#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1vaz n ARG 2 N 0.00 -4.47 -1.24 3.49 0.63 -1.26 -4.61 116.66 109.20 1vaz n ARG 2 Ca 0.00 3.34 -0.41 0.00 -0.92 0.00 0.00 57.85 59.86 1vaz n ARG 2 Cb 0.00 -4.64 -0.06 0.00 0.45 0.00 0.00 32.46 28.20 1vaz n ARG 2 CO 0.00 0.00 0.00 0.54 -2.51 0.00 0.00 177.63 175.66 1vaz n ARG 3 N 1.82 1.40 0.00 -0.14 1.74 -1.26 -4.69 116.66 115.54 1vaz n ARG 3 Ca -0.31 -1.87 0.00 0.00 -0.77 0.00 0.00 57.85 54.90 1vaz n ARG 3 Cb 0.47 -3.01 0.00 0.00 -1.02 0.00 0.00 32.46 28.90 1vaz n ARG 3 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 1vaz n ARG 4 N 7.27 0.00 0.00 5.56 1.74 -1.26 -3.21 116.66 126.75 1vaz n ARG 4 Ca 0.49 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.57 1vaz n ARG 4 Cb 0.41 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.85 1vaz n ARG 4 CO 0.00 0.00 0.00 -2.39 -1.52 0.00 0.00 177.63 173.72 1vaz n HIS 5 N 0.00 0.00 -2.77 -1.55 1.44 -1.26 -5.15 115.22 105.93 1vaz n HIS 5 Ca 0.00 0.00 -0.40 0.00 -2.01 0.00 0.00 57.72 55.31 1vaz n HIS 5 Cb 0.00 0.00 -0.06 0.00 0.12 0.00 0.00 29.99 30.05 1vaz n HIS 5 CO 0.00 0.00 0.00 -1.54 -2.81 0.00 0.00 176.34 171.99 1vaz s SER 6 N 0.00 7.62 0.03 4.39 1.04 -1.20 -4.75 113.70 120.83 1vaz s SER 6 Ca 0.00 1.91 0.00 0.00 0.48 0.00 0.00 55.95 58.34 1vaz s SER 6 Cb 0.00 -2.60 0.00 0.00 0.10 0.00 0.00 66.02 63.52 1vaz s SER 6 CO 0.00 0.15 0.00 0.61 0.98 0.00 0.00 173.24 174.98 1vaz n GLY 7 N 1.55 -1.06 3.58 7.32 0.00 -1.26 -5.03 105.19 110.29 1vaz n GLY 7 Ca -0.02 0.43 -0.21 0.00 0.00 0.00 0.00 46.02 46.22 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 -2.00 1.73 0.27 1.61 0.00 -1.26 -4.77 119.66 115.23 1vaz s GLN 8 Ca 0.00 -0.76 0.00 0.00 -0.00 0.00 0.00 55.36 54.60 1vaz s GLN 8 Cb 0.00 -5.10 0.00 0.00 0.00 0.00 0.00 33.01 27.91 1vaz s GLN 8 CO 0.00 -4.88 0.00 -3.47 0.00 0.00 0.00 175.29 166.94 1vaz n ASP 9 N 17.46 -5.35 -4.85 12.60 -0.08 -1.26 -4.73 116.55 130.35 1vaz n ASP 9 Ca 0.43 0.54 -0.37 0.00 -1.51 0.00 0.00 54.79 53.87 1vaz n ASP 9 Cb 0.47 -3.27 -0.06 0.00 2.34 0.00 0.00 41.12 40.60 1vaz n ASP 9 CO 0.00 0.00 0.00 -0.69 0.12 0.00 0.00 177.20 176.63 1vaz s VAL 10 N -2.67 5.06 -0.04 5.18 1.01 -1.26 -5.02 120.40 122.67 1vaz s VAL 10 Ca 0.00 0.73 0.02 0.00 0.00 0.00 0.00 61.98 62.73 1vaz s VAL 10 Cb 0.00 -3.68 0.01 0.00 0.00 0.00 0.00 36.38 32.71 1vaz s VAL 10 CO 0.00 0.52 -0.10 -1.00 0.00 0.00 0.00 175.10 174.52 1vaz s HIS 11 N -1.15 1.07 0.26 5.22 3.76 -1.26 -2.82 