#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ivz s SER 2 N 0.00 0.33 -0.41 1.61 0.01 -1.26 -5.12 113.70 108.86 1ivz s SER 2 Ca 0.00 -0.78 0.03 0.00 1.31 0.00 0.00 55.95 56.51 1ivz s SER 2 Cb 0.00 0.22 0.16 0.00 0.21 0.00 0.00 66.02 66.61 1ivz s SER 2 CO 0.00 -0.57 0.31 -0.44 0.41 0.00 0.00 173.24 172.96 1ivz s SER 3 N -2.56 2.07 0.03 2.44 0.01 -1.26 -5.00 113.70 109.43 1ivz s SER 3 Ca 0.01 -2.88 -0.26 0.00 1.31 0.00 0.00 55.95 54.14 1ivz s SER 3 Cb 0.03 -0.52 -0.17 0.00 0.21 0.00 0.00 66.02 65.58 1ivz s SER 3 CO -0.08 -0.20 1.43 1.23 0.41 0.00 0.00 173.24 176.02 1ivz h GLY 4 N 6.00 -0.29 -2.69 3.44 0.00 -2.11 -3.44 103.07 103.99 1ivz h GLY 4 Ca 0.20 0.11 -0.55 0.00 0.00 0.00 0.00 47.33 47.09 1ivz h GLY 4 CO 0.37 -0.11 0.58 -1.35 0.00 0.00 0.00 176.54 176.04 1ivz s SER 5 N -5.15 5.30 -0.28 0.19 1.04 -1.26 -5.03 113.70 108.51 1ivz s SER 5 Ca -0.15 2.69 -0.23 0.00 0.48 0.00 0.00 55.95 58.75 1ivz s SER 5 Cb 0.03 -2.63 0.10 0.00 0.10 0.00 0.00 66.02 63.62 1ivz s SER 5 CO 0.61 -1.54 0.85 -0.55 0.98 0.00 0.00 173.24 173.58 1ivz s SER 6 N -1.06 -0.65 -0.38 7.02 0.15 -1.26 -5.13 113.70 112.39 1ivz s SER 6 Ca 0.72 1.20 0.07 0.00 0.70 0.00 0.00 55.95 58.65 1ivz s SER 6 Cb -0.39 1.23 0.18 0.00 -1.71 0.00 0.00 66.02 65.34 1ivz s SER 6 CO 0.45 -0.20 0.61 -0.83 1.20 0.00 0.00 173.24 174.47 1ivz s GLY 7 N 0.60 -1.24 0.28 9.45 0.00 -1.26 -5.16 107.32 109.99 1ivz s GLY 7 Ca -0.01 0.41 0.03 0.00 0.00 0.00 0.00 44.72 45.15 1ivz s GLY 7 CO -0.06 3.65 0.28 1.44 0.00 0.00 0.00 173.10 178.41 1ivz n SER 8 N 4.68 1.55 -3.29 1.64 7.64 -1.26 -5.13 113.62 119.45 1ivz n SER 8 Ca 0.09 -1.87 -0.06 0.00 1.01 0.00 0.00 58.87 58.04 1ivz n SER 8 Cb 0.56 -0.09 -0.05 0.00 -1.01 0.00 0.00 64.21 63.61 1ivz n SER 8 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 1ivz s SER 9 N -2.68 -0.13 -0.05 6.43 0.01 -1.26 -4.98 113.70 111.04 1ivz s SER 9 Ca 0.21 0.13 0.02 0.00 1.31 0.00 0.00 55.95 57.62 1ivz s SER 9 Cb -0.02 1.36 0.01 0.00 0.21 0.00 0.00 66.02 67.58 1ivz s SER 9 CO 0.13 -0.31 -0.10 -0.94 0.41 0.00 0.00 173.24 172.43 1ivz s SER 10 N 2.62 1.47 0.26 2.44 1.04 -1.18 -4.95 113.70 115.40 1ivz s SER 10 Ca 0.13 -0.24 0.07 0.00 0.48 0.00 0.00 55.95 56.39 1ivz s SER 10 Cb -0.14 -0.59 -0.04 0.00 0.10 0.00 0.00 66.02 65.35 1ivz s SER 10 CO -0.22 0.03 0.20 -0.94 0.98 0.00 0.00 173.24 173.29 1ivz s SER 11 N 0.54 5.44 0.16 7.02 1.04 -1.26 -4.36 113.70 122.28 1ivz s SER 11 Ca -0.10 -0.31 0.11 0.00 0.48 0.00 0.00 55.95 56.13 1ivz s SER 11 Cb -0.13 -1.32 -0.04 0.00 0.10 0.00 0.00 66.02 64.63 1ivz s SER 11 CO 0.02 -0.08 -0.25 0.00 0.98 0.00 0.00 173.24 173.92 1ivz s GLN 12 N -3.85 1.42 -0.09 4.02 0.00 -1.25 -4.99 119.66 114.92 1ivz s GLN 12 Ca 0.34 -1.42 0.03 0.00 -0.00 0.00 0.00 55.36 54.32 1ivz s GLN 12 Cb -0.07 -1.79 -0.01 0.00 0.00 0.00 0.00 33.01 31.13 1ivz s GLN 12 CO 0.25 0.41 -0.19 -1.01 0.00 0.00 0.00 175.29 174.74 1ivz s HIS 13 N -1.40 2.62 -0.29 9.60 3.76 -1.26 -2.47 115.29 125.86 1ivz s HIS 13 Ca 0.16 -0.66 0.01 0.00 -0.15 0.00 0.00 55.06 54.43 1ivz s HIS 13 Cb -0.09 -1.70 0.08 0.00 1.11 0.00 0.00 32.58 31.98 1ivz s HIS 13 CO 0.08 -0.18 0.01 -0.06 -0.85 0.00 0.00 174.74 173.74 1ivz s PHE 14 N -0.01 2.68 -0.29 1.40 0.08 -1.06 -1.72 117.98 119.06 1ivz s PHE 14 Ca -0.06 -2.16 -0.34 0.00 0.12 0.00 0.00 56.93 54.48 1ivz s PHE 14 Cb -0.15 -2.05 -0.11 0.00 -0.57 0.00 0.00 43.02 40.15 1ivz s PHE 14 CO 0.05 -0.86 2.13 0.09 -0.10 0.00 0.00 175.22 176.53 1ivz n ASN 15 N 4.58 2.47 -4.53 1.36 5.03 0.22 0.12 115.26 124.50 1ivz n ASN 15 Ca -0.05 0.49 -0.40 0.00 0.87 0.00 0.00 54.58 55.49 1ivz n ASN 15 Cb 0.43 -1.31 -0.10 0.00 -1.02 0.00 0.00 39.78 37.78 1ivz n ASN 15 CO 0.00 0.00 0.00 -0.22 -1.83 0.00 0.00 177.26 175.21 1ivz s LEU 16 N 6.83 4.50 -0.01 3.41 2.96 0.17 -1.97 118.68 134.58 1ivz s LEU 16 Ca 1.06 -0.37 0.04 0.00 -0.22 0.00 0.00 54.13 54.64 1ivz s LEU 16 Cb -0.78 -2.21 -0.01 0.00 0.50 0.00 0.00 46.19 43.70 1ivz s LEU 16 CO 0.48 -0.27 -0.12 0.20 -1.32 0.00 0.00 176.35 175.32 1ivz s ASN 17 N 1.73 1.44 -0.30 3.68 -0.87 -1.09 0.96 114.94 120.49 1ivz s ASN 17 Ca 0.08 -0.23 -0.17 0.00 -1.57 0.00 0.00 52.86 50.97 1ivz s ASN 17 Cb -0.17 -0.16 0.20 0.00 -0.02 0.00 0.00 41.25 41.11 1ivz s ASN 17 CO 0.11 0.15 1.25 0.72 -2.57 0.00 0.00 177.10 176.76 1ivz s PHE 18 N -0.31 -0.10 0.12 2.20 -0.71 -1.02 -1.44 117.98 116.72 1ivz s PHE 18 Ca 0.05 0.19 -0.25 0.00 -1.04 