#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 5.49 -4.42 1.61 3.41 -1.26 -4.94 113.62 113.51 1ivz n SER 2 Ca 0.00 -3.77 -0.44 0.00 -0.26 0.00 0.00 58.87 54.40 1ivz n SER 2 Cb 0.00 -0.64 -0.03 0.00 -0.26 0.00 0.00 64.21 63.28 1ivz n SER 2 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 1ivz s SER 3 N -2.69 6.47 0.00 4.04 1.04 -1.26 -4.57 113.70 116.73 1ivz s SER 3 Ca 0.55 -1.80 0.00 0.00 0.48 0.00 0.00 55.95 55.19 1ivz s SER 3 Cb 0.45 -2.37 0.00 0.00 0.10 0.00 0.00 66.02 64.20 1ivz s SER 3 CO 0.02 -1.10 0.00 0.61 0.98 0.00 0.00 173.24 173.75 1ivz n GLY 4 N 5.27 -0.01 3.79 7.32 0.00 -1.26 -4.99 105.19 115.30 1ivz n GLY 4 Ca 0.11 -0.09 -0.26 0.00 0.00 0.00 0.00 46.02 45.79 1ivz n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1ivz s SER 5 N 0.00 4.48 -0.61 1.61 0.15 -1.26 -5.06 113.70 113.00 1ivz s SER 5 Ca 0.00 -1.17 -0.27 0.00 0.70 0.00 0.00 55.95 55.20 1ivz s SER 5 Cb 0.00 -0.14 0.01 0.00 -1.71 0.00 0.00 66.02 64.18 1ivz s SER 5 CO 0.00 -0.73 1.52 -0.55 1.20 0.00 0.00 173.24 174.68 1ivz s SER 6 N -4.01 5.89 0.00 5.45 0.15 -1.26 -4.73 113.70 115.19 1ivz s SER 6 Ca 0.35 0.15 0.00 0.00 0.70 0.00 0.00 55.95 57.15 1ivz s SER 6 Cb 0.02 -2.54 0.00 0.00 -1.71 0.00 0.00 66.02 61.78 1ivz s SER 6 CO 0.20 -1.93 0.00 0.61 1.20 0.00 0.00 173.24 173.32 1ivz n GLY 7 N 5.42 3.35 3.33 9.45 0.00 -1.26 -5.19 105.19 120.29 1ivz n GLY 7 Ca 0.13 -0.46 -0.25 0.00 0.00 0.00 0.00 46.02 45.44 1ivz n GLY 7 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1ivz n SER 8 N 0.00 1.28 -1.43 1.61 2.88 -1.26 -5.11 113.62 111.58 1ivz n SER 8 Ca 0.00 -3.15 0.18 0.00 -1.33 0.00 0.00 58.87 54.57 1ivz n SER 8 Cb 0.00 1.01 -0.07 0.00 -0.75 0.00 0.00 64.21 64.39 1ivz n SER 8 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 1ivz n SER 9 N -1.52 -8.47 -1.97 -3.46 2.88 -1.26 -5.02 113.62 94.80 1ivz n SER 9 Ca -0.06 1.11 0.00 0.00 -1.33 0.00 0.00 58.87 58.59 1ivz n SER 9 Cb 0.61 -4.70 0.00 0.00 -0.75 0.00 0.00 64.21 59.37 1ivz n SER 9 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 1ivz n SER 10 N -4.31 -8.40 -1.41 -3.46 7.64 -1.26 -4.95 113.62 97.47 1ivz n SER 10 Ca -0.05 1.32 0.17 0.00 1.01 0.00 0.00 58.87 61.32 1ivz n SER 10 Cb 0.67 -4.72 -0.09 0.00 -1.01 0.00 0.00 64.21 59.06 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 1.72 -7.74 -3.92 6.43 7.64 -1.26 -5.03 113.62 111.47 1ivz n SER 11 Ca 0.00 1.40 -0.09 0.00 1.01 0.00 0.00 58.87 61.19 1ivz n SER 11 Cb 0.00 -4.84 -0.09 0.00 -1.01 0.00 0.00 64.21 58.27 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 -4.20 0.69 -0.15 1.43 0.00 -1.26 -5.05 119.66 111.13 1ivz s GLN 12 Ca 0.00 -0.88 -0.04 0.00 -0.00 0.00 0.00 55.36 54.44 1ivz s GLN 12 Cb 0.00 0.27 0.05 0.00 0.00 0.00 0.00 33.01 33.34 1ivz s GLN 12 CO 0.00 -0.19 0.06 -1.01 0.00 0.00 0.00 175.29 174.15 1ivz s HIS 13 N -3.25 0.46 -0.28 9.60 3.76 -1.26 -2.90 115.29 121.43 1ivz s HIS 13 Ca 0.00 -0.37 -0.08 0.00 -0.15 0.00 0.00 55.06 54.47 1ivz s HIS 13 Cb 0.02 -0.77 -0.01 0.00 1.11 0.00 0.00 32.58 32.93 1ivz s HIS 13 CO -0.08 -0.47 0.09 -0.06 -0.85 0.00 0.00 174.74 173.37 1ivz s PHE 14 N 2.04 3.13 -0.29 1.40 0.08 -1.18 0.12 117.98 123.28 1ivz s PHE 14 Ca 0.02 -0.63 -0.28 0.00 0.12 0.00 0.00 56.93 56.16 1ivz s PHE 14 Cb -0.15 -2.27 -0.06 0.00 -0.57 0.00 0.00 43.02 39.96 1ivz s PHE 14 CO -0.07 -0.45 2.27 0.09 -0.10 0.00 0.00 175.22 176.95 1ivz n ASN 15 N 4.92 2.95 -4.72 1.36 4.13 -0.62 0.37 115.26 123.67 1ivz n ASN 15 Ca -0.15 0.08 -0.39 0.00 1.68 0.00 0.00 54.58 55.79 1ivz n ASN 15 Cb 0.50 -1.53 -0.05 0.00 -1.54 0.00 0.00 39.78 37.16 1ivz n ASN 15 CO 0.00 0.00 0.00 -0.22 0.28 0.00 0.00 177.26 177.32 1ivz s LEU 16 N 9.03 4.31 -0.10 3.41 2.96 0.30 -2.87 118.68 135.72 1ivz s LEU 16 Ca 1.02 1.11 -0.11 0.00 -0.22 0.00 0.00 54.13 55.93 1ivz s LEU 16 Cb -0.36 -3.01 0.03 0.00 0.50 0.00 0.00 46.19 43.36 1ivz s LEU 16 CO 0.35 -0.10 0.30 0.20 -1.32 0.00 0.00 176.35 175.78 1ivz s ASN 17 N 0.77 -0.30 -0.30 3.68 0.01 -0.84 -0.18 114.94 117.78 1ivz s ASN 17 Ca 0.35 0.55 -0.18 0.00 -0.71 0.00 0.00 52.86 52.86 1ivz s ASN 17 Cb -0.17 0.58 0.18 0.00 0.41 0.00 0.00 41.25 42.25 1ivz s ASN 17 CO 0.16 -0.14 1.25 0.72 -1.51 0.00 0.00 177.10 177.58 1ivz s PHE 18 N 0.00 -0.09 0.13 2.20 -0.71 -1.14 -0.81 117.98 117.56 1ivz s PHE 18 Ca -0.01 0.11 -0.31 0.00 -1.04 0.00 0.00 56.93 55.68 