115.29 120.37 1vaz s HIS 11 Ca 0.25 -0.30 -0.21 0.00 -0.15 0.00 0.00 55.06 54.65 1vaz s HIS 11 Cb -0.16 -0.78 0.03 0.00 1.11 0.00 0.00 32.58 32.78 1vaz s HIS 11 CO 0.14 -0.15 0.70 0.08 -0.85 0.00 0.00 174.74 174.66 1vaz s VAL 12 N 0.36 0.00 0.37 -0.90 1.01 -0.93 -5.03 120.40 115.29 1vaz s VAL 12 Ca -0.06 -0.84 -0.07 0.00 0.00 0.00 0.00 61.98 61.01 1vaz s VAL 12 Cb -0.11 -1.84 -0.05 0.00 0.00 0.00 0.00 36.38 34.38 1vaz s VAL 12 CO 0.01 -0.00 0.69 -0.69 0.00 0.00 0.00 175.10 175.11 1vaz s VAL 13 N -3.89 4.90 -0.10 2.92 1.01 -1.26 -0.16 120.40 123.83 1vaz s VAL 13 Ca 0.09 0.30 -0.07 0.00 0.00 0.00 0.00 61.98 62.31 1vaz s VAL 13 Cb -0.05 -3.76 0.03 0.00 0.00 0.00 0.00 36.38 32.60 1vaz s VAL 13 CO 0.04 -0.50 0.24 -0.22 0.00 0.00 0.00 175.10 174.66 1vaz s LEU 14 N -3.90 0.83 0.18 3.92 0.20 0.86 -2.73 118.68 118.04 1vaz s LEU 14 Ca 0.47 0.50 0.09 0.00 0.69 0.00 0.00 54.13 55.89 1vaz s LEU 14 Cb -0.10 0.78 -0.04 0.00 -0.43 0.00 0.00 46.19 46.40 1vaz s LEU 14 CO 0.33 -0.12 -0.20 -0.75 -0.29 0.00 0.00 176.35 175.33 1vaz s LYS 15 N 0.57 1.36 -0.23 1.98 2.20 -1.01 0.84 119.74 125.45 1vaz s LYS 15 Ca -0.04 -1.46 0.01 0.00 -0.36 0.00 0.00 55.97 54.12 1vaz s LYS 15 Cb -0.05 -1.49 0.06 0.00 -1.51 0.00 0.00 37.83 34.84 1vaz s LYS 15 CO -0.03 0.31 -0.05 -1.17 -0.36 0.00 0.00 175.35 174.04 1vaz s LEU 16 N -2.71 2.56 0.76 5.43 0.20 -1.18 0.45 118.68 124.19 1vaz s LEU 16 Ca 0.18 -1.17 -0.09 0.00 0.69 0.00 0.00 54.13 53.74 1vaz s LEU 16 Cb -0.06 -1.18 0.09 0.00 -0.43 0.00 0.00 46.19 44.61 1vaz s LEU 16 CO 0.08 -0.23 1.10 0.26 -0.29 0.00 0.00 176.35 177.26 1vaz s TRP 17 N 1.40 2.71 0.24 5.38 0.52 2.18 -4.49 118.94 126.88 1vaz s TRP 17 Ca -0.06 0.48 -0.08 0.00 0.02 0.00 0.00 56.10 56.46 1vaz s TRP 17 Cb -0.19 -3.38 0.38 0.00 -1.15 0.00 0.00 33.47 29.14 1vaz s TRP 17 CO -0.06 -1.67 1.39 1.17 0.02 0.00 0.00 176.95 177.80 1vaz n LYS 18 N -3.13 -0.10 -0.33 4.98 4.81 -0.98 -2.44 118.16 120.98 1vaz n LYS 18 Ca 0.09 1.39 0.03 0.00 -0.87 0.00 0.00 58.31 58.95 1vaz n LYS 18 Cb 0.61 -2.08 0.04 0.00 0.02 0.00 0.00 35.03 33.61 1vaz n LYS 18 CO 0.00 0.00 0.00 -2.37 1.17 0.00 0.00 177.40 176.20 1vaz n THR 19 N -5.44 0.52 -3.71 3.15 5.66 -1.23 -5.01 114.28 108.22 1vaz n THR 19 Ca 0.14 -0.61 -0.13 0.00 -3.05 0.00 0.00 64.05 60.39 1vaz n THR 19 Cb 0.43 0.35 -0.07 0.00 -1.55 0.00 0.00 70.33 69.49 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 -1.40 -0.21 0.09 1.09 0.00 -1.02 -2.82 107.32 103.04 1vaz s