#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 -0.07 0.24 -5.08 -4.23 -1.26 -4.38 115.64 100.86 2aw0 s THR 2 Ca 0.00 0.26 -0.05 0.00 -1.18 0.00 0.00 61.69 60.72 2aw0 s THR 2 Cb 0.00 -0.10 -0.02 0.00 1.34 0.00 0.00 72.50 73.72 2aw0 s THR 2 CO 0.00 0.11 0.31 -1.10 -0.54 0.00 0.00 174.62 173.39 2aw0 s GLN 3 N 1.29 1.45 0.01 3.99 -1.52 -0.33 -4.95 119.66 119.61 2aw0 s GLN 3 Ca -0.06 -1.54 0.02 0.00 -1.95 0.00 0.00 55.36 51.82 2aw0 s GLN 3 Cb -0.13 0.37 -0.01 0.00 -0.22 0.00 0.00 33.01 33.02 2aw0 s GLN 3 CO -0.03 -0.55 -0.06 -2.00 -0.25 0.00 0.00 175.29 172.40 2aw0 s GLU 4 N -3.92 0.42 0.06 2.91 2.12 -1.26 -1.13 118.70 117.91 2aw0 s GLU 4 Ca 0.32 -0.36 0.02 0.00 0.36 0.00 0.00 54.97 55.32 2aw0 s GLU 4 Cb 0.03 -0.33 -0.03 0.00 0.26 0.00 0.00 34.13 34.06 2aw0 s GLU 4 CO 0.13 0.08 -0.08 -0.08 -0.54 0.00 0.00 175.26 174.77 2aw0 s THR 5 N -0.53 0.64 -0.05 -1.70 -1.32 -0.47 -5.01 115.64 107.20 2aw0 s THR 5 Ca -0.02 -1.40 0.06 0.00 -1.21 0.00 0.00 61.69 59.12 2aw0 s THR 5 Cb -0.05 -1.02 -0.01 0.00 -1.51 0.00 0.00 72.50 69.91 2aw0 s THR 5 CO -0.00 -0.55 -0.24 -0.69 -2.21 0.00 0.00 174.62 170.93 2aw0 s VAL 6 N -2.17 1.97 -0.08 5.08 1.01 0.10 -1.12 120.40 125.19 2aw0 s VAL 6 Ca -0.02 -1.02 0.01 0.00 0.00 0.00 0.00 61.98 60.95 2aw0 s VAL 6 Cb -0.05 -1.66 0.02 0.00 0.00 0.00 0.00 36.38 34.69 2aw0 s VAL 6 CO -0.01 0.55 -0.08 -0.63 0.00 0.00 0.00 175.10 174.93 2aw0 s ILE 7 N -0.19 0.93 0.17 2.22 1.01 -0.35 -0.93 121.20 124.06 2aw0 s ILE 7 Ca -0.02 -0.29 -0.31 0.00 0.00 0.00 0.00 60.65 60.03 2aw0 s ILE 7 Cb -0.13 -0.92 -0.09 0.00 0.01 0.00 0.00 42.46 41.33 2aw0 s ILE 7 CO 0.03 0.33 1.44 0.20 0.00 0.00 0.00 174.94 176.94 2aw0 s ASN 8 N 1.25 6.74 -0.33 3.58 0.01 0.92 -0.69 114.94 126.42 2aw0 s ASN 8 Ca -0.04 2.48 0.00 0.00 -0.71 0.00 0.00 52.86 54.59 2aw0 s ASN 8 Cb -0.14 -2.60 0.10 0.00 0.41 0.00 0.00 41.25 39.03 2aw0 s ASN 8 CO -0.03 -0.69 0.11 -0.63 -1.51 0.00 0.00 177.10 174.35 2aw0 s ILE 9 N 0.77 1.19 0.09 0.60 1.01 -0.38 -1.52 121.20 122.94 2aw0 s ILE 9 Ca 0.64 -1.71 -0.00 0.00 0.00 0.00 0.00 60.65 59.58 2aw0 s ILE 9 Cb -0.40 -1.89 -0.04 0.00 0.01 0.00 0.00 42.46 40.15 2aw0 s ILE 9 CO 0.34 -0.69 0.25 -0.62 0.00 0.00 0.00 174.94 174.22 2aw0 s ASP 10 N 1.34 6.38 0.00 3.58 2.15 -0.67 -4.04 116.67 125.40 2aw0 s ASP 10 Ca 0.11 0.31 0.00 0.00 0.43 0.00 0.00 52.55 53.40 2aw0 s ASP 10 Cb -0.18 -1.97 0.00 0.00 -0.30 0.00 0.00 42.92 40.46 2aw0 s ASP 10 CO -0.19 0.13 0.00 0.61 -0.17 0.00 0.00 175.17 175.55 2aw0 n GLY 11 N 0.11 0.72 3.59 2.66 0.00 -1.26 -0.91 105.19 110.11 2aw0 n GLY 11 Ca -0.05 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.55 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 -0.94 3.60 -0.02 1.61 -1.94 -1.26 -4.88 119.30 115.47 2aw0 s MET 12 Ca 0.00 0.51 -0.09 0.00 -1.71 0.00 0.00 55.69 54.40 2aw0 s MET 12 Cb 0.00 -3.98 -0.30 0.00 2.01 0.00 0.00 34.83 32.56 2aw0 s MET 12 CO 0.00 -1.55 0.77 1.15 -0.01 0.00 0.00 175.02 175.38 2aw0 h THR 13 N 6.26 1.05 -3.12 2.05 2.02 -1.98 -3.49 112.91 115.69 2aw0 h THR 13 Ca -0.25 -2.63 -0.09 0.00 0.77 0.00 0.00 66.41 64.22 2aw0 h THR 13 Cb 1.07 2.80 -0.01 0.00 -1.74 0.00 0.00 68.15 70.27 2aw0 h THR 13 CO 1.15 0.84 0.14 0.00 0.37 0.00 0.00 175.52 178.02 2aw0 h ASN 15 N 1.75 0.10 -0.82 0.00 -1.07 -2.00 -1.78 115.58 111.75 2aw0 h ASN 15 Ca -0.28 0.00 0.11 0.00 0.07 0.00 0.00 56.30 56.21 2aw0 h ASN 15 Cb 1.08 -0.02 -0.08 0.00 -2.07 0.00 0.00 38.32 37.23 2aw0 h ASN 15 CO 0.36 0.05 0.45 0.28 0.07 0.00 0.00 177.43 178.64 2aw0 h SER 16 N 0.10 0.60 0.29 6.14 0.02 -1.99 -0.94 113.55 117.78 2aw0 h SER 16 Ca 0.24 0.07 -0.01 0.00 -0.84 0.00 0.00 61.79 61.25 2aw0 h SER 16 Cb 0.83 -0.04 0.00 0.00 0.14 0.00 0.00 62.40 63.33 2aw0 h SER 16 CO -0.03 0.31 -0.14 0.00 -1.14 0.00 0.00 176.83 175.84 2aw0 h VAL 18 N -0.52 0.28 0.09 0.00 2.07 -1.49 -0.52 116.25 116.15 2aw0 h VAL 18 Ca -0.04 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.48 2aw0 h VAL 18 Cb 0.39 0.28 0.00 0.00 -1.52 0.00 0.00 31.29 30.43 2aw0 h VAL 18 CO 0.07 0.00 -0.04 1.56 0.02 0.00 0.00 177.57 179.17 2aw0 h GLN 19 N -0.30 -0.11 0.17 1.57 4.20 -1.17 -1.56 115.11 117.91 2aw0 h GLN 19 Ca 0.14 0.01 -0.01 0.00 0.06 0.00 0.00 58.65 58.85 2aw0 h GLN 19 Cb 0.53 0.03 0.00 0.00 0.30 0.00 0.00 27.48 28.33 2aw0 h GLN 19 CO -0.45 -0.03 -0.08 0.66 -0.67 0.00 0.00 178.83 178.26 2aw0 h SER 20 N -0.16 -0.19 0.13 1.46 4.64 -0.93 -0.22 113.55 118.28 2aw0 h SER 20 Ca -0.01 -0.05 0.02 0.00 -0.47 0.00 0.00 61.79 61.28 2aw0 h SER 20 Cb 0.13 0.05 -0.05 0.00 -0.31 0.00 0.00 