#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 0.00 0.01 1.61 2.88 -1.26 -3.26 113.62 113.60 1ivz n SER 2 Ca 0.00 0.00 -0.01 0.00 -1.33 0.00 0.00 58.87 57.53 1ivz n SER 2 Cb 0.00 0.00 -0.00 0.00 -0.75 0.00 0.00 64.21 63.46 1ivz n SER 2 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 1ivz n SER 3 N 1.63 0.56 0.00 -3.46 2.88 -1.26 -5.10 113.62 108.87 1ivz n SER 3 Ca 0.00 0.08 0.00 0.00 -1.33 0.00 0.00 58.87 57.62 1ivz n SER 3 Cb 0.00 -0.25 0.00 0.00 -0.75 0.00 0.00 64.21 63.21 1ivz n SER 3 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1ivz n GLY 4 N 3.05 0.93 5.15 0.46 0.00 -1.20 -4.99 105.19 108.59 1ivz n GLY 4 Ca -0.01 -0.88 0.00 0.00 0.00 0.00 0.00 46.02 45.13 1ivz n GLY 4 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1ivz n SER 5 N 0.00 0.00 -3.78 1.61 7.64 -1.26 -4.74 113.62 113.09 1ivz n SER 5 Ca 0.00 0.00 -0.30 0.00 1.01 0.00 0.00 58.87 59.58 1ivz n SER 5 Cb 0.00 0.00 0.25 0.00 -1.01 0.00 0.00 64.21 63.45 1ivz n SER 5 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 1ivz s SER 6 N -3.88 0.35 -0.43 6.43 0.01 -1.26 -5.04 113.70 109.88 1ivz s SER 6 Ca 0.00 0.78 0.08 0.00 1.31 0.00 0.00 55.95 58.11 1ivz s SER 6 Cb 0.00 -1.11 0.33 0.00 0.21 0.00 0.00 66.02 65.45 1ivz s SER 6 CO 0.00 -4.49 1.00 0.61 0.41 0.00 0.00 173.24 170.77 1ivz n GLY 7 N -0.12 1.56 0.12 3.44 0.00 -1.26 -4.95 105.19 103.99 1ivz n GLY 7 Ca 0.12 -0.53 -0.22 0.00 0.00 0.00 0.00 46.02 45.39 1ivz n GLY 7 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1ivz n SER 8 N 0.33 1.99 -2.32 1.61 7.64 -1.26 -4.53 113.62 117.08 1ivz n SER 8 Ca 0.12 0.29 -0.21 0.00 1.01 0.00 0.00 58.87 60.07 1ivz n SER 8 Cb 0.69 -0.87 0.02 0.00 -1.01 0.00 0.00 64.21 63.03 1ivz n SER 8 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 1ivz n SER 9 N -3.93 4.19 -3.65 6.43 7.64 -1.26 -4.97 113.62 118.07 1ivz n SER 9 Ca -0.35 -3.46 -0.28 0.00 1.01 0.00 0.00 58.87 55.79 1ivz n SER 9 Cb 0.88 -0.41 -0.16 0.00 -1.01 0.00 0.00 64.21 63.51 1ivz n SER 9 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 1ivz s SER 10 N -3.56 3.17 0.42 6.43 0.01 -1.26 -5.06 113.70 113.85 1ivz s SER 10 Ca 0.45 -1.06 0.00 0.00 1.31 0.00 0.00 55.95 56.65 1ivz s SER 10 Cb 0.40 -0.50 0.00 0.00 0.21 0.00 0.00 66.02 66.13 1ivz s SER 10 CO -0.05 -0.37 0.00 -1.20 0.41 0.00 0.00 173.24 172.03 1ivz n SER 11 N 5.12 -8.04 -4.12 2.44 7.64 -1.26 -4.88 113.62 110.53 1ivz n SER 11 Ca -0.06 0.86 -0.13 0.00 1.01 0.00 0.00 58.87 60.54 1ivz n SER 11 Cb 0.45 -4.27 -0.11 0.00 -1.01 0.00 0.00 64.21 59.27 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 -2.93 0.68 -0.27 1.43 0.00 -1.26 -4.95 119.66 112.35 1ivz s GLN 12 Ca 0.00 -0.99 0.02 0.00 -0.00 0.00 0.00 55.36 54.39 1ivz s GLN 12 Cb 0.00 -0.35 0.08 0.00 0.00 0.00 0.00 33.01 32.74 1ivz s GLN 12 CO 0.00 0.05 -0.01 -1.01 0.00 0.00 0.00 175.29 174.32 1ivz s HIS 13 N -2.13 2.73 -0.46 9.60 3.76 -1.26 -2.54 115.29 124.98 1ivz s HIS 13 Ca -0.01 -2.13 -0.18 0.00 -0.15 0.00 0.00 55.06 52.59 1ivz s HIS 13 Cb -0.05 -1.97 0.04 0.00 1.11 0.00 0.00 32.58 31.71 1ivz s HIS 13 CO -0.01 -0.85 0.54 -0.06 -0.85 0.00 0.00 174.74 173.51 1ivz s PHE 14 N 1.27 3.11 -0.25 1.40 0.08 -1.03 0.13 117.98 122.70 1ivz s PHE 14 Ca 0.00 -0.44 -0.33 0.00 0.12 0.00 0.00 56.93 56.28 1ivz s PHE 14 Cb -0.19 -3.24 -0.10 0.00 -0.57 0.00 0.00 43.02 38.92 1ivz s PHE 14 CO -0.09 -0.87 2.12 -1.71 -0.10 0.00 0.00 175.22 174.57 1ivz n ASN 15 N 5.89 2.75 -4.69 1.36 2.85 -0.55 0.11 115.26 122.97 1ivz n ASN 15 Ca -0.07 0.50 -0.36 0.00 -0.11 0.00 0.00 54.58 54.54 1ivz n ASN 15 Cb 0.46 -1.36 -0.08 0.00 1.24 0.00 0.00 39.78 40.04 1ivz n ASN 15 CO 0.00 0.00 0.00 -0.22 -2.11 0.00 0.00 177.26 174.93 1ivz s LEU 16 N 6.75 4.17 -0.10 1.20 2.96 0.38 -2.83 118.68 131.22 1ivz s LEU 16 Ca 1.03 0.26 -0.08 0.00 -0.22 0.00 0.00 54.13 55.13 1ivz s LEU 16 Cb -0.68 -2.19 0.03 0.00 0.50 0.00 0.00 46.19 43.84 1ivz s LEU 16 CO 0.46 0.09 0.25 0.20 -1.32 0.00 0.00 176.35 176.03 1ivz s ASN 17 N 0.74 -0.26 -0.29 3.68 0.01 -1.02 0.11 114.94 117.90 1ivz s ASN 17 Ca 0.11 0.51 -0.16 0.00 -0.71 0.00 0.00 52.86 52.61 1ivz s ASN 17 Cb -0.13 0.49 0.15 0.00 0.41 0.00 0.00 41.25 42.17 1ivz s ASN 17 CO 0.03 -0.11 0.98 0.72 -1.51 0.00 0.00 177.10 177.21 1ivz s PHE 18 N 0.41 -0.61 0.10 2.20 -0.71 -1.11 -0.61 117.98 117.66 1ivz s PHE 18 Ca -0.02 