#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 4.94 0.36 -5.08 -4.23 -1.26 -4.49 115.64 105.88 2aw0 s THR 2 Ca 0.00 -0.96 0.04 0.00 -1.18 0.00 0.00 61.69 59.59 2aw0 s THR 2 Cb 0.00 -3.74 -0.05 0.00 1.34 0.00 0.00 72.50 70.05 2aw0 s THR 2 CO 0.00 -0.30 0.08 -1.10 -0.54 0.00 0.00 174.62 172.76 2aw0 s GLN 3 N -4.05 1.77 0.00 3.99 -1.52 -0.27 -5.00 119.66 114.58 2aw0 s GLN 3 Ca 0.37 -2.03 0.01 0.00 -1.95 0.00 0.00 55.36 51.77 2aw0 s GLN 3 Cb -0.09 -0.80 -0.00 0.00 -0.22 0.00 0.00 33.01 31.89 2aw0 s GLN 3 CO 0.30 -0.30 -0.03 -2.00 -0.25 0.00 0.00 175.29 173.01 2aw0 s GLU 4 N -3.83 0.25 -0.03 2.91 2.12 -1.26 -1.03 118.70 117.82 2aw0 s GLU 4 Ca 0.31 -0.16 0.03 0.00 0.36 0.00 0.00 54.97 55.50 2aw0 s GLU 4 Cb 0.06 -0.21 0.00 0.00 0.26 0.00 0.00 34.13 34.25 2aw0 s GLU 4 CO 0.14 0.05 -0.11 -0.08 -0.54 0.00 0.00 175.26 174.73 2aw0 s THR 5 N -0.21 0.94 -0.44 -1.70 -1.32 -0.58 -5.00 115.64 107.33 2aw0 s THR 5 Ca -0.00 -0.45 -0.14 0.00 -1.21 0.00 0.00 61.69 59.88 2aw0 s THR 5 Cb -0.02 -0.83 0.05 0.00 -1.51 0.00 0.00 72.50 70.20 2aw0 s THR 5 CO -0.00 0.29 0.34 -0.69 -2.21 0.00 0.00 174.62 172.34 2aw0 s VAL 6 N 0.15 5.09 -0.27 5.08 1.01 -1.26 -1.39 120.40 128.81 2aw0 s VAL 6 Ca -0.03 -0.95 -0.11 0.00 0.00 0.00 0.00 61.98 60.89 2aw0 s VAL 6 Cb -0.09 -3.96 -0.05 0.00 0.00 0.00 0.00 36.38 32.28 2aw0 s VAL 6 CO 0.01 -0.46 0.19 -0.63 0.00 0.00 0.00 175.10 174.21 2aw0 s ILE 7 N 1.62 5.32 -0.05 2.22 1.01 -0.34 -1.31 121.20 129.68 2aw0 s ILE 7 Ca 0.04 0.19 -0.30 0.00 0.00 0.00 0.00 60.65 60.58 2aw0 s ILE 7 Cb -0.22 -3.53 -0.03 0.00 0.01 0.00 0.00 42.46 38.69 2aw0 s ILE 7 CO 0.07 0.28 1.18 0.20 0.00 0.00 0.00 174.94 176.67 2aw0 s ASN 8 N 1.54 7.07 -0.35 3.58 0.01 0.83 -0.67 114.94 126.96 2aw0 s ASN 8 Ca 0.07 1.80 0.03 0.00 -0.71 0.00 0.00 52.86 54.06 2aw0 s ASN 8 Cb -0.15 -2.56 0.10 0.00 0.41 0.00 0.00 41.25 39.05 2aw0 s ASN 8 CO 0.09 -0.56 0.09 -0.63 -1.51 0.00 0.00 177.10 174.58 2aw0 s ILE 9 N 2.09 1.92 0.11 0.60 1.01 -0.28 -1.58 121.20 125.08 2aw0 s ILE 9 Ca 0.55 -2.20 0.01 0.00 0.00 0.00 0.00 60.65 59.01 2aw0 s ILE 9 Cb -0.24 -2.42 -0.04 0.00 0.01 0.00 0.00 42.46 39.77 2aw0 s ILE 9 CO 0.22 -0.65 0.26 -1.81 0.00 0.00 0.00 174.94 172.96 2aw0 s ASP 10 N 0.96 6.36 0.00 3.58 1.01 -0.56 -4.04 116.67 