#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 -5.72 -0.01 1.61 2.88 -1.26 -4.85 113.62 106.27 1ivz n SER 2 Ca 0.00 -0.08 -0.02 0.00 -1.33 0.00 0.00 58.87 57.44 1ivz n SER 2 Cb 0.00 -4.70 -0.01 0.00 -0.75 0.00 0.00 64.21 58.75 1ivz n SER 2 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 1ivz n SER 3 N -1.90 3.46 -3.78 -3.46 7.64 -1.26 -5.02 113.62 109.30 1ivz n SER 3 Ca -0.20 -0.01 -0.23 0.00 1.01 0.00 0.00 58.87 59.43 1ivz n SER 3 Cb 0.66 -0.05 -0.17 0.00 -1.01 0.00 0.00 64.21 63.64 1ivz n SER 3 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 1ivz s GLY 4 N -4.35 0.50 -0.18 0.23 0.00 -1.26 -5.01 107.32 97.25 1ivz s GLY 4 Ca -0.04 -0.16 -0.07 0.00 0.00 0.00 0.00 44.72 44.45 1ivz s GLY 4 CO 0.06 1.10 0.14 -1.14 0.00 0.00 0.00 173.10 173.27 1ivz n SER 5 N 5.11 2.04 0.04 1.64 3.41 -1.26 -4.99 113.62 119.61 1ivz n SER 5 Ca -0.08 0.16 0.00 0.00 -0.26 0.00 0.00 58.87 58.69 1ivz n SER 5 Cb 0.50 -0.76 0.00 0.00 -0.26 0.00 0.00 64.21 63.69 1ivz n SER 5 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 1ivz n SER 6 N -3.61 -0.68 0.00 4.04 2.88 -1.26 -5.05 113.62 109.94 1ivz n SER 6 Ca -0.37 0.28 0.00 0.00 -1.33 0.00 0.00 58.87 57.45 1ivz n SER 6 Cb 0.97 0.86 0.00 0.00 -0.75 0.00 0.00 64.21 65.29 1ivz n SER 6 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1ivz n GLY 7 N -1.18 2.70 3.79 0.46 0.00 -1.26 -5.13 105.19 104.57 1ivz n GLY 7 Ca 0.00 -0.33 -0.36 0.00 0.00 0.00 0.00 46.02 45.34 1ivz n GLY 7 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1ivz s SER 8 N 0.00 7.02 -0.81 1.61 0.15 -1.26 -4.99 113.70 115.42 1ivz s SER 8 Ca 0.00 1.85 0.02 0.00 0.70 0.00 0.00 55.95 58.52 1ivz s SER 8 Cb 0.00 -2.57 0.33 0.00 -1.71 0.00 0.00 66.02 62.07 1ivz s SER 8 CO 0.00 -0.30 1.43 -1.20 1.20 0.00 0.00 173.24 174.36 1ivz n SER 9 N -0.03 6.02 -1.74 5.45 7.64 -1.26 -4.74 113.62 124.97 1ivz n SER 9 Ca 0.05 -3.70 -0.15 0.00 1.01 0.00 0.00 58.87 56.08 1ivz n SER 9 Cb 0.51 -0.87 0.19 0.00 -1.01 0.00 0.00 64.21 63.03 1ivz n SER 9 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 1ivz n SER 10 N -0.17 3.14 -4.37 6.43 7.64 -1.26 -4.98 113.62 120.04 1ivz n SER 10 Ca 0.40 -3.70 -0.17 0.00 1.01 0.00 0.00 58.87 56.41 1ivz n SER 10 Cb 0.33 -0.75 0.04 0.00 -1.01 0.00 0.00 64.21 62.83 1ivz n SER 10 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 1ivz n SER 11 N -1.14 1.89 -3.65 6.43 7.64 -1.26 -4.21 113.62 119.32 1ivz n SER 11 Ca 0.48 -2.32 -0.09 0.00 1.01 0.00 0.00 58.87 57.95 1ivz n SER 11 Cb 1.38 -0.27 -0.07 0.00 -1.01 0.00 0.00 64.21 64.23 1ivz n SER 11 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1ivz s GLN 12 N -4.07 0.70 -0.16 1.43 0.00 -1.26 -5.00 119.66 111.29 1ivz s GLN 12 Ca 0.44 1.13 0.00 0.00 -0.00 0.00 0.00 55.36 56.93 1ivz s GLN 12 Cb -0.03 0.17 0.04 0.00 0.00 0.00 0.00 33.01 33.18 1ivz s GLN 12 CO 0.28 -0.14 -0.09 -1.01 0.00 0.00 0.00 175.29 174.33 1ivz s HIS 13 N 1.37 1.97 -0.33 9.60 3.76 -1.26 -2.68 115.29 127.71 1ivz s HIS 13 Ca -0.08 -1.21 -0.07 0.00 -0.15 0.00 0.00 55.06 53.56 1ivz s HIS 13 Cb -0.05 -1.45 0.03 0.00 1.11 0.00 0.00 32.58 32.22 1ivz s HIS 13 CO -0.15 -0.65 0.11 -0.06 -0.85 0.00 0.00 174.74 173.14 1ivz s PHE 14 N 1.55 3.23 -0.25 1.40 0.08 -1.18 0.10 117.98 122.91 1ivz s PHE 14 Ca 0.02 -1.29 -0.32 0.00 0.12 0.00 0.00 56.93 55.46 1ivz s PHE 14 Cb -0.15 -2.29 -0.09 0.00 -0.57 0.00 0.00 43.02 39.93 1ivz s PHE 14 CO -0.09 -0.69 2.16 -1.71 -0.10 0.00 0.00 175.22 174.79 1ivz n ASN 15 N 4.84 2.82 -4.77 1.36 5.15 0.06 0.09 115.26 124.80 1ivz n ASN 15 Ca -0.13 0.42 -0.39 0.00 -0.60 0.00 0.00 54.58 53.88 1ivz n ASN 15 Cb 0.45 -1.40 -0.06 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 7.21 4.45 -0.18 1.20 2.96 0.28 -2.38 118.68 132.23 1ivz s LEU 16 Ca 1.03 1.24 -0.17 0.00 -0.22 0.00 0.00 54.13 56.01 1ivz s LEU 16 Cb -0.61 -2.97 0.05 0.00 0.50 0.00 0.00 46.19 43.15 1ivz s LEU 16 CO 0.44 0.13 0.48 0.20 -1.32 0.00 0.00 176.35 176.28 1ivz s ASN 17 N -0.41 -0.50 -0.30 3.68 -0.87 -0.64 0.29 114.94 116.19 1ivz s ASN 17 Ca 0.32 0.95 -0.19 0.00 -1.57 0.00 0.00 52.86 52.37 1ivz s ASN 17 Cb -0.19 0.97 0.19 0.00 -0.02 0.00 0.00 41.25 42.19 1ivz s ASN 17 CO 0.19 -0.17 1.25 0.72 -2.57 0.00 0.00 177.10 176.51 1ivz s PHE 18 N 0.22 -0.12 0.18 2.20 -0.71 -1.12 0.48 117.98 119.11 1ivz s PHE 18 Ca -0.00 0.18 -0.30 0.00 -1.04 0.00 