62.40 62.23 2aw0 h SER 20 CO 0.02 -0.07 -0.43 0.40 -0.87 0.00 0.00 176.83 175.88 2aw0 h ILE 21 N -0.30 0.15 -0.60 0.95 2.04 -1.12 -1.40 117.51 117.23 2aw0 h ILE 21 Ca -0.02 0.00 0.08 0.00 1.00 0.00 0.00 64.86 65.92 2aw0 h ILE 21 Cb 0.23 0.15 -0.07 0.00 -0.74 0.00 0.00 36.82 36.39 2aw0 h ILE 21 CO 0.04 0.00 0.25 -0.08 0.00 0.00 0.00 178.15 178.36 2aw0 h GLU 22 N -0.66 0.44 0.00 2.37 4.81 -1.19 -0.38 114.58 119.98 2aw0 h GLU 22 Ca 0.02 -0.03 0.03 0.00 -0.13 0.00 0.00 59.36 59.25 2aw0 h GLU 22 Cb 0.69 -0.10 -0.04 0.00 0.63 0.00 0.00 28.75 29.93 2aw0 h GLU 22 CO -0.24 0.29 -0.25 0.78 -0.73 0.00 0.00 179.01 178.86 2aw0 h GLY 23 N 0.46 -0.38 0.71 1.92 0.00 -0.67 -0.62 103.07 104.49 2aw0 h GLY 23 Ca 0.29 0.30 -0.02 0.00 0.00 0.00 0.00 47.33 47.91 2aw0 h GLY 23 CO -0.27 -0.21 -0.16 -2.08 0.00 0.00 0.00 176.54 173.83 2aw0 h VAL 24 N -0.39 0.68 -0.94 4.60 2.07 -0.78 -3.27 116.25 118.21 2aw0 h VAL 24 Ca 0.06 -0.51 0.01 0.00 0.82 0.00 0.00 66.70 67.08 2aw0 h VAL 24 Cb 0.47 0.94 -0.05 0.00 -1.52 0.00 0.00 31.29 31.13 2aw0 h VAL 24 CO -0.22 0.10 0.62 0.40 0.02 0.00 0.00 177.57 178.50 2aw0 h ILE 25 N -0.73 1.23 -0.23 4.57 5.03 -1.08 -2.22 117.51 124.08 2aw0 h ILE 25 Ca -0.04 -0.44 0.07 0.00 -0.12 0.00 0.00 64.86 64.33 2aw0 h ILE 25 Cb 0.50 -0.15 -0.01 0.00 -3.03 0.00 0.00 36.82 34.13 2aw0 h ILE 25 CO 0.07 0.23 0.22 0.77 -0.68 0.00 0.00 178.15 178.76 2aw0 h SER 26 N 1.27 0.00 0.32 1.72 4.64 -1.15 -1.42 113.55 118.92 2aw0 h SER 26 Ca 0.35 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.67 2aw0 h SER 26 Cb -0.13 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 61.96 2aw0 h SER 26 CO -0.08 0.00 -0.28 0.29 -0.87 0.00 0.00 176.83 175.89 2aw0 n LYS 27 N -3.96 0.64 -2.35 4.77 5.02 -0.84 -4.76 118.16 116.67 2aw0 n LYS 27 Ca 0.03 -0.35 -0.42 0.00 -2.02 0.00 0.00 58.31 55.54 2aw0 n LYS 27 Cb 0.36 -1.49 -0.03 0.00 -0.02 0.00 0.00 35.03 33.85 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 -2.60 4.33 -0.11 1.97 -0.14 -0.54 -4.95 119.74 117.70 2aw0 s LYS 28 Ca 0.22 1.81 -0.39 0.00 -1.36 0.00 0.00 55.97 56.25 2aw0 s LYS 28 Cb 0.19 -3.55 -0.16 0.00 -1.68 0.00 0.00 37.83 32.63 2aw0 s LYS 28 CO 0.55 -0.49 1.55 -2.30 -0.76 0.00 0.00 175.35 173.90 2aw0 n PRO 29 N 5.17 1.12 0.00 -1.68 -0.02 -1.26 -2.12 135.00 136.22 2aw0 n PRO 29 Ca 0.12 0.41 0.00 0.00 -2.02 0.00 0.00 63.50 62.01 2aw0 n PRO 29 Cb 0.45 -2.07 0.00 0.00 -0.02 0.00 0.00 33.50 31.86 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 3.38 2.63 3.70 -1.23 0.00 -1.26 -4.03 105.19 108.38 2aw0 n GLY 30 Ca 0.23 -0.85 -0.42 0.00 0.00 0.00 0.00 46.02 44.98 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 -0.51 3.27 0.00 1.61 1.01 -0.90 -1.33 120.40 123.54 2aw0 s VAL 31 Ca 0.00 0.81 0.00 0.00 0.00 0.00 0.00 61.98 62.79 2aw0 s VAL 31 Cb 0.00 -3.52 0.00 0.00 0.00 0.00 0.00 36.38 32.86 2aw0 s VAL 31 CO 0.00 0.03 0.00 0.29 0.00 0.00 0.00 175.10 175.42 2aw0 n LYS 32 N 4.76 0.00 -3.10 2.72 5.02 -0.22 -4.93 118.16 122.41 2aw0 n LYS 32 Ca 0.13 0.00 -0.28 0.00 -2.02 0.00 0.00 58.31 56.14 2aw0 n LYS 32 Cb 0.42 0.00 -0.03 0.00 -0.02 0.00 0.00 35.03 35.40 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 -1.00 6.43 -0.09 4.39 1.04 -1.26 -4.95 113.70 118.27 2aw0 s SER 33 Ca 0.00 0.84 -0.15 0.00 0.48 0.00 0.00 55.95 57.13 2aw0 s SER 33 Cb 0.00 -2.20 0.03 0.00 0.10 0.00 0.00 66.02 63.95 2aw0 s SER 33 CO 0.00 -0.32 0.36 -0.51 0.98 0.00 0.00 173.24 173.76 2aw0 s ILE 34 N -2.28 0.02 -0.19 -1.02 2.07 -1.26 -1.23 121.20 117.32 2aw0 s ILE 34 Ca 0.46 -0.19 -0.05 0.00 -1.41 0.00 0.00 60.65 59.46 2aw0 s ILE 34 Cb -0.10 -0.59 0.07 0.00 0.13 0.00 0.00 42.46 41.97 2aw0 s ILE 34 CO 0.33 -0.11 0.10 -0.60 -1.91 0.00 0.00 174.94 172.75 2aw0 s ARG 35 N -0.48 0.08 -0.06 3.50 6.06 -0.28 -5.03 118.95 122.74 2aw0 s ARG 35 Ca -0.06 -0.12 -0.08 0.00 -2.50 0.00 0.00 55.73 52.97 2aw0 s ARG 35 Cb -0.04 -1.73 -0.04 0.00 0.06 0.00 0.00 34.95 33.20 2aw0 s ARG 35 CO 0.02 -0.71 0.22 0.08 -2.50 0.00 0.00 175.30 172.41 2aw0 s VAL 36 N 2.14 5.38 -0.05 7.11 1.01 -1.26 -1.42 120.40 133.30 2aw0 s VAL 36 Ca 0.03 0.26 -0.00 0.00 0.00 0.00 0.00 61.98 62.27 2aw0 s VAL 36 Cb -0.16 -3.50 0.03 0.00 0.00 0.00 0.00 36.38 32.74 2aw0 s VAL 36 CO -0.12 0.52 -0.02 -0.55 0.00 0.00 0.00 175.10 174.93 2aw0 s SER 37 N -1.30 1.12 0.03 3.32 0.15 -0.52 -5.01 113.70 111.49 2aw0 s SER 37 Ca 0.21 -0.09 -0.27 0.00 0.70 0.00 0.00 55.95 56.49 2aw0 s SER 37 Cb -0.13 -0.41 -0.17 0.00 -1.71 0.00 0.00 66.02 63.60 2aw0 s SER 37 CO 0.10 -0.12 1.33 0.25 1.20 0.00 0.00 173.24 176.00 2aw0 