#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 0.58 -0.22 1.61 0.01 -1.26 -5.15 113.70 109.28 1ivz s SER 2 Ca 0.00 -0.23 -0.29 0.00 1.31 0.00 0.00 55.95 56.74 1ivz s SER 2 Cb 0.00 -0.02 0.15 0.00 0.21 0.00 0.00 66.02 66.36 1ivz s SER 2 CO 0.00 -0.04 1.15 -0.94 0.41 0.00 0.00 173.24 173.83 1ivz s SER 3 N -0.57 -0.24 0.00 2.44 1.04 -1.26 -5.18 113.70 109.93 1ivz s SER 3 Ca -0.02 0.28 0.00 0.00 0.48 0.00 0.00 55.95 56.68 1ivz s SER 3 Cb -0.04 0.22 0.00 0.00 0.10 0.00 0.00 66.02 66.30 1ivz s SER 3 CO -0.00 -0.20 0.00 0.61 0.98 0.00 0.00 173.24 174.63 1ivz n GLY 4 N 0.76 1.23 3.70 7.32 0.00 -1.26 -5.14 105.19 111.80 1ivz n GLY 4 Ca -0.07 -1.61 -0.08 0.00 0.00 0.00 0.00 46.02 44.26 1ivz n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1ivz s SER 5 N -1.00 -0.26 -0.25 1.61 1.04 -1.26 -5.16 113.70 108.42 1ivz s SER 5 Ca 0.00 -0.59 -0.03 0.00 0.48 0.00 0.00 55.95 55.81 1ivz s SER 5 Cb 0.00 0.66 0.14 0.00 0.10 0.00 0.00 66.02 66.92 1ivz s SER 5 CO 0.00 -1.22 0.44 -0.44 0.98 0.00 0.00 173.24 173.00 1ivz s SER 6 N -2.91 -0.21 0.00 7.02 0.01 -1.26 -5.15 113.70 111.20 1ivz s SER 6 Ca 0.12 0.47 0.00 0.00 1.31 0.00 0.00 55.95 57.85 1ivz s SER 6 Cb -0.04 1.40 0.00 0.00 0.21 0.00 0.00 66.02 67.60 1ivz s SER 6 CO 0.04 -0.28 0.00 0.61 0.41 0.00 0.00 173.24 174.01 1ivz n GLY 7 N 5.38 0.04 3.34 3.44 0.00 -1.26 -5.05 105.19 111.09 1ivz n GLY 7 Ca -0.04 -1.27 -0.26 0.00 0.00 0.00 0.00 46.02 44.46 1ivz n GLY 7 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1ivz n SER 8 N 0.00 -0.30 -3.62 1.61 2.88 -1.26 -5.11 113.62 107.82 1ivz n SER 8 Ca 0.00 -1.36 -0.09 0.00 -1.33 0.00 0.00 58.87 56.09 1ivz n SER 8 Cb 0.00 -0.90 -0.02 0.00 -0.75 0.00 0.00 64.21 62.54 1ivz n SER 8 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 1ivz s SER 9 N -5.07 -0.41 0.81 -3.46 0.15 -1.26 -5.18 113.70 99.28 1ivz s SER 9 Ca 0.66 -0.27 -0.10 0.00 0.70 0.00 0.00 55.95 56.94 1ivz s SER 9 Cb -0.03 0.64 0.12 0.00 -1.71 0.00 0.00 66.02 65.04 1ivz s SER 9 CO 0.47 -1.11 1.14 -0.94 1.20 0.00 0.00 173.24 174.00 1ivz s SER 10 N -2.82 4.13 1.28 5.45 1.04 -1.26 -4.92 113.70 116.61 1ivz s SER 10 Ca 0.06 0.34 -0.17 0.00 0.48 0.00 0.00 55.95 56.66 1ivz s SER 10 Cb -0.03 -0.72 0.26 0.00 0.10 0.00 0.00 66.02 65.62 1ivz s SER 10 CO -0.04 -2.07 0.70 -1.54 0.98 0.00 0.00 173.24 171.28 1ivz n SER 11 N -3.26 -2.85 -4.07 7.02 3.41 -1.26 -4.77 113.62 107.84 1ivz n SER 11 Ca 0.11 -0.79 -0.16 0.00 -0.26 0.00 0.00 58.87 57.78 1ivz n SER 11 Cb 0.60 -0.73 -0.13 0.00 -0.26 0.00 0.00 64.21 63.70 1ivz n SER 11 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1ivz s GLN 12 N -4.64 0.65 -0.23 4.33 -2.07 -1.26 -4.93 119.66 111.50 1ivz s GLN 12 Ca 0.50 -0.63 -0.00 0.00 -1.82 0.00 0.00 55.36 53.41 1ivz s GLN 12 Cb -0.07 -0.56 0.06 0.00 -1.09 0.00 0.00 33.01 31.36 1ivz s GLN 12 CO 0.40 0.13 -0.02 -1.01 -1.32 0.00 0.00 175.29 173.47 1ivz s HIS 13 N -0.90 2.05 -0.30 9.60 3.76 -1.26 -2.44 115.29 125.80 1ivz s HIS 13 Ca -0.03 -1.56 -0.15 0.00 -0.15 0.00 0.00 55.06 53.17 1ivz s HIS 13 Cb -0.07 -1.48 -0.03 0.00 1.11 0.00 0.00 32.58 32.11 1ivz s HIS 13 CO 0.01 -0.74 0.38 -0.06 -0.85 0.00 0.00 174.74 173.48 1ivz s PHE 14 N 1.51 3.23 0.01 1.40 0.08 -0.96 -0.23 117.98 123.02 1ivz s PHE 14 Ca -0.04 0.26 -0.30 0.00 0.12 0.00 0.00 56.93 56.97 1ivz s PHE 14 Cb -0.18 -2.64 -0.09 0.00 -0.57 0.00 0.00 43.02 39.54 1ivz s PHE 14 CO -0.08 -0.32 2.00 0.09 -0.10 0.00 0.00 175.22 176.82 1ivz n ASN 15 N 5.39 4.09 -4.71 1.36 3.02 -0.64 0.96 115.26 124.74 1ivz n ASN 15 Ca -0.08 0.83 -0.36 0.00 -0.03 0.00 0.00 54.58 54.94 1ivz n ASN 15 Cb 0.50 -1.53 -0.08 0.00 -0.61 0.00 0.00 39.78 38.06 1ivz n ASN 15 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 1ivz s LEU 16 N 4.87 4.19 -0.09 3.41 2.96 0.59 -2.15 118.68 132.45 1ivz s LEU 16 Ca 0.90 0.31 -0.07 0.00 -0.22 0.00 0.00 54.13 55.05 1ivz s LEU 16 Cb -0.42 -2.22 0.03 0.00 0.50 0.00 0.00 46.19 44.09 1ivz s LEU 16 CO 0.41 0.10 0.23 0.20 -1.32 0.00 0.00 176.35 175.98 1ivz s ASN 17 N 0.63 -0.24 -0.30 3.68 0.01 -0.62 0.40 114.94 118.50 1ivz s ASN 17 Ca 0.11 0.48 -0.14 0.00 -0.71 0.00 0.00 52.86 52.61 1ivz s ASN 17 Cb -0.13 0.43 0.17 0.00 0.41 0.00 0.00 41.25 42.14 1ivz s ASN 17 CO 0.02 -0.12 1.01 0.72 -1.51 0.00 0.00 177.10 177.22 1ivz s PHE 18 N 0.66 -0.64 0.09 2.20 -0.71 -1.10 -0.45 117.98 118.03 1ivz s