1.15 -0.31 0.00 -1.04 0.00 0.00 56.93 56.71 1ivz s PHE 18 Cb -0.04 0.36 -0.07 0.00 -1.21 0.00 0.00 43.02 42.06 1ivz s PHE 18 CO -0.02 -0.30 1.31 0.99 -1.34 0.00 0.00 175.22 175.86 1ivz s THR 19 N 1.72 3.58 -0.44 -4.49 2.01 -1.26 -2.57 115.64 114.19 1ivz s THR 19 Ca -0.07 1.15 -0.08 0.00 0.31 0.00 0.00 61.69 63.00 1ivz s THR 19 Cb -0.04 -3.74 0.10 0.00 0.01 0.00 0.00 72.50 68.83 1ivz s THR 19 CO -0.16 0.10 0.28 -0.63 -0.69 0.00 0.00 174.62 173.53 1ivz s ILE 20 N 0.97 4.07 0.57 1.82 1.01 -0.87 -1.98 121.20 126.79 1ivz s ILE 20 Ca 0.61 -1.66 0.32 0.00 0.00 0.00 0.00 60.65 59.93 1ivz s ILE 20 Cb -0.34 -3.61 0.36 0.00 0.01 0.00 0.00 42.46 38.89 1ivz s ILE 20 CO 0.31 -0.64 2.25 0.71 0.00 0.00 0.00 174.94 177.57 1ivz h THR 21 N 6.15 0.43 -0.88 2.92 1.35 -1.79 -3.00 112.91 118.09 1ivz h THR 21 Ca -0.21 -0.09 -0.54 0.00 -0.55 0.00 0.00 66.41 65.03 1ivz h THR 21 Cb 1.07 1.06 -0.13 0.00 -1.73 0.00 0.00 68.15 68.42 1ivz h THR 21 CO 0.79 0.02 1.12 -3.20 -0.25 0.00 0.00 175.52 174.00 1ivz n ASN 22 N -3.66 6.93 -3.03 5.36 5.15 0.39 -4.63 115.26 121.76 1ivz n ASN 22 Ca -0.03 -3.05 0.04 0.00 -0.60 0.00 0.00 54.58 50.95 1ivz n ASN 22 Cb 0.10 -1.32 0.00 0.00 -0.53 0.00 0.00 39.78 38.04 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 -1.71 -0.59 0.10 1.20 1.98 -1.14 -4.69 118.68 113.83 1ivz s LEU 23 Ca 0.59 -0.07 -0.31 0.00 -2.89 0.00 0.00 54.13 51.45 1ivz s LEU 23 Cb 0.30 1.13 -0.08 0.00 0.66 0.00 0.00 46.19 48.20 1ivz s LEU 23 CO -0.14 -0.09 1.41 -2.16 -1.89 0.00 0.00 176.35 173.48 1ivz s PRO 24 N 2.55 4.30 -0.28 0.98 0.04 -1.25 -3.73 135.00 137.60 1ivz s PRO 24 Ca 0.21 2.09 -0.29 0.00 0.04 0.00 0.00 61.00 63.05 1ivz s PRO 24 Cb -0.01 -3.30 0.01 0.00 0.04 0.00 0.00 34.50 31.24 1ivz s PRO 24 CO -0.19 -0.48 1.05 -0.47 0.04 0.00 0.00 177.00 176.95 1ivz s TYR 25 N 1.35 3.23 0.41 0.56 5.04 -1.22 -4.97 117.35 121.75 1ivz s TYR 25 Ca 0.65 1.30 0.03 0.00 -2.44 0.00 0.00 57.07 56.62 1ivz s TYR 25 Cb -0.37 -3.50 -0.03 0.00 0.35 0.00 0.00 41.96 38.41 1ivz s TYR 25 CO 0.30 -0.64 0.10 -1.12 -1.34 0.00 0.00 175.55 172.85 1ivz s SER 26 N 1.46 2.93 0.49 4.32 0.01 -1.26 -4.95 113.70 116.70 1ivz s SER 26 Ca 0.45 -1.62 0.14 0.00 1.31 0.00 0.00 55.95 56.22 1ivz s SER 26 Cb -0.13 0.41 1.16 0.00 0.21 0.00 0.00 66.02 67.67 1ivz s SER 26 CO 0.11 -0.87 2.12 1.56 0.41 0.00 0.00 173.24 176.58 1ivz h GLN 27 N 1.77 0.13 -0.01 12.44 4.20 -1.95 -2.48 115.11 129.22 1ivz h GLN 27 Ca -0.37 -0.01 -0.00 0.00 0.06 0.00 0.00 58.65 58.33 1ivz h GLN 27 Cb 1.27 -0.03 -0.00 0.00 0.30 0.00 0.00 27.48 29.02 1ivz h GLN 27 CO 0.61 0.09 0.00 -0.44 -0.67 0.00 0.00 178.83 178.43 1ivz h ASP 28 N 0.14 0.01 0.44 1.46 5.19 -1.96 -2.07 116.42 119.62 1ivz h ASP 28 Ca 0.04 -0.04 -0.01 0.00 -0.62 0.00 0.00 57.03 56.40 1ivz h ASP 28 Cb -0.01 -0.00 -0.00 0.00 0.18 0.00 0.00 39.33 39.50 1ivz h ASP 28 CO -0.01 0.04 -0.05 0.40 -3.12 0.00 0.00 179.24 176.51 1ivz h ILE 29 N -0.03 0.22 -0.86 0.35 1.08 -1.76 -2.18 117.51 114.34 1ivz h ILE 29 Ca 0.00 -0.35 -0.46 0.00 -0.39 0.00 0.00 64.86 63.66 1ivz h ILE 29 Cb 0.04 1.28 -0.26 0.00 -3.07 0.00 0.00 36.82 34.80 1ivz h ILE 29 CO -0.00 0.04 0.59 0.00 -0.69 0.00 0.00 178.15 178.09 1ivz n ALA 30 N -2.16 5.26 -3.15 1.87 0.00 -0.79 -4.73 120.51 116.82 1ivz n ALA 30 Ca -0.01 -2.54 0.04 0.00 0.00 0.00 0.00 53.44 50.93 1ivz n ALA 30 Cb 0.20 -1.42 -0.00 0.00 0.00 0.00 0.00 19.45 18.23 1ivz n ALA 30 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 1ivz s GLN 31 N -2.88 0.45 0.60 0.00 -1.52 -0.82 -5.00 119.66 110.49 1ivz s GLN 31 Ca 0.50 0.45 0.28 0.00 -1.95 0.00 0.00 55.36 54.64 1ivz s GLN 31 Cb 0.41 0.21 1.39 0.00 -0.22 0.00 0.00 33.01 34.80 1ivz s GLN 31 CO 0.08 -0.84 1.79 -1.35 -0.25 0.00 0.00 175.29 174.73 1ivz h PRO 32 N 7.81 0.00 -0.30 2.91 0.11 -1.85 0.88 132.00 141.56 1ivz h PRO 32 Ca -0.04 0.00 0.09 0.00 0.11 0.00 0.00 66.00 66.16 1ivz h PRO 32 Cb 1.19 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.28 1ivz h PRO 32 CO 0.09 0.00 0.23 1.03 -0.21 0.00 0.00 178.00 179.14 1ivz h SER 33 N 0.00 0.00 -3.96 -2.05 0.87 -1.95 -3.42 113.55 103.03 1ivz h SER 33 Ca 0.23 0.00 -0.48 0.00 -1.23 0.00 0.00 61.79 60.31 1ivz h SER 33 Cb 1.41 0.00 0.07 0.00 -0.44 0.00 0.00 62.40 63.44 1ivz h SER 33 CO -0.00 0.00 0.27 0.42 -0.53 0.00 0.00 176.83 176.98 1ivz s THR 34 N -4.95 3.45 0.07 