0.00 0.00 56.93 55.88 1ivz s PHE 18 Cb -0.05 0.06 -0.07 0.00 -1.21 0.00 0.00 43.02 41.75 1ivz s PHE 18 CO -0.00 -0.05 0.75 0.99 -1.34 0.00 0.00 175.22 175.57 1ivz s THR 19 N 1.29 4.50 -0.16 -4.49 2.01 -1.26 -2.14 115.64 115.38 1ivz s THR 19 Ca -0.06 1.63 -0.05 0.00 0.31 0.00 0.00 61.69 63.52 1ivz s THR 19 Cb -0.02 -4.11 -0.03 0.00 0.01 0.00 0.00 72.50 68.35 1ivz s THR 19 CO -0.11 0.49 0.00 -0.63 -0.69 0.00 0.00 174.62 173.67 1ivz s ILE 20 N -0.87 4.24 -0.38 1.82 1.01 -0.51 -2.92 121.20 123.60 1ivz s ILE 20 Ca 0.36 -0.23 0.11 0.00 0.00 0.00 0.00 60.65 60.88 1ivz s ILE 20 Cb -0.22 -2.88 0.66 0.00 0.01 0.00 0.00 42.46 40.03 1ivz s ILE 20 CO 0.25 0.48 1.54 0.35 0.00 0.00 0.00 174.94 177.56 1ivz n THR 21 N 3.49 2.30 -0.04 2.92 -2.24 -0.77 -1.89 114.28 118.06 1ivz n THR 21 Ca -0.17 -1.17 -0.04 0.00 -2.27 0.00 0.00 64.05 60.40 1ivz n THR 21 Cb 0.52 -0.34 -0.05 0.00 -2.10 0.00 0.00 70.33 68.36 1ivz n THR 21 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 1ivz n ASN 22 N 0.40 3.31 -4.46 3.42 5.15 -1.04 -4.87 115.26 117.16 1ivz n ASN 22 Ca 0.25 -0.01 -0.43 0.00 -0.60 0.00 0.00 54.58 53.79 1ivz n ASN 22 Cb 1.06 0.57 -0.05 0.00 -0.53 0.00 0.00 39.78 40.82 1ivz n ASN 22 CO 0.00 0.00 0.00 -0.22 1.40 0.00 0.00 177.26 178.44 1ivz s LEU 23 N -4.63 4.74 0.15 1.20 1.98 -1.26 -5.00 118.68 115.86 1ivz s LEU 23 Ca -0.04 -0.80 -0.31 0.00 -2.89 0.00 0.00 54.13 50.09 1ivz s LEU 23 Cb 0.02 -2.54 -0.09 0.00 0.66 0.00 0.00 46.19 44.25 1ivz s LEU 23 CO 0.27 -1.02 1.44 -2.16 -1.89 0.00 0.00 176.35 173.00 1ivz s PRO 24 N 3.04 4.29 0.68 0.98 0.04 -1.26 -3.51 135.00 139.26 1ivz s PRO 24 Ca 0.19 2.18 -0.16 0.00 0.04 0.00 0.00 61.00 63.26 1ivz s PRO 24 Cb -0.18 -3.20 0.01 0.00 0.04 0.00 0.00 34.50 31.17 1ivz s PRO 24 CO 0.13 -0.48 1.18 -0.47 0.04 0.00 0.00 177.00 177.41 1ivz s TYR 25 N 0.97 2.27 0.15 0.56 5.04 -1.20 -4.95 117.35 120.19 1ivz s TYR 25 Ca 0.65 1.57 -0.24 0.00 -2.44 0.00 0.00 57.07 56.62 1ivz s TYR 25 Cb -0.39 -3.39 0.07 0.00 0.35 0.00 0.00 41.96 38.59 1ivz s TYR 25 CO 0.32 -2.27 0.72 -1.12 -1.34 0.00 0.00 175.55 171.85 1ivz s SER 26 N -2.10 -0.43 0.49 4.32 0.01 -1.26 -4.98 113.70 109.75 1ivz s SER 26 Ca 0.73 -0.16 0.14 0.00 1.31 0.00 0.00 55.95 57.97 1ivz s SER 26 Cb -0.27 0.57 1.18 0.00 0.21 0.00 0.00 66.02 67.71 1ivz s SER 26 CO 0.42 -0.97 2.13 -0.61 0.41 0.00 0.00 173.24 174.61 1ivz h GLN 27 N 2.00 0.13 -0.30 12.44 -0.00 -1.97 -2.11 115.11 125.30 1ivz h GLN 27 Ca -0.28 -0.01 -0.12 0.00 -0.00 0.00 0.00 58.65 58.25 1ivz h GLN 27 Cb 1.28 -0.03 -0.01 0.00 0.00 0.00 0.00 27.48 28.72 1ivz h GLN 27 CO 0.32 0.08 -0.28 -0.44 0.00 0.00 0.00 178.83 178.52 1ivz h ASP 28 N 0.13 0.77 0.29 -0.69 5.19 -1.96 -2.82 116.42 117.33 1ivz h ASP 28 Ca 0.04 -0.46 0.00 0.00 -0.62 0.00 0.00 57.03 55.99 1ivz h ASP 28 Cb 0.00 -0.22 0.00 0.00 0.18 0.00 0.00 39.33 39.30 1ivz h ASP 28 CO -0.01 1.07 0.00 0.40 -3.12 0.00 0.00 179.24 177.58 1ivz h ILE 29 N 0.47 0.00 -0.78 0.35 1.08 -1.70 -1.83 117.51 115.10 1ivz h ILE 29 Ca 0.05 -0.12 -0.36 0.00 -0.39 0.00 0.00 64.86 64.04 1ivz h ILE 29 Cb 0.84 0.88 -0.22 0.00 -3.07 0.00 0.00 36.82 35.26 1ivz h ILE 29 CO 0.07 0.00 0.46 0.00 -0.69 0.00 0.00 178.15 177.99 1ivz n ALA 30 N -1.91 4.87 -3.15 1.87 0.00 -1.06 -4.77 120.51 116.35 1ivz n ALA 30 Ca -0.01 -2.30 0.05 0.00 0.00 0.00 0.00 53.44 51.19 1ivz n ALA 30 Cb 0.12 -1.33 -0.01 0.00 0.00 0.00 0.00 19.45 18.23 1ivz n ALA 30 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 1ivz s GLN 31 N -2.72 0.26 0.64 0.00 -1.52 -0.69 -5.02 119.66 110.61 1ivz s GLN 31 Ca 0.47 0.45 0.31 0.00 -1.95 0.00 0.00 55.36 54.64 1ivz s GLN 31 Cb 0.39 0.25 1.66 0.00 -0.22 0.00 0.00 33.01 35.09 1ivz s GLN 31 CO 0.10 -0.29 1.97 -1.35 -0.25 0.00 0.00 175.29 175.47 1ivz h PRO 32 N 7.97 0.00 -0.64 2.91 0.11 -1.86 -1.12 132.00 139.37 1ivz h PRO 32 Ca -0.15 0.00 0.10 0.00 0.11 0.00 0.00 66.00 66.06 1ivz h PRO 32 Cb 1.17 0.00 -0.04 0.00 0.11 0.00 0.00 31.00 32.24 1ivz h PRO 32 CO -0.03 0.00 0.43 1.03 -0.21 0.00 0.00 178.00 179.22 1ivz h SER 33 N 0.00 0.42 -4.37 -2.05 0.87 -1.95 -3.43 113.55 103.05 1ivz h SER 33 Ca 0.05 0.01 -0.49 0.00 -1.23 0.00 0.00 61.79 60.14 1ivz h SER 33 Cb 0.70 -0.08 0.10 0.00 -0.44 0.00 0.00 62.40 62.69 1ivz h SER 33 CO -0.00 0.25 0.37 0.42 -0.53 0.00 0.00 176.83 177.34 1ivz s THR 34 N -5.44 3.17 0.05 2.23 -4.23 -0.43 -4.99 115.64 106.00 1ivz s THR 34 Ca -0.08 0.38 0.09 0.00 -1.18 0.00 0.00 61.69 60.90 1ivz s THR 34 Cb 0.20 -3.22 -0.19 0.00 1.34 0.00 0.00 72.50 70.62 1ivz s THR 34 CO 0.76 -0.50 1.11 0.74 -0.54 0.00 0.00 174.62 176.19 1ivz h THR 35 N -0.94 1.37 -0.18 3.99 2.02 -1.87 -3.29 112.91 114.01 1ivz h THR 35 Ca -0.46 -3.09 0.05 0.00 0.77 0.00 0.00 66.41 63.68 1ivz h THR 35 Cb 1.27 2.67 -0.01 0.00 -1.74 0.00 0.00 68.15 70.34 1ivz h THR 35 CO 0.61 0.78 0.13 0.50 0.37 0.00 0.00 175.52 177.91 1ivz h LYS 36 N 0.00 0.00 0.23 6.66 3.64 -1.92 0.17 116.57 125.35 1ivz h LYS 36 Ca -0.09 -0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.28 1ivz h LYS 36 Cb 1.80 -0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.62 1ivz h LYS 36 CO 0.11 0.00 -0.11 -0.92 -2.27 0.00 0.00 179.45 176.26 1ivz h TYR 37 N 0.00 -0.29 -0.77 1.91 3.20 -1.74 -2.39 116.97 116.89 1ivz h TYR 37 Ca 0.08 -0.01 -0.02 0.00 3.14 0.00 0.00 58.73 61.93 1ivz h TYR 37 Cb 0.34 0.09 -0.04 0.00 1.54 0.00 0.00 36.73 38.67 1ivz h TYR 37 CO -0.00 0.08 0.40 1.96 -1.64 0.00 0.00 178.16 178.97 1ivz h GLN 38 N -0.91 1.08 0.77 1.82 4.20 -1.60 0.22 115.11 120.69 1ivz h GLN 38 Ca -0.03 -0.13 -0.04 0.00 0.06 0.00 0.00 58.65 58.51 1ivz h GLN 38 Cb 0.50 -0.21 0.01 0.00 0.30 0.00 0.00 27.48 28.08 1ivz h GLN 38 CO 0.05 0.81 -0.37 1.96 -0.67 0.00 0.00 178.83 180.61 1ivz h GLN 39 N 1.09 -0.99 -0.63 1.46 4.20 -0.74 0.11 115.11 119.61 1ivz h GLN 39 Ca 0.27 0.07 -0.07 0.00 0.06 0.00 0.00 58.65 58.98 1ivz h GLN 39 Cb 0.06 0.23 -0.03 0.00 0.30 0.00 0.00 27.48 28.04 1ivz h GLN 39 CO -0.04 -0.66 0.12 1.15 -0.67 0.00 0.00 178.83 178.73 1ivz h THR 40 N -1.03 1.25 -0.64 -0.54 2.02 -1.33 -2.26 112.91 110.38 1ivz h THR 40 Ca -0.11 -0.96 0.00 0.00 0.77 0.00 0.00 66.41 66.11 1ivz h THR 40 Cb 0.79 0.64 -0.03 0.00 -1.74 0.00 0.00 68.15 67.81 1ivz h THR 40 CO 0.17 0.36 0.41 0.50 0.37 0.00 0.00 175.52 177.33 1ivz h LYS 41 N 0.95 0.86 -0.26 6.66 3.64 -0.44 -1.76 116.57 126.22 1ivz h LYS 41 Ca 0.20 -0.06 -0.20 0.00 -1.27 0.00 0.00 60.65 59.32 1ivz h LYS 41 Cb 0.39 -0.19 0.00 0.00 -0.41 0.00 0.00 32.23 32.02 1ivz h LYS 41 CO 0.01 0.58 -0.61 -0.09 -2.27 0.00 0.00 179.45 177.07 1ivz h ARG 42 N 0.88 0.86 -0.38 1.90 9.65 -0.58 -1.96 114.38 124.75 1ivz h ARG 42 Ca 0.23 -0.59 -0.00 0.00 -1.10 0.00 0.00 59.98 58.52 1ivz h ARG 42 Cb -0.07 0.08 -0.02 0.00 -1.39 0.00 0.00 29.97 28.58 1ivz h ARG 42 CO -0.05 1.22 0.22 1.03 2.80 0.00 0.00 179.97 185.19 1ivz h SER 43 N 0.64 0.46 -0.50 -3.80 0.87 -0.91 0.76 113.55 111.08 1ivz h SER 43 Ca -0.00 -0.07 -0.11 0.00 -1.23 0.00 0.00 61.79 60.39 1ivz h SER 43 Cb 1.23 -0.12 -0.02 0.00 -0.44 0.00 0.00 62.40 63.05 1ivz h SER 43 CO 0.13 0.39 -0.10 0.40 -0.53 0.00 0.00 176.83 177.13 1ivz h ILE 44 N 0.49 1.27 -0.03 2.23 2.04 -1.36 -1.20 117.51 120.96 1ivz h ILE 44 Ca 0.14 -1.23 -0.07 0.00 1.00 0.00 0.00 64.86 64.69 1ivz h ILE 44 Cb 0.02 1.03 -0.01 0.00 -0.74 0.00 0.00 36.82 37.13 1ivz h ILE 44 CO -0.02 0.43 -0.32 -0.33 0.00 0.00 0.00 178.15 177.91 1ivz h GLU 45 N 0.81 0.05 -0.01 2.37 4.39 -1.11 -1.58 114.58 119.51 1ivz h GLU 45 Ca 0.13 -0.02 -0.08 0.00 0.34 0.00 0.00 59.36 59.74 1ivz h GLU 45 Cb 0.65 -0.00 0.01 0.00 -0.10 0.00 0.00 28.75 29.30 1ivz h GLU 45 CO 0.04 0.37 -0.29 -0.97 -1.16 0.00 0.00 179.01 177.00 1ivz h ASN 46 N 0.05 0.27 -0.68 1.42 -0.73 -0.59 -2.41 115.58 112.91 1ivz h ASN 46 Ca 0.00 -0.76 -0.02 0.00 1.87 0.00 0.00 56.30 57.40 1ivz h ASN 46 Cb 0.58 -0.08 -0.03 0.00 0.27 0.00 0.00 38.32 39.06 1ivz h ASN 46 CO 0.04 1.00 0.36 0.00 -0.37 0.00 0.00 177.43 178.46 1ivz h ALA 47 N 0.28 0.87 -0.15 1.57 0.00 -1.13 -2.47 119.26 118.23 1ivz h ALA 47 Ca -0.04 -0.12 -0.10 0.00 0.00 0.00 0.00 54.91 54.66 1ivz h ALA 47 Cb 1.04 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 18.54 1ivz h ALA 47 CO 0.06 0.40 -0.35 -0.07 0.00 0.00 0.00 179.25 179.28 1ivz h LEU 48 N 0.94 0.31 0.32 0.00 3.38 -1.38 -2.80 115.31 116.08 1ivz h LEU 48 Ca 0.24 -0.12 -0.01 0.00 0.09 0.00 0.00 57.88 58.08 1ivz h LEU 48 Cb 0.06 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 40.71 1ivz h LEU 48 CO -0.04 0.65 -0.28 -1.13 0.09 0.00 0.00 178.44 177.73 1ivz h ASN 49 N 0.26 -0.75 -0.20 -0.43 -0.73 -0.95 -2.20 115.58 110.58 1ivz h ASN 49 Ca 0.03 0.06 0.06 0.00 1.87 0.00 0.00 56.30 58.31 1ivz h ASN 49 Cb 0.75 0.24 -0.01 0.00 0.27 0.00 0.00 38.32 39.57 1ivz h ASN 49 CO 0.06 -0.38 0.18 0.06 -0.37 0.00 0.00 177.43 176.97 1ivz h GLN 50 N -0.59 0.00 -0.67 6.67 3.07 -1.59 -0.78 115.11 121.23 1ivz h GLN 50 Ca -0.04 0.00 0.03 0.00 0.09 0.00 0.00 58.65 58.73 1ivz h GLN 50 Cb 0.50 0.00 -0.04 0.00 0.08 0.00 0.00 27.48 28.02 1ivz h GLN 50 CO -0.01 0.00 0.44 1.25 0.09 0.00 0.00 178.83 180.60 1ivz h LEU 51 N 0.00 0.69 -0.04 0.06 6.46 -1.12 -2.11 115.31 119.25 1ivz h LEU 51 Ca 0.09 -0.01 -0.07 0.00 -0.12 0.00 0.00 57.88 57.78 1ivz h LEU 51 Cb 0.44 -0.16 0.00 0.00 -0.73 0.00 0.00 40.66 40.22 1ivz h LEU 51 CO -0.00 0.48 -0.23 -0.26 -0.62 0.00 0.00 178.44 177.80 1ivz h PHE 52 N 0.80 0.32 -0.30 1.25 0.04 -0.83 0.27 116.94 118.49 1ivz h PHE 52 Ca 0.27 -0.14 0.09 0.00 2.80 0.00 0.00 57.97 60.98 1ivz h PHE 52 Cb 0.07 -0.05 -0.01 0.00 2.20 0.00 0.00 35.95 38.16 1ivz h PHE 52 CO -0.00 0.87 0.31 0.00 -0.60 0.00 0.00 178.31 178.89 1ivz h ARG 53 N -0.33 0.00 0.00 1.51 3.08 -1.38 -0.21 114.38 117.05 1ivz h ARG 53 Ca -0.02 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.03 1ivz h ARG 53 Cb 0.90 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.95 1ivz h ARG 53 CO 0.05 0.00 -1.41 0.09 -1.07 0.00 0.00 179.97 177.63 1ivz n ASN 54 N -3.83 0.97 -4.50 7.04 3.02 -0.83 -4.86 115.26 112.27 1ivz n ASN 54 Ca 0.04 -0.33 -0.33 0.00 -0.03 0.00 0.00 54.58 53.93 1ivz n ASN 54 Cb 0.46 1.49 0.12 0.00 -0.61 0.00 0.00 39.78 41.24 1ivz n ASN 54 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 1ivz n SER 55 N -1.83 -1.17 0.26 6.41 3.41 0.94 -4.86 113.62 116.78 1ivz n SER 55 Ca -0.01 0.43 0.12 0.00 -0.26 0.00 0.00 58.87 59.15 1ivz n SER 55 Cb 0.38 -1.28 0.72 0.00 -0.26 0.00 0.00 64.21 63.76 1ivz n SER 55 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 1ivz h SER 56 N -1.27 0.00 -1.96 4.04 4.64 -1.88 -2.91 113.55 114.21 1ivz h SER 56 Ca -0.44 0.00 -0.74 0.00 -0.47 0.00 0.00 61.79 60.14 1ivz h SER 56 Cb 1.30 0.00 -0.30 0.00 -0.31 0.00 0.00 62.40 63.09 1ivz h SER 56 CO 0.38 0.12 0.72 2.30 -0.87 0.00 0.00 176.83 179.48 1ivz n ILE 57 N -3.73 3.70 -1.28 0.95 -5.35 -1.26 -4.82 119.36 107.57 1ivz n ILE 57 Ca -0.02 -4.66 -0.21 0.00 -0.27 0.00 0.00 62.75 57.59 1ivz n ILE 57 Cb 0.22 -1.29 -0.11 0.00 -1.74 0.00 0.00 39.64 36.73 1ivz n ILE 57 CO 0.00 0.00 0.00 2.29 -1.76 0.00 0.00 176.55 177.08 1ivz n LYS 58 N -0.46 2.30 -0.44 6.28 2.85 -1.10 -3.58 118.16 124.01 1ivz n LYS 58 Ca 0.50 -1.76 0.00 0.00 -1.05 0.00 0.00 58.31 56.00 1ivz n LYS 58 Cb 0.31 -2.10 0.00 0.00 -0.65 0.00 0.00 35.03 32.58 1ivz n LYS 58 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 177.40 177.80 1ivz n SER 59 N 1.69 0.00 0.00 -5.58 2.88 -1.26 -4.94 113.62 106.41 1ivz n SER 59 Ca 0.47 -1.58 0.00 0.00 -1.33 0.00 0.00 58.87 56.43 1ivz n SER 59 Cb 0.70 -0.12 0.00 0.00 -0.75 0.00 0.00 64.21 64.05 1ivz n SER 59 CO 0.00 0.00 0.00 -1.22 -1.23 0.00 0.00 175.04 172.59 1ivz n TYR 60 N 0.00 -0.79 -1.69 0.66 4.01 -1.24 -4.89 117.16 113.23 1ivz n TYR 60 Ca 0.00 0.00 -0.51 0.00 -0.16 0.00 0.00 57.90 57.23 1ivz n TYR 60 Cb 0.62 0.16 -0.05 0.00 -0.31 0.00 0.00 39.34 39.75 1ivz n TYR 60 CO 0.00 0.00 0.00 0.34 -0.46 0.00 0.00 176.86 176.74 1ivz n PHE 61 N -1.75 2.23 -0.06 -0.72 -0.00 -1.23 -2.49 117.46 113.43 1ivz n PHE 61 Ca 0.00 0.18 -0.04 0.00 -0.00 0.00 0.00 57.45 57.59 1ivz n PHE 61 Cb 0.00 -2.59 -0.01 0.00 -0.00 0.00 0.00 39.48 36.87 1ivz n PHE 61 CO 0.00 0.00 0.00 1.03 -0.00 0.00 0.00 176.76 177.79 1ivz h SER 62 N 8.33 0.00 -1.65 -2.13 0.87 -1.87 -3.45 113.55 113.64 1ivz h SER 62 Ca -0.48 0.00 0.32 0.00 -1.23 0.00 0.00 61.79 60.40 1ivz h SER 62 Cb 1.29 0.00 -0.06 0.00 -0.44 0.00 0.00 62.40 63.18 1ivz h SER 62 CO 0.94 0.67 0.80 -0.90 -0.53 0.00 0.00 176.83 177.81 1ivz n ASP 63 N -4.40 -0.85 -4.74 6.23 5.75 -1.20 -5.01 116.55 112.34 1ivz n ASP 63 Ca -0.06 -1.06 -0.24 0.00 -0.01 0.00 0.00 54.79 53.43 1ivz n ASP 63 Cb 0.23 1.28 -0.07 0.00 -1.03 0.00 0.00 41.12 41.53 1ivz n ASP 63 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1ivz s GLN 65 N -3.90 0.60 -0.52 0.00 0.74 -0.56 -4.88 119.66 111.15 1ivz s GLN 65 Ca 0.40 -1.02 -0.27 0.00 0.05 0.00 0.00 55.36 54.52 1ivz s GLN 65 Cb 0.01 -1.73 -0.03 0.00 1.10 0.00 0.00 33.01 32.36 1ivz s GLN 65 CO 0.23 -1.03 2.01 0.54 -0.55 0.00 0.00 175.29 176.49 1ivz s VAL 66 N 1.60 3.27 -0.01 1.34 0.11 -1.26 -1.51 120.40 123.93 1ivz s VAL 66 Ca 0.11 0.19 -0.23 0.00 -2.93 0.00 0.00 61.98 59.11 1ivz s VAL 66 Cb -0.18 -3.60 -0.15 0.00 -1.53 0.00 0.00 36.38 30.92 1ivz s VAL 66 CO -0.24 -0.55 1.06 -0.07 -3.33 0.00 0.00 175.10 