h LEU 38 N 7.65 -0.50 -0.60 3.45 7.12 -1.95 -0.59 115.31 129.90 2aw0 h LEU 38 Ca -0.31 -0.09 0.12 0.00 0.13 0.00 0.00 57.88 57.73 2aw0 h LEU 38 Cb 1.14 0.13 -0.09 0.00 -0.53 0.00 0.00 40.66 41.30 2aw0 h LEU 38 CO 0.39 -0.18 0.07 0.00 -0.13 0.00 0.00 178.44 178.58 2aw0 h ALA 39 N -0.39 0.66 -0.00 1.25 0.00 -1.97 -0.53 119.26 118.27 2aw0 h ALA 39 Ca -0.06 0.16 0.00 0.00 0.00 0.00 0.00 54.91 55.01 2aw0 h ALA 39 Cb 0.55 0.25 0.00 0.00 0.00 0.00 0.00 17.79 18.59 2aw0 h ALA 39 CO 0.10 -0.36 -0.44 0.09 0.00 0.00 0.00 179.25 178.65 2aw0 n ASN 40 N -5.20 0.53 -3.68 0.00 3.02 -1.25 -4.98 115.26 103.70 2aw0 n ASN 40 Ca 0.09 -0.28 -0.25 0.00 -0.03 0.00 0.00 54.58 54.10 2aw0 n ASN 40 Cb 0.34 0.19 0.03 0.00 -0.61 0.00 0.00 39.78 39.73 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 -1.40 -3.27 -3.48 6.41 7.64 -0.21 -4.91 113.62 114.39 2aw0 n SER 41 Ca 0.06 -0.91 -0.08 0.00 1.01 0.00 0.00 58.87 58.95 2aw0 n SER 41 Cb 0.34 -3.79 -0.01 0.00 -1.01 0.00 0.00 64.21 59.74 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 -3.91 -0.09 -0.08 6.43 4.22 -0.98 -1.25 114.94 119.29 2aw0 s ASN 42 Ca 0.24 -0.89 -0.02 0.00 -2.14 0.00 0.00 52.86 50.06 2aw0 s ASN 42 Cb -0.07 0.76 0.03 0.00 1.28 0.00 0.00 41.25 43.25 2aw0 s ASN 42 CO 0.83 -1.46 0.01 -0.83 -2.04 0.00 0.00 177.10 173.61 2aw0 s GLY 43 N -3.00 0.46 -0.33 0.45 0.00 0.13 -1.44 107.32 103.59 2aw0 s GLY 43 Ca 0.15 -0.13 -0.13 0.00 0.00 0.00 0.00 44.72 44.61 2aw0 s GLY 43 CO 0.10 1.19 0.26 -1.59 0.00 0.00 0.00 173.10 173.05 2aw0 s THR 44 N 1.99 5.27 -0.11 0.90 2.01 -0.51 -1.21 115.64 123.97 2aw0 s THR 44 Ca 0.05 -0.10 0.01 0.00 0.31 0.00 0.00 61.69 61.95 2aw0 s THR 44 Cb -0.13 -3.71 0.02 0.00 0.01 0.00 0.00 72.50 68.70 2aw0 s THR 44 CO -0.05 0.02 -0.11 -0.69 -0.69 0.00 0.00 174.62 173.09 2aw0 s VAL 45 N 1.78 1.25 -0.03 3.82 1.01 -0.28 -1.12 120.40 126.83 2aw0 s VAL 45 Ca 0.07 -0.46 -0.19 0.00 0.00 0.00 0.00 61.98 61.40 2aw0 s VAL 45 Cb -0.17 -1.20 -0.05 0.00 0.00 0.00 0.00 36.38 34.96 2aw0 s VAL 45 CO 0.11 0.40 0.55 -1.61 0.00 0.00 0.00 175.10 174.54 2aw0 s GLU 46 N 1.37 4.28 0.21 2.72 2.02 -0.37 -1.36 118.70 127.57 2aw0 s GLU 46 Ca -0.00 0.63 -0.11 0.00 0.02 0.00 0.00 54.97 55.51 2aw0 s GLU 46 Cb -0.14 -3.35 -0.00 0.00 0.10 0.00 0.00 34.13 