1ivz s PHE 18 Cb -0.02 0.04 -0.08 0.00 -1.21 0.00 0.00 43.02 41.75 1ivz s PHE 18 CO 0.01 -0.05 1.34 0.99 -1.34 0.00 0.00 175.22 176.17 1ivz s THR 19 N 2.71 3.38 -0.57 -4.49 2.01 -1.26 -2.79 115.64 114.63 1ivz s THR 19 Ca -0.07 1.02 -0.19 0.00 0.31 0.00 0.00 61.69 62.76 1ivz s THR 19 Cb -0.06 -3.66 0.09 0.00 0.01 0.00 0.00 72.50 68.88 1ivz s THR 19 CO -0.10 0.10 0.70 -0.63 -0.69 0.00 0.00 174.62 174.00 1ivz s ILE 20 N 0.85 4.80 0.56 1.82 1.01 -0.73 -3.09 121.20 126.42 1ivz s ILE 20 Ca 0.62 -0.79 0.26 0.00 0.00 0.00 0.00 60.65 60.74 1ivz s ILE 20 Cb -0.36 -4.45 0.37 0.00 0.01 0.00 0.00 42.46 38.04 1ivz s ILE 20 CO 0.32 -1.05 2.03 0.71 0.00 0.00 0.00 174.94 176.94 1ivz h THR 21 N 5.91 0.60 -2.22 2.92 1.35 -1.87 -2.59 112.91 117.00 1ivz h THR 21 Ca -0.29 0.00 -0.79 0.00 -0.55 0.00 0.00 66.41 64.78 1ivz h THR 21 Cb 1.09 0.77 -0.28 0.00 -1.73 0.00 0.00 68.15 68.00 1ivz h THR 21 CO 1.07 0.00 0.93 -3.20 -0.25 0.00 0.00 175.52 174.07 1ivz n ASN 22 N -4.08 7.19 -3.12 5.36 5.15 -0.71 -4.71 115.26 120.35 1ivz n ASN 22 Ca 0.06 -3.70 0.01 0.00 -0.60 0.00 0.00 54.58 50.34 1ivz n ASN 22 Cb 0.49 -1.12 -0.01 0.00 -0.53 0.00 0.00 39.78 38.61 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 -4.26 -1.36 0.86 1.20 1.98 -0.98 -4.77 118.68 111.36 1ivz s LEU 23 Ca 0.41 -0.75 -0.14 0.00 -2.89 0.00 0.00 54.13 50.77 1ivz s LEU 23 Cb 0.22 1.74 0.03 0.00 0.66 0.00 0.00 46.19 48.84 1ivz s LEU 23 CO -0.16 -0.14 0.63 -2.65 -1.89 0.00 0.00 176.35 172.14 1ivz n PRO 24 N 4.22 -0.06 -3.80 0.98 -0.02 -1.23 -3.47 135.00 131.62 1ivz n PRO 24 Ca 0.11 0.04 -0.32 0.00 -2.02 0.00 0.00 63.50 61.30 1ivz n PRO 24 Cb 0.58 -1.99 -0.10 0.00 -0.02 0.00 0.00 33.50 31.97 1ivz n PRO 24 CO 0.00 0.00 0.00 -0.47 1.98 0.00 0.00 175.50 177.01 1ivz s TYR 25 N -2.23 3.61 0.65 6.00 6.14 -1.18 -4.77 117.35 125.56 1ivz s TYR 25 Ca 0.63 -3.14 0.00 0.00 0.64 0.00 0.00 57.07 55.20 1ivz s TYR 25 Cb -0.26 -2.96 0.09 0.00 0.42 0.00 0.00 41.96 39.24 1ivz s TYR 25 CO 0.61 -0.67 0.90 -1.54 0.64 0.00 0.00 175.55 175.49 1ivz s SER 26 N -0.62 4.75 0.54 4.32 1.04 -1.26 -4.89 113.70 117.58 1ivz s SER 26 Ca 0.24 -0.23 0.19 0.00 0.48 0.00 0.00 55.95 56.63 1ivz s SER 26 Cb -0.10 -0.36 1.39 0.00 0.10 0.00 0.00 66.02 67.05 1ivz s SER 26 CO -0.11 -1.55 2.17 1.56 0.98 0.00 0.00 173.24 176.29 1ivz h GLN 27 N -0.26 0.00 -0.08 4.02 1.08 -2.00 -2.52 115.11 115.34 1ivz h GLN 27 Ca -0.38 0.00 0.02 0.00 -1.45 0.00 0.00 58.65 56.83 1ivz h GLN 27 Cb 1.28 0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 28.69 1ivz h GLN 27 CO 0.45 0.00 -0.03 -0.44 -0.95 0.00 0.00 178.83 177.87 1ivz h ASP 28 N 0.00 -0.09 0.06 1.46 3.32 -1.94 -1.75 116.42 117.48 1ivz h ASP 28 Ca -0.00 0.03 -0.01 0.00 0.02 0.00 0.00 57.03 57.07 1ivz h ASP 28 Cb 0.00 0.06 -0.00 0.00 0.22 0.00 0.00 39.33 39.61 1ivz h ASP 28 CO 0.00 -0.03 -0.05 0.40 -1.72 0.00 0.00 179.24 177.84 1ivz h ILE 29 N -0.01 0.95 0.00 0.35 1.08 -1.76 -1.00 117.51 117.12 1ivz h ILE 29 Ca 0.04 -0.17 -0.03 0.00 -0.39 0.00 0.00 64.86 64.31 1ivz h ILE 29 Cb 0.07 1.09 -0.00 0.00 -3.07 0.00 0.00 36.82 34.91 1ivz h ILE 29 CO -0.09 0.05 -0.14 0.00 -0.69 0.00 0.00 178.15 177.28 1ivz h ALA 30 N 1.95 1.21 -3.25 1.87 0.00 -1.25 -3.41 119.26 116.39 1ivz h ALA 30 Ca -0.00 -0.13 -0.53 0.00 0.00 0.00 0.00 54.91 54.25 1ivz h ALA 30 Cb 0.09 -0.02 -0.38 0.00 0.00 0.00 0.00 17.79 17.48 1ivz h ALA 30 CO 0.01 0.18 -0.79 -0.65 0.00 0.00 0.00 179.25 177.99 1ivz s GLN 31 N -4.06 1.36 0.64 0.00 -1.52 -0.38 -5.00 119.66 110.71 1ivz s GLN 31 Ca -0.02 -0.34 0.33 0.00 -1.95 0.00 0.00 55.36 53.38 1ivz s GLN 31 Cb 0.12 -1.73 1.82 0.00 -0.22 0.00 0.00 33.01 33.01 1ivz s GLN 31 CO 0.59 -0.36 2.07 -1.35 -0.25 0.00 0.00 175.29 176.00 1ivz h PRO 32 N 8.17 0.00 -0.78 2.91 0.11 -1.79 -1.89 132.00 138.73 1ivz h PRO 32 Ca -0.26 0.00 0.23 0.00 0.11 0.00 0.00 66.00 66.08 1ivz h PRO 32 Cb 1.12 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.20 1ivz h PRO 32 CO 0.39 0.00 0.58 1.03 -0.21 0.00 0.00 178.00 179.79 1ivz h SER 33 N 0.00 0.00 -4.20 -2.05 0.87 -1.95 -3.41 113.55 102.82 1ivz h SER 33 Ca 0.04 0.00 -0.48 0.00 -1.23 0.00 0.00 61.79 60.11 1ivz h SER 33 Cb 0.51 0.00 0.07 0.00 -0.44 0.00 0.00 62.40 62.54 1ivz h SER 33 CO -0.00 0.00 0.33 0.42 -0.53 0.00 0.00 176.83 177.05 1ivz s THR 34 N -4.94 3.37 0.05 2.23 -4.23 -0.71 -5.00 115.64 106.41 