#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1iaz s GLY 6 N 0.00 2.61 0.52 0.00 0.00 0.23 -4.83 107.32 105.85 1iaz s GLY 6 Ca 0.00 0.86 -0.20 0.00 0.00 0.00 0.00 44.72 45.39 1iaz s GLY 6 CO 0.00 1.23 1.08 0.00 0.00 0.00 0.00 173.10 175.41 1iaz s ALA 7 N -1.77 2.78 -0.25 3.20 0.00 -1.22 -4.19 121.76 120.30 1iaz s ALA 7 Ca 0.74 0.70 0.02 0.00 0.00 0.00 0.00 51.96 53.42 1iaz s ALA 7 Cb -0.26 -3.30 0.06 0.00 0.00 0.00 0.00 23.12 19.62 1iaz s ALA 7 CO 0.31 -0.56 -0.09 0.08 0.00 0.00 0.00 175.76 175.49 1iaz s VAL 8 N -1.91 1.97 0.48 0.00 1.01 -1.26 -0.35 120.40 120.34 1iaz s VAL 8 Ca 0.70 -1.52 0.06 0.00 0.00 0.00 0.00 61.98 61.21 1iaz s VAL 8 Cb -0.20 -2.14 -0.01 0.00 0.00 0.00 0.00 36.38 34.03 1iaz s VAL 8 CO 0.24 -0.06 0.24 0.27 0.00 0.00 0.00 175.10 175.79 1iaz s ILE 9 N 1.19 1.90 0.28 2.22 -4.36 0.33 -4.91 121.20 117.85 1iaz s ILE 9 Ca -0.08 -1.65 -0.29 0.00 -0.26 0.00 0.00 60.65 58.37 1iaz s ILE 9 Cb -0.20 -2.55 -0.10 0.00 1.25 0.00 0.00 42.46 40.86 1iaz s ILE 9 CO -0.05 0.00 1.29 -1.81 0.24 0.00 0.00 174.94 174.61 1iaz s ASP 10 N -4.05 6.86 0.24 4.36 1.01 -1.26 -0.15 116.67 123.68 1iaz s ASP 10 Ca 0.33 2.55 -0.05 0.00 0.71 0.00 0.00 52.55 56.10 1iaz s ASP 10 Cb 0.01 -2.63 0.42 0.00 1.01 0.00 0.00 42.92 41.73 1iaz s ASP 10 CO 0.19 -0.50 1.76 1.23 0.21 0.00 0.00 175.17 178.06 1iaz h GLY 11 N 4.14 1.17 2.00 0.21 0.00 -0.86 0.11 103.07 109.83 1iaz h GLY 11 Ca -0.47 -0.21 0.00 0.00 0.00 0.00 0.00 47.33 46.65 1iaz h GLY 11 CO 0.70 -0.02 0.00 0.00 0.00 0.00 0.00 176.54 177.22 1iaz n ALA 12 N -2.45 1.40 0.26 3.60 0.00 -1.26 -1.66 120.51 120.40 1iaz n ALA 12 Ca 0.14 0.03 0.12 0.00 0.00 0.00 0.00 53.44 53.72 1iaz n ALA 12 Cb 0.36 -1.21 0.05 0.00 0.00 0.00 0.00 19.45 18.65 1iaz n ALA 12 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 1iaz h SER 13 N 0.00 0.00 -3.00 0.00 0.02 -1.15 -3.46 113.55 105.96 1iaz h SER 13 Ca 0.00 -0.08 -0.52 0.00 -0.84 0.00 0.00 61.79 60.34 1iaz h SER 13 Cb 0.17 0.00 0.06 0.00 0.14 0.00 0.00 62.40 62.78 1iaz h SER 13 CO 0.00 0.04 0.92 -0.22 -1.14 0.00 0.00 176.83 176.43 1iaz s LEU 14 N -5.00 4.36 0.23 5.07 2.96 -0.67 -4.86 118.68 120.78 1iaz s LEU 14 Ca 0.02 2.83 -0.22 0.00 -0.22 0.00 0.00 54.13 56.53 1iaz s LEU 14 Cb 0.11 -3.61 0.04 0.00 0.50 0.00 0.00 46.19 43.22 1iaz s LEU 14 CO 0.77 -0.89 0.72 -0.94 -1.32 0.00 0.00 176.35 174.68 1iaz s SER 15 N 0.85 -0.33 0.24 3.68 1.04 -1.26 -5.02 113.70 112.90 1iaz s SER 15 Ca 0.68 -0.43 -0.06 0.00 0.48 0.00 0.00 55.95 56.62 1iaz s SER 15 Cb -0.47 0.67 0.25 0.00 0.10 0.00 0.00 66.02 66.56 1iaz s SER 15 CO 0.39 -1.20 1.89 0.15 0.98 0.00 0.00 173.24 175.44 1iaz h PHE 16 N 2.00 1.23 -0.75 5.02 3.57 -1.99 -2.01 116.94 124.01 1iaz h PHE 16 Ca -0.23 -0.01 -0.05 0.00 3.53 0.00 0.00 57.97 61.21 1iaz h PHE 16 Cb 1.26 -0.40 -0.03 0.00 2.79 0.00 0.00 35.95 39.57 1iaz h PHE 16 CO 0.37 0.83 0.29 0.22 -2.23 0.00 0.00 178.31 177.79 1iaz h ASP 17 N 1.28 1.04 -0.43 0.41 3.58 -1.97 0.40 116.42 120.74 1iaz h ASP 17 Ca 0.33 -0.16 -0.04 0.00 0.42 0.00 0.00 57.03 57.58 1iaz h ASP 17 Cb -0.04 -0.27 -0.02 0.00 1.72 0.00 0.00 39.33 40.73 1iaz h ASP 17 CO -0.06 0.93 0.11 0.40 -2.88 0.00 0.00 179.24 177.74 1iaz h ILE 18 N 1.10 1.23 -0.33 2.25 1.08 -1.83 -1.69 117.51 119.32 1iaz h ILE 18 Ca 0.25 -0.79 -0.07 0.00 -0.39 0.00 0.00 64.86 63.86 1iaz h ILE 18 Cb 0.22 0.93 -0.02 0.00 -3.07 0.00 0.00 36.82 34.88 1iaz h ILE 18 CO -0.02 0.28 -0.10 -0.07 -0.69 0.00 0.00 178.15 177.55 1iaz h LEU 19 N 0.56 0.54 -1.23 1.44 3.38 -0.90 -1.77 115.31 117.33 1iaz h LEU 19 Ca 0.14 -0.14 -0.07 0.00 0.09 0.00 0.00 57.88 57.90 1iaz h LEU 19 Cb 0.31 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.90 1iaz h LEU 19 CO 0.00 0.68 -0.21 0.50 0.09 0.00 0.00 178.44 179.50 1iaz h LYS 20 N 0.52 0.26 -0.10 1.13 3.64 0.27 -1.69 116.57 120.60 1iaz h LYS 20 Ca 0.10 -0.08 -0.19 0.00 -1.27 0.00 0.00 60.65 59.21 1iaz h LYS 20 Cb 0.49 -0.03 -0.00 0.00 -0.41 0.00 0.00 32.23 32.28 1iaz h LYS 20 CO 0.03 0.47 -0.72 1.79 -2.27 0.00 0.00 179.45 178.75 1iaz h THR 21 N 0.24 1.36 -0.68 1.00 1.35 -0.56 -1.85 112.91 113.78 1iaz h THR 21 Ca 0.04 -2.08 0.03 0.00 -0.55 0.00 0.00 66.41 63.85 1iaz h THR 21 Cb 0.52 2.06 -0.04 0.00 -1.73 0.00 0.00 68.15 68.95 1iaz h THR 21 CO 0.03 0.63 0.42 0.58 -0.25 0.00 0.00 175.52 176.93 1iaz h VAL 22 N 0.32 1.08 -0.38 6.82 2.07 -0.84 -1.23 116.25 124.10 1iaz h VAL 22 Ca -0.03 -0.28 -0.00 0.00 0.82 0.00 0.00 66.70 67.21 1iaz h VAL 22 Cb 1.29 0.19 -0.02 0.00 -1.52 0.00 0.00 31.29 31.24 1iaz h VAL 22 CO 0.13 0.15 0.23 -0.07 0.02 0.00 0.00 177.57 178.02 1iaz h LEU 23 N 0.82 0.46 -0.95 2.57 3.38 -1.12 -2.78 115.31 117.68 1iaz h LEU 23 Ca 0.27 -0.06 -0.02 0.00 0.09 0.00 0.00 57.88 58.17 1iaz h LEU 23 Cb 0.03 -0.12 -0.04 0.00 0.09 0.00 0.00 40.66 40.62 1iaz h LEU 23 CO -0.11 0.38 0.49 -0.33 0.09 0.00 0.00 178.44 178.96 1iaz h GLU 24 N 0.50 1.22 0.00 1.13 5.08 -0.79 -2.13 114.58 119.59 1iaz h GLU 24 Ca 0.14 -0.14 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1iaz h GLU 24 Cb 0.01 -0.24 0.00 0.00 0.50 0.00 0.00 28.75 29.02 1iaz h GLU 24 CO -0.03 0.89 0.00 0.00 -1.00 0.00 0.00 179.01 178.88 1iaz h ALA 25 N 1.30 1.00 0.00 3.43 0.00 -0.96 -1.07 119.26 122.96 1iaz h ALA 25 Ca 0.31 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.22 1iaz h ALA 25 Cb 0.02 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.81 1iaz h ALA 25 CO -0.05 0.00 0.00 1.28 0.00 0.00 0.00 179.25 180.48 1iaz n LEU 26 N -2.80 0.00 0.00 0.00 4.77 -0.80 -5.02 117.00 113.15 1iaz n LEU 26 Ca -0.01 0.46 0.00 0.00 -0.03 0.00 0.00 56.01 56.42 1iaz n LEU 26 Cb 0.13 -0.46 0.00 0.00 -2.33 0.00 0.00 43.42 40.76 1iaz n LEU 26 CO 0.19 -0.05 0.00 0.61 -1.33 0.00 0.00 177.39 176.81 1iaz n GLY 27 N 1.11 -1.90 3.46 -0.72 0.00 -0.41 -4.61 105.19 102.13 1iaz n GLY 27 Ca 0.08 -1.38 -0.44 0.00 0.00 0.00 0.00 46.02 44.28 1iaz n GLY 27 