30.74 2aw0 s GLU 46 CO -0.06 0.35 0.40 1.52 0.02 0.00 0.00 175.26 177.49 2aw0 s TYR 47 N -0.09 0.38 -0.36 1.61 1.13 -0.28 -1.05 117.35 118.69 2aw0 s TYR 47 Ca 0.29 -0.73 -0.11 0.00 -1.41 0.00 0.00 57.07 55.10 2aw0 s TYR 47 Cb -0.17 0.08 0.02 0.00 -1.10 0.00 0.00 41.96 40.78 2aw0 s TYR 47 CO 0.15 -0.88 0.21 0.34 -2.51 0.00 0.00 175.55 172.86 2aw0 s ASP 48 N -3.00 5.77 0.39 -0.18 2.15 -0.44 -1.19 116.67 120.18 2aw0 s ASP 48 Ca 0.21 -0.83 0.23 0.00 0.43 0.00 0.00 52.55 52.59 2aw0 s ASP 48 Cb 0.01 -2.05 1.29 0.00 -0.30 0.00 0.00 42.92 41.87 2aw0 s ASP 48 CO 0.05 -0.34 1.63 -0.65 -0.17 0.00 0.00 175.17 175.70 2aw0 h PRO 49 N 8.45 0.15 -0.46 4.34 0.11 -1.76 -0.88 132.00 141.94 2aw0 h PRO 49 Ca -0.28 -0.01 -0.05 0.00 0.11 0.00 0.00 66.00 65.77 2aw0 h PRO 49 Cb 1.12 -0.03 -0.02 0.00 0.11 0.00 0.00 31.00 32.18 2aw0 h PRO 49 CO 0.66 0.10 0.08 -0.07 -0.21 0.00 0.00 178.00 178.56 2aw0 h LEU 50 N 0.15 0.66 0.00 2.35 3.38 -1.95 -3.31 115.31 116.59 2aw0 h LEU 50 Ca 0.79 -0.12 -0.33 0.00 0.09 0.00 0.00 57.88 58.32 2aw0 h LEU 50 Cb 2.18 -0.17 -0.06 0.00 0.09 0.00 0.00 40.66 42.69 2aw0 h LEU 50 CO -0.56 0.68 -2.23 0.18 0.09 0.00 0.00 178.44 176.60 2aw0 n LEU 51 N -4.28 0.00 -4.02 1.67 4.77 -0.55 -5.04 117.00 109.55 2aw0 n LEU 51 Ca 0.03 0.00 -0.11 0.00 -0.03 0.00 0.00 56.01 55.90 2aw0 n LEU 51 Cb 0.23 0.44 -0.05 0.00 -2.33 0.00 0.00 43.42 41.72 2aw0 n LEU 51 CO 0.39 0.44 0.17 0.28 -1.33 0.00 0.00 177.39 177.35 2aw0 s THR 52 N -2.44 0.00 0.10 -5.08 -1.32 -0.45 -4.75 115.64 101.70 2aw0 s THR 52 Ca -0.09 -1.47 -0.03 0.00 -1.21 0.00 0.00 61.69 58.90 2aw0 s THR 52 Cb 0.05 -2.40 -0.03 0.00 -1.51 0.00 0.00 72.50 68.61 2aw0 s THR 52 CO 0.74 0.00 0.06 -0.94 -2.21 0.00 0.00 174.62 172.26 2aw0 s SER 53 N -3.09 0.34 0.28 8.08 1.04 -1.26 -3.63 113.70 115.46 2aw0 s SER 53 Ca 0.25 -1.04 0.02 0.00 0.48 0.00 0.00 55.95 55.66 2aw0 s SER 53 Cb -0.00 0.27 0.60 0.00 0.10 0.00 0.00 66.02 66.99 2aw0 s SER 53 CO 0.13 -0.69 1.79 -0.65 0.98 0.00 0.00 173.24 174.79 2aw0 h PRO 54 N 2.94 0.75 -0.58 4.02 0.11 -1.99 -1.18 132.00 136.07 2aw0 h PRO 54 Ca -0.34 -0.05 -0.06 0.00 0.11 0.00 0.00 66.00 65.67 2aw0 h PRO 54 Cb 1.18 -0.17 -0.02 0.00 0.11 0.00 0.00 31.00 32.09 2aw0 h PRO 54 CO 0.61 0.50 0.14 0.93 -0.21 0.00 0.00 178.00 