GLY 20 Ca 0.08 0.32 0.08 0.00 0.00 0.00 0.00 44.72 45.20 1vaz s GLY 20 CO 0.01 0.09 -0.20 -0.11 0.00 0.00 0.00 173.10 172.88 1vaz s PHE 21 N -1.94 1.73 0.53 1.90 -0.12 -0.74 0.55 117.98 119.89 1vaz s PHE 21 Ca -0.09 -0.41 0.07 0.00 -0.05 0.00 0.00 56.93 56.45 1vaz s PHE 21 Cb -0.02 -0.96 0.04 0.00 -0.63 0.00 0.00 43.02 41.44 1vaz s PHE 21 CO 0.01 0.17 0.51 0.45 -0.05 0.00 0.00 175.22 176.31 1vaz s SER 22 N -1.75 4.84 -0.30 1.98 0.15 0.17 -1.66 113.70 117.13 1vaz s SER 22 Ca 0.06 -1.04 -0.09 0.00 0.70 0.00 0.00 55.95 55.57 1vaz s SER 22 Cb -0.10 0.21 0.17 0.00 -1.71 0.00 0.00 66.02 64.59 1vaz s SER 22 CO 0.04 -1.09 0.80 -0.22 1.20 0.00 0.00 173.24 173.97 1vaz s LEU 23 N -4.36 -0.94 0.00 3.45 1.98 -1.26 -2.40 118.68 115.14 1vaz s LEU 23 Ca 0.44 0.90 0.00 0.00 -2.89 0.00 0.00 54.13 52.58 1vaz s LEU 23 Cb -0.03 1.91 0.00 0.00 0.66 0.00 0.00 46.19 48.73 1vaz s LEU 23 CO 0.27 -0.18 0.00 -0.67 -1.89 0.00 0.00 176.35 173.89 1vaz n ASP 24 N 5.33 0.00 0.00 3.68 2.03 -1.10 -3.21 116.55 123.28 1vaz n ASP 24 Ca -0.07 0.00 0.11 0.00 0.52 0.00 0.00 54.79 55.35 1vaz n ASP 24 Cb 0.51 0.00 0.04 0.00 -0.72 0.00 0.00 41.12 40.95 1vaz n ASP 24 CO 0.00 0.00 0.00 0.59 -1.92 0.00 0.00 177.20 175.87 1vaz n ASN 25 N 1.59 0.73 -4.40 1.67 3.02 -1.26 -4.96 115.26 111.65 1vaz n ASN 25 Ca 0.00 -0.56 -0.33 0.00 -0.03 0.00 0.00 54.58 53.66 1vaz n ASN 25 Cb 0.00 0.72 0.14 0.00 -0.61 0.00 0.00 39.78 40.03 1vaz n ASN 25 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1vaz n GLY 26 N 1.47 -2.05 0.00 7.41 0.00 -1.20 -4.96 105.19 105.86 1vaz n GLY 26 Ca 0.04 -0.77 0.00 0.00 0.00 0.00 0.00 46.02 45.29 1vaz n GLY 26 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1vaz n ASP 27 N -1.62 -1.37 -4.81 1.61 5.68 -1.26 -4.62 116.55 110.15 1vaz n ASP 27 Ca 0.05 -0.25 -0.35 0.00 -0.50 0.00 0.00 54.79 53.75 1vaz n ASP 27 Cb 0.55 0.00 -0.06 0.00 -1.14 0.00 0.00 41.12 40.47 1vaz n ASP 27 CO 0.00 0.00 0.00 -0.22 -1.33 0.00 0.00 177.20 175.65 1vaz s LEU 28 N 0.00 4.16 -0.08 -2.12 2.96 -1.26 -4.50 118.68 117.85 1vaz s LEU 28 Ca 0.00 1.59 0.00 0.00 -0.22 0.00 0.00 54.13 55.51 1vaz s LEU 28 Cb 0.00 -4.11 -0.03 0.00 0.50 0.00 0.00 46.19 42.55 1vaz s LEU 28 CO 0.00 -0.17 -0.06 -0.13 -1.32 0.00 0.00 176.35 174.67 1vaz s ARG 29 N -2.58 2.84 -0.27 1.98 0.52 -0.67 -4.99 118.95 115.79 1vaz s ARG 29 Ca 0.53 -0.53 -0.20 0.00 -0.52 0.00 0.00 55.73 55.01 1vaz s ARG 29 Cb -0.13 -2.63 -0.02 0.00 0.52 0.00 0.00 34.95 32.69 1vaz s