#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 1.71 -0.51 5.31 0.52 -1.26 -4.77 118.95 119.96 1vaz s ARG 2 Ca 0.00 -0.56 0.04 0.00 -0.52 0.00 0.00 55.73 54.68 1vaz s ARG 2 Cb 0.00 -5.05 0.16 0.00 0.52 0.00 0.00 34.95 30.58 1vaz s ARG 2 CO 0.00 -4.80 0.36 0.50 0.02 0.00 0.00 175.30 171.37 1vaz s ARG 3 N 7.79 1.47 0.00 3.54 6.06 -1.26 -5.09 118.95 131.46 1vaz s ARG 3 Ca 0.78 -2.43 0.00 0.00 -2.50 0.00 0.00 55.73 51.58 1vaz s ARG 3 Cb -0.05 -2.27 0.00 0.00 0.06 0.00 0.00 34.95 32.70 1vaz s ARG 3 CO 0.14 -1.29 0.00 -2.13 -2.50 0.00 0.00 175.30 169.52 1vaz n ARG 4 N 2.81 0.00 -3.88 5.12 0.63 -1.26 -5.16 116.66 114.92 1vaz n ARG 4 Ca 0.20 0.00 -0.22 0.00 -0.92 0.00 0.00 57.85 56.91 1vaz n ARG 4 Cb 0.40 0.00 -0.17 0.00 0.45 0.00 0.00 32.46 33.14 1vaz n ARG 4 CO 0.00 0.00 0.00 -1.58 -2.51 0.00 0.00 177.63 173.54 1vaz s HIS 5 N -4.23 0.73 0.00 -0.14 5.65 -1.26 -4.94 115.29 111.11 1vaz s HIS 5 Ca 0.00 -0.21 0.00 0.00 0.25 0.00 0.00 55.06 55.10 1vaz s HIS 5 Cb 0.00 -0.79 0.00 0.00 -1.18 0.00 0.00 32.58 30.61 1vaz s HIS 5 CO 0.00 -0.30 0.00 0.45 -0.65 0.00 0.00 174.74 174.24 1vaz n SER 6 N 4.83 0.00 -1.76 9.88 2.88 -1.26 -5.15 113.62 123.04 1vaz n SER 6 Ca -0.12 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.42 1vaz n SER 6 Cb 0.50 0.07 0.00 0.00 -0.75 0.00 0.00 64.21 64.03 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 -1.10 -4.90 3.05 0.46 0.00 -1.26 -4.24 105.19 97.20 1vaz n GLY 7 Ca 0.00 -0.54 -0.27 0.00 0.00 0.00 0.00 46.02 45.21 1vaz n GLY 7 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1vaz n GLN 8 N -0.09 0.87 -3.93 1.61 -0.00 -1.26 -4.77 117.38 109.83 1vaz n GLN 8 Ca 0.00 -1.19 -0.29 0.00 -0.00 0.00 0.00 57.00 55.53 1vaz n GLN 8 Cb 0.00 -2.46 -0.16 0.00 -0.00 0.00 0.00 30.24 27.62 1vaz n GLN 8 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.06 176.55 1vaz s ASP 9 N 5.11 2.93 -0.53 2.61 1.11 -1.26 -5.07 116.67 121.58 1vaz s ASP 9 Ca 0.41 -0.69 -0.19 0.00 0.18 0.00 0.00 52.55 52.25 1vaz s ASP 9 Cb 0.10 -1.01 0.07 0.00 1.07 0.00 0.00 42.92 43.14 1vaz s ASP 9 CO 0.11 -0.16 0.66 -0.69 1.18 0.00 0.00 175.17 176.26 1vaz s VAL 10 N 1.56 4.84 -0.01 -1.27 1.01 -1.26 -5.04 120.40 120.24 1vaz s VAL 10 Ca 0.01 -0.57 0.08 0.00 0.00 0.00 0.00 61.98 61.50 1vaz s VAL 10 Cb -0.15 -4.35 -0.02 0.00 0.00 0.00 0.00 36.38 31.85 1vaz s VAL 10 CO -0.08 -0.89 -0.26 -1.00 0.00 0.00 0.00 175.10 172.86 1vaz s HIS 11 N 2.71 2.33 0.24 5.22 3.76 -1.26 -1.96 115.29 126.32 1vaz s HIS 11 Ca 0.15 -0.43 -0.16 0.00 -0.15 0.00 0.00 55.06 54.46 1vaz s HIS 11 Cb -0.20 -1.48 0.01 0.00 1.11 0.00 0.00 32.58 32.02 1vaz s HIS 11 CO 0.11 -0.01 0.55 0.08 -0.85 0.00 0.00 174.74 174.62 1vaz s VAL 12 N -0.65 0.01 -0.21 -0.90 1.01 -1.09 -5.03 120.40 113.54 1vaz s VAL 12 Ca 0.10 -1.11 -0.06 0.00 0.00 0.00 0.00 61.98 60.91 1vaz s VAL 12 Cb -0.10 -1.95 -0.03 0.00 0.00 0.00 0.00 36.38 34.30 1vaz s VAL 12 CO -0.00 -0.05 0.03 -0.69 0.00 0.00 0.00 175.10 174.39 1vaz s VAL 13 N -3.95 4.18 -0.30 2.92 1.01 -1.26 0.13 120.40 123.13 1vaz s VAL 13 Ca 0.15 -0.23 -0.01 0.00 0.00 0.00 0.00 61.98 61.90 1vaz s VAL 13 Cb -0.02 -2.91 0.06 0.00 0.00 0.00 0.00 36.38 33.51 1vaz s VAL 13 CO 0.05 0.40 -0.00 -0.76 0.00 0.00 0.00 175.10 174.78 1vaz s LEU 14 N 1.11 3.94 0.26 3.92 1.02 -0.49 -3.92 118.68 124.52 1vaz s LEU 14 Ca 0.03 -1.38 -0.03 0.00 0.02 0.00 0.00 54.13 52.77 1vaz s LEU 14 Cb -0.14 -1.69 -0.05 0.00 0.02 0.00 0.00 46.19 44.33 1vaz s LEU 14 CO 0.02 -0.27 0.49 -0.75 0.02 0.00 0.00 176.35 175.86 1vaz s LYS 15 N 1.20 3.58 -0.10 1.70 2.20 -0.86 -2.00 119.74 125.46 1vaz s LYS 15 Ca -0.04 -0.14 -0.00 0.00 -0.36 0.00 0.00 55.97 55.43 1vaz s LYS 15 Cb -0.20 -2.72 0.02 0.00 -1.51 0.00 0.00 37.83 33.43 1vaz s LYS 15 CO -0.02 0.28 -0.08 -1.17 -0.36 0.00 0.00 175.35 174.00 1vaz s LEU 16 N -3.50 1.21 0.59 5.43 2.96 -1.18 -0.64 118.68 123.55 1vaz s LEU 16 Ca 0.42 -0.28 0.01 0.00 -0.22 0.00 0.00 54.13 54.06 1vaz s LEU 16 Cb -0.11 -0.80 0.06 0.00 0.50 0.00 0.00 46.19 45.84 1vaz s LEU 16 CO 0.30 -0.10 0.83 0.26 -1.32 0.00 0.00 176.35 176.31 1vaz s TRP 17 N 1.57 2.42 0.36 5.38 0.52 2.37 -3.53 118.94 128.03 1vaz s TRP 17 Ca 0.02 -0.14 0.22 0.00 0.02 0.00 0.00 56.10 56.22 1vaz s TRP 17 Cb -0.13 -2.77 1.29 0.00 -1.15 0.00 0.00 33.47 30.71 1vaz s TRP 17 CO -0.06 -1.10 1.48 1.17 0.02 0.00 0.00 176.95 178.46 1vaz n LYS 18 N -2.45 -0.05 -0.38 4.98 4.81 -1.16 -2.46 118.16 121.45 1vaz n LYS 18 Ca 0.10 1.28 0.00 0.00 -0.87 0.00 0.00 58.31 58.82 1vaz n LYS 18 Cb 0.60 -2.33 0.00 0.00 0.02 0.00 0.00 35.03 33.32 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 -5.03 0.00 -3.71 3.15 5.66 -1.26 -5.05 114.28 108.04 1vaz n THR 19 Ca 0.36 0.00 -0.13 0.00 -3.05 0.00 0.00 64.05 61.23 1vaz n THR 19 Cb 1.26 0.44 -0.07 0.00 -1.55 0.00 0.00 70.33 70.41 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 -0.53 -0.21 -0.01 1.09 0.00 -1.03 -2.34 107.32 104.30 