PHE 18 Ca -0.04 0.91 -0.30 0.00 -1.04 0.00 0.00 56.93 56.45 1ivz s PHE 18 Cb -0.06 0.31 -0.05 0.00 -1.21 0.00 0.00 43.02 42.01 1ivz s PHE 18 CO -0.04 -0.33 1.05 0.99 -1.34 0.00 0.00 175.22 175.55 1ivz s THR 19 N 2.63 4.34 -0.16 -4.49 2.01 -1.26 -1.98 115.64 116.73 1ivz s THR 19 Ca -0.00 1.83 -0.13 0.00 0.31 0.00 0.00 61.69 63.70 1ivz s THR 19 Cb -0.08 -4.17 -0.05 0.00 0.01 0.00 0.00 72.50 68.22 1ivz s THR 19 CO -0.15 0.22 0.26 -0.63 -0.69 0.00 0.00 174.62 173.63 1ivz s ILE 20 N 0.43 5.32 -0.42 1.82 1.01 0.26 -3.12 121.20 126.50 1ivz s ILE 20 Ca 0.51 0.47 0.02 0.00 0.00 0.00 0.00 60.65 61.66 1ivz s ILE 20 Cb -0.25 -3.59 0.54 0.00 0.01 0.00 0.00 42.46 39.16 1ivz s ILE 20 CO 0.30 0.43 1.84 0.35 0.00 0.00 0.00 174.94 177.86 1ivz n THR 21 N 3.34 2.99 -2.34 2.92 -2.24 -1.21 -1.90 114.28 115.84 1ivz n THR 21 Ca -0.13 -1.83 0.00 0.00 -2.27 0.00 0.00 64.05 59.82 1ivz n THR 21 Cb 0.52 -0.68 -0.01 0.00 -2.10 0.00 0.00 70.33 68.06 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 -0.84 0.36 -3.49 3.42 5.15 -1.22 -4.92 115.26 113.72 1ivz n ASN 22 Ca 0.52 -2.00 -0.21 0.00 -0.60 0.00 0.00 54.58 52.29 1ivz n ASN 22 Cb 1.33 -0.11 -0.13 0.00 -0.53 0.00 0.00 39.78 40.35 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 -0.02 0.05 0.40 1.20 1.98 -1.21 -4.92 118.68 116.16 1ivz s LEU 23 Ca 0.23 -0.63 -0.26 0.00 -2.89 0.00 0.00 54.13 50.59 1ivz s LEU 23 Cb 0.26 0.19 -0.09 0.00 0.66 0.00 0.00 46.19 47.22 1ivz s LEU 23 CO -0.12 -0.37 1.25 -2.16 -1.89 0.00 0.00 176.35 173.07 1ivz s PRO 24 N 2.27 4.00 -0.25 0.98 0.04 -1.26 -3.53 135.00 137.25 1ivz s PRO 24 Ca 0.07 2.05 -0.09 0.00 0.04 0.00 0.00 61.00 63.07 1ivz s PRO 24 Cb -0.15 -2.73 -0.04 0.00 0.04 0.00 0.00 34.50 31.61 1ivz s PRO 24 CO -0.22 -0.43 0.12 -0.47 0.04 0.00 0.00 177.00 176.04 1ivz s TYR 25 N -1.31 3.19 0.41 0.56 6.14 -1.26 -4.96 117.35 120.13 1ivz s TYR 25 Ca 0.57 -0.07 0.03 0.00 0.64 0.00 0.00 57.07 58.24 1ivz s TYR 25 Cb -0.36 -2.26 -0.03 0.00 0.42 0.00 0.00 41.96 39.73 1ivz s TYR 25 CO 0.45 -0.15 0.11 -1.54 0.64 0.00 0.00 175.55 175.06 1ivz s SER 26 N 1.38 2.92 0.47 4.32 1.04 -1.26 -5.01 113.70 117.57 1ivz s SER 26 Ca 0.06 -1.64 0.13 0.00 0.48 0.00 0.00 55.95 54.98 1ivz s SER 26 Cb -0.15 0.44 1.08 0.00 0.10 0.00 0.00 66.02 67.50 1ivz s SER 26 CO 0.06 -0.89 2.07 0.06 0.98 0.00 0.00 173.24 175.52 1ivz h GLN 27 N 1.77 0.12 -0.12 4.02 3.07 -2.00 -2.61 115.11 119.36 1ivz h GLN 27 Ca -0.37 -0.01 0.00 0.00 0.09 0.00 0.00 58.65 58.36 1ivz h GLN 27 Cb 1.28 -0.02 -0.01 0.00 0.08 0.00 0.00 27.48 28.80 1ivz h GLN 27 CO 0.60 0.15 0.08 -0.44 0.09 0.00 0.00 178.83 179.31 1ivz h ASP 28 N 0.12 0.14 -0.04 0.06 5.19 -1.96 -2.07 116.42 117.87 1ivz h ASP 28 Ca 0.03 -0.02 0.01 0.00 -0.62 0.00 0.00 57.03 56.43 1ivz h ASP 28 Cb 0.10 -0.03 -0.00 0.00 0.18 0.00 0.00 39.33 39.58 1ivz h ASP 28 CO 0.00 0.11 0.03 0.40 -3.12 0.00 0.00 179.24 176.67 1ivz h ILE 29 N 0.15 0.82 0.00 0.35 1.08 -1.81 -0.06 117.51 118.04 1ivz h ILE 29 Ca 0.04 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.51 1ivz h ILE 29 Cb -0.00 0.98 0.00 0.00 -3.07 0.00 0.00 36.82 34.73 1ivz h ILE 29 CO -0.01 0.00 0.00 0.00 -0.69 0.00 0.00 178.15 177.45 1ivz h ALA 30 N 1.97 1.00 -3.44 1.87 0.00 -1.28 -3.40 119.26 115.99 1ivz h ALA 30 Ca 0.02 0.00 -0.59 0.00 0.00 0.00 0.00 54.91 54.34 1ivz h ALA 30 Cb 0.08 0.00 -0.38 0.00 0.00 0.00 0.00 17.79 17.49 1ivz h ALA 30 CO -0.00 0.00 -0.80 -0.65 0.00 0.00 0.00 179.25 177.80 1ivz s GLN 31 N -3.70 1.67 0.62 0.00 -1.52 -0.04 -5.00 119.66 111.69 1ivz s GLN 31 Ca 0.00 -0.75 0.29 0.00 -1.95 0.00 0.00 55.36 52.95 1ivz s GLN 31 Cb 0.10 -2.31 1.55 0.00 -0.22 0.00 0.00 33.01 32.12 1ivz s GLN 31 CO 0.48 -0.48 1.92 -1.35 -0.25 0.00 0.00 175.29 175.61 1ivz h PRO 32 N 8.03 0.00 -0.44 2.91 0.11 -1.78 -0.73 132.00 140.10 1ivz h PRO 32 Ca -0.24 0.00 0.13 0.00 0.11 0.00 0.00 66.00 66.00 1ivz h PRO 32 Cb 1.10 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.19 1ivz h PRO 32 CO 0.43 0.00 0.32 1.03 -0.21 0.00 0.00 178.00 179.57 1ivz h SER 33 N 0.00 0.00 -4.30 -2.05 0.87 -1.94 -3.40 113.55 102.73 1ivz h SER 33 Ca 0.12 0.00 -0.50 0.00 -1.23 0.00 0.00 61.79 60.18 1ivz h SER 33 Cb 0.91 0.00 0.11 0.00 -0.44 0.00 0.00 62.40 62.98 1ivz h SER 33 CO -0.00 0.00 0.34 0.42 -0.53 0.00 0.00 176.83 177.06 1ivz s THR 34 N -4.99 3.40 0.06 2.23 -4.23 -0.28 -4.98 115.64 