0.00 56.93 55.77 1ivz s PHE 18 Cb -0.03 0.06 -0.09 0.00 -1.21 0.00 0.00 43.02 41.75 1ivz s PHE 18 CO 0.01 -0.06 1.33 0.99 -1.34 0.00 0.00 175.22 176.15 1ivz s THR 19 N 2.39 3.19 -0.38 -4.49 2.01 -1.26 -2.47 115.64 114.64 1ivz s THR 19 Ca -0.03 0.95 -0.10 0.00 0.31 0.00 0.00 61.69 62.83 1ivz s THR 19 Cb -0.04 -3.61 0.04 0.00 0.01 0.00 0.00 72.50 68.91 1ivz s THR 19 CO -0.13 0.13 0.20 -0.63 -0.69 0.00 0.00 174.62 173.50 1ivz s ILE 20 N 0.32 4.33 0.34 1.82 1.01 -0.32 -3.24 121.20 125.46 1ivz s ILE 20 Ca 0.58 -1.06 0.11 0.00 0.00 0.00 0.00 60.65 60.29 1ivz s ILE 20 Cb -0.37 -3.49 0.07 0.00 0.01 0.00 0.00 42.46 38.68 1ivz s ILE 20 CO 0.37 -0.30 1.78 0.71 0.00 0.00 0.00 174.94 177.50 1ivz h THR 21 N 5.99 1.30 0.00 2.92 1.35 -1.78 -2.31 112.91 120.38 1ivz h THR 21 Ca -0.24 -1.43 0.00 0.00 -0.55 0.00 0.00 66.41 64.19 1ivz h THR 21 Cb 1.09 1.74 0.00 0.00 -1.73 0.00 0.00 68.15 69.25 1ivz h THR 21 CO 0.68 0.41 0.00 -3.20 -0.25 0.00 0.00 175.52 173.16 1ivz n ASN 22 N -4.05 0.00 -4.26 5.36 5.15 0.31 -4.47 115.26 113.31 1ivz n ASN 22 Ca -0.02 -0.54 -0.44 0.00 -0.60 0.00 0.00 54.58 52.98 1ivz n ASN 22 Cb 0.45 -0.15 -0.04 0.00 -0.53 0.00 0.00 39.78 39.51 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 -2.29 6.31 -0.15 1.20 1.98 -0.88 -4.87 118.68 119.97 1ivz s LEU 23 Ca 0.37 -2.70 -0.29 0.00 -2.89 0.00 0.00 54.13 48.62 1ivz s LEU 23 Cb 0.20 -2.11 -0.04 0.00 0.66 0.00 0.00 46.19 44.90 1ivz s LEU 23 CO 0.40 -0.53 1.71 -2.16 -1.89 0.00 0.00 176.35 173.89 1ivz s PRO 24 N 0.16 3.87 -0.04 0.98 0.04 -1.11 -4.10 135.00 134.81 1ivz s PRO 24 Ca 0.17 1.93 -0.30 0.00 0.04 0.00 0.00 61.00 62.84 1ivz s PRO 24 Cb -0.14 -4.06 -0.02 0.00 0.04 0.00 0.00 34.50 30.32 1ivz s PRO 24 CO -0.07 -1.21 0.99 -0.47 0.04 0.00 0.00 177.00 176.28 1ivz s TYR 25 N 5.09 3.61 0.37 0.56 6.14 -1.21 -4.98 117.35 126.93 1ivz s TYR 25 Ca 0.76 1.66 0.06 0.00 0.64 0.00 0.00 57.07 60.19 1ivz s TYR 25 Cb -0.29 -3.14 -0.03 0.00 0.42 0.00 0.00 41.96 38.92 1ivz s TYR 25 CO 0.31 -0.08 0.22 -1.12 0.64 0.00 0.00 175.55 175.51 1ivz s SER 26 N 1.04 2.15 0.52 4.32 0.01 -1.26 -4.74 113.70 115.74 1ivz s SER 26 Ca 0.51 -1.74 0.17 0.00 1.31 0.00 0.00 55.95 56.20 1ivz s SER 26 Cb -0.20 0.56 1.29 0.00 0.21 0.00 0.00 66.02 67.88 1ivz s SER 26 CO 0.25 -1.02 2.14 1.56 0.41 0.00 0.00 173.24 176.57 1ivz h GLN 27 N 1.98 0.00 -0.31 12.44 4.20 -1.99 -2.17 115.11 129.26 1ivz h GLN 27 Ca -0.29 0.00 -0.03 0.00 0.06 0.00 0.00 58.65 58.39 1ivz h GLN 27 Cb 1.25 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 29.02 1ivz h GLN 27 CO 0.44 0.00 0.09 -0.44 -0.67 0.00 0.00 178.83 178.25 1ivz h ASP 28 N 0.00 0.46 0.49 1.46 3.32 -1.96 -2.10 116.42 118.09 1ivz h ASP 28 Ca 0.02 -0.21 0.00 0.00 0.02 0.00 0.00 57.03 56.86 1ivz h ASP 28 Cb 0.08 -0.12 0.00 0.00 0.22 0.00 0.00 39.33 39.51 1ivz h ASP 28 CO -0.00 0.55 0.00 -0.38 -1.72 0.00 0.00 179.24 177.69 1ivz n ILE 29 N -4.68 1.00 0.04 0.35 2.08 -0.83 -2.00 119.36 115.33 1ivz n ILE 29 Ca -0.02 0.34 0.02 0.00 0.56 0.00 0.00 62.75 63.65 1ivz n ILE 29 Cb 0.17 -1.25 -0.07 0.00 -0.75 0.00 0.00 39.64 37.75 1ivz n ILE 29 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 1ivz n ALA 30 N -1.69 2.05 -4.06 -1.39 0.00 -0.84 -4.81 120.51 109.78 1ivz n ALA 30 Ca 0.02 -0.50 -0.31 0.00 0.00 0.00 0.00 53.44 52.65 1ivz n ALA 30 Cb 0.16 -0.97 -0.16 0.00 0.00 0.00 0.00 19.45 18.49 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 -3.01 2.51 0.66 0.00 -0.21 -0.85 -5.00 119.66 113.76 1ivz s GLN 31 Ca -0.03 -0.75 0.36 0.00 0.02 0.00 0.00 55.36 54.96 1ivz s GLN 31 Cb 0.09 -2.37 1.99 0.00 1.00 0.00 0.00 33.01 33.71 1ivz s GLN 31 CO 0.81 -0.28 2.15 -1.35 -2.12 0.00 0.00 175.29 174.50 1ivz h PRO 32 N 7.98 0.00 -0.57 2.91 0.11 -1.88 -1.97 132.00 138.58 1ivz h PRO 32 Ca -0.38 0.00 0.17 0.00 0.11 0.00 0.00 66.00 65.89 1ivz h PRO 32 Cb 1.13 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.21 1ivz h PRO 32 CO 0.56 0.00 0.44 1.03 -0.21 0.00 0.00 178.00 179.82 1ivz h SER 33 N 0.00 0.00 -3.94 -2.05 0.87 -1.94 -3.42 113.55 103.07 1ivz h SER 33 Ca 0.01 0.00 -0.48 0.00 -1.23 0.00 0.00 61.79 60.10 1ivz h SER 33 Cb 0.35 0.00 0.07 0.00 -0.44 0.00 0.00 62.40 62.38 1ivz h SER 33 CO -0.00 0.00 0.26 0.42 -0.53 0.00 0.00 176.83 176.98 1ivz s THR 34 N -4.92 3.39 0.06 2.23 -4.23 -0.74 -5.01 115.64 106.43 1ivz s THR 34 Ca -0.05 