1vaz s GLY 20 Ca 0.00 0.29 0.07 0.00 0.00 0.00 0.00 44.72 45.08 1vaz s GLY 20 CO 0.00 0.06 -0.22 -0.11 0.00 0.00 0.00 173.10 172.83 1vaz s PHE 21 N -2.03 1.95 0.54 1.90 -0.12 -0.40 0.58 117.98 120.39 1vaz s PHE 21 Ca -0.08 -0.37 0.07 0.00 -0.05 0.00 0.00 56.93 56.50 1vaz s PHE 21 Cb -0.02 -1.25 0.05 0.00 -0.63 0.00 0.00 43.02 41.17 1vaz s PHE 21 CO 0.00 -0.02 0.52 0.45 -0.05 0.00 0.00 175.22 176.12 1vaz s SER 22 N -0.55 4.82 -0.30 1.98 0.15 0.18 -0.99 113.70 119.00 1vaz s SER 22 Ca 0.08 -1.07 -0.15 0.00 0.70 0.00 0.00 55.95 55.51 1vaz s SER 22 Cb -0.08 0.27 0.16 0.00 -1.71 0.00 0.00 66.02 64.65 1vaz s SER 22 CO -0.01 -1.12 1.00 -0.22 1.20 0.00 0.00 173.24 174.09 1vaz s LEU 23 N -4.38 -0.53 0.28 3.45 0.20 -1.26 -2.03 118.68 114.41 1vaz s LEU 23 Ca 0.44 0.76 0.00 0.00 0.69 0.00 0.00 54.13 56.02 1vaz s LEU 23 Cb -0.03 1.65 0.00 0.00 -0.43 0.00 0.00 46.19 47.38 1vaz s LEU 23 CO 0.27 -0.11 0.00 0.47 -0.29 0.00 0.00 176.35 176.69 1vaz n ASP 24 N 4.59 -6.92 0.15 3.68 8.00 -1.25 -3.50 116.55 121.29 1vaz n ASP 24 Ca -0.12 0.50 0.19 0.00 0.71 0.00 0.00 54.79 56.08 1vaz n ASP 24 Cb 0.54 -3.55 0.78 0.00 -0.02 0.00 0.00 41.12 38.87 1vaz n ASP 24 CO 0.00 0.00 0.00 -0.55 -0.39 0.00 0.00 177.20 176.26 1vaz h ASN 25 N -1.08 0.00 -2.01 -2.24 7.08 -2.01 -3.43 115.58 111.89 1vaz h ASN 25 Ca 0.01 0.00 -0.54 0.00 -3.08 0.00 0.00 56.30 52.69 1vaz h ASN 25 Cb 1.07 0.00 0.24 0.00 -2.08 0.00 0.00 38.32 37.55 1vaz h ASN 25 CO 0.01 0.00 -1.85 0.61 -2.08 0.00 0.00 177.43 174.12 1vaz n GLY 26 N -1.44 -4.30 2.17 9.14 0.00 -1.23 -4.92 105.19 104.61 1vaz n GLY 26 Ca 0.05 -0.73 -0.18 0.00 0.00 0.00 0.00 46.02 45.16 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 3.09 -1.42 -4.80 1.61 8.00 -1.26 -4.61 116.55 117.16 1vaz n ASP 27 Ca -0.01 -0.96 -0.34 0.00 0.71 0.00 0.00 54.79 54.18 1vaz n ASP 27 Cb 0.58 -0.62 -0.06 0.00 -0.02 0.00 0.00 41.12 41.00 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 4.02 0.04 0.64 0.20 -1.26 -4.36 118.68 117.95 1vaz s LEU 28 Ca 0.44 1.81 0.02 0.00 0.69 0.00 0.00 54.13 57.09 1vaz s LEU 28 Cb -0.04 -4.41 -0.04 0.00 -0.43 0.00 0.00 46.19 41.28 1vaz s LEU 28 CO 0.33 -0.40 0.03 -0.13 -0.29 0.00 0.00 176.35 175.89 1vaz s ARG 29 N -2.90 2.79 0.02 1.98 3.00 -0.16 -4.95 118.95 118.72 1vaz s ARG 29 Ca 0.60 -0.66 -0.19 0.00 0.00 0.00 0.00 55.73 55.48 1vaz s ARG 29 Cb -0.14 -2.68 -0.06 0.00 0.00 0.00 0.00 34.95 32.07 1vaz s ARG 29 CO 0.18 0.59 0.54 -1.12 