179.96 2aw0 h GLU 55 N 0.78 0.93 -0.13 1.05 5.08 -1.98 -0.11 114.58 120.19 2aw0 h GLU 55 Ca 0.51 -0.23 -0.01 0.00 -1.00 0.00 0.00 59.36 58.64 2aw0 h GLU 55 Cb 0.68 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 29.81 2aw0 h GLU 55 CO -0.34 0.86 0.05 1.15 -1.00 0.00 0.00 179.01 179.74 2aw0 h THR 56 N 0.83 1.14 -0.10 1.13 2.02 -1.76 -0.06 112.91 116.11 2aw0 h THR 56 Ca 0.18 -0.43 -0.00 0.00 0.77 0.00 0.00 66.41 66.93 2aw0 h THR 56 Cb 0.35 1.19 -0.01 0.00 -1.74 0.00 0.00 68.15 67.95 2aw0 h THR 56 CO 0.00 0.13 0.06 -0.07 0.37 0.00 0.00 175.52 176.02 2aw0 h LEU 57 N 0.06 0.13 -0.48 2.58 3.38 -1.14 -0.59 115.31 119.25 2aw0 h LEU 57 Ca 0.04 -0.06 0.09 0.00 0.09 0.00 0.00 57.88 58.05 2aw0 h LEU 57 Cb 0.16 -0.03 -0.08 0.00 0.09 0.00 0.00 40.66 40.80 2aw0 h LEU 57 CO -0.00 0.15 0.01 -0.09 0.09 0.00 0.00 178.44 178.60 2aw0 h ARG 58 N 0.10 0.12 -0.50 1.13 2.43 -1.00 -2.03 114.38 114.63 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 0.05 -0.03 -0.06 0.00 -0.42 0.00 0.00 29.97 29.51 2aw0 h ARG 58 CO -0.01 0.08 0.17 0.78 -1.51 0.00 0.00 179.97 179.48 2aw0 h GLY 59 N 0.13 0.66 0.99 2.80 0.00 -0.34 0.74 103.07 108.04 2aw0 h GLY 59 Ca 0.24 -0.09 0.00 0.00 0.00 0.00 0.00 47.33 47.49 2aw0 h GLY 59 CO -0.39 -0.00 0.01 0.00 0.00 0.00 0.00 176.54 176.15 2aw0 h ALA 60 N 1.34 0.02 -0.70 3.60 0.00 -0.68 -0.28 119.26 122.57 2aw0 h ALA 60 Ca 0.24 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.13 2aw0 h ALA 60 Cb 0.27 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.02 2aw0 h ALA 60 CO -0.26 -0.47 0.40 0.82 0.00 0.00 0.00 179.25 179.74 2aw0 h ILE 61 N 0.01 1.21 -0.50 0.00 2.04 -1.07 -2.20 117.51 116.99 2aw0 h ILE 61 Ca 0.01 -0.49 -0.00 0.00 1.00 0.00 0.00 64.86 65.38 2aw0 h ILE 61 Cb 0.01 0.27 -0.02 0.00 -0.74 0.00 0.00 36.82 36.33 2aw0 h ILE 61 CO -0.00 0.22 0.30 -0.08 0.00 0.00 0.00 178.15 178.59 2aw0 h GLU 62 N 0.95 0.68 -0.92 2.37 4.81 -0.63 -2.49 114.58 119.35 2aw0 h GLU 62 Ca 0.25 -0.06 0.03 0.00 -0.13 0.00 0.00 59.36 59.45 2aw0 h GLU 62 Cb 0.00 -0.14 -0.05 0.00 0.63 0.00 0.00 28.75 29.19 2aw0 h GLU 62 CO -0.04 0.49 0.60 0.22 -0.73 0.00 0.00 179.01 179.55 2aw0 h ASP 63 N 0.67 1.01 0.27 1.04 3.58 -0.75 -0.57 116.42 121.67 2aw0 h ASP 63 Ca 0.18 -0.01 0.00 0.00 0.42 0.00 