#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ivz n SER 2 N 0.00 3.85 -4.66 1.61 2.88 -1.26 -4.99 113.62 111.05 1ivz n SER 2 Ca 0.00 -3.73 -0.43 0.00 -1.33 0.00 0.00 58.87 53.38 1ivz n SER 2 Cb 0.00 -0.73 -0.02 0.00 -0.75 0.00 0.00 64.21 62.70 1ivz n SER 2 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 1ivz s SER 3 N -2.09 6.95 -0.08 -3.46 1.04 -1.26 -4.90 113.70 109.90 1ivz s SER 3 Ca 0.52 1.70 -0.08 0.00 0.48 0.00 0.00 55.95 58.57 1ivz s SER 3 Cb 0.45 -2.54 -0.04 0.00 0.10 0.00 0.00 66.02 63.99 1ivz s SER 3 CO 0.04 -0.75 -0.18 0.61 0.98 0.00 0.00 173.24 173.94 1ivz n GLY 4 N 3.60 -0.26 3.52 7.32 0.00 -1.26 -4.87 105.19 113.23 1ivz n GLY 4 Ca 0.14 -0.13 -0.42 0.00 0.00 0.00 0.00 46.02 45.61 1ivz n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1ivz s SER 5 N -6.06 6.57 -0.23 1.61 0.15 -1.26 -4.91 113.70 109.57 1ivz s SER 5 Ca -0.16 -1.75 -0.03 0.00 0.70 0.00 0.00 55.95 54.71 1ivz s SER 5 Cb 0.04 -2.50 0.10 0.00 -1.71 0.00 0.00 66.02 61.95 1ivz s SER 5 CO 0.22 -1.31 0.23 -0.44 1.20 0.00 0.00 173.24 173.14 1ivz s SER 6 N 4.38 1.62 0.00 5.45 0.01 -1.26 -4.98 113.70 118.93 1ivz s SER 6 Ca 0.41 -0.42 0.00 0.00 1.31 0.00 0.00 55.95 57.25 1ivz s SER 6 Cb -0.02 0.34 0.00 0.00 0.21 0.00 0.00 66.02 66.55 1ivz s SER 6 CO -0.09 -0.35 0.00 0.61 0.41 0.00 0.00 173.24 173.82 1ivz n GLY 7 N 5.31 0.75 0.08 3.44 0.00 -1.26 -5.04 105.19 108.47 1ivz n GLY 7 Ca -0.05 -0.72 -0.10 0.00 0.00 0.00 0.00 46.02 45.16 1ivz n GLY 7 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1ivz h SER 8 N 0.00 0.11 -0.64 1.61 0.02 -2.00 -3.35 113.55 109.29 1ivz h SER 8 Ca 0.00 -0.13 -0.62 0.00 -0.84 0.00 0.00 61.79 60.21 1ivz h SER 8 Cb 0.00 -0.03 -0.08 0.00 0.14 0.00 0.00 62.40 62.43 1ivz h SER 8 CO 0.00 1.10 2.21 -0.24 -1.14 0.00 0.00 176.83 178.77 1ivz n SER 9 N -3.35 7.70 -3.57 3.07 2.88 -1.26 -4.83 113.62 114.26 1ivz n SER 9 Ca -0.05 -2.89 -0.16 0.00 -1.33 0.00 0.00 58.87 54.43 1ivz n SER 9 Cb 0.98 -1.41 -0.06 0.00 -0.75 0.00 0.00 64.21 62.96 1ivz n SER 9 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 1ivz s SER 10 N 1.12 -0.68 0.60 -3.46 1.04 -1.26 -5.14 113.70 105.92 1ivz s SER 10 Ca 0.61 1.01 0.00 0.00 0.48 0.00 0.00 55.95 58.05 1ivz s SER 10 Cb 0.23 0.92 0.00 0.00 0.10 0.00 0.00 66.02 67.27 1ivz s SER 10 CO -0.09 -0.45 0.00 -0.24 0.98 0.00 0.00 173.24 173.44 1ivz n SER 11 N 1.65 -7.91 -3.90 7.02 2.88 -1.26 -4.96 113.62 107.14 1ivz n SER 11 Ca -0.17 1.39 -0.10 0.00 -1.33 0.00 0.00 58.87 58.66 1ivz n SER 11 Cb 0.56 -4.89 -0.09 0.00 -0.75 0.00 0.00 64.21 59.05 1ivz n SER 11 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1ivz s GLN 12 N -4.14 0.63 0.05 -1.46 -2.07 -1.26 -4.99 119.66 106.44 1ivz s GLN 12 Ca 0.00 -0.74 0.09 0.00 -1.82 0.00 0.00 55.36 52.89 1ivz s GLN 12 Cb 0.00 0.25 -0.03 0.00 -1.09 0.00 0.00 33.01 32.14 1ivz s GLN 12 CO 0.00 -0.17 -0.26 -1.01 -1.32 0.00 0.00 175.29 172.53 1ivz s HIS 13 N -2.70 2.34 -0.29 9.60 3.76 -1.26 -2.40 115.29 124.35 1ivz s HIS 13 Ca -0.04 -0.39 -0.00 0.00 -0.15 0.00 0.00 55.06 54.47 1ivz s HIS 13 Cb -0.01 -1.39 0.09 0.00 1.11 0.00 0.00 32.58 32.39 1ivz s HIS 13 CO -0.05 0.16 0.06 -0.06 -0.85 0.00 0.00 174.74 174.00 1ivz s PHE 14 N -0.84 1.95 -0.26 1.40 0.08 -0.95 -1.22 117.98 118.14 1ivz s PHE 14 Ca 0.12 -1.77 -0.33 0.00 0.12 0.00 0.00 56.93 55.07 1ivz s PHE 14 Cb -0.10 -1.75 -0.10 0.00 -0.57 0.00 0.00 43.02 40.50 1ivz s PHE 14 CO 0.03 -0.84 2.12 -1.71 -0.10 0.00 0.00 175.22 174.72 1ivz n ASN 15 N 4.78 2.68 -4.72 1.36 5.15 0.29 0.12 115.26 124.92 1ivz n ASN 15 Ca -0.04 0.49 -0.36 0.00 -0.60 0.00 0.00 54.58 54.08 1ivz n ASN 15 Cb 0.43 -1.35 -0.08 0.00 -0.53 0.00 0.00 39.78 38.25 1ivz n ASN 15 CO 0.00 0.00 0.00 -0.22 1.40 0.00 0.00 177.26 178.44 1ivz s LEU 16 N 6.79 4.21 -0.07 1.20 2.96 0.20 -2.05 118.68 131.92 1ivz s LEU 16 Ca 1.04 0.39 -0.05 0.00 -0.22 0.00 0.00 54.13 55.28 1ivz s LEU 16 Cb -0.70 -2.28 0.03 0.00 0.50 0.00 0.00 46.19 43.73 1ivz s LEU 16 CO 0.47 0.10 0.18 0.20 -1.32 0.00 0.00 176.35 175.98 1ivz s ASN 17 N 0.56 -0.18 -0.30 3.68 0.01 -0.84 0.92 114.94 118.79 1ivz s ASN 17 Ca 0.13 0.37 -0.18 0.00 -0.71 0.00 0.00 52.86 52.47 1ivz s ASN 17 Cb -0.13 0.33 0.18 0.00 0.41 0.00 0.00 41.25 42.04 1ivz s ASN 17 CO 0.03 -0.10 1.21 0.72 -1.51 0.00 0.00 177.10 177.45 1ivz s PHE 18 N 0.52 -0.21 0.25 2.20 -0.71 -1.08 -0.47 117.98 118.48 1ivz