#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1vaz s ARG 2 N 0.00 3.77 0.00 5.31 1.81 -1.26 -4.99 118.95 123.58 1vaz s ARG 2 Ca 0.00 0.49 0.00 0.00 -1.72 0.00 0.00 55.73 54.50 1vaz s ARG 2 Cb 0.00 -3.84 0.00 0.00 -0.45 0.00 0.00 34.95 30.66 1vaz s ARG 2 CO 0.00 -1.05 0.00 2.89 -0.68 0.00 0.00 175.30 176.46 1vaz n ARG 3 N 6.96 1.04 -0.30 3.54 0.00 -1.26 -5.01 116.66 121.63 1vaz n ARG 3 Ca 0.07 0.00 0.13 0.00 -0.00 0.00 0.00 57.85 58.06 1vaz n ARG 3 Cb 0.48 0.00 0.29 0.00 -0.00 0.00 0.00 32.46 33.23 1vaz n ARG 3 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1vaz h ARG 4 N 0.00 0.19 -6.35 2.89 -0.00 -2.05 -3.45 114.38 105.61 1vaz h ARG 4 Ca 0.00 -0.01 -0.46 0.00 -0.50 0.00 0.00 59.98 59.00 1vaz h ARG 4 Cb 0.00 -0.04 0.02 0.00 0.00 0.00 0.00 29.97 29.95 1vaz h ARG 4 CO 0.00 0.12 -0.91 1.58 0.00 0.00 0.00 179.97 180.76 1vaz n HIS 5 N -5.24 -1.78 0.00 3.04 -0.00 -1.26 -3.15 115.22 106.83 1vaz n HIS 5 Ca 0.22 0.59 0.00 0.00 0.46 0.00 0.00 57.72 58.99 1vaz n HIS 5 Cb 0.70 -3.62 0.00 0.00 -0.12 0.00 0.00 29.99 26.94 1vaz n HIS 5 CO 0.00 0.00 0.00 0.45 0.46 0.00 0.00 176.34 177.25 1vaz n SER 6 N -2.82 0.00 0.00 0.26 2.88 -1.26 -4.84 113.62 107.84 1vaz n SER 6 Ca -0.20 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.34 1vaz n SER 6 Cb 0.64 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.10 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 0.00 0.33 3.76 0.46 0.00 -1.19 -4.49 105.19 104.07 1vaz n GLY 7 Ca 0.00 0.63 -0.24 0.00 0.00 0.00 0.00 46.02 46.41 1vaz n GLY 7 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1vaz s GLN 8 N 0.00 2.72 -0.29 1.61 1.11 -1.26 -5.00 119.66 118.55 1vaz s GLN 8 Ca 0.00 -1.08 0.05 0.00 0.01 0.00 0.00 55.36 54.34 1vaz s GLN 8 Cb 0.00 -2.48 0.54 0.00 -1.01 0.00 0.00 33.01 30.07 1vaz s GLN 8 CO 0.00 0.42 1.62 -0.25 0.01 0.00 0.00 175.29 177.09 1vaz n ASP 9 N -0.75 3.90 -3.47 5.90 8.00 -1.26 -4.68 116.55 124.20 1vaz n ASP 9 Ca -0.08 -3.05 -0.25 0.00 0.71 0.00 0.00 54.79 52.12 1vaz n ASP 9 Cb 0.57 -0.72 -0.12 0.00 -0.02 0.00 0.00 41.12 40.83 1vaz n ASP 9 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 1vaz s VAL 10 N -2.44 -0.14 0.03 2.53 0.11 -1.26 -4.88 120.40 114.34 1vaz s VAL 10 Ca 0.43 -0.92 0.04 0.00 -2.93 0.00 0.00 61.98 58.60 1vaz s VAL 10 Cb 0.35 -0.97 -0.02 0.00 -1.53 0.00 0.00 36.38 34.21 1vaz s VAL 10 CO 0.10 -0.70 -0.11 -2.28 -3.33 0.00 0.00 175.10 168.78 1vaz s HIS 11 N 1.87 0.95 -0.12 1.54 5.65 -1.26 -2.78 115.29 