1ivz s THR 34 Ca -0.05 0.26 0.09 0.00 -1.18 0.00 0.00 61.69 60.81 1ivz s THR 34 Cb 0.20 -3.41 -0.17 0.00 1.34 0.00 0.00 72.50 70.46 1ivz s THR 34 CO 0.74 -0.50 1.22 0.74 -0.54 0.00 0.00 174.62 176.27 1ivz h THR 35 N -0.53 1.46 -0.27 3.99 2.02 -1.88 -3.25 112.91 114.44 1ivz h THR 35 Ca -0.45 -3.13 0.08 0.00 0.77 0.00 0.00 66.41 63.68 1ivz h THR 35 Cb 1.26 2.71 -0.01 0.00 -1.74 0.00 0.00 68.15 70.38 1ivz h THR 35 CO 0.63 0.83 0.22 0.50 0.37 0.00 0.00 175.52 178.07 1ivz h LYS 36 N 0.00 0.00 0.07 6.66 3.64 -1.92 0.40 116.57 125.42 1ivz h LYS 36 Ca -0.05 0.00 -0.20 0.00 -1.27 0.00 0.00 60.65 59.13 1ivz h LYS 36 Cb 1.74 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 33.56 1ivz h LYS 36 CO 0.11 0.00 -1.02 -0.92 -2.27 0.00 0.00 179.45 175.35 1ivz h TYR 37 N 0.00 0.29 -0.05 1.91 5.03 -1.77 -3.02 116.97 119.35 1ivz h TYR 37 Ca 0.13 -0.21 -0.07 0.00 2.58 0.00 0.00 58.73 61.16 1ivz h TYR 37 Cb 0.57 -0.01 -0.01 0.00 1.55 0.00 0.00 36.73 38.83 1ivz h TYR 37 CO 0.00 1.40 -0.28 1.96 -1.32 0.00 0.00 178.16 179.92 1ivz h GLN 38 N -0.58 0.10 0.22 1.82 4.20 -1.45 -1.30 115.11 118.11 1ivz h GLN 38 Ca -0.23 -0.03 -0.01 0.00 0.06 0.00 0.00 58.65 58.44 1ivz h GLN 38 Cb 1.51 -0.01 0.00 0.00 0.30 0.00 0.00 27.48 29.28 1ivz h GLN 38 CO 0.01 0.37 -0.10 1.96 -0.67 0.00 0.00 178.83 180.40 1ivz h GLN 39 N 0.09 -0.28 -0.88 1.46 1.08 -0.36 -2.75 115.11 113.47 1ivz h GLN 39 Ca 0.01 0.02 0.03 0.00 -1.45 0.00 0.00 58.65 57.26 1ivz h GLN 39 Cb 0.54 0.06 -0.05 0.00 -0.05 0.00 0.00 27.48 27.99 1ivz h GLN 39 CO 0.04 0.09 0.58 1.15 -0.95 0.00 0.00 178.83 179.74 1ivz h THR 40 N -0.90 1.17 0.12 -0.54 2.02 -1.51 0.72 112.91 113.97 1ivz h THR 40 Ca -0.03 -0.39 -0.00 0.00 0.77 0.00 0.00 66.41 66.76 1ivz h THR 40 Cb 0.50 -0.06 -0.00 0.00 -1.74 0.00 0.00 68.15 66.85 1ivz h THR 40 CO 0.05 0.21 -0.06 0.50 0.37 0.00 0.00 175.52 176.58 1ivz h LYS 41 N 1.13 -0.16 -0.45 6.66 3.64 -1.30 -0.70 116.57 125.38 1ivz h LYS 41 Ca 0.34 0.01 -0.12 0.00 -1.27 0.00 0.00 60.65 59.62 1ivz h LYS 41 Cb -0.02 0.04 -0.02 0.00 -0.41 0.00 0.00 32.23 31.82 1ivz h LYS 41 CO -0.10 -0.11 -0.19 -0.09 -2.27 0.00 0.00 179.45 176.70 1ivz h ARG 42 N -0.17 0.87 -0.17 1.90 2.43 -1.16 -0.59 114.38 117.50 1ivz h ARG 42 Ca -0.01 -0.34 0.01 0.00 -0.81 0.00 0.00 59.98 58.82 1ivz h ARG 42 Cb 0.14 -0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 29.63 1ivz h ARG 42 CO 0.02 0.99 0.10 1.03 -1.51 0.00 0.00 179.97 180.59 1ivz h SER 43 N 0.77 0.15 0.08 -3.80 0.87 -0.66 0.19 113.55 111.15 1ivz h SER 43 Ca 0.11 0.00 -0.00 0.00 -1.23 0.00 0.00 61.79 60.67 1ivz h SER 43 Cb 0.72 -0.03 0.00 0.00 -0.44 0.00 0.00 62.40 62.65 1ivz h SER 43 CO 0.06 0.12 -0.04 0.40 -0.53 0.00 0.00 176.83 176.83 1ivz h ILE 44 N 0.20 1.18 -0.46 2.23 2.04 -1.08 -1.66 117.51 119.95 1ivz h ILE 44 Ca 0.07 -1.12 0.08 0.00 1.00 0.00 0.00 64.86 64.88 1ivz h ILE 44 Cb -0.00 1.89 -0.03 0.00 -0.74 0.00 0.00 36.82 37.94 1ivz h ILE 44 CO -0.03 0.27 0.31 -0.08 0.00 0.00 0.00 178.15 178.62 1ivz h GLU 45 N -0.64 0.29 0.02 2.37 4.22 -1.08 -1.02 114.58 118.74 1ivz h GLU 45 Ca -0.01 -0.02 -0.26 0.00 0.08 0.00 0.00 59.36 59.15 1ivz h GLU 45 Cb 0.52 -0.07 0.02 0.00 0.50 0.00 0.00 28.75 29.72 1ivz h GLU 45 CO 0.02 0.19 -1.04 -0.97 -2.18 0.00 0.00 179.01 175.03 1ivz h ASN 46 N 0.30 0.78 -0.28 1.04 -1.24 -0.60 -2.83 115.58 112.76 1ivz h ASN 46 Ca 0.21 -0.64 -0.08 0.00 0.71 0.00 0.00 56.30 56.50 1ivz h ASN 46 Cb 0.43 -0.24 -0.02 0.00 0.73 0.00 0.00 38.32 39.23 1ivz h ASN 46 CO -0.05 1.45 -0.08 0.00 -1.29 0.00 0.00 177.43 177.46 1ivz h ALA 47 N 0.50 1.12 -0.02 1.57 0.00 -0.29 -2.68 119.26 119.45 1ivz h ALA 47 Ca -0.12 -0.28 -0.14 0.00 0.00 0.00 0.00 54.91 54.37 1ivz h ALA 47 Cb 1.69 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 19.30 1ivz h ALA 47 CO 0.20 0.55 -0.63 -0.07 0.00 0.00 0.00 179.25 179.29 1ivz h LEU 48 N 0.62 0.10 0.75 0.00 3.38 -1.27 -2.87 115.31 116.03 1ivz h LEU 48 Ca 0.11 -0.06 -0.04 0.00 0.09 0.00 0.00 57.88 57.99 1ivz h LEU 48 Cb 0.51 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.23 1ivz h LEU 48 CO 0.03 0.71 -0.40 -1.13 0.09 0.00 0.00 178.44 177.74 1ivz h ASN 49 N 0.06 -0.98 -0.16 -0.43 -0.73 -1.21 -1.96 115.58 110.17 1ivz h ASN 49 Ca -0.01 0.04 0.04 0.00 1.87 0.00 0.00 56.30 58.25 1ivz h ASN 49 Cb 1.13 0.27 -0.01 0.00 0.27 0.00 0.00 38.32 39.98 1ivz h