s PHE 18 Ca -0.03 0.32 -0.30 0.00 -1.04 0.00 0.00 56.93 55.88 1ivz s PHE 18 Cb -0.05 0.11 -0.09 0.00 -1.21 0.00 0.00 43.02 41.78 1ivz s PHE 18 CO -0.03 -0.11 1.04 0.99 -1.34 0.00 0.00 175.22 175.77 1ivz s THR 19 N 2.40 3.75 -0.47 -4.49 2.01 -1.26 -2.13 115.64 115.45 1ivz s THR 19 Ca -0.02 1.73 -0.11 0.00 0.31 0.00 0.00 61.69 63.60 1ivz s THR 19 Cb -0.04 -4.10 0.11 0.00 0.01 0.00 0.00 72.50 68.47 1ivz s THR 19 CO -0.14 0.40 0.35 -0.63 -0.69 0.00 0.00 174.62 173.91 1ivz s ILE 20 N -1.05 4.46 0.55 1.82 1.01 0.01 -2.54 121.20 125.46 1ivz s ILE 20 Ca 0.44 -1.58 0.22 0.00 0.00 0.00 0.00 60.65 59.73 1ivz s ILE 20 Cb -0.29 -3.85 0.32 0.00 0.01 0.00 0.00 42.46 38.65 1ivz s ILE 20 CO 0.37 -0.70 2.15 0.71 0.00 0.00 0.00 174.94 177.47 1ivz h THR 21 N 6.05 0.78 -0.13 2.92 1.35 -1.82 -1.47 112.91 120.59 1ivz h THR 21 Ca -0.24 0.00 -0.20 0.00 -0.55 0.00 0.00 66.41 65.43 1ivz h THR 21 Cb 1.08 0.95 0.00 0.00 -1.73 0.00 0.00 68.15 68.45 1ivz h THR 21 CO 0.86 0.00 -0.72 -1.13 -0.25 0.00 0.00 175.52 174.28 1ivz h ASN 22 N 0.00 0.69 -3.59 5.36 -1.24 -1.27 -3.39 115.58 112.15 1ivz h ASN 22 Ca 0.04 -0.44 -0.62 0.00 0.71 0.00 0.00 56.30 55.99 1ivz h ASN 22 Cb 0.18 -0.20 -0.13 0.00 0.73 0.00 0.00 38.32 38.90 1ivz h ASN 22 CO -0.00 1.20 0.40 -0.22 -1.29 0.00 0.00 177.43 177.52 1ivz s LEU 23 N -8.20 4.22 0.99 0.34 1.98 -0.58 -4.96 118.68 112.48 1ivz s LEU 23 Ca -0.08 -0.12 -0.15 0.00 -2.89 0.00 0.00 54.13 50.89 1ivz s LEU 23 Cb 0.10 -2.97 0.19 0.00 0.66 0.00 0.00 46.19 44.16 1ivz s LEU 23 CO 0.87 -0.96 1.18 -2.16 -1.89 0.00 0.00 176.35 173.39 1ivz s PRO 24 N 3.40 0.44 -0.33 0.98 0.04 -1.23 -1.53 135.00 136.78 1ivz s PRO 24 Ca 0.31 -0.00 0.02 0.00 0.04 0.00 0.00 61.00 61.37 1ivz s PRO 24 Cb -0.12 -1.79 0.10 0.00 0.04 0.00 0.00 34.50 32.73 1ivz s PRO 24 CO 0.23 -2.61 0.06 -0.47 0.04 0.00 0.00 177.00 174.24 1ivz s TYR 25 N -3.40 3.11 0.59 0.56 6.14 -0.94 -4.64 117.35 118.78 1ivz s TYR 25 Ca 0.68 -2.58 0.10 0.00 0.64 0.00 0.00 57.07 55.91 1ivz s TYR 25 Cb -0.10 -2.51 0.09 0.00 0.42 0.00 0.00 41.96 39.86 1ivz s TYR 25 CO 0.54 -0.92 0.79 -1.54 0.64 0.00 0.00 175.55 175.06 1ivz s SER 26 N 1.13 4.99 0.38 4.32 1.04 -1.26 -4.94 113.70 119.35 1ivz s SER 26 Ca 0.10 -0.94 0.12 0.00 0.48 0.00 0.00 55.95 55.70 1ivz s SER 26 Cb -0.19 0.45 0.75 0.00 0.10 0.00 0.00 66.02 67.13 1ivz s SER 26 CO -0.13 -1.41 1.86 -0.61 0.98 0.00 0.00 173.24 173.93 1ivz h GLN 27 N 0.16 0.06 -0.61 4.02 -0.00 -2.00 -2.91 115.11 113.82 1ivz h GLN 27 Ca -0.29 -0.02 0.02 0.00 -0.00 0.00 0.00 58.65 58.36 1ivz h GLN 27 Cb 1.29 -0.00 -0.04 0.00 0.00 0.00 0.00 27.48 28.73 1ivz h GLN 27 CO 0.41 0.36 0.39 -0.44 0.00 0.00 0.00 178.83 179.55 1ivz h ASP 28 N 0.05 0.64 0.27 -0.69 3.32 -1.95 -0.80 116.42 117.26 1ivz h ASP 28 Ca 0.01 -0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1ivz h ASP 28 Cb 0.58 -0.14 0.00 0.00 0.22 0.00 0.00 39.33 39.98 1ivz h ASP 28 CO 0.04 0.45 0.00 0.40 -1.72 0.00 0.00 179.24 178.41 1ivz h ILE 29 N 0.77 0.00 0.00 0.35 1.08 -1.82 -0.99 117.51 116.90 1ivz h ILE 29 Ca 0.24 -0.12 0.00 0.00 -0.39 0.00 0.00 64.86 64.59 1ivz h ILE 29 Cb -0.01 0.95 0.00 0.00 -3.07 0.00 0.00 36.82 34.68 1ivz h ILE 29 CO -0.09 0.00 -0.24 0.00 -0.69 0.00 0.00 178.15 177.13 1ivz h ALA 30 N 2.03 0.88 -3.68 1.87 0.00 -1.20 -3.43 119.26 115.73 1ivz h ALA 30 Ca 0.00 0.00 -0.63 0.00 0.00 0.00 0.00 54.91 54.28 1ivz h ALA 30 Cb 0.13 0.00 -0.38 0.00 0.00 0.00 0.00 17.79 17.55 1ivz h ALA 30 CO 0.00 0.00 -0.79 -0.65 0.00 0.00 0.00 179.25 177.81 1ivz s GLN 31 N -3.24 1.82 0.60 0.00 -1.52 -0.38 -4.99 119.66 111.96 1ivz s GLN 31 Ca 0.05 -1.07 0.29 0.00 -1.95 0.00 0.00 55.36 52.68 1ivz s GLN 31 Cb 0.07 -2.66 1.59 0.00 -0.22 0.00 0.00 33.01 31.78 1ivz s GLN 31 CO 0.69 -0.58 1.98 -1.35 -0.25 0.00 0.00 175.29 175.79 1ivz h PRO 32 N 7.91 0.00 -0.44 2.91 0.11 -1.83 -0.74 132.00 139.92 1ivz h PRO 32 Ca -0.19 0.00 0.11 0.00 0.11 0.00 0.00 66.00 66.03 1ivz h PRO 32 Cb 1.07 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.15 1ivz h PRO 32 CO 0.43 0.00 0.31 1.03 -0.21 0.00 0.00 178.00 179.56 1ivz h SER 33 N 0.00 0.07 -4.37 -2.05 0.87 -1.94 -3.42 113.55 102.71 1ivz h SER 33 Ca 0.13 0.00 -0.49 0.00 -1.23 0.00 0.00 61.79 60.20 1ivz h SER 33 Cb 0.83 -0.01 0.10 0.00 -0.44 0.00 0.00 62.40 62.88 1ivz h SER 33 CO -0.00 0.04 0.36 0.42 -0.53 0.00 0.00 176.83 177.13 1ivz s THR 34 N -5.10 3.07 0.06 2.23 -4.23 -0.28 -4.99 115.64 106.40 1ivz s THR 34 Ca -0.06 0.35 0.06 0.00 -1.18 0.00 0.00 61.69 60.86 1ivz s THR 34 Cb 0.19 -3.19 -0.23 0.00 1.34 0.00 0.00 72.50 70.61 1ivz s THR 34 CO 0.72 -0.45 1.06 0.74 -0.54 0.00 0.00 174.62 176.15 1ivz h THR 35 N -0.97 1.41 -0.45 3.99 2.02 -1.87 -3.30 112.91 113.75 1ivz h THR 35 Ca -0.46 -3.13 0.13 0.00 0.77 0.00 0.00 66.41 63.71 1ivz h THR 35 Cb 1.27 2.75 -0.02 0.00 -1.74 0.00 0.00 68.15 70.41 1ivz h THR 35 CO 0.61 0.83 0.32 0.50 0.37 0.00 0.00 175.52 178.16 1ivz h LYS 36 N 0.02 0.00 -0.01 6.66 1.63 -1.92 0.50 116.57 123.46 1ivz h LYS 36 Ca -0.12 -0.00 -0.04 0.00 -0.85 0.00 0.00 60.65 59.64 1ivz h LYS 36 Cb 1.88 -0.00 0.00 0.00 -0.60 0.00 0.00 32.23 33.51 1ivz h LYS 36 CO 0.13 0.00 -0.14 -0.92 -3.45 0.00 0.00 179.45 175.07 1ivz h TYR 37 N 0.00 0.15 -0.40 1.91 5.03 -1.74 -2.63 116.97 119.30 1ivz h TYR 37 Ca 0.21 -0.08 -0.13 0.00 2.58 0.00 0.00 58.73 61.32 1ivz h TYR 37 Cb 0.85 -0.02 -0.01 0.00 1.55 0.00 0.00 36.73 39.10 1ivz h TYR 37 CO -0.00 0.85 -0.25 1.96 -1.32 0.00 0.00 178.16 179.41 1ivz h GLN 38 N -0.59 0.87 0.95 1.82 4.20 -1.47 -0.12 115.11 120.77 1ivz h GLN 38 Ca -0.02 -0.40 -0.05 0.00 0.06 0.00 0.00 58.65 58.24 1ivz h GLN 38 Cb 0.89 -0.01 0.01 0.00 0.30 0.00 0.00 27.48 28.66 1ivz h GLN 38 CO 0.03 1.05 -0.46 1.96 -0.67 0.00 0.00 178.83 180.73 1ivz h GLN 39 N 0.68 -1.24 -0.36 1.46 4.20 -0.13 0.14 115.11 119.86 1ivz h GLN 39 Ca 0.08 0.08 -0.00 0.00 0.06 0.00 0.00 58.65 58.88 1ivz h GLN 39 Cb 0.82 0.28 -0.02 0.00 0.30 0.00 0.00 27.48 28.86 1ivz h GLN 39 CO 0.07 -0.83 0.22 1.15 -0.67 0.00 0.00 178.83 178.78 1ivz h THR 40 N -1.29 1.11 -0.80 -0.54 2.02 -1.54 0.43 112.91 112.31 1ivz h THR 40 Ca -0.13 -0.25 0.06 0.00 0.77 0.00 0.00 66.41 66.86 1ivz h THR 40 Cb 0.99 0.63 -0.05 0.00 -1.74 0.00 0.00 68.15 67.98 1ivz h THR 40 CO 0.21 0.11 0.52 0.50 0.37 0.00 0.00 175.52 177.23 1ivz h LYS 41 N 0.48 0.86 0.00 6.66 3.64 -0.98 0.22 116.57 127.44 1ivz h LYS 41 Ca 0.13 -0.05 -0.22 0.00 -1.27 0.00 0.00 60.65 59.24 1ivz h LYS 41 Cb -0.01 -0.19 -0.03 0.00 -0.41 0.00 0.00 32.23 31.58 1ivz h LYS 41 CO -0.03 0.57 -1.12 -0.09 -2.27 0.00 0.00 179.45 176.51 1ivz h ARG 42 N 0.88 0.00 0.20 1.90 9.65 -0.22 -3.00 114.38 123.80 1ivz h ARG 42 Ca 0.34 0.00 -0.01 0.00 -1.10 0.00 0.00 59.98 59.21 1ivz h ARG 42 Cb 0.21 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 28.79 1ivz h ARG 42 CO -0.12 0.86 -0.10 1.03 2.80 0.00 0.00 179.97 184.44 1ivz h SER 43 N 0.00 -0.23 -0.58 -3.80 0.87 0.75 -2.28 113.55 108.28 1ivz h SER 43 Ca -0.07 -0.27 -0.01 0.00 -1.23 0.00 0.00 61.79 60.21 1ivz h SER 43 Cb 1.79 0.06 -0.03 0.00 -0.44 0.00 0.00 62.40 63.79 1ivz h SER 43 CO 0.11 0.19 0.33 0.40 -0.53 0.00 0.00 176.83 177.34 1ivz h ILE 44 N -0.71 1.18 -0.04 2.23 2.04 -1.13 -1.41 117.51 119.67 1ivz h ILE 44 Ca -0.03 -0.44 -0.01 0.00 1.00 0.00 0.00 64.86 65.38 1ivz h ILE 44 Cb 0.49 0.42 -0.00 0.00 -0.74 0.00 0.00 36.82 36.99 1ivz h ILE 44 CO 0.05 0.19 -0.01 -0.08 0.00 0.00 0.00 178.15 178.30 1ivz h GLU 45 N 0.78 0.05 0.01 2.37 4.22 -1.58 -1.79 114.58 118.64 1ivz h GLU 45 Ca 0.21 -0.00 -0.13 0.00 0.08 0.00 0.00 59.36 59.51 1ivz h GLU 45 Cb 0.02 -0.01 0.01 0.00 0.50 0.00 0.00 28.75 29.27 1ivz h GLU 45 CO -0.04 0.07 -0.51 -0.97 -2.18 0.00 0.00 179.01 175.38 1ivz h ASN 46 N 0.05 0.43 -0.99 1.04 -0.73 -0.76 -2.79 115.58 111.83 1ivz h ASN 46 Ca 0.01 -0.78 0.03 0.00 1.87 0.00 0.00 56.30 57.43 1ivz h ASN 46 Cb 0.05 -0.13 -0.05 0.00 0.27 0.00 0.00 38.32 38.45 1ivz h ASN 46 CO 0.00 1.16 0.65 0.00 -0.37 0.00 0.00 177.43 178.87 1ivz h ALA 47 N 0.28 1.29 -0.17 1.57 0.00 -0.88 -1.88 119.26 119.48 1ivz h ALA 47 Ca -0.07 -0.05 -0.11 0.00 0.00 0.00 0.00 54.91 54.68 1ivz h ALA 47 Cb 1.24 -0.37 -0.01 0.00 0.00 0.00 0.00 17.79 18.65 1ivz h ALA 47 CO 0.10 0.57 -0.39 -0.07 0.00 0.00 0.00 179.25 179.47 1ivz h LEU 48 N 1.28 0.40 -0.42 0.00 3.38 -1.41 -2.70 115.31 115.84 1ivz h LEU 48 Ca 0.38 -0.16 -0.00 0.00 0.09 0.00 0.00 57.88 58.19 1ivz h LEU 48 Cb -0.05 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 40.57 1ivz h LEU 48 CO -0.11 0.75 0.26 -1.13 0.09 0.00 0.00 178.44 178.30 1ivz h ASN 49 N 0.32 0.50 0.20 -0.43 -0.73 -1.06 -2.31 115.58 112.07 1ivz h ASN 49 Ca 0.03 -0.05 -0.01 0.00 1.87 0.00 0.00 56.30 58.14 1ivz h ASN 49 Cb 0.82 -0.13 0.00 0.00 0.27 0.00 0.00 38.32 39.29 1ivz h ASN 49 