121.14 1vaz s HIS 11 Ca 0.12 -0.34 -0.29 0.00 0.25 0.00 0.00 55.06 54.80 1vaz s HIS 11 Cb -0.17 -0.57 0.07 0.00 -1.18 0.00 0.00 32.58 30.73 1vaz s HIS 11 CO -0.24 -0.00 0.69 0.14 -0.65 0.00 0.00 174.74 174.68 1vaz s VAL 12 N -0.83 0.00 -0.19 0.89 -7.23 -1.15 -5.02 120.40 106.86 1vaz s VAL 12 Ca -0.01 0.00 -0.18 0.00 -1.81 0.00 0.00 61.98 59.98 1vaz s VAL 12 Cb -0.07 -1.00 -0.03 0.00 0.56 0.00 0.00 36.38 35.83 1vaz s VAL 12 CO 0.01 0.00 0.51 -0.69 -0.31 0.00 0.00 175.10 174.62 1vaz s VAL 13 N -0.73 5.12 -0.38 1.32 1.01 -1.26 -2.79 120.40 122.69 1vaz s VAL 13 Ca -0.08 0.95 -0.17 0.00 0.00 0.00 0.00 61.98 62.68 1vaz s VAL 13 Cb -0.01 -3.84 0.00 0.00 0.00 0.00 0.00 36.38 32.53 1vaz s VAL 13 CO 0.07 0.20 0.46 -0.22 0.00 0.00 0.00 175.10 175.61 1vaz s LEU 14 N 1.50 4.56 0.20 3.92 0.20 0.86 -4.33 118.68 125.58 1vaz s LEU 14 Ca 0.24 -0.33 0.08 0.00 0.69 0.00 0.00 54.13 54.81 1vaz s LEU 14 Cb -0.15 -2.46 -0.04 0.00 -0.43 0.00 0.00 46.19 43.10 1vaz s LEU 14 CO 0.10 -0.50 -0.00 -0.75 -0.29 0.00 0.00 176.35 174.90 1vaz s LYS 15 N 2.24 2.36 -0.09 1.98 2.20 -1.05 0.21 119.74 127.58 1vaz s LYS 15 Ca 0.15 -1.20 -0.01 0.00 -0.36 0.00 0.00 55.97 54.55 1vaz s LYS 15 Cb -0.16 -2.30 0.03 0.00 -1.51 0.00 0.00 37.83 33.89 1vaz s LYS 15 CO 0.13 0.43 -0.04 -0.51 -0.36 0.00 0.00 175.35 175.00 1vaz s LEU 16 N -3.14 0.96 0.00 5.43 1.02 -1.15 -1.40 118.68 120.40 1vaz s LEU 16 Ca 0.28 -0.19 0.01 0.00 0.02 0.00 0.00 54.13 54.25 1vaz s LEU 16 Cb -0.08 -0.63 0.08 0.00 0.02 0.00 0.00 46.19 45.57 1vaz s LEU 16 CO 0.19 -0.14 0.57 0.79 0.02 0.00 0.00 176.35 177.78 1vaz n TRP 17 N 4.91 -3.04 -0.27 0.29 7.02 1.36 -4.47 117.44 123.23 1vaz n TRP 17 Ca -0.12 -1.07 0.28 0.00 -1.02 0.00 0.00 57.50 55.58 1vaz n TRP 17 Cb 0.50 -0.42 0.44 0.00 -2.42 0.00 0.00 31.31 29.41 1vaz n TRP 17 CO 0.00 0.00 0.00 1.17 -2.02 0.00 0.00 177.69 176.84 1vaz n LYS 18 N -2.04 0.01 -0.66 -0.99 4.81 -1.26 -2.64 118.16 115.39 1vaz n LYS 18 Ca 0.10 0.89 -0.03 0.00 -0.87 0.00 0.00 58.31 58.40 1vaz n LYS 18 Cb 0.35 -2.18 -0.03 0.00 0.02 0.00 0.00 35.03 33.19 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 -3.10 0.00 -3.72 3.15 5.66 -1.26 -5.14 114.28 109.87 1vaz n THR 19 Ca 0.24 0.00 -0.13 0.00 -3.05 0.00 0.00 64.05 61.11 1vaz n THR 19 Cb 1.40 0.19 -0.07 0.00 -1.55 0.00 0.00 70.33 70.30 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 -0.38 -0.19 -0.09 1.09 0.00 -1.08 -2.96 107.32 103.70 1vaz s GLY 20 Ca 0.00 0.23 0.04 0.00 0.00 0.00 0.00 44.72 