ARG 29 CO 0.19 0.64 0.63 0.45 0.02 0.00 0.00 175.30 177.22 1vaz s SER 30 N -0.73 6.56 0.38 0.23 0.15 -1.26 -1.79 113.70 117.24 1vaz s SER 30 Ca 0.11 0.64 0.32 0.00 0.70 0.00 0.00 55.95 57.72 1vaz s SER 30 Cb -0.11 -2.33 1.23 0.00 -1.71 0.00 0.00 66.02 63.09 1vaz s SER 30 CO 0.02 -0.40 1.18 -1.22 1.20 0.00 0.00 173.24 174.02 1vaz n TYR 31 N 5.75 0.23 -0.02 3.44 4.01 -1.13 0.23 117.16 129.68 1vaz n TYR 31 Ca -0.01 0.24 -0.12 0.00 -0.16 0.00 0.00 57.90 57.85 1vaz n TYR 31 Cb 0.49 -0.62 0.01 0.00 -0.31 0.00 0.00 39.34 38.90 1vaz n TYR 31 CO 0.00 0.00 0.00 0.37 -0.46 0.00 0.00 176.86 176.77 1vaz h GLN 32 N 0.00 0.68 -5.57 -0.72 -0.00 -1.91 -3.44 115.11 104.16 1vaz h GLN 32 Ca 0.69 -0.46 -0.52 0.00 -0.00 0.00 0.00 58.65 58.37 1vaz h GLN 32 Cb 2.54 0.06 0.22 0.00 0.00 0.00 0.00 27.48 30.30 1vaz h GLN 32 CO -0.16 1.08 -1.67 -3.47 0.00 0.00 0.00 178.83 174.61 1vaz n ASP 33 N -3.96 -5.40 -0.03 -0.69 -0.08 0.63 -4.83 116.55 102.17 1vaz n ASP 33 Ca -0.04 0.21 -0.14 0.00 -1.51 0.00 0.00 54.79 53.31 1vaz n ASP 33 Cb 0.64 -0.71 -0.09 0.00 2.34 0.00 0.00 41.12 43.29 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 -0.83 0.20 -1.06 -0.67 0.13 -1.89 -2.98 132.00 124.90 1vaz h PRO 34 Ca -0.41 -0.13 0.31 0.00 -0.87 0.00 0.00 66.00 64.90 1vaz h PRO 34 Cb 1.22 0.02 -0.04 0.00 0.13 0.00 0.00 31.00 32.33 1vaz h PRO 34 CO 0.23 0.73 1.01 1.03 -0.23 0.00 0.00 178.00 180.78 1vaz h SER 35 N -0.31 0.00 0.00 1.44 0.87 -1.94 1.75 113.55 115.36 1vaz h SER 35 Ca -0.00 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 1vaz h SER 35 Cb 0.74 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.70 1vaz h SER 35 CO 0.03 0.00 0.00 0.59 -0.53 0.00 0.00 176.83 176.92 1vaz n ASN 36 N -3.60 0.36 0.31 6.23 5.03 -1.13 -2.29 115.26 120.17 1vaz n ASN 36 Ca 0.23 0.67 -0.17 0.00 0.87 0.00 0.00 54.58 56.18 1vaz n ASN 36 Cb 1.35 -0.71 -0.08 0.00 -1.02 0.00 0.00 39.78 39.31 1vaz n ASN 36 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1vaz h ALA 37 N 2.00 -0.84 0.00 5.41 0.00 0.25 1.11 119.26 127.19 1vaz h ALA 37 Ca 0.00 -0.17 -0.01 0.00 0.00 0.00 0.00 54.91 54.73 1vaz h ALA 37 Cb 0.00 0.40 -0.00 0.00 0.00 0.00 0.00 17.79 18.19 1vaz h ALA 37 CO 0.00 -0.98 -0.05 0.37 0.00 0.00 0.00 179.25 178.59 1vaz h GLN 38 N -0.83 0.00 0.09 0.00 5.75 -1.67 -2.57 115.11 115.88 1vaz h GLN 38 Ca -0.07 0.00 -0.00 0.00 -0.15 0.00 0.00 58.65 58.43 1vaz h GLN 38 Cb 0.67 0.00 0.00 0.00 1.07 0.00 0.00 27.48 29.22 1vaz h GLN 38 CO 