0.11 0.07 0.00 -1.18 0.00 0.00 61.69 60.64 1ivz s THR 34 Cb 0.19 -3.39 -0.23 0.00 1.34 0.00 0.00 72.50 70.41 1ivz s THR 34 CO 0.70 -0.45 1.07 0.74 -0.54 0.00 0.00 174.62 176.14 1ivz h THR 35 N -0.39 1.42 -0.16 3.99 2.02 -1.88 -3.29 112.91 114.61 1ivz h THR 35 Ca -0.45 -3.16 0.05 0.00 0.77 0.00 0.00 66.41 63.62 1ivz h THR 35 Cb 1.26 2.73 -0.01 0.00 -1.74 0.00 0.00 68.15 70.40 1ivz h THR 35 CO 0.62 0.83 0.13 0.50 0.37 0.00 0.00 175.52 177.97 1ivz h LYS 36 N 0.01 0.00 -0.03 6.66 3.64 -1.93 0.45 116.57 125.37 1ivz h LYS 36 Ca -0.11 0.00 -0.22 0.00 -1.27 0.00 0.00 60.65 59.05 1ivz h LYS 36 Cb 1.87 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.69 1ivz h LYS 36 CO 0.12 0.00 -0.88 -0.92 -2.27 0.00 0.00 179.45 175.50 1ivz h TYR 37 N 0.00 0.67 0.20 1.91 5.03 -1.71 -1.07 116.97 121.99 1ivz h TYR 37 Ca 0.08 -0.34 -0.33 0.00 2.58 0.00 0.00 58.73 60.72 1ivz h TYR 37 Cb 0.34 -0.08 0.02 0.00 1.55 0.00 0.00 36.73 38.56 1ivz h TYR 37 CO 0.00 1.15 -1.52 1.96 -1.32 0.00 0.00 178.16 178.42 1ivz h GLN 38 N 0.28 0.41 -0.08 1.82 4.20 -1.31 -2.66 115.11 117.78 1ivz h GLN 38 Ca -0.07 -0.71 -0.04 0.00 0.06 0.00 0.00 58.65 57.90 1ivz h GLN 38 Cb 1.50 0.26 -0.00 0.00 0.30 0.00 0.00 27.48 29.55 1ivz h GLN 38 CO 0.16 1.32 -0.10 1.96 -0.67 0.00 0.00 178.83 181.50 1ivz h GLN 39 N 0.11 0.21 -0.27 1.46 1.08 -0.24 -2.05 115.11 115.41 1ivz h GLN 39 Ca -0.26 -0.12 -0.03 0.00 -1.45 0.00 0.00 58.65 56.80 1ivz h GLN 39 Cb 2.10 0.01 -0.01 0.00 -0.05 0.00 0.00 27.48 29.53 1ivz h GLN 39 CO 0.22 0.67 0.06 1.15 -0.95 0.00 0.00 178.83 179.98 1ivz h THR 40 N -0.23 1.22 -0.59 -0.54 2.02 -1.34 0.63 112.91 114.08 1ivz h THR 40 Ca 0.01 -0.72 0.03 0.00 0.77 0.00 0.00 66.41 66.50 1ivz h THR 40 Cb 0.64 1.18 -0.04 0.00 -1.74 0.00 0.00 68.15 68.19 1ivz h THR 40 CO 0.02 0.23 0.36 0.50 0.37 0.00 0.00 175.52 177.01 1ivz h LYS 41 N 0.26 0.69 -0.02 6.66 3.64 -1.53 -1.96 116.57 124.30 1ivz h LYS 41 Ca 0.08 -0.04 -0.13 0.00 -1.27 0.00 0.00 60.65 59.30 1ivz h LYS 41 Cb 0.29 -0.15 -0.02 0.00 -0.41 0.00 0.00 32.23 31.94 1ivz h LYS 41 CO 0.00 0.45 -0.58 -0.09 -2.27 0.00 0.00 179.45 176.97 1ivz h ARG 42 N 0.71 0.06 -0.41 1.90 9.65 -1.26 -2.53 114.38 122.50 1ivz h ARG 42 Ca 0.24 -0.04 -0.01 0.00 -1.10 0.00 0.00 59.98 59.07 1ivz h ARG 42 Cb 0.02 0.01 -0.02 0.00 -1.39 0.00 0.00 29.97 28.59 1ivz h ARG 42 CO -0.10 0.62 0.21 1.03 2.80 0.00 0.00 179.97 184.53 1ivz h SER 43 N 0.04 0.53 -0.11 -3.80 0.87 -0.15 0.61 113.55 111.54 1ivz h SER 43 Ca -0.01 -0.12 -0.05 0.00 -1.23 0.00 0.00 61.79 60.39 1ivz h SER 43 Cb 1.04 -0.14 -0.00 0.00 -0.44 0.00 0.00 62.40 62.86 1ivz h SER 43 CO 0.08 0.49 -0.14 0.40 -0.53 0.00 0.00 176.83 177.14 1ivz h ILE 44 N 0.52 1.37 -0.65 2.23 2.04 -1.37 -1.24 117.51 120.41 1ivz h ILE 44 Ca 0.14 -1.33 0.01 0.00 1.00 0.00 0.00 64.86 64.68 1ivz h ILE 44 Cb 0.10 1.99 -0.03 0.00 -0.74 0.00 0.00 36.82 38.13 1ivz h ILE 44 CO -0.02 0.38 0.43 -0.33 0.00 0.00 0.00 178.15 178.61 1ivz h GLU 45 N -0.12 0.86 -0.10 2.37 5.08 -1.39 -0.51 114.58 120.78 1ivz h GLU 45 Ca 0.01 -0.05 -0.10 0.00 -1.00 0.00 0.00 59.36 58.23 1ivz h GLU 45 Cb 0.68 -0.19 0.00 0.00 0.50 0.00 0.00 28.75 29.74 1ivz h GLU 45 CO 0.03 0.57 -0.31 -0.97 -1.00 0.00 0.00 179.01 177.33 1ivz h ASN 46 N 0.88 0.44 -0.65 1.42 -1.24 -0.84 -2.58 115.58 113.02 1ivz h ASN 46 Ca 0.24 -0.61 -0.01 0.00 0.71 0.00 0.00 56.30 56.63 1ivz h ASN 46 Cb -0.10 -0.13 -0.03 0.00 0.73 0.00 0.00 38.32 38.79 1ivz h ASN 46 CO -0.05 0.98 0.38 0.00 -1.29 0.00 0.00 177.43 177.44 1ivz h ALA 47 N 0.47 1.42 0.00 1.57 0.00 -0.87 -1.90 119.26 119.95 1ivz h ALA 47 Ca -0.01 -0.09 -0.12 0.00 0.00 0.00 0.00 54.91 54.69 1ivz h ALA 47 Cb 0.94 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 18.44 1ivz h ALA 47 CO 0.07 0.49 -0.55 -0.07 0.00 0.00 0.00 179.25 179.19 1ivz h LEU 48 N 0.92 0.00 0.91 0.00 3.38 -1.11 -2.92 115.31 116.48 1ivz h LEU 48 Ca 0.24 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 58.16 1ivz h LEU 48 Cb -0.00 0.00 0.01 0.00 0.09 0.00 0.00 40.66 40.75 1ivz h LEU 48 CO -0.04 0.55 -0.47 -1.13 0.09 0.00 0.00 178.44 177.44 1ivz h ASN 49 N 0.00 -1.13 -0.15 -0.43 -0.73 -0.92 -1.98 115.58 110.24 1ivz h ASN 49 Ca -0.01 0.05 0.01 0.00 1.87 0.00 0.00 56.30 58.22 1ivz h ASN 49 Cb 0.98 0.30 -0.01 0.00 0.27 0.00 0.00 38.32 39.86 1ivz h ASN 49 CO 0.07 -0.77 0.10 0.06 -0.37 0.00 