44.99 1vaz s GLY 20 CO 0.00 -0.00 -0.22 -0.11 0.00 0.00 0.00 173.10 172.77 1vaz s PHE 21 N -2.18 2.59 0.53 1.90 -0.12 -0.63 0.41 117.98 120.48 1vaz s PHE 21 Ca -0.07 -0.86 0.07 0.00 -0.05 0.00 0.00 56.93 56.02 1vaz s PHE 21 Cb -0.02 -1.71 0.04 0.00 -0.63 0.00 0.00 43.02 40.71 1vaz s PHE 21 CO -0.01 -0.31 0.52 -1.12 -0.05 0.00 0.00 175.22 174.26 1vaz s SER 22 N 0.18 4.85 -0.30 1.98 0.01 -0.49 -1.08 113.70 118.86 1vaz s SER 22 Ca -0.13 -1.04 -0.16 0.00 1.31 0.00 0.00 55.95 55.94 1vaz s SER 22 Cb -0.16 0.22 0.17 0.00 0.21 0.00 0.00 66.02 66.45 1vaz s SER 22 CO 0.07 -1.11 1.05 -0.22 0.41 0.00 0.00 173.24 173.44 1vaz s LEU 23 N -4.38 -0.43 0.42 2.44 0.20 -1.26 -2.54 118.68 113.13 1vaz s LEU 23 Ca 0.45 0.63 0.00 0.00 0.69 0.00 0.00 54.13 55.90 1vaz s LEU 23 Cb -0.04 1.55 0.00 0.00 -0.43 0.00 0.00 46.19 47.28 1vaz s LEU 23 CO 0.28 -0.09 0.00 0.47 -0.29 0.00 0.00 176.35 176.71 1vaz n ASP 24 N 4.15 -8.21 0.20 3.68 9.92 -1.26 -3.37 116.55 121.66 1vaz n ASP 24 Ca -0.14 0.84 0.17 0.00 -0.53 0.00 0.00 54.79 55.14 1vaz n ASP 24 Cb 0.55 -4.43 0.73 0.00 -0.64 0.00 0.00 41.12 37.34 1vaz n ASP 24 CO 0.00 0.00 0.00 -0.55 0.13 0.00 0.00 177.20 176.78 1vaz h ASN 25 N -1.35 0.00 -1.96 -2.24 -1.07 -2.01 -3.43 115.58 103.52 1vaz h ASN 25 Ca -0.05 0.00 -0.54 0.00 0.07 0.00 0.00 56.30 55.79 1vaz h ASN 25 Cb 1.35 0.00 0.24 0.00 -2.07 0.00 0.00 38.32 37.84 1vaz h ASN 25 CO 0.03 0.00 -1.89 0.61 0.07 0.00 0.00 177.43 176.26 1vaz n GLY 26 N -1.37 -4.14 3.63 9.14 0.00 -1.22 -4.88 105.19 106.34 1vaz n GLY 26 Ca 0.03 -0.68 -0.29 0.00 0.00 0.00 0.00 46.02 45.08 1vaz n GLY 26 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1vaz s ASP 27 N -1.10 2.22 0.74 1.61 1.01 -1.26 -4.65 116.67 115.25 1vaz s ASP 27 Ca 0.41 1.29 -0.11 0.00 0.71 0.00 0.00 52.55 54.85 1vaz s ASP 27 Cb -0.13 -1.99 0.04 0.00 1.01 0.00 0.00 42.92 41.85 1vaz s ASP 27 CO 0.79 -3.40 1.09 -0.22 0.21 0.00 0.00 175.17 173.64 1vaz s LEU 28 N -6.65 3.11 -0.04 1.23 2.96 -1.26 -4.50 118.68 113.53 1vaz s LEU 28 Ca 0.66 1.85 0.02 0.00 -0.22 0.00 0.00 54.13 56.44 1vaz s LEU 28 Cb -0.20 -4.53 -0.03 0.00 0.50 0.00 0.00 46.19 41.93 1vaz s LEU 28 CO 0.59 -1.92 -0.07 -0.60 -1.32 0.00 0.00 176.35 173.03 1vaz s ARG 29 N -4.74 2.68 -0.16 1.98 3.52 -0.24 -4.95 118.95 117.04 1vaz s ARG 29 Ca 0.62 -0.61 -0.18 0.00 -0.13 0.00 0.00 55.73 55.44 1vaz s ARG 29 Cb -0.18 -2.56 -0.04 0.00 -1.56 0.00 0.00 34.95 30.62 1vaz s ARG 29 CO 0.53 0.64 0.48 0.45 -0.81 0.00 0.00 175.30 