#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1vaz h ARG 2 N 0.00 -0.01 -5.11 3.49 9.65 -2.09 -3.44 114.38 116.86 1vaz h ARG 2 Ca 0.00 0.00 -0.63 0.00 -1.10 0.00 0.00 59.98 58.25 1vaz h ARG 2 Cb 0.00 0.00 -0.15 0.00 -1.39 0.00 0.00 29.97 28.43 1vaz h ARG 2 CO 0.00 -0.01 -0.33 0.50 2.80 0.00 0.00 179.97 182.93 1vaz s ARG 3 N -1.25 4.02 -0.12 0.20 3.52 -1.26 -5.07 118.95 118.99 1vaz s ARG 3 Ca -0.00 -0.06 -0.07 0.00 -0.13 0.00 0.00 55.73 55.47 1vaz s ARG 3 Cb 0.00 -3.63 -0.04 0.00 -1.56 0.00 0.00 34.95 29.72 1vaz s ARG 3 CO 0.01 -0.19 0.13 1.03 -0.81 0.00 0.00 175.30 175.46 1vaz s ARG 4 N 1.81 3.43 0.12 5.12 0.52 -1.26 -5.00 118.95 123.68 1vaz s ARG 4 Ca 0.13 -0.15 -0.19 0.00 -0.52 0.00 0.00 55.73 54.99 1vaz s ARG 4 Cb -0.15 -3.17 -0.06 0.00 0.52 0.00 0.00 34.95 32.09 1vaz s ARG 4 CO 0.09 0.76 1.72 1.25 0.02 0.00 0.00 175.30 179.15 1vaz h HIS 5 N 5.05 0.33 -0.21 -0.53 -0.00 -2.02 -3.12 115.15 114.65 1vaz h HIS 5 Ca -0.54 -0.01 -0.09 0.00 -0.00 0.00 0.00 60.37 59.73 1vaz h HIS 5 Cb 1.22 -0.11 -0.06 0.00 -0.00 0.00 0.00 27.41 28.47 1vaz h HIS 5 CO 0.74 0.28 -0.18 0.45 -0.00 0.00 0.00 177.93 179.22 1vaz n SER 6 N -4.87 2.40 -3.47 3.26 2.88 -1.26 -5.04 113.62 107.53 1vaz n SER 6 Ca -0.03 -3.66 -0.26 0.00 -1.33 0.00 0.00 58.87 53.59 1vaz n SER 6 Cb 0.07 -0.58 0.21 0.00 -0.75 0.00 0.00 64.21 63.16 1vaz n SER 6 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1vaz n GLY 7 N -1.09 -2.48 3.58 0.46 0.00 -1.18 -4.89 105.19 99.59 1vaz n GLY 7 Ca 0.26 -1.53 -0.41 0.00 0.00 0.00 0.00 46.02 44.34 1vaz n GLY 7 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1vaz s GLN 8 N -5.24 3.21 0.02 1.61 0.00 -1.26 -4.93 119.66 113.07 1vaz s GLN 8 Ca 0.63 0.69 -0.28 0.00 -0.00 0.00 0.00 55.36 56.40 1vaz s GLN 8 Cb -0.05 -4.17 0.08 0.00 0.00 0.00 0.00 33.01 28.87 1vaz s GLN 8 CO 0.47 -2.03 0.73 0.34 0.00 0.00 0.00 175.29 174.81 1vaz s ASP 9 N 5.29 -0.54 -0.59 12.60 2.15 -1.26 -5.09 116.67 129.24 1vaz s ASP 9 Ca 0.60 0.29 -0.12 0.00 0.43 0.00 0.00 52.55 53.76 1vaz s ASP 9 Cb -0.13 0.50 0.15 0.00 -0.30 0.00 0.00 42.92 43.14 1vaz s ASP 9 CO 0.26 -0.70 0.50 0.54 -0.17 0.00 0.00 175.17 175.60 1vaz s VAL 10 N -2.44 4.79 0.13 1.11 0.11 -1.26 -5.04 120.40 117.80 1vaz s VAL 10 Ca -0.03 -1.96 0.04 0.00 -2.93 0.00 0.00 61.98 57.10 1vaz s VAL 10 Cb -0.01 -4.07 -0.04 0.00 -1.53 0.00 0.00 36.38 30.73 1vaz s VAL 10 CO -0.03 -0.87 -0.10 -2.28 -3.33 0.00 0.00 175.10 168.49 1vaz s HIS 11 N 1.03 1.21 0.26 1.54 2.46 -1.26 -2.89 115.29 117.64 1vaz