123.97 2aw0 s ASP 10 Ca 0.11 0.24 0.00 0.00 0.71 0.00 0.00 52.55 53.61 2aw0 s ASP 10 Cb -0.19 -1.94 0.00 0.00 1.01 0.00 0.00 42.92 41.79 2aw0 s ASP 10 CO -0.11 0.10 0.00 0.61 0.21 0.00 0.00 175.17 175.98 2aw0 n GLY 11 N -0.16 0.78 3.60 0.21 0.00 -1.26 -1.35 105.19 107.00 2aw0 n GLY 11 Ca -0.06 -0.28 -0.43 0.00 0.00 0.00 0.00 46.02 45.25 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 -0.71 3.72 -0.02 1.61 -1.94 -1.26 -4.91 119.30 115.78 2aw0 s MET 12 Ca 0.00 0.58 -0.07 0.00 -1.71 0.00 0.00 55.69 54.48 2aw0 s MET 12 Cb 0.00 -3.91 -0.30 0.00 2.01 0.00 0.00 34.83 32.63 2aw0 s MET 12 CO 0.00 -1.39 0.78 0.00 -0.01 0.00 0.00 175.02 174.40 2aw0 h THR 13 N 6.24 1.06 -3.15 2.05 1.03 -1.97 -3.50 112.91 114.68 2aw0 h THR 13 Ca -0.23 -2.66 -0.06 0.00 -0.01 0.00 0.00 66.41 63.45 2aw0 h THR 13 Cb 1.06 2.78 -0.00 0.00 -1.07 0.00 0.00 68.15 70.92 2aw0 h THR 13 CO 1.13 0.83 0.22 0.00 -0.01 0.00 0.00 175.52 177.69 2aw0 n ASN 15 N -1.52 0.47 -0.17 0.00 4.13 -1.26 -1.87 115.26 115.04 2aw0 n ASN 15 Ca -0.08 0.62 0.02 0.00 1.68 0.00 0.00 54.58 56.82 2aw0 n ASN 15 Cb 0.60 -0.72 0.29 0.00 -1.54 0.00 0.00 39.78 38.41 2aw0 n ASN 15 CO 0.00 0.00 0.00 0.77 0.28 0.00 0.00 177.26 178.31 2aw0 h SER 16 N 0.00 0.77 0.15 6.41 4.64 -1.99 -1.45 113.55 122.08 2aw0 h SER 16 Ca 0.00 -0.02 -0.00 0.00 -0.47 0.00 0.00 61.79 61.30 2aw0 h SER 16 Cb 0.30 -0.19 -0.00 0.00 -0.31 0.00 0.00 62.40 62.20 2aw0 h SER 16 CO 0.00 0.56 -0.09 0.00 -0.87 0.00 0.00 176.83 176.43 2aw0 h VAL 18 N -0.23 0.28 0.10 0.00 2.07 -1.55 -0.45 116.25 116.47 2aw0 h VAL 18 Ca -0.01 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.52 2aw0 h VAL 18 Cb 0.19 0.28 -0.02 0.00 -1.52 0.00 0.00 31.29 30.22 2aw0 h VAL 18 CO 0.02 0.00 -0.15 -0.61 0.02 0.00 0.00 177.57 176.85 2aw0 h GLN 19 N -0.45 -0.29 -0.10 1.57 5.75 -1.21 -1.51 115.11 118.88 2aw0 h GLN 19 Ca 0.07 0.02 -0.00 0.00 -0.15 0.00 0.00 58.65 58.59 2aw0 h GLN 19 Cb 0.56 0.07 -0.00 0.00 1.07 0.00 0.00 27.48 29.17 2aw0 h GLN 19 CO -0.31 -0.19 0.06 0.66 -2.65 0.00 0.00 178.83 176.40 2aw0 h SER 20 N -0.30 0.12 0.44 -0.69 4.64 -0.97 -0.94 113.55 115.85 2aw0 h SER 20 Ca 0.02 -0.06 -0.02 0.00 -0.47 0.00 0.00 61.79 61.26 2aw0 h SER 20 Cb 0.31 -0.03 -0.00 0.00 -0.31 0.00 0.00 62.40 62.37 2aw0 h