2.23 -4.23 0.30 -5.00 115.64 107.51 1ivz s THR 34 Ca -0.05 0.14 0.08 0.00 -1.18 0.00 0.00 61.69 60.68 1ivz s THR 34 Cb 0.18 -3.41 -0.22 0.00 1.34 0.00 0.00 72.50 70.39 1ivz s THR 34 CO 0.67 -0.47 1.09 0.74 -0.54 0.00 0.00 174.62 176.11 1ivz h THR 35 N -0.39 1.45 -0.28 3.99 2.02 -1.86 -3.29 112.91 114.55 1ivz h THR 35 Ca -0.45 -3.20 0.08 0.00 0.77 0.00 0.00 66.41 63.61 1ivz h THR 35 Cb 1.26 2.72 -0.01 0.00 -1.74 0.00 0.00 68.15 70.38 1ivz h THR 35 CO 0.62 0.83 0.22 0.50 0.37 0.00 0.00 175.52 178.06 1ivz h LYS 36 N 0.00 0.00 0.22 6.66 3.64 -1.92 0.25 116.57 125.43 1ivz h LYS 36 Ca -0.10 0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.27 1ivz h LYS 36 Cb 1.85 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.67 1ivz h LYS 36 CO 0.12 0.00 -0.11 -0.92 -2.27 0.00 0.00 179.45 176.27 1ivz h TYR 37 N 0.00 -0.28 -0.02 1.91 3.20 -1.71 -2.66 116.97 117.41 1ivz h TYR 37 Ca 0.13 -0.01 -0.13 0.00 3.14 0.00 0.00 58.73 61.87 1ivz h TYR 37 Cb 0.58 0.09 -0.02 0.00 1.54 0.00 0.00 36.73 38.93 1ivz h TYR 37 CO 0.00 0.07 -0.57 1.96 -1.64 0.00 0.00 178.16 177.98 1ivz h GLN 38 N -0.68 0.06 0.43 1.82 4.20 -1.57 -2.54 115.11 116.82 1ivz h GLN 38 Ca -0.03 -0.04 -0.02 0.00 0.06 0.00 0.00 58.65 58.62 1ivz h GLN 38 Cb 0.48 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.26 1ivz h GLN 38 CO 0.05 0.62 -0.23 1.96 -0.67 0.00 0.00 178.83 180.56 1ivz h GLN 39 N 0.04 -0.58 -0.09 1.46 4.20 -0.53 0.21 115.11 119.83 1ivz h GLN 39 Ca -0.00 0.04 0.01 0.00 0.06 0.00 0.00 58.65 58.75 1ivz h GLN 39 Cb 1.03 0.13 -0.00 0.00 0.30 0.00 0.00 27.48 28.94 1ivz h GLN 39 CO 0.08 -0.39 0.06 1.15 -0.67 0.00 0.00 178.83 179.06 1ivz h THR 40 N -0.60 1.00 0.78 -0.54 2.02 -1.57 -1.12 112.91 112.89 1ivz h THR 40 Ca -0.06 -0.03 -0.04 0.00 0.77 0.00 0.00 66.41 67.05 1ivz h THR 40 Cb 0.47 0.91 0.01 0.00 -1.74 0.00 0.00 68.15 67.80 1ivz h THR 40 CO 0.08 0.02 -0.38 0.50 0.37 0.00 0.00 175.52 176.11 1ivz h LYS 41 N 0.09 -1.02 -0.12 6.66 3.64 -1.26 -2.52 116.57 122.05 1ivz h LYS 41 Ca 0.04 0.07 -0.01 0.00 -1.27 0.00 0.00 60.65 59.47 1ivz h LYS 41 Cb 0.04 0.23 -0.01 0.00 -0.41 0.00 0.00 32.23 32.08 1ivz h LYS 41 CO -0.01 -0.67 0.02 -0.09 -2.27 0.00 0.00 179.45 176.43 1ivz h ARG 42 N -1.26 0.16 -0.75 1.90 9.65 -0.77 -1.92 114.38 121.40 1ivz h ARG 42 Ca -0.11 -0.02 -0.00 0.00 -1.10 0.00 0.00 59.98 58.75 1ivz h ARG 42 Cb 0.81 -0.03 -0.04 0.00 -1.39 0.00 0.00 29.97 29.33 1ivz h ARG 42 CO 0.18 0.16 0.45 1.03 2.80 0.00 0.00 179.97 184.60 1ivz h SER 43 N 0.16 0.90 -0.02 -3.80 0.87 -1.12 0.11 113.55 110.66 1ivz h SER 43 Ca 0.04 -0.06 -0.04 0.00 -1.23 0.00 0.00 61.79 60.51 1ivz h SER 43 Cb 0.08 -0.23 0.00 0.00 -0.44 0.00 0.00 62.40 61.82 1ivz h SER 43 CO -0.00 0.69 -0.13 0.40 -0.53 0.00 0.00 176.83 177.27 1ivz h ILE 44 N 1.02 1.52 -0.98 2.23 2.04 -0.96 -2.17 117.51 120.20 1ivz h ILE 44 Ca 0.27 -1.71 0.05 0.00 1.00 0.00 0.00 64.86 64.47 1ivz h ILE 44 Cb -0.04 2.60 -0.06 0.00 -0.74 0.00 0.00 36.82 38.57 1ivz h ILE 44 CO -0.05 0.46 0.64 -0.33 0.00 0.00 0.00 178.15 178.87 1ivz h GLU 45 N -0.52 1.17 -0.11 2.37 5.08 -1.29 0.37 114.58 121.66 1ivz h GLU 45 Ca -0.01 -0.07 -0.03 0.00 -1.00 0.00 0.00 59.36 58.25 1ivz h GLU 45 Cb 0.82 -0.26 -0.00 0.00 0.50 0.00 0.00 28.75 29.80 1ivz h GLU 45 CO 0.03 0.78 -0.05 -0.97 -1.00 0.00 0.00 179.01 177.79 1ivz h ASN 46 N 1.21 0.23 -0.57 1.42 -1.24 -0.83 -0.53 115.58 115.27 1ivz h ASN 46 Ca 0.40 -0.40 -0.08 0.00 0.71 0.00 0.00 56.30 56.93 1ivz h ASN 46 Cb 0.06 -0.06 -0.02 0.00 0.73 0.00 0.00 38.32 39.02 1ivz h ASN 46 CO -0.14 0.58 0.06 0.00 -1.29 0.00 0.00 177.43 176.64 1ivz h ALA 47 N 0.66 0.97 -0.03 1.57 0.00 -1.02 -2.71 119.26 118.70 1ivz h ALA 47 Ca 0.03 -0.27 -0.12 0.00 0.00 0.00 0.00 54.91 54.54 1ivz h ALA 47 Cb 0.49 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 18.04 1ivz h ALA 47 CO 0.01 0.64 -0.54 -0.07 0.00 0.00 0.00 179.25 179.29 1ivz h LEU 48 N 0.93 0.08 0.53 0.00 3.38 -0.24 -2.74 115.31 117.25 1ivz h LEU 48 Ca 0.18 -0.04 -0.02 0.00 0.09 0.00 0.00 57.88 58.09 1ivz h LEU 48 Cb 0.46 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.19 1ivz h LEU 48 CO 0.02 0.61 -0.30 -1.13 0.09 0.00 0.00 178.44 177.73 1ivz h ASN 49 N 0.06 -0.73 -0.05 -0.43 -0.73 -0.76 -2.52 115.58 110.42 1ivz h ASN 49 Ca -0.00 0.03 0.01 0.00 1.87 0.00 0.00 56.30 58.22 1ivz h ASN 49 Cb 