ASN 49 CO 0.09 -0.65 0.11 0.06 -0.37 0.00 0.00 177.43 176.67 1ivz h GLN 50 N -1.06 0.02 -0.06 6.67 3.07 -1.62 -0.66 115.11 121.47 1ivz h GLN 50 Ca -0.10 -0.00 -0.06 0.00 0.09 0.00 0.00 58.65 58.58 1ivz h GLN 50 Cb 0.83 -0.00 -0.01 0.00 0.08 0.00 0.00 27.48 28.37 1ivz h GLN 50 CO 0.14 0.01 -0.25 1.25 0.09 0.00 0.00 178.83 180.08 1ivz h LEU 51 N 0.02 0.09 -0.25 0.06 6.46 -1.24 -2.08 115.31 118.37 1ivz h LEU 51 Ca 0.07 -0.02 -0.21 0.00 -0.12 0.00 0.00 57.88 57.61 1ivz h LEU 51 Cb 0.28 -0.03 0.00 0.00 -0.73 0.00 0.00 40.66 40.19 1ivz h LEU 51 CO -0.00 0.35 -0.69 -0.26 -0.62 0.00 0.00 178.44 177.22 1ivz h PHE 52 N 0.09 1.02 0.00 1.25 0.04 -0.35 -3.04 116.94 115.95 1ivz h PHE 52 Ca 0.01 -0.42 0.00 0.00 2.80 0.00 0.00 57.97 60.37 1ivz h PHE 52 Cb 0.49 -0.17 0.00 0.00 2.20 0.00 0.00 35.95 38.47 1ivz h PHE 52 CO 0.00 1.24 0.00 0.00 -0.60 0.00 0.00 178.31 178.95 1ivz h ARG 53 N 0.56 0.00 -0.76 1.51 3.08 -1.36 -3.06 114.38 114.35 1ivz h ARG 53 Ca -0.03 0.00 -0.47 0.00 0.07 0.00 0.00 59.98 59.55 1ivz h ARG 53 Cb 1.30 0.00 -0.26 0.00 0.08 0.00 0.00 29.97 31.09 1ivz h ARG 53 CO 0.14 0.00 0.25 0.09 -1.07 0.00 0.00 179.97 179.38 1ivz n ASN 54 N -2.96 4.74 -4.40 7.04 3.02 -0.81 -4.88 115.26 117.00 1ivz n ASN 54 Ca 0.02 -3.75 -0.20 0.00 -0.03 0.00 0.00 54.58 50.63 1ivz n ASN 54 Cb 0.36 -0.74 -0.10 0.00 -0.61 0.00 0.00 39.78 38.69 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 -2.22 2.05 0.39 6.41 1.04 -1.15 -4.98 113.70 115.23 1ivz s SER 55 Ca 0.55 -1.35 0.13 0.00 0.48 0.00 0.00 55.95 55.76 1ivz s SER 55 Cb 0.46 -0.02 0.78 0.00 0.10 0.00 0.00 66.02 67.34 1ivz s SER 55 CO 0.03 -0.61 1.86 0.28 0.98 0.00 0.00 173.24 175.78 1ivz h SER 56 N 2.23 0.00 -1.77 7.02 0.02 -1.92 -3.02 113.55 116.11 1ivz h SER 56 Ca -0.40 -0.00 -0.72 0.00 -0.84 0.00 0.00 61.79 59.83 1ivz h SER 56 Cb 1.24 -0.00 -0.26 0.00 0.14 0.00 0.00 62.40 63.52 1ivz h SER 56 CO 0.67 0.33 0.95 2.30 -1.14 0.00 0.00 176.83 179.94 1ivz n ILE 57 N -4.15 3.55 -0.98 3.27 -5.35 -1.26 -4.69 119.36 109.76 1ivz n ILE 57 Ca -0.02 -3.98 -0.23 0.00 -0.27 0.00 0.00 62.75 58.26 1ivz n ILE 57 Cb 0.37 -1.28 0.06 0.00 -1.74 0.00 0.00 39.64 37.05 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 -0.36 2.10 0.00 6.28 2.85 -1.14 -3.37 118.16 124.51 1ivz n LYS 58 Ca 0.54 -2.20 0.00 0.00 -1.05 0.00 0.00 58.31 55.60 1ivz n LYS 58 Cb 0.31 -1.86 0.00 0.00 -0.65 0.00 0.00 35.03 32.83 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 -0.20 0.25 0.02 -5.58 2.88 -1.26 -4.87 113.62 104.85 1ivz n SER 59 Ca 0.42 0.00 -0.09 0.00 -1.33 0.00 0.00 58.87 57.87 1ivz n SER 59 Cb 0.71 0.00 -0.13 0.00 -0.75 0.00 0.00 64.21 64.04 1ivz n SER 59 CO 0.00 0.00 0.00 1.88 -1.23 0.00 0.00 175.04 175.69 1ivz h TYR 60 N 0.00 0.07 -2.64 0.66 0.05 -1.95 -3.46 116.97 109.70 1ivz h TYR 60 Ca 0.00 -0.05 -0.54 0.00 0.05 0.00 0.00 58.73 58.19 1ivz h TYR 60 Cb 0.20 -0.00 0.02 0.00 1.01 0.00 0.00 36.73 37.96 1ivz h TYR 60 CO 0.00 1.07 1.04 0.12 -1.05 0.00 0.00 178.16 179.34 1ivz s PHE 61 N -2.64 2.22 -0.09 4.88 2.19 -1.22 -0.99 117.98 122.33 1ivz s PHE 61 Ca -0.03 0.22 -0.05 0.00 0.33 0.00 0.00 56.93 57.39 1ivz s PHE 61 Cb 0.09 -3.99 -0.02 0.00 -1.31 0.00 0.00 43.02 37.79 1ivz s PHE 61 CO 0.83 -4.04 -0.10 1.03 1.83 0.00 0.00 175.22 174.76 1ivz h SER 62 N 8.78 0.00 -1.78 6.13 0.87 -1.80 -3.44 113.55 122.30 1ivz h SER 62 Ca -0.43 0.00 0.22 0.00 -1.23 0.00 0.00 61.79 60.36 1ivz h SER 62 Cb 1.20 0.00 -0.04 0.00 -0.44 0.00 0.00 62.40 63.12 1ivz h SER 62 CO 0.94 0.49 0.62 -0.67 -0.53 0.00 0.00 176.83 177.67 1ivz n ASP 63 N -3.86 -1.03 -4.58 6.23 -0.08 -0.99 -4.99 116.55 107.24 1ivz n ASP 63 Ca -0.04 -1.34 -0.26 0.00 -1.51 0.00 0.00 54.79 51.65 1ivz n ASP 63 Cb 0.16 1.63 -0.09 0.00 2.34 0.00 0.00 41.12 45.15 1ivz n ASP 63 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1ivz s GLN 65 N -3.10 0.73 -0.47 0.00 0.74 -1.08 -4.93 119.66 111.55 1ivz s GLN 65 Ca 0.27 -1.36 -0.27 0.00 0.05 0.00 0.00 55.36 54.05 1ivz s GLN 65 Cb -0.08 -1.69 -0.04 0.00 1.10 0.00 0.00 33.01 32.31 1ivz s GLN 65 CO 0.16 -1.13 2.03 0.54 -0.55 0.00 0.00 175.29 176.35 1ivz s VAL 66 N 1.12 3.25 0.02 1.34 0.11 -1.26 -2.03 120.40 122.94 1ivz s VAL 66 Ca 0.15 0.20 -0.14 0.00 -2.93 0.00 0.00 61.98 59.26 1ivz s VAL 66 Cb -0.21 -3.52 -0.08 0.00 -1.53 0.00 0.00 36.38 31.04 1ivz s VAL 66 CO -0.09 -0.45 1.18 -0.07 -3.33 0.00 0.00 175.10 172.34 1ivz h LEU 67 N 16.49 -0.42 0.00 2.54 3.38 0.34 -3.47 115.31 134.17 1ivz h LEU 67 Ca -0.29 0.01 0.02 0.00 0.09 0.00 0.00 57.88 57.71 1ivz h LEU 67 Cb 1.20 0.11 -0.00 0.00 0.09 0.00 0.00 40.66 42.06 1ivz h LEU 67 CO 1.13 -0.30 0.17 0.00 0.09 0.00 0.00 178.44 179.53 1ivz n ALA 68 N -2.25 -0.91 -3.50 1.53 0.00 -1.12 -5.04 120.51 109.22 1ivz n ALA 68 Ca -0.06 -0.51 -0.35 0.00 0.00 0.00 0.00 53.44 52.51 1ivz n ALA 68 Cb 0.20 0.37 -0.14 0.00 0.00 0.00 0.00 19.45 19.88 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 -5.45 3.06 0.35 0.00 0.08 -1.26 -1.66 117.98 113.09 1ivz s PHE 69 Ca 0.08 -1.21 -0.26 0.00 0.12 0.00 0.00 56.93 55.66 1ivz s PHE 69 Cb -0.02 -2.13 -0.10 0.00 -0.57 0.00 0.00 43.02 40.21 1ivz s PHE 69 CO 0.04 -0.63 1.00 0.50 -0.10 0.00 0.00 175.22 176.03 1ivz s ARG 70 N 1.42 4.44 -0.10 0.44 6.06 0.23 -4.84 118.95 126.61 1ivz s ARG 70 Ca 0.02 1.44 -0.01 0.00 -2.50 0.00 0.00 55.73 54.68 1ivz s ARG 70 Cb -0.16 -2.75 -0.03 0.00 0.06 0.00 0.00 34.95 32.07 1ivz s ARG 70 CO -0.02 0.13 -0.03 0.45 -2.50 0.00 0.00 175.30 173.32 1ivz s SER 71 N -1.52 4.90 -0.06 -2.12 0.15 -1.26 -0.19 113.70 113.60 1ivz s SER 71 Ca 0.52 0.01 -0.04 0.00 0.70 0.00 0.00 55.95 57.13 1ivz s SER 71 Cb -0.21 -1.46 -0.04 0.00 -1.71 0.00 0.00 66.02 62.60 1ivz s SER 71 CO 0.27 0.31 0.15 0.68 1.20 0.00 0.00 173.24 175.85 1ivz s VAL 72 N -0.49 5.39 0.07 4.45 -7.23 -1.26 -4.96 120.40 116.38 1ivz s VAL 72 Ca 0.08 -0.02 0.09 0.00 -1.81 0.00 0.00 61.98 60.32 1ivz s VAL 72 Cb -0.12 -3.44 -0.20 0.00 0.56 0.00 0.00 36.38 33.18 1ivz s VAL 72 CO 0.02 0.46 1.15 0.28 -0.31 0.00 0.00 175.10 176.70 1ivz h SER 73 N 4.38 0.00 0.20 4.85 0.02 -2.02 -3.38 113.55 117.60 1ivz h SER 73 Ca -0.52 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 60.43 1ivz h SER 73 Cb 1.21 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.74 1ivz h SER 73 CO 0.63 0.97 -0.12 -1.13 -1.14 0.00 0.00 176.83 176.04 1ivz h ASN 74 N 0.00 -0.31 -4.32 3.07 -1.24 -2.05 -3.44 115.58 107.29 1ivz h ASN 74 Ca -0.07 0.02 -0.70 0.00 0.71 0.00 0.00 56.30 56.26 1ivz h ASN 74 Cb 1.80 0.09 -0.27 0.00 0.73 0.00 0.00 38.32 40.68 1ivz h ASN 74 CO 0.11 -0.19 -0.88 0.20 -1.29 0.00 0.00 177.43 175.38 1ivz s ASN 75 N -2.61 3.16 -0.44 1.15 -0.87 -1.26 -5.03 114.94 109.04 1ivz s ASN 75 Ca -0.05 -0.59 0.03 0.00 -1.57 0.00 0.00 52.86 50.69 1ivz s ASN 75 Cb 0.01 -0.29 0.61 0.00 -0.02 0.00 0.00 41.25 41.56 1ivz s ASN 75 CO 0.15 0.26 1.88 0.59 -2.57 0.00 0.00 177.10 177.41 1ivz n ASN 76 N 1.80 4.10 -0.19 -1.22 5.03 -1.26 -4.13 115.26 119.39 1ivz n ASN 76 Ca -0.17 -3.53 0.06 0.00 0.87 0.00 0.00 54.58 51.81 1ivz n ASN 76 Cb 0.52 -0.84 0.08 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 -1.02 1.51 -4.10 6.41 2.85 -1.26 -3.10 115.26 116.55 1ivz n ASN 77 Ca 0.57 -2.59 -0.26 0.00 -0.11 0.00 0.00 54.58 52.19 1ivz n ASN 77 Cb 1.51 -0.31 -0.06 0.00 1.24 0.00 0.00 39.78 42.16 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 -0.87 0.80 -3.15 1.20 8.25 -1.23 -3.53 115.22 116.70 1ivz n HIS 78 Ca 0.09 -2.15 0.04 0.00 -0.26 0.00 0.00 57.72 55.45 1ivz n HIS 78 Cb 0.62 -0.22 -0.00 0.00 1.12 0.00 0.00 29.99 31.51 1ivz n HIS 78 CO 0.00 0.00 0.00 0.99 0.64 0.00 0.00 176.34 177.97 1ivz s THR 79 N -2.62 -0.89 -0.69 1.59 2.01 -1.23 -3.78 115.64 110.03 1ivz s THR 79 Ca 0.04 0.00 -0.26 0.00 0.31 0.00 0.00 61.69 61.78 1ivz s THR 79 Cb 0.00 -0.93 -0.01 0.00 0.01 0.00 0.00 72.50 71.57 1ivz s THR 79 CO 0.03 0.00 1.77 -0.83 -0.69 0.00 0.00 174.62 174.90 1ivz s GLY 80 N 2.86 0.34 0.24 4.40 0.00 0.73 -1.77 107.32 114.11 1ivz s GLY 80 Ca 0.14 -0.95 -0.31 0.00 0.00 0.00 0.00 44.72 43.61 1ivz s GLY 80 CO -0.23 3.29 1.62 0.14 0.00 0.00 0.00 173.10 177.92 1ivz s VAL 81 N 8.58 2.20 -0.67 1.40 1.01 -1.12 0.77 120.40 132.57 1ivz s VAL 81 Ca 0.62 0.15 0.05 0.00 0.00 0.00 0.00 61.98 62.80 1ivz s VAL 81 Cb -0.11 -3.10 0.18 0.00 0.00 0.00 0.00 36.38 33.35 1ivz s VAL 81 CO 0.16 0.02 0.50 0.47 0.00 0.00 0.00 175.10 176.25 1ivz n ASP 82 N 3.11 2.68 -4.94 3.32 9.92 -0.66 -2.87 116.55 127.11 1ivz n ASP 82 Ca 0.12 -3.14 -0.22 0.00 -0.53 0.00 0.00 54.79 51.02 1ivz n ASP 82 Cb 0.37 -0.73 0.01 0.00 -0.64 0.00 0.00 41.12 40.13 1ivz n ASP 82 CO 0.00 0.00 0.00 -0.94 0.13 0.00 0.00 177.20 176.39 1ivz s SER 83 N -1.39 4.97 -0.15 -2.24 1.04 0.75 0.10 113.70 