171.97 1ivz h LEU 67 N 16.81 -0.45 0.00 2.54 3.38 0.28 -3.48 115.31 134.38 1ivz h LEU 67 Ca -0.27 -0.12 0.12 0.00 0.09 0.00 0.00 57.88 57.69 1ivz h LEU 67 Cb 1.20 0.12 -0.02 0.00 0.09 0.00 0.00 40.66 42.04 1ivz h LEU 67 CO 1.16 -0.04 0.32 0.00 0.09 0.00 0.00 178.44 179.97 1ivz n ALA 68 N -2.58 -1.31 -2.46 1.53 0.00 -1.10 -5.02 120.51 109.57 1ivz n ALA 68 Ca -0.09 -0.32 -0.24 0.00 0.00 0.00 0.00 53.44 52.79 1ivz n ALA 68 Cb 0.28 0.09 -0.07 0.00 0.00 0.00 0.00 19.45 19.75 1ivz n ALA 68 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 1ivz s PHE 69 N -3.02 2.66 0.00 0.00 0.08 -1.26 -0.07 117.98 116.38 1ivz s PHE 69 Ca 0.11 -0.47 0.05 0.00 0.12 0.00 0.00 56.93 56.74 1ivz s PHE 69 Cb -0.00 -1.80 -0.02 0.00 -0.57 0.00 0.00 43.02 40.63 1ivz s PHE 69 CO 0.00 0.25 -0.16 1.03 -0.10 0.00 0.00 175.22 176.24 1ivz s ARG 70 N -3.88 1.19 0.33 0.44 1.81 -0.29 -4.89 118.95 113.66 1ivz s ARG 70 Ca 0.40 -0.63 -0.20 0.00 -1.72 0.00 0.00 55.73 53.57 1ivz s ARG 70 Cb 0.00 -1.18 -0.10 0.00 -0.45 0.00 0.00 34.95 33.22 1ivz s ARG 70 CO 0.23 0.32 0.84 -1.54 -0.68 0.00 0.00 175.30 174.46 1ivz s SER 71 N -0.61 7.00 0.08 0.23 1.04 -1.26 0.32 113.70 120.50 1ivz s SER 71 Ca 0.05 1.55 0.07 0.00 0.48 0.00 0.00 55.95 58.09 1ivz s SER 71 Cb -0.07 -2.48 -0.04 0.00 0.10 0.00 0.00 66.02 63.54 1ivz s SER 71 CO 0.00 -0.17 -0.11 0.68 0.98 0.00 0.00 173.24 174.62 1ivz s VAL 72 N -1.87 3.31 0.56 5.02 -7.23 -1.26 -4.86 120.40 114.08 1ivz s VAL 72 Ca 0.53 -1.19 0.04 0.00 -1.81 0.00 0.00 61.98 59.55 1ivz s VAL 72 Cb -0.13 -2.51 0.06 0.00 0.56 0.00 0.00 36.38 34.36 1ivz s VAL 72 CO 0.18 0.19 0.78 -0.44 -0.31 0.00 0.00 175.10 175.50 1ivz s SER 73 N -1.98 5.12 0.00 4.85 0.01 -1.26 -4.63 113.70 115.81 1ivz s SER 73 Ca 0.20 -0.34 0.00 0.00 1.31 0.00 0.00 55.95 57.12 1ivz s SER 73 Cb -0.11 -0.41 0.00 0.00 0.21 0.00 0.00 66.02 65.71 1ivz s SER 73 CO 0.11 -1.26 0.00 0.59 0.41 0.00 0.00 173.24 173.10 1ivz n ASN 74 N -2.33 0.00 -4.54 2.44 3.02 -1.26 -4.60 115.26 107.99 1ivz n ASN 74 Ca 0.11 0.00 -0.41 0.00 -0.03 0.00 0.00 54.58 54.25 1ivz n ASN 74 Cb 0.60 0.00 -0.09 0.00 -0.61 0.00 0.00 39.78 39.68 1ivz n ASN 74 CO 0.00 0.00 0.00 0.21 -2.62 0.00 0.00 177.26 174.85 1ivz s ASN 75 N -3.04 6.18 -0.53 6.41 2.47 -1.26 -4.97 114.94 120.20 1ivz s ASN 75 Ca 0.00 -0.26 -0.03 0.00 0.42 0.00 0.00 52.86 52.99 1ivz s ASN 75 Cb 0.00 -2.20 0.17 0.00 -1.45 0.00 0.00 41.25 37.77 1ivz s ASN 75 CO 0.00 -0.35 2.46 0.59 -3.72 0.00 0.00 177.10 176.08 1ivz n ASN 76 N 5.39 6.77 -0.27 -4.21 4.13 -1.26 -4.18 115.26 121.64 1ivz n ASN 76 Ca -0.09 -3.35 0.06 0.00 1.68 0.00 0.00 54.58 52.88 1ivz n ASN 76 Cb 0.49 -1.16 0.08 0.00 -1.54 0.00 0.00 39.78 37.66 1ivz n ASN 76 CO 0.00 0.00 0.00 -3.20 0.28 0.00 0.00 177.26 174.34 1ivz n ASN 77 N 0.39 1.39 -3.79 6.41 4.05 -1.26 -4.43 115.26 118.02 1ivz n ASN 77 Ca 0.48 -2.66 -0.23 0.00 0.45 0.00 0.00 54.58 52.62 1ivz n ASN 77 Cb 0.50 -0.34 -0.08 0.00 1.23 0.00 0.00 39.78 41.09 1ivz n ASN 77 CO 0.00 0.00 0.00 -1.00 -3.05 0.00 0.00 177.26 173.21 1ivz s HIS 78 N -1.71 1.77 -0.29 1.20 0.09 -1.26 -4.40 115.29 110.69 1ivz s HIS 78 Ca 0.19 -1.46 -0.12 0.00 -0.00 0.00 0.00 55.06 53.68 1ivz s HIS 78 Cb 0.17 -0.98 0.11 0.00 -0.00 0.00 0.00 32.58 31.88 1ivz s HIS 78 CO 0.01 -0.54 0.66 0.99 -0.00 0.00 0.00 174.74 175.86 1ivz s THR 79 N -3.29 -0.61 0.51 1.30 2.01 -0.79 -3.26 115.64 111.51 1ivz s THR 79 Ca 0.30 0.00 -0.20 0.00 0.31 0.00 0.00 61.69 62.10 1ivz s THR 79 Cb 0.02 -0.99 -0.07 0.00 0.01 0.00 0.00 72.50 71.47 1ivz s THR 79 CO 0.20 0.00 1.07 -0.83 -0.69 0.00 0.00 174.62 174.37 1ivz s GLY 80 N 2.40 2.51 -0.15 4.40 0.00 0.15 -1.42 107.32 115.21 1ivz s GLY 80 Ca -0.07 0.65 0.02 0.00 0.00 0.00 0.00 44.72 45.31 1ivz s GLY 80 CO -0.19 0.98 -0.20 0.14 0.00 0.00 0.00 173.10 173.83 1ivz s VAL 81 N -1.96 1.95 -0.87 1.40 1.01 -0.91 -1.14 120.40 119.88 1ivz s VAL 81 Ca 0.69 -0.89 -0.02 0.00 0.00 0.00 0.00 61.98 61.75 1ivz s VAL 81 Cb -0.19 -1.75 0.22 0.00 0.00 0.00 0.00 36.38 34.66 1ivz s VAL 81 CO 0.24 0.52 0.76 -1.81 0.00 0.00 0.00 175.10 174.81 1ivz s ASP 82 N 1.09 5.97 0.50 3.32 1.11 0.90 -2.44 116.67 127.12 1ivz s ASP 82 Ca -0.01 -3.62 0.09 0.00 0.18 0.00 0.00 52.55 49.18 1ivz s ASP 82 Cb -0.14 -1.91 0.05 0.00 1.07 0.00 0.00 42.92 41.98 1ivz s ASP 82 CO -0.07 -0.21 0.64 -0.94 1.18 0.00 0.00 175.17 175.77 1ivz s SER 83 N 0.00 5.25 -0.20 0.27 1.04 0.27 0.96 113.70 121.29 