s HIS 11 Ca 0.09 -0.72 -0.21 0.00 0.47 0.00 0.00 55.06 54.68 1vaz s HIS 11 Cb -0.23 -0.63 0.03 0.00 -0.13 0.00 0.00 32.58 31.62 1vaz s HIS 11 CO -0.02 0.05 0.70 0.54 -2.47 0.00 0.00 174.74 173.55 1vaz s VAL 12 N -3.00 0.00 -0.28 0.89 0.11 -0.84 -4.91 120.40 112.37 1vaz s VAL 12 Ca 0.13 -0.82 0.03 0.00 -2.93 0.00 0.00 61.98 58.39 1vaz s VAL 12 Cb 0.01 -1.83 0.07 0.00 -1.53 0.00 0.00 36.38 33.10 1vaz s VAL 12 CO 0.00 0.00 -0.07 -0.69 -3.33 0.00 0.00 175.10 171.02 1vaz s VAL 13 N -3.88 2.16 -0.34 2.04 1.01 -1.26 0.98 120.40 121.11 1vaz s VAL 13 Ca 0.09 -1.79 -0.13 0.00 0.00 0.00 0.00 61.98 60.16 1vaz s VAL 13 Cb -0.05 -2.35 -0.02 0.00 0.00 0.00 0.00 36.38 33.96 1vaz s VAL 13 CO 0.03 -0.17 0.25 -0.76 0.00 0.00 0.00 175.10 174.45 1vaz s LEU 14 N 1.07 4.51 0.33 3.92 1.43 0.15 -3.70 118.68 126.39 1vaz s LEU 14 Ca -0.04 -0.41 -0.02 0.00 -1.03 0.00 0.00 54.13 52.63 1vaz s LEU 14 Cb -0.20 -2.15 -0.04 0.00 0.03 0.00 0.00 46.19 43.84 1vaz s LEU 14 CO -0.06 -0.24 0.56 -0.75 0.23 0.00 0.00 176.35 176.09 1vaz s LYS 15 N 1.74 3.54 -0.09 1.70 2.20 -0.83 -1.95 119.74 126.05 1vaz s LYS 15 Ca 0.06 -0.18 0.01 0.00 -0.36 0.00 0.00 55.97 55.51 1vaz s LYS 15 Cb -0.17 -2.65 0.02 0.00 -1.51 0.00 0.00 37.83 33.52 1vaz s LYS 15 CO 0.11 0.16 -0.10 -1.17 -0.36 0.00 0.00 175.35 173.99 1vaz s LEU 16 N -4.01 1.43 0.53 5.43 2.96 -1.17 -0.59 118.68 123.26 1vaz s LEU 16 Ca 0.42 -0.30 0.08 0.00 -0.22 0.00 0.00 54.13 54.11 1vaz s LEU 16 Cb -0.10 -0.83 0.06 0.00 0.50 0.00 0.00 46.19 45.82 1vaz s LEU 16 CO 0.34 -0.04 0.65 0.26 -1.32 0.00 0.00 176.35 176.24 1vaz s TRP 17 N 1.16 1.79 0.24 5.38 0.52 2.45 -4.36 118.94 126.12 1vaz s TRP 17 Ca -0.05 -0.67 -0.07 0.00 0.02 0.00 0.00 56.10 55.33 1vaz s TRP 17 Cb -0.14 -2.18 0.39 0.00 -1.15 0.00 0.00 33.47 30.39 1vaz s TRP 17 CO -0.02 -0.82 1.34 1.63 0.02 0.00 0.00 176.95 179.09 1vaz n LYS 18 N -2.03 -0.08 -0.94 4.98 5.02 -1.26 -2.62 118.16 121.23 1vaz n LYS 18 Ca 0.10 1.34 0.01 0.00 -2.02 0.00 0.00 58.31 57.74 1vaz n LYS 18 Cb 0.62 -2.00 0.00 0.00 -0.02 0.00 0.00 35.03 33.63 1vaz n LYS 18 CO 0.00 0.00 0.00 -2.37 -0.52 0.00 0.00 177.40 174.51 1vaz n THR 19 N -5.40 0.00 -3.72 -0.18 5.66 -1.26 -5.08 114.28 104.30 1vaz n THR 19 Ca 0.14 -0.42 -0.13 0.00 -3.05 0.00 0.00 64.05 60.59 1vaz n THR 19 Cb 0.43 0.68 -0.07 0.00 -1.55 0.00 0.00 70.33 69.81 1vaz n THR 19 CO 0.00 0.00 0.00 -0.83 -3.05 0.00 0.00 175.07 171.19 1vaz s GLY 20 N -1.35 -0.21 0.12 1.09 0.00 -1.08 0.08 107.32 105.97 1vaz s GLY 20 Ca 0.14 0.31 0.09 0.00 0.00 