#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 6.43 0.01 1.61 0.01 -1.26 -5.04 113.70 115.45 1ivz s SER 2 Ca 0.00 0.61 -0.15 0.00 1.31 0.00 0.00 55.95 57.72 1ivz s SER 2 Cb 0.00 -2.10 -0.08 0.00 0.21 0.00 0.00 66.02 64.05 1ivz s SER 2 CO 0.00 -0.14 0.94 0.28 0.41 0.00 0.00 173.24 174.73 1ivz h SER 3 N 1.80 -0.45 0.00 2.44 0.02 -1.88 -3.47 113.55 112.01 1ivz h SER 3 Ca -0.48 0.02 0.00 0.00 -0.84 0.00 0.00 61.79 60.49 1ivz h SER 3 Cb 1.19 0.12 0.00 0.00 0.14 0.00 0.00 62.40 63.85 1ivz h SER 3 CO 0.67 -0.25 0.00 0.61 -1.14 0.00 0.00 176.83 176.72 1ivz n GLY 4 N -0.46 4.10 0.05 -3.77 0.00 -1.26 -3.71 105.19 100.14 1ivz n GLY 4 Ca -0.07 0.07 -0.04 0.00 0.00 0.00 0.00 46.02 45.98 1ivz n GLY 4 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1ivz n SER 5 N 8.85 1.21 -4.95 1.61 3.41 -1.26 -5.00 113.62 117.49 1ivz n SER 5 Ca 0.00 0.40 -0.23 0.00 -0.26 0.00 0.00 58.87 58.78 1ivz n SER 5 Cb 0.00 -0.71 -0.01 0.00 -0.26 0.00 0.00 64.21 63.23 1ivz n SER 5 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 1ivz s SER 6 N -5.06 6.25 0.00 4.04 1.04 -1.24 -5.09 113.70 113.63 1ivz s SER 6 Ca -0.13 0.29 0.00 0.00 0.48 0.00 0.00 55.95 56.59 1ivz s SER 6 Cb 0.02 -1.89 0.00 0.00 0.10 0.00 0.00 66.02 64.24 1ivz s SER 6 CO 0.19 -0.27 0.00 0.61 0.98 0.00 0.00 173.24 174.75 1ivz n GLY 7 N -1.69 -0.19 3.23 7.32 0.00 -1.26 -4.75 105.19 107.84 1ivz n GLY 7 Ca -0.05 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.88 1ivz n GLY 7 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1ivz s SER 8 N -1.52 0.18 -1.22 1.61 0.01 -1.26 -4.84 113.70 106.67 1ivz s SER 8 Ca 0.00 -0.91 -0.02 0.00 1.31 0.00 0.00 55.95 56.32 1ivz s SER 8 Cb 0.00 0.35 0.00 0.00 0.21 0.00 0.00 66.02 66.58 1ivz s SER 8 CO 0.00 -0.77 1.03 -1.20 0.41 0.00 0.00 173.24 172.71 1ivz n SER 9 N -0.10 -3.23 -4.36 2.44 7.64 -1.26 -4.97 113.62 109.77 1ivz n SER 9 Ca -0.10 -0.59 -0.42 0.00 1.01 0.00 0.00 58.87 58.78 1ivz n SER 9 Cb 0.63 -5.01 -0.10 0.00 -1.01 0.00 0.00 64.21 58.72 1ivz n SER 9 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 1ivz s SER 10 N -4.05 5.88 0.49 6.43 0.15 -1.26 -4.99 113.70 116.36 1ivz s SER 10 Ca 0.16 -1.20 0.00 0.00 0.70 0.00 0.00 55.95 55.61 1ivz s SER 10 Cb -0.07 -2.08 0.00 0.00 -1.71 0.00 0.00 66.02 62.16 1ivz s SER 10 CO 0.72 -0.50 0.00 -1.54 1.20 0.00 0.00 173.24 173.11 1ivz n SER 11 N 5.06 -8.07 -4.70 5.45 3.41 -1.26 -4.85 113.62 108.66 1ivz n SER 11 Ca -0.11 1.07 -0.23 0.00 -0.26 0.00 0.00 58.87 59.34 1ivz n SER 11 Cb 0.45 -4.61 -0.07 0.00 -0.26 0.00 0.00 64.21 59.72 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 -3.53 2.34 -0.33 4.33 0.00 -1.26 -4.93 119.66 116.28 1ivz s GLN 12 Ca 0.00 -1.52 -0.01 0.00 -0.00 0.00 0.00 55.36 53.82 1ivz s GLN 12 Cb 0.00 -2.16 0.12 0.00 0.00 0.00 0.00 33.01 30.97 1ivz s GLN 12 CO 0.00 0.19 0.16 -1.01 0.00 0.00 0.00 175.29 174.63 1ivz s HIS 13 N -2.40 0.91 -0.39 9.60 3.76 -1.26 -2.68 115.29 122.83 1ivz s HIS 13 Ca 0.36 -1.47 -0.25 0.00 -0.15 0.00 0.00 55.06 53.55 1ivz s HIS 13 Cb -0.03 -1.18 0.02 0.00 1.11 0.00 0.00 32.58 32.49 1ivz s HIS 13 CO 0.22 -0.83 0.89 -0.06 -0.85 0.00 0.00 174.74 174.10 1ivz s PHE 14 N 1.47 3.05 -0.15 1.40 0.08 -1.02 -0.74 117.98 122.07 1ivz s PHE 14 Ca 0.13 0.61 -0.36 0.00 0.12 0.00 0.00 56.93 57.44 1ivz s PHE 14 Cb -0.20 -3.67 -0.13 0.00 -0.57 0.00 0.00 43.02 38.46 1ivz s PHE 14 CO -0.18 -0.88 1.87 -1.71 -0.10 0.00 0.00 175.22 174.22 1ivz n ASN 15 N 6.79 3.15 -4.78 1.36 2.85 0.42 0.11 115.26 125.15 1ivz n ASN 15 Ca 0.06 0.96 -0.36 0.00 -0.11 0.00 0.00 54.58 55.13 1ivz n ASN 15 Cb 0.48 -1.31 -0.07 0.00 1.24 0.00 0.00 39.78 40.12 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 4.17 4.29 -0.12 1.20 2.96 0.18 -2.00 118.68 129.36 1ivz s LEU 16 Ca 0.95 0.45 -0.10 0.00 -0.22 0.00 0.00 54.13 55.21 1ivz s LEU 16 Cb -0.79 -2.22 0.04 0.00 0.50 0.00 0.00 46.19 43.72 1ivz s LEU 16 CO 0.55 0.23 0.31 0.20 -1.32 0.00 0.00 176.35 176.31 1ivz s ASN 17 N -0.10 -0.33 -0.30 3.68 -0.87 -0.73 -0.09 114.94 116.20 1ivz s ASN 17 Ca 0.14 0.63 -0.18 0.00 -1.57 0.00 0.00 52.86 51.88 1ivz s ASN 17 Cb -0.12 0.60 0.19 0.00 -0.02 0.00 0.00 41.25 41.91 1ivz s ASN 17 CO 0.03 -0.12 1.23 0.72 -2.57 0.00 0.00 177.10 176.39 1ivz s PHE 18 N 0.45 -0.16 0.10 2.20 -0.71 -1.14 -0.22 117.98 118.49 1ivz