0.07 0.05 -0.04 0.35 -2.65 0.00 0.00 178.83 176.61 1vaz h PHE 39 N 0.00 -0.11 -0.99 3.99 3.04 -0.96 0.16 116.94 122.07 1vaz h PHE 39 Ca -0.00 -0.00 0.18 0.00 3.98 0.00 0.00 57.97 62.12 1vaz h PHE 39 Cb 0.89 0.04 -0.10 0.00 2.56 0.00 0.00 35.95 39.34 1vaz h PHE 39 CO 0.00 -0.07 0.62 1.25 -2.02 0.00 0.00 178.31 178.09 1vaz h LEU 40 N -0.34 0.78 -0.01 0.59 5.85 0.11 2.16 115.31 124.45 1vaz h LEU 40 Ca -0.01 0.08 -0.02 0.00 0.84 0.00 0.00 57.88 58.77 1vaz h LEU 40 Cb 0.09 -0.06 0.00 0.00 0.37 0.00 0.00 40.66 41.06 1vaz h LEU 40 CO 0.02 0.32 -0.06 1.05 -0.34 0.00 0.00 178.44 179.42 1vaz h GLU 41 N 0.78 0.07 0.03 1.25 4.11 -1.55 -2.39 114.58 116.88 1vaz h GLU 41 Ca 0.55 -0.06 -0.00 0.00 0.07 0.00 0.00 59.36 59.92 1vaz h GLU 41 Cb 0.83 0.01 0.00 0.00 0.50 0.00 0.00 28.75 30.09 1vaz h GLU 41 CO -0.33 0.71 -0.01 1.03 0.07 0.00 0.00 179.01 180.47 1vaz h SER 42 N -0.55 -0.03 -0.79 3.06 0.87 0.11 -2.77 113.55 113.45 1vaz h SER 42 Ca -0.00 -0.65 0.14 0.00 -1.23 0.00 0.00 61.79 60.05 1vaz h SER 42 Cb 0.72 0.01 -0.09 0.00 -0.44 0.00 0.00 62.40 62.60 1vaz h SER 42 CO 0.01 0.66 0.36 0.40 -0.53 0.00 0.00 176.83 177.74 1vaz h ILE 43 N -0.77 0.70 0.01 2.23 1.08 1.37 1.40 117.51 123.53 1vaz h ILE 43 Ca -0.00 -0.18 0.01 0.00 -0.39 0.00 0.00 64.86 64.30 1vaz h ILE 43 Cb 0.68 0.13 -0.02 0.00 -3.07 0.00 0.00 36.82 34.54 1vaz h ILE 43 CO 0.01 0.10 -0.07 0.03 -0.69 0.00 0.00 178.15 177.52 1vaz h ARG 44 N 0.53 -0.13 0.00 2.37 3.08 -1.47 0.27 114.38 119.03 1vaz h ARG 44 Ca 0.43 0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.49 1vaz h ARG 44 Cb 0.62 0.03 0.00 0.00 0.08 0.00 0.00 29.97 30.70 1vaz h ARG 44 CO -0.38 -0.09 0.00 0.54 -1.07 0.00 0.00 179.97 178.98 1vaz n ARG 45 N -5.19 0.12 0.00 0.04 5.12 -0.25 -4.83 116.66 111.67 1vaz n ARG 45 Ca -0.06 0.37 0.00 0.00 -1.93 0.00 0.00 57.85 56.23 1vaz n ARG 45 Cb 0.12 -1.74 0.00 0.00 -1.16 0.00 0.00 32.46 29.68 1vaz n ARG 45 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1vaz n GLY 46 N -0.05 0.82 3.25 -0.13 0.00 0.20 -5.08 105.19 104.19 1vaz n GLY 46 Ca 0.02 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.92 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 0.35 0.41 0.11 1.61 2.02 0.42 -4.50 118.70 119.12 1vaz s GLU 47 Ca 0.00 0.55 -0.18 0.00 0.02 0.00 0.00 54.97 55.35 1vaz s GLU 47 Cb 0.00 0.16 -0.07 0.00 0.10 0.00 0.00 34.13 34.32 1vaz s GLU 47 CO 0.00 -0.07 0.58 0.54 0.02 0.00 0.00 175.26 176.33 1vaz s VAL 48 N 0.42 4.74 0.00 2.63 