0.00 0.00 0.00 175.30 175.50 1vaz s SER 30 N -1.95 6.96 0.17 0.23 0.01 -1.26 -1.28 113.70 116.58 1vaz s SER 30 Ca 0.24 1.14 0.08 0.00 1.31 0.00 0.00 55.95 58.71 1vaz s SER 30 Cb -0.12 -2.34 0.43 0.00 0.21 0.00 0.00 66.02 64.21 1vaz s SER 30 CO 0.15 0.19 1.13 -1.22 0.41 0.00 0.00 173.24 173.90 1vaz n TYR 31 N 2.28 0.27 -0.03 2.43 4.02 -0.99 -1.42 117.16 123.73 1vaz n TYR 31 Ca -0.09 0.14 -0.19 0.00 -0.01 0.00 0.00 57.90 57.74 1vaz n TYR 31 Cb 0.51 -0.57 -0.14 0.00 -0.02 0.00 0.00 39.34 39.13 1vaz n TYR 31 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 176.86 176.89 1vaz n GLN 32 N -1.74 0.72 -0.98 -0.72 6.02 -1.26 -4.89 117.38 114.53 1vaz n GLN 32 Ca -0.01 0.23 -0.36 0.00 -0.01 0.00 0.00 57.00 56.85 1vaz n GLN 32 Cb 0.21 -1.66 0.04 0.00 1.02 0.00 0.00 30.24 29.85 1vaz n GLN 32 CO 0.00 0.00 0.00 -3.47 -1.01 0.00 0.00 177.06 172.58 1vaz n ASP 33 N -3.38 -5.22 -0.04 1.08 -0.08 -0.50 -4.83 116.55 103.57 1vaz n ASP 33 Ca -0.34 0.13 -0.16 0.00 -1.51 0.00 0.00 54.79 52.91 1vaz n ASP 33 Cb 1.04 -0.68 -0.06 0.00 2.34 0.00 0.00 41.12 43.75 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 -0.98 0.83 -0.79 -0.67 0.13 -1.93 -3.00 132.00 125.59 1vaz h PRO 34 Ca -0.42 -0.62 0.23 0.00 -0.87 0.00 0.00 66.00 64.32 1vaz h PRO 34 Cb 1.30 0.11 -0.03 0.00 0.13 0.00 0.00 31.00 32.51 1vaz h PRO 34 CO 0.22 1.23 0.95 1.03 -0.23 0.00 0.00 178.00 181.21 1vaz h SER 35 N 0.59 0.00 0.18 1.44 0.87 -1.93 1.94 113.55 116.65 1vaz h SER 35 Ca -0.03 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.53 1vaz h SER 35 Cb 1.32 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.28 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 -3.35 0.00 0.49 6.23 3.02 -1.13 -2.08 115.26 118.43 1vaz n ASN 36 Ca 0.17 0.28 -0.20 0.00 -0.03 0.00 0.00 54.58 54.80 1vaz n ASN 36 Cb 1.21 -0.35 -0.10 0.00 -0.61 0.00 0.00 39.78 39.93 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 2.34 -1.23 0.00 5.41 0.00 0.29 0.32 119.26 126.38 1vaz h ALA 37 Ca 0.00 -0.27 -0.19 0.00 0.00 0.00 0.00 54.91 54.45 1vaz h ALA 37 Cb 0.09 0.48 -0.03 0.00 0.00 0.00 0.00 17.79 18.33 1vaz h ALA 37 CO 0.00 -1.19 -1.24 0.37 0.00 0.00 0.00 179.25 177.18 1vaz h GLN 38 N -1.23 0.00 0.62 0.00 5.75 -1.76 -2.30 115.11 116.19 1vaz h GLN 38 Ca -0.12 0.00 -0.03 0.00 -0.15 0.00 0.00 58.65 58.34 1vaz h GLN 38 Cb 0.95 0.00 0.01 0.00 1.07 0.00 0.00 27.48 29.50 1vaz h GLN 38 CO 0.20 0.50 -0.30 0.35 -2.65 0.00 0.00 178.83 176.93 