s PHE 18 Ca -0.02 0.30 -0.30 0.00 -1.04 0.00 0.00 56.93 55.86 1ivz s PHE 18 Cb -0.04 0.10 -0.06 0.00 -1.21 0.00 0.00 43.02 41.81 1ivz s PHE 18 CO -0.02 -0.08 1.15 0.99 -1.34 0.00 0.00 175.22 175.92 1ivz s THR 19 N 1.79 4.03 -0.60 -4.49 2.01 -1.26 -2.59 115.64 114.53 1ivz s THR 19 Ca -0.03 1.54 -0.15 0.00 0.31 0.00 0.00 61.69 63.37 1ivz s THR 19 Cb -0.02 -3.99 0.15 0.00 0.01 0.00 0.00 72.50 68.65 1ivz s THR 19 CO -0.15 0.17 0.55 -0.63 -0.69 0.00 0.00 174.62 173.88 1ivz s ILE 20 N 0.61 5.24 0.58 1.82 1.01 0.30 -2.92 121.20 127.85 1ivz s ILE 20 Ca 0.55 -1.74 0.28 0.00 0.00 0.00 0.00 60.65 59.74 1ivz s ILE 20 Cb -0.29 -4.33 0.38 0.00 0.01 0.00 0.00 42.46 38.22 1ivz s ILE 20 CO 0.31 -0.90 1.97 0.71 0.00 0.00 0.00 174.94 177.03 1ivz h THR 21 N 5.65 0.43 -0.80 2.92 1.35 -1.81 -2.47 112.91 118.17 1ivz h THR 21 Ca -0.20 0.00 -0.49 0.00 -0.55 0.00 0.00 66.41 65.17 1ivz h THR 21 Cb 1.08 0.69 -0.13 0.00 -1.73 0.00 0.00 68.15 68.06 1ivz h THR 21 CO 0.96 0.00 0.80 -3.20 -0.25 0.00 0.00 175.52 173.84 1ivz n ASN 22 N -3.79 6.64 -2.78 5.36 5.15 0.42 -4.54 115.26 121.72 1ivz n ASN 22 Ca 0.06 -3.01 0.01 0.00 -0.60 0.00 0.00 54.58 51.04 1ivz n ASN 22 Cb 0.56 -1.31 0.01 0.00 -0.53 0.00 0.00 39.78 38.50 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 -1.59 -0.42 0.11 1.20 1.98 -0.93 -4.81 118.68 114.21 1ivz s LEU 23 Ca 0.60 -0.26 -0.31 0.00 -2.89 0.00 0.00 54.13 51.27 1ivz s LEU 23 Cb 0.32 0.54 -0.09 0.00 0.66 0.00 0.00 46.19 47.63 1ivz s LEU 23 CO -0.15 -0.04 1.64 -2.16 -1.89 0.00 0.00 176.35 173.75 1ivz s PRO 24 N 1.79 4.20 -0.60 0.98 0.04 -1.25 -3.39 135.00 136.77 1ivz s PRO 24 Ca 0.16 2.36 -0.26 0.00 0.04 0.00 0.00 61.00 63.30 1ivz s PRO 24 Cb 0.04 -3.44 -0.06 0.00 0.04 0.00 0.00 34.50 31.07 1ivz s PRO 24 CO -0.14 -0.70 2.23 -0.47 0.04 0.00 0.00 177.00 177.96 1ivz s TYR 25 N 2.12 1.29 0.40 0.56 5.04 -1.09 -4.92 117.35 120.75 1ivz s TYR 25 Ca 0.73 1.35 0.08 0.00 -2.44 0.00 0.00 57.07 56.79 1ivz s TYR 25 Cb -0.42 -3.73 -0.01 0.00 0.35 0.00 0.00 41.96 38.15 1ivz s TYR 25 CO 0.32 -2.27 0.42 0.45 -1.34 0.00 0.00 175.55 173.13 1ivz s SER 26 N 10.60 5.29 0.55 4.32 0.15 -1.26 -4.98 113.70 128.36 1ivz s SER 26 Ca 0.86 -0.60 0.23 0.00 0.70 0.00 0.00 55.95 57.15 1ivz s SER 26 Cb -0.14 -0.69 1.47 0.00 -1.71 0.00 0.00 66.02 64.95 1ivz s SER 26 CO 0.20 -0.62 2.14 0.06 1.20 0.00 0.00 173.24 176.21 1ivz h GLN 27 N 0.96 0.00 -0.22 5.44 -0.00 -1.98 -1.80 115.11 117.50 1ivz h GLN 27 Ca -0.42 0.00 -0.06 0.00 -0.00 0.00 0.00 58.65 58.17 1ivz h GLN 27 Cb 1.27 0.00 -0.01 0.00 -0.00 0.00 0.00 27.48 28.74 1ivz h GLN 27 CO 0.54 0.00 -0.09 -0.44 -0.00 0.00 0.00 178.83 178.84 1ivz h ASP 28 N 0.00 0.46 0.49 0.06 3.32 -1.94 -3.00 116.42 115.80 1ivz h ASP 28 Ca 0.06 -0.40 -0.07 0.00 0.02 0.00 0.00 57.03 56.64 1ivz h ASP 28 Cb 0.26 -0.13 -0.01 0.00 0.22 0.00 0.00 39.33 39.67 1ivz h ASP 28 CO -0.00 0.76 -0.33 0.40 -1.72 0.00 0.00 179.24 178.35 1ivz h ILE 29 N 0.16 1.05 0.00 0.35 1.08 -1.69 -2.29 117.51 116.17 1ivz h ILE 29 Ca 0.05 -1.22 0.00 0.00 -0.39 0.00 0.00 64.86 63.30 1ivz h ILE 29 Cb 0.58 1.69 0.00 0.00 -3.07 0.00 0.00 36.82 36.02 1ivz h ILE 29 CO 0.03 0.33 0.00 0.00 -0.69 0.00 0.00 178.15 177.82 1ivz n ALA 30 N -2.39 1.88 -3.96 1.87 0.00 -0.78 -4.49 120.51 112.63 1ivz n ALA 30 Ca -0.01 -0.07 -0.31 0.00 0.00 0.00 0.00 53.44 53.05 1ivz n ALA 30 Cb 0.40 -1.30 -0.15 0.00 0.00 0.00 0.00 19.45 18.39 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 -2.96 1.70 -0.61 0.00 -1.52 -0.86 -5.03 119.66 110.39 1ivz s GLN 31 Ca 0.10 -1.08 -0.08 0.00 -1.95 0.00 0.00 55.36 52.35 1ivz s GLN 31 Cb 0.12 -2.65 -0.07 0.00 -0.22 0.00 0.00 33.01 30.20 1ivz s GLN 31 CO 0.34 -0.61 1.76 -2.30 -0.25 0.00 0.00 175.29 174.23 1ivz n PRO 32 N 4.62 1.35 -1.36 2.91 -0.02 -1.26 -3.25 135.00 137.99 1ivz n PRO 32 Ca -0.12 -1.23 -0.02 0.00 -2.02 0.00 0.00 63.50 60.11 1ivz n PRO 32 Cb 0.44 -2.39 0.01 0.00 -0.02 0.00 0.00 33.50 31.53 1ivz n PRO 32 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1ivz n SER 33 N 5.10 -0.57 -2.99 2.55 2.88 -1.26 -5.07 113.62 114.26 1ivz n SER 33 Ca 0.33 -1.23 -0.15 0.00 -1.33 0.00 0.00 58.87 56.49 1ivz n SER 33 Cb 0.15 0.23 -0.04 0.00 -0.75 0.00 0.00 64.21 63.79 1ivz n SER 33 CO 0.00 0.00 0.00 0.35 -1.23 0.00 0.00 175.04 174.16 1ivz n THR 34 N -0.35 