0.11 -1.18 0.17 120.40 127.28 1vaz s VAL 48 Ca -0.02 1.14 0.00 0.00 -2.93 0.00 0.00 61.98 60.17 1vaz s VAL 48 Cb -0.04 -3.86 0.00 0.00 -1.53 0.00 0.00 36.38 30.95 1vaz s VAL 48 CO -0.02 0.45 0.30 -0.81 -3.33 0.00 0.00 175.10 171.69 1vaz n PRO 49 N 1.40 0.00 -0.30 1.54 -0.04 -1.26 -1.36 135.00 134.98 1vaz n PRO 49 Ca -0.08 0.18 0.23 0.00 -0.04 0.00 0.00 63.50 63.79 1vaz n PRO 49 Cb 0.51 -0.90 0.43 0.00 -0.04 0.00 0.00 33.50 33.50 1vaz n PRO 49 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1vaz n ALA 50 N -1.04 0.75 0.19 0.55 0.00 -1.26 0.50 120.51 120.20 1vaz n ALA 50 Ca 0.00 0.95 -0.13 0.00 0.00 0.00 0.00 53.44 54.26 1vaz n ALA 50 Cb 0.00 -0.84 -0.07 0.00 0.00 0.00 0.00 19.45 18.53 1vaz n ALA 50 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 1vaz h GLU 51 N 0.00 -0.51 -0.20 0.00 4.39 -1.98 -1.87 114.58 114.40 1vaz h GLU 51 Ca 0.69 0.03 0.06 0.00 0.34 0.00 0.00 59.36 60.48 1vaz h GLU 51 Cb 1.69 0.12 -0.01 0.00 -0.10 0.00 0.00 28.75 30.44 1vaz h GLU 51 CO -0.76 -0.19 0.23 1.37 -1.16 0.00 0.00 179.01 178.50 1vaz h LEU 52 N -0.92 0.00 -0.75 1.33 8.10 0.98 0.70 115.31 124.75 1vaz h LEU 52 Ca -0.05 0.00 -0.12 0.00 0.11 0.00 0.00 57.88 57.82 1vaz h LEU 52 Cb 0.55 0.00 -0.02 0.00 -0.44 0.00 0.00 40.66 40.75 1vaz h LEU 52 CO 0.09 0.00 -0.55 0.03 -4.11 0.00 0.00 178.44 173.90 1vaz h ARG 53 N 0.00 0.00 0.49 0.17 3.08 0.40 4.29 114.38 122.81 1vaz h ARG 53 Ca 0.10 0.00 -0.02 0.00 0.07 0.00 0.00 59.98 60.12 1vaz h ARG 53 Cb 0.56 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.62 1vaz h ARG 53 CO -0.00 0.55 -0.23 0.00 -1.07 0.00 0.00 179.97 179.21 1vaz h ARG 54 N 0.00 -0.63 0.00 0.04 3.08 0.12 -3.34 114.38 113.65 1vaz h ARG 54 Ca -0.01 0.04 -0.30 0.00 0.07 0.00 0.00 59.98 59.79 1vaz h ARG 54 Cb 1.07 0.14 -0.04 0.00 0.08 0.00 0.00 29.97 31.22 1vaz h ARG 54 CO 0.07 -0.42 -1.96 1.28 -1.07 0.00 0.00 179.97 177.87 1vaz n LEU 55 N -4.75 1.79 -0.18 3.04 4.77 -1.03 -4.61 117.00 116.01 1vaz n LEU 55 Ca -0.08 0.31 -0.01 0.00 -0.03 0.00 0.00 56.01 56.20 1vaz n LEU 55 Cb 0.26 -0.72 0.07 0.00 -2.33 0.00 0.00 43.42 40.69 1vaz n LEU 55 CO 0.20 0.27 0.80 0.00 -1.33 0.00 0.00 177.39 177.33 1vaz h ALA 56 N -0.90 0.47 -5.42 -1.18 0.00 -0.87 -3.46 119.26 107.90 1vaz h ALA 56 Ca -0.45 0.19 -0.34 0.00 0.00 0.00 0.00 54.91 54.32 1vaz h ALA 56 Cb 1.36 0.36 0.14 0.00 0.00 0.00 0.00 17.79 19.65 1vaz h ALA 56 CO -0.27 -0.41 -0.67 0.72 0.00 0.00 0.00 179.25 178.62 1vaz n HIS 57 N -5.32 -2.37 