CO 0.07 0.41 -0.10 -0.61 -0.37 0.00 0.00 177.43 176.82 1ivz h GLN 50 N 0.56 -0.26 -1.02 6.67 -0.00 -1.39 -2.90 115.11 116.77 1ivz h GLN 50 Ca 0.15 0.02 0.26 0.00 -0.00 0.00 0.00 58.65 59.08 1ivz h GLN 50 Cb -0.01 0.06 -0.08 0.00 0.00 0.00 0.00 27.48 27.46 1ivz h GLN 50 CO -0.03 -0.01 0.68 1.25 0.00 0.00 0.00 178.83 180.72 1ivz h LEU 51 N -0.49 0.33 0.72 -2.39 6.46 -1.40 -1.06 115.31 117.49 1ivz h LEU 51 Ca -0.03 0.05 -0.04 0.00 -0.12 0.00 0.00 57.88 57.75 1ivz h LEU 51 Cb 0.37 -0.00 0.01 0.00 -0.73 0.00 0.00 40.66 40.31 1ivz h LEU 51 CO 0.05 0.08 -0.35 -0.26 -0.62 0.00 0.00 178.44 177.34 1ivz h PHE 52 N 0.30 -0.90 -0.21 1.25 0.04 -1.21 0.90 116.94 117.11 1ivz h PHE 52 Ca 0.55 -0.02 0.06 0.00 2.80 0.00 0.00 57.97 61.36 1ivz h PHE 52 Cb 1.56 0.30 -0.01 0.00 2.20 0.00 0.00 35.95 40.00 1ivz h PHE 52 CO -0.00 -0.56 0.21 0.07 -0.60 0.00 0.00 178.31 177.42 1ivz h ARG 53 N -1.09 0.00 0.00 1.51 0.11 -1.31 0.38 114.38 113.98 1ivz h ARG 53 Ca -0.10 0.00 -0.20 0.00 0.10 0.00 0.00 59.98 59.78 1ivz h ARG 53 Cb 0.75 0.00 -0.03 0.00 1.11 0.00 0.00 29.97 31.80 1ivz h ARG 53 CO 0.16 0.00 -0.97 -0.91 0.10 0.00 0.00 179.97 178.35 1ivz h ASN 54 N 0.00 0.00 -3.61 0.08 2.35 -1.01 -3.42 115.58 109.97 1ivz h ASN 54 Ca 0.10 0.00 -0.47 0.00 -0.55 0.00 0.00 56.30 55.39 1ivz h ASN 54 Cb 0.52 0.00 0.21 0.00 0.05 0.00 0.00 38.32 39.09 1ivz h ASN 54 CO -0.00 0.97 0.08 -0.94 -1.65 0.00 0.00 177.43 175.89 1ivz s SER 55 N -6.69 1.62 0.44 5.81 1.04 0.29 -4.90 113.70 111.31 1ivz s SER 55 Ca 0.01 1.76 0.19 0.00 0.48 0.00 0.00 55.95 58.39 1ivz s SER 55 Cb 0.10 -2.41 1.01 0.00 0.10 0.00 0.00 66.02 64.82 1ivz s SER 55 CO 0.82 -3.84 1.93 -1.28 0.98 0.00 0.00 173.24 171.84 1ivz h SER 56 N -2.38 0.00 -1.08 7.02 0.87 -1.90 -2.97 113.55 113.12 1ivz h SER 56 Ca -0.55 0.00 -0.53 0.00 -1.23 0.00 0.00 61.79 59.47 1ivz h SER 56 Cb 1.31 0.00 -0.20 0.00 -0.44 0.00 0.00 62.40 63.07 1ivz h SER 56 CO 0.47 0.25 0.60 2.30 -0.53 0.00 0.00 176.83 179.92 1ivz n ILE 57 N -3.92 3.29 -1.52 2.23 -5.35 -1.26 -4.75 119.36 108.07 1ivz n ILE 57 Ca -0.02 -2.88 -0.31 0.00 -0.27 0.00 0.00 62.75 59.27 1ivz n ILE 57 Cb 0.33 -1.39 -0.06 0.00 -1.74 0.00 0.00 39.64 36.78 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 0.19 3.34 0.00 6.28 2.85 -1.12 -3.34 118.16 126.36 1ivz n LYS 58 Ca 0.47 -2.43 0.00 0.00 -1.05 0.00 0.00 58.31 55.30 1ivz n LYS 58 Cb 0.52 -2.42 0.00 0.00 -0.65 0.00 0.00 35.03 32.48 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 2.05 0.00 0.01 -5.58 2.88 -1.26 -4.93 113.62 106.80 1ivz n SER 59 Ca 0.59 0.00 -0.09 0.00 -1.33 0.00 0.00 58.87 58.04 1ivz n SER 59 Cb 0.45 0.25 -0.13 0.00 -0.75 0.00 0.00 64.21 64.03 1ivz n SER 59 CO 0.00 0.00 0.00 1.88 -1.23 0.00 0.00 175.04 175.69 1ivz h TYR 60 N 0.00 0.04 -2.41 0.66 0.05 -1.97 -3.46 116.97 109.89 1ivz h TYR 60 Ca 0.00 -0.03 -0.54 0.00 0.05 0.00 0.00 58.73 58.22 1ivz h TYR 60 Cb 0.00 -0.00 0.01 0.00 1.01 0.00 0.00 36.73 37.75 1ivz h TYR 60 CO 0.00 1.04 1.21 0.12 -1.05 0.00 0.00 178.16 179.48 1ivz s PHE 61 N -2.64 1.40 -0.07 4.88 2.19 -1.21 -1.82 117.98 120.71 1ivz s PHE 61 Ca -0.03 -0.32 -0.03 0.00 0.33 0.00 0.00 56.93 56.88 1ivz s PHE 61 Cb 0.09 -4.18 -0.01 0.00 -1.31 0.00 0.00 43.02 37.61 1ivz s PHE 61 CO 0.82 -5.23 -0.05 0.77 1.83 0.00 0.00 175.22 173.36 1ivz h SER 62 N 10.51 0.00 -1.96 6.13 0.02 -1.86 -3.45 113.55 122.94 1ivz h SER 62 Ca -0.47 0.00 0.32 0.00 -0.84 0.00 0.00 61.79 60.80 1ivz h SER 62 Cb 1.23 0.00 -0.06 0.00 0.14 0.00 0.00 62.40 63.71 1ivz h SER 62 CO 0.94 0.38 0.84 -0.67 -1.14 0.00 0.00 176.83 177.18 1ivz n ASP 63 N -3.73 -1.08 -4.58 3.07 2.03 -1.24 -5.01 116.55 106.01 1ivz n ASP 63 Ca -0.02 -1.21 -0.25 0.00 0.52 0.00 0.00 54.79 53.83 1ivz n ASP 63 Cb 0.07 1.68 -0.10 0.00 -0.72 0.00 0.00 41.12 42.05 1ivz n ASP 63 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1ivz s GLN 65 N -3.65 0.35 -0.73 0.00 -0.44 -0.87 -4.90 119.66 109.41 1ivz s GLN 65 Ca 0.33 -0.34 -0.26 0.00 -2.50 0.00 0.00 55.36 52.59 1ivz s GLN 65 Cb 0.01 -1.86 0.01 0.00 -1.64 0.00 0.00 33.01 29.53 1ivz s GLN 65 CO 0.18 -0.73 1.53 0.54 0.50 0.00 0.00 175.29 177.31 1ivz s VAL 66 N 1.99 3.60 0.07 1.34 0.11 -1.26 -0.89 120.40 125.36 1ivz s VAL 66 Ca 0.02 0.19 -0.34 0.00 -2.93 0.00 0.00 61.98 58.92 1ivz s VAL 66 Cb -0.16 -4.54 -0.18 0.00 -1.53 0.00 0.00 36.38 29.96 1ivz s VAL 66 CO -0.13 -1.49 1.60 -0.07 -3.33 0.00 0.00 175.10 171.68 1ivz h LEU 67 N 14.46 -0.95 -7.80 2.54 3.38 -0.56 -3.48 115.31 122.89 1ivz h LEU 67 Ca -0.21 0.05 0.29 0.00 0.09 0.00 0.00 57.88 58.10 1ivz h LEU 67 Cb 1.08 0.27 -0.07 0.00 0.09 0.00 0.00 40.66 42.03 1ivz h LEU 67 CO 1.27 -0.62 0.80 0.00 0.09 0.00 0.00 178.44 179.98 1ivz s ALA 68 N -6.01 -2.19 0.03 1.53 0.00 -1.15 -5.06 121.76 108.91 1ivz s ALA 68 Ca -0.18 0.08 0.02 0.00 0.00 0.00 0.00 51.96 51.88 1ivz s ALA 68 Cb 0.04 0.75 -0.04 0.00 0.00 0.00 0.00 23.12 23.87 1ivz s ALA 68 CO 0.62 -1.11 0.03 -0.06 0.00 0.00 0.00 175.76 175.24 1ivz s PHE 69 N -2.18 3.12 -0.17 0.00 0.08 -1.26 -1.92 117.98 115.65 1ivz s PHE 69 Ca 0.24 0.08 -0.12 0.00 0.12 0.00 0.00 56.93 57.26 1ivz s PHE 69 Cb 0.00 -1.65 -0.05 0.00 -0.57 0.00 0.00 43.02 40.76 1ivz s PHE 69 CO 0.00 0.49 0.21 0.50 -0.10 0.00 0.00 175.22 176.32 1ivz s ARG 70 N -1.91 4.16 -0.07 0.44 6.06 -0.46 -4.84 118.95 122.32 1ivz s ARG 70 Ca 0.23 -0.07 -0.25 0.00 -2.50 0.00 0.00 55.73 53.15 1ivz s ARG 70 Cb -0.12 -3.40 -0.03 0.00 0.06 0.00 0.00 34.95 31.46 1ivz s ARG 70 CO 0.15 0.31 0.76 0.45 -2.50 0.00 0.00 175.30 174.47 1ivz s SER 71 N 0.28 7.03 -0.09 -2.12 0.15 -1.26 -0.98 113.70 116.71 1ivz s SER 71 Ca 0.12 1.24 -0.02 0.00 0.70 0.00 0.00 55.95 58.00 1ivz s SER 71 Cb -0.12 -2.44 -0.03 0.00 -1.71 0.00 0.00 66.02 61.72 1ivz s SER 71 CO 0.01 -0.18 -0.01 0.68 1.20 0.00 0.00 173.24 174.94 1ivz s VAL 72 N 1.05 4.17 -0.05 4.45 -7.23 -1.26 -4.97 120.40 116.55 1ivz s VAL 72 Ca 0.39 -0.29 0.09 0.00 -1.81 0.00 0.00 61.98 60.36 1ivz s VAL 72 Cb -0.18 -2.75 -0.13 0.00 0.56 0.00 0.00 36.38 33.87 1ivz s VAL 72 CO 0.19 0.59 0.12 -1.20 -0.31 0.00 0.00 175.10 174.49 1ivz n SER 73 N 2.30 2.74 0.01 4.85 7.64 -1.26 -3.85 113.62 126.06 1ivz n SER 73 Ca -0.18 0.00 -0.01 0.00 1.01 0.00 0.00 58.87 59.69 1ivz n SER 73 Cb 0.53 1.08 -0.01 0.00 -1.01 0.00 0.00 64.21 64.81 1ivz n SER 73 CO 0.00 0.00 0.00 -1.13 -3.01 0.00 0.00 175.04 170.90 1ivz h ASN 74 N 0.00 -0.07 0.60 6.43 -1.24 -2.03 -3.32 115.58 115.95 1ivz h ASN 74 Ca -0.13 0.01 -0.26 0.00 0.71 0.00 0.00 56.30 56.63 1ivz h ASN 74 Cb 1.02 0.02 -0.04 0.00 0.73 0.00 0.00 38.32 40.05 1ivz h ASN 74 CO 0.01 -0.03 -1.56 -1.13 -1.29 0.00 0.00 177.43 173.43 1ivz h ASN 75 N -0.05 0.00 -2.17 1.15 -0.73 -2.01 -3.48 115.58 108.29 1ivz h ASN 75 Ca -0.00 0.00 -0.36 0.00 1.87 0.00 0.00 56.30 57.81 1ivz h ASN 75 Cb 0.05 0.00 -0.05 0.00 0.27 0.00 0.00 38.32 38.59 1ivz h ASN 75 CO -0.00 0.92 -0.43 0.59 -0.37 0.00 0.00 177.43 178.14 1ivz n ASN 76 N -3.06 -5.22 -0.41 1.15 4.13 -1.25 -4.82 115.26 105.78 1ivz n ASN 76 Ca -0.13 0.09 0.00 0.00 1.68 0.00 0.00 54.58 56.22 1ivz n ASN 76 Cb 1.00 -4.29 0.00 0.00 -1.54 0.00 0.00 39.78 34.95 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 -1.31 0.00 -3.44 6.41 4.05 -1.26 -4.63 115.26 115.08 1ivz n ASN 77 Ca -0.21 -1.70 -0.19 0.00 0.45 0.00 0.00 54.58 52.93 1ivz n ASN 77 Cb 0.65 -0.14 -0.04 0.00 1.23 0.00 0.00 39.78 41.47 1ivz n ASN 77 CO 0.00 0.00 0.00 1.41 -3.05 0.00 0.00 177.26 175.62 1ivz n HIS 78 N 0.00 0.56 -3.46 1.20 -0.00 -1.25 -3.49 115.22 108.78 1ivz n HIS 78 Ca 0.00 -1.52 0.01 0.00 -0.00 0.00 0.00 57.72 56.21 1ivz n HIS 78 Cb 0.64 -0.15 -0.03 0.00 -0.00 0.00 0.00 29.99 30.44 1ivz n HIS 78 CO 0.00 0.00 0.00 0.99 -0.00 0.00 0.00 176.34 177.33 1ivz s THR 79 N -2.19 -0.80 0.34 1.59 2.01 -0.58 -2.23 115.64 113.78 1ivz s THR 79 Ca 0.03 0.00 -0.28 0.00 0.31 0.00 0.00 61.69 61.75 1ivz s THR 79 Cb 0.00 -1.00 -0.10 0.00 0.01 0.00 0.00 72.50 71.41 1ivz s THR 79 CO 0.02 0.00 1.30 -0.83 -0.69 0.00 0.00 174.62 174.42 1ivz s GLY 80 N 2.76 2.99 -0.69 4.40 0.00 -0.16 -0.81 107.32 115.82 1ivz s GLY 80 Ca -0.00 1.25 -0.02 0.00 0.00 0.00 0.00 44.72 45.94 1ivz s GLY 80 CO -0.18 1.88 0.52 0.14 0.00 0.00 0.00 173.10 175.46 1ivz s VAL 81 N -1.16 3.84 -1.11 1.40 1.01 -0.91 -1.35 120.40 122.12 1ivz s VAL 81 Ca 0.50 -3.21 -0.18 0.00 0.00 0.00 0.00 61.98 59.09 1ivz s VAL 81 Cb -0.39 -3.47 0.10 0.00 0.00 0.00 0.00 36.38 32.62 1ivz s VAL 81 CO 0.52 -0.93 1.44 -0.62 0.00 0.00 0.00 175.10 175.51 1ivz s ASP 82 N 0.43 6.75 0.38 3.32 -1.08 -0.81 -2.62 116.67 123.04 1ivz s ASP 82 Ca 0.19 -2.22 0.05 0.00 -0.52 0.00 0.00 52.55 50.06 1ivz s ASP 82 Cb -0.17 -2.49 0.05 0.00 -1.46 0.00 0.00 42.92 38.85 1ivz s ASP 82 CO -0.06 -1.13 0.44 -1.54 0.52 0.00 0.00 175.17 173.40 1ivz n SER 83 N 7.42 