1ivz s SER 83 Ca 0.26 -0.73 -0.03 0.00 0.48 0.00 0.00 55.95 55.94 1ivz s SER 83 Cb -0.09 -0.10 0.06 0.00 0.10 0.00 0.00 66.02 66.00 1ivz s SER 83 CO -0.11 -1.06 0.04 -0.22 0.98 0.00 0.00 173.24 172.86 1ivz s LEU 84 N -4.48 1.23 -0.93 2.42 1.98 -0.57 0.42 118.68 118.74 1ivz s LEU 84 Ca 0.56 -0.86 -0.24 0.00 -2.89 0.00 0.00 54.13 50.69 1ivz s LEU 84 Cb -0.07 -0.61 -0.16 0.00 0.66 0.00 0.00 46.19 46.01 1ivz s LEU 84 CO 0.34 -0.31 1.92 0.00 -1.89 0.00 0.00 176.35 176.42 1ivz s ASN 86 N 6.50 6.32 0.02 0.00 0.01 -0.52 -2.58 114.94 124.70 1ivz s ASN 86 Ca 0.68 2.31 0.05 0.00 -0.71 0.00 0.00 52.86 55.19 1ivz s ASN 86 Cb 0.04 -2.61 -0.02 0.00 0.41 0.00 0.00 41.25 39.08 1ivz s ASN 86 CO 0.16 -0.81 -0.14 -0.36 -1.51 0.00 0.00 177.10 174.45 1ivz s PHE 87 N -1.50 1.19 0.77 2.20 0.40 -1.03 -3.23 117.98 116.78 1ivz s PHE 87 Ca 0.61 -0.31 -0.14 0.00 -0.60 0.00 0.00 56.93 56.49 1ivz s PHE 87 Cb -0.29 -0.73 0.06 0.00 0.51 0.00 0.00 43.02 42.57 1ivz s PHE 87 CO 0.36 0.02 1.20 -1.12 0.70 0.00 0.00 175.22 176.37 1ivz s SER 88 N -0.89 3.94 0.55 1.36 0.01 -1.04 -3.93 113.70 113.71 1ivz s SER 88 Ca 0.02 2.32 0.26 0.00 1.31 0.00 0.00 55.95 59.86 1ivz s SER 88 Cb -0.07 -2.58 1.48 0.00 0.21 0.00 0.00 66.02 65.05 1ivz s SER 88 CO 0.01 -2.43 2.04 -0.65 0.41 0.00 0.00 173.24 172.62 1ivz h PRO 89 N -0.62 0.00 0.00 12.44 0.11 -1.90 0.60 132.00 142.64 1ivz h PRO 89 Ca -0.47 0.00 -0.06 0.00 0.11 0.00 0.00 66.00 65.58 1ivz h PRO 89 Cb 1.29 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.39 1ivz h PRO 89 CO 0.48 0.00 -0.30 -0.07 -0.21 0.00 0.00 178.00 177.90 1ivz h LEU 90 N 0.00 0.00 -9.93 2.35 4.07 -1.90 -3.12 115.31 106.78 1ivz h LEU 90 Ca 0.16 0.00 -0.56 0.00 0.08 0.00 0.00 57.88 57.55 1ivz h LEU 90 Cb 0.71 0.00 0.15 0.00 1.08 0.00 0.00 40.66 42.60 1ivz h LEU 90 CO -0.00 0.30 0.33 0.00 -1.08 0.00 0.00 178.44 177.99 1ivz n ALA 91 N -2.36 0.74 -3.57 1.53 0.00 0.20 -5.02 120.51 112.04 1ivz n ALA 91 Ca -0.01 0.06 -0.11 0.00 0.00 0.00 0.00 53.44 53.37 1ivz n ALA 91 Cb 0.39 -2.22 -0.05 0.00 0.00 0.00 0.00 19.45 17.58 1ivz n ALA 91 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 1ivz s ARG 92 N -2.85 0.65 -1.27 0.00 3.52 -1.26 -4.84 118.95 112.90 1ivz s ARG 92 Ca 0.75 0.12 -0.04 0.00 -0.13 0.00 0.00 55.73 56.43 1ivz s ARG 92 Cb -0.42 0.31 0.00 0.00 -1.56 0.00 0.00 34.95 33.28 1ivz s ARG 92 CO 0.47 -0.21 0.54 -2.13 -0.81 0.00 0.00 175.30 173.16 1ivz n ARG 93 N 0.66 -4.26 -3.76 5.12 0.00 -1.26 -4.99 116.66 108.17 1ivz n ARG 93 Ca -0.11 0.75 -0.36 0.00 -0.00 0.00 0.00 57.85 58.13 1ivz n ARG 93 Cb 0.58 -5.28 -0.11 0.00 0.00 0.00 0.00 32.46 27.65 1ivz n ARG 93 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.63 177.71 1ivz s VAL 94 N -3.08 4.82 0.49 5.15 1.01 -1.26 -5.10 120.40 122.43 1ivz s VAL 94 Ca 0.27 -0.00 0.07 0.00 0.00 0.00 0.00 61.98 62.32 1ivz s VAL 94 Cb -0.12 -3.25 0.04 0.00 0.00 0.00 0.00 36.38 33.05 1ivz s VAL 94 CO 0.33 0.35 0.67 -1.81 0.00 0.00 0.00 175.10 174.64 1ivz s ASP 95 N 1.28 5.40 0.21 3.32 1.01 -1.26 -5.02 116.67 121.61 1ivz s ASP 95 Ca 0.06 -0.46 0.01 0.00 0.71 0.00 0.00 52.55 52.86 1ivz s ASP 95 Cb -0.14 -0.42 0.16 0.00 1.01 0.00 0.00 42.92 43.52 1ivz s ASP 95 CO 0.05 -1.01 1.50 0.08 0.21 0.00 0.00 175.17 176.00 1ivz h ARG 96 N 0.39 0.36 0.00 8.23 0.11 -1.93 -3.03 114.38 118.50 1ivz h ARG 96 Ca -0.38 -0.26 -0.07 0.00 0.10 0.00 0.00 59.98 59.38 1ivz h ARG 96 Cb 1.28 0.04 -0.01 0.00 1.11 0.00 0.00 29.97 32.40 1ivz h ARG 96 CO 0.45 0.88 -0.31 0.28 0.10 0.00 0.00 179.97 181.36 1ivz h VAL 97 N 0.26 1.13 0.90 0.08 2.07 -1.96 -2.57 116.25 116.16 1ivz h VAL 97 Ca -0.01 -1.09 -0.04 0.00 0.82 0.00 0.00 66.70 66.37 1ivz h VAL 97 Cb 1.17 1.60 0.00 0.00 -1.52 0.00 0.00 31.29 32.55 1ivz h VAL 97 CO 0.11 0.30 -0.48 0.00 0.02 0.00 0.00 177.57 177.52 1ivz h ALA 98 N 1.69 -1.32 0.00 1.67 0.00 -1.93 0.23 119.26 119.60 1ivz h ALA 98 Ca -0.00 -0.27 -0.02 0.00 0.00 0.00 0.00 54.91 54.61 1ivz h ALA 98 Cb 0.58 0.55 -0.00 0.00 0.00 0.00 0.00 17.79 18.91 1ivz h ALA 98 CO 0.04 -1.25 -0.11 0.82 0.00 0.00 0.00 179.25 178.76 1ivz h ILE 99 N -1.26 0.71 -0.10 0.00 2.04 -1.64 -1.92 117.51 115.34 1ivz h ILE 99 Ca -0.12 -0.42 -0.09 0.00 1.00 0.00 0.00 64.86 65.22 1ivz h ILE 99 Cb 0.98 1.26 0.00 0.00 -0.74 0.00 0.00 36.82 38.32 1ivz h ILE 99 CO 0.17 0.10 -0.31 0.22 0.00 0.00 0.00 178.15 178.34 1ivz h TYR 100 N 0.00 0.49 0.32 1.37 3.20 -1.11 -2.26 116.97 