0.00 177.43 176.52 1ivz h GLN 50 N -1.26 0.15 0.27 6.67 3.07 -1.59 -2.36 115.11 120.06 1ivz h GLN 50 Ca -0.12 -0.01 -0.01 0.00 0.09 0.00 0.00 58.65 58.59 1ivz h GLN 50 Cb 0.98 -0.03 0.00 0.00 0.08 0.00 0.00 27.48 28.51 1ivz h GLN 50 CO 0.18 0.10 -0.13 1.25 0.09 0.00 0.00 178.83 180.32 1ivz h LEU 51 N 0.16 -0.31 -0.80 0.06 6.46 -1.28 -1.45 115.31 118.15 1ivz h LEU 51 Ca 0.06 -0.02 -0.01 0.00 -0.12 0.00 0.00 57.88 57.79 1ivz h LEU 51 Cb 0.05 0.08 -0.04 0.00 -0.73 0.00 0.00 40.66 40.02 1ivz h LEU 51 CO -0.01 -0.18 0.47 -0.26 -0.62 0.00 0.00 178.44 177.84 1ivz h PHE 52 N -0.41 1.07 0.00 1.25 0.04 -1.01 0.84 116.94 118.73 1ivz h PHE 52 Ca -0.04 -0.01 -0.02 0.00 2.80 0.00 0.00 57.97 60.70 1ivz h PHE 52 Cb 0.31 -0.35 -0.00 0.00 2.20 0.00 0.00 35.95 38.11 1ivz h PHE 52 CO -0.05 0.73 -0.09 0.00 -0.60 0.00 0.00 178.31 178.31 1ivz h ARG 53 N 1.10 0.00 0.00 1.51 3.08 -1.26 -2.55 114.38 116.26 1ivz h ARG 53 Ca 0.29 0.00 -0.24 0.00 0.07 0.00 0.00 59.98 60.10 1ivz h ARG 53 Cb -0.01 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 29.99 1ivz h ARG 53 CO -0.05 0.09 -1.88 0.09 -1.07 0.00 0.00 179.97 177.15 1ivz n ASN 54 N -4.33 0.45 -4.62 7.04 3.02 -0.56 -4.78 115.26 111.48 1ivz n ASN 54 Ca -0.03 0.21 -0.34 0.00 -0.03 0.00 0.00 54.58 54.38 1ivz n ASN 54 Cb 0.17 0.65 0.11 0.00 -0.61 0.00 0.00 39.78 40.10 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 -2.79 0.34 0.23 6.41 3.41 0.29 -4.86 113.62 116.65 1ivz n SER 55 Ca -0.18 0.59 0.12 0.00 -0.26 0.00 0.00 58.87 59.13 1ivz n SER 55 Cb 0.95 -1.42 0.72 0.00 -0.26 0.00 0.00 64.21 64.20 1ivz n SER 55 CO 0.00 0.00 0.00 -1.28 -0.16 0.00 0.00 175.04 173.60 1ivz h SER 56 N -0.72 0.00 -1.14 4.04 0.87 -1.89 -2.30 113.55 112.42 1ivz h SER 56 Ca -0.46 0.00 -0.55 0.00 -1.23 0.00 0.00 61.79 59.55 1ivz h SER 56 Cb 1.31 0.00 -0.21 0.00 -0.44 0.00 0.00 62.40 63.07 1ivz h SER 56 CO 0.45 0.00 0.62 2.30 -0.53 0.00 0.00 176.83 179.67 1ivz n ILE 57 N -4.31 3.32 -1.27 2.23 -5.35 -1.26 -4.69 119.36 108.02 1ivz n ILE 57 Ca -0.01 -2.99 -0.23 0.00 -0.27 0.00 0.00 62.75 59.24 1ivz n ILE 57 Cb 0.17 -1.40 -0.02 0.00 -1.74 0.00 0.00 39.64 36.65 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 2.20 0.00 6.28 2.85 -0.87 -3.12 118.16 125.69 1ivz n LYS 58 Ca 0.48 -2.08 0.00 0.00 -1.05 0.00 0.00 58.31 55.66 1ivz n LYS 58 Cb 0.50 -1.97 0.00 0.00 -0.65 0.00 0.00 35.03 32.92 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 0.69 0.00 -0.02 -5.58 2.88 -1.26 -4.89 113.62 105.43 1ivz n SER 59 Ca 0.43 0.00 -0.07 0.00 -1.33 0.00 0.00 58.87 57.90 1ivz n SER 59 Cb 0.57 0.01 -0.13 0.00 -0.75 0.00 0.00 64.21 63.91 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 -2.22 0.86 -1.94 0.66 4.01 -1.26 -4.77 117.16 112.50 1ivz n TYR 60 Ca 0.00 0.31 -0.32 0.00 -0.16 0.00 0.00 57.90 57.73 1ivz n TYR 60 Cb 0.00 -1.13 -0.04 0.00 -0.31 0.00 0.00 39.34 37.86 1ivz n TYR 60 CO 0.00 0.00 0.00 0.12 -0.46 0.00 0.00 176.86 176.52 1ivz s PHE 61 N -2.66 1.59 0.03 -0.72 2.19 -1.18 -0.11 117.98 117.11 1ivz s PHE 61 Ca -0.05 0.94 -0.18 0.00 0.33 0.00 0.00 56.93 57.97 1ivz s PHE 61 Cb 0.08 -3.95 -0.10 0.00 -1.31 0.00 0.00 43.02 37.74 1ivz s PHE 61 CO 0.82 -2.09 1.25 0.77 1.83 0.00 0.00 175.22 177.80 1ivz h SER 62 N 14.17 -0.56 -0.86 6.13 0.02 -1.79 -3.46 113.55 127.20 1ivz h SER 62 Ca -0.12 0.02 0.02 0.00 -0.84 0.00 0.00 61.79 60.88 1ivz h SER 62 Cb 1.11 0.15 -0.00 0.00 0.14 0.00 0.00 62.40 63.79 1ivz h SER 62 CO 1.19 -0.39 0.09 0.47 -1.14 0.00 0.00 176.83 177.05 1ivz n ASP 63 N -3.82 -0.26 -4.25 3.07 8.00 -0.85 -5.01 116.55 113.43 1ivz n ASP 63 Ca -0.08 -1.13 -0.19 0.00 0.71 0.00 0.00 54.79 54.10 1ivz n ASP 63 Cb 0.26 0.42 -0.11 0.00 -0.02 0.00 0.00 41.12 41.67 1ivz n ASP 63 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1ivz s GLN 65 N -2.58 1.01 -0.32 0.00 0.74 -0.58 -4.90 119.66 113.02 1ivz s GLN 65 Ca 0.09 -0.07 -0.26 0.00 0.05 0.00 0.00 55.36 55.17 1ivz s GLN 65 Cb -0.06 -1.18 0.01 0.00 1.10 0.00 0.00 33.01 32.88 1ivz s GLN 65 CO 0.03 -0.24 0.91 0.54 -0.55 0.00 0.00 175.29 175.98 1ivz s VAL 66 N 1.66 4.66 -0.03 1.34 0.11 -1.26 0.55 120.40 127.43 1ivz s VAL 66 Ca 0.02 1.37 -0.04 0.00 -2.93 0.00 0.00 61.98 60.40 1ivz s VAL 66 Cb -0.13 -4.28 -0.02 0.00 -1.53 0.00 0.00 36.38 30.42 1ivz s VAL 66 CO -0.05 -0.38 0.31 -0.07 -3.33 0.00 0.00 175.10 171.57 1ivz h LEU 67 