176.59 1vaz s SER 30 N -1.01 6.60 0.66 -2.12 0.15 -1.26 -1.61 113.70 115.11 1vaz s SER 30 Ca 0.14 0.72 0.15 0.00 0.70 0.00 0.00 55.95 57.66 1vaz s SER 30 Cb -0.11 -2.28 0.80 0.00 -1.71 0.00 0.00 66.02 62.73 1vaz s SER 30 CO 0.03 -0.07 1.44 1.88 1.20 0.00 0.00 173.24 177.73 1vaz h TYR 31 N 7.05 0.00 -0.03 3.44 -1.99 -1.89 1.07 116.97 124.62 1vaz h TYR 31 Ca -0.38 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.35 1vaz h TYR 31 Cb 1.17 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.90 1vaz h TYR 31 CO 0.65 0.00 0.00 0.94 -0.00 0.00 0.00 178.16 179.75 1vaz n GLN 32 N -2.77 0.29 -0.04 4.88 0.00 -1.26 -4.95 117.38 113.52 1vaz n GLN 32 Ca 0.01 -1.00 -0.02 0.00 -0.00 0.00 0.00 57.00 55.99 1vaz n GLN 32 Cb 0.76 -1.13 0.02 0.00 0.00 0.00 0.00 30.24 29.90 1vaz n GLN 32 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.06 173.59 1vaz n ASP 33 N 0.32 -1.66 -0.04 1.69 2.03 0.37 -4.97 116.55 114.29 1vaz n ASP 33 Ca 0.04 -0.29 -0.01 0.00 0.52 0.00 0.00 54.79 55.06 1vaz n ASP 33 Cb 0.18 -0.07 -0.00 0.00 -0.72 0.00 0.00 41.12 40.51 1vaz n ASP 33 CO 0.00 0.00 0.00 1.55 -1.92 0.00 0.00 177.20 176.83 1vaz h PRO 34 N 0.00 0.00 -0.89 -0.67 0.13 -1.96 -3.34 132.00 125.27 1vaz h PRO 34 Ca -0.03 0.00 0.26 0.00 -0.87 0.00 0.00 66.00 65.36 1vaz h PRO 34 Cb 0.09 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 31.19 1vaz h PRO 34 CO 0.02 0.00 0.98 1.03 -0.23 0.00 0.00 178.00 179.80 1vaz h SER 35 N -0.62 0.00 0.18 1.44 0.87 -1.94 1.30 113.55 114.78 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 0.11 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.07 1vaz h SER 35 CO 0.00 0.00 0.00 -0.46 -0.53 0.00 0.00 176.83 175.84 1vaz n ASN 36 N -3.43 0.00 0.32 6.23 0.23 -1.25 -2.54 115.26 114.82 1vaz n ASN 36 Ca 0.19 0.35 -0.17 0.00 -0.53 0.00 0.00 54.58 54.42 1vaz n ASN 36 Cb 1.27 -0.39 -0.09 0.00 -2.08 0.00 0.00 39.78 38.49 1vaz n ASN 36 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1vaz h ALA 37 N 2.28 -0.86 0.05 -2.53 0.00 0.15 0.75 119.26 119.10 1vaz h ALA 37 Ca 0.00 -0.17 -0.25 0.00 0.00 0.00 0.00 54.91 54.48 1vaz h ALA 37 Cb 0.09 0.40 -0.02 0.00 0.00 0.00 0.00 17.79 18.25 1vaz h ALA 37 CO 0.00 -0.99 -1.26 0.37 0.00 0.00 0.00 179.25 177.37 1vaz h GLN 38 N -0.85 0.11 0.37 0.00 5.75 -1.75 -2.55 115.11 116.19 1vaz h GLN 38 Ca -0.07 -0.18 -0.02 0.00 -0.15 0.00 0.00 58.65 58.23 1vaz h GLN 38 Cb 0.68 0.07 0.00 0.00 1.07 0.00 0.00 27.48 29.30 1vaz h GLN 38 CO 0.09 1.00 -0.18 0.35 -2.65 