0.00 0.00 8.25 1.39 -4.59 115.22 112.57 1vaz n HIS 57 Ca 0.07 0.91 0.00 0.00 -0.26 0.00 0.00 57.72 58.43 1vaz n HIS 57 Cb 0.31 -4.78 0.00 0.00 1.12 0.00 0.00 29.99 26.64 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 -1.54 0.28 0.00 -1.41 0.00 -1.25 -5.02 105.19 96.25 1vaz n GLY 58 Ca -0.12 -0.02 0.00 0.00 0.00 0.00 0.00 46.02 45.88 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 -0.20 2.89 -0.02 0.00 -1.26 -5.01 105.19 101.58 1vaz n GLY 59 Ca 0.00 -0.28 -0.12 0.00 0.00 0.00 0.00 46.02 45.62 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 0.66 -0.00 1.61 -0.21 -1.26 -4.95 119.66 115.51 1vaz s GLN 60 Ca 0.00 -0.62 -0.17 0.00 0.02 0.00 0.00 55.36 54.59 1vaz s GLN 60 Cb 0.00 -0.48 0.03 0.00 1.00 0.00 0.00 33.01 33.56 1vaz s GLN 60 CO 0.00 -1.18 0.36 0.08 -2.12 0.00 0.00 175.29 172.43 1vaz s VAL 61 N 1.64 0.06 -0.20 1.09 1.01 -1.26 -4.43 120.40 118.31 1vaz s VAL 61 Ca 0.16 -0.46 -0.20 0.00 0.00 0.00 0.00 61.98 61.48 1vaz s VAL 61 Cb -0.12 -0.75 -0.03 0.00 0.00 0.00 0.00 36.38 35.49 1vaz s VAL 61 CO -0.07 -0.25 0.60 0.20 0.00 0.00 0.00 175.10 175.58 1vaz s ASN 62 N -1.51 6.65 0.11 3.32 0.01 -1.13 -3.13 114.94 119.27 1vaz s ASN 62 Ca -0.11 0.79 0.09 0.00 -0.71 0.00 0.00 52.86 52.92 1vaz s ASN 62 Cb -0.03 -2.33 -0.04 0.00 0.41 0.00 0.00 41.25 39.25 1vaz s ASN 62 CO 0.03 -0.24 -0.21 -1.48 -1.51 0.00 0.00 177.10 173.69 1vaz s LEU 63 N 1.80 2.54 -0.45 0.60 2.34 -1.26 -2.19 118.68 122.07 1vaz s LEU 63 Ca 0.27 -0.60 -0.21 0.00 0.06 0.00 0.00 54.13 53.66 1vaz s LEU 63 Cb -0.16 -1.43 0.03 0.00 -0.56 0.00 0.00 46.19 44.07 1vaz s LEU 63 CO 0.10 0.19 0.65 -1.81 -1.06 0.00 0.00 176.35 174.42 1vaz s ASP 64 N -1.98 6.30 -0.02 1.48 1.01 0.78 -4.76 116.67 119.49 1vaz s ASP 64 Ca 0.16 -0.44 -0.30 0.00 0.71 0.00 0.00 52.55 52.68 1vaz s ASP 64 Cb -0.10 -2.32 -0.03 0.00 1.01 0.00 0.00 42.92 41.47 1vaz s ASP 64 CO 0.08 -0.81 1.10 -0.32 0.21 0.00 0.00 175.17 175.43 1vaz s MET 65 N 2.82 4.45 -0.21 8.23 1.75 -1.21 0.30 119.30 135.42 1vaz s MET 65 Ca 0.21 1.58 -0.07 0.00 -1.25 0.00 0.00 55.69 56.16 1vaz s MET 65 Cb -0.15 -3.47 -0.03 0.00 2.84 0.00 0.00 34.83 34.02 1vaz s MET 65 CO 0.18 -0.26 0.05 -1.21 -0.65 0.00 0.00 175.02 173.13 1vaz s GLU 66 N 1.52 3.77 -0.56 4.11 8.01 0.25 -4.91 118.70 130.88 1vaz s GLU 66 Ca 0.54 -0.44 -0.18 0.00 0.01 0.00 0.00 54.97 54.90 1vaz s GLU 66 Cb -0.24 -3.22 0.10 0.00 -4.31 0.00 0.00 34.13 26.46 1vaz s GLU 66 CO 0.25 0.03 0.64 -0.51 0.01 0.00 0.00 