106.84 1ivz s THR 34 Ca -0.05 0.45 0.09 0.00 -1.18 0.00 0.00 61.69 61.00 1ivz s THR 34 Cb 0.19 -3.18 -0.21 0.00 1.34 0.00 0.00 72.50 70.64 1ivz s THR 34 CO 0.71 -0.59 1.11 0.74 -0.54 0.00 0.00 174.62 176.05 1ivz h THR 35 N -0.98 1.43 -0.13 3.99 2.02 -1.88 -3.25 112.91 114.13 1ivz h THR 35 Ca -0.46 -3.17 0.04 0.00 0.77 0.00 0.00 66.41 63.59 1ivz h THR 35 Cb 1.25 2.71 -0.01 0.00 -1.74 0.00 0.00 68.15 70.36 1ivz h THR 35 CO 0.58 0.82 0.09 0.50 0.37 0.00 0.00 175.52 177.88 1ivz h LYS 36 N 0.00 0.00 0.00 6.66 3.64 -1.93 0.19 116.57 125.13 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 1.82 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 33.64 1ivz h LYS 36 CO 0.11 0.00 -0.07 -0.92 -2.27 0.00 0.00 179.45 176.31 1ivz h TYR 37 N 0.00 0.00 -0.14 1.91 3.20 -1.81 -3.05 116.97 117.09 1ivz h TYR 37 Ca 0.06 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.93 1ivz h TYR 37 Cb 0.24 0.00 -0.01 0.00 1.54 0.00 0.00 36.73 38.51 1ivz h TYR 37 CO 0.00 0.68 0.09 1.96 -1.64 0.00 0.00 178.16 179.25 1ivz h GLN 38 N -1.00 0.17 0.33 1.82 4.20 -1.54 0.27 115.11 119.36 1ivz h GLN 38 Ca -0.02 -0.01 -0.02 0.00 0.06 0.00 0.00 58.65 58.67 1ivz h GLN 38 Cb 0.68 -0.04 0.00 0.00 0.30 0.00 0.00 27.48 28.42 1ivz h GLN 38 CO -0.01 0.11 -0.16 1.96 -0.67 0.00 0.00 178.83 180.07 1ivz h GLN 39 N 0.18 -0.42 -0.11 1.46 1.08 -0.73 -1.89 115.11 114.67 1ivz h GLN 39 Ca 0.05 0.03 -0.01 0.00 -1.45 0.00 0.00 58.65 57.27 1ivz h GLN 39 Cb -0.01 0.10 -0.01 0.00 -0.05 0.00 0.00 27.48 27.51 1ivz h GLN 39 CO -0.01 -0.28 0.01 1.15 -0.95 0.00 0.00 178.83 178.75 1ivz h THR 40 N -0.62 1.07 -0.06 -0.54 2.02 -1.45 -0.87 112.91 112.45 1ivz h THR 40 Ca -0.04 -0.26 -0.08 0.00 0.77 0.00 0.00 66.41 66.80 1ivz h THR 40 Cb 0.33 0.97 -0.01 0.00 -1.74 0.00 0.00 68.15 67.71 1ivz h THR 40 CO 0.07 0.09 -0.32 0.50 0.37 0.00 0.00 175.52 176.24 1ivz h LYS 41 N 0.16 0.12 0.21 6.66 3.64 -0.49 -2.19 116.57 124.68 1ivz h LYS 41 Ca 0.04 -0.04 -0.34 0.00 -1.27 0.00 0.00 60.65 59.04 1ivz h LYS 41 Cb 0.09 -0.01 0.02 0.00 -0.41 0.00 0.00 32.23 31.92 1ivz h LYS 41 CO -0.00 0.43 -1.62 -0.09 -2.27 0.00 0.00 179.45 175.90 1ivz h ARG 42 N 0.11 0.44 -0.69 1.90 2.43 -0.41 -2.93 114.38 115.22 1ivz h ARG 42 Ca 0.01 -0.75 0.02 0.00 -0.81 0.00 0.00 59.98 58.45 1ivz h ARG 42 Cb 0.62 0.28 -0.04 0.00 -0.42 0.00 0.00 29.97 30.41 1ivz h ARG 42 CO 0.04 1.36 0.45 1.03 -1.51 0.00 0.00 179.97 181.34 1ivz h SER 43 N 0.08 0.76 -0.16 -3.80 0.87 -1.12 0.93 113.55 111.12 1ivz h SER 43 Ca -0.31 -0.01 -0.07 0.00 -1.23 0.00 0.00 61.79 60.17 1ivz h SER 43 Cb 2.09 -0.18 -0.00 0.00 -0.44 0.00 0.00 62.40 63.87 1ivz h SER 43 CO 0.21 0.54 -0.16 0.40 -0.53 0.00 0.00 176.83 177.29 1ivz h ILE 44 N 0.91 1.34 -1.00 2.23 2.04 -1.53 -0.77 117.51 120.73 1ivz h ILE 44 Ca 0.26 -1.33 0.01 0.00 1.00 0.00 0.00 64.86 64.80 1ivz h ILE 44 Cb -0.06 1.87 -0.05 0.00 -0.74 0.00 0.00 36.82 37.84 1ivz h ILE 44 CO -0.08 0.39 0.65 -0.08 0.00 0.00 0.00 178.15 179.04 1ivz h GLU 45 N 0.02 1.32 -0.18 2.37 4.22 -1.31 0.10 114.58 121.13 1ivz h GLU 45 Ca 0.02 -0.08 -0.19 0.00 0.08 0.00 0.00 59.36 59.19 1ivz h GLU 45 Cb 0.70 -0.29 0.00 0.00 0.50 0.00 0.00 28.75 29.66 1ivz h GLU 45 CO 0.04 0.88 -0.65 -0.97 -2.18 0.00 0.00 179.01 176.12 1ivz h ASN 46 N 1.35 0.76 -0.02 1.04 -1.24 -0.80 -2.49 115.58 114.18 1ivz h ASN 46 Ca 0.36 -0.45 -0.12 0.00 0.71 0.00 0.00 56.30 56.81 1ivz h ASN 46 Cb -0.15 -0.22 -0.01 0.00 0.73 0.00 0.00 38.32 38.67 1ivz h ASN 46 CO -0.08 1.21 -0.35 0.00 -1.29 0.00 0.00 177.43 176.92 1ivz h ALA 47 N 0.79 0.95 -0.02 1.57 0.00 -0.65 -2.90 119.26 119.01 1ivz h ALA 47 Ca -0.02 -0.41 -0.14 0.00 0.00 0.00 0.00 54.91 54.35 1ivz h ALA 47 Cb 1.24 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.90 1ivz h ALA 47 CO 0.13 0.61 -0.62 -0.07 0.00 0.00 0.00 179.25 179.30 1ivz h LEU 48 N 0.43 0.07 0.90 0.00 3.38 -0.78 -2.83 115.31 116.49 1ivz h LEU 48 Ca 0.05 -0.04 -0.04 0.00 0.09 0.00 0.00 57.88 57.93 1ivz h LEU 48 Cb 0.82 -0.02 0.01 0.00 0.09 0.00 0.00 40.66 41.56 1ivz h LEU 48 CO 0.07 0.68 -0.43 -1.13 0.09 0.00 0.00 178.44 177.71 1ivz h ASN 49 N 0.04 -1.03 -0.11 -0.43 -0.73 -1.24 -2.71 115.58 109.37 1ivz h ASN 49 Ca -0.01 0.03 0.03 0.00 1.87 0.00 0.00 56.30 58.22 1ivz h ASN 49 Cb 1.11 0.27 -0.00 0.00 0.27 0.00 0.00 38.32 39.96 1ivz h ASN 49 CO 0.09 -0.69 0.08 0.06 -0.37 0.00 0.00 177.43 