0.00 0.00 178.83 177.44 1vaz h PHE 39 N 0.03 -0.47 -0.31 3.99 3.04 -1.41 0.15 116.94 121.96 1vaz h PHE 39 Ca -0.12 -0.01 -0.06 0.00 3.98 0.00 0.00 57.97 61.75 1vaz h PHE 39 Cb 1.90 0.15 -0.01 0.00 2.56 0.00 0.00 35.95 40.55 1vaz h PHE 39 CO 0.03 -0.14 -0.06 1.25 -2.02 0.00 0.00 178.31 177.37 1vaz h LEU 40 N -0.85 0.58 0.03 0.59 5.85 0.39 -1.64 115.31 120.27 1vaz h LEU 40 Ca -0.05 -0.36 -0.00 0.00 0.84 0.00 0.00 57.88 58.31 1vaz h LEU 40 Cb 0.54 -0.16 0.00 0.00 0.37 0.00 0.00 40.66 41.41 1vaz h LEU 40 CO 0.08 0.80 -0.02 1.05 -0.34 0.00 0.00 178.44 180.02 1vaz h GLU 41 N 0.36 -0.04 0.50 1.25 4.11 -1.49 -2.15 114.58 117.11 1vaz h GLU 41 Ca 0.08 0.00 -0.02 0.00 0.07 0.00 0.00 59.36 59.49 1vaz h GLU 41 Cb 0.54 0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.81 1vaz h GLU 41 CO 0.03 0.63 -0.24 0.77 0.07 0.00 0.00 179.01 180.27 1vaz h SER 42 N -0.85 -0.57 -0.93 3.06 0.02 -0.82 -1.33 113.55 112.14 1vaz h SER 42 Ca -0.00 -0.04 0.15 0.00 -0.84 0.00 0.00 61.79 61.05 1vaz h SER 42 Cb 0.70 0.15 -0.09 0.00 0.14 0.00 0.00 62.40 63.29 1vaz h SER 42 CO 0.01 -0.31 0.54 0.40 -1.14 0.00 0.00 176.83 176.33 1vaz h ILE 43 N -0.80 0.79 0.00 3.27 2.04 -0.93 1.06 117.51 122.95 1vaz h ILE 43 Ca -0.07 -0.27 -0.00 0.00 1.00 0.00 0.00 64.86 65.52 1vaz h ILE 43 Cb 0.57 -0.06 -0.00 0.00 -0.74 0.00 0.00 36.82 36.59 1vaz h ILE 43 CO 0.11 0.14 -0.02 0.03 0.00 0.00 0.00 178.15 178.42 1vaz h ARG 44 N 0.78 0.00 0.00 2.37 3.08 -1.01 0.06 114.38 119.65 1vaz h ARG 44 Ca 0.50 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.55 1vaz h ARG 44 Cb 0.65 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.70 1vaz h ARG 44 CO -0.33 0.02 -0.88 0.54 -1.07 0.00 0.00 179.97 178.25 1vaz n ARG 45 N -3.22 0.39 0.00 0.04 5.12 0.35 -4.99 116.66 114.35 1vaz n ARG 45 Ca -0.02 0.07 0.00 0.00 -1.93 0.00 0.00 57.85 55.97 1vaz n ARG 45 Cb 0.16 -1.70 0.00 0.00 -1.16 0.00 0.00 32.46 29.77 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 1.30 -1.82 2.90 -0.13 0.00 0.01 -5.08 105.19 102.37 1vaz n GLY 46 Ca 0.02 0.71 -0.11 0.00 0.00 0.00 0.00 46.02 46.64 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 0.00 0.73 -0.28 1.61 2.02 -1.25 -4.70 118.70 116.83 1vaz s GLU 47 Ca 0.00 -0.73 0.01 0.00 0.02 0.00 0.00 54.97 54.27 1vaz s GLU 47 Cb 0.00 -0.45 0.15 0.00 0.10 0.00 0.00 34.13 33.93 1vaz s GLU 47 CO 0.00 -1.21 0.40 0.08 0.02 0.00 0.00 175.26 174.55 1vaz s VAL 48 N 1.48 -0.62 0.00 2.63 1.01 -1.26 -2.79 120.40 120.85 1vaz s VAL 48 