N 9.79 -0.12 -7.58 2.54 3.38 -0.28 -3.48 115.31 119.55 1ivz h LEU 67 Ca -0.23 0.00 0.23 0.00 0.09 0.00 0.00 57.88 57.98 1ivz h LEU 67 Cb 1.08 0.03 -0.09 0.00 0.09 0.00 0.00 40.66 41.78 1ivz h LEU 67 CO 0.95 0.07 0.63 0.00 0.09 0.00 0.00 178.44 180.18 1ivz s ALA 68 N -3.17 -1.86 -0.16 1.53 0.00 -1.06 -5.05 121.76 111.99 1ivz s ALA 68 Ca -0.02 0.23 -0.06 0.00 0.00 0.00 0.00 51.96 52.11 1ivz s ALA 68 Cb 0.00 0.58 -0.04 0.00 0.00 0.00 0.00 23.12 23.66 1ivz s ALA 68 CO 0.06 -1.06 0.04 -0.06 0.00 0.00 0.00 175.76 174.75 1ivz s PHE 69 N -2.80 3.22 -0.44 0.00 0.08 -1.26 -1.63 117.98 115.14 1ivz s PHE 69 Ca 0.15 0.06 -0.20 0.00 0.12 0.00 0.00 56.93 57.06 1ivz s PHE 69 Cb 0.00 -2.00 0.03 0.00 -0.57 0.00 0.00 43.02 40.48 1ivz s PHE 69 CO 0.01 0.21 0.60 1.03 -0.10 0.00 0.00 175.22 176.97 1ivz s ARG 70 N 0.06 3.22 -0.61 0.44 3.00 0.21 -4.93 118.95 120.35 1ivz s ARG 70 Ca 0.04 -0.51 -0.27 0.00 0.00 0.00 0.00 55.73 54.99 1ivz s ARG 70 Cb -0.12 -3.97 0.00 0.00 0.00 0.00 0.00 34.95 30.86 1ivz s ARG 70 CO 0.01 -1.00 1.58 0.45 0.00 0.00 0.00 175.30 176.33 1ivz s SER 71 N 2.04 5.79 0.33 0.23 0.15 -1.26 -0.73 113.70 120.24 1ivz s SER 71 Ca 0.20 0.18 -0.29 0.00 0.70 0.00 0.00 55.95 56.74 1ivz s SER 71 Cb -0.15 -2.54 -0.10 0.00 -1.71 0.00 0.00 66.02 61.51 1ivz s SER 71 CO 0.17 -2.00 1.38 0.68 1.20 0.00 0.00 173.24 174.67 1ivz s VAL 72 N 7.20 2.52 -0.06 4.45 -7.23 -1.26 -4.93 120.40 121.09 1ivz s VAL 72 Ca 0.55 0.51 0.13 0.00 -1.81 0.00 0.00 61.98 61.37 1ivz s VAL 72 Cb -0.11 -3.33 -0.13 0.00 0.56 0.00 0.00 36.38 33.37 1ivz s VAL 72 CO 0.21 0.12 1.01 0.77 -0.31 0.00 0.00 175.10 176.90 1ivz h SER 73 N 3.56 0.00 -0.75 4.85 4.64 -1.97 -3.35 113.55 120.53 1ivz h SER 73 Ca -0.49 0.00 0.06 0.00 -0.47 0.00 0.00 61.79 60.89 1ivz h SER 73 Cb 1.23 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 63.26 1ivz h SER 73 CO 0.67 0.76 0.44 0.78 -0.87 0.00 0.00 176.83 178.61 1ivz h ASN 74 N 0.00 0.68 -5.05 4.97 4.21 -2.02 -3.44 115.58 114.94 1ivz h ASN 74 Ca -0.13 0.02 -0.14 0.00 1.21 0.00 0.00 56.30 57.26 1ivz h ASN 74 Cb 1.69 -0.11 -0.19 0.00 -1.12 0.00 0.00 38.32 38.59 1ivz h ASN 74 CO 0.08 0.44 -0.59 0.21 -1.29 0.00 0.00 177.43 176.27 1ivz s ASN 75 N -5.67 0.20 -0.41 5.81 3.84 -1.26 -5.04 114.94 112.41 1ivz s ASN 75 Ca -0.13 -0.50 0.06 0.00 0.21 0.00 0.00 52.86 52.50 1ivz s ASN 75 Cb 0.17 0.18 0.68 0.00 -0.55 0.00 0.00 41.25 41.73 1ivz s ASN 75 CO 0.77 -0.42 1.87 0.59 -2.79 0.00 0.00 177.10 177.13 1ivz n ASN 76 N 1.12 4.08 0.00 -4.21 5.03 -1.26 -4.27 115.26 115.74 1ivz n ASN 76 Ca -0.21 -3.46 0.00 0.00 0.87 0.00 0.00 54.58 51.78 1ivz n ASN 76 Cb 0.57 -0.81 0.00 0.00 -1.02 0.00 0.00 39.78 38.52 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 -0.82 3.01 -4.36 6.41 2.85 -1.26 -3.93 115.26 117.16 1ivz n ASN 77 Ca 0.53 0.00 -0.29 0.00 -0.11 0.00 0.00 54.58 54.71 1ivz n ASN 77 Cb 1.58 0.00 0.19 0.00 1.24 0.00 0.00 39.78 42.79 1ivz n ASN 77 CO 0.00 0.00 0.00 -1.00 -2.11 0.00 0.00 177.26 174.15 1ivz s HIS 78 N -1.94 1.60 -0.30 1.20 0.09 -1.26 -2.77 115.29 111.91 1ivz s HIS 78 Ca 0.00 0.71 -0.03 0.00 -0.00 0.00 0.00 55.06 55.74 1ivz s HIS 78 Cb 0.00 -3.45 0.19 0.00 -0.00 0.00 0.00 32.58 29.32 1ivz s HIS 78 CO 0.00 -3.09 0.69 0.99 -0.00 0.00 0.00 174.74 173.33 1ivz s THR 79 N -3.15 -0.87 -0.44 1.30 2.01 -1.13 -4.17 115.64 109.19 1ivz s THR 79 Ca 0.68 0.00 -0.28 0.00 0.31 0.00 0.00 61.69 62.40 1ivz s THR 79 Cb -0.13 -1.00 -0.01 0.00 0.01 0.00 0.00 72.50 71.37 1ivz s THR 79 CO 0.56 0.00 1.76 -0.83 -0.69 0.00 0.00 174.62 175.41 1ivz s GLY 80 N 2.88 0.65 0.34 4.40 0.00 0.09 -1.18 107.32 114.50 1ivz s GLY 80 Ca 0.16 -0.11 -0.28 0.00 0.00 0.00 0.00 44.72 44.50 1ivz s GLY 80 CO -0.19 3.24 1.19 0.14 0.00 0.00 0.00 173.10 177.47 1ivz s VAL 81 N 7.37 3.13 -0.55 1.40 1.01 -1.03 0.68 120.40 132.42 1ivz s VAL 81 Ca 0.73 1.06 0.05 0.00 0.00 0.00 0.00 61.98 63.82 1ivz s VAL 81 Cb -0.18 -3.64 0.19 0.00 0.00 0.00 0.00 36.38 32.75 1ivz s VAL 81 CO 0.29 0.20 0.49 -0.67 0.00 0.00 0.00 175.10 175.40 1ivz n ASP 82 N 0.64 1.49 -4.67 3.32 -0.08 -0.65 -2.80 116.55 113.79 1ivz n ASP 82 Ca 0.01 -2.88 -0.19 0.00 -1.51 0.00 0.00 54.79 50.23 1ivz n ASP 82 Cb 0.45 -0.65 0.05 0.00 2.34 0.00 0.00 41.12 43.30 1ivz n ASP 82 CO 0.00 0.00 0.00 -1.54 0.12 0.00 0.00 177.20 175.78 1ivz n SER 83 N 2.00 2.05 -3.72 1.67 3.41 0.15 