176.59 1ivz h GLN 50 N -1.30 0.03 -0.61 6.67 3.07 -1.61 -1.38 115.11 119.98 1ivz h GLN 50 Ca -0.12 -0.00 -0.01 0.00 0.09 0.00 0.00 58.65 58.61 1ivz h GLN 50 Cb 0.93 -0.01 -0.03 0.00 0.08 0.00 0.00 27.48 28.45 1ivz h GLN 50 CO 0.20 0.02 0.34 1.25 0.09 0.00 0.00 178.83 180.74 1ivz h LEU 51 N 0.03 0.74 0.05 0.06 6.46 -1.28 -0.31 115.31 121.06 1ivz h LEU 51 Ca 0.05 -0.05 -0.24 0.00 -0.12 0.00 0.00 57.88 57.52 1ivz h LEU 51 Cb 0.16 -0.19 0.02 0.00 -0.73 0.00 0.00 40.66 39.93 1ivz h LEU 51 CO -0.00 0.59 -0.98 -0.26 -0.62 0.00 0.00 178.44 177.17 1ivz h PHE 52 N 0.84 0.89 0.00 1.25 0.04 -0.95 -1.81 116.94 117.19 1ivz h PHE 52 Ca 0.22 -0.52 -0.04 0.00 2.80 0.00 0.00 57.97 60.43 1ivz h PHE 52 Cb 0.01 -0.09 -0.01 0.00 2.20 0.00 0.00 35.95 38.06 1ivz h PHE 52 CO 0.00 1.36 -0.20 0.00 -0.60 0.00 0.00 178.31 178.88 1ivz h ARG 53 N 0.17 0.00 0.00 1.51 2.47 -1.16 -2.75 114.38 114.62 1ivz h ARG 53 Ca -0.14 0.00 -0.27 0.00 -1.26 0.00 0.00 59.98 58.32 1ivz h ARG 53 Cb 1.67 0.00 -0.05 0.00 -1.65 0.00 0.00 29.97 29.94 1ivz h ARG 53 CO 0.19 0.20 -1.57 -0.91 0.56 0.00 0.00 179.97 178.44 1ivz h ASN 54 N 0.00 0.00 -4.20 7.04 2.35 -1.08 -3.43 115.58 116.26 1ivz h ASN 54 Ca -0.00 0.00 -0.51 0.00 -0.55 0.00 0.00 56.30 55.24 1ivz h ASN 54 Cb 0.45 0.00 0.16 0.00 0.05 0.00 0.00 38.32 38.98 1ivz h ASN 54 CO 0.03 0.95 0.26 -0.94 -1.65 0.00 0.00 177.43 176.08 1ivz s SER 55 N -6.15 3.63 0.57 5.81 1.04 -0.68 -4.90 113.70 113.02 1ivz s SER 55 Ca -0.04 1.86 0.27 0.00 0.48 0.00 0.00 55.95 58.52 1ivz s SER 55 Cb 0.08 -2.46 1.69 0.00 0.10 0.00 0.00 66.02 65.44 1ivz s SER 55 CO 0.82 -2.60 2.23 -1.28 0.98 0.00 0.00 173.24 173.39 1ivz h SER 56 N -1.52 0.00 -1.04 7.02 0.87 -1.91 -2.45 113.55 114.53 1ivz h SER 56 Ca -0.45 0.00 -0.52 0.00 -1.23 0.00 0.00 61.79 59.59 1ivz h SER 56 Cb 1.26 0.00 -0.20 0.00 -0.44 0.00 0.00 62.40 63.02 1ivz h SER 56 CO 0.49 0.00 0.58 2.30 -0.53 0.00 0.00 176.83 179.67 1ivz n ILE 57 N -4.01 3.26 -1.54 2.23 -5.35 -1.26 -4.70 119.36 107.99 1ivz n ILE 57 Ca -0.03 -2.82 -0.28 0.00 -0.27 0.00 0.00 62.75 59.35 1ivz n ILE 57 Cb 0.09 -1.40 -0.05 0.00 -1.74 0.00 0.00 39.64 36.54 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 0.24 2.48 0.00 6.28 2.85 -0.92 -3.52 118.16 125.56 1ivz n LYS 58 Ca 0.47 -2.48 0.00 0.00 -1.05 0.00 0.00 58.31 55.25 1ivz n LYS 58 Cb 0.52 -2.16 0.00 0.00 -0.65 0.00 0.00 35.03 32.74 1ivz n LYS 58 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 177.40 177.78 1ivz n SER 59 N 0.76 0.00 0.00 -5.58 7.64 -1.26 -4.92 113.62 110.26 1ivz n SER 59 Ca 0.50 0.00 -0.17 0.00 1.01 0.00 0.00 58.87 60.20 1ivz n SER 59 Cb 0.52 0.03 -0.14 0.00 -1.01 0.00 0.00 64.21 63.61 1ivz n SER 59 CO 0.00 0.00 0.00 -1.22 -3.01 0.00 0.00 175.04 170.81 1ivz n TYR 60 N -2.24 1.21 -1.63 1.43 4.01 -1.26 -4.86 117.16 113.83 1ivz n TYR 60 Ca 0.00 0.31 -0.43 0.00 -0.16 0.00 0.00 57.90 57.62 1ivz n TYR 60 Cb 0.00 -1.18 -0.03 0.00 -0.31 0.00 0.00 39.34 37.82 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 -3.34 2.24 -0.05 -0.72 -0.00 -1.23 -1.76 117.46 112.59 1ivz n PHE 61 Ca -0.27 -0.24 -0.01 0.00 -0.00 0.00 0.00 57.45 56.93 1ivz n PHE 61 Cb 1.05 -2.76 -0.00 0.00 -0.00 0.00 0.00 39.48 37.77 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 12.61 0.00 -1.58 -2.13 0.87 -1.82 -3.48 113.55 118.03 1ivz h SER 62 Ca -0.45 0.00 0.21 0.00 -1.23 0.00 0.00 61.79 60.32 1ivz h SER 62 Cb 1.24 0.00 -0.04 0.00 -0.44 0.00 0.00 62.40 63.16 1ivz h SER 62 CO 0.95 0.50 0.58 -0.90 -0.53 0.00 0.00 176.83 177.43 1ivz n ASP 63 N -4.47 -0.88 -4.58 6.23 5.75 -1.24 -5.07 116.55 112.29 1ivz n ASP 63 Ca -0.01 -1.25 -0.30 0.00 -0.01 0.00 0.00 54.79 53.22 1ivz n ASP 63 Cb 0.05 1.38 -0.10 0.00 -1.03 0.00 0.00 41.12 41.42 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 -2.24 1.74 -0.39 0.00 0.74 -0.29 -4.90 119.66 114.31 1ivz s GLN 65 Ca 0.22 -2.30 -0.28 0.00 0.05 0.00 0.00 55.36 53.05 1ivz s GLN 65 Cb -0.11 -3.19 -0.02 0.00 1.10 0.00 0.00 33.01 30.79 1ivz s GLN 65 CO 0.14 -1.05 1.80 0.54 -0.55 0.00 0.00 175.29 176.16 1ivz s VAL 66 N 0.20 3.47 -0.00 1.34 0.11 -1.26 -1.36 120.40 122.90 1ivz s VAL 66 Ca 0.15 0.45 -0.15 0.00 -2.93 0.00 0.00 61.98 59.49 1ivz s VAL 66 Cb -0.23 -3.73 -0.08 0.00 -1.53 0.00 0.00 36.38 30.81 1ivz s VAL 66 CO -0.03 -0.52 0.82 -0.07 -3.33 0.00 0.00 175.10 171.96 1ivz h LEU 67 N 14.22 -0.47 