0.00 -0.08 2.46 -2.24 -1.20 -5.07 114.28 107.81 1ivz n THR 34 Ca -0.11 -1.38 -0.13 0.00 -2.27 0.00 0.00 64.05 60.16 1ivz n THR 34 Cb 0.56 0.45 -0.10 0.00 -2.10 0.00 0.00 70.33 69.15 1ivz n THR 34 CO 0.00 0.00 0.00 0.74 -0.57 0.00 0.00 175.07 175.24 1ivz h THR 35 N 1.35 1.16 -0.24 4.28 2.02 -1.93 -2.90 112.91 116.66 1ivz h THR 35 Ca -0.20 -1.99 0.07 0.00 0.77 0.00 0.00 66.41 65.07 1ivz h THR 35 Cb 0.71 2.31 -0.01 0.00 -1.74 0.00 0.00 68.15 69.42 1ivz h THR 35 CO 0.31 0.39 0.19 0.50 0.37 0.00 0.00 175.52 177.28 1ivz h LYS 36 N -1.00 0.00 0.01 6.66 3.64 -1.98 0.59 116.57 124.49 1ivz h LYS 36 Ca -0.08 0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.28 1ivz h LYS 36 Cb 0.87 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.69 1ivz h LYS 36 CO -0.05 0.00 -0.07 -0.92 -2.27 0.00 0.00 179.45 176.14 1ivz h TYR 37 N 0.00 0.06 -0.03 1.91 3.20 -1.77 -2.12 116.97 118.22 1ivz h TYR 37 Ca 0.11 -0.04 -0.11 0.00 3.14 0.00 0.00 58.73 61.84 1ivz h TYR 37 Cb 0.48 -0.01 -0.01 0.00 1.54 0.00 0.00 36.73 38.73 1ivz h TYR 37 CO 0.00 0.90 -0.48 1.96 -1.64 0.00 0.00 178.16 178.90 1ivz h GLN 38 N -0.80 0.07 -0.10 1.82 1.08 -1.20 -0.66 115.11 115.32 1ivz h GLN 38 Ca -0.01 -0.04 -0.21 0.00 -1.45 0.00 0.00 58.65 56.95 1ivz h GLN 38 Cb 0.93 0.00 0.01 0.00 -0.05 0.00 0.00 27.48 28.37 1ivz h GLN 38 CO 0.01 0.54 -0.74 1.96 -0.95 0.00 0.00 178.83 179.65 1ivz h GLN 39 N 0.06 0.69 -0.06 1.46 4.20 0.08 -2.32 115.11 119.21 1ivz h GLN 39 Ca -0.00 -0.60 -0.06 0.00 0.06 0.00 0.00 58.65 58.05 1ivz h GLN 39 Cb 0.88 0.14 0.00 0.00 0.30 0.00 0.00 27.48 28.79 1ivz h GLN 39 CO 0.07 1.21 -0.19 1.15 -0.67 0.00 0.00 178.83 180.39 1ivz h THR 40 N 0.36 1.43 -0.22 -0.54 2.02 -1.31 -2.50 112.91 112.16 1ivz h THR 40 Ca -0.06 -1.57 0.02 0.00 0.77 0.00 0.00 66.41 65.56 1ivz h THR 40 Cb 1.39 2.30 -0.02 0.00 -1.74 0.00 0.00 68.15 70.07 1ivz h THR 40 CO 0.15 0.44 0.09 0.50 0.37 0.00 0.00 175.52 177.07 1ivz h LYS 41 N -0.27 0.19 -0.05 6.66 3.64 -1.22 -1.22 116.57 124.31 1ivz h LYS 41 Ca -0.01 -0.01 -0.02 0.00 -1.27 0.00 0.00 60.65 59.34 1ivz h LYS 41 Cb 0.81 -0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 32.59 1ivz h LYS 41 CO 0.04 0.13 -0.08 -0.09 -2.27 0.00 0.00 179.45 177.18 1ivz h ARG 42 N 0.20 0.07 -0.31 1.90 9.65 -1.49 -1.03 114.38 123.37 1ivz h ARG 42 Ca 0.09 -0.01 -0.16 0.00 -1.10 0.00 0.00 59.98 58.80 1ivz h ARG 42 Cb 0.05 -0.01 -0.00 0.00 -1.39 0.00 0.00 29.97 28.61 1ivz h ARG 42 CO -0.08 0.15 -0.43 0.77 2.80 0.00 0.00 179.97 183.18 1ivz h SER 43 N 0.07 0.91 -0.05 -3.80 0.02 -0.86 -1.63 113.55 108.22 1ivz h SER 43 Ca 0.02 -0.50 -0.02 0.00 -0.84 0.00 0.00 61.79 60.44 1ivz h SER 43 Cb 0.19 -0.26 -0.00 0.00 0.14 0.00 0.00 62.40 62.47 1ivz h SER 43 CO 0.01 1.24 -0.06 0.40 -1.14 0.00 0.00 176.83 177.28 1ivz h ILE 44 N 0.61 1.39 -0.71 3.27 2.04 -0.74 0.21 117.51 123.59 1ivz h ILE 44 Ca 0.03 -1.26 0.01 0.00 1.00 0.00 0.00 64.86 64.65 1ivz h ILE 44 Cb 1.03 2.12 -0.04 0.00 -0.74 0.00 0.00 36.82 39.20 1ivz h ILE 44 CO 0.10 0.34 0.47 -0.08 0.00 0.00 0.00 178.15 178.98 1ivz h GLU 45 N -0.34 0.92 -0.04 2.37 4.22 -1.27 0.36 114.58 120.80 1ivz h GLU 45 Ca 0.01 -0.06 -0.01 0.00 0.08 0.00 0.00 59.36 59.38 1ivz h GLU 45 Cb 0.58 -0.21 -0.00 0.00 0.50 0.00 0.00 28.75 29.62 1ivz h GLU 45 CO 0.01 0.61 -0.03 -0.97 -2.18 0.00 0.00 179.01 176.46 1ivz h ASN 46 N 0.95 0.09 0.07 1.04 -1.24 -1.32 -2.13 115.58 113.04 1ivz h ASN 46 Ca 0.26 -0.46 -0.04 0.00 0.71 0.00 0.00 56.30 56.78 1ivz h ASN 46 Cb -0.09 -0.02 -0.01 0.00 0.73 0.00 0.00 38.32 38.93 1ivz h ASN 46 CO -0.07 0.53 -0.12 0.00 -1.29 0.00 0.00 177.43 176.48 1ivz h ALA 47 N 0.56 1.64 -0.07 1.57 0.00 -0.78 -2.24 119.26 119.93 1ivz h ALA 47 Ca 0.01 -0.16 -0.16 0.00 0.00 0.00 0.00 54.91 54.59 1ivz h ALA 47 Cb 0.50 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.22 1ivz h ALA 47 CO 0.01 0.27 -0.65 -0.07 0.00 0.00 0.00 179.25 178.80 1ivz h LEU 48 N 0.13 0.34 -0.86 0.00 3.38 -0.22 -3.00 115.31 115.06 1ivz h LEU 48 Ca 0.03 -0.21 -0.05 0.00 0.09 0.00 0.00 57.88 57.74 1ivz h LEU 48 Cb 0.30 -0.10 -0.03 0.00 0.09 0.00 0.00 40.66 40.92 1ivz h LEU 48 CO 0.02 0.90 0.26 0.78 0.09 0.00 0.00 178.44 180.49 1ivz h ASN 49 N 0.21 1.02 0.40 -0.43 2.35 -0.76 -2.66 115.58 115.70 1ivz h ASN 49 Ca -0.01 -0.17 -0.02 0.00 -0.55 0.00 0.00 56.30 