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1iaz s ASN 28 N -4.00 6.65 0.10 1.61 -0.87 -1.26 -4.92 114.94 112.25 1iaz s ASN 28 Ca 0.00 -2.09 0.09 0.00 -1.57 0.00 0.00 52.86 49.29 1iaz s ASN 28 Cb 0.00 -2.41 -0.03 0.00 -0.02 0.00 0.00 41.25 38.79 1iaz s ASN 28 CO 0.00 -1.06 -0.24 0.68 -2.57 0.00 0.00 177.10 173.91 1iaz s VAL 29 N 2.69 1.96 0.13 1.60 -7.23 -1.26 -5.07 120.40 113.22 1iaz s VAL 29 Ca 0.34 -1.55 -0.13 0.00 -1.81 0.00 0.00 61.98 58.82 1iaz s VAL 29 Cb -0.04 -1.74 -0.02 0.00 0.56 0.00 0.00 36.38 35.14 1iaz s VAL 29 CO -0.09 0.08 1.54 0.50 -0.31 0.00 0.00 175.10 176.83 1iaz h LYS 30 N 4.21 0.82 -4.64 4.82 3.64 -1.93 -3.43 116.57 120.05 1iaz h LYS 30 Ca -0.47 -0.31 -0.61 0.00 -1.27 0.00 0.00 60.65 57.99 1iaz h LYS 30 Cb 1.17 -0.05 -0.36 0.00 -0.41 0.00 0.00 32.23 32.58 1iaz h LYS 30 CO 0.40 0.94 -0.83 1.03 -2.27 0.00 0.00 179.45 178.72 1iaz s ARG 31 N -4.79 2.23 0.05 1.90 1.81 -1.26 -4.42 118.95 114.47 1iaz s ARG 31 Ca -0.12 -0.64 -0.18 0.00 -1.72 0.00 0.00 55.73 53.06 1iaz s ARG 31 Cb 0.11 -2.20 0.04 0.00 -0.45 0.00 0.00 34.95 32.44 1iaz s ARG 31 CO 0.83 -0.29 0.42 -1.59 -0.68 0.00 0.00 175.30 173.99 1iaz s LYS 32 N 1.46 0.94 -0.03 3.54 -2.85 -0.61 -2.13 119.74 120.06 1iaz s LYS 32 Ca 0.03 -0.37 -0.03 0.00 -1.00 0.00 0.00 55.97 54.60 1iaz s LYS 32 Cb -0.14 0.42 0.01 0.00 -2.06 0.00 0.00 37.83 36.06 1iaz s LYS 32 CO -0.10 -0.33 0.08 -1.50 0.10 0.00 0.00 175.35 173.60 1iaz s ILE 33 N -2.56 -0.01 -0.20 3.79 2.07 -0.00 -1.11 121.20 123.19 1iaz s ILE 33 Ca -0.05 0.02 -0.04 0.00 -1.41 0.00 0.00 60.65 59.17 1iaz s ILE 33 Cb -0.01 -0.12 -0.02 0.00 0.13 0.00 0.00 42.46 42.45 1iaz s ILE 33 CO -0.03 0.01 -0.03 0.00 -1.91 0.00 0.00 174.94 172.98 1iaz s ALA 34 N 0.15 2.90 -0.10 1.50 0.00 -0.30 -1.45 121.76 124.46 1iaz s ALA 34 Ca -0.01 -1.05 0.02 0.00 0.00 0.00 0.00 51.96 50.92 1iaz s ALA 34 Cb -0.02 -1.68 -0.02 0.00 0.00 0.00 0.00 23.12 21.41 1iaz s ALA 34 CO -0.00 -0.22 -0.16 0.08 0.00 0.00 0.00 175.76 175.46 1iaz s VAL 35 N 1.12 2.79 -0.06 0.00 1.01 0.28 -1.53 120.40 124.01 1iaz s VAL 35 Ca 0.02 -0.78 0.02 0.00 0.00 0.00 0.00 61.98 61.24 1iaz s VAL 35 Cb -0.15 -2.12 0.01 0.00 0.00 0.00 0.00 36.38 34.13 1iaz s VAL 35 CO 0.00 0.55 -0.11 -0.83 0.00 0.00 0.00 175.10 174.72 1iaz s GLY 36 N 0.00 0.72 -0.16 4.51 0.00 -0.04 -0.69 107.32 111.66 1iaz s GLY 36 Ca -0.05 -0.34 -0.01 0.00 0.00 0.00 0.00 44.72 44.31 1iaz s GLY 36 CO 0.04 0.16 -0.01 0.14 0.00 0.00 0.00 173.10 173.43 1iaz s VAL 37 N 0.68 0.76 -0.29 1.40 1.01 -0.64 -1.07 120.40 122.25 1iaz s VAL 37 Ca -0.14 -0.46 -0.18 0.00 0.00 0.00 0.00 61.98 61.21 1iaz s VAL 37 Cb -0.15 -1.05 -0.02 0.00 0.00 0.00 0.00 36.38 35.16 1iaz s VAL 37 CO 0.03 0.04 0.51 -0.62 0.00 0.00 0.00 175.10 175.06 1iaz s ASP 38 N 1.78 6.39 -0.63 3.32 2.15 0.13 -0.68 116.67 129.13 1iaz s ASP 38 Ca 0.01 0.34 -0.22 0.00 0.43 0.00 0.00 52.55 53.10 1iaz s ASP 38 Cb -0.15 -2.28 0.07 0.00 -0.30 0.00 0.00 42.92 40.26 1iaz s ASP 38 CO -0.07 -0.35 0.92 0.21 -0.17 0.00 0.00 175.17 175.71 1iaz s ASN 39 N 1.63 6.19 -0.20 -0.34 2.47 -0.10 -1.20 114.94 123.40 1iaz s ASN 39 Ca 0.20 -0.95 0.12 0.00 0.42 0.00 0.00 52.86 52.66 1iaz s ASN 39 Cb -0.15 -2.40 0.43 0.00 -1.45 0.00 0.00 41.25 37.67 1iaz s ASN 39 CO 0.11 -1.36 1.21 -0.62 -3.72 0.00 0.00 177.10 172.71 1iaz n GLU 40 N 7.49 1.71 0.19 0.43 -0.58 0.18 -0.30 120.64 129.76 1iaz n GLU 40 Ca -0.04 -3.30 0.13 0.00 -0.42 0.00 0.00 57.16 53.53 1iaz n GLU 40 Cb 0.45 -1.54 0.31 0.00 -0.57 0.00 0.00 31.44 30.09 1iaz n GLU 40 CO 0.00 0.00 0.00 0.66 -0.48 0.00 0.00 177.13 177.31 1iaz h SER 41 N 1.20 0.00 0.00 1.62 4.64 -1.80 -3.33 113.55 115.88 1iaz h SER 41 Ca 0.03 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.35 1iaz h SER 41 Cb 1.18 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.27 1iaz h SER 41 CO 0.12 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.69 1iaz n GLY 42 N 0.98 0.75 2.95 -0.77 0.00 -1.26 -4.78 105.19 103.06 1iaz n GLY 42 Ca 0.04 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.93 1iaz n GLY 42 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1iaz s LYS 43 N -0.49 0.29 0.27 1.61 1.02 -1.26 -4.97 119.74 116.22 1iaz s LYS 43 Ca 0.00 -0.26 -0.29 0.00 0.02 0.00 0.00 55.97 55.43 1iaz s LYS 43 Cb 0.00 -0.21 -0.09 0.00 -0.52 0.00 0.00 37.83 37.01 1iaz s LYS 43 CO 0.00 0.05 1.21 0.99 -0.92 0.00 0.00 175.35 176.68 1iaz s THR 44 N -0.42 3.20 -0.07 2.17 2.01 -1.26 -4.12 115.64 117.15 1iaz s THR 44 Ca -0.02 1.14 -0.00 0.00 0.31 0.00 0.00 61.69 63.11 1iaz s THR 44 Cb -0.03 -3.72 -0.03 0.00 0.01 0.00 0.00 72.50 68.72 1iaz s THR 44 CO -0.00 0.24 -0.03 0.26 -0.69 0.00 0.00 174.62 174.40 1iaz s TRP 45 N -0.80 3.06 -0.11 4.92 0.51 -0.49 -0.73 118.94 125.30 1iaz s TRP 45 Ca 0.49 0.11 0.02 0.00 -2.12 0.00 0.00 56.10 54.60 1iaz s TRP 45 Cb -0.35 -1.74 0.01 0.00 -0.81 0.00 0.00 33.47 30.58 1iaz s TRP 45 CO 0.44 0.41 -0.17 0.99 -0.51 0.00 0.00 176.95 178.11 1iaz s THR 46 N -0.88 1.63 0.17 2.01 2.01 0.72 -0.99 115.64 120.30 1iaz s THR 46 Ca 0.14 -0.73 -0.34 0.00 0.31 0.00 0.00 61.69 61.07 1iaz s THR 46 Cb -0.11 -1.47 -0.15 0.00 0.01 0.00 0.00 72.50 70.78 1iaz s THR 46 CO 0.03 0.47 1.40 0.00 -0.69 0.00 0.00 174.62 175.83 1iaz n ALA 47 N 4.08 0.36 -0.11 7.40 0.00 0.23 0.13 120.51 132.60 1iaz n ALA 47 Ca -0.19 0.46 0.00 0.00 0.00 0.00 0.00 53.44 53.70 1iaz n ALA 47 Cb 0.51 -2.21 0.00 0.00 0.00 0.00 0.00 19.45 17.76 1iaz n ALA 47 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 1iaz n LEU 48 N 2.62 0.00 0.00 0.00 7.94 -0.11 -4.73 117.00 122.73 1iaz n LEU 48 Ca 0.16 0.00 0.02 0.00 -1.11 0.00 0.00 56.01 55.07 1iaz n LEU 48 Cb 0.26 -0.44 0.01 0.00 0.53 0.00 0.00 43.42 43.78 1iaz n LEU 48 CO 0.62 -0.45 0.98 -0.46 -1.11 0.00 0.00 177.39 176.98 1iaz n ASN 49 N -2.39 -1.23 -4.23 1.96 6.94 -1.06 -5.01 115.26 110.23 1iaz n ASN 49 Ca 0.00 -1.36 -0.14 