0.00 2.54 3.38 -0.98 -3.48 115.31 130.52 1ivz h LEU 67 Ca -0.32 0.02 0.02 0.00 0.09 0.00 0.00 57.88 57.69 1ivz h LEU 67 Cb 1.16 0.12 -0.00 0.00 0.09 0.00 0.00 40.66 42.03 1ivz h LEU 67 CO 1.07 -0.20 0.07 0.00 0.09 0.00 0.00 178.44 179.48 1ivz n ALA 68 N -2.49 -0.32 -3.65 1.53 0.00 -1.14 -5.06 120.51 109.38 1ivz n ALA 68 Ca -0.07 -0.11 -0.35 0.00 0.00 0.00 0.00 53.44 52.92 1ivz n ALA 68 Cb 0.22 0.06 -0.14 0.00 0.00 0.00 0.00 19.45 19.58 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 -5.14 2.94 0.10 0.00 0.08 -1.26 -2.28 117.98 112.41 1ivz s PHE 69 Ca 0.03 -1.17 -0.30 0.00 0.12 0.00 0.00 56.93 55.61 1ivz s PHE 69 Cb -0.00 -2.07 -0.06 0.00 -0.57 0.00 0.00 43.02 40.33 1ivz s PHE 69 CO 0.00 -0.63 1.02 1.03 -0.10 0.00 0.00 175.22 176.55 1ivz s ARG 70 N 1.42 4.62 0.73 0.44 1.81 0.77 -4.84 118.95 123.90 1ivz s ARG 70 Ca 0.05 1.54 -0.11 0.00 -1.72 0.00 0.00 55.73 55.49 1ivz s ARG 70 Cb -0.14 -3.37 0.03 0.00 -0.45 0.00 0.00 34.95 31.02 1ivz s ARG 70 CO -0.05 0.08 1.08 0.45 -0.68 0.00 0.00 175.30 176.17 1ivz s SER 71 N 0.29 5.09 0.04 0.23 0.15 -1.26 -1.07 113.70 117.17 1ivz s SER 71 Ca 0.50 1.43 -0.09 0.00 0.70 0.00 0.00 55.95 58.48 1ivz s SER 71 Cb -0.25 -2.25 0.00 0.00 -1.71 0.00 0.00 66.02 61.81 1ivz s SER 71 CO 0.31 -1.60 0.19 0.68 1.20 0.00 0.00 173.24 174.01 1ivz s VAL 72 N -3.13 0.11 -0.21 4.45 -7.23 -1.26 -4.79 120.40 108.34 1ivz s VAL 72 Ca 0.59 -0.90 -0.07 0.00 -1.81 0.00 0.00 61.98 59.78 1ivz s VAL 72 Cb -0.14 -0.90 -0.10 0.00 0.56 0.00 0.00 36.38 35.81 1ivz s VAL 72 CO 0.54 -0.50 -0.24 -1.20 -0.31 0.00 0.00 175.10 173.39 1ivz n SER 73 N 0.71 1.75 -4.71 4.85 7.64 -1.26 -4.65 113.62 117.95 1ivz n SER 73 Ca -0.19 0.16 -0.43 0.00 1.01 0.00 0.00 58.87 59.42 1ivz n SER 73 Cb 0.59 -0.53 -0.03 0.00 -1.01 0.00 0.00 64.21 63.23 1ivz n SER 73 CO 0.00 0.00 0.00 -3.20 -3.01 0.00 0.00 175.04 168.83 1ivz n ASN 74 N -3.70 3.86 0.00 6.43 4.05 -1.26 -2.72 115.26 121.92 1ivz n ASN 74 Ca -0.39 1.07 0.00 0.00 0.45 0.00 0.00 54.58 55.71 1ivz n ASN 74 Cb 0.81 -1.56 0.00 0.00 1.23 0.00 0.00 39.78 40.27 1ivz n ASN 74 CO 0.00 0.00 0.00 -3.20 -3.05 0.00 0.00 177.26 171.01 1ivz n ASN 75 N 3.77 0.00 -0.84 1.20 2.85 -1.26 -4.40 115.26 116.59 1ivz n ASN 75 Ca 0.16 0.00 -0.06 0.00 -0.11 0.00 0.00 54.58 54.56 1ivz n ASN 75 Cb 0.34 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.36 1ivz n ASN 75 CO 0.00 0.00 0.00 0.59 -2.11 0.00 0.00 177.26 175.74 1ivz n ASN 76 N 2.98 -2.60 -0.91 1.20 5.03 -1.10 -4.90 115.26 114.95 1ivz n ASN 76 Ca 0.00 -0.04 -0.02 0.00 0.87 0.00 0.00 54.58 55.39 1ivz n ASN 76 Cb 0.00 -1.79 -0.03 0.00 -1.02 0.00 0.00 39.78 36.95 1ivz n ASN 76 CO 0.00 0.00 0.00 -3.20 -1.83 0.00 0.00 177.26 172.23 1ivz n ASN 77 N 0.71 -0.22 -4.80 6.41 2.85 -1.26 -4.67 115.26 114.28 1ivz n ASN 77 Ca -0.06 -1.75 -0.32 0.00 -0.11 0.00 0.00 54.58 52.35 1ivz n ASN 77 Cb 0.55 0.04 -0.05 0.00 1.24 0.00 0.00 39.78 41.56 1ivz n ASN 77 CO 0.00 0.00 0.00 1.41 -2.11 0.00 0.00 177.26 176.56 1ivz n HIS 78 N 0.10 0.69 -3.56 1.20 8.25 -1.23 -3.36 115.22 117.32 1ivz n HIS 78 Ca -0.11 -2.53 -0.01 0.00 -0.26 0.00 0.00 57.72 54.82 1ivz n HIS 78 Cb 0.74 -0.38 -0.04 0.00 1.12 0.00 0.00 29.99 31.43 1ivz n HIS 78 CO 0.00 0.00 0.00 0.99 0.64 0.00 0.00 176.34 177.97 1ivz s THR 79 N -2.86 -0.73 -0.50 1.59 2.01 -0.80 -4.04 115.64 110.31 1ivz s THR 79 Ca 0.09 0.00 -0.29 0.00 0.31 0.00 0.00 61.69 61.81 1ivz s THR 79 Cb -0.01 -1.00 0.02 0.00 0.01 0.00 0.00 72.50 71.53 1ivz s THR 79 CO 0.06 0.00 1.24 -0.83 -0.69 0.00 0.00 174.62 174.40 1ivz s GLY 80 N 2.61 1.16 -0.91 4.40 0.00 -0.23 -0.57 107.32 113.78 1ivz s GLY 80 Ca -0.05 -0.52 -0.24 0.00 0.00 0.00 0.00 44.72 43.90 1ivz s GLY 80 CO -0.18 2.56 1.50 0.14 0.00 0.00 0.00 173.10 177.12 1ivz s VAL 81 N 4.99 3.77 -1.04 1.40 1.01 -0.84 -0.16 120.40 129.53 1ivz s VAL 81 Ca 0.50 -0.36 -0.18 0.00 0.00 0.00 0.00 61.98 61.95 1ivz s VAL 81 Cb -0.09 -4.81 0.13 0.00 0.00 0.00 0.00 36.38 31.60 1ivz s VAL 81 CO 0.30 -1.72 1.29 -0.62 0.00 0.00 0.00 175.10 174.34 1ivz s ASP 82 N 5.28 6.74 0.43 3.32 -1.08 -0.97 -2.69 116.67 127.70 1ivz s ASP 82 Ca 0.48 -2.24 0.04 0.00 -0.52 0.00 0.00 52.55 50.31 1ivz s ASP 82 Cb -0.04 -2.43 0.04 0.00 -1.46 0.00 0.00 42.92 39.03 1ivz s ASP 82 CO -0.01 -1.05 0.35 -1.54 0.52 0.00 0.00 175.17 173.45 1ivz n SER 83 N 6.73 2.31 -3.75 -0.34 3.41 0.16 -0.32 