55.55 1ivz h ASN 49 Cb 1.19 -0.26 0.00 0.00 0.05 0.00 0.00 38.32 39.29 1ivz h ASN 49 CO 0.10 0.92 -0.19 -0.61 -1.65 0.00 0.00 177.43 176.01 1ivz h GLN 50 N 1.07 -0.51 -1.01 0.81 -0.00 -1.47 -3.02 115.11 110.97 1ivz h GLN 50 Ca 0.24 0.03 0.24 0.00 -0.00 0.00 0.00 58.65 59.17 1ivz h GLN 50 Cb 0.25 0.12 -0.12 0.00 0.00 0.00 0.00 27.48 27.73 1ivz h GLN 50 CO -0.01 -0.22 0.61 1.25 0.00 0.00 0.00 178.83 180.45 1ivz h LEU 51 N -0.78 0.66 -0.24 -2.39 6.46 -1.47 -0.02 115.31 117.52 1ivz h LEU 51 Ca -0.05 0.12 0.01 0.00 -0.12 0.00 0.00 57.88 57.83 1ivz h LEU 51 Cb 0.53 0.02 -0.02 0.00 -0.73 0.00 0.00 40.66 40.46 1ivz h LEU 51 CO 0.09 0.13 0.14 -0.26 -0.62 0.00 0.00 178.44 177.92 1ivz h PHE 52 N 0.58 0.27 0.00 1.25 0.04 -1.38 0.28 116.94 117.99 1ivz h PHE 52 Ca 0.63 0.01 0.00 0.00 2.80 0.00 0.00 57.97 61.40 1ivz h PHE 52 Cb 1.22 -0.09 0.00 0.00 2.20 0.00 0.00 35.95 39.28 1ivz h PHE 52 CO -0.01 0.16 0.00 0.54 -0.60 0.00 0.00 178.31 178.41 1ivz n ARG 53 N -4.95 0.20 -0.09 1.51 1.74 -0.14 -2.95 116.66 111.99 1ivz n ARG 53 Ca -0.02 0.09 -0.07 0.00 -0.77 0.00 0.00 57.85 57.08 1ivz n ARG 53 Cb 0.04 -1.50 -0.16 0.00 -1.02 0.00 0.00 32.46 29.82 1ivz n ARG 53 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 1ivz n ASN 54 N -1.36 0.03 -3.84 0.55 3.02 -0.51 -4.92 115.26 108.22 1ivz n ASN 54 Ca 0.09 0.00 -0.30 0.00 -0.03 0.00 0.00 54.58 54.34 1ivz n ASN 54 Cb 0.21 1.12 0.25 0.00 -0.61 0.00 0.00 39.78 40.75 1ivz n ASN 54 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 1ivz s SER 55 N -5.36 0.41 0.32 6.41 1.04 0.89 -4.95 113.70 112.47 1ivz s SER 55 Ca -0.10 0.84 0.18 0.00 0.48 0.00 0.00 55.95 57.35 1ivz s SER 55 Cb 0.07 -1.21 0.15 0.00 0.10 0.00 0.00 66.02 65.13 1ivz s SER 55 CO 0.84 -4.46 1.45 0.28 0.98 0.00 0.00 173.24 172.33 1ivz h SER 56 N -2.81 0.00 -1.01 7.02 0.02 -1.90 -3.31 113.55 111.56 1ivz h SER 56 Ca -0.47 0.00 -0.51 0.00 -0.84 0.00 0.00 61.79 59.97 1ivz h SER 56 Cb 1.32 0.00 -0.19 0.00 0.14 0.00 0.00 62.40 63.66 1ivz h SER 56 CO 0.36 0.29 0.56 2.30 -1.14 0.00 0.00 176.83 179.20 1ivz n ILE 57 N -3.13 3.24 -1.09 3.27 -5.35 -1.26 -4.61 119.36 110.44 1ivz n ILE 57 Ca 0.02 -2.77 -0.26 0.00 -0.27 0.00 0.00 62.75 59.47 1ivz n ILE 57 Cb 0.65 -1.41 0.07 0.00 -1.74 0.00 0.00 39.64 37.22 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 0.27 2.26 -0.11 6.28 2.85 -1.25 -3.77 118.16 124.70 1ivz n LYS 58 Ca 0.46 -2.50 -0.19 0.00 -1.05 0.00 0.00 58.31 55.03 1ivz n LYS 58 Cb 0.53 -1.98 -0.09 0.00 -0.65 0.00 0.00 35.03 32.84 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 -0.40 1.95 -0.04 -5.58 2.88 -1.26 -4.76 113.62 106.41 1ivz n SER 59 Ca 0.48 0.09 -0.02 0.00 -1.33 0.00 0.00 58.87 58.09 1ivz n SER 59 Cb 0.71 -0.50 -0.08 0.00 -0.75 0.00 0.00 64.21 63.59 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 -3.58 0.00 -1.67 0.66 4.01 -1.26 -5.00 117.16 110.32 1ivz n TYR 60 Ca -0.40 0.00 -0.46 0.00 -0.16 0.00 0.00 57.90 56.87 1ivz n TYR 60 Cb 0.85 -0.42 -0.04 0.00 -0.31 0.00 0.00 39.34 39.41 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 -2.23 2.31 -0.02 -0.72 -0.00 -1.25 -1.10 117.46 114.45 1ivz n PHE 61 Ca -0.12 0.19 -0.02 0.00 -0.00 0.00 0.00 57.45 57.50 1ivz n PHE 61 Cb 0.67 -2.58 -0.01 0.00 -0.00 0.00 0.00 39.48 37.57 1ivz n PHE 61 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.76 177.21 1ivz n SER 62 N 4.18 0.64 -2.47 -2.13 2.88 -1.21 -4.90 113.62 110.60 1ivz n SER 62 Ca 0.18 0.10 -0.04 0.00 -1.33 0.00 0.00 58.87 57.78 1ivz n SER 62 Cb 0.29 -0.43 0.02 0.00 -0.75 0.00 0.00 64.21 63.34 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 -3.13 -1.45 -4.68 -3.46 5.75 -1.25 -4.97 116.55 103.36 1ivz n ASP 63 Ca -0.04 -1.90 -0.24 0.00 -0.01 0.00 0.00 54.79 52.61 1ivz n ASP 63 Cb 0.13 2.39 -0.07 0.00 -1.03 0.00 0.00 41.12 42.54 1ivz n ASP 63 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1ivz s GLN 65 N -3.78 0.81 -0.32 0.00 2.00 -0.68 -4.90 119.66 112.78 1ivz s GLN 65 Ca 0.36 -1.27 -0.28 0.00 -2.00 0.00 0.00 55.36 52.17 1ivz s GLN 65 Cb -0.01 -1.99 -0.02 0.00 0.80 0.00 0.00 33.01 31.79 1ivz s GLN 65 CO 0.21 -1.04 1.78 0.54 -0.50 0.00 0.00 175.29 176.28 1ivz s VAL 66 N 1.33 3.50 -0.08 1.34 0.11 -1.26 -1.49 120.40 123.85 1ivz s VAL 66 Ca 0.12 0.51 -0.09 0.00 -2.93 0.00 0.00 61.98 59.58 1ivz s VAL 66 Cb -0.19 -3.66 -0.06 0.00 -1.53 0.00 0.00 36.38 30.94 1ivz s VAL 66 CO -0.18 -0.41 0.35 -0.07 -3.33 0.00 0.00 175.10 171.46 1ivz h LEU 67 N 13.50 -0.16 0.00 2.54 3.38 -0.78 -3.48 115.31 130.31 1ivz h LEU 67 Ca -0.34 -0.11 0.19 0.00 0.09 0.00 0.00 57.88 57.71 1ivz h LEU 67 Cb 1.17 0.04 -0.03 0.00 0.09 0.00 0.00 40.66 41.92 1ivz h LEU 67 CO 1.03 0.36 0.63 0.00 0.09 0.00 0.00 178.44 180.55 1ivz n ALA 68 N -2.73 -2.77 -2.30 1.53 0.00 -1.14 -5.03 120.51 108.06 1ivz n ALA 68 Ca -0.04 -0.94 -0.24 0.00 0.00 0.00 0.00 53.44 52.22 1ivz n ALA 68 Cb 0.13 0.47 -0.00 0.00 0.00 0.00 0.00 19.45 20.05 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 -2.22 1.88 0.04 0.00 0.08 -1.26 -0.67 117.98 115.84 1ivz s PHE 69 Ca 0.23 -0.73 -0.11 0.00 0.12 0.00 0.00 56.93 56.45 1ivz s PHE 69 Cb -0.02 -2.02 0.01 0.00 -0.57 0.00 0.00 43.02 40.42 1ivz s PHE 69 CO 0.04 -0.47 0.22 1.03 -0.10 0.00 0.00 175.22 175.94 1ivz s ARG 70 N -4.29 0.73 0.74 0.44 1.81 0.29 -4.88 118.95 113.80 1ivz s ARG 70 Ca 0.42 -0.62 -0.01 0.00 -1.72 0.00 0.00 55.73 53.80 1ivz s ARG 70 Cb -0.03 0.31 0.14 0.00 -0.45 0.00 0.00 34.95 34.92 1ivz s ARG 70 CO 0.25 -0.22 1.02 0.45 -0.68 0.00 0.00 175.30 176.13 1ivz s SER 71 N -2.12 4.21 -0.09 0.23 0.15 -1.26 0.34 113.70 115.15 1ivz s SER 71 Ca -0.04 -0.43 -0.06 0.00 0.70 0.00 0.00 55.95 56.12 1ivz s SER 71 Cb -0.01 0.12 0.04 0.00 -1.71 0.00 0.00 66.02 64.46 1ivz s SER 71 CO -0.04 -1.97 0.22 0.68 1.20 0.00 0.00 173.24 173.34 1ivz s VAL 72 N -3.19 -0.03 0.00 4.45 -7.23 -1.26 -4.59 120.40 108.55 1ivz s VAL 72 Ca 0.68 0.09 0.00 0.00 -1.81 0.00 0.00 61.98 60.94 1ivz s VAL 72 Cb -0.04 -0.34 0.00 0.00 0.56 0.00 0.00 36.38 36.56 1ivz s VAL 72 CO 0.45 0.04 0.73 -1.54 -0.31 0.00 0.00 175.10 174.47 1ivz n SER 73 N 3.74 0.00 -4.63 4.85 3.41 -1.26 -4.46 113.62 115.27 1ivz n SER 73 Ca -0.21 0.78 -0.43 0.00 -0.26 0.00 0.00 58.87 58.75 1ivz n SER 73 Cb 0.55 -0.34 -0.03 0.00 -0.26 0.00 0.00 64.21 64.13 1ivz n SER 73 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1ivz n ASN 74 N -1.52 3.70 -1.88 4.04 3.02 -1.26 -4.35 115.26 117.01 1ivz n ASN 74 Ca 0.00 0.59 0.00 0.00 -0.03 0.00 0.00 54.58 55.14 1ivz n ASN 74 Cb 0.00 -1.53 0.00 0.00 -0.61 0.00 0.00 39.78 37.64 1ivz n ASN 74 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 1ivz n ASN 75 N 9.36 -8.23 -2.07 6.41 5.15 -1.26 -4.82 115.26 119.80 1ivz n ASN 75 Ca 0.25 1.23 -0.20 0.00 -0.60 0.00 0.00 54.58 55.26 1ivz n ASN 75 Cb 0.42 -4.62 0.17 0.00 -0.53 0.00 0.00 39.78 35.22 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 1.62 3.73 -1.25 1.20 5.03 -1.26 -4.24 115.26 120.10 1ivz n ASN 76 Ca 0.00 -3.39 0.08 0.00 0.87 0.00 0.00 54.58 52.14 1ivz n ASN 76 Cb 0.00 -0.79 0.30 0.00 -1.02 0.00 0.00 39.78 38.27 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 -0.88 4.36 -4.14 6.41 2.85 -1.26 -3.71 115.26 118.89 1ivz n ASN 77 Ca 0.51 -2.69 -0.28 0.00 -0.11 0.00 0.00 54.58 52.02 1ivz n ASN 77 Cb 1.52 -0.53 -0.07 0.00 1.24 0.00 0.00 39.78 41.93 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 0.32 0.41 -3.65 1.20 -0.00 -1.26 -3.84 115.22 108.40 1ivz n HIS 78 Ca 0.22 -2.66 -0.05 0.00 -0.00 0.00 0.00 57.72 55.23 1ivz n HIS 78 Cb 0.88 -0.09 -0.06 0.00 -0.00 0.00 0.00 29.99 30.72 1ivz n HIS 78 CO 0.00 0.00 0.00 0.99 -0.00 0.00 0.00 176.34 177.33 1ivz s THR 79 N -3.07 -0.34 0.08 1.59 2.01 -1.22 -2.66 115.64 112.03 1ivz s THR 79 Ca 0.16 0.01 -0.28 0.00 0.31 0.00 0.00 61.69 61.89 1ivz s THR 79 Cb 0.01 -0.98 -0.05 0.00 0.01 0.00 0.00 72.50 71.49 1ivz s THR 79 CO 0.11 0.00 0.89 -0.83 -0.69 0.00 0.00 174.62 174.11 1ivz s GLY 80 N 2.06 2.92 -0.12 4.40 0.00 0.15 -0.53 107.32 116.20 1ivz s GLY 80 Ca -0.08 0.47 -0.06 0.00 0.00 0.00 0.00 44.72 45.04 1ivz s GLY 80 CO -0.19 1.35 0.09 0.14 0.00 0.00 0.00 173.10 174.49 1ivz s VAL 81 N 0.09 5.10 -0.65 1.40 1.01 -1.07 0.10 120.40 126.38 1ivz s VAL 81 Ca 0.44 0.06 0.05 0.00 0.00 0.00 0.00 61.98 62.54 1ivz s VAL 81 Cb -0.22 -3.22 0.20 0.00 0.00 0.00 0.00 36.38 33.14 1ivz s VAL 81 CO 0.27 0.59 0.57 0.47 0.00 0.00 0.00 175.10 177.00 1ivz n ASP 82 N 2.28 2.87 -4.39 3.32 9.92 0.16 -2.86 116.55 127.84 1ivz n ASP 82 Ca -0.19 -3.20 -0.16 0.00 -0.53 0.00 0.00 54.79 50.71 1ivz n ASP 82 Cb 0.54 -0.71 0.06 0.00 -0.64 0.00 0.00 41.12 40.37 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 