#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 6.09 -0.79 1.61 0.01 -1.26 -5.03 113.70 114.34 1ivz s SER 2 Ca 0.00 0.08 -0.26 0.00 1.31 0.00 0.00 55.95 57.09 1ivz s SER 2 Cb 0.00 -2.13 0.00 0.00 0.21 0.00 0.00 66.02 64.11 1ivz s SER 2 CO 0.00 -0.01 1.62 -0.44 0.41 0.00 0.00 173.24 174.81 1ivz s SER 3 N 1.44 5.76 -0.01 2.44 0.01 -1.26 -4.47 113.70 117.61 1ivz s SER 3 Ca 0.08 -0.45 -0.01 0.00 1.31 0.00 0.00 55.95 56.89 1ivz s SER 3 Cb -0.15 -2.55 0.00 0.00 0.21 0.00 0.00 66.02 63.53 1ivz s SER 3 CO 0.08 -2.11 0.01 0.61 0.41 0.00 0.00 173.24 172.24 1ivz n GLY 4 N 6.05 -3.25 1.11 3.44 0.00 -1.26 -5.07 105.19 106.21 1ivz n GLY 4 Ca 0.21 -0.34 0.00 0.00 0.00 0.00 0.00 46.02 45.89 1ivz n GLY 4 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1ivz n SER 5 N 0.25 0.38 -4.62 1.61 2.88 -1.26 -5.05 113.62 107.81 1ivz n SER 5 Ca -0.02 0.00 -0.46 0.00 -1.33 0.00 0.00 58.87 57.06 1ivz n SER 5 Cb 0.03 0.00 -0.04 0.00 -0.75 0.00 0.00 64.21 63.45 1ivz n SER 5 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 1ivz n SER 6 N -2.32 3.37 0.00 -3.46 3.41 -1.26 -2.65 113.62 110.71 1ivz n SER 6 Ca 0.00 0.66 0.00 0.00 -0.26 0.00 0.00 58.87 59.27 1ivz n SER 6 Cb 0.13 -1.44 0.00 0.00 -0.26 0.00 0.00 64.21 62.64 1ivz n SER 6 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1ivz n GLY 7 N 5.13 1.88 3.68 5.00 0.00 -1.26 -5.09 105.19 114.54 1ivz n GLY 7 Ca 0.27 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.86 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 -2.00 7.03 0.51 1.61 0.01 -1.08 -4.84 113.70 114.94 1ivz s SER 8 Ca 0.00 1.80 0.00 0.00 1.31 0.00 0.00 55.95 59.06 1ivz s SER 8 Cb 0.00 -2.56 0.00 0.00 0.21 0.00 0.00 66.02 63.67 1ivz s SER 8 CO 0.00 -0.61 0.00 -1.20 0.41 0.00 0.00 173.24 171.84 1ivz n SER 9 N 5.40 -7.82 -1.54 2.44 7.64 -1.26 -4.76 113.62 113.71 1ivz n SER 9 Ca 0.11 1.12 0.02 0.00 1.01 0.00 0.00 58.87 61.13 1ivz n SER 9 Cb 0.46 -3.16 0.01 0.00 -1.01 0.00 0.00 64.21 60.51 1ivz n SER 9 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 1ivz n SER 10 N -3.87 0.65 -4.84 6.43 7.64 -1.26 -5.11 113.62 113.25 1ivz n SER 10 Ca 0.01 -2.01 -0.26 0.00 1.01 0.00 0.00 58.87 57.62 1ivz n SER 10 Cb 0.48 -0.19 -0.04 0.00 -1.01 0.00 0.00 64.21 63.45 1ivz n SER 