113.62 121.82 1ivz n SER 83 Ca 0.30 -2.45 -0.23 0.00 -0.26 0.00 0.00 58.87 56.23 1ivz n SER 83 Cb 0.48 -0.06 -0.17 0.00 -0.26 0.00 0.00 64.21 64.19 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 0.57 -1.25 1.04 1.98 -0.46 -0.30 118.68 120.26 1ivz s LEU 84 Ca 0.26 -0.14 -0.19 0.00 -2.89 0.00 0.00 54.13 51.17 1ivz s LEU 84 Cb -0.02 -0.41 0.05 0.00 0.66 0.00 0.00 46.19 46.47 1ivz s LEU 84 CO 0.17 -0.22 1.74 0.00 -1.89 0.00 0.00 176.35 176.15 1ivz s ASN 86 N 4.65 6.71 0.30 0.00 0.01 -0.83 -2.27 114.94 123.50 1ivz s ASN 86 Ca 0.55 2.43 0.03 0.00 -0.71 0.00 0.00 52.86 55.16 1ivz s ASN 86 Cb 0.03 -2.63 -0.01 0.00 0.41 0.00 0.00 41.25 39.05 1ivz s ASN 86 CO 0.07 -0.55 0.12 0.49 -1.51 0.00 0.00 177.10 175.71 1ivz n PHE 87 N 0.45 0.04 -4.15 2.20 3.01 -1.02 -3.29 117.46 114.71 1ivz n PHE 87 Ca 0.02 -1.94 -0.29 0.00 1.01 0.00 0.00 57.45 56.25 1ivz n PHE 87 Cb 0.45 0.01 -0.08 0.00 -0.01 0.00 0.00 39.48 39.86 1ivz n PHE 87 CO 0.00 0.00 0.00 -1.12 1.01 0.00 0.00 176.76 176.65 1ivz s SER 88 N -2.84 4.99 0.61 4.37 0.01 -0.72 -4.52 113.70 115.60 1ivz s SER 88 Ca 0.16 -0.24 0.39 0.00 1.31 0.00 0.00 55.95 57.57 1ivz s SER 88 Cb 0.01 -1.16 1.96 0.00 0.21 0.00 0.00 66.02 67.03 1ivz s SER 88 CO 0.12 0.14 2.21 -0.65 0.41 0.00 0.00 173.24 175.47 1ivz h PRO 89 N 3.13 0.00 0.00 12.44 0.11 -1.90 -2.34 132.00 143.44 1ivz h PRO 89 Ca -0.48 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 65.60 1ivz h PRO 89 Cb 1.18 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.28 1ivz h PRO 89 CO 0.59 0.02 -0.15 -0.07 -0.21 0.00 0.00 178.00 178.18 1ivz h LEU 90 N 0.00 0.00 0.00 2.35 4.07 -1.93 -3.31 115.31 116.48 1ivz h LEU 90 Ca -0.00 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.96 1ivz h LEU 90 Cb 0.21 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.95 1ivz h LEU 90 CO 0.00 0.15 0.00 0.00 -1.08 0.00 0.00 178.44 177.52 1ivz n ALA 91 N -2.38 -0.01 -1.88 1.53 0.00 -0.88 -4.87 120.51 112.03 1ivz n ALA 91 Ca -0.02 0.00 -0.19 0.00 0.00 0.00 0.00 53.44 53.23 1ivz n ALA 91 Cb 0.24 0.01 -0.05 0.00 0.00 0.00 0.00 19.45 19.65 1ivz n ALA 91 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1ivz n ARG 92 N -0.55 -1.37 -1.02 0.00 1.74 -1.25 -4.76 116.66 109.45 1ivz n ARG 92 Ca 0.00 1.05 -0.07 0.00 -0.77 0.00 0.00 57.85 58.07 1ivz n ARG 92 Cb 0.00 -5.44 -0.06 0.00 -1.02 0.00 0.00 32.46 25.94 1ivz n ARG 92 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 1ivz n ARG 93 N -2.60 0.04 -3.94 5.56 5.12 -1.26 -5.14 116.66 114.45 1ivz n ARG 93 Ca -0.20 -0.96 -0.31 0.00 -1.93 0.00 0.00 57.85 54.45 1ivz n ARG 93 Cb 0.63 0.50 -0.04 0.00 -1.16 0.00 0.00 32.46 32.39 1ivz n ARG 93 CO 0.00 0.00 0.00 0.08 -1.93 0.00 0.00 177.63 175.78 1ivz s VAL 94 N 0.00 5.26 0.12 1.55 1.01 -1.26 -5.12 120.40 121.96 1ivz s VAL 94 Ca 0.00 -0.44 0.03 0.00 0.00 0.00 0.00 61.98 61.57 1ivz s VAL 94 Cb 0.01 -3.56 -0.04 0.00 0.00 0.00 0.00 36.38 32.79 1ivz s VAL 94 CO -0.00 0.14 -0.08 -1.81 0.00 0.00 0.00 175.10 173.35 1ivz s ASP 95 N -2.48 1.43 0.36 3.32 1.01 -1.26 -5.04 116.67 114.01 1ivz s ASP 95 Ca 0.34 -0.98 0.05 0.00 0.71 0.00 0.00 52.55 52.67 1ivz s ASP 95 Cb -0.13 0.04 0.69 0.00 1.01 0.00 0.00 42.92 44.53 1ivz s ASP 95 CO 0.27 -0.39 1.95 0.08 0.21 0.00 0.00 175.17 177.29 1ivz h ARG 96 N 2.98 0.56 -0.01 8.23 0.11 -1.87 -1.90 114.38 122.49 1ivz h ARG 96 Ca -0.36 -0.08 -0.07 0.00 0.10 0.00 0.00 59.98 59.57 1ivz h ARG 96 Cb 1.18 -0.10 -0.01 0.00 1.11 0.00 0.00 29.97 32.15 1ivz h ARG 96 CO 0.63 0.49 -0.31 0.28 0.10 0.00 0.00 179.97 181.16 1ivz h VAL 97 N 0.56 1.22 0.39 0.08 2.07 -1.96 -2.12 116.25 116.48 1ivz h VAL 97 Ca 0.14 -1.07 -0.02 0.00 0.82 0.00 0.00 66.70 66.57 1ivz h VAL 97 Cb 0.15 1.57 0.00 0.00 -1.52 0.00 0.00 31.29 31.49 1ivz h VAL 97 CO -0.01 0.31 -0.19 0.00 0.02 0.00 0.00 177.57 177.70 1ivz h ALA 98 N 1.68 -0.52 0.00 1.67 0.00 -1.75 0.79 119.26 121.12 1ivz h ALA 98 Ca -0.00 -0.17 -0.03 0.00 0.00 0.00 0.00 54.91 54.71 1ivz h ALA 98 Cb 0.55 0.20 -0.00 0.00 0.00 0.00 0.00 17.79 18.54 1ivz h ALA 98 CO 0.04 -0.70 -0.17 0.82 0.00 0.00 0.00 179.25 179.25 1ivz h ILE 99 N -0.72 0.68 -0.01 0.00 2.04 -1.50 -1.90 117.51 116.11 1ivz h ILE 99 Ca -0.05 -0.70 -0.15 0.00 1.00 0.00 0.00 64.86 64.95 1ivz h ILE 99 Cb 0.50 1.44 0.01 0.00 -0.74 0.00 0.00 36.82 38.03 1ivz h ILE 99 CO 0.09 0.16 -0.59 0.22 0.00 0.00 0.00 178.15 