118.98 1ivz h TYR 100 Ca -0.00 -0.20 -0.02 0.00 3.14 0.00 0.00 58.73 61.65 1ivz h TYR 100 Cb 0.25 -0.08 0.00 0.00 1.54 0.00 0.00 36.73 38.44 1ivz h TYR 100 CO 0.00 0.92 -0.15 0.93 -1.64 0.00 0.00 178.16 178.22 1ivz h GLU 101 N -0.07 -0.41 -0.09 1.82 5.08 -0.20 -1.98 114.58 118.71 1ivz h GLU 101 Ca -0.01 0.03 0.03 0.00 -1.00 0.00 0.00 59.36 58.40 1ivz h GLU 101 Cb 0.93 0.09 -0.00 0.00 0.50 0.00 0.00 28.75 30.27 1ivz h GLU 101 CO 0.07 -0.12 0.07 1.05 -1.00 0.00 0.00 179.01 179.08 1ivz h GLU 102 N -0.70 0.00 -0.01 2.33 -0.00 -1.48 -0.80 114.58 113.93 1ivz h GLU 102 Ca -0.04 0.00 -0.18 0.00 -0.00 0.00 0.00 59.36 59.14 1ivz h GLU 102 Cb 0.48 0.00 -0.02 0.00 -0.00 0.00 0.00 28.75 29.22 1ivz h GLU 102 CO 0.07 0.00 -0.80 0.35 -0.00 0.00 0.00 179.01 178.63 1ivz h PHE 103 N 0.00 0.17 0.00 2.06 3.57 -1.25 -3.05 116.94 118.43 1ivz h PHE 103 Ca 0.04 -0.09 -0.20 0.00 3.53 0.00 0.00 57.97 61.26 1ivz h PHE 103 Cb 0.18 -0.02 -0.03 0.00 2.79 0.00 0.00 35.95 38.88 1ivz h PHE 103 CO 0.00 0.86 -0.94 -0.07 -2.23 0.00 0.00 178.31 175.93 1ivz h LEU 104 N 0.07 0.00 -0.70 0.59 3.38 -0.42 -2.59 115.31 115.65 1ivz h LEU 104 Ca -0.02 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 57.82 1ivz h LEU 104 Cb 1.40 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.14 1ivz h LEU 104 CO 0.11 0.94 -0.39 -0.09 0.09 0.00 0.00 178.44 179.10 1ivz h ARG 105 N 0.00 0.55 0.00 1.13 2.43 -1.23 -0.47 114.38 116.79 1ivz h ARG 105 Ca -0.01 -0.27 -0.09 0.00 -0.81 0.00 0.00 59.98 58.80 1ivz h ARG 105 Cb 1.70 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 31.24 1ivz h ARG 105 CO 0.12 0.85 -0.77 1.98 -1.51 0.00 0.00 179.97 180.64 1ivz h MET 106 N 0.46 0.00 -0.76 0.20 4.05 -1.59 -3.29 114.93 114.00 1ivz h MET 106 Ca 0.04 0.00 -0.10 0.00 -0.28 0.00 0.00 59.70 59.36 1ivz h MET 106 Cb 0.88 0.00 -0.06 0.00 -0.80 0.00 0.00 31.60 31.62 1ivz h MET 106 CO 0.08 0.27 0.13 0.25 0.23 0.00 0.00 176.91 177.87 1ivz n THR 107 N -3.01 2.27 -3.09 -0.77 -2.24 -0.98 -4.56 114.28 101.91 1ivz n THR 107 Ca -0.01 -1.18 -0.18 0.00 -2.27 0.00 0.00 64.05 60.41 1ivz n THR 107 Cb 0.70 -0.40 0.02 0.00 -2.10 0.00 0.00 70.33 68.55 1ivz n THR 107 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 1ivz n HIS 108 N 0.15 -3.07 -2.14 4.78 8.25 -1.10 -1.05 115.22 121.04 1ivz n HIS 108 Ca 0.28 1.27 -0.14 0.00 -0.26 0.00 0.00 57.72 58.86 1ivz n HIS 108 Cb 1.09 -3.10 -0.02 0.00 1.12 0.00 0.00 29.99 29.08 1ivz n HIS 108 CO 0.00 0.00 0.00 -1.71 0.64 0.00 0.00 176.34 175.27 1ivz n ASN 109 N -0.09 -4.19 -2.81 0.41 2.85 -0.23 -3.08 115.26 108.12 1ivz n ASN 109 Ca 0.03 0.21 -0.05 0.00 -0.11 0.00 0.00 54.58 54.66 1ivz n ASN 109 Cb 0.51 -3.63 0.01 0.00 1.24 0.00 0.00 39.78 37.91 1ivz n ASN 109 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1ivz n GLY 110 N -0.68 -1.24 0.77 8.20 0.00 -0.94 -4.96 105.19 106.33 1ivz n GLY 110 Ca -0.16 0.94 0.00 0.00 0.00 0.00 0.00 46.02 46.80 1ivz n GLY 110 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1ivz n THR 111 N -0.73 0.00 -3.90 2.61 -2.24 -0.22 -3.94 114.28 105.86 1ivz n THR 111 Ca 0.08 0.00 -0.30 0.00 -2.27 0.00 0.00 64.05 61.55 1ivz n THR 111 Cb 0.45 -0.03 -0.15 0.00 -2.10 0.00 0.00 70.33 68.50 1ivz n THR 111 CO 0.00 0.00 0.00 -1.58 -0.57 0.00 0.00 175.07 172.92 1ivz s GLN 112 N -1.38 1.15 -0.99 -0.78 0.74 -0.73 0.43 119.66 118.10 1ivz s GLN 112 Ca 0.00 -1.53 -0.23 0.00 0.05 0.00 0.00 55.36 53.65 1ivz s GLN 112 Cb 0.00 -2.68 0.02 0.00 1.10 0.00 0.00 33.01 31.44 1ivz s GLN 112 CO 0.00 -0.96 1.63 -1.17 -0.55 0.00 0.00 175.29 174.24 1ivz s LEU 113 N 1.21 3.39 0.00 3.68 1.98 0.29 -4.35 118.68 124.88 1ivz s LEU 113 Ca 0.10 -1.22 0.00 0.00 -2.89 0.00 0.00 54.13 50.12 1ivz s LEU 113 Cb -0.18 -2.57 0.00 0.00 0.66 0.00 0.00 46.19 44.10 1ivz s LEU 113 CO -0.15 -1.94 0.00 0.18 -1.89 0.00 0.00 176.35 172.55 1ivz n LEU 114 N 10.67 0.00 -0.01 -0.68 4.77 -1.26 -1.26 117.00 129.23 1ivz n LEU 114 Ca 0.36 0.00 -0.02 0.00 -0.03 0.00 0.00 56.01 56.32 1ivz n LEU 114 Cb 0.49 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.57 1ivz n LEU 114 CO 0.64 0.00 -0.59 -3.20 -1.33 0.00 0.00 177.39 172.91 1ivz n ASN 115 N 1.46 4.10 -4.71 -1.43 2.85 -1.26 -5.01 115.26 111.26 1ivz n ASN 115 Ca 0.00 -0.01 -0.42 0.00 -0.11 0.00 0.00 54.58 54.04 1ivz n ASN 115 Cb 0.00 0.27 -0.03 0.00 1.24 0.00 0.00 39.78 41.25 1ivz n ASN 115 CO 0.00 0.00 0.00 -0.36 -2.11 0.00 0.00 177.26 174.79 