SER 20 CO -0.07 0.14 -0.25 0.40 -0.87 0.00 0.00 176.83 176.19 2aw0 h ILE 21 N 0.09 0.49 -0.67 0.95 2.04 -1.00 -0.72 117.51 118.68 2aw0 h ILE 21 Ca 0.04 0.00 -0.03 0.00 1.00 0.00 0.00 64.86 65.87 2aw0 h ILE 21 Cb 0.05 0.49 -0.03 0.00 -0.74 0.00 0.00 36.82 36.58 2aw0 h ILE 21 CO -0.01 0.00 0.31 1.05 0.00 0.00 0.00 178.15 179.50 2aw0 h GLU 22 N -0.65 0.96 0.22 2.37 -0.00 -1.27 -0.78 114.58 115.44 2aw0 h GLU 22 Ca -0.05 -0.14 0.00 0.00 -0.00 0.00 0.00 59.36 59.17 2aw0 h GLU 22 Cb 0.52 -0.18 -0.02 0.00 -0.00 0.00 0.00 28.75 29.08 2aw0 h GLU 22 CO 0.07 0.75 -0.22 0.78 -0.00 0.00 0.00 179.01 180.39 2aw0 h GLY 23 N 1.03 -0.48 0.95 1.06 0.00 -0.90 -0.61 103.07 104.11 2aw0 h GLY 23 Ca 0.23 0.25 -0.02 0.00 0.00 0.00 0.00 47.33 47.79 2aw0 h GLY 23 CO -0.03 -0.21 -0.19 -2.08 0.00 0.00 0.00 176.54 174.03 2aw0 h VAL 24 N -0.48 0.62 -0.80 4.60 2.07 -0.91 -3.26 116.25 118.10 2aw0 h VAL 24 Ca -0.00 -0.11 -0.05 0.00 0.82 0.00 0.00 66.70 67.36 2aw0 h VAL 24 Cb 0.44 0.67 -0.04 0.00 -1.52 0.00 0.00 31.29 30.85 2aw0 h VAL 24 CO -0.05 0.02 0.32 0.40 0.02 0.00 0.00 177.57 178.28 2aw0 h ILE 25 N -0.59 1.26 -0.19 4.57 2.04 -1.11 -2.45 117.51 121.04 2aw0 h ILE 25 Ca -0.05 -0.82 0.06 0.00 1.00 0.00 0.00 64.86 65.04 2aw0 h ILE 25 Cb 0.44 0.31 -0.01 0.00 -0.74 0.00 0.00 36.82 36.82 2aw0 h ILE 25 CO 0.09 0.34 0.24 0.77 0.00 0.00 0.00 178.15 179.59 2aw0 h SER 26 N 1.16 0.00 0.49 1.72 4.64 -1.14 -0.85 113.55 119.56 2aw0 h SER 26 Ca 0.27 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.59 2aw0 h SER 26 Cb 0.22 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.31 2aw0 h SER 26 CO -0.02 0.00 -0.44 0.29 -0.87 0.00 0.00 176.83 175.79 2aw0 n LYS 27 N -3.65 0.12 -2.28 4.77 5.02 -0.92 -4.84 118.16 116.37 2aw0 n LYS 27 Ca 0.02 -0.07 -0.40 0.00 -2.02 0.00 0.00 58.31 55.85 2aw0 n LYS 27 Cb 0.36 -1.50 -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 -2.93 4.32 0.19 1.97 -0.14 -0.33 -4.96 119.74 117.87 2aw0 s LYS 28 Ca 0.13 1.96 -0.31 0.00 -1.36 0.00 0.00 55.97 56.39 2aw0 s LYS 28 Cb 0.18 -2.96 -0.09 0.00 -1.68 0.00 0.00 37.83 33.28 2aw0 s LYS 28 CO 0.67 -0.12 1.45 -1.25 -0.76 0.00 0.00 175.35 175.33 2aw0 s PRO 29 N -1.88 4.28 0.00 -1.68 0.04 -1.26 -2.48 135.00 132.02 2aw0 s PRO 29 Ca 0.51 2.24 0.00 0.00 0.04 