178.03 1ivz h TYR 100 N 0.00 0.61 0.33 1.37 3.20 -1.18 -2.62 116.97 118.68 1ivz h TYR 100 Ca -0.00 -0.33 -0.02 0.00 3.14 0.00 0.00 58.73 61.53 1ivz h TYR 100 Cb 0.43 -0.07 0.00 0.00 1.54 0.00 0.00 36.73 38.63 1ivz h TYR 100 CO 0.00 1.14 -0.16 0.93 -1.64 0.00 0.00 178.16 178.43 1ivz h GLU 101 N -0.09 -0.43 -0.67 1.82 5.08 -0.63 -2.32 114.58 117.34 1ivz h GLU 101 Ca -0.07 0.03 0.08 0.00 -1.00 0.00 0.00 59.36 58.40 1ivz h GLU 101 Cb 1.30 0.10 -0.04 0.00 0.50 0.00 0.00 28.75 30.60 1ivz h GLU 101 CO 0.12 -0.12 0.44 0.93 -1.00 0.00 0.00 179.01 179.38 1ivz h GLU 102 N -0.76 0.59 -0.29 2.33 5.08 -1.49 -1.69 114.58 118.34 1ivz h GLU 102 Ca -0.05 -0.04 -0.03 0.00 -1.00 0.00 0.00 59.36 58.24 1ivz h GLU 102 Cb 0.51 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.61 1ivz h GLU 102 CO 0.07 0.39 0.05 0.35 -1.00 0.00 0.00 179.01 178.87 1ivz h PHE 103 N 0.61 0.52 -0.58 4.33 3.57 -1.40 -2.40 116.94 121.60 1ivz h PHE 103 Ca 0.30 -0.07 -0.05 0.00 3.53 0.00 0.00 57.97 61.68 1ivz h PHE 103 Cb 0.38 -0.14 -0.03 0.00 2.79 0.00 0.00 35.95 38.95 1ivz h PHE 103 CO -0.00 0.58 0.17 -0.07 -2.23 0.00 0.00 178.31 176.76 1ivz h LEU 104 N 0.30 0.80 -1.14 0.59 3.38 -0.79 0.16 115.31 118.62 1ivz h LEU 104 Ca 0.09 -0.13 -0.07 0.00 0.09 0.00 0.00 57.88 57.85 1ivz h LEU 104 Cb 0.34 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.87 1ivz h LEU 104 CO 0.01 0.76 -0.20 -0.09 0.09 0.00 0.00 178.44 179.01 1ivz h ARG 105 N 0.84 0.36 0.00 1.13 2.43 -1.18 0.17 114.38 118.13 1ivz h ARG 105 Ca 0.19 -0.11 -0.12 0.00 -0.81 0.00 0.00 59.98 59.13 1ivz h ARG 105 Cb 0.25 -0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 29.75 1ivz h ARG 105 CO -0.01 0.55 -1.10 1.98 -1.51 0.00 0.00 179.97 179.88 1ivz h MET 106 N 0.33 0.00 -0.84 0.20 4.05 -0.97 -3.32 114.93 114.38 1ivz h MET 106 Ca 0.06 0.00 -0.21 0.00 -0.28 0.00 0.00 59.70 59.27 1ivz h MET 106 Cb 0.54 0.00 -0.12 0.00 -0.80 0.00 0.00 31.60 31.22 1ivz h MET 106 CO 0.04 0.27 0.26 0.25 0.23 0.00 0.00 176.91 177.96 1ivz n THR 107 N -2.93 2.47 -3.15 -0.77 -2.24 0.51 -4.43 114.28 103.75 1ivz n THR 107 Ca -0.05 -1.31 -0.20 0.00 -2.27 0.00 0.00 64.05 60.22 1ivz n THR 107 Cb 0.75 -0.46 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 -0.16 -3.11 -2.35 4.78 -0.00 -1.05 -0.67 115.22 112.66 1ivz n HIS 108 Ca 0.35 1.27 -0.17 0.00 -0.00 0.00 0.00 57.72 59.17 1ivz n HIS 108 Cb 1.22 -3.21 -0.01 0.00 -0.00 0.00 0.00 29.99 27.99 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 -0.47 -4.87 -3.14 0.41 3.02 -0.01 -2.75 115.26 107.45 1ivz n ASN 109 Ca 0.02 0.11 -0.06 0.00 -0.03 0.00 0.00 54.58 54.62 1ivz n ASN 109 Cb 0.56 -4.11 0.03 0.00 -0.61 0.00 0.00 39.78 35.64 1ivz n ASN 109 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1ivz n GLY 110 N -0.86 -1.21 0.92 7.41 0.00 -0.85 -4.91 105.19 105.69 1ivz n GLY 110 Ca -0.19 0.52 0.00 0.00 0.00 0.00 0.00 46.02 46.34 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 -2.35 0.00 -3.96 2.61 -2.24 0.15 -3.36 114.28 105.13 1ivz n THR 111 Ca -0.03 0.00 -0.31 0.00 -2.27 0.00 0.00 64.05 61.44 1ivz n THR 111 Cb 0.55 -0.16 -0.15 0.00 -2.10 0.00 0.00 70.33 68.47 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 -1.46 1.33 -0.87 -0.78 0.74 -0.37 0.93 119.66 119.18 1ivz s GLN 112 Ca 0.00 -1.73 -0.25 0.00 0.05 0.00 0.00 55.36 53.43 1ivz s GLN 112 Cb 0.00 -2.95 -0.04 0.00 1.10 0.00 0.00 33.01 31.12 1ivz s GLN 112 CO 0.00 -0.95 1.91 -1.17 -0.55 0.00 0.00 175.29 174.53 1ivz s LEU 113 N 1.02 3.19 0.00 3.68 1.98 0.16 -4.24 118.68 124.48 1ivz s LEU 113 Ca 0.11 -0.59 0.00 0.00 -2.89 0.00 0.00 54.13 50.76 1ivz s LEU 113 Cb -0.19 -2.56 0.00 0.00 0.66 0.00 0.00 46.19 44.11 1ivz s LEU 113 CO -0.11 -2.65 0.00 0.18 -1.89 0.00 0.00 176.35 171.88 1ivz n LEU 114 N 13.60 0.00 -0.02 -0.68 4.77 -1.26 -1.30 117.00 132.10 1ivz n LEU 114 Ca 0.37 0.00 -0.03 0.00 -0.03 0.00 0.00 56.01 56.32 1ivz n LEU 114 Cb 0.48 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.54 1ivz n LEU 114 CO 0.61 0.00 -0.66 0.59 -1.33 0.00 0.00 177.39 176.60 1ivz n ASN 115 N 1.39 3.73 -4.84 -1.43 3.02 -1.26 -5.04 115.26 110.83 1ivz n ASN 115 Ca 0.00 -0.02 -0.31 0.00 -0.03 0.00 0.00 54.58 54.22 1ivz n ASN 115 Cb 0.00 0.23 0.03 0.00 -0.61 0.00 0.00 39.78 39.42 1ivz n ASN 115 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 1ivz s PHE 116 N -2.11 3.29 -0.24 3.10 