Ca 0.18 -0.26 0.00 0.00 0.00 0.00 0.00 61.98 61.90 1vaz s VAL 48 Cb -0.10 -0.95 0.00 0.00 0.00 0.00 0.00 36.38 35.32 1vaz s VAL 48 CO -0.04 -0.26 0.00 -0.81 0.00 0.00 0.00 175.10 173.99 1vaz n PRO 49 N 5.35 2.38 -0.05 2.72 -0.04 -1.26 -2.40 135.00 141.70 1vaz n PRO 49 Ca -0.00 0.00 -0.13 0.00 -0.04 0.00 0.00 63.50 63.32 1vaz n PRO 49 Cb 0.49 0.00 -0.12 0.00 -0.04 0.00 0.00 33.50 33.84 1vaz n PRO 49 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1vaz h ALA 50 N -1.56 -0.01 -1.13 0.55 0.00 -1.89 -3.06 119.26 112.16 1vaz h ALA 50 Ca 0.00 -0.42 0.33 0.00 0.00 0.00 0.00 54.91 54.82 1vaz h ALA 50 Cb 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 17.75 1vaz h ALA 50 CO 0.00 -0.07 1.04 1.49 0.00 0.00 0.00 179.25 181.72 1vaz h GLU 51 N -0.89 0.00 -0.13 0.00 4.22 -1.96 1.51 114.58 117.33 1vaz h GLU 51 Ca -0.00 0.00 0.00 0.00 0.08 0.00 0.00 59.36 59.44 1vaz h GLU 51 Cb 0.84 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.08 1vaz h GLU 51 CO 0.00 0.00 0.08 1.37 -2.18 0.00 0.00 179.01 178.29 1vaz h LEU 52 N 0.00 0.15 -2.44 1.64 8.10 -1.90 0.65 115.31 121.52 1vaz h LEU 52 Ca 0.54 -0.02 0.02 0.00 0.11 0.00 0.00 57.88 58.52 1vaz h LEU 52 Cb 2.62 -0.04 -0.00 0.00 -0.44 0.00 0.00 40.66 42.80 1vaz h LEU 52 CO -0.01 0.13 0.08 -0.09 -4.11 0.00 0.00 178.44 174.44 1vaz h ARG 53 N 0.16 0.00 0.72 0.17 2.43 0.20 0.54 114.38 118.61 1vaz h ARG 53 Ca 0.05 0.00 -0.04 0.00 -0.81 0.00 0.00 59.98 59.18 1vaz h ARG 53 Cb -0.00 0.00 0.01 0.00 -0.42 0.00 0.00 29.97 29.56 1vaz h ARG 53 CO -0.01 0.00 -0.35 -0.09 -1.51 0.00 0.00 179.97 178.01 1vaz h ARG 54 N 0.00 -0.93 0.00 0.20 1.12 -0.55 -3.33 114.38 110.90 1vaz h ARG 54 Ca 0.03 0.06 -0.03 0.00 -1.11 0.00 0.00 59.98 58.94 1vaz h ARG 54 Cb 0.18 0.21 -0.00 0.00 -0.01 0.00 0.00 29.97 30.35 1vaz h ARG 54 CO -0.00 -0.62 -1.05 -0.11 -3.11 0.00 0.00 179.97 175.09 1vaz n LEU 55 N -5.42 1.90 -0.10 3.80 0.00 -0.93 -4.68 117.00 111.58 1vaz n LEU 55 Ca -0.12 0.32 -0.10 0.00 0.00 0.00 0.00 56.01 56.11 1vaz n LEU 55 Cb 0.38 -0.73 -0.07 0.00 0.00 0.00 0.00 43.42 43.01 1vaz n LEU 55 CO 0.30 -0.24 0.50 0.00 0.00 0.00 0.00 177.39 177.94 1vaz h ALA 56 N -0.96 -0.64 -5.13 1.96 0.00 -0.26 -3.47 119.26 110.77 1vaz h ALA 56 Ca -0.04 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1vaz h ALA 56 Cb 0.99 1.00 0.00 0.00 0.00 0.00 0.00 17.79 19.79 1vaz h ALA 56 CO -0.02 -0.83 -0.08 1.58 0.00 0.00 0.00 179.25 179.90 1vaz n HIS 57 N -4.56 -2.79 0.00 0.00 -0.00 0.19 -4.77 115.22 