0.00 -0.02 0.00 0.00 54.58 53.05 1iaz n ASN 49 Cb 0.00 1.94 -0.10 0.00 -2.36 0.00 0.00 39.78 39.26 1iaz n ASN 49 CO 0.00 0.00 0.00 0.42 -1.03 0.00 0.00 177.26 176.65 1iaz s THR 50 N -2.04 1.12 -0.03 5.53 -4.23 -1.26 -0.62 115.64 114.11 1iaz s THR 50 Ca 0.27 -1.95 -0.01 0.00 -1.18 0.00 0.00 61.69 58.82 1iaz s THR 50 Cb -0.01 -1.73 0.03 0.00 1.34 0.00 0.00 72.50 72.13 1iaz s THR 50 CO 0.01 -0.69 0.04 -0.47 -0.54 0.00 0.00 174.62 172.96 1iaz s TYR 51 N -3.09 0.09 -0.26 3.99 5.04 0.62 -4.88 117.35 118.87 1iaz s TYR 51 Ca 0.14 0.17 -0.08 0.00 -2.44 0.00 0.00 57.07 54.86 1iaz s TYR 51 Cb 0.01 -0.39 -0.03 0.00 0.35 0.00 0.00 41.96 41.90 1iaz s TYR 51 CO 0.00 -0.15 0.09 -0.06 -1.34 0.00 0.00 175.55 174.09 1iaz s PHE 52 N 1.65 3.11 0.12 4.97 0.40 -1.26 -0.31 117.98 126.65 1iaz s PHE 52 Ca -0.02 -0.38 0.00 0.00 -0.60 0.00 0.00 56.93 55.93 1iaz s PHE 52 Cb -0.13 -2.26 -0.14 0.00 0.51 0.00 0.00 43.02 41.00 1iaz s PHE 52 CO -0.03 -0.35 1.27 -0.09 0.70 0.00 0.00 175.22 176.73 1iaz h ARG 53 N 8.26 0.21 -3.39 0.44 9.65 -0.34 -3.46 114.38 125.75 1iaz h ARG 53 Ca -0.38 -0.28 -0.16 0.00 -1.10 0.00 0.00 59.98 58.06 1iaz h ARG 53 Cb 1.17 0.09 -0.23 0.00 -1.39 0.00 0.00 29.97 29.61 1iaz h ARG 53 CO 0.58 1.06 -0.49 -1.12 2.80 0.00 0.00 179.97 182.80 1iaz s SER 54 N -6.98 -0.09 0.11 -3.80 0.01 -0.57 -4.95 113.70 97.43 1iaz s SER 54 Ca -0.03 0.09 0.00 0.00 1.31 0.00 0.00 55.95 57.32 1iaz s SER 54 Cb 0.09 0.29 0.00 0.00 0.21 0.00 0.00 66.02 66.61 1iaz s SER 54 CO 0.85 -0.22 0.00 0.61 0.41 0.00 0.00 173.24 174.89 1iaz n GLY 55 N 2.23 -1.59 1.72 3.44 0.00 -1.04 -1.08 105.19 108.86 1iaz n GLY 55 Ca -0.17 -1.32 -0.02 0.00 0.00 0.00 0.00 46.02 44.51 1iaz n GLY 55 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 1iaz n THR 56 N -0.11 0.00 -3.91 2.61 5.66 -0.02 -4.72 114.28 113.79 1iaz n THR 56 Ca 0.00 -0.30 -0.11 0.00 -3.05 0.00 0.00 64.05 60.59 1iaz n THR 56 Cb 0.00 0.37 -0.12 0.00 -1.55 0.00 0.00 70.33 69.03 1iaz n THR 56 CO 0.00 0.00 0.00 -0.55 -3.05 0.00 0.00 175.07 171.47 1iaz s SER 57 N -2.06 0.09 -0.05 1.09 0.15 -1.26 -0.52 113.70 111.14 1iaz s SER 57 Ca 0.10 -0.20 0.15 0.00 0.70 0.00 0.00 55.95 56.70 1iaz s SER 57 Cb -0.01 0.09 0.53 0.00 -1.71 0.00 0.00 66.02 64.91 1iaz s SER 57 CO 0.03 -0.16 1.42 0.47 1.20 0.00 0.00 173.24 176.20 1iaz n ASP 58 N 2.31 3.43 -4.28 5.45 8.00 -1.26 -4.90 116.55 125.30 1iaz n ASP 58 Ca -0.18 -2.19 -0.16 0.00 0.71 0.00 0.00 54.79 52.97 1iaz n ASP 58 Cb 0.57 -0.45 -0.10 0.00 -0.02 0.00 0.00 41.12 41.12 1iaz n ASP 58 CO 0.00 0.00 0.00 0.27 -0.39 0.00 0.00 177.20 177.08 1iaz s ILE 59 N -1.54 0.45 0.38 0.53 -4.36 -1.26 -4.82 121.20 110.57 1iaz s ILE 59 Ca 0.39 -2.00 0.08 0.00 -0.26 0.00 0.00 60.65 58.86 1iaz s ILE 59 Cb 0.23 -2.61 -0.05 0.00 1.25 0.00 0.00 42.46 41.28 1iaz s ILE 59 CO 0.22 0.00 0.10 0.68 0.24 0.00 0.00 174.94 176.18 1iaz s VAL 60 N -3.82 2.51 0.19 8.37 -7.23 -1.26 -4.84 120.40 114.33 1iaz s VAL 60 Ca 0.38 -1.82 -0.30 0.00 -1.81 0.00 0.00 61.98 58.43 1iaz s VAL 60 Cb 0.08 -2.92 -0.09 0.00 0.56 0.00 0.00 36.38 34.01 1iaz s VAL 60 CO 0.14 -0.10 1.30 -0.76 -0.31 0.00 0.00 175.10 175.36 1iaz s LEU 61 N -3.81 4.42 0.23 1.32 1.43 -1.26 -0.60 118.68 120.40 1iaz s LEU 61 Ca 0.38 2.37 -0.31 0.00 -1.03 0.00 0.00 54.13 55.54 1iaz s LEU 61 Cb 0.02 -3.61 -0.11 0.00 0.03 0.00 0.00 46.19 42.52 1iaz s LEU 61 CO 0.21 -0.52 1.62 -2.16 0.23 0.00 0.00 176.35 175.74 1iaz s PRO 62 N -0.05 4.16 0.26 1.29 0.04 -1.26 -4.72 135.00 134.72 1iaz s PRO 62 Ca 0.57 2.51 -0.03 0.00 0.04 0.00 0.00 61.00 64.10 1iaz s PRO 62 Cb -0.36 -3.08 0.43 0.00 0.04 0.00 0.00 34.50 31.53 1iaz s PRO 62 CO 0.38 -0.65 1.84 1.25 0.04 0.00 0.00 177.00 179.85 1iaz h HIS 63 N 6.07 1.04 -3.29 0.56 2.76 -1.92 -3.38 115.15 116.99 1iaz h HIS 63 Ca -0.44 0.03 -0.50 0.00 -2.20 0.00 0.00 60.37 57.25 1iaz h HIS 63 Cb 1.21 -0.33 -0.36 0.00 1.55 0.00 0.00 27.41 29.48 1iaz h HIS 63 CO 0.62 0.47 -0.80 0.21 -1.30 0.00 0.00 177.93 177.14 1iaz s LYS 64 N -6.02 1.44 -0.45 5.26 2.47 -1.26 -0.60 119.74 120.58 1iaz s LYS 64 Ca -0.12 -0.26 0.03 0.00 -1.56 0.00 0.00 55.97 54.06 1iaz s LYS 64 Cb 0.20 -1.41 0.13 0.00 -1.46 0.00 0.00 37.83 35.29 1iaz s LYS 64 CO 0.80 -0.16 0.21 0.08 0.16 0.00 0.00 175.35 176.44 1iaz s VAL 65 N 1.32 1.95 0.88 4.02 1.01 -0.17 -5.00 120.40 124.43 1iaz s VAL 65 Ca -0.03 -2.74 -0.12 0.00 0.00 0.00 0.00 61.98 59.10 1iaz s VAL 65 Cb -0.14 -2.38 0.12 0.00 0.00 0.00 0.00 36.38 33.98 1iaz s VAL 65 CO -0.04 -0.80 1.10 -2.16 0.00 0.00 0.00 175.10 173.21 1iaz s PRO 66 N 0.27 1.37 0.22 2.72 0.04 -1.26 -1.40 135.00 136.96 1iaz s PRO 66 Ca 0.16 0.66 -0.32 0.00 0.04 0.00 0.00 61.00 61.54 1iaz s PRO 66 Cb -0.24 -1.83 -0.12 0.00 0.04 0.00 0.00 34.50 32.34 1iaz s PRO 66 CO -0.03 -2.12 1.64 1.58 0.04 0.00 0.00 177.00 178.10 1iaz n HIS 67 N -3.78 2.64 0.00 0.56 -0.00 -1.26 -1.98 115.22 111.40 1iaz n HIS 67 Ca 0.07 0.17 0.00 0.00 -0.00 0.00 0.00 57.72 57.96 1iaz n HIS 67 Cb 0.56 -2.61 0.00 0.00 -0.00 0.00 0.00 29.99 27.94 1iaz n HIS 67 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 1iaz n GLY 68 N 3.26 0.32 3.54 1.57 0.00 0.58 -5.02 105.19 109.44 1iaz n GLY 68 Ca 0.14 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.88 1iaz n GLY 68 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1iaz s LYS 69 N -0.88 1.96 -0.01 1.61 -0.14 -0.84 -0.25 119.74 121.20 1iaz s LYS 69 Ca 0.00 -1.22 0.08 0.00 -1.36 0.00 0.00 55.97 53.47 1iaz s LYS 69 Cb 0.00 -2.15 -0.02 0.00 -1.68 0.00 0.00 37.83 33.98 1iaz s LYS 69 CO 0.00 0.46 -0.26 0.00 -0.76 0.00 0.00 175.35 174.79 1iaz s ALA 70 N -1.47 2.15 0.10 5.17 0.00 0.79 -0.92 121.76 127.58 1iaz s ALA 70 Ca 0.22 -1.13 -0.04 0.00 0.00 0.00 0.00 51.96 51.01 1iaz s ALA 70 Cb -0.10 -0.53 -0.05 0.00 0.00 0.00 0.00 23.12 22.44 1iaz s ALA 70 CO 0.13 0.53 0.32 -0.48 0.00 0.00 0.00 175.76 176.26 1iaz s LEU 71 N -0.70 4.31 -0.04 