0.00 0.00 61.00 63.78 2aw0 s PRO 29 Cb -0.34 -3.16 0.00 0.00 0.04 0.00 0.00 34.50 31.04 2aw0 s PRO 29 CO 0.44 -0.45 0.00 0.41 0.04 0.00 0.00 177.00 177.44 2aw0 n GLY 30 N 2.91 3.14 3.76 0.56 0.00 -1.26 -3.84 105.19 110.46 2aw0 n GLY 30 Ca 0.10 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.71 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 -2.89 2.90 0.00 1.61 1.01 -1.03 -1.33 120.40 120.66 2aw0 s VAL 31 Ca 0.00 0.86 0.00 0.00 0.00 0.00 0.00 61.98 62.84 2aw0 s VAL 31 Cb 0.00 -3.55 0.00 0.00 0.00 0.00 0.00 36.38 32.83 2aw0 s VAL 31 CO 0.00 0.19 0.00 0.29 0.00 0.00 0.00 175.10 175.58 2aw0 n LYS 32 N 1.28 0.00 -2.76 2.72 5.02 -0.40 -4.95 118.16 119.07 2aw0 n LYS 32 Ca 0.01 0.00 -0.33 0.00 -2.02 0.00 0.00 58.31 55.98 2aw0 n LYS 32 Cb 0.42 0.00 -0.06 0.00 -0.02 0.00 0.00 35.03 35.37 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 0.99 6.88 -0.14 4.39 1.04 -1.26 -4.91 113.70 120.70 2aw0 s SER 33 Ca 0.00 1.66 -0.12 0.00 0.48 0.00 0.00 55.95 57.96 2aw0 s SER 33 Cb 0.00 -2.53 0.04 0.00 0.10 0.00 0.00 66.02 63.63 2aw0 s SER 33 CO 0.00 -0.39 0.36 -0.51 0.98 0.00 0.00 173.24 173.68 2aw0 s ILE 34 N -2.25 -0.00 -0.31 -1.02 2.07 -1.26 -1.11 121.20 117.32 2aw0 s ILE 34 Ca 0.61 0.01 -0.03 0.00 -1.41 0.00 0.00 60.65 59.83 2aw0 s ILE 34 Cb -0.09 -0.51 0.11 0.00 0.13 0.00 0.00 42.46 42.10 2aw0 s ILE 34 CO 0.16 0.00 0.15 -0.13 -1.91 0.00 0.00 174.94 173.21 2aw0 s ARG 35 N 0.25 0.35 -0.06 3.50 0.52 -0.22 -5.02 118.95 118.27 2aw0 s ARG 35 Ca -0.00 -0.80 -0.06 0.00 -0.52 0.00 0.00 55.73 54.34 2aw0 s ARG 35 Cb -0.03 -1.30 -0.04 0.00 0.52 0.00 0.00 34.95 34.10 2aw0 s ARG 35 CO -0.00 -1.07 0.19 0.08 0.02 0.00 0.00 175.30 174.52 2aw0 s VAL 36 N 1.77 5.43 -0.02 3.52 1.01 -1.26 -1.25 120.40 129.60 2aw0 s VAL 36 Ca 0.11 0.15 0.00 0.00 0.00 0.00 0.00 61.98 62.25 2aw0 s VAL 36 Cb -0.18 -3.48 0.02 0.00 0.00 0.00 0.00 36.38 32.74 2aw0 s VAL 36 CO -0.26 0.50 0.02 -0.55 0.00 0.00 0.00 175.10 174.81 2aw0 s SER 37 N -1.37 0.08 -0.03 3.32 0.15 -0.50 -5.00 113.70 110.35 2aw0 s SER 37 Ca 0.21 0.03 -0.25 0.00 0.70 0.00 0.00 55.95 56.63 2aw0 s SER 37 Cb -0.13 -0.07 -0.19 0.00 -1.71 0.00 0.00 66.02 63.93 2aw0 s SER 37 CO 0.10 -0.10 1.16 0.25 1.20 0.00 0.00 173.24 175.85 2aw0 h LEU 38 N 7.07 -0.09 -0.45 