0.00 57.03 57.61 2aw0 h ASP 63 Cb -0.01 -0.24 0.00 0.00 1.72 0.00 0.00 39.33 40.80 2aw0 h ASP 63 CO -0.03 0.70 0.00 0.23 -2.88 0.00 0.00 179.24 177.26 2aw0 n MET 64 N -4.43 0.09 -0.45 0.28 2.81 -0.85 -4.87 117.12 109.70 2aw0 n MET 64 Ca 0.12 0.24 0.00 0.00 -1.81 0.00 0.00 57.70 56.24 2aw0 n MET 64 Cb 0.08 -1.50 0.00 0.00 -0.71 0.00 0.00 33.22 31.09 2aw0 n MET 64 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2aw0 n GLY 65 N -0.37 0.79 3.06 3.03 0.00 -0.22 -5.10 105.19 106.38 2aw0 n GLY 65 Ca 0.04 -0.52 -0.08 0.00 0.00 0.00 0.00 46.02 45.46 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 -2.07 0.41 -1.08 1.61 0.08 -1.23 -5.00 117.98 110.70 2aw0 s PHE 66 Ca 0.00 -0.85 -0.21 0.00 0.12 0.00 0.00 56.93 55.99 2aw0 s PHE 66 Cb 0.00 -0.30 0.07 0.00 -0.57 0.00 0.00 43.02 42.21 2aw0 s PHE 66 CO 0.00 -0.32 1.48 -0.51 -0.10 0.00 0.00 175.22 175.77 2aw0 s ASP 67 N -2.38 6.60 -0.26 1.36 1.01 -0.08 -4.31 116.67 118.61 2aw0 s ASP 67 Ca -0.01 -1.77 -0.11 0.00 0.71 0.00 0.00 52.55 51.36 2aw0 s ASP 67 Cb 0.01 -2.55 -0.05 0.00 1.01 0.00 0.00 42.92 41.35 2aw0 s ASP 67 CO -0.07 -1.37 0.20 0.00 0.21 0.00 0.00 175.17 174.14 2aw0 s ALA 68 N 4.48 3.57 -0.07 5.23 0.00 -1.26 -1.67 121.76 132.04 2aw0 s ALA 68 Ca 0.46 -0.96 -0.05 0.00 0.00 0.00 0.00 51.96 51.42 2aw0 s ALA 68 Cb 0.00 -2.43 0.02 0.00 0.00 0.00 0.00 23.12 20.71 2aw0 s ALA 68 CO -0.06 -0.39 0.17 0.99 0.00 0.00 0.00 175.76 176.47 2aw0 s THR 69 N 1.45 -0.02 0.29 0.00 2.01 -0.58 -4.93 115.64 113.87 2aw0 s THR 69 Ca 0.08 0.06 -0.29 0.00 0.31 0.00 0.00 61.69 61.85 2aw0 s THR 69 Cb -0.15 -0.25 -0.11 0.00 0.01 0.00 0.00 72.50 72.01 2aw0 s THR 69 CO 0.08 0.02 1.46 -0.76 -0.69 0.00 0.00 174.62 174.73 2aw0 s LEU 70 N 0.47 4.37 -0.19 4.42 1.43 -1.26 -0.06 118.68 127.87 2aw0 s LEU 70 Ca -0.03 2.80 -0.18 0.00 -1.03 0.00 0.00 54.13 55.69 2aw0 s LEU 70 Cb -0.05 -3.64 -0.15 0.00 0.03 0.00 0.00 46.19 42.39 2aw0 s LEU 70 CO -0.02 -0.75 0.13 0.28 0.23 0.00 0.00 176.35 176.21 2aw0 h SER 71 N 4.38 0.00 0.00 2.29 0.02 -1.35 -3.43 113.55 115.45 2aw0 h SER 71 Ca -0.48 -0.39 0.00 0.00 -0.84 0.00 0.00 61.79 60.09 2aw0 h SER 71 Cb 1.22 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.76 2aw0 h SER 71 CO 0.74 1.28 0.00 -0.90 -1.14 0.00 0.00 176.83 176.81