0.00 0.05 0.15 -0.51 118.68 121.93 1iaz s LEU 71 Ca 0.10 0.50 0.06 0.00 0.05 0.00 0.00 54.13 54.84 1iaz s LEU 71 Cb -0.10 -3.12 -0.02 0.00 -2.05 0.00 0.00 46.19 40.90 1iaz s LEU 71 CO -0.01 0.11 -0.22 -0.76 -0.55 0.00 0.00 176.35 174.93 1iaz s LEU 72 N -2.48 2.28 0.19 1.48 1.02 0.52 -1.61 118.68 120.08 1iaz s LEU 72 Ca 0.37 -0.40 -0.12 0.00 0.02 0.00 0.00 54.13 54.00 1iaz s LEU 72 Cb -0.13 -1.42 0.00 0.00 0.02 0.00 0.00 46.19 44.67 1iaz s LEU 72 CO 0.24 0.30 0.40 -0.47 0.02 0.00 0.00 176.35 176.84 1iaz s TYR 73 N -0.47 0.25 0.23 0.29 5.04 0.13 -3.38 117.35 119.45 1iaz s TYR 73 Ca 0.06 -0.61 -0.14 0.00 -2.44 0.00 0.00 57.07 53.94 1iaz s TYR 73 Cb -0.11 0.13 0.00 0.00 0.35 0.00 0.00 41.96 42.32 1iaz s TYR 73 CO 0.01 -0.84 0.49 0.54 -1.34 0.00 0.00 175.55 174.41 1iaz s ASN 74 N -2.96 -0.12 0.23 4.32 6.03 -1.26 -0.56 114.94 120.62 1iaz s ASN 74 Ca 0.16 -0.82 -0.18 0.00 -1.03 0.00 0.00 52.86 50.99 1iaz s ASN 74 Cb 0.01 0.58 0.02 0.00 -3.03 0.00 0.00 41.25 38.84 1iaz s ASN 74 CO 0.02 -1.12 0.57 -0.83 -2.03 0.00 0.00 177.10 173.70 1iaz s GLY 75 N -2.98 0.01 0.24 0.45 0.00 -0.53 -4.62 107.32 99.89 1iaz s GLY 75 Ca 0.19 -0.35 -0.20 0.00 0.00 0.00 0.00 44.72 44.36 1iaz s GLY 75 CO 0.06 -0.27 0.98 -0.86 0.00 0.00 0.00 173.10 173.01 1iaz s GLN 76 N -3.91 1.55 1.06 2.90 -2.07 0.32 -0.82 119.66 118.69 1iaz s GLN 76 Ca 0.12 -1.00 -0.14 0.00 -1.82 0.00 0.00 55.36 52.52 1iaz s GLN 76 Cb -0.02 0.43 0.15 0.00 -1.09 0.00 0.00 33.01 32.48 1iaz s GLN 76 CO 0.02 -0.73 0.61 0.36 -1.32 0.00 0.00 175.29 174.23 1iaz n LYS 77 N -0.66 -1.35 -1.53 9.60 -0.00 -0.91 -0.84 118.16 122.47 1iaz n LYS 77 Ca -0.04 -0.36 -0.37 0.00 -0.00 0.00 0.00 58.31 57.54 1iaz n LYS 77 Cb 0.60 -2.00 0.07 0.00 -0.00 0.00 0.00 35.03 33.69 1iaz n LYS 77 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.40 177.15 1iaz n ASP 78 N -3.04 0.64 -4.61 -5.58 8.00 -1.26 -4.10 116.55 106.60 1iaz n ASP 78 Ca 0.05 0.75 -0.43 0.00 0.71 0.00 0.00 54.79 55.87 1iaz n ASP 78 Cb 0.56 -1.40 -0.02 0.00 -0.02 0.00 0.00 41.12 40.24 1iaz n ASP 78 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 1iaz s ARG 79 N -2.98 3.61 0.00 -1.24 0.52 -1.26 -4.79 118.95 112.81 1iaz s ARG 79 Ca 0.76 1.19 0.00 0.00 -0.52 0.00 0.00 55.73 57.15 1iaz s ARG 79 Cb -0.39 -4.04 0.00 0.00 0.52 0.00 0.00 34.95 31.04 1iaz s ARG 79 CO 0.48 -1.52 0.00 0.41 0.02 0.00 0.00 175.30 174.69 1iaz n GLY 80 N 4.97 1.00 0.22 -3.53 0.00 -1.26 -4.88 105.19 101.72 1iaz n GLY 80 Ca 0.18 -1.96 0.15 0.00 0.00 0.00 0.00 46.02 44.38 1iaz n GLY 80 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1iaz h PRO 81 N 6.79 0.00 -6.32 1.61 0.13 -2.03 -3.44 132.00 128.74 1iaz h PRO 81 Ca 0.00 0.00 -0.57 0.00 -0.87 0.00 0.00 66.00 64.56 1iaz h PRO 81 Cb 0.00 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 31.09 1iaz h PRO 81 CO 0.00 0.00 1.06 0.14 -0.23 0.00 0.00 178.00 178.97 1iaz s VAL 82 N -3.42 3.89 -0.11 1.56 -7.23 -1.26 -5.00 120.40 108.83 1iaz s VAL 82 Ca 0.04 1.00 -0.29 0.00 -1.81 0.00 0.00 61.98 60.93 1iaz s VAL 82 Cb 0.08 -3.91 -0.01 0.00 0.56 0.00 0.00 36.38 33.09 1iaz s VAL 82 CO 0.57 -0.39 0.97 0.00 -0.31 0.00 0.00 175.10 175.94 1iaz s ALA 83 N 4.87 3.41 0.04 1.32 0.00 -1.26 -4.39 121.76 125.74 1iaz s ALA 83 Ca 0.65 0.33 0.01 0.00 0.00 0.00 0.00 51.96 52.94 1iaz s ALA 83 Cb -0.21 -3.39 -0.00 0.00 0.00 0.00 0.00 23.12 19.52 1iaz s ALA 83 CO 0.27 -0.59 0.02 0.25 0.00 0.00 0.00 175.76 175.71 1iaz n THR 84 N 4.54 0.00 -3.42 0.00 -2.24 -1.26 -5.01 114.28 106.89 1iaz n THR 84 Ca 0.08 -0.24 -0.06 0.00 -2.27 0.00 0.00 64.05 61.56 1iaz n THR 84 Cb 0.49 0.10 0.01 0.00 -2.10 0.00 0.00 70.33 68.83 1iaz n THR 84 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1iaz n GLY 85 N 0.99 2.65 2.93 3.38 0.00 -1.26 -4.56 105.19 109.33 1iaz n GLY 85 Ca 0.00 -2.19 -0.31 0.00 0.00 0.00 0.00 46.02 43.53 1iaz n GLY 85 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1iaz s ALA 86 N -2.20 2.29 -0.08 4.61 0.00 -0.06 -2.51 121.76 123.82 1iaz s ALA 86 Ca 0.10 -1.94 0.00 0.00 0.00 0.00 0.00 51.96 50.12 1iaz s ALA 86 Cb -0.01 -1.71 0.02 0.00 0.00 0.00 0.00 23.12 21.43 1iaz s ALA 86 CO 0.07 -1.51 -0.06 0.08 0.00 0.00 0.00 175.76 174.33 1iaz s VAL 87 N 1.22 0.80 0.02 0.00 1.01 -0.24 -1.13 120.40 122.09 1iaz s VAL 87 Ca 0.05 -0.21 -0.06 0.00 0.00 0.00 0.00 61.98 61.76 1iaz s VAL 87 Cb -0.19 -0.82 0.02 0.00 0.00 0.00 0.00 36.38 35.39 1iaz s VAL 87 CO -0.11 0.31 0.27 0.61 0.00 0.00 0.00 175.10 176.17 1iaz n GLY 88 N 4.51 0.90 2.86 4.51 0.00 -0.53 0.49 105.19 117.92 1iaz n GLY 88 Ca -0.17 -0.94 -0.12 0.00 0.00 0.00 0.00 46.02 44.79 1iaz n GLY 88 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1iaz s VAL 89 N -2.32 0.00 0.01 1.61 1.01 0.57 -1.60 120.40 119.68 1iaz s VAL 89 Ca 0.06 0.02 0.08 0.00 0.00 0.00 0.00 61.98 62.14 1iaz s VAL 89 Cb -0.00 -0.02 -0.02 0.00 0.00 0.00 0.00 36.38 36.33 1iaz s VAL 89 CO 0.01 0.01 -0.24 -1.48 0.00 0.00 0.00 175.10 173.40 1iaz s LEU 90 N 0.12 2.09 -0.03 3.92 0.05 -0.53 -0.28 118.68 124.03 1iaz s LEU 90 Ca -0.01 -0.48 0.03 0.00 0.05 0.00 0.00 54.13 53.73 1iaz s LEU 90 Cb -0.01 -1.19 -0.00 0.00 -2.05 0.00 0.00 46.19 42.93 1iaz s LEU 90 CO -0.00 0.26 -0.12 0.00 -0.55 0.00 0.00 176.35 175.94 1iaz s ALA 91 N -0.64 1.07 -0.07 1.48 0.00 0.21 -1.22 121.76 122.58 1iaz s ALA 91 Ca 0.09 -0.47 0.04 0.00 0.00 0.00 0.00 51.96 51.62 1iaz s ALA 91 Cb -0.09 -0.35 0.00 0.00 0.00 0.00 0.00 23.12 22.67 1iaz s ALA 91 CO 0.00 0.20 -0.20 0.71 0.00 0.00 0.00 175.76 176.48 1iaz s TYR 92 N 0.05 2.07 -0.33 0.00 1.51 -0.28 -0.93 117.35 119.44 1iaz s TYR 92 Ca -0.01 -0.76 -0.23 0.00 -1.01 0.00 0.00 57.07 55.06 1iaz s TYR 92 Cb -0.08 -1.41 0.00 0.00 -0.11 0.00 0.00 41.96 40.36 1iaz s TYR 92 CO 0.01 -0.30 0.78 -1.17 -1.11 0.00 0.00 175.55 173.75 1iaz s LEU 93 N 0.30 4.10 0.79 -1.29 2.96 0.12 -0.47 118.68 125.19 1iaz s LEU 93 Ca -0.13 0.55 -0.12 0.00 -0.22 0.00 0.00 54.13 54.21 1iaz s LEU 93 Cb -0.16 -3.05 0.07 0.00 0.50 0.00 0.00 46.19 43.55 1iaz s LEU 93 CO 0.06 -0.65 1.11 -0.04 -1.32 0.00 0.00 176.35 175.51 1iaz s MET 94 N 2.99 2.12 0.50 1.98 -1.94 0.47 -0.20 119.30 125.21 1iaz s MET 94 Ca 0.32 0.49 0.19 0.00 -1.71 0.00 0.00 55.69 54.98 1iaz s MET 94 Cb -0.14 -1.93 1.25 0.00 2.01 0.00 0.00 34.83 36.01 1iaz s MET 94 CO 0.14 -1.56 2.02 1.03 -0.01 0.00 0.00 175.02 176.64 1iaz h SER 95 N -1.04 0.12 0.28 3.03 0.87 -1.23 -1.65 113.55 113.93 1iaz h SER 95 Ca -0.47 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.09 1iaz h SER 95 Cb 1.28 -0.02 0.00 0.00 -0.44 0.00 0.00 62.40 63.22 1iaz h SER 95 CO 0.61 0.07 -0.01 -0.90 -0.53 0.00 0.00 176.83 176.08 1iaz n ASP 96 N -4.44 0.05 0.00 6.23 5.75 -1.26 -4.89 116.55 117.98 1iaz n ASP 96 Ca 0.07 -0.60 0.00 0.00 -0.01 0.00 0.00 54.79 54.25 1iaz n ASP 96 Cb 0.42 -0.13 0.00 0.00 -1.03 0.00 0.00 41.12 40.38 1iaz n ASP 96 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1iaz n GLY 97 N 1.15 0.58 3.95 6.12 0.00 -0.62 -5.01 105.19 111.36 1iaz n GLY 97 Ca 0.19 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.98 1iaz n GLY 97 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1iaz s ASN 98 N -2.80 6.30 -0.19 1.61 0.01 -1.26 -2.94 114.94 115.68 1iaz s ASN 98 Ca 0.00 0.35 -0.04 0.00 -0.71 0.00 0.00 52.86 52.46 1iaz s ASN 98 Cb 0.00 -1.99 -0.02 0.00 0.41 0.00 0.00 41.25 39.65 1iaz s ASN 98 CO 0.00 -0.23 -0.03 -0.89 -1.51 0.00 0.00 177.10 174.43 1iaz s THR 99 N -2.22 3.69 -0.26 1.60 2.01 -0.47 -0.40 115.64 119.59 1iaz s THR 99 Ca 0.38 -0.41 -0.22 0.00 0.31 0.00 0.00 61.69 61.75 1iaz s THR 99 Cb -0.09 -2.65 -0.01 0.00 0.01 0.00 0.00 72.50 69.76 1iaz s THR 99 CO 0.34 0.45 0.73 -0.22 -0.69 0.00 0.00 174.62 175.23 1iaz s LEU 100 N 0.90 4.07 -0.04 4.42 1.98 0.37 -0.01 118.68 130.39 1iaz s LEU 100 Ca -0.00 0.83 0.04 0.00 -2.89 0.00 0.00 54.13 52.12 1iaz s LEU 100 Cb -0.15 -3.02 -0.03 0.00 0.66 0.00 0.00 46.19 43.66 1iaz s LEU 100 CO 0.01 -0.46 -0.16 0.00 -1.89 0.00 0.00 176.35 173.85 1iaz s ALA 101 N 2.70 2.61 -0.06 5.97 0.00 0.39 -1.13 121.76 132.23 1iaz s ALA 101 Ca 0.30 -1.01 0.01 0.00 0.00 0.00 0.00 51.96 51.26 1iaz s ALA 101 Cb -0.15 -0.90 0.02 0.00 0.00 0.00 0.00 23.12 22.08 1iaz s ALA 101 CO 0.08 0.56 -0.08 0.08 0.00 0.00 0.00 175.76 176.40 1iaz s VAL 102 N -0.74 0.84 -0.09 0.00 1.01 -0.36 -1.59 120.40 119.47 1iaz s VAL 102 Ca 0.12 -0.27 -0.03 0.00 0.00 0.00 0.00 61.98 61.79 1iaz s VAL 102 Cb -0.11 -0.82 -0.04 0.00 0.00 0.00 0.00 36.38 35.42 1iaz s VAL 102 CO 0.01 0.30 0.04 -0.22 0.00 0.00 0.00 175.10 175.23 1iaz s LEU 103 N 1.01 3.81 -0.01 3.92 2.96 0.31 -1.45 118.68 129.23 1iaz s LEU 103 Ca -0.09 0.23 0.01 0.00 -0.22 0.00 0.00 54.13 54.06 1iaz s LEU 103 Cb -0.14 -1.91 0.01 0.00 0.50 0.00 0.00 46.19 44.64 1iaz s LEU 103 CO -0.00 0.38 -0.03 0.72 -1.32 0.00 0.00 176.35 176.10 1iaz s PHE 104 N -0.94 0.39 -0.17 5.38 -0.12 -0.62 -1.81 117.98 120.08 1iaz s PHE 104 Ca 0.14 -0.07 -0.04 0.00 -0.05 0.00 0.00 56.93 56.91 1iaz s PHE 104 Cb -0.12 -0.31 0.07 0.00 -0.63 0.00 0.00 43.02 42.04 1iaz s PHE 104 CO 0.03 -0.05 0.15 0.45 -0.05 0.00 0.00 175.22 175.75 1iaz s SER 105 N 0.22 1.81 -0.33 1.98 0.15 0.48 -1.46 113.70 116.55 1iaz s SER 105 Ca -0.02 -0.37 0.04 0.00 0.70 0.00 0.00 55.95 56.30 1iaz s SER 105 Cb -0.05 0.05 0.10 0.00 -1.71 0.00 0.00 66.02 64.40 1iaz s SER 105 CO -0.00 -0.33 0.03 -0.69 1.20 0.00 0.00 173.24 173.45 1iaz s VAL 106 N 2.23 2.26 0.72 4.45 1.01 -0.28 -1.52 120.40 129.25 1iaz s VAL 106 Ca 0.04 -2.27 -0.11 0.00 0.00 0.00 0.00 61.98 59.64 1iaz s VAL 106 Cb -0.15 -2.64 0.02 0.00 0.00 0.00 0.00 36.38 33.60 1iaz s VAL 106 CO -0.10 -0.54 1.07 -2.16 0.00 0.00 0.00 175.10 173.37 1iaz s PRO 107 N 0.93 2.73 -0.02 2.72 0.04 -1.26 -0.88 135.00 139.26 1iaz s PRO 107 Ca 0.09 1.04 -0.22 0.00 0.04 0.00 0.00 61.00 61.96 1iaz s PRO 107 Cb -0.19 -1.96 -0.23 0.00 0.04 0.00 0.00 34.50 32.15 1iaz s PRO 107 CO -0.08 -1.27 1.07 -0.92 0.04 0.00 0.00 177.00 175.84 1iaz h TYR 108 N -0.79 0.46 -3.46 0.56 3.20 -1.92 -3.43 116.97 111.60 1iaz h TYR 108 Ca -0.44 -0.25 -0.72 0.00 3.14 0.00 0.00 58.73 60.46 1iaz h TYR 108 Cb 1.22 -0.05 -0.25 0.00 1.54 0.00 0.00 36.73 39.18 1iaz h TYR 108 CO 0.60 1.06 -0.44 0.34 -1.64 0.00 0.00 178.16 178.08 1iaz s ASP 109 N -6.57 5.83 0.00 -2.11 -1.08 -1.26 -4.95 116.67 106.53 1iaz s ASP 109 Ca -0.14 -1.26 0.31 0.00 -0.52 0.00 0.00 52.55 50.93 1iaz s ASP 109 Cb 0.02 -2.06 1.65 0.00 -1.46 0.00 0.00 42.92 41.07 1iaz s ASP 109 CO 0.79 -0.51 2.11 -1.22 0.52 0.00 0.00 175.17 176.86 1iaz n TYR 110 N 5.03 0.00 -0.04 -5.34 4.01 -1.26 -2.33 117.16 117.23 1iaz n TYR 110 Ca -0.11 0.00 -0.06 0.00 -0.16 0.00 0.00 57.90 57.57 1iaz n TYR 110 Cb 0.44 -0.19 0.13 0.00 -0.31 0.00 0.00 39.34 39.41 1iaz n TYR 110 CO 0.00 0.00 0.00 -0.91 -0.46 0.00 0.00 176.86 175.49 1iaz h ASN 111 N 0.00 0.66 -0.00 7.72 2.35 -2.00 -3.33 115.58 120.98 1iaz h ASN 111 Ca 0.00 -0.23 0.00 0.00 -0.55 0.00 0.00 56.30 55.52 1iaz h ASN 111 Cb 0.19 -0.18 0.00 0.00 0.05 0.00 0.00 38.32 38.38 1iaz h ASN 111 CO 0.00 0.89 -0.05 0.79 -1.65 0.00 0.00 177.43 177.41 1iaz n TRP 112 N -4.11 0.00 -4.36 1.19 7.02 -1.22 -5.07 117.44 110.89 1iaz n TRP 112 Ca -0.00 0.00 -0.18 0.00 -1.02 0.00 0.00 57.50 56.30 1iaz n TRP 112 Cb 0.43 0.00 -0.10 0.00 -2.42 0.00 0.00 31.31 29.21 1iaz n TRP 112 CO 0.00 0.00 0.00 0.71 -2.02 0.00 0.00 177.69 176.38 1iaz s TYR 113 N -0.84 1.66 0.19 -5.99 2.02 -0.98 -5.14 117.35 108.26 1iaz s TYR 113 Ca 0.01 -0.96 -0.02 0.00 -0.37 0.00 0.00 57.07 55.73 1iaz s TYR 113 Cb 0.01 -0.99 -0.04 0.00 -0.40 0.00 0.00 41.96 40.54 1iaz s TYR 113 CO 0.05 -0.06 0.13 -1.12 -1.57 0.00 0.00 175.55 172.98 1iaz s SER 114 N -3.35 0.17 0.33 2.29 0.01 -1.26 -4.36 113.70 107.53 1iaz s SER 114 Ca 0.32 -1.32 -0.28 0.00 1.31 0.00 0.00 55.95 55.98 1iaz s SER 114 Cb 