0.00 0.00 44.72 45.26 1vaz s GLY 20 CO -0.07 0.07 -0.23 -0.11 0.00 0.00 0.00 173.10 172.76 1vaz s PHE 21 N -1.96 2.00 0.55 1.90 -0.12 -0.65 0.59 117.98 120.28 1vaz s PHE 21 Ca -0.09 -0.40 0.07 0.00 -0.05 0.00 0.00 56.93 56.46 1vaz s PHE 21 Cb -0.02 -1.08 0.05 0.00 -0.63 0.00 0.00 43.02 41.34 1vaz s PHE 21 CO 0.01 0.27 0.54 0.45 -0.05 0.00 0.00 175.22 176.44 1vaz s SER 22 N -2.02 4.82 -0.30 1.98 0.15 0.24 -1.83 113.70 116.75 1vaz s SER 22 Ca 0.10 -1.08 -0.09 0.00 0.70 0.00 0.00 55.95 55.58 1vaz s SER 22 Cb -0.10 0.33 0.18 0.00 -1.71 0.00 0.00 66.02 64.72 1vaz s SER 22 CO 0.05 -1.17 0.88 -0.22 1.20 0.00 0.00 173.24 173.98 1vaz s LEU 23 N -4.41 -0.81 0.00 3.45 0.20 -1.26 -1.97 118.68 113.88 1vaz s LEU 23 Ca 0.44 0.55 0.00 0.00 0.69 0.00 0.00 54.13 55.81 1vaz s LEU 23 Cb -0.04 1.69 0.00 0.00 -0.43 0.00 0.00 46.19 47.42 1vaz s LEU 23 CO 0.28 -0.15 0.00 -0.90 -0.29 0.00 0.00 176.35 175.29 1vaz n ASP 24 N 5.43 0.00 -2.19 3.68 5.68 -1.24 -4.28 116.55 123.62 1vaz n ASP 24 Ca -0.05 0.00 0.00 0.00 -0.50 0.00 0.00 54.79 54.24 1vaz n ASP 24 Cb 0.53 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.51 1vaz n ASP 24 CO 0.00 0.00 0.00 -3.20 -1.33 0.00 0.00 177.20 172.67 1vaz n ASN 25 N 2.16 0.00 -1.41 -1.12 5.15 -1.26 -4.99 115.26 113.79 1vaz n ASN 25 Ca 0.00 0.00 0.16 0.00 -0.60 0.00 0.00 54.58 54.14 1vaz n ASN 25 Cb 0.00 0.00 -0.09 0.00 -0.53 0.00 0.00 39.78 39.16 1vaz n ASN 25 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1vaz n GLY 26 N 5.00 -3.18 0.06 8.20 0.00 -1.26 -4.92 105.19 109.10 1vaz n GLY 26 Ca 0.00 -0.94 -0.00 0.00 0.00 0.00 0.00 46.02 45.07 1vaz n GLY 26 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1vaz n ASP 27 N -4.25 0.01 -4.76 1.61 8.00 -1.26 -4.77 116.55 111.13 1vaz n ASP 27 Ca -0.09 -1.01 -0.40 0.00 0.71 0.00 0.00 54.79 54.00 1vaz n ASP 27 Cb 0.65 -0.02 -0.05 0.00 -0.02 0.00 0.00 41.12 41.68 1vaz n ASP 27 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 1vaz s LEU 28 N 0.00 4.57 0.04 0.64 0.20 -1.26 -4.67 118.68 118.20 1vaz s LEU 28 Ca 0.01 2.13 0.02 0.00 0.69 0.00 0.00 54.13 56.97 1vaz s LEU 28 Cb -0.00 -3.66 -0.04 0.00 -0.43 0.00 0.00 46.19 42.07 1vaz s LEU 28 CO 0.01 -0.04 0.07 -0.13 -0.29 0.00 0.00 176.35 175.97 1vaz s ARG 29 N -1.41 2.94 -0.09 1.98 0.52 -0.76 -4.96 118.95 117.18 1vaz s ARG 29 Ca 0.44 -0.61 -0.19 0.00 -0.52 0.00 0.00 55.73 54.85 1vaz s ARG 29 Cb -0.29 -2.77 -0.04 0.00 0.52 0.00 0.00 34.95 32.37 1vaz s ARG 29 CO 0.37 0.60 0.51 0.45 0.02 0.00 0.00 175.30 177.25 1vaz