0.97 0.20 -0.00 0.00 0.27 0.00 0.00 38.32 39.77 1ivz h ASN 49 CO 0.07 -0.47 0.04 0.06 -0.37 0.00 0.00 177.43 176.76 1ivz h GLN 50 N -0.76 0.00 0.20 6.67 3.07 -1.62 -2.62 115.11 120.05 1ivz h GLN 50 Ca -0.07 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.67 1ivz h GLN 50 Cb 0.60 0.00 -0.01 0.00 0.08 0.00 0.00 27.48 28.15 1ivz h GLN 50 CO 0.09 0.00 -0.18 1.25 0.09 0.00 0.00 178.83 180.09 1ivz h LEU 51 N 0.00 -0.46 -0.74 0.06 6.46 -1.17 -0.99 115.31 118.46 1ivz h LEU 51 Ca 0.02 0.04 0.01 0.00 -0.12 0.00 0.00 57.88 57.84 1ivz h LEU 51 Cb 0.10 0.16 -0.04 0.00 -0.73 0.00 0.00 40.66 40.15 1ivz h LEU 51 CO -0.00 -0.27 0.48 -0.26 -0.62 0.00 0.00 178.44 177.78 1ivz h PHE 52 N -0.40 0.92 0.00 1.25 0.04 -1.08 0.80 116.94 118.47 1ivz h PHE 52 Ca -0.00 0.02 0.00 0.00 2.80 0.00 0.00 57.97 60.79 1ivz h PHE 52 Cb 0.36 -0.31 0.00 0.00 2.20 0.00 0.00 35.95 38.21 1ivz h PHE 52 CO -0.13 0.56 0.00 0.00 -0.60 0.00 0.00 178.31 178.14 1ivz h ARG 53 N 0.98 0.00 0.00 1.51 3.08 -1.36 -2.84 114.38 115.75 1ivz h ARG 53 Ca 0.28 0.00 -0.24 0.00 0.07 0.00 0.00 59.98 60.09 1ivz h ARG 53 Cb -0.09 0.00 -0.05 0.00 0.08 0.00 0.00 29.97 29.92 1ivz h ARG 53 CO -0.07 0.00 -1.98 0.09 -1.07 0.00 0.00 179.97 176.94 1ivz n ASN 54 N -2.36 1.35 -3.22 7.04 3.02 -0.35 -4.73 115.26 116.01 1ivz n ASN 54 Ca 0.01 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.56 1ivz n ASN 54 Cb 0.18 0.96 0.00 0.00 -0.61 0.00 0.00 39.78 40.31 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 -2.49 -1.30 -1.97 6.41 3.41 0.26 -4.86 113.62 113.08 1ivz n SER 55 Ca -0.22 0.00 -0.16 0.00 -0.26 0.00 0.00 58.87 58.23 1ivz n SER 55 Cb 0.92 0.00 0.18 0.00 -0.26 0.00 0.00 64.21 65.05 1ivz n SER 55 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 1ivz n SER 56 N -1.96 3.82 -2.69 4.04 2.88 -1.26 -4.26 113.62 114.20 1ivz n SER 56 Ca 0.00 -3.25 -0.07 0.00 -1.33 0.00 0.00 58.87 54.21 1ivz n SER 56 Cb 0.00 -0.76 0.09 0.00 -0.75 0.00 0.00 64.21 62.78 1ivz n SER 56 CO 0.00 0.00 0.00 2.30 -1.23 0.00 0.00 175.04 176.11 1ivz n ILE 57 N -0.66 0.41 -0.78 2.46 -5.35 -1.26 -4.95 119.36 109.22 1ivz n ILE 57 Ca 0.46 -2.09 -0.20 0.00 -0.27 0.00 0.00 62.75 60.65 1ivz n ILE 57 Cb 1.42 0.89 0.10 0.00 -1.74 0.00 0.00 39.64 40.30 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 -0.45 2.01 -0.01 6.28 0.00 -1.21 -3.18 118.16 121.60 1ivz n LYS 58 Ca 0.01 -2.20 -0.01 0.00 -0.00 0.00 0.00 58.31 56.11 1ivz n LYS 58 Cb 0.84 -1.86 -0.01 0.00 -0.00 0.00 0.00 35.03 34.00 1ivz n LYS 58 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.40 177.85 1ivz n SER 59 N -0.48 3.93 -0.09 -5.58 2.88 -1.26 -4.82 113.62 108.20 1ivz n SER 59 Ca 0.43 -0.01 -0.10 0.00 -1.33 0.00 0.00 58.87 57.86 1ivz n SER 59 Cb 1.04 0.00 -0.12 0.00 -0.75 0.00 0.00 64.21 64.38 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 -2.52 0.00 -1.73 0.66 4.01 -1.26 -4.97 117.16 111.35 1ivz n TYR 60 Ca -0.02 0.00 -0.42 0.00 -0.16 0.00 0.00 57.90 57.30 1ivz n TYR 60 Cb 0.53 -0.80 -0.03 0.00 -0.31 0.00 0.00 39.34 38.73 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 -2.40 2.85 -0.16 -0.72 2.19 -1.19 -1.70 117.98 116.85 1ivz s PHE 61 Ca -0.14 0.44 -0.17 0.00 0.33 0.00 0.00 56.93 57.39 1ivz s PHE 61 Cb 0.06 -4.13 -0.06 0.00 -1.31 0.00 0.00 43.02 37.58 1ivz s PHE 61 CO 0.61 -4.18 -0.32 0.45 1.83 0.00 0.00 175.22 173.60 1ivz n SER 62 N 3.51 1.80 -3.05 6.13 2.88 -1.22 -4.83 113.62 118.83 1ivz n SER 62 Ca 0.14 0.31 0.02 0.00 -1.33 0.00 0.00 58.87 58.01 1ivz n SER 62 Cb 0.36 -0.72 0.01 0.00 -0.75 0.00 0.00 64.21 63.11 1ivz n SER 62 CO 0.00 0.00 0.00 -0.90 -1.23 0.00 0.00 175.04 172.91 1ivz n ASP 63 N -4.32 -0.84 -4.49 -3.46 5.68 -1.19 -5.03 116.55 102.90 1ivz n ASP 63 Ca -0.13 -1.16 -0.29 0.00 -0.50 0.00 0.00 54.79 52.72 1ivz n ASP 63 Cb 0.48 1.30 -0.11 0.00 -1.14 0.00 0.00 41.12 41.65 1ivz n ASP 63 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1ivz s GLN 65 N -2.25 1.45 -0.19 0.00 0.74 0.06 -4.90 119.66 114.57 1ivz s GLN 65 Ca 0.19 -1.75 -0.29 0.00 0.05 0.00 0.00 55.36 53.55 1ivz s GLN 65 Cb -0.10 -3.06 -0.03 0.00 1.10 0.00 0.00 33.01 30.92 1ivz s GLN 65 CO 0.10 -0.92 1.59 0.54 -0.55 0.00 0.00 175.29 176.06 1ivz s VAL 66 N 0.99 3.72 -0.04 1.34 0.11 -1.26 -1.04 120.40 124.22 1ivz s VAL 66 Ca 0.09 0.83 -0.00 0.00 -2.93 0.00 0.00 61.98 59.98 1ivz s VAL 66 Cb -0.19 -3.69 -0.00 0.00 -1.53 0.00 0.00 36.38 30.97 1ivz s VAL 66 CO -0.10 -0.25 0.01 -0.07 -3.33 0.00 0.00 175.10 171.37 1ivz h LEU 67 N 11.30 -0.00 0.00 2.54 3.38 -0.84 -3.48 115.31 128.20 1ivz h LEU 67 Ca -0.34 0.00 0.01 0.00 0.09 0.00 0.00 57.88 57.64 1ivz h LEU 67 Cb 1.15 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.90 1ivz h LEU 67 CO 0.99 0.20 0.05 0.00 0.09 0.00 0.00 178.44 179.77 1ivz n ALA 68 N -2.32 -0.21 -2.84 1.53 0.00 -1.14 -5.05 120.51 110.48 1ivz n ALA 68 Ca -0.00 -0.08 -0.30 0.00 0.00 0.00 0.00 53.44 53.06 1ivz n ALA 68 Cb 0.00 0.05 -0.16 0.00 0.00 0.00 0.00 19.45 19.34 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 -5.85 2.21 0.27 0.00 0.08 -1.26 -1.87 117.98 111.56 1ivz s PHE 69 Ca 0.02 -0.68 0.06 0.00 0.12 0.00 0.00 56.93 56.45 1ivz s PHE 69 Cb -0.00 -1.46 -0.03 0.00 -0.57 0.00 0.00 43.02 40.96 1ivz s PHE 69 CO 0.00 -0.22 0.32 1.03 -0.10 0.00 0.00 175.22 176.25 1ivz s ARG 70 N -0.05 3.15 -0.14 0.44 1.81 0.18 -4.90 118.95 119.45 1ivz s ARG 70 Ca -0.05 -0.95 -0.04 0.00 -1.72 0.00 0.00 55.73 52.97 1ivz s ARG 70 Cb -0.13 -2.73 -0.03 0.00 -0.45 0.00 0.00 34.95 31.60 1ivz s ARG 70 CO 0.04 0.33 0.01 0.45 -0.68 0.00 0.00 175.30 175.45 1ivz s SER 71 N -3.97 5.21 0.18 0.23 0.15 -1.26 -0.55 113.70 113.70 1ivz s SER 71 Ca 0.36 0.04 0.03 0.00 0.70 0.00 0.00 55.95 57.07 1ivz s SER 71 Cb -0.08 -1.73 -0.03 0.00 -1.71 0.00 0.00 66.02 62.46 1ivz s SER 71 CO 0.28 0.25 0.32 0.68 1.20 0.00 0.00 173.24 175.97 1ivz s VAL 72 N -0.10 5.29 -0.58 4.45 -7.23 -1.26 -4.91 120.40 116.06 1ivz s VAL 72 Ca 0.04 -0.72 0.02 0.00 -1.81 0.00 0.00 61.98 59.51 1ivz s VAL 72 Cb -0.13 -3.78 0.15 0.00 0.56 0.00 0.00 36.38 33.18 1ivz s VAL 72 CO 0.02 -0.18 0.35 -0.44 -0.31 0.00 0.00 175.10 174.54 1ivz s SER 73 N -3.44 4.69 0.01 4.85 0.01 -1.26 -4.50 113.70 114.07 1ivz s SER 73 Ca 0.35 -3.02 0.00 0.00 1.31 0.00 0.00 55.95 54.59 1ivz s SER 73 Cb -0.10 -1.72 0.00 0.00 0.21 0.00 0.00 66.02 64.40 1ivz s SER 73 CO 0.29 -0.27 0.00 -3.20 0.41 0.00 0.00 173.24 170.47 1ivz n ASN 74 N 3.16 -0.13 -0.01 2.44 2.85 -1.26 -4.97 115.26 117.34 1ivz n ASN 74 Ca 0.07 0.03 0.08 0.00 -0.11 0.00 0.00 54.58 54.65 1ivz n ASN 74 Cb 0.34 0.48 -0.12 0.00 1.24 0.00 0.00 39.78 41.73 1ivz n ASN 74 CO 0.00 0.00 0.00 -3.20 -2.11 0.00 0.00 177.26 171.95 1ivz n ASN 75 N -2.28 1.42 -2.00 1.20 5.15 -1.26 -5.00 115.26 112.49 1ivz n ASN 75 Ca 0.00 -0.08 -0.17 0.00 -0.60 0.00 0.00 54.58 53.72 1ivz n ASN 75 Cb 0.00 1.63 -0.01 0.00 -0.53 0.00 0.00 39.78 40.87 1ivz n ASN 75 CO 0.00 0.00 0.00 0.59 1.40 0.00 0.00 177.26 179.25 1ivz n ASN 76 N -1.96 -5.10 -0.40 1.20 5.03 -1.26 -4.86 115.26 107.91 1ivz n ASN 76 Ca -0.02 -0.02 0.01 0.00 0.87 0.00 0.00 54.58 55.42 1ivz n ASN 76 Cb 0.38 -4.18 0.02 0.00 -1.02 0.00 0.00 39.78 34.98 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 -1.34 0.36 -3.29 6.41 4.05 -1.26 -4.57 115.26 115.62 1ivz n ASN 77 Ca -0.20 -2.09 -0.16 0.00 0.45 0.00 0.00 54.58 52.58 1ivz n ASN 77 Cb 0.65 -0.22 -0.03 0.00 1.23 0.00 0.00 39.78 41.42 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 -0.21 0.56 -3.45 1.20 8.25 -1.26 -3.96 115.22 116.36 1ivz n HIS 78 Ca 0.02 -1.23 -0.03 0.00 -0.26 0.00 0.00 57.72 56.22 1ivz n HIS 78 Cb 0.67 -0.16 -0.05 0.00 1.12 0.00 0.00 29.99 31.57 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 -1.91 -0.84 -0.49 1.59 2.01 -1.21 -3.43 115.64 111.35 1ivz s THR 79 Ca 0.00 0.02 -0.28 0.00 0.31 0.00 0.00 61.69 61.75 1ivz s THR 79 Cb 0.00 -0.89 -0.01 0.00 0.01 0.00 0.00 72.50 71.62 1ivz s THR 79 CO 0.00 -0.01 1.65 -0.83 -0.69 0.00 0.00 174.62 174.74 1ivz s GLY 80 N 2.76 0.70 0.17 4.40 0.00 0.29 -2.05 107.32 113.59 1ivz s GLY 80 Ca 0.06 -0.33 -0.30 0.00 0.00 0.00 0.00 44.72 44.16 1ivz s GLY 80 CO -0.18 3.10 1.20 0.14 0.00 0.00 0.00 173.10 177.36 1ivz s VAL 81 N 7.05 3.63 -0.59 1.40 1.01 -1.06 0.49 120.40 132.33 1ivz s VAL 81 Ca 0.66 1.35 0.06 0.00 0.00 0.00 0.00 61.98 64.04 1ivz s VAL 81 Cb -0.15 -3.86 0.21 0.00 0.00 0.00 0.00 36.38 32.58 1ivz s VAL 81 CO 0.27 0.20 0.55 0.47 0.00 0.00 0.00 175.10 176.59 1ivz n ASP 82 N 2.67 2.18 -3.94 3.32 9.92 -0.78 -2.75 116.55 127.17 1ivz n ASP 82 Ca 0.05 -3.05 -0.13 0.00 -0.53 0.00 0.00 54.79 51.13 1ivz n ASP 82 Cb 0.45 -0.68 0.05 0.00 -0.64 0.00 0.00 41.12 40.30 1ivz n ASP 82 CO 0.00 0.00 0.00 -1.54 0.13 0.00 0.00 