0.47 113.62 119.65 1ivz n SER 83 Ca 0.25 -2.47 -0.23 0.00 -0.26 0.00 0.00 58.87 56.17 1ivz n SER 83 Cb 0.43 -0.33 -0.18 0.00 -0.26 0.00 0.00 64.21 63.88 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 0.48 -1.17 1.04 1.98 0.19 0.10 118.68 121.30 1ivz s LEU 84 Ca 0.51 -0.15 -0.22 0.00 -2.89 0.00 0.00 54.13 51.38 1ivz s LEU 84 Cb -0.04 -0.34 -0.03 0.00 0.66 0.00 0.00 46.19 46.44 1ivz s LEU 84 CO 0.32 -0.24 1.84 0.00 -1.89 0.00 0.00 176.35 176.39 1ivz s ASN 86 N 5.88 6.72 0.21 0.00 0.01 0.13 -3.08 114.94 124.82 1ivz s ASN 86 Ca 0.63 2.27 0.10 0.00 -0.71 0.00 0.00 52.86 55.15 1ivz s ASN 86 Cb 0.00 -2.56 -0.04 0.00 0.41 0.00 0.00 41.25 39.06 1ivz s ASN 86 CO 0.08 -0.82 -0.14 -0.36 -1.51 0.00 0.00 177.10 174.35 1ivz s PHE 87 N 2.75 2.50 0.66 2.20 0.40 -1.09 -2.01 117.98 123.39 1ivz s PHE 87 Ca 0.69 -0.27 -0.12 0.00 -0.60 0.00 0.00 56.93 56.63 1ivz s PHE 87 Cb -0.35 -1.19 -0.01 0.00 0.51 0.00 0.00 43.02 41.97 1ivz s PHE 87 CO 0.29 0.55 1.05 0.45 0.70 0.00 0.00 175.22 178.26 1ivz s SER 88 N -2.98 5.70 0.28 1.36 0.15 0.85 -4.35 113.70 114.71 1ivz s SER 88 Ca 0.25 1.59 0.23 0.00 0.70 0.00 0.00 55.95 58.72 1ivz s SER 88 Cb -0.08 -2.49 1.04 0.00 -1.71 0.00 0.00 66.02 62.78 1ivz s SER 88 CO 0.14 -1.23 1.71 -0.81 1.20 0.00 0.00 173.24 174.25 1ivz n PRO 89 N -2.84 0.19 0.03 5.44 -0.04 -1.26 -2.54 135.00 133.97 1ivz n PRO 89 Ca 0.07 0.48 -0.05 0.00 -0.04 0.00 0.00 63.50 63.96 1ivz n PRO 89 Cb 0.54 -1.91 0.15 0.00 -0.04 0.00 0.00 33.50 32.24 1ivz n PRO 89 CO 0.00 0.00 0.00 -0.07 -0.04 0.00 0.00 175.50 175.39 1ivz h LEU 90 N 0.00 0.47 -9.81 1.53 4.07 -1.92 -3.41 115.31 106.25 1ivz h LEU 90 Ca 0.00 -0.20 -0.35 0.00 0.08 0.00 0.00 57.88 57.40 1ivz h LEU 90 Cb 0.28 -0.13 0.20 0.00 1.08 0.00 0.00 40.66 42.10 1ivz h LEU 90 CO 0.00 0.83 -0.18 0.00 -1.08 0.00 0.00 178.44 178.00 1ivz n ALA 91 N -2.49 -4.23 0.00 1.53 0.00 -1.05 -4.94 120.51 109.33 1ivz n ALA 91 Ca -0.02 -1.72 0.00 0.00 0.00 0.00 0.00 53.44 51.70 1ivz n ALA 91 Cb 0.50 -1.52 0.00 0.00 0.00 0.00 0.00 19.45 18.43 1ivz n ALA 91 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 1ivz n ARG 92 N -5.03 0.00 -1.25 0.00 0.63 -1.26 -4.88 116.66 104.86 1ivz n ARG 92 Ca 0.11 0.00 -0.26 0.00 -0.92 0.00 0.00 57.85 56.78 1ivz n ARG 92 Cb 0.55 0.00 0.16 0.00 0.45 0.00 0.00 32.46 33.62 1ivz n ARG 92 CO 0.00 0.00 0.00 0.54 -2.51 0.00 0.00 177.63 175.66 1ivz n ARG 93 N 0.00 2.34 -3.17 -0.14 3.00 -1.26 -4.97 116.66 112.46 1ivz n ARG 93 Ca 0.00 -3.08 -0.39 0.00 -0.01 0.00 0.00 57.85 54.38 1ivz n ARG 93 Cb 0.00 -2.20 -0.06 0.00 0.00 0.00 0.00 32.46 30.20 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 -3.63 4.61 0.14 1.55 1.01 -1.26 -5.08 120.40 117.73 1ivz s VAL 94 Ca 0.59 1.39 0.06 0.00 0.00 0.00 0.00 61.98 64.02 1ivz s VAL 94 Cb 0.49 -3.98 -0.04 0.00 0.00 0.00 0.00 36.38 32.84 1ivz s VAL 94 CO 0.08 0.54 -0.14 -1.81 0.00 0.00 0.00 175.10 173.77 1ivz s ASP 95 N -1.12 2.13 0.51 3.32 1.11 -1.26 -5.03 116.67 116.32 1ivz s ASP 95 Ca 0.31 -0.85 0.17 0.00 0.18 0.00 0.00 52.55 52.37 1ivz s ASP 95 Cb -0.21 -0.08 1.25 0.00 1.07 0.00 0.00 42.92 44.94 1ivz s ASP 95 CO 0.22 -0.14 2.10 0.08 1.18 0.00 0.00 175.17 178.60 1ivz h ARG 96 N 3.37 0.07 -0.01 8.23 -0.00 -1.95 -0.63 114.38 123.46 1ivz h ARG 96 Ca -0.40 -0.00 -0.08 0.00 -0.00 0.00 0.00 59.98 59.49 1ivz h ARG 96 Cb 1.20 -0.02 -0.01 0.00 -0.00 0.00 0.00 29.97 31.14 1ivz h ARG 96 CO 0.52 0.05 -0.39 0.28 -0.00 0.00 0.00 179.97 180.43 1ivz h VAL 97 N 0.08 1.28 0.66 0.08 2.07 -1.96 -1.94 116.25 116.53 1ivz h VAL 97 Ca 0.08 -1.35 -0.03 0.00 0.82 0.00 0.00 66.70 66.22 1ivz h VAL 97 Cb 0.24 1.71 0.01 0.00 -1.52 0.00 0.00 31.29 31.74 1ivz h VAL 97 CO -0.01 0.39 -0.32 0.00 0.02 0.00 0.00 177.57 177.65 1ivz h ALA 98 N 1.59 -1.17 0.00 1.67 0.00 -1.52 0.19 119.26 120.03 1ivz h ALA 98 Ca -0.00 -0.19 -0.01 0.00 0.00 0.00 0.00 54.91 54.70 1ivz h ALA 98 Cb 0.70 0.34 -0.00 0.00 0.00 0.00 0.00 17.79 18.83 1ivz h ALA 98 CO 0.05 -1.10 -0.07 0.82 0.00 0.00 0.00 179.25 178.95 1ivz h ILE 99 N -0.94 0.41 -0.03 0.00 2.04 -1.60 -0.31 117.51 117.07 1ivz h ILE 99 Ca -0.09 -0.37 -0.14 0.00 1.00 0.00 0.00 64.86 65.26 1ivz h ILE 99 Cb 0.68 1.26 0.01 0.00 -0.74 0.00 0.00 36.82 38.03 1ivz h ILE 99 CO 0.15 0.07 -0.53 0.22 0.00 0.00 0.00 178.15 178.05 1ivz h TYR 100 N 0.00 0.60 0.04 1.37 3.20 -1.16 -2.65 116.97 