116.78 1ivz s SER 83 Ca 0.27 -0.92 -0.02 0.00 0.48 0.00 0.00 55.95 55.76 1ivz s SER 83 Cb -0.01 -0.00 0.05 0.00 0.10 0.00 0.00 66.02 66.15 1ivz s SER 83 CO -0.16 -1.00 0.02 -0.22 0.98 0.00 0.00 173.24 172.85 1ivz s LEU 84 N -4.35 0.99 -1.11 2.42 1.98 -0.86 0.11 118.68 117.87 1ivz s LEU 84 Ca 0.48 -0.55 -0.25 0.00 -2.89 0.00 0.00 54.13 50.92 1ivz s LEU 84 Cb -0.04 -0.57 -0.15 0.00 0.66 0.00 0.00 46.19 46.10 1ivz s LEU 84 CO 0.29 -0.26 2.04 0.00 -1.89 0.00 0.00 176.35 176.53 1ivz s ASN 86 N 7.70 6.89 0.12 0.00 0.01 -0.64 -3.09 114.94 125.93 1ivz s ASN 86 Ca 0.75 2.18 0.09 0.00 -0.71 0.00 0.00 52.86 55.17 1ivz s ASN 86 Cb -0.04 -2.57 -0.04 0.00 0.41 0.00 0.00 41.25 39.01 1ivz s ASN 86 CO 0.14 -0.64 -0.19 -0.36 -1.51 0.00 0.00 177.10 174.54 1ivz s PHE 87 N 1.59 2.50 0.88 2.20 0.40 -1.14 -2.34 117.98 122.07 1ivz s PHE 87 Ca 0.63 -0.28 -0.12 0.00 -0.60 0.00 0.00 56.93 56.56 1ivz s PHE 87 Cb -0.33 -1.33 0.12 0.00 0.51 0.00 0.00 43.02 41.99 1ivz s PHE 87 CO 0.28 0.39 1.10 -1.12 0.70 0.00 0.00 175.22 176.57 1ivz s SER 88 N -2.17 3.62 0.40 1.36 0.01 -0.16 -4.26 113.70 112.50 1ivz s SER 88 Ca 0.18 1.39 0.07 0.00 1.31 0.00 0.00 55.95 58.90 1ivz s SER 88 Cb -0.10 -2.08 0.82 0.00 0.21 0.00 0.00 66.02 64.87 1ivz s SER 88 CO 0.10 -2.53 2.01 1.55 0.41 0.00 0.00 173.24 174.78 1ivz h PRO 89 N -1.48 0.47 0.00 12.44 0.13 -1.96 -1.76 132.00 139.85 1ivz h PRO 89 Ca -0.49 -0.05 -0.01 0.00 -0.87 0.00 0.00 66.00 64.58 1ivz h PRO 89 Cb 1.29 -0.10 -0.00 0.00 0.13 0.00 0.00 31.00 32.32 1ivz h PRO 89 CO 0.56 0.38 -0.03 -0.07 -0.23 0.00 0.00 178.00 178.62 1ivz h LEU 90 N 0.48 0.00-10.08 1.56 4.07 -1.92 -3.37 115.31 106.05 1ivz h LEU 90 Ca 0.12 0.00 -0.53 0.00 0.08 0.00 0.00 57.88 57.55 1ivz h LEU 90 Cb 0.07 0.00 0.20 0.00 1.08 0.00 0.00 40.66 42.01 1ivz h LEU 90 CO -0.02 0.03 -0.00 0.00 -1.08 0.00 0.00 178.44 177.37 1ivz n ALA 91 N -2.41 -1.13 0.00 1.53 0.00 -0.66 -4.85 120.51 112.99 1ivz n ALA 91 Ca -0.03 -0.49 0.00 0.00 0.00 0.00 0.00 53.44 52.92 1ivz n ALA 91 Cb 0.11 -2.08 0.00 0.00 0.00 0.00 0.00 19.45 17.48 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 -3.06 0.00 -1.51 0.00 3.00 -1.26 -4.62 116.66 109.21 1ivz n ARG 92 Ca 0.11 0.00 -0.31 0.00 -0.00 0.00 0.00 57.85 57.65 1ivz n ARG 92 Cb 0.52 0.00 -0.06 0.00 0.00 0.00 0.00 32.46 32.92 1ivz n ARG 92 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.63 178.17 1ivz n ARG 93 N -0.62 3.35 -3.89 -0.14 3.00 -1.26 -4.85 116.66 112.25 1ivz n ARG 93 Ca 0.00 -2.40 -0.14 0.00 -0.01 0.00 0.00 57.85 55.30 1ivz n ARG 93 Cb 0.00 -2.43 -0.15 0.00 0.00 0.00 0.00 32.46 29.88 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 -0.17 0.07 0.07 1.55 1.01 -1.26 -5.06 120.40 116.60 1ivz s VAL 94 Ca 0.62 0.05 -0.00 0.00 0.00 0.00 0.00 61.98 62.64 1ivz s VAL 94 Cb 0.26 -0.12 -0.00 0.00 0.00 0.00 0.00 36.38 36.52 1ivz s VAL 94 CO -0.10 0.06 -0.01 0.47 0.00 0.00 0.00 175.10 175.53 1ivz n ASP 95 N 3.56 0.86 0.00 3.32 9.92 -1.26 -5.08 116.55 127.87 1ivz n ASP 95 Ca -0.19 0.11 0.00 0.00 -0.53 0.00 0.00 54.79 54.18 1ivz n ASP 95 Cb 0.55 -0.27 0.00 0.00 -0.64 0.00 0.00 41.12 40.76 1ivz n ASP 95 CO 0.00 0.00 0.00 -2.11 0.13 0.00 0.00 177.20 175.22 1ivz n ARG 96 N -3.27 0.00 0.27 -1.24 1.85 -1.26 -4.58 116.66 108.43 1ivz n ARG 96 Ca -0.00 0.00 0.12 0.00 -1.00 0.00 0.00 57.85 56.96 1ivz n ARG 96 Cb 0.01 0.00 0.76 0.00 -1.05 0.00 0.00 32.46 32.18 1ivz n ARG 96 CO 0.00 0.00 0.00 0.28 -0.01 0.00 0.00 177.63 177.90 1ivz h VAL 97 N 0.00 0.73 0.60 8.89 2.07 -1.98 -2.28 116.25 124.28 1ivz h VAL 97 Ca 0.00 -0.19 -0.03 0.00 0.82 0.00 0.00 66.70 67.30 1ivz h VAL 97 Cb 0.00 1.11 -0.00 0.00 -1.52 0.00 0.00 31.29 30.88 1ivz h VAL 97 CO 0.00 0.05 -0.35 0.00 0.02 0.00 0.00 177.57 177.29 1ivz h ALA 98 N 1.95 -1.19 0.00 1.67 0.00 -1.97 0.73 119.26 120.45 1ivz h ALA 98 Ca -0.00 -0.19 -0.02 0.00 0.00 0.00 0.00 54.91 54.70 1ivz h ALA 98 Cb 0.11 0.44 -0.00 0.00 0.00 0.00 0.00 17.79 18.34 1ivz h ALA 98 CO 0.01 -1.15 -0.09 0.82 0.00 0.00 0.00 179.25 178.83 1ivz h ILE 99 N -0.89 0.46 0.03 0.00 2.04 -1.95 0.10 117.51 117.31 1ivz h ILE 99 Ca -0.08 -0.46 -0.13 0.00 1.00 0.00 0.00 64.86 65.19 1ivz h ILE 99 Cb 0.70 1.31 0.01 0.00 -0.74 0.00 0.00 36.82 38.11 1ivz h ILE 99 CO 0.10 0.09 -0.54 0.22 0.00 0.00 0.00 178.15 178.02 1ivz h TYR 100 N 0.00 0.49 -0.08 1.37 3.20 -1.08 -2.75 116.97 