1vaz h PHE 39 N 0.00 -0.77 -0.00 3.99 3.04 -1.40 0.93 116.94 122.73 1vaz h PHE 39 Ca -0.14 -0.02 -0.00 0.00 3.98 0.00 0.00 57.97 61.79 1vaz h PHE 39 Cb 1.68 0.25 0.00 0.00 2.56 0.00 0.00 35.95 40.45 1vaz h PHE 39 CO 0.00 -0.43 -0.00 1.25 -2.02 0.00 0.00 178.31 177.11 1vaz h LEU 40 N -1.08 0.00 0.35 0.59 5.85 -0.52 -2.21 115.31 118.30 1vaz h LEU 40 Ca -0.08 -0.57 -0.02 0.00 0.84 0.00 0.00 57.88 58.05 1vaz h LEU 40 Cb 0.68 -0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.72 1vaz h LEU 40 CO 0.14 0.57 -0.17 -0.33 -0.34 0.00 0.00 178.44 178.31 1vaz h GLU 41 N -0.56 -0.45 -0.82 1.25 4.39 -1.38 -2.70 114.58 114.30 1vaz h GLU 41 Ca 0.00 0.03 0.04 0.00 0.34 0.00 0.00 59.36 59.77 1vaz h GLU 41 Cb 0.57 0.10 -0.05 0.00 -0.10 0.00 0.00 28.75 29.27 1vaz h GLU 41 CO 0.00 -0.21 0.54 1.03 -1.16 0.00 0.00 179.01 179.22 1vaz h SER 42 N -1.06 0.87 -0.22 1.42 0.87 -0.90 -2.35 113.55 112.18 1vaz h SER 42 Ca -0.05 -0.01 -0.01 0.00 -1.23 0.00 0.00 61.79 60.49 1vaz h SER 42 Cb 0.46 -0.20 -0.01 0.00 -0.44 0.00 0.00 62.40 62.21 1vaz h SER 42 CO 0.08 0.60 0.09 0.40 -0.53 0.00 0.00 176.83 177.47 1vaz h ILE 43 N 1.01 1.17 -0.89 2.23 2.04 -0.63 2.61 117.51 125.05 1vaz h ILE 43 Ca 0.33 -0.50 0.16 0.00 1.00 0.00 0.00 64.86 65.85 1vaz h ILE 43 Cb 0.04 1.09 -0.10 0.00 -0.74 0.00 0.00 36.82 37.11 1vaz h ILE 43 CO -0.10 0.16 0.47 0.03 0.00 0.00 0.00 178.15 178.72 1vaz h ARG 44 N 0.21 0.62 0.00 2.37 2.47 -1.08 0.76 114.38 119.72 1vaz h ARG 44 Ca 0.07 -0.04 0.00 0.00 -1.26 0.00 0.00 59.98 58.76 1vaz h ARG 44 Cb 0.18 -0.14 0.00 0.00 -1.65 0.00 0.00 29.97 28.36 1vaz h ARG 44 CO -0.01 0.41 -0.07 0.54 0.56 0.00 0.00 179.97 181.41 1vaz n ARG 45 N -4.86 0.16 0.00 0.04 5.12 -0.93 -4.90 116.66 111.28 1vaz n ARG 45 Ca 0.19 0.12 0.00 0.00 -1.93 0.00 0.00 57.85 56.23 1vaz n ARG 45 Cb 0.48 -1.67 0.00 0.00 -1.16 0.00 0.00 32.46 30.10 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 1.39 0.62 3.02 -0.13 0.00 0.26 -5.07 105.19 105.28 1vaz n GLY 46 Ca 0.06 -0.16 -0.10 0.00 0.00 0.00 0.00 46.02 45.83 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 0.37 0.36 0.25 1.61 2.02 0.84 -3.63 118.70 120.52 1vaz s GLU 47 Ca 0.00 -0.55 -0.11 0.00 0.02 0.00 0.00 54.97 54.33 1vaz s GLU 47 Cb 0.00 0.14 -0.08 0.00 0.10 0.00 0.00 34.13 34.29 1vaz s GLU 47 CO 0.00 -0.07 0.59 0.08 0.02 0.00 0.00 175.26 175.88 1vaz s VAL 48 N -1.45 4.88 -0.06 2.63 1.01 -1.24 -1.60 120.40 124.57 1vaz s VAL 48 Ca -0.16 