s SER 30 N -2.07 6.76 0.51 0.23 0.15 -1.26 -1.64 113.70 116.38 1vaz s SER 30 Ca 0.26 0.91 0.39 0.00 0.70 0.00 0.00 55.95 58.21 1vaz s SER 30 Cb -0.12 -2.31 1.33 0.00 -1.71 0.00 0.00 66.02 63.21 1vaz s SER 30 CO 0.18 0.03 1.32 -1.22 1.20 0.00 0.00 173.24 174.75 1vaz n TYR 31 N 3.42 0.00 0.10 3.44 4.02 0.11 0.16 117.16 128.41 1vaz n TYR 31 Ca -0.07 0.00 -0.20 0.00 -0.01 0.00 0.00 57.90 57.62 1vaz n TYR 31 Cb 0.52 -0.38 -0.12 0.00 -0.02 0.00 0.00 39.34 39.33 1vaz n TYR 31 CO 0.00 0.00 0.00 0.37 -1.01 0.00 0.00 176.86 176.22 1vaz h GLN 32 N 0.00 0.50 -5.47 -0.72 5.75 -1.91 -3.45 115.11 109.81 1vaz h GLN 32 Ca 0.72 -0.71 -0.50 0.00 -0.15 0.00 0.00 58.65 58.01 1vaz h GLN 32 Cb 3.16 0.24 0.22 0.00 1.07 0.00 0.00 27.48 32.18 1vaz h GLN 32 CO -0.01 1.32 -1.74 -3.47 -2.65 0.00 0.00 178.83 172.28 1vaz n ASP 33 N -3.72 -5.40 -0.01 -0.69 -0.08 0.41 -4.85 116.55 102.22 1vaz n ASP 33 Ca -0.12 0.16 -0.18 0.00 -1.51 0.00 0.00 54.79 53.14 1vaz n ASP 33 Cb 0.99 -0.68 -0.09 0.00 2.34 0.00 0.00 41.12 43.68 1vaz n ASP 33 CO 0.00 0.00 0.00 1.55 0.12 0.00 0.00 177.20 178.87 1vaz h PRO 34 N -0.91 0.64 -0.91 -0.67 0.13 -1.90 -3.11 132.00 125.26 1vaz h PRO 34 Ca -0.40 -0.58 0.26 0.00 -0.87 0.00 0.00 66.00 64.42 1vaz h PRO 34 Cb 1.19 0.14 -0.04 0.00 0.13 0.00 0.00 31.00 32.42 1vaz h PRO 34 CO 0.21 1.19 0.98 1.03 -0.23 0.00 0.00 178.00 181.18 1vaz h SER 35 N 0.28 0.00 0.23 1.44 0.87 -1.93 1.95 113.55 116.39 1vaz h SER 35 Ca -0.07 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.49 1vaz h SER 35 Cb 1.38 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.34 1vaz h SER 35 CO 0.15 0.00 0.00 0.59 -0.53 0.00 0.00 176.83 177.04 1vaz n ASN 36 N -3.47 0.00 0.16 6.23 3.02 -1.17 -2.48 115.26 117.54 1vaz n ASN 36 Ca 0.20 0.39 -0.14 0.00 -0.03 0.00 0.00 54.58 55.00 1vaz n ASN 36 Cb 1.27 -0.43 -0.07 0.00 -0.61 0.00 0.00 39.78 39.95 1vaz n ASN 36 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1vaz h ALA 37 N 2.31 -0.55 0.02 5.41 0.00 0.29 0.51 119.26 127.25 1vaz h ALA 37 Ca 0.00 -0.07 -0.28 0.00 0.00 0.00 0.00 54.91 54.56 1vaz h ALA 37 Cb 0.11 0.43 -0.04 0.00 0.00 0.00 0.00 17.79 18.29 1vaz h ALA 37 CO 0.00 -0.85 -1.54 0.37 0.00 0.00 0.00 179.25 177.23 1vaz h GLN 38 N -0.56 0.05 0.41 0.00 5.75 -1.75 -2.30 115.11 116.71 1vaz h GLN 38 Ca 0.00 -0.08 -0.02 0.00 -0.15 0.00 0.00 58.65 58.40 1vaz h GLN 38 Cb 0.54 0.03 0.00 0.00 1.07 0.00 0.00 27.48 29.12 1vaz h GLN 38 CO -0.10 0.73 -0.20 0.35 -2.65 0.00 0.00 178.83 176.96 1vaz h PHE 39 N 0.01 -0.52 