARG 58 Cb 0.09 -0.04 -0.07 0.00 -0.42 0.00 0.00 29.97 29.53 2aw0 h ARG 58 CO -0.01 0.11 -0.15 0.78 -1.51 0.00 0.00 179.97 179.20 2aw0 h GLY 59 N 0.17 0.13 1.00 2.80 0.00 -0.44 -0.83 103.07 105.90 2aw0 h GLY 59 Ca 0.33 0.19 0.00 0.00 0.00 0.00 0.00 47.33 47.86 2aw0 h GLY 59 CO -0.49 -0.17 0.39 0.00 0.00 0.00 0.00 176.54 176.27 2aw0 h ALA 60 N 1.19 0.78 -0.56 3.60 0.00 -0.11 0.39 119.26 124.55 2aw0 h ALA 60 Ca 0.17 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 55.02 2aw0 h ALA 60 Cb 0.35 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 17.87 2aw0 h ALA 60 CO -0.40 0.23 0.34 0.82 0.00 0.00 0.00 179.25 180.24 2aw0 h ILE 61 N 0.83 1.17 -0.65 0.00 1.08 -0.94 -0.74 117.51 118.26 2aw0 h ILE 61 Ca 0.22 -0.38 0.02 0.00 -0.39 0.00 0.00 64.86 64.34 2aw0 h ILE 61 Cb -0.07 0.41 -0.04 0.00 -3.07 0.00 0.00 36.82 34.05 2aw0 h ILE 61 CO -0.05 0.17 0.41 -0.08 -0.69 0.00 0.00 178.15 177.92 2aw0 h GLU 62 N 0.75 0.79 -0.83 2.37 4.22 -0.71 -1.05 114.58 120.12 2aw0 h GLU 62 Ca 0.20 -0.05 -0.00 0.00 0.08 0.00 0.00 59.36 59.59 2aw0 h GLU 62 Cb -0.01 -0.18 -0.04 0.00 0.50 0.00 0.00 28.75 29.02 2aw0 h GLU 62 CO -0.04 0.52 0.51 -0.44 -2.18 0.00 0.00 179.01 177.39 2aw0 h ASP 63 N 0.81 0.98 -0.54 1.04 3.32 -0.44 -2.16 116.42 119.43 2aw0 h ASP 63 Ca 0.26 -0.06 -0.01 0.00 0.02 0.00 0.00 57.03 57.24 2aw0 h ASP 63 Cb -0.01 -0.25 -0.03 0.00 0.22 0.00 0.00 39.33 39.27 2aw0 h ASP 63 CO -0.09 0.75 0.28 0.24 -1.72 0.00 0.00 179.24 178.70 2aw0 h MET 64 N 1.13 0.77 0.00 3.56 2.86 -0.77 -3.48 114.93 119.01 2aw0 h MET 64 Ca 0.30 -0.10 0.00 0.00 -2.06 0.00 0.00 59.70 57.84 2aw0 h MET 64 Cb -0.07 -0.15 0.00 0.00 0.06 0.00 0.00 31.60 31.45 2aw0 h MET 64 CO -0.06 0.61 0.00 0.41 1.06 0.00 0.00 176.91 178.93 2aw0 n GLY 65 N -0.98 0.28 3.09 8.32 0.00 -0.43 -5.11 105.19 110.35 2aw0 n GLY 65 Ca 0.03 -0.71 -0.07 0.00 0.00 0.00 0.00 46.02 45.27 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 0.48 -0.71 1.61 0.08 -1.11 -4.99 117.98 113.34 2aw0 s PHE 66 Ca 0.00 -1.01 -0.26 0.00 0.12 0.00 0.00 56.93 55.78 2aw0 s PHE 66 Cb 0.00 -0.36 -0.00 0.00 -0.57 0.00 0.00 43.02 42.09 2aw0 s PHE 66 CO 0.00 -0.38 1.67 0.34 -0.10 0.00 0.00 175.22 176.76 2aw0 s ASP 67 N -2.82 5.60 -0.22 1.36 2.15 -0.33 -4.08 116.67 118.32 2aw0 s ASP 67 Ca 0.05 -0.12 -0.10 0.00 0.43 0.00 0.00 52.55 52.81 2aw0 s ASP 67 Cb 0.07 -2.54 -0.05 0.00 -0.30 0.00 0.00 42.92 40.09 2aw0 s ASP 67 CO -0.09 -2.21 0.15 0.00 -0.17 0.00 0.00 175.17 172.85 2aw0 s ALA 68 N 7.95 3.65 0.02 3.66 0.00 -1.26 -1.89 121.76 133.89 2aw0 s ALA 68 Ca 0.57 -0.76 -0.15 0.00 0.00 0.00 0.00 51.96 51.62 2aw0 s ALA 68 Cb -0.10 -2.24 0.02 0.00 0.00 0.00 0.00 23.12 20.80 2aw0 s ALA 68 CO 0.15 0.01 0.32 0.99 0.00 0.00 0.00 175.76 177.23 2aw0 s THR 69 N 0.65 0.07 -0.07 0.00 2.01 -0.86 -4.97 115.64 112.46 2aw0 s THR 69 Ca 0.08 -0.57 -0.30 0.00 0.31 0.00 0.00 61.69 61.21 2aw0 s THR 69 Cb -0.12 -0.81 -0.03 0.00 0.01 0.00 0.00 72.50 71.55 2aw0 s THR 69 CO 0.01 -0.32 1.22 -0.76 -0.69 0.00 0.00 174.62 174.08 2aw0 s LEU 70 N -1.75 4.26 -0.15 4.42 2.01 -1.26 -0.22 118.68 126.01 2aw0 s LEU 70 Ca -0.09 1.80 -0.10 0.00 0.01 0.00 0.00 54.13 55.75 2aw0 s LEU 70 Cb -0.03 -3.55 -0.04 0.00 0.01 0.00 0.00 46.19 42.58 2aw0 s LEU 70 CO 0.00 -0.62 -0.19 -0.24 1.01 0.00 0.00 176.35 176.31 2aw0 n SER 71 N 5.44 1.82 0.00 2.29 2.88 -0.30 -4.78 113.62 120.97 2aw0 n SER 71 Ca 0.11 0.60 0.00 0.00 -1.33 0.00 0.00 58.87 58.26 2aw0 n SER 71 Cb 0.46 -0.86 0.00 0.00 -0.75 0.00 0.00 64.21 63.06 2aw0 n SER 71 CO 0.00 0.00 0.00 -0.67 -1.23 0.00 0.00 175.04 173.14