3.45 5.85 -1.93 -1.33 115.31 127.87 2aw0 h LEU 38 Ca -0.41 -0.44 0.06 0.00 0.84 0.00 0.00 57.88 57.93 2aw0 h LEU 38 Cb 1.14 0.02 -0.05 0.00 0.37 0.00 0.00 40.66 42.14 2aw0 h LEU 38 CO 0.49 0.42 0.14 0.00 -0.34 0.00 0.00 178.44 179.14 2aw0 h ALA 39 N 0.22 0.53 -0.00 1.25 0.00 -1.97 -1.39 119.26 117.90 2aw0 h ALA 39 Ca -0.01 0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.97 2aw0 h ALA 39 Cb 0.52 0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.37 2aw0 h ALA 39 CO 0.02 -0.25 -0.36 0.09 0.00 0.00 0.00 179.25 178.74 2aw0 n ASN 40 N -5.04 0.67 -3.57 0.00 3.02 -1.26 -4.99 115.26 104.11 2aw0 n ASN 40 Ca 0.04 -0.48 -0.23 0.00 -0.03 0.00 0.00 54.58 53.88 2aw0 n ASN 40 Cb 0.19 0.15 0.05 0.00 -0.61 0.00 0.00 39.78 39.56 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 -1.15 -4.27 -3.57 6.41 7.64 -0.53 -4.90 113.62 113.26 2aw0 n SER 41 Ca 0.09 -0.86 -0.07 0.00 1.01 0.00 0.00 58.87 59.03 2aw0 n SER 41 Cb 0.34 -4.13 -0.01 0.00 -1.01 0.00 0.00 64.21 59.40 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 -3.75 -0.16 -0.15 6.43 2.20 -0.79 -1.12 114.94 117.59 2aw0 s ASN 42 Ca 0.31 -0.73 -0.03 0.00 -0.94 0.00 0.00 52.86 51.47 2aw0 s ASN 42 Cb -0.08 0.72 0.05 0.00 -2.00 0.00 0.00 41.25 39.94 2aw0 s ASN 42 CO 0.81 -1.36 0.05 -0.83 -2.94 0.00 0.00 177.10 172.83 2aw0 s GLY 43 N -2.99 0.50 -0.50 0.45 0.00 0.16 -1.41 107.32 103.54 2aw0 s GLY 43 Ca 0.13 -0.37 -0.16 0.00 0.00 0.00 0.00 44.72 44.32 2aw0 s GLY 43 CO 0.07 1.47 0.45 -1.59 0.00 0.00 0.00 173.10 173.50 2aw0 s THR 44 N 2.00 5.19 -0.17 0.90 2.01 -0.38 -1.20 115.64 124.00 2aw0 s THR 44 Ca 0.02 -1.13 -0.00 0.00 0.31 0.00 0.00 61.69 60.88 2aw0 s THR 44 Cb -0.15 -4.20 0.00 0.00 0.01 0.00 0.00 72.50 68.15 2aw0 s THR 44 CO -0.07 -0.69 -0.14 -0.69 -0.69 0.00 0.00 174.62 172.34 2aw0 s VAL 45 N 1.73 2.67 -0.06 3.82 1.01 -0.48 -1.05 120.40 128.04 2aw0 s VAL 45 Ca 0.05 -0.76 -0.20 0.00 0.00 0.00 0.00 61.98 61.07 2aw0 s VAL 45 Cb -0.25 -2.14 -0.05 0.00 0.00 0.00 0.00 36.38 33.94 2aw0 s VAL 45 CO 0.06 0.51 0.55 -0.70 0.00 0.00 0.00 175.10 175.52 2aw0 s GLU 46 N 0.97 4.32 0.15 2.72 2.12 -0.26 -1.53 118.70 127.19 2aw0 s GLU 46 Ca -0.02 0.62 -0.12 0.00 0.36 0.00 0.00 54.97 55.81 2aw0 s GLU 46 Cb -0.15 -3.39 0.01 0.00 0.26 0.00 0.00 34.13 