0.05 3.99 3.04 -1.36 0.51 116.94 122.67 1vaz h PHE 39 Ca -0.23 -0.01 -0.00 0.00 3.98 0.00 0.00 57.97 61.71 1vaz h PHE 39 Cb 1.96 0.17 0.00 0.00 2.56 0.00 0.00 35.95 40.64 1vaz h PHE 39 CO 0.01 -0.23 -0.03 1.25 -2.02 0.00 0.00 178.31 177.29 1vaz h LEU 40 N -0.73 -0.06 0.06 0.59 5.85 -0.13 -2.22 115.31 118.68 1vaz h LEU 40 Ca -0.06 -0.53 -0.00 0.00 0.84 0.00 0.00 57.88 58.13 1vaz h LEU 40 Cb 0.51 0.02 0.00 0.00 0.37 0.00 0.00 40.66 41.56 1vaz h LEU 40 CO 0.09 0.53 -0.03 1.05 -0.34 0.00 0.00 178.44 179.74 1vaz h GLU 41 N -0.68 -0.08 -0.73 1.25 4.11 -1.40 -2.71 114.58 114.34 1vaz h GLU 41 Ca -0.01 0.01 -0.05 0.00 0.07 0.00 0.00 59.36 59.38 1vaz h GLU 41 Cb 0.59 0.02 -0.03 0.00 0.50 0.00 0.00 28.75 29.82 1vaz h GLU 41 CO 0.01 0.52 0.26 1.03 0.07 0.00 0.00 179.01 180.90 1vaz h SER 42 N -0.82 1.04 -0.26 3.06 0.87 -0.07 -2.59 113.55 114.77 1vaz h SER 42 Ca -0.01 -0.18 -0.02 0.00 -1.23 0.00 0.00 61.79 60.36 1vaz h SER 42 Cb 0.63 -0.27 -0.01 0.00 -0.44 0.00 0.00 62.40 62.31 1vaz h SER 42 CO 0.01 0.94 0.09 0.40 -0.53 0.00 0.00 176.83 177.74 1vaz h ILE 43 N 1.08 1.19 -0.95 2.23 2.04 -0.20 2.28 117.51 125.18 1vaz h ILE 43 Ca 0.24 -0.60 0.17 0.00 1.00 0.00 0.00 64.86 65.67 1vaz h ILE 43 Cb 0.26 1.10 -0.10 0.00 -0.74 0.00 0.00 36.82 37.34 1vaz h ILE 43 CO -0.01 0.20 0.55 -0.09 0.00 0.00 0.00 178.15 178.80 1vaz h ARG 44 N 0.26 0.72 0.00 2.37 2.43 -1.25 0.54 114.38 119.45 1vaz h ARG 44 Ca 0.08 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.21 1vaz h ARG 44 Cb 0.22 -0.16 0.00 0.00 -0.42 0.00 0.00 29.97 29.61 1vaz h ARG 44 CO -0.00 0.48 -0.26 0.00 -1.51 0.00 0.00 179.97 178.67 1vaz h ARG 45 N 0.74 0.00 0.00 0.20 3.08 -1.03 -3.47 114.38 113.90 1vaz h ARG 45 Ca 0.53 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.58 1vaz h ARG 45 Cb 0.77 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.82 1vaz h ARG 45 CO -0.36 0.00 0.00 0.41 -1.07 0.00 0.00 179.97 178.95 1vaz n GLY 46 N 1.24 0.69 3.25 0.04 0.00 0.22 -5.09 105.19 105.55 1vaz n GLY 46 Ca 0.04 -0.42 -0.14 0.00 0.00 0.00 0.00 46.02 45.50 1vaz n GLY 46 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1vaz s GLU 47 N -0.30 0.69 -0.00 1.61 8.01 0.71 -3.98 118.70 125.44 1vaz s GLU 47 Ca 0.00 -0.18 -0.00 0.00 0.01 0.00 0.00 54.97 54.80 1vaz s GLU 47 Cb 0.00 0.31 -0.04 0.00 -4.31 0.00 0.00 34.13 30.09 1vaz s GLU 47 CO 0.00 -0.19 0.08 0.54 0.01 0.00 0.00 175.26 175.70 1vaz s VAL 48 N -1.35 4.72 0.21 2.63 0.11 -1.23 -0.97 120.40 124.52 1vaz s VAL 48 Ca -0.13 -0.41 0.11 0.00 -2.93 0.00 0.00 61.98 58.62 1vaz s VAL 48 Cb -0.05 -3.16 -0.04 0.00 -1.53 0.00 0.00 36.38 31.60 1vaz s VAL 48 CO 0.04 0.35 1.55 1.55 -3.33 0.00 0.00 175.10 175.27 1vaz h PRO 49 N 4.11 0.00 0.00 1.54 0.13 -1.90 -3.13 132.00 132.75 1vaz h PRO 49 Ca -0.49 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.64 1vaz h PRO 49 Cb 1.18 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.31 1vaz h PRO 49 CO 0.62 0.67 -0.64 0.00 -0.23 0.00 0.00 178.00 178.42 1vaz n ALA 50 N -2.39 0.68 0.33 -0.56 0.00 -1.26 -4.23 120.51 113.08 1vaz n ALA 50 Ca -0.01 -0.61 0.19 0.00 0.00 0.00 0.00 53.44 53.02 1vaz n ALA 50 Cb 0.68 0.03 1.02 0.00 0.00 0.00 0.00 19.45 21.18 1vaz n ALA 50 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 1vaz h GLU 51 N -0.64 0.00 0.00 0.00 4.57 -1.91 0.29 114.58 116.89 1vaz h GLU 51 Ca 0.00 0.00 -0.16 0.00 -1.18 0.00 0.00 59.36 58.02 1vaz h GLU 51 Cb 0.64 0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 29.21 1vaz h GLU 51 CO 0.00 0.00 -0.79 1.37 -1.18 0.00 0.00 179.01 178.41 1vaz h LEU 52 N 0.00 0.00 -0.50 1.64 -0.00 -1.77 -2.76 115.31 111.92 1vaz h LEU 52 Ca 0.00 0.00 -0.14 0.00 -0.00 0.00 0.00 57.88 57.74 1vaz h LEU 52 Cb 0.31 0.00 -0.02 0.00 -0.00 0.00 0.00 40.66 40.95 1vaz h LEU 52 CO 0.00 0.75 -0.66 -0.09 -0.00 0.00 0.00 178.44 178.45 1vaz h ARG 53 N 0.00 0.00 0.44 0.17 2.43 -1.12 2.26 114.38 118.57 1vaz h ARG 53 Ca -0.02 0.00 -0.02 0.00 -0.81 0.00 0.00 59.98 59.13 1vaz h ARG 53 Cb 1.59 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 31.14 1vaz h ARG 53 CO 0.10 0.66 -0.21 0.00 -1.51 0.00 0.00 179.97 179.00 1vaz h ARG 54 N 0.00 -0.57 0.00 0.20 3.08 -1.41 -3.34 114.38 112.33 1vaz h ARG 54 Ca -0.01 0.04 -0.27 0.00 0.07 0.00 0.00 59.98 59.81 1vaz h ARG 54 Cb 1.27 0.13 -0.04 0.00 0.08 0.00 0.00 29.97 31.41 1vaz h ARG 54 CO 0.09 -0.31 -1.87 -0.11 -1.07 0.00 0.00 179.97 176.70 1vaz n LEU 55 N -5.18 1.87 0.03 3.04 -0.00 -1.05 -4.67 117.00 111.05 1vaz n LEU 55 Ca -0.09 0.32 -0.11 0.00 -0.00 0.00 0.00 56.01 56.13 1vaz n LEU 55 Cb 0.27 -0.75 -0.05 0.00 -0.00 0.00 0.00 43.42 42.89 1vaz n LEU 55 CO 0.23 0.22 0.65 0.00 -0.00 0.00 0.00 177.39 178.48 1vaz h ALA 56 N -0.94 -0.41 -2.51 1.96 0.00 -1.11 -3.47 119.26 112.77 1vaz h ALA 56 Ca -0.41 0.00 -0.09 0.00 0.00 0.00 0.00 54.91 54.42 1vaz h ALA 56 Cb 1.33 0.58 0.04 0.00 0.00 0.00 0.00 17.79 19.74 1vaz h ALA 56 CO -0.25 -0.81 -0.17 0.72 0.00 0.00 0.00 179.25 178.74 1vaz n HIS 57 N -5.41 -0.61 0.00 0.00 8.25 0.74 -4.71 115.22 113.49 1vaz n HIS 57 Ca -0.04 