0.07 0.37 -0.09 0.00 0.21 0.00 0.00 66.02 66.57 1iaz s SER 114 CO 0.11 -0.83 1.13 0.20 0.41 0.00 0.00 173.24 174.27 1iaz s ASN 115 N -3.12 6.99 0.05 2.44 0.01 -1.26 -4.52 114.94 115.51 1iaz s ASN 115 Ca 0.34 2.31 -0.04 0.00 -0.71 0.00 0.00 52.86 54.76 1iaz s ASN 115 Cb 0.07 -2.62 -0.02 0.00 0.41 0.00 0.00 41.25 39.09 1iaz s ASN 115 CO 0.09 -0.35 0.07 0.26 -1.51 0.00 0.00 177.10 175.66 1iaz s TRP 116 N -1.28 0.28 0.18 2.20 0.52 -0.58 -0.50 118.94 119.77 1iaz s TRP 116 Ca 0.49 -0.67 -0.16 0.00 0.02 0.00 0.00 56.10 55.78 1iaz s TRP 116 Cb -0.31 -0.20 0.02 0.00 -1.15 0.00 0.00 33.47 31.83 1iaz s TRP 116 CO 0.40 -0.39 0.47 1.67 0.02 0.00 0.00 176.95 179.13 1iaz s TRP 117 N -3.08 -0.05 0.06 -1.98 1.48 0.31 -0.38 118.94 115.29 1iaz s TRP 117 Ca -0.01 -0.29 -0.27 0.00 -1.06 0.00 0.00 56.10 54.48 1iaz s TRP 117 Cb 0.02 0.31 0.08 0.00 -1.16 0.00 0.00 33.47 32.71 1iaz s TRP 117 CO -0.07 -0.86 0.68 1.21 -4.06 0.00 0.00 176.95 173.85 1iaz s ASN 118 N -2.88 -0.57 -0.00 -2.66 3.84 -0.75 0.42 114.94 112.34 1iaz s ASN 118 Ca 0.10 0.26 0.01 0.00 0.21 0.00 0.00 52.86 53.43 1iaz s ASN 118 Cb -0.00 0.54 -0.00 0.00 -0.55 0.00 0.00 41.25 41.24 1iaz s ASN 118 CO -0.04 -0.78 -0.03 -0.69 -2.79 0.00 0.00 177.10 172.77 1iaz s VAL 119 N -2.70 0.24 -0.20 -5.21 1.01 -1.26 -0.53 120.40 111.76 1iaz s VAL 119 Ca -0.03 -0.16 -0.27 0.00 0.00 0.00 0.00 61.98 61.52 1iaz s VAL 119 Cb -0.01 -0.22 0.09 0.00 0.00 0.00 0.00 36.38 36.25 1iaz s VAL 119 CO -0.04 0.05 0.83 -0.60 0.00 0.00 0.00 175.10 175.34 1iaz s ARG 120 N -0.12 0.78 -0.27 2.72 3.52 -0.62 -5.01 118.95 119.95 1iaz s ARG 120 Ca 0.01 0.57 -0.10 0.00 -0.13 0.00 0.00 55.73 56.08 1iaz s ARG 120 Cb -0.01 0.37 -0.04 0.00 -1.56 0.00 0.00 34.95 33.70 1iaz s ARG 120 CO -0.00 -0.16 0.16 0.42 -0.81 0.00 0.00 175.30 174.90 1iaz s ILE 121 N -0.30 5.06 0.23 4.11 1.01 -1.26 -0.46 121.20 129.59 1iaz s ILE 121 Ca -0.02 0.09 -0.08 0.00 0.00 0.00 0.00 60.65 60.63 1iaz s ILE 121 Cb -0.03 -3.40 -0.06 0.00 0.01 0.00 0.00 42.46 38.97 1iaz s ILE 121 CO 0.02 0.28 0.52 -0.31 0.00 0.00 0.00 174.94 175.44 1iaz s TYR 122 N 1.69 3.44 0.14 3.97 1.51 0.99 -4.92 117.35 124.18 1iaz s TYR 122 Ca 0.07 0.77 -0.30 0.00 -1.01 0.00 0.00 57.07 56.60 1iaz s TYR 122 Cb -0.16 -2.18 -0.07 0.00 -0.11 0.00 0.00 41.96 39.44 1iaz s TYR 122 CO 0.09 0.27 1.04 0.21 -1.11 0.00 0.00 175.55 176.06 1iaz s LYS 123 N -2.96 4.63 1.05 -0.62 2.20 -1.26 -1.37 119.74 121.41 1iaz s LYS 123 Ca 0.46 1.60 0.00 0.00 -0.36 0.00 0.00 55.97 57.66 1iaz s LYS 123 Cb -0.11 -3.33 0.00 0.00 -1.51 0.00 0.00 37.83 32.88 1iaz s LYS 123 CO 0.24 0.12 0.00 0.41 -0.36 0.00 0.00 175.35 175.76 1iaz n GLY 124 N 2.21 -1.89 3.55 5.54 0.00 -1.24 -4.65 105.19 108.71 1iaz n GLY 124 Ca 0.03 -1.35 -0.43 0.00 0.00 0.00 0.00 46.02 44.27 1iaz n GLY 124 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1iaz s LYS 125 N -0.20 3.46 -0.25 1.61 2.20 -1.15 -2.15 119.74 123.25 1iaz s LYS 125 Ca 0.00 -0.02 0.02 0.00 -0.36 0.00 0.00 55.97 55.60 1iaz s LYS 125 Cb 0.00 -3.92 0.07 0.00 -1.51 0.00 0.00 37.83 32.46 1iaz s LYS 125 CO 0.00 -1.11 -0.05 1.03 -0.36 0.00 0.00 175.35 174.86 1iaz s ARG 126 N 3.34 1.73 0.43 4.03 1.81 -1.26 -5.04 118.95 123.99 1iaz s ARG 126 Ca 0.31 -1.17 -0.25 0.00 -1.72 0.00 0.00 55.73 52.90 1iaz s ARG 126 Cb -0.12 -2.70 -0.08 0.00 -0.45 0.00 0.00 34.95 31.60 1iaz s ARG 126 CO 0.23 -0.64 1.23 1.03 -0.68 0.00 0.00 175.30 176.47 1iaz s ARG 127 N 1.28 3.87 0.39 3.54 1.81 -1.26 -4.95 118.95 123.63 1iaz s ARG 127 Ca -0.04 1.98 -0.27 0.00 -1.72 0.00 0.00 55.73 55.68 1iaz s ARG 127 Cb -0.19 -2.60 -0.09 0.00 -0.45 0.00 0.00 34.95 31.61 1iaz s ARG 127 CO -0.07 -0.52 1.34 0.00 -0.68 0.00 0.00 175.30 175.37 1iaz s ALA 128 N -1.38 3.35 0.19 2.13 0.00 -1.26 -4.87 121.76 119.92 1iaz s ALA 128 Ca 0.60 1.31 -0.09 0.00 0.00 0.00 0.00 51.96 53.77 1iaz s ALA 128 Cb -0.34 -3.51 0.03 0.00 0.00 0.00 0.00 23.12 19.31 1iaz s ALA 128 CO 0.42 -0.85 0.47 -0.40 0.00 0.00 0.00 175.76 175.40 1iaz n ASP 129 N 0.28 -1.19 -0.30 0.00 5.68 -1.26 -4.62 116.55 115.14 1iaz n ASP 129 Ca 0.03 -1.79 0.00 0.00 -0.50 0.00 0.00 54.79 52.53 1iaz n ASP 129 Cb 0.42 1.98 0.13 0.00 -1.14 0.00 0.00 41.12 42.51 1iaz n ASP 129 CO 0.00 0.00 0.00 -0.61 -1.33 0.00 0.00 177.20 175.26 1iaz h GLN 130 N 0.00 0.92 -0.31 0.11 5.75 -1.96 -1.82 115.11 117.80 1iaz h GLN 130 Ca -0.18 -0.06 -0.02 0.00 -0.15 0.00 0.00 58.65 58.24 1iaz h GLN 130 Cb 0.67 -0.21 -0.01 0.00 1.07 0.00 0.00 27.48 29.00 1iaz h GLN 130 CO 0.23 0.61 0.10 -0.09 -2.65 0.00 0.00 178.83 177.03 1iaz h ARG 131 N 0.95 0.48 -0.55 1.69 2.43 -1.97 -0.44 114.38 116.97 1iaz h ARG 131 Ca 0.36 -0.10 -0.05 0.00 -0.81 0.00 0.00 59.98 59.38 1iaz h ARG 131 Cb 0.15 -0.07 -0.03 0.00 -0.42 0.00 0.00 29.97 29.60 1iaz h ARG 131 CO -0.16 0.52 0.14 1.98 -1.51 0.00 0.00 179.97 180.94 1iaz h MET 132 N 0.35 0.84 -0.41 0.20 4.05 -1.84 0.15 114.93 118.28 1iaz h MET 132 Ca 0.10 -0.17 -0.04 0.00 -0.28 0.00 0.00 59.70 59.32 1iaz h MET 132 Cb 0.23 -0.13 -0.02 0.00 -0.80 0.00 0.00 31.60 30.89 1iaz h MET 132 CO -0.00 0.75 0.11 -0.92 0.23 0.00 0.00 176.91 177.07 1iaz h TYR 133 N 0.81 0.67 -0.74 1.39 3.20 -1.11 -1.17 116.97 120.03 1iaz h TYR 133 Ca 0.18 -0.07 -0.01 0.00 3.14 0.00 0.00 58.73 61.96 1iaz h TYR 133 Cb 0.28 -0.19 -0.03 0.00 1.54 0.00 0.00 36.73 38.33 1iaz h TYR 133 CO 0.02 0.63 0.41 0.93 -1.64 0.00 0.00 178.16 178.50 1iaz h GLU 134 N 0.51 1.03 -0.16 1.82 5.08 -0.38 -1.44 114.58 121.04 1iaz h GLU 134 Ca 0.13 -0.12 -0.02 0.00 -1.00 0.00 0.00 59.36 58.35 1iaz h GLU 134 Cb 0.29 -0.20 -0.01 0.00 0.50 0.00 0.00 28.75 29.33 1iaz h GLU 134 CO -0.00 0.77 0.04 0.93 -1.00 0.00 0.00 179.01 179.75 1iaz h GLU 135 N 1.02 0.26 0.00 2.33 5.08 -0.85 0.18 114.58 122.60 1iaz h GLU 135 Ca 0.26 -0.06 -0.06 0.00 -1.00 0.00 0.00 59.36 58.50 1iaz h GLU 135 Cb 0.04 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.24 