177.20 175.79 1ivz n SER 83 N 1.70 1.37 -3.65 -2.24 3.41 0.30 -0.15 113.62 114.36 1ivz n SER 83 Ca 0.25 -2.01 -0.23 0.00 -0.26 0.00 0.00 58.87 56.63 1ivz n SER 83 Cb 0.42 -0.29 -0.18 0.00 -0.26 0.00 0.00 64.21 63.90 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 0.26 -1.22 1.04 1.98 -0.21 -0.47 118.68 120.07 1ivz s LEU 84 Ca 0.41 -0.21 -0.20 0.00 -2.89 0.00 0.00 54.13 51.24 1ivz s LEU 84 Cb -0.03 -0.20 -0.02 0.00 0.66 0.00 0.00 46.19 46.60 1ivz s LEU 84 CO 0.26 -0.29 1.88 0.00 -1.89 0.00 0.00 176.35 176.32 1ivz s ASN 86 N 5.06 6.28 0.41 0.00 0.01 -0.49 -2.46 114.94 123.75 1ivz s ASN 86 Ca 0.59 2.34 0.05 0.00 -0.71 0.00 0.00 52.86 55.13 1ivz s ASN 86 Cb 0.04 -2.61 -0.02 0.00 0.41 0.00 0.00 41.25 39.08 1ivz s ASN 86 CO 0.09 -0.84 0.18 0.49 -1.51 0.00 0.00 177.10 175.51 1ivz n PHE 87 N -0.29 -0.07 -3.16 2.20 3.01 -1.05 -3.19 117.46 114.91 1ivz n PHE 87 Ca 0.06 -2.76 -0.26 0.00 1.01 0.00 0.00 57.45 55.50 1ivz n PHE 87 Cb 0.47 0.06 -0.01 0.00 -0.01 0.00 0.00 39.48 39.99 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 -3.56 6.32 0.40 4.37 0.01 -0.69 -4.47 113.70 116.09 1ivz s SER 88 Ca 0.26 0.65 0.19 0.00 1.31 0.00 0.00 55.95 58.36 1ivz s SER 88 Cb 0.01 -2.12 0.84 0.00 0.21 0.00 0.00 66.02 64.96 1ivz s SER 88 CO 0.18 -0.36 1.82 1.55 0.41 0.00 0.00 173.24 176.84 1ivz h PRO 89 N 0.80 0.00 -0.65 12.44 0.13 -1.89 -3.02 132.00 139.81 1ivz h PRO 89 Ca -0.48 0.00 0.01 0.00 -0.87 0.00 0.00 66.00 64.66 1ivz h PRO 89 Cb 1.21 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.31 1ivz h PRO 89 CO 0.62 0.32 0.43 -0.07 -0.23 0.00 0.00 178.00 179.08 1ivz h LEU 90 N 0.00 0.73-10.67 1.56 4.07 -1.94 -3.39 115.31 105.68 1ivz h LEU 90 Ca -0.00 -0.02 -0.43 0.00 0.08 0.00 0.00 57.88 57.51 1ivz h LEU 90 Cb 0.74 -0.18 0.17 0.00 1.08 0.00 0.00 40.66 42.47 1ivz h LEU 90 CO 0.04 0.53 0.32 0.00 -1.08 0.00 0.00 178.44 178.25 1ivz s ALA 91 N -5.74 1.65 0.00 1.53 0.00 -1.14 -4.96 121.76 113.10 1ivz s ALA 91 Ca -0.10 -1.12 0.00 0.00 0.00 0.00 0.00 51.96 50.74 1ivz s ALA 91 Cb 0.18 -2.81 0.00 0.00 0.00 0.00 0.00 23.12 20.48 1ivz s ALA 91 CO 0.77 -2.86 0.00 -2.13 0.00 0.00 0.00 175.76 171.54 1ivz n ARG 92 N -4.13 0.00 -1.52 0.00 0.63 -1.26 -4.77 116.66 105.61 1ivz n ARG 92 Ca 0.15 0.00 -0.28 0.00 -0.92 0.00 0.00 57.85 56.80 1ivz n ARG 92 Cb 0.59 0.00 -0.05 0.00 0.45 0.00 0.00 32.46 33.45 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 -0.49 2.46 -3.53 -0.14 3.00 -1.26 -4.85 116.66 111.85 1ivz n ARG 93 Ca 0.00 -2.41 -0.41 0.00 -0.01 0.00 0.00 57.85 55.01 1ivz n ARG 93 Cb 0.00 -2.16 -0.07 0.00 0.00 0.00 0.00 32.46 30.23 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 -2.34 4.45 1.09 1.55 1.01 -1.26 -5.08 120.40 119.82 1ivz s VAL 94 Ca 0.59 -2.17 -0.12 0.00 0.00 0.00 0.00 61.98 60.28 1ivz s VAL 94 Cb 0.38 -3.88 0.24 0.00 0.00 0.00 0.00 36.38 33.13 1ivz s VAL 94 CO -0.23 -0.86 1.07 -1.81 0.00 0.00 0.00 175.10 173.27 1ivz s ASP 95 N 2.19 1.55 0.10 3.32 1.01 -1.26 -4.95 116.67 118.63 1ivz s ASP 95 Ca 0.11 1.77 -0.12 0.00 0.71 0.00 0.00 52.55 55.02 1ivz s ASP 95 Cb -0.22 -2.42 -0.18 0.00 1.01 0.00 0.00 42.92 41.12 1ivz s ASP 95 CO -0.03 -3.89 1.26 0.03 0.21 0.00 0.00 175.17 172.75 1ivz h ARG 96 N -2.41 0.70 0.00 8.23 3.08 -1.98 -3.15 114.38 118.85 1ivz h ARG 96 Ca -0.55 -0.67 -0.01 0.00 0.07 0.00 0.00 59.98 58.81 1ivz h ARG 96 Cb 1.31 0.17 -0.00 0.00 0.08 0.00 0.00 29.97 31.53 1ivz h ARG 96 CO 0.47 1.27 -0.06 0.28 -1.07 0.00 0.00 179.97 180.86 1ivz h VAL 97 N 0.43 0.62 0.33 2.04 2.07 -1.92 -2.50 116.25 117.32 1ivz h VAL 97 Ca -0.09 -0.24 -0.01 0.00 0.82 0.00 0.00 66.70 67.17 1ivz h VAL 97 Cb 1.56 1.15 -0.02 0.00 -1.52 0.00 0.00 31.29 32.47 1ivz h VAL 97 CO 0.18 0.06 -0.36 0.00 0.02 0.00 0.00 177.57 177.47 1ivz h ALA 98 N 1.94 -1.02 0.00 1.67 0.00 -1.91 0.67 119.26 120.60 1ivz h ALA 98 Ca -0.00 -0.13 -0.05 0.00 0.00 0.00 0.00 54.91 54.73 1ivz h ALA 98 Cb 0.15 0.61 -0.01 0.00 0.00 0.00 0.00 17.79 18.54 1ivz h ALA 98 CO 0.01 -1.05 -0.26 0.82 0.00 0.00 0.00 179.25 178.77 1ivz h ILE 99 N -0.69 0.86 -0.28 0.00 2.04 -1.70 0.11 117.51 117.85 1ivz h ILE 99 Ca -0.04 -1.01 -0.11 0.00 1.00 0.00 0.00 64.86 64.70 1ivz h ILE 99 Cb 0.61 1.60 -0.01 0.00 -0.74 0.00 0.00 36.82 38.28 1ivz h ILE 99 CO -0.06 0.25 -0.25 0.22 0.00 0.00 0.00 178.15 178.31 1ivz h TYR 100 N 0.00 0.80 