0.23 0.00 0.00 -0.26 0.00 0.00 57.72 57.65 1vaz n HIS 57 Cb 0.32 -2.35 0.00 0.00 1.12 0.00 0.00 29.99 29.09 1vaz n HIS 57 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1vaz n GLY 58 N -0.95 -0.81 0.00 -1.41 0.00 -1.25 -5.02 105.19 95.75 1vaz n GLY 58 Ca -0.03 0.39 0.00 0.00 0.00 0.00 0.00 46.02 46.38 1vaz n GLY 58 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1vaz n GLY 59 N 0.00 -1.80 2.89 -0.02 0.00 -1.26 -4.95 105.19 100.04 1vaz n GLY 59 Ca 0.00 0.78 -0.11 0.00 0.00 0.00 0.00 46.02 46.69 1vaz n GLY 59 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1vaz s GLN 60 N 0.00 0.75 -0.00 1.61 -0.21 -1.26 -4.89 119.66 115.65 1vaz s GLN 60 Ca 0.00 -0.76 -0.19 0.00 0.02 0.00 0.00 55.36 54.43 1vaz s GLN 60 Cb 0.00 -0.45 0.03 0.00 1.00 0.00 0.00 33.01 33.59 1vaz s GLN 60 CO 0.00 -1.22 0.40 0.08 -2.12 0.00 0.00 175.29 172.44 1vaz s VAL 61 N 1.44 0.05 0.27 1.09 1.01 -1.26 -4.47 120.40 118.53 1vaz s VAL 61 Ca 0.18 -0.39 -0.25 0.00 0.00 0.00 0.00 61.98 61.52 1vaz s VAL 61 Cb -0.10 -0.78 -0.09 0.00 0.00 0.00 0.00 36.38 35.41 1vaz s VAL 61 CO -0.05 -0.22 0.88 0.20 0.00 0.00 0.00 175.10 175.92 1vaz s ASN 62 N -1.50 7.35 0.10 3.32 -0.87 -1.14 -3.35 114.94 118.84 1vaz s ASN 62 Ca -0.11 1.76 0.03 0.00 -1.57 0.00 0.00 52.86 52.96 1vaz s ASN 62 Cb -0.03 -2.55 -0.04 0.00 -0.02 0.00 0.00 41.25 38.62 1vaz s ASN 62 CO 0.03 0.02 -0.08 -1.48 -2.57 0.00 0.00 177.10 173.03 1vaz s LEU 63 N -1.78 2.46 -0.19 0.60 2.34 -1.26 -1.99 118.68 118.86 1vaz s LEU 63 Ca 0.46 -0.92 -0.00 0.00 0.06 0.00 0.00 54.13 53.73 1vaz s LEU 63 Cb -0.20 -0.18 0.01 0.00 -0.56 0.00 0.00 46.19 45.26 1vaz s LEU 63 CO 0.25 -0.37 -0.16 -1.81 -1.06 0.00 0.00 176.35 173.20 1vaz s ASP 64 N -2.77 3.43 0.16 1.48 1.11 0.28 -4.89 116.67 115.46 1vaz s ASP 64 Ca 0.09 -0.58 -0.30 0.00 0.18 0.00 0.00 52.55 51.94 1vaz s ASP 64 Cb 0.01 -1.55 -0.07 0.00 1.07 0.00 0.00 42.92 42.39 1vaz s ASP 64 CO -0.02 -0.00 1.08 -0.32 1.18 0.00 0.00 175.17 177.08 1vaz s MET 65 N 1.32 4.61 -0.22 8.23 1.75 -1.25 0.34 119.30 134.08 1vaz s MET 65 Ca 0.05 1.67 -0.03 0.00 -1.25 0.00 0.00 55.69 56.12 1vaz s MET 65 Cb -0.13 -3.30 -0.00 0.00 2.84 0.00 0.00 34.83 34.23 1vaz s MET 65 CO -0.10 0.09 -0.06 -1.21 -0.65 0.00 0.00 175.02 173.08 1vaz s GLU 66 N -0.22 3.33 -0.56 4.11 0.41 -0.82 -4.91 118.70 120.04 1vaz s GLU 66 Ca 0.49 -0.65 -0.26 0.00 -0.41 0.00 0.00 54.97 54.15 1vaz s GLU 66 Cb -0.28 -2.96 0.04 0.00 -1.78 0.00 0.00 34.13 29.14 1vaz s GLU 66 CO 0.34 -0.20 1.04 0.34 -0.49 0.00 0.00 175.26 