175.26 175.68 1vaz s ASP 67 N 1.00 6.19 -0.32 -0.19 1.11 -1.26 -3.13 116.67 120.07 1vaz s ASP 67 Ca 0.03 -1.41 0.18 0.00 0.18 0.00 0.00 52.55 51.54 1vaz s ASP 67 Cb -0.14 -2.28 0.47 0.00 1.07 0.00 0.00 42.92 42.04 1vaz s ASP 67 CO 0.03 -1.00 0.99 1.41 1.18 0.00 0.00 175.17 177.78 1vaz n HIS 68 N 6.04 1.34 -0.05 4.23 8.25 -1.26 -4.90 115.22 128.87 1vaz n HIS 68 Ca -0.10 -2.68 -0.10 0.00 -0.26 0.00 0.00 57.72 54.58 1vaz n HIS 68 Cb 0.43 -0.33 0.05 0.00 1.12 0.00 0.00 29.99 31.25 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 2.89 0.72 0.00 -0.41 2.47 -1.89 0.41 114.38 118.57 1vaz h ARG 69 Ca -0.07 -0.38 0.00 0.00 -1.26 0.00 0.00 59.98 58.26 1vaz h ARG 69 Cb 1.19 0.01 0.00 0.00 -1.65 0.00 0.00 29.97 29.52 1vaz h ARG 69 CO 0.47 1.00 0.00 -0.25 0.56 0.00 0.00 179.97 181.75 1vaz n ASP 70 N -4.03 0.00 -2.06 7.04 8.00 -1.26 -3.12 116.55 121.12 1vaz n ASP 70 Ca -0.02 0.22 -0.02 0.00 0.71 0.00 0.00 54.79 55.68 1vaz n ASP 70 Cb 0.54 -0.33 0.04 0.00 -0.02 0.00 0.00 41.12 41.35 1vaz n ASP 70 CO 0.00 0.00 0.00 -1.84 -0.39 0.00 0.00 177.20 174.97 1vaz n GLU 71 N -1.33 0.84 -3.84 -1.24 0.28 -0.87 -5.13 120.64 109.35 1vaz n GLU 71 Ca 0.04 -1.79 -0.26 0.00 -0.16 0.00 0.00 57.16 54.99 1vaz n GLU 71 Cb 0.09 -0.07 0.00 0.00 1.43 0.00 0.00 31.44 32.89 1vaz n GLU 71 CO 0.00 0.00 0.00 -0.51 -0.16 0.00 0.00 177.13 176.46 1vaz s ASP 72 N -1.83 4.64 -0.34 -1.84 1.11 0.14 -5.00 116.67 113.55 1vaz s ASP 72 Ca 0.15 -1.26 -0.35 0.00 0.18 0.00 0.00 52.55 51.27 1vaz s ASP 72 Cb 0.29 0.51 -0.11 0.00 1.07 0.00 0.00 42.92 44.67 1vaz s ASP 72 CO -0.08 -1.17 2.18 0.33 1.18 0.00 0.00 175.17 177.61 1vaz n PHE 73 N -1.83 1.63 -1.30 4.23 -0.00 -1.26 -4.55 117.46 114.37 1vaz n PHE 73 Ca -0.01 0.26 -0.24 0.00 -0.00 0.00 0.00 57.45 57.47 1vaz n PHE 73 Cb 0.64 -2.54 0.18 0.00 -0.00 0.00 0.00 39.48 37.77 1vaz n PHE 73 CO 0.00 0.00 0.00 0.28 -0.00 0.00 0.00 176.76 177.04 1vaz n VAL 74 N 7.15 0.00 -0.35 -2.13 0.31 -1.26 -2.31 118.33 119.74 1vaz n VAL 74 Ca 0.40 -0.57 -0.07 0.00 -0.01 0.00 0.00 64.34 64.10 1vaz n VAL 74 Cb 0.24 -1.38 -0.04 0.00 -0.91 0.00 0.00 33.84 31.75 1vaz n VAL 74 CO 0.00 0.00 0.00 0.11 -1.32 0.00 0.00 176.83 175.62 1vaz h LYS 75 N 0.00 -0.07 0.00 5.55 1.57 -1.95 -3.44 116.57 118.24 1vaz h LYS 75 Ca -0.34 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.45 1vaz h LYS 75 Cb 0.98 0.02 0.00 0.00 0.08 0.00 0.00 32.23 33.30 1vaz h LYS 75 CO 0.23 -0.04 0.00 -0.35 -0.57 0.00 0.00 179.45 178.71