1.63 1.71 -3.76 -2.24 3.41 0.87 -0.05 113.62 115.19 1ivz n SER 83 Ca 0.24 -2.25 -0.23 0.00 -0.26 0.00 0.00 58.87 56.38 1ivz n SER 83 Cb 0.39 -0.35 -0.18 0.00 -0.26 0.00 0.00 64.21 63.81 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 0.58 -1.14 1.04 1.98 -0.55 0.50 118.68 121.08 1ivz s LEU 84 Ca 0.50 -0.11 -0.22 0.00 -2.89 0.00 0.00 54.13 51.41 1ivz s LEU 84 Cb -0.04 -0.42 -0.03 0.00 0.66 0.00 0.00 46.19 46.36 1ivz s LEU 84 CO 0.32 -0.20 1.84 0.00 -1.89 0.00 0.00 176.35 176.41 1ivz s ASN 86 N 6.07 6.99 0.30 0.00 0.01 -0.80 -2.43 114.94 125.08 1ivz s ASN 86 Ca 0.63 2.49 0.03 0.00 -0.71 0.00 0.00 52.86 55.30 1ivz s ASN 86 Cb -0.01 -2.64 -0.01 0.00 0.41 0.00 0.00 41.25 39.01 1ivz s ASN 86 CO 0.07 -0.36 0.10 0.49 -1.51 0.00 0.00 177.10 175.89 1ivz n PHE 87 N 1.06 0.11 -2.84 2.20 3.01 -1.09 -3.34 117.46 116.57 1ivz n PHE 87 Ca -0.00 -1.89 -0.23 0.00 1.01 0.00 0.00 57.45 56.34 1ivz n PHE 87 Cb 0.43 -0.01 0.02 0.00 -0.01 0.00 0.00 39.48 39.91 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 -2.82 5.65 0.23 4.37 0.01 -0.26 -4.50 113.70 116.38 1ivz s SER 88 Ca 0.15 0.24 0.03 0.00 1.31 0.00 0.00 55.95 57.67 1ivz s SER 88 Cb 0.01 -1.36 0.25 0.00 0.21 0.00 0.00 66.02 65.13 1ivz s SER 88 CO 0.10 -0.86 1.57 1.55 0.41 0.00 0.00 173.24 176.02 1ivz h PRO 89 N 0.25 0.33 -0.15 12.44 0.13 -1.89 -3.06 132.00 140.06 1ivz h PRO 89 Ca -0.45 -0.21 0.01 0.00 -0.87 0.00 0.00 66.00 64.48 1ivz h PRO 89 Cb 1.27 0.02 -0.01 0.00 0.13 0.00 0.00 31.00 32.41 1ivz h PRO 89 CO 0.56 0.79 0.10 -0.07 -0.23 0.00 0.00 178.00 179.15 1ivz h LEU 90 N 0.25 0.14-10.18 1.56 4.07 -1.96 -3.39 115.31 105.81 1ivz h LEU 90 Ca 0.00 -0.00 -0.47 0.00 0.08 0.00 0.00 57.88 57.49 1ivz h LEU 90 Cb 1.04 -0.03 0.21 0.00 1.08 0.00 0.00 40.66 42.96 1ivz h LEU 90 CO 0.09 0.10 0.08 0.00 -1.08 0.00 0.00 178.44 177.63 1ivz s ALA 91 N -5.19 0.14 0.00 1.53 0.00 -1.16 -4.89 121.76 112.19 1ivz s ALA 91 Ca -0.06 0.17 0.00 0.00 0.00 0.00 0.00 51.96 52.07 1ivz s ALA 91 Cb 0.17 -3.34 0.00 0.00 0.00 0.00 0.00 23.12 19.95 1ivz s ALA 91 CO 0.69 -3.54 0.00 -2.13 0.00 0.00 0.00 175.76 170.78 1ivz n ARG 92 N -4.74 0.00 -1.42 0.00 0.63 -1.26 -4.90 116.66 104.96 1ivz n ARG 92 Ca 0.06 0.00 -0.29 0.00 -0.92 0.00 0.00 57.85 56.70 1ivz n ARG 92 Cb 0.53 0.00 0.01 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 -0.50 2.39 -4.08 -0.14 5.12 -1.26 -4.90 116.66 113.29 1ivz n ARG 93 Ca 0.00 -2.59 -0.34 0.00 -1.93 0.00 0.00 57.85 52.99 1ivz n ARG 93 Cb 0.00 -2.08 -0.14 0.00 -1.16 0.00 0.00 32.46 29.08 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 -3.32 3.23 0.25 1.55 1.01 -1.26 -5.11 120.40 116.74 1ivz s VAL 94 Ca 0.52 -0.55 0.05 0.00 0.00 0.00 0.00 61.98 62.00 1ivz s VAL 94 Cb 0.39 -2.44 -0.03 0.00 0.00 0.00 0.00 36.38 34.29 1ivz s VAL 94 CO -0.18 0.45 0.35 -1.81 0.00 0.00 0.00 175.10 173.91 1ivz s ASP 95 N 1.24 6.21 0.42 3.32 1.01 -1.26 -5.00 116.67 122.61 1ivz s ASP 95 Ca 0.03 0.02 0.11 0.00 0.71 0.00 0.00 52.55 53.42 1ivz s ASP 95 Cb -0.14 -1.77 0.91 0.00 1.01 0.00 0.00 42.92 42.93 1ivz s ASP 95 CO -0.03 -0.09 1.99 0.08 0.21 0.00 0.00 175.17 177.33 1ivz h ARG 96 N 1.18 0.19 0.00 8.23 0.11 -1.92 -1.89 114.38 120.28 1ivz h ARG 96 Ca -0.51 -0.03 -0.05 0.00 0.10 0.00 0.00 59.98 59.48 1ivz h ARG 96 Cb 1.23 -0.03 -0.01 0.00 1.11 0.00 0.00 29.97 32.27 1ivz h ARG 96 CO 0.60 0.28 -0.26 0.28 0.10 0.00 0.00 179.97 180.97 1ivz h VAL 97 N 0.19 1.06 0.71 0.08 2.07 -1.95 -2.37 116.25 116.05 1ivz h VAL 97 Ca 0.04 -0.93 -0.03 0.00 0.82 0.00 0.00 66.70 66.60 1ivz h VAL 97 Cb 0.25 1.52 0.01 0.00 -1.52 0.00 0.00 31.29 31.54 1ivz h VAL 97 CO 0.01 0.26 -0.34 0.00 0.02 0.00 0.00 177.57 177.52 1ivz h ALA 98 N 1.74 -1.25 0.00 1.67 0.00 -1.74 0.65 119.26 120.33 1ivz h ALA 98 Ca -0.00 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.70 1ivz h ALA 98 Cb 0.50 0.37 0.00 0.00 0.00 0.00 0.00 17.79 18.65 1ivz h ALA 98 CO 0.03 -1.18 0.00 0.82 0.00 0.00 0.00 179.25 178.92 1ivz h ILE 99 N -0.95 0.00 0.09 0.00 2.04 -1.63 -0.50 117.51 116.56 1ivz h ILE 99 Ca -0.10 -0.20 -0.17 0.00 1.00 0.00 0.00 64.86 65.40 1ivz h ILE 99 Cb 0.73 1.16 0.01 0.00 -0.74 0.00 0.00 36.82 37.97 1ivz h ILE 99 CO 0.16 0.00 -0.80 0.22 0.00 0.00 0.00 178.15 177.73 1ivz h TYR 100 N 0.00 0.35 0.00 1.37 3.20 -1.09 -2.18 116.97 