0.12 1.37 3.20 -0.99 -1.55 116.97 119.92 1ivz h TYR 100 Ca -0.00 -0.23 -0.18 0.00 3.14 0.00 0.00 58.73 61.45 1ivz h TYR 100 Cb 0.58 -0.17 0.02 0.00 1.54 0.00 0.00 36.73 38.70 1ivz h TYR 100 CO 0.00 0.96 -0.78 0.93 -1.64 0.00 0.00 178.16 177.63 1ivz h GLU 101 N 0.41 0.32 -0.30 1.82 5.08 0.55 -2.75 114.58 119.71 1ivz h GLU 101 Ca 0.05 -0.50 -0.00 0.00 -1.00 0.00 0.00 59.36 57.91 1ivz h GLU 101 Cb 0.81 0.18 -0.02 0.00 0.50 0.00 0.00 28.75 30.23 1ivz h GLU 101 CO 0.06 1.22 0.18 0.93 -1.00 0.00 0.00 179.01 180.40 1ivz h GLU 102 N -0.33 0.41 -0.01 2.33 4.39 -0.85 -1.55 114.58 118.97 1ivz h GLU 102 Ca -0.13 -0.03 -0.14 0.00 0.34 0.00 0.00 59.36 59.40 1ivz h GLU 102 Cb 1.59 -0.09 0.01 0.00 -0.10 0.00 0.00 28.75 30.16 1ivz h GLU 102 CO 0.15 0.29 -0.53 0.35 -1.16 0.00 0.00 179.01 178.10 1ivz h PHE 103 N 0.42 0.56 -0.87 4.33 3.57 -1.36 -3.13 116.94 120.46 1ivz h PHE 103 Ca 0.11 -0.30 0.03 0.00 3.53 0.00 0.00 57.97 61.34 1ivz h PHE 103 Cb -0.01 -0.07 -0.05 0.00 2.79 0.00 0.00 35.95 38.61 1ivz h PHE 103 CO 0.00 1.11 0.56 -0.07 -2.23 0.00 0.00 178.31 177.68 1ivz h LEU 104 N -0.15 0.95 0.81 0.59 3.38 -1.16 -0.99 115.31 118.74 1ivz h LEU 104 Ca -0.06 -0.01 -0.04 0.00 0.09 0.00 0.00 57.88 57.86 1ivz h LEU 104 Cb 1.25 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 41.78 1ivz h LEU 104 CO 0.11 0.66 -0.44 0.03 0.09 0.00 0.00 178.44 178.88 1ivz h ARG 105 N 1.11 -1.12 0.00 1.13 3.08 -1.36 0.78 114.38 118.00 1ivz h ARG 105 Ca 0.34 0.08 -0.01 0.00 0.07 0.00 0.00 59.98 60.46 1ivz h ARG 105 Cb -0.03 0.25 -0.00 0.00 0.08 0.00 0.00 29.97 30.27 1ivz h ARG 105 CO -0.10 -0.74 -0.02 1.98 -1.07 0.00 0.00 179.97 180.01 1ivz h MET 106 N -1.16 0.00 -0.91 0.04 4.05 -1.47 -1.48 114.93 114.00 1ivz h MET 106 Ca -0.11 0.00 -0.31 0.00 -0.28 0.00 0.00 59.70 59.01 1ivz h MET 106 Cb 0.91 0.00 -0.18 0.00 -0.80 0.00 0.00 31.60 31.53 1ivz h MET 106 CO 0.15 0.02 0.39 0.25 0.23 0.00 0.00 176.91 177.95 1ivz n THR 107 N -3.43 2.62 -3.46 -0.77 -2.24 -0.39 -4.62 114.28 102.00 1ivz n THR 107 Ca -0.02 -1.43 -0.23 0.00 -2.27 0.00 0.00 64.05 60.10 1ivz n THR 107 Cb 0.13 -0.51 0.05 0.00 -2.10 0.00 0.00 70.33 67.90 1ivz n THR 107 CO 0.00 0.00 0.00 1.57 -0.57 0.00 0.00 175.07 176.07 1ivz n HIS 108 N -0.47 -2.21 -2.17 4.78 -0.00 -0.56 -0.02 115.22 114.58 1ivz n HIS 108 Ca 0.41 0.66 -0.16 0.00 0.46 0.00 0.00 57.72 59.10 1ivz n HIS 108 Cb 1.33 -3.77 -0.02 0.00 -0.12 0.00 0.00 29.99 27.42 1ivz n HIS 108 CO 0.00 0.00 0.00 0.09 0.46 0.00 0.00 176.34 176.89 1ivz n ASN 109 N -2.89 -4.78 -1.78 0.26 4.13 0.24 -2.41 115.26 108.03 1ivz n ASN 109 Ca -0.08 0.05 -0.12 0.00 1.68 0.00 0.00 54.58 56.11 1ivz n ASN 109 Cb 0.60 -3.86 0.02 0.00 -1.54 0.00 0.00 39.78 35.00 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 -1.02 0.05 0.00 7.41 0.00 0.53 -4.73 105.19 107.43 1ivz n GLY 110 Ca -0.18 -0.28 0.00 0.00 0.00 0.00 0.00 46.02 45.56 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 -3.92 0.00 -3.38 2.61 -2.24 0.21 -1.48 114.28 106.08 1ivz n THR 111 Ca -0.05 -0.23 -0.00 0.00 -2.27 0.00 0.00 64.05 61.49 1ivz n THR 111 Cb 0.56 0.73 -0.04 0.00 -2.10 0.00 0.00 70.33 69.48 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 -1.52 0.52 -0.83 -0.78 0.74 0.97 -2.77 119.66 115.99 1ivz s GLN 112 Ca 0.00 1.10 -0.15 0.00 0.05 0.00 0.00 55.36 56.35 1ivz s GLN 112 Cb 0.00 0.51 0.19 0.00 1.10 0.00 0.00 33.01 34.81 1ivz s GLN 112 CO 0.00 -0.45 0.84 -1.17 -0.55 0.00 0.00 175.29 173.95 1ivz s LEU 113 N 2.81 6.31 0.00 3.68 1.98 -0.65 -3.66 118.68 129.16 1ivz s LEU 113 Ca 0.09 -2.47 0.00 0.00 -2.89 0.00 0.00 54.13 48.86 1ivz s LEU 113 Cb -0.14 -2.26 0.00 0.00 0.66 0.00 0.00 46.19 44.46 1ivz s LEU 113 CO -0.19 -0.71 0.00 0.18 -1.89 0.00 0.00 176.35 173.74 1ivz n LEU 114 N 4.68 0.00 -2.30 -0.68 4.77 -1.26 -1.16 117.00 121.04 1ivz n LEU 114 Ca 0.14 0.00 -0.05 0.00 -0.03 0.00 0.00 56.01 56.07 1ivz n LEU 114 Cb 0.47 0.00 0.05 0.00 -2.33 0.00 0.00 43.42 41.61 1ivz n LEU 114 CO 0.39 0.00 0.07 0.59 -1.33 0.00 0.00 177.39 177.11 1ivz n ASN 115 N 1.31 2.35 -3.32 -1.43 4.13 -1.26 -4.98 115.26 112.06 1ivz n ASN 115 Ca 0.00 -2.57 -0.12 0.00 1.68 0.00 0.00 54.58 53.57 1ivz n ASN 115 Cb 0.00 -0.42 -0.06 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 -3.19 -0.76 0.15 3.10 0.08 -0.31 -5.12 117.98 111.93 1ivz s PHE 116 Ca 0.35 -0.22 -0.31 0.00 0.12 0.00 0.00 56.93 56.86 1ivz s PHE 116 Cb 0.36 -0.23 -0.10 0.00 -0.57 0.00 0.00 43.02 42.48 1ivz s PHE 116 CO -0.04 -1.00 1.70 0.95 -0.10 0.00 0.00 175.22 176.73 1ivz s THR 117 N 1.96 2.50 0.06 0.64 -4.23 -1.26 -1.63 115.64 113.68 1ivz s THR 117 Ca 0.14 0.22 -0.05 0.00 -1.18 0.00 0.00 61.69 60.82 1ivz s THR 117 Cb -0.13 -3.14 -0.02 0.00 1.34 0.00 0.00 72.50 70.55 1ivz s THR 117 CO -0.16 0.01 0.07 -1.48 -0.54 0.00 0.00 174.62 172.52 1ivz s LEU 118 N 1.88 1.99 0.78 4.79 0.05 -1.12 -0.46 118.68 126.60 1ivz s LEU 118 Ca 0.75 -0.81 -0.11 0.00 0.05 0.00 0.00 54.13 54.01 1ivz s LEU 118 Cb -0.45 0.58 0.06 0.00 -2.05 0.00 0.00 46.19 44.33 1ivz s LEU 118 CO 0.33 -0.64 1.09 -0.62 -0.55 0.00 0.00 176.35 175.96 1ivz s ASP 119 N -2.81 4.43 -0.21 1.48 2.15 -0.84 -3.69 116.67 117.17 1ivz s ASP 119 Ca 0.05 1.74 -0.16 0.00 0.43 0.00 0.00 52.55 54.61 1ivz s ASP 119 Cb 0.06 -2.45 -0.11 0.00 -0.30 0.00 0.00 42.92 40.11 1ivz s ASP 119 CO -0.10 -2.07 -0.15 -1.14 -0.17 0.00 0.00 175.17 171.54 1ivz n ARG 120 N -3.54 0.55 0.19 4.34 0.63 -0.55 -4.26 116.66 114.01 1ivz n ARG 120 Ca 0.09 0.40 0.06 0.00 -0.92 0.00 0.00 57.85 57.48 1ivz n ARG 120 Cb 0.53 -1.60 0.55 0.00 0.45 0.00 0.00 32.46 32.40 1ivz n ARG 120 CO 0.00 0.00 0.00 1.57 -2.51 0.00 0.00 177.63 176.69 1ivz h LYS 121 N -1.00 0.14 -0.13 -0.14 2.10 -1.93 -1.53 116.57 114.08 1ivz h LYS 121 Ca -0.34 -0.01 0.00 0.00 -2.00 0.00 0.00 60.65 58.30 1ivz h LYS 121 Cb 1.20 -0.03 -0.01 0.00 -0.90 0.00 0.00 32.23 32.50 1ivz h LYS 121 CO -0.20 0.14 0.08 0.66 -2.00 0.00 0.00 179.45 178.12 1ivz h SER 122 N 0.14 0.14 -3.92 7.07 4.64 -1.93 -3.43 113.55 116.27 1ivz h SER 122 Ca 0.04 -0.00 -0.56 0.00 -0.47 0.00 0.00 61.79 60.79 1ivz h SER 122 Cb 0.06 -0.04 0.14 0.00 -0.31 0.00 0.00 62.40 62.26 1ivz h SER 122 CO -0.00 0.11 0.52 0.52 -0.87 0.00 0.00 176.83 177.10 1ivz n VAL 123 N -4.52 3.81 -3.55 0.95 0.31 -0.58 -4.36 118.33 110.40 1ivz n VAL 123 Ca -0.01 -0.50 -0.01 0.00 -0.01 0.00 0.00 64.34 63.81 1ivz n VAL 123 Cb 0.08 -1.57 -0.05 0.00 -0.91 0.00 0.00 33.84 31.39 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 -1.32 -0.59 -0.10 3.52 2.19 0.22 -4.96 117.98 116.94 1ivz s PHE 124 Ca 0.72 1.11 0.02 0.00 0.33 0.00 0.00 56.93 59.12 1ivz s PHE 124 Cb -0.42 0.36 0.01 0.00 -1.31 0.00 0.00 43.02 41.66 1ivz s PHE 124 CO 0.49 -0.29 -0.15 0.54 1.83 0.00 0.00 175.22 177.64 1ivz s VAL 125 N 1.78 1.42 0.38 3.12 0.11 -1.26 -2.43 120.40 123.53 1ivz s VAL 125 Ca -0.06 -0.61 0.04 0.00 -2.93 0.00 0.00 61.98 58.42 1ivz s VAL 125 Cb -0.05 -1.30 -0.03 0.00 -1.53 0.00 0.00 36.38 33.47 1ivz s VAL 125 CO -0.16 0.43 0.14 -0.62 -3.33 0.00 0.00 175.10 171.56 1ivz s ASP 126 N 0.94 2.51 -0.28 3.54 2.15 -1.13 -4.88 116.67 119.51 1ivz s ASP 126 Ca -0.08 -1.65 -0.29 0.00 0.43 0.00 0.00 52.55 50.97 1ivz s ASP 126 Cb -0.15 0.46 -0.02 0.00 -0.30 0.00 0.00 42.92 42.91 1ivz s ASP 126 CO -0.00 -0.92 1.72 -0.94 -0.17 0.00 0.00 175.17 174.86 1ivz s SER 127 N -3.55 6.10 -0.01 -0.34 1.04 -1.26 -1.48 113.70 114.20 1ivz s SER 127 Ca 0.27 1.43 -0.23 0.00 0.48 0.00 0.00 55.95 57.90 1ivz s SER 127 Cb 0.03 -2.53 -0.16 0.00 0.10 0.00 0.00 66.02 63.46 1ivz s SER 127 CO 0.16 -1.52 1.10 1.23 0.98 0.00 0.00 173.24 175.19 1ivz h GLY 128 N 12.81 -0.40 0.91 7.32 0.00 -0.64 -3.36 103.07 119.71 1ivz h GLY 128 Ca -0.34 0.15 -0.04 0.00 0.00 0.00 0.00 47.33 47.10 1ivz h GLY 128 CO 1.02 -0.14 -0.40 -0.56 0.00 0.00 0.00 176.54 176.46 1ivz h PRO 129 N -0.82 -1.08 0.00 4.80 0.13 -1.91 -3.46 132.00 129.67 1ivz h PRO 129 Ca -0.04 0.07 0.00 0.00 -0.87 0.00 0.00 66.00 65.16 1ivz h PRO 129 Cb 0.51 0.24 0.00 0.00 0.13 0.00 0.00 31.00 31.89 1ivz h PRO 129 CO 0.06 -0.71 0.00 0.45 -0.23 0.00 0.00 178.00 177.58 1ivz n SER 130 N -5.54 0.00 0.00 1.44 2.88 -1.26 -4.79 113.62 106.36 1ivz n SER 130 Ca -0.15 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.39 1ivz n SER 130 Cb 0.45 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.91 1ivz n SER 130 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 1ivz n SER 131 N 2.00 0.00 0.00 -3.46 2.88 -1.26 -5.18 113.62 108.60 1ivz n SER 131 Ca 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 1ivz n SER 131 Cb 0.00 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.46 1ivz n SER 131 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42