118.36 1ivz h TYR 100 Ca -0.00 -0.30 -0.00 0.00 3.14 0.00 0.00 58.73 61.56 1ivz h TYR 100 Cb 0.25 -0.08 0.00 0.00 1.54 0.00 0.00 36.73 38.45 1ivz h TYR 100 CO 0.00 1.10 -0.02 0.93 -1.64 0.00 0.00 178.16 178.53 1ivz h GLU 101 N -0.08 -0.05 -0.18 1.82 5.08 -0.29 -2.48 114.58 118.41 1ivz h GLU 101 Ca -0.06 0.00 0.05 0.00 -1.00 0.00 0.00 59.36 58.36 1ivz h GLU 101 Cb 1.23 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 30.48 1ivz h GLU 101 CO 0.11 0.60 0.14 0.93 -1.00 0.00 0.00 179.01 179.79 1ivz h GLU 102 N -0.79 0.00 0.13 2.33 5.08 -1.21 0.10 114.58 120.22 1ivz h GLU 102 Ca -0.01 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.35 1ivz h GLU 102 Cb 0.67 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.92 1ivz h GLU 102 CO 0.01 0.00 -0.06 0.35 -1.00 0.00 0.00 179.01 178.30 1ivz h PHE 103 N 0.00 -0.17 -1.00 4.33 3.57 -1.51 -3.07 116.94 119.10 1ivz h PHE 103 Ca 0.08 -0.00 0.09 0.00 3.53 0.00 0.00 57.97 61.67 1ivz h PHE 103 Cb 0.36 0.06 -0.07 0.00 2.79 0.00 0.00 35.95 39.09 1ivz h PHE 103 CO 0.00 -0.02 0.64 -0.07 -2.23 0.00 0.00 178.31 176.63 1ivz h LEU 104 N -1.03 0.98 -1.76 0.59 3.38 -1.27 0.09 115.31 116.29 1ivz h LEU 104 Ca -0.02 0.02 -0.03 0.00 0.09 0.00 0.00 57.88 57.94 1ivz h LEU 104 Cb 0.23 -0.18 -0.00 0.00 0.09 0.00 0.00 40.66 40.79 1ivz h LEU 104 CO 0.03 0.59 -0.16 -0.09 0.09 0.00 0.00 178.44 178.90 1ivz h ARG 105 N 1.09 0.00 0.00 1.13 2.43 -1.10 0.47 114.38 118.40 1ivz h ARG 105 Ca 0.46 0.00 -0.16 0.00 -0.81 0.00 0.00 59.98 59.47 1ivz h ARG 105 Cb 0.31 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 29.83 1ivz h ARG 105 CO -0.21 0.16 -1.19 1.98 -1.51 0.00 0.00 179.97 179.19 1ivz h MET 106 N 0.00 0.00 -1.52 0.20 4.05 -0.95 -3.36 114.93 113.35 1ivz h MET 106 Ca -0.00 0.00 -0.51 0.00 -0.28 0.00 0.00 59.70 58.91 1ivz h MET 106 Cb 0.31 0.00 -0.20 0.00 -0.80 0.00 0.00 31.60 30.91 1ivz h MET 106 CO 0.02 0.38 0.61 0.25 0.23 0.00 0.00 176.91 178.40 1ivz n THR 107 N -2.99 3.22 -3.63 -0.77 -2.24 -0.21 -4.71 114.28 102.94 1ivz n THR 107 Ca -0.07 -2.57 -0.21 0.00 -2.27 0.00 0.00 64.05 58.93 1ivz n THR 107 Cb 0.83 -1.33 0.04 0.00 -2.10 0.00 0.00 70.33 67.77 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 0.00 -1.99 -3.30 4.78 8.25 -1.21 0.45 115.22 122.21 1ivz n HIS 108 Ca 0.46 0.81 -0.16 0.00 -0.26 0.00 0.00 57.72 58.56 1ivz n HIS 108 Cb 0.56 -4.32 0.08 0.00 1.12 0.00 0.00 29.99 27.42 1ivz n HIS 108 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 1ivz n ASN 109 N -3.04 -2.71 -3.64 0.41 3.02 0.68 -2.84 115.26 107.14 1ivz n ASN 109 Ca -0.25 -0.54 -0.24 0.00 -0.03 0.00 0.00 54.58 53.52 1ivz n ASN 109 Cb 0.66 -4.58 0.07 0.00 -0.61 0.00 0.00 39.78 35.32 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 -1.24 -0.53 0.00 7.41 0.00 0.13 -4.70 105.19 106.27 1ivz n GLY 110 Ca -0.21 0.24 0.00 0.00 0.00 0.00 0.00 46.02 46.05 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 -4.90 0.00 -3.63 2.61 -2.24 0.51 0.64 114.28 107.27 1ivz n THR 111 Ca -0.01 0.00 -0.18 0.00 -2.27 0.00 0.00 64.05 61.59 1ivz n THR 111 Cb 0.56 -0.46 -0.15 0.00 -2.10 0.00 0.00 70.33 68.18 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 -1.79 0.06 -0.82 -0.78 0.74 0.17 -0.26 119.66 117.00 1ivz s GLN 112 Ca 0.00 0.42 -0.17 0.00 0.05 0.00 0.00 55.36 55.66 1ivz s GLN 112 Cb 0.00 -0.63 0.16 0.00 1.10 0.00 0.00 33.01 33.64 1ivz s GLN 112 CO 0.00 -0.42 0.90 -1.17 -0.55 0.00 0.00 175.29 174.05 1ivz s LEU 113 N 2.28 5.78 0.00 3.68 1.98 0.23 -3.31 118.68 129.32 1ivz s LEU 113 Ca 0.04 -2.16 0.00 0.00 -2.89 0.00 0.00 54.13 49.12 1ivz s LEU 113 Cb -0.13 -2.31 0.00 0.00 0.66 0.00 0.00 46.19 44.41 1ivz s LEU 113 CO -0.07 -0.89 0.00 0.18 -1.89 0.00 0.00 176.35 173.68 1ivz n LEU 114 N 5.52 0.00 -2.59 -0.68 4.77 -1.26 -1.86 117.00 120.90 1ivz n LEU 114 Ca 0.13 0.00 -0.10 0.00 -0.03 0.00 0.00 56.01 56.01 1ivz n LEU 114 Cb 0.47 0.00 0.03 0.00 -2.33 0.00 0.00 43.42 41.59 1ivz n LEU 114 CO 0.46 0.00 0.03 0.59 -1.33 0.00 0.00 177.39 177.13 1ivz n ASN 115 N 1.26 2.55 -3.38 -1.43 4.13 -1.26 -5.02 115.26 112.11 1ivz n ASN 115 Ca 0.00 -2.70 -0.00 0.00 1.68 0.00 0.00 54.58 53.56 1ivz n ASN 115 Cb 0.00 -0.46 -0.03 0.00 -1.54 0.00 0.00 39.78 37.75 1ivz n ASN 115 CO 0.00 0.00 0.00 -0.36 0.28 0.00 0.00 177.26 177.18 1ivz s PHE 116 N -3.59 -1.37 -0.25 3.10 0.08 -0.77 -5.09 117.98 110.08 