10 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 1ivz s SER 11 N -1.95 4.58 -0.01 6.43 1.04 -1.26 -4.22 113.70 118.30 1ivz s SER 11 Ca 0.27 -1.17 0.02 0.00 0.48 0.00 0.00 55.95 55.54 1ivz s SER 11 Cb 0.32 0.04 -0.00 0.00 0.10 0.00 0.00 66.02 66.48 1ivz s SER 11 CO -0.13 -0.86 -0.06 0.00 0.98 0.00 0.00 173.24 173.17 1ivz s GLN 12 N -4.11 0.56 -0.06 4.02 -2.07 -1.26 -4.99 119.66 111.74 1ivz s GLN 12 Ca 0.35 -0.23 0.03 0.00 -1.82 0.00 0.00 55.36 53.70 1ivz s GLN 12 Cb -0.00 -0.55 0.00 0.00 -1.09 0.00 0.00 33.01 31.38 1ivz s GLN 12 CO 0.21 0.13 -0.16 -1.01 -1.32 0.00 0.00 175.29 173.13 1ivz s HIS 13 N -0.07 1.76 -0.21 9.60 3.76 -1.26 -2.55 115.29 126.31 1ivz s HIS 13 Ca 0.01 -0.61 0.01 0.00 -0.15 0.00 0.00 55.06 54.32 1ivz s HIS 13 Cb -0.04 -1.22 0.05 0.00 1.11 0.00 0.00 32.58 32.48 1ivz s HIS 13 CO -0.00 -0.26 -0.08 -0.06 -0.85 0.00 0.00 174.74 173.49 1ivz s PHE 14 N 0.36 2.37 -0.15 1.40 0.08 -1.05 -2.34 117.98 118.65 1ivz s PHE 14 Ca -0.11 -1.62 -0.32 0.00 0.12 0.00 0.00 56.93 55.00 1ivz s PHE 14 Cb -0.15 -1.60 -0.09 0.00 -0.57 0.00 0.00 43.02 40.61 1ivz s PHE 14 CO 0.04 -0.75 2.05 0.09 -0.10 0.00 0.00 175.22 176.55 1ivz n ASN 15 N 4.69 3.31 -4.59 1.36 4.13 0.68 0.99 115.26 125.84 1ivz n ASN 15 Ca -0.14 0.65 -0.38 0.00 1.68 0.00 0.00 54.58 56.40 1ivz n ASN 15 Cb 0.46 -1.43 -0.11 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 5.87 3.97 -0.00 3.41 2.96 0.26 -2.37 118.68 132.78 1ivz s LEU 16 Ca 0.97 -0.01 0.01 0.00 -0.22 0.00 0.00 54.13 54.89 1ivz s LEU 16 Cb -0.58 -2.10 -0.00 0.00 0.50 0.00 0.00 46.19 44.02 1ivz s LEU 16 CO 0.45 -0.03 -0.05 0.20 -1.32 0.00 0.00 176.35 175.61 1ivz s ASN 17 N 1.62 0.56 -0.30 3.68 0.01 -0.75 0.48 114.94 120.24 1ivz s ASN 17 Ca 0.07 -0.09 -0.18 0.00 -0.71 0.00 0.00 52.86 51.95 1ivz s ASN 17 Cb -0.15 -0.07 0.18 0.00 0.41 0.00 0.00 41.25 41.62 1ivz s ASN 17 CO 0.09 0.05 1.24 0.72 -1.51 0.00 0.00 177.10 177.70 1ivz s PHE 18 N -0.08 -0.13 0.23 2.20 -0.71 -1.04 -1.18 117.98 117.27 1ivz s PHE 18 Ca 0.01 0.18 -0.30 0.00 -1.04 0.00 0.00 56.93 55.79 1ivz s PHE 18 Cb -0.02 0.06 -0.09 0.00 -1.21 0.00 0.00 43.02 41.76 1ivz s PHE 18 CO -0.00 -0.07 1.17 0.99 -1.34 0.00 0.00 175.22 175.97 1ivz s THR 19 N 2.53 3.47 -0.49 -4.49 2.01 -1.26 -2.82 