0.40 -0.42 -5.05 117.98 116.94 1ivz s PHE 116 Ca -0.05 1.39 0.00 0.00 -0.60 0.00 0.00 56.93 57.67 1ivz s PHE 116 Cb 0.02 -2.83 0.04 0.00 0.51 0.00 0.00 43.02 40.75 1ivz s PHE 116 CO 0.15 -0.99 -0.09 0.95 0.70 0.00 0.00 175.22 175.94 1ivz s THR 117 N -3.01 2.54 0.22 0.64 -4.23 -1.26 0.41 115.64 110.94 1ivz s THR 117 Ca 0.58 -1.21 0.06 0.00 -1.18 0.00 0.00 61.69 59.94 1ivz s THR 117 Cb -0.13 -2.32 -0.05 0.00 1.34 0.00 0.00 72.50 71.34 1ivz s THR 117 CO 0.52 0.17 -0.10 -1.48 -0.54 0.00 0.00 174.62 173.19 1ivz s LEU 118 N 1.25 2.49 0.99 4.79 0.05 0.27 -3.32 118.68 125.20 1ivz s LEU 118 Ca -0.02 -1.09 -0.14 0.00 0.05 0.00 0.00 54.13 52.93 1ivz s LEU 118 Cb -0.17 -0.56 0.18 0.00 -2.05 0.00 0.00 46.19 43.59 1ivz s LEU 118 CO -0.06 -0.28 1.15 -0.62 -0.55 0.00 0.00 176.35 175.99 1ivz s ASP 119 N -3.32 2.81 -0.20 1.48 -1.08 -1.18 -3.95 116.67 111.23 1ivz s ASP 119 Ca 0.24 0.85 -0.10 0.00 -0.52 0.00 0.00 52.55 53.02 1ivz s ASP 119 Cb 0.02 -1.31 -0.08 0.00 -1.46 0.00 0.00 42.92 40.08 1ivz s ASP 119 CO 0.07 -2.98 -0.26 -1.14 0.52 0.00 0.00 175.17 171.39 1ivz n ARG 120 N -4.03 0.42 -0.03 4.34 0.63 -1.21 -4.26 116.66 112.52 1ivz n ARG 120 Ca 0.09 0.18 0.23 0.00 -0.92 0.00 0.00 57.85 57.43 1ivz n ARG 120 Cb 0.59 -1.20 0.72 0.00 0.45 0.00 0.00 32.46 33.02 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 -0.71 0.00 0.00 -0.14 1.57 -1.96 0.46 116.57 115.79 1ivz h LYS 121 Ca -0.49 0.00 -0.17 0.00 -1.87 0.00 0.00 60.65 58.12 1ivz h LYS 121 Cb 1.42 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 33.71 1ivz h LYS 121 CO -0.30 0.00 -0.79 1.03 -0.57 0.00 0.00 179.45 178.82 1ivz h SER 122 N 0.00 0.00 -3.43 0.86 0.87 -1.90 -3.45 113.55 106.50 1ivz h SER 122 Ca 0.29 0.00 -0.53 0.00 -1.23 0.00 0.00 61.79 60.33 1ivz h SER 122 Cb 1.31 0.00 0.07 0.00 -0.44 0.00 0.00 62.40 63.34 1ivz h SER 122 CO -0.00 0.79 0.81 -0.69 -0.53 0.00 0.00 176.83 177.20 1ivz s VAL 123 N -3.01 2.38 -0.24 2.23 1.01 0.16 -4.21 120.40 118.72 1ivz s VAL 123 Ca 0.01 0.33 -0.29 0.00 0.00 0.00 0.00 61.98 62.03 1ivz s VAL 123 Cb 0.10 -3.21 0.16 0.00 0.00 0.00 0.00 36.38 33.44 1ivz s VAL 123 CO 0.78 0.06 1.20 0.12 0.00 0.00 0.00 175.10 177.26 1ivz s PHE 124 N -0.15 -0.20 -0.07 5.22 2.19 0.40 -4.97 117.98 120.39 1ivz s PHE 124 Ca 0.60 0.38 -0.06 0.00 0.33 0.00 0.00 56.93 58.17 1ivz s PHE 124 Cb -0.44 0.47 0.02 0.00 -1.31 0.00 0.00 43.02 41.75 1ivz s PHE 124 CO 0.47 -0.17 0.19 0.54 1.83 0.00 0.00 175.22 178.08 1ivz s VAL 125 N -0.86 -0.01 0.13 3.12 0.11 -1.26 -1.59 120.40 120.05 1ivz s VAL 125 Ca 0.04 0.02 0.00 0.00 -2.93 0.00 0.00 61.98 59.12 1ivz s VAL 125 Cb -0.01 -0.28 -0.00 0.00 -1.53 0.00 0.00 36.38 34.56 1ivz s VAL 125 CO -0.05 0.01 0.01 -0.67 -3.33 0.00 0.00 175.10 171.08 1ivz n ASP 126 N 3.16 1.90 -4.34 3.54 2.03 -0.92 -4.75 116.55 117.18 1ivz n ASP 126 Ca -0.15 -1.60 -0.46 0.00 0.52 0.00 0.00 54.79 53.11 1ivz n ASP 126 Cb 0.58 0.16 -0.01 0.00 -0.72 0.00 0.00 41.12 41.13 1ivz n ASP 126 CO 0.00 0.00 0.00 -0.94 -1.92 0.00 0.00 177.20 174.34 1ivz s SER 127 N -1.73 7.15 0.57 1.67 1.04 -1.26 -1.63 113.70 119.50 1ivz s SER 127 Ca 0.02 -3.33 0.00 0.00 0.48 0.00 0.00 55.95 53.12 1ivz s SER 127 Cb 0.00 -2.21 0.00 0.00 0.10 0.00 0.00 66.02 63.91 1ivz s SER 127 CO 0.01 -0.37 0.00 0.61 0.98 0.00 0.00 173.24 174.47 1ivz n GLY 128 N 3.08 -1.44 1.49 7.32 0.00 0.68 -3.45 105.19 112.87 1ivz n GLY 128 Ca 0.21 -1.03 -0.12 0.00 0.00 0.00 0.00 46.02 45.08 1ivz n GLY 128 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1ivz n PRO 129 N -3.25 -0.95 -1.71 1.61 -0.04 -1.26 -4.17 135.00 125.22 1ivz n PRO 129 Ca 0.01 -0.78 -0.20 0.00 -0.04 0.00 0.00 63.50 62.49 1ivz n PRO 129 Cb 0.39 -0.58 -0.07 0.00 -0.04 0.00 0.00 33.50 33.20 1ivz n PRO 129 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1ivz n SER 130 N -3.47 -5.28 -2.33 3.54 2.88 -1.26 -1.74 113.62 105.95 1ivz n SER 130 Ca 0.06 0.41 -0.14 0.00 -1.33 0.00 0.00 58.87 57.88 1ivz n SER 130 Cb 0.23 -4.64 -0.01 0.00 -0.75 0.00 0.00 64.21 59.04 1ivz n SER 130 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 1ivz n SER 131 N -1.37 -4.24 0.00 -3.46 7.64 -1.26 -5.17 113.62 105.76 1ivz n SER 131 Ca -0.20 0.17 0.00 0.00 1.01 0.00 0.00 58.87 59.85 1ivz n SER 131 Cb 0.65 -3.61 0.00 0.00 -1.01 0.00 0.00 64.21 60.24 1ivz n SER 131 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64