30.86 2aw0 s GLU 46 CO -0.02 0.25 0.34 1.52 -0.54 0.00 0.00 175.26 176.80 2aw0 s TYR 47 N 0.26 0.13 -0.34 5.30 1.13 -0.20 -1.28 117.35 122.36 2aw0 s TYR 47 Ca 0.30 -0.50 -0.15 0.00 -1.41 0.00 0.00 57.07 55.31 2aw0 s TYR 47 Cb -0.17 0.10 -0.01 0.00 -1.10 0.00 0.00 41.96 40.78 2aw0 s TYR 47 CO 0.14 -0.73 0.35 0.34 -2.51 0.00 0.00 175.55 173.14 2aw0 s ASP 48 N -2.90 6.17 0.36 -0.18 2.15 -0.45 -1.11 116.67 120.71 2aw0 s ASP 48 Ca 0.11 -0.24 0.15 0.00 0.43 0.00 0.00 52.55 53.00 2aw0 s ASP 48 Cb 0.02 -2.19 1.04 0.00 -0.30 0.00 0.00 42.92 41.49 2aw0 s ASP 48 CO -0.05 -0.33 1.72 -0.65 -0.17 0.00 0.00 175.17 175.70 2aw0 h PRO 49 N 8.46 0.42 0.00 4.34 0.11 -1.79 -1.42 132.00 142.12 2aw0 h PRO 49 Ca -0.30 -0.03 -0.10 0.00 0.11 0.00 0.00 66.00 65.68 2aw0 h PRO 49 Cb 1.15 -0.09 -0.01 0.00 0.11 0.00 0.00 31.00 32.15 2aw0 h PRO 49 CO 0.69 0.28 -0.49 -0.07 -0.21 0.00 0.00 178.00 178.19 2aw0 h LEU 50 N 0.43 0.00 0.00 2.35 4.07 -1.95 -3.30 115.31 116.91 2aw0 h LEU 50 Ca 0.66 0.00 -0.37 0.00 0.08 0.00 0.00 57.88 58.25 2aw0 h LEU 50 Cb 1.52 0.00 -0.07 0.00 1.08 0.00 0.00 40.66 43.19 2aw0 h LEU 50 CO -0.43 0.49 -2.39 0.18 -1.08 0.00 0.00 178.44 175.21 2aw0 n LEU 51 N -3.94 0.55 -4.00 1.67 4.77 -0.78 -5.03 117.00 110.23 2aw0 n LEU 51 Ca -0.01 -0.01 -0.10 0.00 -0.03 0.00 0.00 56.01 55.85 2aw0 n LEU 51 Cb 0.51 0.24 -0.05 0.00 -2.33 0.00 0.00 43.42 41.79 2aw0 n LEU 51 CO 0.40 0.57 0.19 0.28 -1.33 0.00 0.00 177.39 177.51 2aw0 s THR 52 N -2.50 0.00 0.12 -5.08 -1.32 -0.61 -4.79 115.64 101.47 2aw0 s THR 52 Ca -0.14 -1.42 -0.03 0.00 -1.21 0.00 0.00 61.69 58.89 2aw0 s THR 52 Cb 0.07 -2.31 -0.03 0.00 -1.51 0.00 0.00 72.50 68.71 2aw0 s THR 52 CO 0.79 0.00 0.09 -0.94 -2.21 0.00 0.00 174.62 172.35 2aw0 s SER 53 N -3.06 0.28 0.30 8.08 1.04 -1.26 -3.73 113.70 115.35 2aw0 s SER 53 Ca 0.23 -1.08 0.04 0.00 0.48 0.00 0.00 55.95 55.62 2aw0 s SER 53 Cb -0.01 0.31 0.66 0.00 0.10 0.00 0.00 66.02 67.09 2aw0 s SER 53 CO 0.11 -0.74 1.82 -0.65 0.98 0.00 0.00 173.24 174.76 2aw0 h PRO 54 N 2.84 0.84 -0.46 4.02 0.11 -1.99 -1.63 132.00 135.74 2aw0 h PRO 54 Ca -0.34 -0.05 -0.12 0.00 0.11 0.00 0.00 66.00 65.59 2aw0 h PRO 54 Cb 1.19 -0.19 -0.01 0.00 0.11 0.00 0.00 31.00 32.10 2aw0 h PRO 54 CO 0.58 0.56 -0.20 0.93 -0.21 0.00 0.00 