0.57 -0.26 0.00 0.00 0.00 0.00 61.98 62.13 1vaz s VAL 48 Cb -0.09 -3.62 -0.21 0.00 0.00 0.00 0.00 36.38 32.46 1vaz s VAL 48 CO -0.00 -0.10 1.05 1.55 0.00 0.00 0.00 175.10 177.60 1vaz h PRO 49 N 2.46 -0.04 0.00 2.72 0.13 -1.87 -3.34 132.00 132.06 1vaz h PRO 49 Ca -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 1vaz h PRO 49 Cb 1.17 0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.31 1vaz h PRO 49 CO 0.68 0.57 -0.57 0.00 -0.23 0.00 0.00 178.00 178.45 1vaz n ALA 50 N -2.46 0.80 0.28 -0.56 0.00 -1.26 -4.36 120.51 112.95 1vaz n ALA 50 Ca -0.09 -0.55 0.11 0.00 0.00 0.00 0.00 53.44 52.91 1vaz n ALA 50 Cb 0.31 0.03 0.59 0.00 0.00 0.00 0.00 19.45 20.38 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 -0.57 0.00 0.05 0.00 4.39 -1.97 0.36 114.58 116.84 1vaz h GLU 51 Ca 0.00 0.00 -0.24 0.00 0.34 0.00 0.00 59.36 59.46 1vaz h GLU 51 Cb 0.57 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.23 1vaz h GLU 51 CO 0.00 0.00 -1.05 1.37 -1.16 0.00 0.00 179.01 178.17 1vaz h LEU 52 N 0.00 0.52 -1.22 1.33 -0.00 -1.79 -2.76 115.31 111.39 1vaz h LEU 52 Ca 0.00 -0.46 -0.06 0.00 -0.00 0.00 0.00 57.88 57.36 1vaz h LEU 52 Cb 0.80 -0.16 -0.01 0.00 -0.00 0.00 0.00 40.66 41.29 1vaz h LEU 52 CO 0.00 1.28 -0.30 -0.09 -0.00 0.00 0.00 178.44 179.33 1vaz h ARG 53 N 0.19 0.00 0.63 0.17 2.43 -0.49 2.50 114.38 119.81 1vaz h ARG 53 Ca -0.10 0.00 -0.03 0.00 -0.81 0.00 0.00 59.98 59.04 1vaz h ARG 53 Cb 1.71 0.00 0.01 0.00 -0.42 0.00 0.00 29.97 31.26 1vaz h ARG 53 CO 0.18 0.30 -0.30 0.00 -1.51 0.00 0.00 179.97 178.64 1vaz h ARG 54 N 0.00 -0.82 0.00 0.20 3.08 -1.29 -3.31 114.38 112.24 1vaz h ARG 54 Ca -0.00 0.06 -0.23 0.00 0.07 0.00 0.00 59.98 59.87 1vaz h ARG 54 Cb 0.72 0.19 -0.03 0.00 0.08 0.00 0.00 29.97 30.92 1vaz h ARG 54 CO 0.04 -0.54 -1.75 1.28 -1.07 0.00 0.00 179.97 177.93 1vaz n LEU 55 N -5.34 1.89 0.10 3.04 4.77 -1.06 -4.66 117.00 115.75 1vaz n LEU 55 Ca -0.11 0.32 -0.15 0.00 -0.03 0.00 0.00 56.01 56.04 1vaz n LEU 55 Cb 0.34 -0.76 -0.09 0.00 -2.33 0.00 0.00 43.42 40.58 1vaz n LEU 55 CO 0.26 0.15 0.51 0.00 -1.33 0.00 0.00 177.39 176.98 1vaz h ALA 56 N -0.96 -0.97 -2.18 -1.18 0.00 -0.05 -3.47 119.26 110.45 1vaz h ALA 56 Ca -0.35 -0.10 -0.02 0.00 0.00 0.00 0.00 54.91 54.43 1vaz h ALA 56 Cb 1.29 0.88 0.01 0.00 0.00 0.00 0.00 17.79 19.97 1vaz h ALA 56 CO -0.21 -1.09 -0.05 1.58 0.00 0.00 0.00 179.25 179.47 1vaz n HIS 57 N -5.27 -0.16 0.00 0.00 -0.00 0.79 -4.76 115.22 