1ivz s PHE 116 N -2.06 3.65 -0.34 1.20 0.40 -0.39 -5.02 117.98 115.42 1ivz s PHE 116 Ca -0.03 1.66 -0.18 0.00 -0.60 0.00 0.00 56.93 57.78 1ivz s PHE 116 Cb 0.01 -3.09 -0.01 0.00 0.51 0.00 0.00 43.02 40.44 1ivz s PHE 116 CO 0.08 -0.00 0.51 0.95 0.70 0.00 0.00 175.22 177.46 1ivz s THR 117 N 0.99 5.02 0.22 0.64 -4.23 -1.26 0.11 115.64 117.13 1ivz s THR 117 Ca 0.51 0.40 0.08 0.00 -1.18 0.00 0.00 61.69 61.50 1ivz s THR 117 Cb -0.21 -3.94 -0.05 0.00 1.34 0.00 0.00 72.50 69.64 1ivz s THR 117 CO 0.27 -0.18 -0.14 -1.48 -0.54 0.00 0.00 174.62 172.55 1ivz s LEU 118 N 2.38 2.56 0.00 4.79 0.05 0.17 -1.84 118.68 126.78 1ivz s LEU 118 Ca 0.19 -1.03 -0.02 0.00 0.05 0.00 0.00 54.13 53.32 1ivz s LEU 118 Cb -0.15 -0.72 0.03 0.00 -2.05 0.00 0.00 46.19 43.29 1ivz s LEU 118 CO 0.13 -0.16 0.09 -0.67 -0.55 0.00 0.00 176.35 175.19 1ivz n ASP 119 N -0.42 -1.20 0.00 1.48 2.03 -1.15 -3.91 116.55 113.39 1ivz n ASP 119 Ca -0.07 -0.51 0.00 0.00 0.52 0.00 0.00 54.79 54.73 1ivz n ASP 119 Cb 0.60 -0.08 0.00 0.00 -0.72 0.00 0.00 41.12 40.92 1ivz n ASP 119 CO 0.00 0.00 0.00 -1.14 -1.92 0.00 0.00 177.20 174.14 1ivz n ARG 120 N -1.83 0.00 -0.36 -0.67 0.63 -1.25 -4.37 116.66 108.80 1ivz n ARG 120 Ca 0.01 0.00 0.02 0.00 -0.92 0.00 0.00 57.85 56.97 1ivz n ARG 120 Cb 0.05 -0.78 0.18 0.00 0.45 0.00 0.00 32.46 32.36 1ivz n ARG 120 CO 0.00 0.00 0.00 0.87 -2.51 0.00 0.00 177.63 175.99 1ivz h LYS 121 N 0.00 1.14 0.00 -0.14 6.56 -1.96 -0.71 116.57 121.46 1ivz h LYS 121 Ca 0.00 -0.07 -0.05 0.00 -1.06 0.00 0.00 60.65 59.47 1ivz h LYS 121 Cb 0.93 -0.26 -0.01 0.00 -0.57 0.00 0.00 32.23 32.33 1ivz h LYS 121 CO 0.00 0.76 -0.26 0.66 -2.06 0.00 0.00 179.45 178.55 1ivz h SER 122 N 1.18 0.00 -2.80 0.86 4.64 -1.92 -3.43 113.55 112.07 1ivz h SER 122 Ca 0.42 0.00 -0.52 0.00 -0.47 0.00 0.00 61.79 61.22 1ivz h SER 122 Cb 0.14 0.00 0.05 0.00 -0.31 0.00 0.00 62.40 62.27 1ivz h SER 122 CO -0.16 0.26 0.90 -0.69 -0.87 0.00 0.00 176.83 176.27 1ivz s VAL 123 N -4.41 2.54 -0.30 0.95 1.01 -0.27 -4.10 120.40 115.82 1ivz s VAL 123 Ca -0.03 0.39 -0.16 0.00 0.00 0.00 0.00 61.98 62.17 1ivz s VAL 123 Cb 0.15 -3.25 0.18 0.00 0.00 0.00 0.00 36.38 33.46 1ivz s VAL 123 CO 0.70 0.03 1.12 0.12 0.00 0.00 0.00 175.10 177.07 1ivz s PHE 124 N 1.14 -0.35 -0.11 5.22 2.19 -0.52 -4.99 117.98 120.55 1ivz s PHE 124 Ca 0.71 0.67 0.02 0.00 0.33 0.00 0.00 56.93 58.66 1ivz s PHE 124 Cb -0.45 0.21 -0.01 0.00 -1.31 0.00 0.00 43.02 41.47 1ivz s PHE 124 CO 0.31 -0.17 -0.20 0.54 1.83 0.00 0.00 175.22 177.53 1ivz s VAL 125 N 1.51 2.44 0.31 3.12 0.11 -1.26 -2.66 120.40 123.97 1ivz s VAL 125 Ca -0.06 -0.88 0.10 0.00 -2.93 0.00 0.00 61.98 58.20 1ivz s VAL 125 Cb -0.03 -1.97 -0.05 0.00 -1.53 0.00 0.00 36.38 32.80 1ivz s VAL 125 CO -0.14 0.55 -0.03 -0.62 -3.33 0.00 0.00 175.10 171.53 1ivz s ASP 126 N 0.34 4.18 -1.35 3.54 2.15 -0.83 -4.77 116.67 119.92 1ivz s ASP 126 Ca -0.16 -0.91 -0.15 0.00 0.43 0.00 0.00 52.55 51.77 1ivz s ASP 126 Cb -0.17 -0.57 0.08 0.00 -0.30 0.00 0.00 42.92 41.95 1ivz s ASP 126 CO 0.08 -0.13 1.92 -0.24 -0.17 0.00 0.00 175.17 176.63 1ivz n SER 127 N -0.89 4.55 -1.40 -0.34 2.88 -1.26 -0.61 113.62 116.55 1ivz n SER 127 Ca -0.05 -2.92 0.16 0.00 -1.33 0.00 0.00 58.87 54.73 1ivz n SER 127 Cb 0.61 -1.66 -0.09 0.00 -0.75 0.00 0.00 64.21 62.32 1ivz n SER 127 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1ivz n GLY 128 N 4.44 -3.13 3.63 0.46 0.00 -0.70 -4.63 105.19 105.25 1ivz n GLY 128 Ca 0.48 -0.92 -0.43 0.00 0.00 0.00 0.00 46.02 45.15 1ivz n GLY 128 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1ivz s PRO 129 N -4.47 3.67 0.30 1.61 0.02 -1.26 -4.58 135.00 130.28 1ivz s PRO 129 Ca 0.00 1.96 0.00 0.00 0.02 0.00 0.00 61.00 62.98 1ivz s PRO 129 Cb 0.00 -4.16 0.00 0.00 0.02 0.00 0.00 34.50 30.36 1ivz s PRO 129 CO 0.00 -1.47 0.00 0.45 -0.33 0.00 0.00 177.00 175.65 1ivz n SER 130 N 9.23 -2.61 0.00 2.53 2.88 -1.26 -5.05 113.62 119.33 1ivz n SER 130 Ca 0.22 0.57 0.00 0.00 -1.33 0.00 0.00 58.87 58.33 1ivz n SER 130 Cb 0.44 2.60 0.00 0.00 -0.75 0.00 0.00 64.21 66.51 1ivz n SER 130 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 1ivz n SER 131 N -3.10 0.00 -0.58 -3.46 2.88 -1.26 -5.24 113.62 102.86 1ivz n SER 131 Ca 0.00 0.00 0.14 0.00 -1.33 0.00 0.00 58.87 57.68 1ivz n SER 131 Cb 0.00 0.00 0.44 0.00 -0.75 0.00 0.00 64.21 63.90 1ivz n SER 131 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42