178.00 179.66 2aw0 h GLU 55 N 0.87 0.92 0.02 1.05 4.39 -1.98 0.11 114.58 119.97 2aw0 h GLU 55 Ca 0.52 -0.37 -0.00 0.00 0.34 0.00 0.00 59.36 59.84 2aw0 h GLU 55 Cb 0.68 -0.04 0.00 0.00 -0.10 0.00 0.00 28.75 29.29 2aw0 h GLU 55 CO -0.29 1.03 -0.01 1.15 -1.16 0.00 0.00 179.01 179.72 2aw0 h THR 56 N 0.80 1.04 0.30 1.13 2.02 -1.79 0.36 112.91 116.78 2aw0 h THR 56 Ca 0.11 -0.21 -0.01 0.00 0.77 0.00 0.00 66.41 67.06 2aw0 h THR 56 Cb 0.75 1.19 0.00 0.00 -1.74 0.00 0.00 68.15 68.35 2aw0 h THR 56 CO 0.06 0.05 -0.14 -0.07 0.37 0.00 0.00 175.52 175.79 2aw0 h LEU 57 N -0.12 -0.34 -0.60 2.58 3.38 -1.25 -0.87 115.31 118.10 2aw0 h LEU 57 Ca -0.00 -0.01 0.11 0.00 0.09 0.00 0.00 57.88 58.07 2aw0 h LEU 57 Cb 0.11 0.09 -0.08 0.00 0.09 0.00 0.00 40.66 40.87 2aw0 h LEU 57 CO 0.01 -0.22 0.15 -0.09 0.09 0.00 0.00 178.44 178.38 2aw0 h ARG 58 N -0.43 0.28 -0.02 1.13 2.43 -0.99 -1.63 114.38 115.15 2aw0 h ARG 58 Ca -0.04 -0.02 0.03 0.00 -0.81 0.00 0.00 59.98 59.14 2aw0 h ARG 58 Cb 0.33 -0.06 -0.04 0.00 -0.42 0.00 0.00 29.97 29.77 2aw0 h ARG 58 CO 0.07 0.18 -0.22 0.78 -1.51 0.00 0.00 179.97 179.27 2aw0 h GLY 59 N 0.29 -0.30 0.87 2.80 0.00 -0.57 -0.52 103.07 105.63 2aw0 h GLY 59 Ca 0.31 0.27 0.03 0.00 0.00 0.00 0.00 47.33 47.93 2aw0 h GLY 59 CO -0.38 -0.19 0.36 0.00 0.00 0.00 0.00 176.54 176.32 2aw0 h ALA 60 N 0.54 0.76 -0.53 3.60 0.00 -0.65 0.88 119.26 123.87 2aw0 h ALA 60 Ca 0.07 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.96 2aw0 h ALA 60 Cb 0.43 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 18.02 2aw0 h ALA 60 CO -0.21 0.09 0.32 0.82 0.00 0.00 0.00 179.25 180.26 2aw0 h ILE 61 N 0.70 1.16 -0.92 0.00 2.04 -1.09 -0.78 117.51 118.62 2aw0 h ILE 61 Ca 0.24 -0.35 -0.01 0.00 1.00 0.00 0.00 64.86 65.74 2aw0 h ILE 61 Cb 0.03 0.44 -0.04 0.00 -0.74 0.00 0.00 36.82 36.50 2aw0 h ILE 61 CO -0.10 0.16 0.52 -0.08 0.00 0.00 0.00 178.15 178.65 2aw0 h GLU 62 N 0.71 1.27 -0.68 2.37 4.81 -0.54 -1.79 114.58 120.73 2aw0 h GLU 62 Ca 0.19 -0.14 -0.05 0.00 -0.13 0.00 0.00 59.36 59.23 2aw0 h GLU 62 Cb -0.02 -0.26 -0.03 0.00 0.63 0.00 0.00 28.75 29.08 2aw0 h GLU 62 CO -0.04 0.92 0.23 -0.44 -0.73 0.00 0.00 179.01 178.95 2aw0 h ASP 63 N 1.28 0.98 -0.44 1.04 3.32 -0.37 -2.62 116.42 119.61 2aw0 h ASP 63 Ca 0.33 -0.20 