105.82 1vaz n HIS 57 Ca -0.08 0.07 0.00 0.00 0.46 0.00 0.00 57.72 58.17 1vaz n HIS 57 Cb 0.38 -2.14 0.00 0.00 -0.12 0.00 0.00 29.99 28.11 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 -0.97 -0.52 0.00 1.57 0.00 -1.26 -5.00 105.19 99.00 1vaz n GLY 58 Ca -0.02 0.32 0.00 0.00 0.00 0.00 0.00 46.02 46.33 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 -1.81 2.86 -0.02 0.00 -1.26 -4.95 105.19 100.01 1vaz n GLY 59 Ca 0.00 0.78 -0.12 0.00 0.00 0.00 0.00 46.02 46.68 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 -0.02 1.61 -0.21 -1.26 -4.81 119.66 115.71 1vaz s GLN 60 Ca 0.00 -0.82 -0.18 0.00 0.02 0.00 0.00 55.36 54.38 1vaz s GLN 60 Cb 0.00 -0.50 0.03 0.00 1.00 0.00 0.00 33.01 33.54 1vaz s GLN 60 CO 0.00 -1.22 0.40 0.08 -2.12 0.00 0.00 175.29 172.42 1vaz s VAL 61 N 1.39 0.05 -0.54 1.09 1.01 -1.24 -4.53 120.40 117.63 1vaz s VAL 61 Ca 0.19 -0.38 -0.26 0.00 0.00 0.00 0.00 61.98 61.53 1vaz s VAL 61 Cb -0.10 -0.73 0.03 0.00 0.00 0.00 0.00 36.38 35.59 1vaz s VAL 61 CO -0.05 -0.21 1.03 0.20 0.00 0.00 0.00 175.10 176.07 1vaz s ASN 62 N -1.36 6.43 0.03 3.32 0.01 -0.83 -3.38 114.94 119.16 1vaz s ASN 62 Ca -0.12 -0.06 -0.03 0.00 -0.71 0.00 0.00 52.86 51.94 1vaz s ASN 62 Cb -0.04 -2.48 -0.04 0.00 0.41 0.00 0.00 41.25 39.10 1vaz s ASN 62 CO 0.05 -1.27 0.23 -1.48 -1.51 0.00 0.00 177.10 173.12 1vaz s LEU 63 N 4.24 4.36 0.58 0.60 2.34 -1.26 -2.68 118.68 126.86 1vaz s LEU 63 Ca 0.37 0.38 -0.00 0.00 0.06 0.00 0.00 54.13 54.94 1vaz s LEU 63 Cb -0.10 -2.80 0.04 0.00 -0.56 0.00 0.00 46.19 42.76 1vaz s LEU 63 CO 0.23 0.21 0.82 -0.62 -1.06 0.00 0.00 176.35 175.94 1vaz s ASP 64 N -2.12 5.19 -0.22 1.48 -1.08 0.12 -4.86 116.67 115.17 1vaz s ASP 64 Ca 0.31 0.10 -0.02 0.00 -0.52 0.00 0.00 52.55 52.42 1vaz s ASP 64 Cb -0.13 -0.94 0.07 0.00 -1.46 0.00 0.00 42.92 40.46 1vaz s ASP 64 CO 0.22 -1.23 0.05 -0.04 0.52 0.00 0.00 175.17 174.68 1vaz s MET 65 N -4.86 0.70 -0.23 4.34 -1.94 -1.25 -1.40 119.30 114.66 1vaz s MET 65 Ca 0.58 -0.59 -0.21 0.00 -1.71 0.00 0.00 55.69 53.76 1vaz s MET 65 Cb -0.10 -2.06 -0.02 0.00 2.01 0.00 0.00 34.83 34.65 1vaz s MET 65 CO 0.40 -0.73 0.65 -1.21 -0.01 0.00 0.00 175.02 174.11 1vaz s GLU 66 N 1.80 4.16 -0.26 2.03 0.41 -0.85 -4.97 118.70 121.02 1vaz s GLU 66 Ca 0.01 0.61 -0.29 0.00 -0.41 0.00 0.00 54.97 54.90 1vaz s GLU 66 Cb -0.17 -3.61 -0.01 0.00 -1.78 0.00 0.00 34.13 28.55 1vaz s GLU 66 CO -0.13 -0.34 1.43 -0.51 -0.49 0.00 0.00 175.26 