1.70 -3.54 -0.34 3.41 0.26 0.18 113.62 122.71 1ivz n SER 83 Ca 0.36 -2.12 -0.28 0.00 -0.26 0.00 0.00 58.87 56.57 1ivz n SER 83 Cb 0.47 -0.19 -0.15 0.00 -0.26 0.00 0.00 64.21 64.09 1ivz n SER 83 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 1ivz s LEU 84 N 0.00 0.44 -0.91 1.04 1.98 -0.07 -0.63 118.68 120.53 1ivz s LEU 84 Ca 0.33 -1.14 -0.24 0.00 -2.89 0.00 0.00 54.13 50.19 1ivz s LEU 84 Cb -0.03 -0.26 -0.16 0.00 0.66 0.00 0.00 46.19 46.40 1ivz s LEU 84 CO 0.21 -0.42 1.91 0.00 -1.89 0.00 0.00 176.35 176.16 1ivz s ASN 86 N 6.27 5.05 0.03 0.00 0.01 -0.63 -2.23 114.94 123.44 1ivz s ASN 86 Ca 0.66 1.98 -0.00 0.00 -0.71 0.00 0.00 52.86 54.79 1ivz s ASN 86 Cb 0.06 -2.55 -0.03 0.00 0.41 0.00 0.00 41.25 39.14 1ivz s ASN 86 CO 0.16 -1.67 -0.03 -0.36 -1.51 0.00 0.00 177.10 173.69 1ivz s PHE 87 N -2.41 0.37 0.81 2.20 0.40 -1.01 -3.64 117.98 114.71 1ivz s PHE 87 Ca 0.66 -0.70 -0.12 0.00 -0.60 0.00 0.00 56.93 56.17 1ivz s PHE 87 Cb -0.20 -0.27 0.08 0.00 0.51 0.00 0.00 43.02 43.14 1ivz s PHE 87 CO 0.43 -0.24 1.12 -1.12 0.70 0.00 0.00 175.22 176.11 1ivz s SER 88 N -1.94 4.39 0.43 1.36 0.01 -0.75 -3.99 113.70 113.19 1ivz s SER 88 Ca -0.08 1.10 0.20 0.00 1.31 0.00 0.00 55.95 58.47 1ivz s SER 88 Cb -0.04 -1.76 0.96 0.00 0.21 0.00 0.00 66.02 65.38 1ivz s SER 88 CO -0.04 -2.01 1.88 1.55 0.41 0.00 0.00 173.24 175.03 1ivz h PRO 89 N -1.12 0.00 -0.02 12.44 0.13 -1.93 -2.81 132.00 138.68 1ivz h PRO 89 Ca -0.47 0.00 0.01 0.00 -0.87 0.00 0.00 66.00 64.66 1ivz h PRO 89 Cb 1.29 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.42 1ivz h PRO 89 CO 0.62 0.28 0.02 -0.07 -0.23 0.00 0.00 178.00 178.62 1ivz h LEU 90 N 0.00 0.00-10.02 1.56 4.07 -1.93 -3.41 115.31 105.59 1ivz h LEU 90 Ca -0.00 0.00 -0.47 0.00 0.08 0.00 0.00 57.88 57.49 1ivz h LEU 90 Cb 0.62 0.00 0.22 0.00 1.08 0.00 0.00 40.66 42.58 1ivz h LEU 90 CO 0.04 0.00 -0.26 0.00 -1.08 0.00 0.00 178.44 177.13 1ivz n ALA 91 N -2.53 -2.79 -3.55 1.53 0.00 -1.06 -5.04 120.51 107.07 1ivz n ALA 91 Ca -0.02 -1.04 -0.01 0.00 0.00 0.00 0.00 53.44 52.37 1ivz n ALA 91 Cb 0.11 -1.91 -0.06 0.00 0.00 0.00 0.00 19.45 17.60 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 -4.15 0.32 -1.12 0.00 3.52 -1.26 -4.94 118.95 111.31 1ivz s ARG 92 Ca 0.64 0.64 -0.04 0.00 -0.13 0.00 0.00 55.73 56.84 1ivz s ARG 92 Cb -0.22 0.21 0.00 0.00 -1.56 0.00 0.00 34.95 33.38 1ivz s ARG 92 CO 0.64 -0.08 0.96 -2.13 -0.81 0.00 0.00 175.30 173.88 1ivz n ARG 93 N 4.15 -6.42 -2.76 5.12 0.00 -1.26 -4.92 116.66 110.57 1ivz n ARG 93 Ca -0.15 0.73 -0.43 0.00 -0.00 0.00 0.00 57.85 58.01 1ivz n ARG 93 Cb 0.56 -5.45 -0.03 0.00 0.00 0.00 0.00 32.46 27.53 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 -3.30 4.36 0.57 5.15 1.01 -1.26 -5.01 120.40 121.94 1ivz s VAL 94 Ca 0.27 -1.21 -0.20 0.00 0.00 0.00 0.00 61.98 60.84 1ivz s VAL 94 Cb -0.12 -4.91 -0.04 0.00 0.00 0.00 0.00 36.38 31.32 1ivz s VAL 94 CO 0.64 -1.70 1.25 -1.81 0.00 0.00 0.00 175.10 173.48 1ivz s ASP 95 N 4.24 5.22 0.45 3.32 1.11 -1.26 -4.90 116.67 124.85 1ivz s ASP 95 Ca 0.39 2.51 0.11 0.00 0.18 0.00 0.00 52.55 55.74 1ivz s ASP 95 Cb -0.03 -2.61 1.03 0.00 1.07 0.00 0.00 42.92 42.38 1ivz s ASP 95 CO -0.10 -1.58 2.07 0.08 1.18 0.00 0.00 175.17 176.83 1ivz h ARG 96 N 1.11 0.34 -0.02 8.23 0.11 -1.95 -0.90 114.38 121.30 1ivz h ARG 96 Ca -0.51 -0.02 0.00 0.00 0.10 0.00 0.00 59.98 59.56 1ivz h ARG 96 Cb 1.30 -0.08 -0.00 0.00 1.11 0.00 0.00 29.97 32.30 1ivz h ARG 96 CO 0.56 0.22 0.01 0.28 0.10 0.00 0.00 179.97 181.15 1ivz h VAL 97 N 0.35 0.70 0.77 0.08 2.07 -1.90 -1.50 116.25 116.82 1ivz h VAL 97 Ca 0.13 0.00 -0.04 0.00 0.82 0.00 0.00 66.70 67.61 1ivz h VAL 97 Cb 0.08 0.99 0.01 0.00 -1.52 0.00 0.00 31.29 30.84 1ivz h VAL 97 CO -0.03 0.00 -0.39 0.00 0.02 0.00 0.00 177.57 177.17 1ivz h ALA 98 N 1.99 -1.27 0.00 1.67 0.00 -1.51 0.59 119.26 120.72 1ivz h ALA 98 Ca 0.01 -0.23 -0.04 0.00 0.00 0.00 0.00 54.91 54.65 1ivz h ALA 98 Cb 0.04 0.45 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 1ivz h ALA 98 CO -0.00 -1.20 -0.20 0.82 0.00 0.00 0.00 179.25 178.67 1ivz h ILE 99 N -1.06 0.64 -0.05 0.00 2.04 -1.65 -0.62 117.51 116.80 1ivz h ILE 99 Ca -0.10 -0.87 -0.18 0.00 1.00 0.00 0.00 64.86 64.70 1ivz h ILE 99 Cb 0.82 1.56 0.01 0.00 -0.74 0.00 0.00 36.82 38.48 1ivz h ILE 99 CO 0.16 0.19 -0.67 0.22 0.00 0.00 0.00 178.15 178.05 1ivz h TYR 100 N 