1iaz h GLU 135 CO -0.04 0.40 -0.29 -0.07 -1.00 0.00 0.00 179.01 178.01 1iaz h LEU 136 N 0.07 0.00 0.00 1.33 3.38 -1.06 0.40 115.31 119.43 1iaz h LEU 136 Ca 0.05 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.01 1iaz h LEU 136 Cb 0.26 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.01 1iaz h LEU 136 CO 0.00 0.29 -0.64 0.00 0.09 0.00 0.00 178.44 178.18 1iaz n TYR 137 N -3.82 0.78 0.08 1.13 9.36 -0.56 -3.88 117.16 120.26 1iaz n TYR 137 Ca -0.01 0.34 -0.15 0.00 3.32 0.00 0.00 57.90 61.39 1iaz n TYR 137 Cb 0.38 -0.75 -0.14 0.00 -0.63 0.00 0.00 39.34 38.20 1iaz n TYR 137 CO 0.00 0.00 0.00 1.88 0.22 0.00 0.00 176.86 178.96 1iaz h TYR 138 N -1.00 0.42 0.03 2.98 0.05 -0.76 -3.39 116.97 115.30 1iaz h TYR 138 Ca -0.02 -0.31 -0.38 0.00 0.05 0.00 0.00 58.73 58.07 1iaz h TYR 138 Cb 0.64 -0.02 -0.05 0.00 1.01 0.00 0.00 36.73 38.31 1iaz h TYR 138 CO -0.24 1.28 -2.19 0.09 -1.05 0.00 0.00 178.16 176.06 1iaz n ASN 139 N -3.47 1.99 -1.88 3.88 3.02 -0.88 -4.73 115.26 113.19 1iaz n ASN 139 Ca -0.11 0.15 -0.18 0.00 -0.03 0.00 0.00 54.58 54.41 1iaz n ASN 139 Cb 1.03 -0.71 0.11 0.00 -0.61 0.00 0.00 39.78 39.59 1iaz n ASN 139 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 1iaz n LEU 140 N -3.74 5.85 -3.40 3.41 7.99 0.13 -4.98 117.00 122.26 1iaz n LEU 140 Ca -0.43 -3.09 -0.22 0.00 -0.01 0.00 0.00 56.01 52.26 1iaz n LEU 140 Cb 0.93 -0.80 0.01 0.00 -0.11 0.00 0.00 43.42 43.46 1iaz n LEU 140 CO 0.23 0.97 -0.09 -1.20 -1.51 0.00 0.00 177.39 175.79 1iaz n SER 141 N -0.51 -6.16 -4.75 -1.43 7.64 -1.26 -4.95 113.62 102.21 1iaz n SER 141 Ca 0.41 -0.28 -0.30 0.00 1.01 0.00 0.00 58.87 59.70 1iaz n SER 141 Cb 1.14 -3.01 0.11 0.00 -1.01 0.00 0.00 64.21 61.44 1iaz n SER 141 CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 1iaz s PRO 142 N -3.40 1.84 0.10 1.43 0.04 -1.25 -5.00 135.00 128.76 1iaz s PRO 142 Ca 0.16 1.00 -0.11 0.00 0.04 0.00 0.00 61.00 62.09 1iaz s PRO 142 Cb -0.02 -1.86 -0.06 0.00 0.04 0.00 0.00 34.50 32.59 1iaz s PRO 142 CO 0.84 -1.88 0.44 -0.06 0.04 0.00 0.00 177.00 176.38 1iaz s PHE 143 N -2.93 3.59 0.39 0.56 0.08 0.17 -4.89 117.98 114.95 1iaz s PHE 143 Ca 0.62 0.85 -0.23 0.00 0.12 0.00 0.00 56.93 58.29 1iaz s PHE 143 Cb -0.17 -2.21 -0.10 0.00 -0.57 0.00 0.00 43.02 39.97 1iaz s PHE 143 CO 0.56 0.49 0.97 1.03 -0.10 0.00 0.00 175.22 178.17 1iaz s ARG 144 N -1.93 4.33 -1.11 0.44 1.81 -1.26 -0.53 118.95 120.70 1iaz s ARG 144 Ca 0.34 1.27 -0.21 0.00 -1.72 0.00 0.00 55.73 55.42 1iaz s ARG 144 Cb -0.14 -2.46 0.07 0.00 -0.45 0.00 0.00 34.95 31.97 1iaz s ARG 144 CO 0.18 0.05 1.50 0.20 -0.68 0.00 0.00 175.30 176.55 1iaz s GLY 145 N -1.87 1.51 -0.14 -3.53 0.00 0.34 -4.68 107.32 98.96 1iaz s GLY 145 Ca 0.57 -2.58 0.18 0.00 0.00 0.00 0.00 44.72 42.90 1iaz s GLY 145 CO 0.20 2.60 1.15 2.09 0.00 0.00 0.00 173.10 179.14 1iaz n ASP 146 N 8.31 2.27 -2.03 1.64 5.75 -1.13 -3.41 116.55 127.95 1iaz n ASP 146 Ca 0.37 -3.15 -0.19 0.00 -0.01 0.00 0.00 54.79 51.81 1iaz n ASP 146 Cb 0.49 -0.44 -0.02 0.00 -1.03 0.00 0.00 41.12 40.12 1iaz n ASP 146 CO 0.00 0.00 0.00 0.59 -0.11 0.00 0.00 177.20 177.68 1iaz n ASN 147 N -1.39 -5.40 -4.17 -1.12 3.02 -0.61 -4.96 115.26 100.62 1iaz n ASN 147 Ca 0.16 0.05 -0.19 0.00 -0.03 0.00 0.00 54.58 54.58 1iaz n ASN 147 Cb 0.65 -4.47 -0.12 0.00 -0.61 0.00 0.00 39.78 35.23 1iaz n ASN 147 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 1iaz s GLY 148 N -2.25 0.85 0.39 7.41 0.00 -1.26 -4.98 107.32 107.47 1iaz s GLY 148 Ca 0.00 -0.96 -0.23 0.00 0.00 0.00 0.00 44.72 43.53 1iaz s GLY 148 CO 0.00 -0.98 0.94 -0.98 0.00 0.00 0.00 173.10 172.08 1iaz s TRP 149 N -1.17 3.45 -0.01 1.90 0.52 -1.26 -4.23 118.94 118.14 1iaz s TRP 149 Ca -0.01 1.67 0.01 0.00 0.02 0.00 0.00 56.10 57.78 1iaz s TRP 149 Cb -0.09 -2.87 0.01 0.00 -1.15 0.00 0.00 33.47 29.36 1iaz s TRP 149 CO 0.02 0.01 -0.01 -1.01 0.02 0.00 0.00 176.95 175.98 1iaz s HIS 150 N -1.97 0.23 -0.07 -1.98 3.76 0.01 -4.95 115.29 110.32 1iaz s HIS 150 Ca 0.57 -0.01 0.02 0.00 -0.15 0.00 0.00 55.06 55.49 1iaz s HIS 150 Cb -0.13 -0.23 -0.03 0.00 1.11 0.00 0.00 32.58 33.31 1iaz s HIS 150 CO 0.17 -0.05 -0.11 0.99 -0.85 0.00 0.00 174.74 174.89 1iaz s THR 151 N 0.36 3.32 -0.14 1.30 2.01 -1.26 -1.21 115.64 120.03 1iaz s THR 151 Ca -0.03 -0.61 -0.07 0.00 0.31 0.00 0.00 61.69 61.29 1iaz s THR 151 Cb -0.06 -2.34 0.06 0.00 0.01 0.00 0.00 72.50 70.17 1iaz s THR 151 CO -0.01 0.58 0.33 -0.60 -0.69 0.00 0.00 174.62 174.23 1iaz s ARG 152 N -0.56 0.28 0.30 4.92 3.52 -0.14 -4.99 118.95 122.28 1iaz s ARG 152 Ca 0.08 0.71 -0.29 0.00 -0.13 0.00 0.00 55.73 56.10 1iaz s ARG 152 Cb -0.12 -0.03 -0.10 0.00 -1.56 0.00 0.00 34.95 33.14 1iaz s ARG 152 CO 0.02 -0.19 1.26 -0.80 -0.81 0.00 0.00 175.30 174.78 1iaz s ASN 153 N 1.60 6.90 -0.00 -2.12 0.01 -1.26 -0.52 114.94 119.56 1iaz s ASN 153 Ca -0.07 2.56 0.13 0.00 -0.71 0.00 0.00 52.86 54.77 1iaz s ASN 153 Cb -0.10 -2.64 -0.15 0.00 0.41 0.00 0.00 41.25 38.77 1iaz s ASN 153 CO -0.11 -0.44 0.55 0.18 -1.51 0.00 0.00 177.10 175.77 1iaz n LEU 154 N 1.12 0.59 0.00 0.60 4.77 0.01 -4.88 117.00 119.20 1iaz n LEU 154 Ca 0.00 -0.47 0.00 0.00 -0.03 0.00 0.00 56.01 55.52 1iaz n LEU 154 Cb 0.43 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.52 1iaz n LEU 154 CO 0.58 0.15 0.00 0.61 -1.33 0.00 0.00 177.39 177.39 1iaz n GLY 155 N 1.34 -2.68 2.15 -0.72 0.00 -1.19 -4.53 105.19 99.56 1iaz n GLY 155 Ca 0.02 -1.88 -0.13 0.00 0.00 0.00 0.00 46.02 44.03 1iaz n GLY 155 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1iaz n TYR 156 N -0.16 -0.73 -1.37 1.61 4.02 -1.26 -0.64 117.16 118.63 1iaz n TYR 156 Ca 0.00 0.00 -0.07 0.00 -0.01 0.00 0.00 57.90 57.82 1iaz n TYR 156 Cb 0.00 -2.66 -0.03 0.00 -0.02 0.00 0.00 39.34 36.63 1iaz n TYR 156 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1iaz n GLY 157 N -0.45 0.80 3.34 2.72 0.00 -1.26 -5.03 105.19 105.32 1iaz