118.11 1ivz h TYR 100 Ca -0.00 -0.29 -0.11 0.00 3.14 0.00 0.00 58.73 61.47 1ivz h TYR 100 Cb 0.31 -0.05 0.01 0.00 1.54 0.00 0.00 36.73 38.53 1ivz h TYR 100 CO 0.00 1.13 -0.40 0.93 -1.64 0.00 0.00 178.16 178.18 1ivz h GLU 101 N -0.29 0.41 -0.80 1.82 5.08 0.75 -1.87 114.58 119.68 1ivz h GLU 101 Ca -0.08 -0.33 0.04 0.00 -1.00 0.00 0.00 59.36 57.99 1ivz h GLU 101 Cb 1.30 0.07 -0.05 0.00 0.50 0.00 0.00 28.75 30.57 1ivz h GLU 101 CO 0.11 0.97 0.52 0.93 -1.00 0.00 0.00 179.01 180.54 1ivz h GLU 102 N -0.06 0.92 -0.06 2.33 3.07 -0.94 -0.07 114.58 119.78 1ivz h GLU 102 Ca -0.03 -0.06 -0.09 0.00 -0.50 0.00 0.00 59.36 58.69 1ivz h GLU 102 Cb 1.05 -0.21 0.00 0.00 -0.84 0.00 0.00 28.75 28.76 1ivz h GLU 102 CO 0.08 0.61 -0.31 0.35 -1.40 0.00 0.00 179.01 178.35 1ivz h PHE 103 N 0.95 0.42 -0.44 4.33 3.57 -1.50 -2.88 116.94 121.39 1ivz h PHE 103 Ca 0.32 -0.19 0.00 0.00 3.53 0.00 0.00 57.97 61.64 1ivz h PHE 103 Cb 0.09 -0.06 -0.02 0.00 2.79 0.00 0.00 35.95 38.75 1ivz h PHE 103 CO -0.00 0.93 0.29 -0.07 -2.23 0.00 0.00 178.31 177.23 1ivz h LEU 104 N -0.20 0.51 -0.89 0.59 3.38 -0.96 0.55 115.31 118.28 1ivz h LEU 104 Ca -0.02 -0.01 -0.11 0.00 0.09 0.00 0.00 57.88 57.82 1ivz h LEU 104 Cb 0.97 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 41.57 1ivz h LEU 104 CO 0.06 0.37 -0.54 -0.09 0.09 0.00 0.00 178.44 178.33 1ivz h ARG 105 N 0.60 0.00 0.00 1.13 2.43 -1.02 0.18 114.38 117.69 1ivz h ARG 105 Ca 0.16 0.00 -0.17 0.00 -0.81 0.00 0.00 59.98 59.17 1ivz h ARG 105 Cb -0.07 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 29.45 1ivz h ARG 105 CO -0.03 0.54 -1.48 -0.12 -1.51 0.00 0.00 179.97 177.37 1ivz n MET 106 N -3.85 0.63 -0.71 0.20 1.56 -0.55 -3.97 117.12 110.43 1ivz n MET 106 Ca -0.01 0.19 0.03 0.00 -0.27 0.00 0.00 57.70 57.64 1ivz n MET 106 Cb 0.56 -1.78 0.30 0.00 2.15 0.00 0.00 33.22 34.45 1ivz n MET 106 CO 0.00 0.00 0.00 0.25 -0.73 0.00 0.00 175.97 175.49 1ivz n THR 107 N -2.84 2.17 -3.14 1.12 -2.24 0.18 -4.68 114.28 104.85 1ivz n THR 107 Ca -0.10 -1.11 -0.17 0.00 -2.27 0.00 0.00 64.05 60.40 1ivz n THR 107 Cb 0.83 -0.35 0.02 0.00 -2.10 0.00 0.00 70.33 68.73 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 0.38 -3.09 -2.15 4.78 -0.00 -1.05 -1.19 115.22 112.91 1ivz n HIS 108 Ca 0.23 1.25 -0.19 0.00 0.46 0.00 0.00 57.72 59.47 1ivz n HIS 108 Cb 1.02 -3.33 -0.03 0.00 -0.12 0.00 0.00 29.99 27.52 1ivz n HIS 108 CO 0.00 0.00 0.00 -1.71 0.46 0.00 0.00 176.34 175.09 1ivz n ASN 109 N -0.65 -5.35 -3.47 0.26 5.15 0.61 -2.18 115.26 109.63 1ivz n ASN 109 Ca 0.01 0.16 -0.18 0.00 -0.60 0.00 0.00 54.58 53.97 1ivz n ASN 109 Cb 0.55 -4.55 0.08 0.00 -0.53 0.00 0.00 39.78 35.33 1ivz n ASN 109 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1ivz n GLY 110 N -0.79 -0.36 0.00 8.20 0.00 -1.07 -4.79 105.19 106.39 1ivz n GLY 110 Ca -0.22 0.11 0.00 0.00 0.00 0.00 0.00 46.02 45.91 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 -4.14 0.00 -3.81 2.61 -2.24 -0.33 -2.61 114.28 103.76 1ivz n THR 111 Ca -0.29 0.00 -0.30 0.00 -2.27 0.00 0.00 64.05 61.19 1ivz n THR 111 Cb 0.67 -0.41 -0.15 0.00 -2.10 0.00 0.00 70.33 68.33 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 -1.74 1.00 -0.87 -0.78 0.74 -0.48 -0.05 119.66 117.48 1ivz s GLN 112 Ca 0.00 -1.02 -0.24 0.00 0.05 0.00 0.00 55.36 54.15 1ivz s GLN 112 Cb 0.00 -2.29 0.06 0.00 1.10 0.00 0.00 33.01 31.88 1ivz s GLN 112 CO 0.00 -0.82 1.28 -1.17 -0.55 0.00 0.00 175.29 174.03 1ivz s LEU 113 N 1.53 3.74 0.00 3.68 1.98 0.16 -4.30 118.68 125.47 1ivz s LEU 113 Ca 0.04 -1.15 0.00 0.00 -2.89 0.00 0.00 54.13 50.13 1ivz s LEU 113 Cb -0.18 -2.52 0.00 0.00 0.66 0.00 0.00 46.19 44.15 1ivz s LEU 113 CO -0.16 -1.54 0.00 0.18 -1.89 0.00 0.00 176.35 172.94 1ivz n LEU 114 N 8.54 0.00 0.00 -0.68 4.77 -1.26 -1.44 117.00 126.93 1ivz n LEU 114 Ca 0.17 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.15 1ivz n LEU 114 Cb 0.49 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.58 1ivz n LEU 114 CO 0.65 0.00 -0.49 0.59 -1.33 0.00 0.00 177.39 176.81 1ivz n ASN 115 N 1.48 4.09 -4.70 -1.43 5.03 -1.26 -5.02 115.26 113.45 1ivz n ASN 115 Ca 0.00 0.00 -0.42 0.00 0.87 0.00 0.00 54.58 55.03 1ivz n ASN 115 Cb 0.00 0.07 -0.03 0.00 -1.02 0.00 0.00 39.78 38.81 1ivz n ASN 115 CO 0.00 0.00 0.00 -0.36 -1.83 0.00 0.00 177.26 175.07 1ivz s PHE 116 N -1.99 3.39 -0.29 