0.00 0.78 0.09 1.37 3.20 -1.07 -2.69 116.97 118.65 1ivz h TYR 100 Ca -0.00 -0.39 -0.00 0.00 3.14 0.00 0.00 58.73 61.48 1ivz h TYR 100 Cb 0.55 -0.10 0.00 0.00 1.54 0.00 0.00 36.73 38.71 1ivz h TYR 100 CO 0.00 1.20 -0.04 0.93 -1.64 0.00 0.00 178.16 178.60 1ivz h GLU 101 N 0.15 -0.12 -0.52 1.82 5.08 0.37 -2.13 114.58 119.23 1ivz h GLU 101 Ca -0.07 0.01 0.15 0.00 -1.00 0.00 0.00 59.36 58.45 1ivz h GLU 101 Cb 1.34 0.03 -0.02 0.00 0.50 0.00 0.00 28.75 30.60 1ivz h GLU 101 CO 0.14 0.40 0.37 0.93 -1.00 0.00 0.00 179.01 179.85 1ivz h GLU 102 N -0.89 0.00 0.10 2.33 3.07 -1.26 -0.59 114.58 117.34 1ivz h GLU 102 Ca -0.01 0.00 -0.16 0.00 -0.50 0.00 0.00 59.36 58.69 1ivz h GLU 102 Cb 0.57 0.00 0.02 0.00 -0.84 0.00 0.00 28.75 28.50 1ivz h GLU 102 CO 0.02 0.00 -0.68 0.35 -1.40 0.00 0.00 179.01 177.30 1ivz h PHE 103 N 0.00 0.50 0.26 4.33 3.57 -1.52 -3.09 116.94 120.99 1ivz h PHE 103 Ca 0.25 -0.34 -0.01 0.00 3.53 0.00 0.00 57.97 61.39 1ivz h PHE 103 Cb 0.99 -0.03 0.00 0.00 2.79 0.00 0.00 35.95 39.71 1ivz h PHE 103 CO 0.00 1.24 -0.13 -0.07 -2.23 0.00 0.00 178.31 177.12 1ivz h LEU 104 N -0.38 -0.30 -0.75 0.59 3.38 -0.60 0.10 115.31 117.36 1ivz h LEU 104 Ca -0.11 -0.02 0.09 0.00 0.09 0.00 0.00 57.88 57.93 1ivz h LEU 104 Cb 1.50 0.08 -0.07 0.00 0.09 0.00 0.00 40.66 42.26 1ivz h LEU 104 CO 0.13 -0.18 0.41 0.03 0.09 0.00 0.00 178.44 178.91 1ivz h ARG 105 N -0.38 0.67 0.00 1.13 3.08 -1.29 -0.73 114.38 116.85 1ivz h ARG 105 Ca -0.04 -0.04 -0.11 0.00 0.07 0.00 0.00 59.98 59.86 1ivz h ARG 105 Cb 0.29 -0.15 -0.02 0.00 0.08 0.00 0.00 29.97 30.18 1ivz h ARG 105 CO 0.06 0.45 -0.54 1.98 -1.07 0.00 0.00 179.97 180.85 1ivz h MET 106 N 0.69 0.00 -0.60 0.04 4.05 -1.43 -2.86 114.93 114.84 1ivz h MET 106 Ca 0.36 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.78 1ivz h MET 106 Cb 0.34 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.14 1ivz h MET 106 CO -0.25 0.54 0.00 0.25 0.23 0.00 0.00 176.91 177.68 1ivz n THR 107 N -3.74 1.15 -3.00 -0.77 -2.24 0.35 -4.70 114.28 101.33 1ivz n THR 107 Ca -0.01 -0.74 -0.14 0.00 -2.27 0.00 0.00 64.05 60.89 1ivz n THR 107 Cb 0.58 -0.01 0.01 0.00 -2.10 0.00 0.00 70.33 68.81 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 0.64 -3.30 -2.31 4.78 -0.00 -0.43 -0.60 115.22 113.99 1ivz n HIS 108 Ca 0.16 1.34 -0.19 0.00 -0.00 0.00 0.00 57.72 59.03 1ivz n HIS 108 Cb 0.61 -3.65 -0.02 0.00 -0.00 0.00 0.00 29.99 26.93 1ivz n HIS 108 CO 0.00 0.00 0.00 0.09 -0.00 0.00 0.00 176.34 176.43 1ivz n ASN 109 N -0.40 -5.38 -3.73 0.41 4.13 -0.79 -1.87 115.26 107.63 1ivz n ASN 109 Ca 0.07 0.08 -0.26 0.00 1.68 0.00 0.00 54.58 56.15 1ivz n ASN 109 Cb 0.51 -4.53 0.06 0.00 -1.54 0.00 0.00 39.78 34.27 1ivz n ASN 109 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1ivz n GLY 110 N -0.89 -0.51 0.00 7.41 0.00 -1.06 -4.77 105.19 105.36 1ivz n GLY 110 Ca -0.22 0.22 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 -4.81 0.00 -3.80 2.61 -2.24 -0.78 -2.11 114.28 103.16 1ivz n THR 111 Ca -0.00 0.00 -0.26 0.00 -2.27 0.00 0.00 64.05 61.52 1ivz n THR 111 Cb 0.56 -0.85 -0.17 0.00 -2.10 0.00 0.00 70.33 67.77 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 -2.00 0.88 -0.64 -0.78 0.74 0.23 -0.76 119.66 117.33 1ivz s GLN 112 Ca 0.00 -0.24 -0.16 0.00 0.05 0.00 0.00 55.36 55.01 1ivz s GLN 112 Cb 0.00 -1.65 0.16 0.00 1.10 0.00 0.00 33.01 32.62 1ivz s GLN 112 CO 0.00 -0.45 0.61 -1.17 -0.55 0.00 0.00 175.29 173.73 1ivz s LEU 113 N 1.84 6.32 0.00 3.68 1.98 0.16 -3.97 118.68 128.69 1ivz s LEU 113 Ca 0.02 -2.07 0.00 0.00 -2.89 0.00 0.00 54.13 49.19 1ivz s LEU 113 Cb -0.15 -2.22 0.00 0.00 0.66 0.00 0.00 46.19 44.49 1ivz s LEU 113 CO -0.07 -0.78 0.00 0.18 -1.89 0.00 0.00 176.35 173.79 1ivz n LEU 114 N 4.91 0.00 -1.45 -0.68 4.77 -1.26 -0.89 117.00 122.39 1ivz n LEU 114 Ca -0.04 0.00 0.04 0.00 -0.03 0.00 0.00 56.01 55.98 1ivz n LEU 114 Cb 0.43 0.00 0.03 0.00 -2.33 0.00 0.00 43.42 41.55 1ivz n LEU 114 CO 0.47 0.00 0.08 -3.20 -1.33 0.00 0.00 177.39 173.41 1ivz n ASN 115 N 1.46 1.03 -3.54 -1.43 4.05 -1.26 -5.03 115.26 110.55 1ivz n ASN 115 Ca 0.00 -2.09 -0.23 0.00 0.45 0.00 0.00 54.58 52.71 1ivz n ASN 115 Cb 0.00 -0.31 -0.15 0.00 1.23 0.00 0.00 39.78 40.55 1ivz n ASN 115 CO 0.00 0.00 0.00 -0.36 -3.05 0.00 0.00 177.26 173.85 1ivz s PHE 116 N -0.16 0.00 -0.27 1.20 0.08 -0.07 -5.09 117.98 113.67 1ivz s PHE 116 Ca 