n GLY 157 Ca -0.14 -0.69 -0.18 0.00 0.00 0.00 0.00 46.02 45.01 1iaz n GLY 157 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1iaz s LEU 158 N -1.76 2.48 0.09 0.99 1.43 0.18 -1.70 118.68 120.40 1iaz s LEU 158 Ca 0.00 -1.09 -0.01 0.00 -1.03 0.00 0.00 54.13 52.00 1iaz s LEU 158 Cb 0.00 -0.53 -0.04 0.00 0.03 0.00 0.00 46.19 45.65 1iaz s LEU 158 CO 0.00 -0.30 0.02 -1.59 0.23 0.00 0.00 176.35 174.72 1iaz s LYS 159 N -3.72 0.78 -0.03 1.70 -2.85 0.98 -0.81 119.74 115.79 1iaz s LYS 159 Ca 0.24 -1.32 0.05 0.00 -1.00 0.00 0.00 55.97 53.93 1iaz s LYS 159 Cb 0.02 0.23 -0.01 0.00 -2.06 0.00 0.00 37.83 36.01 1iaz s LYS 159 CO 0.07 -0.19 -0.17 0.45 0.10 0.00 0.00 175.35 175.61 1iaz s SER 160 N -2.98 2.05 -0.14 0.03 0.15 0.33 -1.36 113.70 111.77 1iaz s SER 160 Ca 0.16 -0.32 0.02 0.00 0.70 0.00 0.00 55.95 56.50 1iaz s SER 160 Cb 0.08 -0.40 0.01 0.00 -1.71 0.00 0.00 66.02 64.00 1iaz s SER 160 CO -0.04 0.18 -0.19 -0.13 1.20 0.00 0.00 173.24 174.26 1iaz s ARG 161 N -0.17 2.69 0.09 5.44 0.52 -0.63 -0.97 118.95 125.92 1iaz s ARG 161 Ca 0.01 -0.73 0.00 0.00 -0.52 0.00 0.00 55.73 54.50 1iaz s ARG 161 Cb -0.09 -2.26 -0.04 0.00 0.52 0.00 0.00 34.95 33.08 1iaz s ARG 161 CO 0.01 -0.09 -0.03 0.20 0.02 0.00 0.00 175.30 175.41 1iaz s GLY 162 N 1.03 0.69 -0.04 -3.53 0.00 -0.35 -0.40 107.32 104.72 1iaz s GLY 162 Ca -0.03 -1.32 -0.04 0.00 0.00 0.00 0.00 44.72 43.33 1iaz s GLY 162 CO -0.05 -1.39 0.12 -0.12 0.00 0.00 0.00 173.10 171.66 1iaz s PHE 163 N -3.81 -0.13 -0.06 1.90 2.19 0.98 -0.81 117.98 118.25 1iaz s PHE 163 Ca 0.12 0.31 -0.05 0.00 0.33 0.00 0.00 56.93 57.64 1iaz s PHE 163 Cb 0.07 0.04 0.01 0.00 -1.31 0.00 0.00 43.02 41.83 1iaz s PHE 163 CO -0.06 -0.06 0.15 1.41 1.83 0.00 0.00 175.22 178.49 1iaz s MET 164 N 0.11 0.19 0.41 10.12 1.75 -1.26 -0.20 119.30 130.42 1iaz s MET 164 Ca -0.00 0.19 -0.05 0.00 -1.25 0.00 0.00 55.69 54.58 1iaz s MET 164 Cb -0.01 0.09 0.09 0.00 2.84 0.00 0.00 34.83 37.84 1iaz s MET 164 CO -0.00 -0.02 0.57 0.27 -0.65 0.00 0.00 175.02 175.18 1iaz n ASN 165 N 2.95 0.29 -0.53 1.11 6.94 -0.94 -1.58 115.26 123.50 1iaz n ASN 165 Ca -0.13 -1.35 0.08 0.00 -0.02 0.00 0.00 54.58 53.16 1iaz n ASN 165 Cb 0.59 -0.41 0.04 0.00 -2.36 0.00 0.00 39.78 37.64 1iaz n ASN 165 CO 0.00 0.00 0.00 -1.54 -1.03 0.00 0.00 177.26 174.69 1iaz n SER 166 N -3.22 2.05 -4.95 0.53 3.41 -1.22 -4.33 113.62 105.88 1iaz n SER 166 Ca 0.08 -1.52 -0.24 0.00 -0.26 0.00 0.00 58.87 56.93 1iaz n SER 166 Cb 0.28 0.17 0.04 0.00 -0.26 0.00 0.00 64.21 64.44 1iaz n SER 166 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 1iaz s SER 167 N -1.50 5.21 0.54 4.04 0.15 -1.26 -4.63 113.70 116.26 1iaz s SER 167 Ca 0.16 0.29 0.35 0.00 0.70 0.00 0.00 55.95 57.45 1iaz s SER 167 Cb 0.13 -1.14 1.60 0.00 -1.71 0.00 0.00 66.02 64.90 1iaz s SER 167 CO 0.26 -1.25 2.04 1.23 1.20 0.00 0.00 173.24 176.73 1iaz h GLY 168 N -0.17 0.00 -7.60 9.45 0.00 -1.91 -3.17 103.07 99.67 1iaz h GLY 168 Ca -0.44 0.00 -0.77 0.00 0.00 0.00 0.00 47.33 46.13 1iaz h GLY 168 CO 0.57 0.00 0.15 0.30 0.00 0.00 0.00 176.54 177.55 1iaz s HIS 169 N -3.75 3.95 0.26 5.60 3.76 -1.26 -1.57 115.29 122.28 1iaz s HIS 169 Ca -0.00 -2.55 -0.15 0.00 -0.15 0.00 0.00 55.06 52.20 1iaz s HIS 169 Cb 0.10 -3.65 -0.08 0.00 1.11 0.00 0.00 32.58 30.06 1iaz s HIS 169 CO 0.47 -0.91 0.68 0.00 -0.85 0.00 0.00 174.74 174.14 1iaz s ALA 170 N -0.72 3.42 -0.08 -1.40 0.00 -0.27 -4.97 121.76 117.75 1iaz s ALA 170 Ca 0.25 0.00 0.01 0.00 0.00 0.00 0.00 51.96 52.22 1iaz s ALA 170 Cb -0.11 -2.70 0.02 0.00 0.00 0.00 0.00 23.12 20.33 1iaz s ALA 170 CO -0.09 0.37 -0.08 0.42 0.00 0.00 0.00 175.76 176.39 1iaz s ILE 171 N -1.77 0.89 -0.15 0.00 1.01 -1.26 -1.15 121.20 118.76 1iaz s ILE 171 Ca 0.48 -0.27 -0.00 0.00 0.00 0.00 0.00 60.65 60.86 1iaz s ILE 171 Cb -0.13 -0.88 0.03 0.00 0.01 0.00 0.00 42.46 41.49 1iaz s ILE 171 CO 0.19 0.32 -0.09 -0.22 0.00 0.00 0.00 174.94 175.15 1iaz s LEU 172 N 1.22 1.59 -0.05 2.97 2.96 -0.58 -2.21 118.68 124.58 1iaz s LEU 172 Ca -0.05 -0.54 0.04 0.00 -0.22 0.00 0.00 54.13 53.35 1iaz s LEU 172 Cb -0.14 -1.00 0.00 0.00 0.50 0.00 0.00 46.19 45.56 1iaz s LEU 172 CO -0.02 -0.13 -0.16 -1.83 -1.32 0.00 0.00 176.35 172.89 1iaz s GLU 173 N 1.59 1.79 0.00 1.98 -1.05 0.72 -0.86 118.70 122.87 1iaz s GLU 173 Ca 0.03 -0.56 0.03 0.00 -0.15 0.00 0.00 54.97 54.32 1iaz s GLU 173 Cb -0.14 -1.52 -0.01 0.00 -0.44 0.00 0.00 34.13 32.02 1iaz s GLU 173 CO -0.09 0.18 -0.09 0.42 0.95 0.00 0.00 175.26 176.63 1iaz s ILE 174 N 0.21 0.71 -0.16 1.83 1.01 -0.23 -0.01 121.20 124.56 1iaz s ILE 174 Ca -0.07 -0.48 0.01 0.00 0.00 0.00 0.00 60.65 60.11 1iaz s ILE 174 Cb -0.13 -0.61 0.02 0.00 0.01 0.00 0.00 42.46 41.75 1iaz s ILE 174 CO 0.03 0.13 -0.17 -1.00 0.00 0.00 0.00 174.94 173.93 1iaz s HIS 175 N -0.35 2.42 -0.29 3.97 3.76 0.47 -0.69 115.29 124.58 1iaz s HIS 175 Ca 0.02 -1.37 -0.11 0.00 -0.15 0.00 0.00 55.06 53.45 1iaz s HIS 175 Cb -0.04 -1.72 -0.04 0.00 1.11 0.00 0.00 32.58 31.88 1iaz s HIS 175 CO -0.00 -0.70 0.20 0.08 -0.85 0.00 0.00 174.74 173.47 1iaz s VAL 176 N 1.31 5.30 0.33 -0.90 1.01 -0.34 -1.61 120.40 125.51 1iaz s VAL 176 Ca 0.03 0.08 0.05 0.00 0.00 0.00 0.00 61.98 62.14 1iaz s VAL 176 Cb -0.13 -3.57 -0.03 0.00 0.00 0.00 0.00 36.38 32.64 1iaz s VAL 176 CO -0.10 0.19 0.22 -0.94 0.00 0.00 0.00 175.10 174.47 1iaz s SER 177 N 1.75 1.72 0.26 3.32 1.04 -0.47 -0.65 113.70 120.67 1iaz s SER 177 Ca 0.07 -1.68 -0.30 0.00 0.48 0.00 0.00 55.95 54.52 1iaz s SER 177 Cb -0.16 0.51 -0.10 0.00 0.10 0.00 0.00 66.02 66.36 1iaz s SER 177 CO 0.11 -0.99 1.47 -0.75 0.98 0.00 0.00 173.24 174.06 1iaz s LYS 178 N -3.62 4.23 0.00 4.02 2.20 -1.25 -0.01 119.74 125.31 1iaz s LYS 178 Ca 0.37 2.36 0.09 0.00 -0.36 0.00 0.00 55.97 58.42 1iaz s LYS 178 Cb 0.03 -3.09 0.51 0.00 -1.51 0.00 0.00 37.83 33.77 1iaz s LYS 178 CO 0.22 -0.47 0.96 0.00 -0.36 0.00 0.00 175.35 175.70