115.64 114.59 1ivz s THR 19 Ca -0.04 1.34 -0.13 0.00 0.31 0.00 0.00 61.69 63.16 1ivz s THR 19 Cb -0.05 -3.85 0.11 0.00 0.01 0.00 0.00 72.50 68.72 1ivz s THR 19 CO -0.12 0.26 0.41 -0.63 -0.69 0.00 0.00 174.62 173.85 1ivz s ILE 20 N -0.56 4.85 0.56 1.82 1.01 0.32 -3.04 121.20 126.16 1ivz s ILE 20 Ca 0.49 -1.46 0.26 0.00 0.00 0.00 0.00 60.65 59.94 1ivz s ILE 20 Cb -0.33 -4.06 0.37 0.00 0.01 0.00 0.00 42.46 38.45 1ivz s ILE 20 CO 0.40 -0.74 2.03 0.71 0.00 0.00 0.00 174.94 177.33 1ivz h THR 21 N 5.94 0.60 -1.29 2.92 1.35 -1.84 -2.20 112.91 118.40 1ivz h THR 21 Ca -0.27 0.00 -0.56 0.00 -0.55 0.00 0.00 66.41 65.03 1ivz h THR 21 Cb 1.09 0.77 -0.20 0.00 -1.73 0.00 0.00 68.15 68.08 1ivz h THR 21 CO 0.93 0.00 0.56 -3.20 -0.25 0.00 0.00 175.52 173.55 1ivz n ASN 22 N -4.09 6.73 -3.07 5.36 5.15 -0.71 -4.50 115.26 120.13 1ivz n ASN 22 Ca 0.06 -3.36 0.00 0.00 -0.60 0.00 0.00 54.58 50.68 1ivz n ASN 22 Cb 0.49 -1.19 -0.00 0.00 -0.53 0.00 0.00 39.78 38.54 1ivz n ASN 22 CO 0.00 0.00 0.00 -0.22 1.40 0.00 0.00 177.26 178.44 1ivz s LEU 23 N -2.64 -1.39 0.64 1.20 1.98 -0.83 -4.82 118.68 112.82 1ivz s LEU 23 Ca 0.57 -0.89 -0.17 0.00 -2.89 0.00 0.00 54.13 50.74 1ivz s LEU 23 Cb 0.40 1.78 -0.04 0.00 0.66 0.00 0.00 46.19 48.98 1ivz s LEU 23 CO -0.27 -0.13 0.80 -2.65 -1.89 0.00 0.00 176.35 172.21 1ivz n PRO 24 N 4.03 0.65 -3.76 0.98 -0.02 -1.25 -2.93 135.00 132.70 1ivz n PRO 24 Ca 0.12 0.26 -0.37 0.00 -2.02 0.00 0.00 63.50 61.49 1ivz n PRO 24 Cb 0.58 -2.03 -0.13 0.00 -0.02 0.00 0.00 33.50 31.90 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 -1.67 3.15 0.43 6.00 5.04 -1.25 -4.83 117.35 124.22 1ivz s TYR 25 Ca 0.73 -1.00 0.03 0.00 -2.44 0.00 0.00 57.07 54.39 1ivz s TYR 25 Cb -0.40 -2.25 -0.03 0.00 0.35 0.00 0.00 41.96 39.63 1ivz s TYR 25 CO 0.50 -0.58 0.07 -1.12 -1.34 0.00 0.00 175.55 173.08 1ivz s SER 26 N 1.49 3.20 0.54 4.32 0.01 -1.26 -4.91 113.70 117.09 1ivz s SER 26 Ca 0.02 -1.60 0.20 0.00 1.31 0.00 0.00 55.95 55.88 1ivz s SER 26 Cb -0.17 0.35 1.42 0.00 0.21 0.00 0.00 66.02 67.83 1ivz s SER 26 CO 0.02 -0.82 2.17 -0.61 0.41 0.00 0.00 173.24 174.41 1ivz h GLN 27 N 1.71 0.00 -0.25 12.44 5.75 -1.99 -2.39 115.11 130.38 1ivz h GLN 27 Ca -0.39 0.00 0.02 0.00 -0.15 0.00 0.00 58.65 58.13 1ivz