118.62 1ivz h TYR 100 Ca 0.00 -0.26 -0.12 0.00 3.14 0.00 0.00 58.73 61.50 1ivz h TYR 100 Cb 0.20 -0.01 -0.02 0.00 1.54 0.00 0.00 36.73 38.44 1ivz h TYR 100 CO 0.00 1.31 -0.56 0.93 -1.64 0.00 0.00 178.16 178.19 1ivz h GLU 101 N -0.55 0.00 0.01 1.82 5.08 0.60 -2.29 114.58 119.25 1ivz h GLU 101 Ca -0.16 0.00 -0.24 0.00 -1.00 0.00 0.00 59.36 57.95 1ivz h GLU 101 Cb 1.49 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 30.71 1ivz h GLU 101 CO 0.07 0.56 -1.27 1.49 -1.00 0.00 0.00 179.01 178.86 1ivz h GLU 102 N 0.00 0.02 0.00 2.33 4.81 -1.22 -2.63 114.58 117.88 1ivz h GLU 102 Ca -0.01 -0.03 -0.15 0.00 -0.13 0.00 0.00 59.36 59.04 1ivz h GLU 102 Cb 1.05 0.01 -0.02 0.00 0.63 0.00 0.00 28.75 30.42 1ivz h GLU 102 CO 0.07 0.84 -0.73 0.35 -0.73 0.00 0.00 179.01 178.81 1ivz h PHE 103 N 0.00 0.00 0.17 0.92 3.57 -1.33 -2.94 116.94 117.33 1ivz h PHE 103 Ca -0.12 0.00 -0.34 0.00 3.53 0.00 0.00 57.97 61.05 1ivz h PHE 103 Cb 1.87 0.00 0.01 0.00 2.79 0.00 0.00 35.95 40.62 1ivz h PHE 103 CO 0.00 0.73 -1.65 -0.07 -2.23 0.00 0.00 178.31 175.09 1ivz h LEU 104 N 0.00 0.57 0.15 0.59 3.38 -1.50 -3.19 115.31 115.31 1ivz h LEU 104 Ca -0.01 -0.80 -0.01 0.00 0.09 0.00 0.00 57.88 57.15 1ivz h LEU 104 Cb 1.38 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 41.95 1ivz h LEU 104 CO 0.09 1.67 -0.07 -0.09 0.09 0.00 0.00 178.44 180.13 1ivz h ARG 105 N 0.10 -0.20 0.00 1.13 2.43 -1.54 0.87 114.38 117.17 1ivz h ARG 105 Ca -0.30 0.01 -0.02 0.00 -0.81 0.00 0.00 59.98 58.87 1ivz h ARG 105 Cb 2.08 0.05 -0.00 0.00 -0.42 0.00 0.00 29.97 31.68 1ivz h ARG 105 CO 0.19 -0.06 -0.08 1.98 -1.51 0.00 0.00 179.97 180.48 1ivz h MET 106 N -0.29 0.00 -0.97 0.20 4.05 -1.68 -1.81 114.93 114.42 1ivz h MET 106 Ca -0.02 0.00 -0.41 0.00 -0.28 0.00 0.00 59.70 58.99 1ivz h MET 106 Cb 0.23 0.00 -0.24 0.00 -0.80 0.00 0.00 31.60 30.78 1ivz h MET 106 CO 0.03 0.08 0.52 0.25 0.23 0.00 0.00 176.91 178.03 1ivz n THR 107 N -3.74 2.84 -3.54 -0.77 -2.24 -0.95 -4.91 114.28 100.98 1ivz n THR 107 Ca -0.02 -1.60 -0.26 0.00 -2.27 0.00 0.00 64.05 59.90 1ivz n THR 107 Cb 0.19 -0.53 0.05 0.00 -2.10 0.00 0.00 70.33 67.94 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 -0.80 -2.09 -3.19 4.78 8.25 -0.68 -0.25 115.22 121.24 1ivz n HIS 108 Ca 0.49 0.60 -0.21 0.00 -0.26 0.00 0.00 57.72 58.34 1ivz n HIS 108 Cb 1.47 -3.70 0.05 0.00 1.12 0.00 0.00 29.99 28.93 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 -2.87 -5.80 -2.98 0.41 3.02 0.28 -3.56 115.26 103.75 1ivz n ASN 109 Ca -0.10 -0.36 -0.00 0.00 -0.03 0.00 0.00 54.58 54.09 1ivz n ASN 109 Cb 0.60 -4.53 0.00 0.00 -0.61 0.00 0.00 39.78 35.25 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 -1.64 -1.20 1.20 7.41 0.00 0.31 -4.56 105.19 106.71 1ivz n GLY 110 Ca -0.05 0.45 0.00 0.00 0.00 0.00 0.00 46.02 46.42 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 -1.71 0.00 -3.80 2.61 -2.24 0.66 -2.13 114.28 107.68 1ivz n THR 111 Ca 0.00 0.00 -0.30 0.00 -2.27 0.00 0.00 64.05 61.48 1ivz n THR 111 Cb 0.50 -0.28 -0.15 0.00 -2.10 0.00 0.00 70.33 68.31 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 -1.60 0.95 -1.08 -0.78 0.74 -0.97 -0.69 119.66 116.23 1ivz s GLN 112 Ca 0.00 -1.36 -0.18 0.00 0.05 0.00 0.00 55.36 53.87 1ivz s GLN 112 Cb 0.00 -2.30 0.11 0.00 1.10 0.00 0.00 33.01 31.92 1ivz s GLN 112 CO 0.00 -1.00 1.38 -1.17 -0.55 0.00 0.00 175.29 173.95 1ivz s LEU 113 N 1.31 4.49 0.00 3.68 1.98 -0.55 -4.59 118.68 125.00 1ivz s LEU 113 Ca 0.11 -2.20 0.00 0.00 -2.89 0.00 0.00 54.13 49.15 1ivz s LEU 113 Cb -0.18 -2.47 0.00 0.00 0.66 0.00 0.00 46.19 44.20 1ivz s LEU 113 CO -0.19 -1.11 0.00 0.18 -1.89 0.00 0.00 176.35 173.35 1ivz n LEU 114 N 7.17 0.00 -1.23 -0.68 4.77 -1.26 -0.95 117.00 124.83 1ivz n LEU 114 Ca 0.33 0.00 0.04 0.00 -0.03 0.00 0.00 56.01 56.35 1ivz n LEU 114 Cb 0.47 0.00 0.09 0.00 -2.33 0.00 0.00 43.42 41.65 1ivz n LEU 114 CO 0.61 0.00 0.17 0.59 -1.33 0.00 0.00 177.39 177.43 1ivz n ASN 115 N 1.47 1.34 -3.35 -1.43 4.13 -1.26 -4.98 115.26 111.19 1ivz n ASN 115 Ca 0.00 -2.71 -0.13 0.00 1.68 0.00 0.00 54.58 53.42 1ivz n ASN 115 Cb 0.00 -0.39 -0.07 0.00 -1.54 0.00 0.00 39.78 37.78 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 -1.34 -0.70 0.04 3.10 0.40 -0.12 -5.12 117.98 114.24 1ivz s PHE 116 Ca 0.36 -0.08 -0.30 0.00 -0.60 