103.29 1vaz n HIS 57 Ca -0.02 1.08 0.00 0.00 0.46 0.00 0.00 57.72 59.23 1vaz n HIS 57 Cb 0.24 -3.86 0.00 0.00 -0.12 0.00 0.00 29.99 26.24 1vaz n HIS 57 CO 0.00 0.00 0.00 0.41 0.46 0.00 0.00 176.34 177.21 1vaz n GLY 58 N -1.44 0.13 0.00 1.57 0.00 -1.26 -4.96 105.19 99.22 1vaz n GLY 58 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.04 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 0.72 2.89 -0.02 0.00 -1.26 -5.11 105.19 102.40 1vaz n GLY 59 Ca 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.92 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 0.56 0.37 -0.01 1.61 -0.21 -1.26 -4.87 119.66 115.85 1vaz s GLN 60 Ca 0.00 0.28 -0.16 0.00 0.02 0.00 0.00 55.36 55.50 1vaz s GLN 60 Cb 0.00 -0.46 0.03 0.00 1.00 0.00 0.00 33.01 33.58 1vaz s GLN 60 CO 0.00 -0.84 0.34 0.08 -2.12 0.00 0.00 175.29 172.75 1vaz s VAL 61 N 2.51 0.06 -0.94 1.09 1.01 -1.12 -4.61 120.40 118.40 1vaz s VAL 61 Ca 0.11 -0.46 -0.23 0.00 0.00 0.00 0.00 61.98 61.40 1vaz s VAL 61 Cb -0.14 -0.69 0.06 0.00 0.00 0.00 0.00 36.38 35.61 1vaz s VAL 61 CO -0.23 -0.25 1.35 0.20 0.00 0.00 0.00 175.10 176.17 1vaz s ASN 62 N -1.41 6.44 0.23 3.32 -0.87 -1.12 -4.36 114.94 117.17 1vaz s ASN 62 Ca -0.12 -1.34 0.11 0.00 -1.57 0.00 0.00 52.86 49.93 1vaz s ASN 62 Cb -0.04 -2.54 -0.05 0.00 -0.02 0.00 0.00 41.25 38.60 1vaz s ASN 62 CO 0.04 -1.50 -0.20 -0.22 -2.57 0.00 0.00 177.10 172.65 1vaz s LEU 63 N 4.75 2.52 0.16 0.60 0.20 -1.26 -2.95 118.68 122.70 1vaz s LEU 63 Ca 0.41 -0.96 0.05 0.00 0.69 0.00 0.00 54.13 54.32 1vaz s LEU 63 Cb -0.03 -1.00 -0.04 0.00 -0.43 0.00 0.00 46.19 44.69 1vaz s LEU 63 CO -0.05 0.01 -0.11 1.51 -0.29 0.00 0.00 176.35 177.42 1vaz s ASP 64 N -3.14 1.96 0.57 3.68 1.47 -1.12 -4.86 116.67 115.23 1vaz s ASP 64 Ca 0.24 -1.00 -0.05 0.00 1.18 0.00 0.00 52.55 52.92 1vaz s ASP 64 Cb -0.05 -0.04 0.01 0.00 -0.34 0.00 0.00 42.92 42.50 1vaz s ASP 64 CO 0.11 -0.29 0.86 -0.04 0.68 0.00 0.00 175.17 176.50 1vaz s MET 65 N -3.67 2.88 -0.17 2.11 -1.94 -1.25 0.30 119.30 117.55 1vaz s MET 65 Ca 0.17 -0.14 -0.05 0.00 -1.71 0.00 0.00 55.69 53.97 1vaz s MET 65 Cb 0.01 -2.32 0.09 0.00 2.01 0.00 0.00 34.83 34.62 1vaz s MET 65 CO 0.02 -0.67 0.30 -1.21 -0.01 0.00 0.00 175.02 173.45 1vaz s GLU 66 N -4.92 0.22 -0.26 2.03 0.41 0.56 -4.68 118.70 112.05 1vaz s GLU 66 Ca 0.54 0.67 -0.21 0.00 -0.41 0.00 0.00 54.97 55.55 1vaz s GLU 66 Cb -0.10 -0.25 -0.01 0.00 -1.78 0.00 0.00 34.13 31.98 1vaz s GLU 66 CO 0.44 -0.40 0.69 -0.51 -0.49 0.00 