0.01 0.00 0.02 0.00 0.00 57.03 57.19 2aw0 h ASP 63 Cb -0.00 -0.26 -0.03 0.00 0.22 0.00 0.00 39.33 39.27 2aw0 h ASP 63 CO -0.06 0.92 0.28 0.24 -1.72 0.00 0.00 179.24 178.90 2aw0 h MET 64 N 0.99 0.55 0.00 3.56 2.86 -0.81 -3.47 114.93 118.60 2aw0 h MET 64 Ca 0.22 -0.03 0.00 0.00 -2.06 0.00 0.00 59.70 57.83 2aw0 h MET 64 Cb 0.28 -0.12 0.00 0.00 0.06 0.00 0.00 31.60 31.81 2aw0 h MET 64 CO -0.01 0.36 0.00 0.41 1.06 0.00 0.00 176.91 178.73 2aw0 n GLY 65 N -1.22 0.18 3.08 8.32 0.00 -0.70 -5.11 105.19 109.74 2aw0 n GLY 65 Ca 0.02 -0.55 -0.07 0.00 0.00 0.00 0.00 46.02 45.41 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 0.45 -0.89 1.61 0.08 -1.16 -5.02 117.98 113.05 2aw0 s PHE 66 Ca 0.00 -0.94 -0.25 0.00 0.12 0.00 0.00 56.93 55.86 2aw0 s PHE 66 Cb 0.00 -0.33 0.02 0.00 -0.57 0.00 0.00 43.02 42.13 2aw0 s PHE 66 CO 0.00 -0.35 1.55 0.34 -0.10 0.00 0.00 175.22 176.66 2aw0 s ASP 67 N -2.64 6.02 -0.27 1.36 2.15 -0.46 -4.17 116.67 118.65 2aw0 s ASP 67 Ca 0.03 -0.87 -0.11 0.00 0.43 0.00 0.00 52.55 52.02 2aw0 s ASP 67 Cb 0.05 -2.56 -0.05 0.00 -0.30 0.00 0.00 42.92 40.06 2aw0 s ASP 67 CO -0.08 -1.93 0.21 0.00 -0.17 0.00 0.00 175.17 173.20 2aw0 s ALA 68 N 6.61 3.55 -0.03 3.66 0.00 -1.26 -1.49 121.76 132.79 2aw0 s ALA 68 Ca 0.50 -1.00 -0.13 0.00 0.00 0.00 0.00 51.96 51.33 2aw0 s ALA 68 Cb -0.05 -2.48 0.02 0.00 0.00 0.00 0.00 23.12 20.62 2aw0 s ALA 68 CO 0.01 -0.48 0.28 -0.08 0.00 0.00 0.00 175.76 175.48 2aw0 s THR 69 N 1.64 0.05 0.59 0.00 -1.32 -0.61 -4.95 115.64 111.04 2aw0 s THR 69 Ca 0.08 -0.43 -0.17 0.00 -1.21 0.00 0.00 61.69 59.96 2aw0 s THR 69 Cb -0.15 -0.55 -0.04 0.00 -1.51 0.00 0.00 72.50 70.25 2aw0 s THR 69 CO 0.09 -0.24 1.10 -0.76 -2.21 0.00 0.00 174.62 172.60 2aw0 s LEU 70 N -1.08 3.59 0.30 9.08 1.43 -1.26 -0.12 118.68 130.61 2aw0 s LEU 70 Ca -0.11 2.02 -0.02 0.00 -1.03 0.00 0.00 54.13 54.98 2aw0 s LEU 70 Cb -0.05 -4.56 0.45 0.00 0.03 0.00 0.00 46.19 42.06 2aw0 s LEU 70 CO 0.03 -1.30 1.97 0.77 0.23 0.00 0.00 176.35 178.05 2aw0 h SER 71 N 0.70 0.95 0.00 2.29 4.64 -1.56 -3.43 113.55 117.14 2aw0 h SER 71 Ca -0.48 -0.02 0.00 0.00 -0.47 0.00 0.00 61.79 60.81 2aw0 h SER 71 Cb 1.24 -0.23 0.00 0.00 -0.31 0.00 0.00 62.40 63.10 2aw0 h SER 71 CO 0.56 0.68 0.00 -0.67 -0.87 0.00 0.00 176.83 176.53