0.00 0.00 56.93 56.30 1ivz s PHE 116 Cb 0.38 -0.30 -0.08 0.00 0.51 0.00 0.00 43.02 43.54 1ivz s PHE 116 CO -0.13 -0.97 1.68 0.95 0.70 0.00 0.00 175.22 177.45 1ivz s THR 117 N 2.24 3.17 0.09 0.64 -4.23 -1.26 -1.49 115.64 114.80 1ivz s THR 117 Ca 0.11 0.50 0.01 0.00 -1.18 0.00 0.00 61.69 61.14 1ivz s THR 117 Cb -0.13 -3.32 -0.04 0.00 1.34 0.00 0.00 72.50 70.34 1ivz s THR 117 CO -0.25 -0.02 -0.06 -1.48 -0.54 0.00 0.00 174.62 172.27 1ivz s LEU 118 N 3.13 2.48 0.89 4.79 0.05 0.13 -0.43 118.68 129.71 1ivz s LEU 118 Ca 0.75 -0.95 -0.12 0.00 0.05 0.00 0.00 54.13 53.86 1ivz s LEU 118 Cb -0.38 -0.05 0.12 0.00 -2.05 0.00 0.00 46.19 43.83 1ivz s LEU 118 CO 0.32 -0.45 1.11 -0.62 -0.55 0.00 0.00 176.35 176.16 1ivz s ASP 119 N -2.86 3.65 -0.19 1.48 -1.08 -1.15 -2.87 116.67 113.65 1ivz s ASP 119 Ca 0.09 1.23 -0.09 0.00 -0.52 0.00 0.00 52.55 53.25 1ivz s ASP 119 Cb 0.04 -1.89 -0.09 0.00 -1.46 0.00 0.00 42.92 39.52 1ivz s ASP 119 CO -0.05 -2.50 -0.24 -1.14 0.52 0.00 0.00 175.17 171.76 1ivz n ARG 120 N -3.76 0.41 0.05 4.34 0.00 -0.90 -4.31 116.66 112.49 1ivz n ARG 120 Ca 0.07 0.18 0.12 0.00 -0.00 0.00 0.00 57.85 58.21 1ivz n ARG 120 Cb 0.57 -1.20 0.59 0.00 0.00 0.00 0.00 32.46 32.42 1ivz n ARG 120 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 177.63 179.20 1ivz h LYS 121 N -0.64 0.18 -0.02 -0.14 2.10 -1.91 0.18 116.57 116.31 1ivz h LYS 121 Ca -0.49 -0.01 -0.11 0.00 -2.00 0.00 0.00 60.65 58.04 1ivz h LYS 121 Cb 1.44 -0.04 -0.02 0.00 -0.90 0.00 0.00 32.23 32.72 1ivz h LYS 121 CO -0.28 0.12 -0.52 0.66 -2.00 0.00 0.00 179.45 177.42 1ivz h SER 122 N 0.18 0.05 -4.00 7.07 4.64 -1.94 -3.44 113.55 116.11 1ivz h SER 122 Ca 0.17 -0.03 -0.55 0.00 -0.47 0.00 0.00 61.79 60.92 1ivz h SER 122 Cb 0.46 -0.02 0.12 0.00 -0.31 0.00 0.00 62.40 62.65 1ivz h SER 122 CO -0.03 0.56 0.69 -0.69 -0.87 0.00 0.00 176.83 176.50 1ivz s VAL 123 N -3.86 2.04 -0.29 0.95 1.01 0.05 -4.46 120.40 115.84 1ivz s VAL 123 Ca -0.02 0.04 -0.19 0.00 0.00 0.00 0.00 61.98 61.80 1ivz s VAL 123 Cb 0.13 -3.02 0.15 0.00 0.00 0.00 0.00 36.38 33.64 1ivz s VAL 123 CO 0.76 0.00 1.08 0.12 0.00 0.00 0.00 175.10 177.06 1ivz s PHE 124 N -1.21 -0.43 -0.03 5.22 2.19 0.69 -4.95 117.98 119.45 1ivz s PHE 124 Ca 0.63 0.91 0.02 0.00 0.33 0.00 0.00 56.93 58.82 1ivz s PHE 124 Cb -0.44 0.33 0.01 0.00 -1.31 0.00 0.00 43.02 41.61 1ivz s PHE 124 CO 0.55 -0.21 -0.09 0.54 1.83 0.00 0.00 175.22 177.84 1ivz s VAL 125 N 0.87 0.81 0.42 3.12 0.11 -1.26 -1.78 120.40 122.69 1ivz s VAL 125 Ca -0.04 -0.35 0.04 0.00 -2.93 0.00 0.00 61.98 58.69 1ivz s VAL 125 Cb -0.04 -0.73 -0.04 0.00 -1.53 0.00 0.00 36.38 34.04 1ivz s VAL 125 CO -0.12 0.26 0.05 -0.62 -3.33 0.00 0.00 175.10 171.34 1ivz s ASP 126 N 0.32 3.35 -0.40 3.54 -1.08 -0.85 -4.77 116.67 116.77 1ivz s ASP 126 Ca -0.05 -1.54 -0.25 0.00 -0.52 0.00 0.00 52.55 50.19 1ivz s ASP 126 Cb -0.10 0.18 0.02 0.00 -1.46 0.00 0.00 42.92 41.56 1ivz s ASP 126 CO 0.01 -0.73 0.88 -0.44 0.52 0.00 0.00 175.17 175.41 1ivz s SER 127 N -3.69 6.57 0.00 -0.34 0.01 -1.26 -0.44 113.70 114.56 1ivz s SER 127 Ca 0.23 0.34 0.00 0.00 1.31 0.00 0.00 55.95 57.83 1ivz s SER 127 Cb 0.05 -2.44 0.00 0.00 0.21 0.00 0.00 66.02 63.85 1ivz s SER 127 CO 0.12 -0.89 0.00 0.61 0.41 0.00 0.00 173.24 173.49 1ivz n GLY 128 N 4.63 -1.68 3.70 3.44 0.00 0.09 -4.82 105.19 110.54 1ivz n GLY 128 Ca 0.05 -1.24 -0.42 0.00 0.00 0.00 0.00 46.02 44.41 1ivz n GLY 128 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1ivz s PRO 129 N 0.00 4.31 -0.20 1.61 0.04 -1.26 -4.92 135.00 134.58 1ivz s PRO 129 Ca 0.00 2.01 -0.00 0.00 0.04 0.00 0.00 61.00 63.04 1ivz s PRO 129 Cb 0.00 -3.43 0.05 0.00 0.04 0.00 0.00 34.50 31.16 1ivz s PRO 129 CO 0.00 -0.50 -0.05 -1.12 0.04 0.00 0.00 177.00 175.37 1ivz s SER 130 N 1.54 3.31 -0.11 6.66 0.01 -1.26 -4.51 113.70 119.34 1ivz s SER 130 Ca 0.64 -0.91 -0.08 0.00 1.31 0.00 0.00 55.95 56.91 1ivz s SER 130 Cb -0.34 -1.01 0.03 0.00 0.21 0.00 0.00 66.02 64.91 1ivz s SER 130 CO 0.28 -0.22 0.16 -0.24 0.41 0.00 0.00 173.24 173.64 1ivz n SER 131 N 4.80 -3.65 0.00 2.44 2.88 -1.26 -5.08 113.62 113.74 1ivz n SER 131 Ca -0.12 1.52 0.00 0.00 -1.33 0.00 0.00 58.87 58.94 1ivz n SER 131 Cb 0.46 -5.21 0.00 0.00 -0.75 0.00 0.00 64.21 58.71 1ivz n SER 131 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42