175.23 1vaz s ASP 67 N 1.33 6.56 -0.46 -0.19 1.11 -1.26 -3.09 116.67 120.67 1vaz s ASP 67 Ca 0.28 1.40 0.06 0.00 0.18 0.00 0.00 52.55 54.47 1vaz s ASP 67 Cb -0.16 -2.54 0.32 0.00 1.07 0.00 0.00 42.92 41.62 1vaz s ASP 67 CO 0.09 -1.14 1.13 1.41 1.18 0.00 0.00 175.17 177.83 1vaz n HIS 68 N 7.94 -2.80 -0.05 4.23 8.25 -1.23 -4.98 115.22 126.58 1vaz n HIS 68 Ca 0.16 -2.07 -0.05 0.00 -0.26 0.00 0.00 57.72 55.50 1vaz n HIS 68 Cb 0.46 1.62 -0.02 0.00 1.12 0.00 0.00 29.99 33.18 1vaz n HIS 68 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 1vaz n ARG 69 N 0.39 0.32 -0.15 -0.41 5.12 -1.24 -3.53 116.66 117.16 1vaz n ARG 69 Ca 0.06 0.25 0.04 0.00 -1.93 0.00 0.00 57.85 56.26 1vaz n ARG 69 Cb 0.70 -1.20 0.11 0.00 -1.16 0.00 0.00 32.46 30.91 1vaz n ARG 69 CO 0.00 0.00 0.00 -0.25 -1.93 0.00 0.00 177.63 175.45 1vaz n ASP 70 N -3.76 1.47 0.00 0.55 8.00 -1.26 -2.96 116.55 118.59 1vaz n ASP 70 Ca -0.07 -2.05 0.00 0.00 0.71 0.00 0.00 54.79 53.38 1vaz n ASP 70 Cb 0.27 -0.23 0.00 0.00 -0.02 0.00 0.00 41.12 41.14 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 0.19 0.17 -4.14 -1.24 1.02 -1.26 -4.20 120.64 111.18 1vaz n GLU 71 Ca 0.08 -0.14 -0.17 0.00 -0.02 0.00 0.00 57.16 56.91 1vaz n GLU 71 Cb 0.26 -0.58 -0.15 0.00 -0.02 0.00 0.00 31.44 30.94 1vaz n GLU 71 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 1vaz s ASP 72 N -0.07 0.64 0.14 1.62 2.15 -1.23 -5.04 116.67 114.89 1vaz s ASP 72 Ca 0.00 -0.09 0.00 0.00 0.43 0.00 0.00 52.55 52.89 1vaz s ASP 72 Cb 0.00 -0.14 0.00 0.00 -0.30 0.00 0.00 42.92 42.48 1vaz s ASP 72 CO 0.00 0.03 0.00 0.33 -0.17 0.00 0.00 175.17 175.36 1vaz n PHE 73 N 3.25 -3.80 -2.45 -5.34 7.35 -1.26 -2.98 117.46 112.22 1vaz n PHE 73 Ca -0.16 2.29 -0.02 0.00 -0.76 0.00 0.00 57.45 58.79 1vaz n PHE 73 Cb 0.56 -2.94 -0.02 0.00 0.35 0.00 0.00 39.48 37.43 1vaz n PHE 73 CO 0.00 0.00 0.00 0.28 -0.76 0.00 0.00 176.76 176.28 1vaz n VAL 74 N 1.87-13.16 -0.52 -2.13 0.31 -1.26 -3.88 118.33 99.57 1vaz n VAL 74 Ca 0.00 3.02 -0.24 0.00 -0.01 0.00 0.00 64.34 67.11 1vaz n VAL 74 Cb 0.00 -6.22 0.18 0.00 -0.91 0.00 0.00 33.84 26.90 1vaz n VAL 74 CO 0.00 0.00 0.00 0.29 -1.32 0.00 0.00 176.83 175.80 1vaz n LYS 75 N 1.82 -2.52 0.00 5.55 5.02 -1.26 -4.77 118.16 122.00 1vaz n LYS 75 Ca -0.15 -0.74 0.10 0.00 -2.02 0.00 0.00 58.31 55.50 1vaz n LYS 75 Cb 0.23 -1.62 0.62 0.00 -0.02 0.00 0.00 35.03 34.24 1vaz n LYS 75 CO 0.00 0.00 0.00 -0.35 -0.52 0.00 0.00 177.40 176.53