0.00 175.26 174.98 1vaz s ASP 67 N 2.46 6.63 -0.45 -0.19 1.01 -1.26 -2.95 116.67 121.92 1vaz s ASP 67 Ca 0.04 0.75 0.07 0.00 0.71 0.00 0.00 52.55 54.11 1vaz s ASP 67 Cb -0.13 -2.36 0.32 0.00 1.01 0.00 0.00 42.92 41.75 1vaz s ASP 67 CO -0.11 -0.43 1.03 1.41 0.21 0.00 0.00 175.17 177.28 1vaz n HIS 68 N 5.83 -2.39 0.12 4.23 8.25 -1.26 -4.96 115.22 125.04 1vaz n HIS 68 Ca 0.01 -2.39 -0.02 0.00 -0.26 0.00 0.00 57.72 55.06 1vaz n HIS 68 Cb 0.49 1.28 0.09 0.00 1.12 0.00 0.00 29.99 32.96 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 3.09 0.00 0.00 -0.41 2.47 -1.92 -2.71 114.38 114.91 1vaz h ARG 69 Ca -0.07 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.65 1vaz h ARG 69 Cb 1.07 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.39 1vaz h ARG 69 CO 0.21 0.70 0.23 0.22 0.56 0.00 0.00 179.97 181.89 1vaz h ASP 70 N 0.00 0.00 -1.85 7.04 3.58 -1.98 -1.51 116.42 121.70 1vaz h ASP 70 Ca -0.01 0.00 -0.49 0.00 0.42 0.00 0.00 57.03 56.95 1vaz h ASP 70 Cb 1.29 0.00 -0.41 0.00 1.72 0.00 0.00 39.33 41.94 1vaz h ASP 70 CO 0.09 0.00 -1.05 -1.84 -2.88 0.00 0.00 179.24 173.56 1vaz n GLU 71 N -2.24 1.63 -2.50 0.28 0.28 -1.02 -5.10 120.64 111.97 1vaz n GLU 71 Ca -0.01 -3.74 -0.35 0.00 -0.16 0.00 0.00 57.16 52.90 1vaz n GLU 71 Cb 0.26 -1.77 -0.03 0.00 1.43 0.00 0.00 31.44 31.33 1vaz n GLU 71 CO 0.00 0.00 0.00 0.16 -0.16 0.00 0.00 177.13 177.13 1vaz s ASP 72 N -2.84 6.44 0.02 -1.84 -4.77 -0.57 -4.94 116.67 108.17 1vaz s ASP 72 Ca 0.40 2.02 -0.30 0.00 -3.30 0.00 0.00 52.55 51.37 1vaz s ASP 72 Cb 0.36 -2.58 -0.08 0.00 -1.09 0.00 0.00 42.92 39.53 1vaz s ASP 72 CO -0.08 -0.71 1.90 0.12 0.70 0.00 0.00 175.17 177.10 1vaz s PHE 73 N -1.80 1.44 0.23 2.11 2.19 -1.26 -4.92 117.98 115.97 1vaz s PHE 73 Ca 0.64 -0.32 0.03 0.00 0.33 0.00 0.00 56.93 57.61 1vaz s PHE 73 Cb -0.20 -4.18 -0.05 0.00 -1.31 0.00 0.00 43.02 37.28 1vaz s PHE 73 CO 0.25 -5.22 0.01 0.08 1.83 0.00 0.00 175.22 172.17 1vaz s VAL 74 N 4.33 0.98 0.08 3.12 1.01 -1.26 -4.83 120.40 123.83 1vaz s VAL 74 Ca 0.85 -2.03 -0.36 0.00 0.00 0.00 0.00 61.98 60.45 1vaz s VAL 74 Cb -0.41 -2.38 -0.18 0.00 0.00 0.00 0.00 36.38 33.41 1vaz s VAL 74 CO 0.39 -0.29 1.05 0.29 0.00 0.00 0.00 175.10 176.54 1vaz n LYS 75 N -0.42 0.43 0.00 2.72 4.76 -1.26 -5.27 118.16 119.12 1vaz n LYS 75 Ca -0.05 0.15 0.11 0.00 -2.87 0.00 0.00 58.31 55.65 1vaz n LYS 75 Cb 0.64 -1.60 0.62 0.00 -1.84 0.00 0.00 35.03 32.86 1vaz n LYS 75 CO 0.00 0.00 0.00 -0.35 -1.37 0.00 0.00 177.40 175.68