1ivz s PHE 116 Ca 0.34 1.83 -0.29 0.00 0.12 0.00 0.00 56.93 58.93 1ivz s PHE 116 Cb 0.38 0.57 0.00 0.00 -0.57 0.00 0.00 43.02 43.40 1ivz s PHE 116 CO -0.02 -0.76 1.17 0.95 -0.10 0.00 0.00 175.22 176.46 1ivz s THR 117 N 2.82 4.40 0.10 0.64 -4.23 -1.26 0.77 115.64 118.88 1ivz s THR 117 Ca 0.09 1.66 0.02 0.00 -1.18 0.00 0.00 61.69 62.28 1ivz s THR 117 Cb -0.14 -4.21 -0.04 0.00 1.34 0.00 0.00 72.50 69.45 1ivz s THR 117 CO -0.19 -0.30 -0.07 -1.48 -0.54 0.00 0.00 174.62 172.03 1ivz s LEU 118 N 3.66 2.51 0.32 4.79 0.05 0.65 -0.53 118.68 130.13 1ivz s LEU 118 Ca 0.50 -1.00 -0.25 0.00 0.05 0.00 0.00 54.13 53.43 1ivz s LEU 118 Cb -0.17 -0.11 -0.10 0.00 -2.05 0.00 0.00 46.19 43.76 1ivz s LEU 118 CO 0.14 -0.44 0.93 -0.62 -0.55 0.00 0.00 176.35 175.82 1ivz s ASP 119 N -3.02 7.30 -0.07 1.48 -1.08 -1.20 -3.29 116.67 116.79 1ivz s ASP 119 Ca 0.12 1.81 -0.25 0.00 -0.52 0.00 0.00 52.55 53.71 1ivz s ASP 119 Cb 0.05 -2.57 -0.26 0.00 -1.46 0.00 0.00 42.92 38.67 1ivz s ASP 119 CO -0.04 -0.08 0.93 -0.09 0.52 0.00 0.00 175.17 176.41 1ivz h ARG 120 N 3.11 0.17 -0.37 4.34 1.12 -0.08 -3.26 114.38 119.42 1ivz h ARG 120 Ca -0.47 -0.23 0.03 0.00 -1.11 0.00 0.00 59.98 58.20 1ivz h ARG 120 Cb 1.19 0.08 -0.02 0.00 -0.01 0.00 0.00 29.97 31.21 1ivz h ARG 120 CO 0.65 1.03 0.25 0.87 -3.11 0.00 0.00 179.97 179.65 1ivz h LYS 121 N -0.58 0.36 -0.31 0.20 1.57 -1.94 -0.99 116.57 114.89 1ivz h LYS 121 Ca -0.05 -0.02 -0.04 0.00 -1.87 0.00 0.00 60.65 58.66 1ivz h LYS 121 Cb 1.18 -0.08 -0.02 0.00 0.08 0.00 0.00 32.23 33.39 1ivz h LYS 121 CO 0.07 0.24 0.01 1.03 -0.57 0.00 0.00 179.45 180.22 1ivz h SER 122 N 0.37 0.43 -4.08 0.86 0.87 -1.92 -3.44 113.55 106.65 1ivz h SER 122 Ca 0.15 -0.07 -0.56 0.00 -1.23 0.00 0.00 61.79 60.08 1ivz h SER 122 Cb 0.13 -0.11 0.16 0.00 -0.44 0.00 0.00 62.40 62.14 1ivz h SER 122 CO -0.03 0.49 0.49 0.52 -0.53 0.00 0.00 176.83 177.76 1ivz n VAL 123 N -4.31 4.82 -3.65 2.23 0.31 -0.38 -4.28 118.33 113.09 1ivz n VAL 123 Ca 0.01 -0.49 -0.01 0.00 -0.01 0.00 0.00 64.34 63.84 1ivz n VAL 123 Cb 0.22 -1.47 -0.06 0.00 -0.91 0.00 0.00 33.84 31.62 1ivz n VAL 123 CO 0.00 0.00 0.00 0.12 -1.32 0.00 0.00 176.83 175.63 1ivz s PHE 124 N -1.41 -0.30 -0.14 3.52 2.19 0.18 -4.92 117.98 117.09 1ivz s PHE 124 Ca 0.82 0.63 -0.01 0.00 0.33 0.00 0.00 56.93 58.71 1ivz s PHE 124 Cb -0.38 0.24 0.03 0.00 -1.31 0.00 0.00 43.02 41.60 1ivz s PHE 124 CO 0.41 -0.15 -0.06 0.54 1.83 0.00 0.00 175.22 177.79 1ivz s VAL 125 N 0.99 1.05 0.42 3.12 0.11 -1.26 -1.62 120.40 123.21 1ivz s VAL 125 Ca -0.06 -0.46 0.07 0.00 -2.93 0.00 0.00 61.98 58.61 1ivz s VAL 125 Cb -0.03 -1.16 -0.02 0.00 -1.53 0.00 0.00 36.38 33.63 1ivz s VAL 125 CO -0.12 0.23 0.33 -0.62 -3.33 0.00 0.00 175.10 171.59 1ivz s ASP 126 N 1.68 4.86 -0.62 3.54 2.15 -1.00 -4.77 116.67 122.50 1ivz s ASP 126 Ca 0.03 -0.86 -0.27 0.00 0.43 0.00 0.00 52.55 51.87 1ivz s ASP 126 Cb -0.14 -0.48 0.00 0.00 -0.30 0.00 0.00 42.92 42.00 1ivz s ASP 126 CO -0.08 -0.66 1.59 -0.44 -0.17 0.00 0.00 175.17 175.41 1ivz s SER 127 N -4.09 5.75 0.63 -0.34 0.01 -1.26 -0.76 113.70 113.64 1ivz s SER 127 Ca 0.46 0.15 0.00 0.00 1.31 0.00 0.00 55.95 57.86 1ivz s SER 127 Cb -0.01 -2.54 0.00 0.00 0.21 0.00 0.00 66.02 63.68 1ivz s SER 127 CO 0.26 -2.04 0.00 0.61 0.41 0.00 0.00 173.24 172.48 1ivz n GLY 128 N 5.49 -3.56 0.35 3.44 0.00 0.29 -4.76 105.19 106.43 1ivz n GLY 128 Ca 0.14 -0.96 -0.13 0.00 0.00 0.00 0.00 46.02 45.06 1ivz n GLY 128 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1ivz h PRO 129 N -1.03 -0.82 -4.90 1.61 0.11 -1.87 -3.39 132.00 121.72 1ivz h PRO 129 Ca -0.15 0.06 0.00 0.00 0.11 0.00 0.00 66.00 66.01 1ivz h PRO 129 Cb 1.29 0.19 0.00 0.00 0.11 0.00 0.00 31.00 32.59 1ivz h PRO 129 CO 0.06 -0.54 -0.85 0.43 -0.21 0.00 0.00 178.00 176.88 1ivz n SER 130 N -5.29 -7.37 -4.67 -2.05 7.64 -1.26 -5.03 113.62 95.59 1ivz n SER 130 Ca -0.11 1.23 -0.32 0.00 1.01 0.00 0.00 58.87 60.68 1ivz n SER 130 Cb 0.33 -4.87 -0.09 0.00 -1.01 0.00 0.00 64.21 58.57 1ivz n SER 130 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 1ivz s SER 131 N -1.52 5.01 0.00 6.43 0.15 -1.26 -5.24 113.70 117.27 1ivz s SER 131 Ca 0.02 -0.06 0.00 0.00 0.70 0.00 0.00 55.95 56.60 1ivz s SER 131 Cb -0.00 -1.27 0.00 0.00 -1.71 0.00 0.00 66.02 63.04 1ivz s SER 131 CO 0.70 0.26 0.00 0.61 1.20 0.00 0.00 173.24 176.01