0.34 -0.21 -0.29 0.00 0.12 0.00 0.00 56.93 56.89 1ivz s PHE 116 Cb 0.39 -0.59 -0.02 0.00 -0.57 0.00 0.00 43.02 42.23 1ivz s PHE 116 CO -0.16 -0.62 1.56 0.95 -0.10 0.00 0.00 175.22 176.84 1ivz s THR 117 N 2.21 3.77 0.22 0.64 -4.23 -1.26 -0.67 115.64 116.33 1ivz s THR 117 Ca 0.05 0.85 0.09 0.00 -1.18 0.00 0.00 61.69 61.51 1ivz s THR 117 Cb -0.16 -3.84 -0.05 0.00 1.34 0.00 0.00 72.50 69.80 1ivz s THR 117 CO -0.16 -0.39 -0.16 -1.48 -0.54 0.00 0.00 174.62 171.88 1ivz s LEU 118 N 5.27 2.55 0.79 4.79 0.05 0.06 -0.96 118.68 131.23 1ivz s LEU 118 Ca 0.68 -1.00 -0.12 0.00 0.05 0.00 0.00 54.13 53.74 1ivz s LEU 118 Cb -0.22 -0.79 0.07 0.00 -2.05 0.00 0.00 46.19 43.20 1ivz s LEU 118 CO 0.29 -0.10 1.15 -0.62 -0.55 0.00 0.00 176.35 176.51 1ivz s ASP 119 N -3.27 4.01 -0.24 1.48 2.15 -1.05 -3.92 116.67 115.83 1ivz s ASP 119 Ca 0.23 2.13 -0.16 0.00 0.43 0.00 0.00 52.55 55.18 1ivz s ASP 119 Cb -0.02 -2.56 -0.13 0.00 -0.30 0.00 0.00 42.92 39.91 1ivz s ASP 119 CO 0.09 -2.38 -0.20 -1.14 -0.17 0.00 0.00 175.17 171.37 1ivz n ARG 120 N -3.33 0.57 0.14 4.34 0.00 -0.89 -4.18 116.66 113.31 1ivz n ARG 120 Ca 0.11 0.35 0.14 0.00 -0.00 0.00 0.00 57.85 58.46 1ivz n ARG 120 Cb 0.52 -1.56 0.68 0.00 0.00 0.00 0.00 32.46 32.10 1ivz n ARG 120 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.63 178.50 1ivz h LYS 121 N -1.00 0.00 -0.07 -0.14 1.57 -1.94 0.21 116.57 115.21 1ivz h LYS 121 Ca -0.50 0.00 -0.08 0.00 -1.87 0.00 0.00 60.65 58.20 1ivz h LYS 121 Cb 1.41 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.71 1ivz h LYS 121 CO -0.30 0.00 -0.33 1.03 -0.57 0.00 0.00 179.45 179.28 1ivz h SER 122 N 0.00 0.12 -2.59 0.86 0.87 -1.93 -3.43 113.55 107.45 1ivz h SER 122 Ca 0.12 -0.04 -0.53 0.00 -1.23 0.00 0.00 61.79 60.10 1ivz h SER 122 Cb 0.49 -0.03 0.02 0.00 -0.44 0.00 0.00 62.40 62.44 1ivz h SER 122 CO -0.00 0.45 1.07 -0.69 -0.53 0.00 0.00 176.83 177.14 1ivz s VAL 123 N -4.30 3.06 -0.21 2.23 1.01 0.06 -4.09 120.40 118.17 1ivz s VAL 123 Ca -0.04 0.38 -0.10 0.00 0.00 0.00 0.00 61.98 62.22 1ivz s VAL 123 Cb 0.14 -3.24 0.07 0.00 0.00 0.00 0.00 36.38 33.35 1ivz s VAL 123 CO 0.74 -0.01 0.49 0.12 0.00 0.00 0.00 175.10 176.43 1ivz s PHE 124 N 3.24 -0.77 -0.26 5.22 2.19 0.38 -4.99 117.98 123.00 1ivz s PHE 124 Ca 0.77 1.57 0.03 0.00 0.33 0.00 0.00 56.93 59.62 1ivz s PHE 124 Cb -0.40 0.38 0.06 0.00 -1.31 0.00 0.00 43.02 41.75 1ivz s PHE 124 CO 0.34 -0.42 -0.09 0.54 1.83 0.00 0.00 175.22 177.41 1ivz s VAL 125 N 1.72 2.03 0.21 3.12 0.11 -1.26 -2.00 120.40 124.33 1ivz s VAL 125 Ca -0.08 -1.56 0.10 0.00 -2.93 0.00 0.00 61.98 57.50 1ivz s VAL 125 Cb -0.08 -2.18 -0.04 0.00 -1.53 0.00 0.00 36.38 32.54 1ivz s VAL 125 CO -0.15 -0.06 -0.10 -0.62 -3.33 0.00 0.00 175.10 170.85 1ivz s ASP 126 N 1.16 4.19 -0.66 3.54 -1.08 -0.87 -4.80 116.67 118.15 1ivz s ASP 126 Ca -0.08 -0.66 -0.26 0.00 -0.52 0.00 0.00 52.55 51.03 1ivz s ASP 126 Cb -0.20 -0.67 -0.05 0.00 -1.46 0.00 0.00 42.92 40.54 1ivz s ASP 126 CO -0.05 0.07 2.09 -0.44 0.52 0.00 0.00 175.17 177.36 1ivz s SER 127 N -3.08 4.86 0.41 -0.34 0.01 -1.26 0.10 113.70 114.40 1ivz s SER 127 Ca 0.27 0.30 0.00 0.00 1.31 0.00 0.00 55.95 57.82 1ivz s SER 127 Cb -0.08 -2.53 0.00 0.00 0.21 0.00 0.00 66.02 63.62 1ivz s SER 127 CO 0.16 -2.77 0.00 0.61 0.41 0.00 0.00 173.24 171.65 1ivz n GLY 128 N 6.14 -1.68 3.86 3.44 0.00 -0.36 -4.80 105.19 111.79 1ivz n GLY 128 Ca 0.32 -1.07 -0.31 0.00 0.00 0.00 0.00 46.02 44.95 1ivz n GLY 128 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1ivz s PRO 129 N -1.87 3.45 -0.20 1.61 0.04 -1.26 -4.34 135.00 132.42 1ivz s PRO 129 Ca 0.00 0.81 -0.11 0.00 0.04 0.00 0.00 61.00 61.74 1ivz s PRO 129 Cb 0.00 -2.06 0.04 0.00 0.04 0.00 0.00 34.50 32.52 1ivz s PRO 129 CO 0.00 -0.69 0.21 0.43 0.04 0.00 0.00 177.00 176.99 1ivz n SER 130 N -2.82 -1.60 0.00 6.66 7.64 -1.26 -5.03 113.62 117.21 1ivz n SER 130 Ca 0.06 1.36 0.00 0.00 1.01 0.00 0.00 58.87 61.30 1ivz n SER 130 Cb 0.54 -5.21 0.00 0.00 -1.01 0.00 0.00 64.21 58.53 1ivz n SER 130 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 1ivz n SER 131 N 1.59 0.66 0.00 6.43 2.88 -1.26 -5.06 113.62 118.86 1ivz n SER 131 Ca -0.36 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.18 1ivz n SER 131 Cb 0.56 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.02 1ivz n SER 131 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42