3.10 0.40 -0.52 -5.01 117.98 117.07 1ivz s PHE 116 Ca 0.00 1.39 -0.19 0.00 -0.60 0.00 0.00 56.93 57.52 1ivz s PHE 116 Cb 0.00 -3.33 -0.01 0.00 0.51 0.00 0.00 43.02 40.19 1ivz s PHE 116 CO 0.00 -0.88 0.59 0.95 0.70 0.00 0.00 175.22 176.58 1ivz s THR 117 N 1.68 4.99 0.19 0.64 -4.23 -1.26 0.35 115.64 118.00 1ivz s THR 117 Ca 0.55 0.87 0.07 0.00 -1.18 0.00 0.00 61.69 61.99 1ivz s THR 117 Cb -0.24 -3.94 -0.05 0.00 1.34 0.00 0.00 72.50 69.61 1ivz s THR 117 CO 0.24 -0.06 -0.12 -1.48 -0.54 0.00 0.00 174.62 172.66 1ivz s LEU 118 N 2.50 2.53 1.33 4.79 0.05 0.92 -1.74 118.68 129.06 1ivz s LEU 118 Ca 0.24 -1.03 -0.21 0.00 0.05 0.00 0.00 54.13 53.17 1ivz s LEU 118 Cb -0.15 -0.57 0.33 0.00 -2.05 0.00 0.00 46.19 43.76 1ivz s LEU 118 CO 0.11 -0.24 1.00 -0.62 -0.55 0.00 0.00 176.35 176.05 1ivz s ASP 119 N -3.28 -0.27 -0.03 1.48 2.15 -1.18 -3.89 116.67 111.66 1ivz s ASP 119 Ca 0.21 0.77 -0.00 0.00 0.43 0.00 0.00 52.55 53.96 1ivz s ASP 119 Cb 0.01 -1.08 -0.02 0.00 -0.30 0.00 0.00 42.92 41.53 1ivz s ASP 119 CO 0.05 -4.87 -0.03 -1.14 -0.17 0.00 0.00 175.17 169.02 1ivz n ARG 120 N -5.28 0.07 0.09 4.34 0.63 -1.07 -4.41 116.66 111.02 1ivz n ARG 120 Ca 0.13 0.02 0.07 0.00 -0.92 0.00 0.00 57.85 57.14 1ivz n ARG 120 Cb 0.60 -0.97 0.52 0.00 0.45 0.00 0.00 32.46 33.06 1ivz n ARG 120 CO 0.00 0.00 0.00 0.87 -2.51 0.00 0.00 177.63 175.99 1ivz h LYS 121 N -0.02 0.30 -0.00 -0.14 6.56 -1.94 -1.33 116.57 120.00 1ivz h LYS 121 Ca -0.07 -0.02 -0.18 0.00 -1.06 0.00 0.00 60.65 59.33 1ivz h LYS 121 Cb 1.09 -0.07 -0.02 0.00 -0.57 0.00 0.00 32.23 32.66 1ivz h LYS 121 CO -0.02 0.20 -0.82 1.03 -2.06 0.00 0.00 179.45 177.78 1ivz h SER 122 N 0.31 0.09 -3.07 0.86 0.87 -1.92 -3.45 113.55 107.24 1ivz h SER 122 Ca 0.11 -0.07 -0.53 0.00 -1.23 0.00 0.00 61.79 60.07 1ivz h SER 122 Cb 0.05 -0.03 0.05 0.00 -0.44 0.00 0.00 62.40 62.03 1ivz h SER 122 CO -0.02 0.86 0.84 -0.69 -0.53 0.00 0.00 176.83 177.29 1ivz s VAL 123 N -3.21 2.58 -0.10 2.23 1.01 -0.50 -4.19 120.40 118.22 1ivz s VAL 123 Ca -0.01 0.45 -0.33 0.00 0.00 0.00 0.00 61.98 62.09 1ivz s VAL 123 Cb 0.11 -3.29 0.13 0.00 0.00 0.00 0.00 36.38 33.33 1ivz s VAL 123 CO 0.80 0.05 1.18 0.12 0.00 0.00 0.00 175.10 177.26 1ivz s PHE 124 N 0.62 -0.13 -0.15 5.22 5.36 0.01 -4.97 117.98 123.94 1ivz s PHE 124 Ca 0.66 0.04 -0.08 0.00 -0.96 0.00 0.00 56.93 56.58 1ivz s PHE 124 Cb -0.43 0.53 0.06 0.00 -0.34 0.00 0.00 43.02 42.84 1ivz s PHE 124 CO 0.37 -0.29 0.37 0.54 -1.46 0.00 0.00 175.22 174.75 1ivz s VAL 125 N -2.54 -0.06 0.51 3.12 0.11 -1.26 -1.99 120.40 118.30 1ivz s VAL 125 Ca 0.10 0.11 0.01 0.00 -2.93 0.00 0.00 61.98 59.28 1ivz s VAL 125 Cb 0.01 -0.55 -0.01 0.00 -1.53 0.00 0.00 36.38 34.29 1ivz s VAL 125 CO -0.04 0.05 0.03 -0.62 -3.33 0.00 0.00 175.10 171.18 1ivz s ASP 126 N 1.43 4.17 -0.33 3.54 -1.08 -1.14 -4.76 116.67 118.50 1ivz s ASP 126 Ca -0.09 -1.63 -0.27 0.00 -0.52 0.00 0.00 52.55 50.04 1ivz s ASP 126 Cb -0.09 0.53 0.01 0.00 -1.46 0.00 0.00 42.92 41.91 1ivz s ASP 126 CO -0.12 -0.87 0.95 -0.44 0.52 0.00 0.00 175.17 175.21 1ivz s SER 127 N -3.90 6.79 0.05 -0.34 0.01 -1.26 -1.58 113.70 113.46 1ivz s SER 127 Ca 0.07 0.82 -0.27 0.00 1.31 0.00 0.00 55.95 57.88 1ivz s SER 127 Cb 0.01 -2.48 -0.15 0.00 0.21 0.00 0.00 66.02 63.61 1ivz s SER 127 CO 0.04 -0.80 1.41 1.23 0.41 0.00 0.00 173.24 175.53 1ivz h GLY 128 N 9.90 -1.05 0.00 3.44 0.00 0.52 -3.35 103.07 112.52 1ivz h GLY 128 Ca -0.22 0.41 0.00 0.00 0.00 0.00 0.00 47.33 47.52 1ivz h GLY 128 CO 0.98 -0.37 0.00 -1.55 0.00 0.00 0.00 176.54 175.60 1ivz n PRO 129 N -4.67 0.00 0.09 4.80 -0.04 -1.25 -4.78 135.00 129.15 1ivz n PRO 129 Ca -0.12 0.52 0.00 0.00 -0.04 0.00 0.00 63.50 63.86 1ivz n PRO 129 Cb 0.38 -1.45 0.00 0.00 -0.04 0.00 0.00 33.50 32.39 1ivz n PRO 129 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1ivz n SER 130 N -1.98 -1.65 -2.77 3.54 2.88 -1.26 -4.12 113.62 108.27 1ivz n SER 130 Ca 0.00 0.56 -0.06 0.00 -1.33 0.00 0.00 58.87 58.04 1ivz n SER 130 Cb 0.00 1.78 0.01 0.00 -0.75 0.00 0.00 64.21 65.25 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 -2.97 -7.46 -0.49 -3.46 2.88 -1.26 -4.79 113.62 96.07 1ivz n SER 131 Ca 0.00 0.42 0.06 0.00 -1.33 0.00 0.00 58.87 58.02 1ivz n SER 131 Cb 0.00 -5.04 0.05 0.00 -0.75 0.00 0.00 64.21 58.47 1ivz n SER 131 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42