176.28 1vaz s ASP 67 N 1.46 6.38 -0.39 -0.19 2.15 -1.26 -3.07 116.67 121.74 1vaz s ASP 67 Ca 0.06 -0.18 0.11 0.00 0.43 0.00 0.00 52.55 52.96 1vaz s ASP 67 Cb -0.14 -2.48 0.37 0.00 -0.30 0.00 0.00 42.92 40.37 1vaz s ASP 67 CO -0.04 -1.33 0.99 1.41 -0.17 0.00 0.00 175.17 176.03 1vaz n HIS 68 N 7.84 -0.97 -0.05 -5.34 8.25 -1.26 -4.97 115.22 118.73 1vaz n HIS 68 Ca 0.04 -2.80 -0.13 0.00 -0.26 0.00 0.00 57.72 54.57 1vaz n HIS 68 Cb 0.48 0.53 -0.11 0.00 1.12 0.00 0.00 29.99 32.01 1vaz n HIS 68 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1vaz h ARG 69 N 2.83 -0.01 0.00 -0.41 2.47 -1.86 -3.14 114.38 114.25 1vaz h ARG 69 Ca -0.06 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.66 1vaz h ARG 69 Cb 1.11 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.43 1vaz h ARG 69 CO 0.30 0.78 0.00 -0.25 0.56 0.00 0.00 179.97 181.36 1vaz n ASP 70 N -4.70 0.00 -0.11 7.04 8.00 -1.26 -3.69 116.55 121.83 1vaz n ASP 70 Ca -0.09 -1.69 -0.20 0.00 0.71 0.00 0.00 54.79 53.52 1vaz n ASP 70 Cb 0.39 0.00 -0.08 0.00 -0.02 0.00 0.00 41.12 41.41 1vaz n ASP 70 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1vaz n GLU 71 N -0.60 0.55 -4.39 -1.24 4.71 -1.19 -5.05 120.64 113.44 1vaz n GLU 71 Ca 0.04 0.43 -0.23 0.00 -0.01 0.00 0.00 57.16 57.40 1vaz n GLU 71 Cb 0.02 -1.62 -0.08 0.00 -1.01 0.00 0.00 31.44 28.75 1vaz n GLU 71 CO 0.00 0.00 0.00 0.34 0.09 0.00 0.00 177.13 177.56 1vaz s ASP 72 N -6.75 2.23 -0.62 1.62 2.15 -1.20 -4.95 116.67 109.15 1vaz s ASP 72 Ca -0.30 -1.76 -0.22 0.00 0.43 0.00 0.00 52.55 50.70 1vaz s ASP 72 Cb 0.08 0.59 0.03 0.00 -0.30 0.00 0.00 42.92 43.32 1vaz s ASP 72 CO 0.48 -1.04 0.64 0.33 -0.17 0.00 0.00 175.17 175.40 1vaz n PHE 73 N -0.77 -2.40 -3.89 -5.34 -0.00 -1.26 -4.74 117.46 99.06 1vaz n PHE 73 Ca 0.02 1.00 -0.30 0.00 -0.00 0.00 0.00 57.45 58.17 1vaz n PHE 73 Cb 0.63 -2.22 -0.15 0.00 -0.00 0.00 0.00 39.48 37.74 1vaz n PHE 73 CO 0.00 0.00 0.00 0.08 -0.00 0.00 0.00 176.76 176.84 1vaz s VAL 74 N -2.15 1.48 -0.67 -2.13 1.01 -1.26 -4.06 120.40 112.62 1vaz s VAL 74 Ca 0.21 -1.56 -0.38 0.00 0.00 0.00 0.00 61.98 60.25 1vaz s VAL 74 Cb -0.02 -1.97 -0.19 0.00 0.00 0.00 0.00 36.38 34.20 1vaz s VAL 74 CO 0.89 -0.43 2.36 0.29 0.00 0.00 0.00 175.10 178.21 1vaz n LYS 75 N 4.63 0.15 0.00 2.72 4.76 -1.26 -5.18 118.16 123.98 1vaz n LYS 75 Ca -0.04 0.03 0.11 0.00 -2.87 0.00 0.00 58.31 55.54 1vaz n LYS 75 Cb 0.43 -1.68 0.64 0.00 -1.84 0.00 0.00 35.03 32.58 1vaz n LYS 75 CO 0.00 0.00 0.00 -0.35 -1.37 0.00 0.00 177.40 175.68