h GLN 27 Cb 1.28 0.00 -0.03 0.00 1.07 0.00 0.00 27.48 29.80 1ivz h GLN 27 CO 0.66 0.00 0.09 -0.44 -2.65 0.00 0.00 178.83 176.49 1ivz h ASP 28 N 0.00 0.12 0.59 -0.69 5.19 -1.96 -0.36 116.42 119.31 1ivz h ASP 28 Ca 0.01 0.02 0.00 0.00 -0.62 0.00 0.00 57.03 56.44 1ivz h ASP 28 Cb 0.04 0.01 0.00 0.00 0.18 0.00 0.00 39.33 39.55 1ivz h ASP 28 CO -0.00 0.10 0.00 -0.38 -3.12 0.00 0.00 179.24 175.84 1ivz n ILE 29 N -5.02 0.88 0.04 0.35 2.08 -0.91 -2.11 119.36 114.68 1ivz n ILE 29 Ca -0.01 0.32 0.04 0.00 0.56 0.00 0.00 62.75 63.66 1ivz n ILE 29 Cb 0.08 -1.26 -0.07 0.00 -0.75 0.00 0.00 39.64 37.64 1ivz n ILE 29 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 1ivz n ALA 30 N -1.76 2.21 -3.40 -1.39 0.00 -0.34 -4.77 120.51 111.06 1ivz n ALA 30 Ca 0.01 -0.49 -0.37 0.00 0.00 0.00 0.00 53.44 52.59 1ivz n ALA 30 Cb 0.19 -0.93 -0.12 0.00 0.00 0.00 0.00 19.45 18.59 1ivz n ALA 30 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 1ivz s GLN 31 N -3.12 2.50 -0.62 0.00 -1.52 -0.29 -5.00 119.66 111.61 1ivz s GLN 31 Ca -0.03 -1.31 -0.08 0.00 -1.95 0.00 0.00 55.36 51.99 1ivz s GLN 31 Cb 0.09 -3.45 -0.07 0.00 -0.22 0.00 0.00 33.01 29.37 1ivz s GLN 31 CO 0.82 -0.74 1.78 -2.30 -0.25 0.00 0.00 175.29 174.60 1ivz n PRO 32 N 4.76 1.37 0.00 2.91 -0.02 -1.26 -3.11 135.00 139.65 1ivz n PRO 32 Ca -0.11 -1.25 0.00 0.00 -2.02 0.00 0.00 63.50 60.12 1ivz n PRO 32 Cb 0.44 -2.40 0.00 0.00 -0.02 0.00 0.00 33.50 31.51 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 5.11 0.00 -3.66 2.55 2.88 -1.26 -5.04 113.62 114.19 1ivz n SER 33 Ca 0.34 0.00 -0.30 0.00 -1.33 0.00 0.00 58.87 57.58 1ivz n SER 33 Cb 0.15 0.02 0.26 0.00 -0.75 0.00 0.00 64.21 63.89 1ivz n SER 33 CO 0.00 0.00 0.00 0.42 -1.23 0.00 0.00 175.04 174.23 1ivz s THR 34 N -1.17 1.43 0.06 2.46 -4.23 -1.18 -4.94 115.64 108.07 1ivz s THR 34 Ca 0.00 0.00 0.06 0.00 -1.18 0.00 0.00 61.69 60.57 1ivz s THR 34 Cb 0.00 -2.30 -0.23 0.00 1.34 0.00 0.00 72.50 71.32 1ivz s THR 34 CO 0.00 0.00 1.07 0.74 -0.54 0.00 0.00 174.62 175.89 1ivz h THR 35 N -2.96 1.42 -0.74 3.99 2.02 -1.92 -3.25 112.91 111.46 1ivz h THR 35 Ca -0.45 -3.15 0.01 0.00 0.77 0.00 0.00 66.41 63.59 1ivz h THR 35 Cb 1.31 2.74 -0.04 0.00 -1.74 0.00 0.00 68.15 70.43 1ivz h THR 35 CO 0.32 0.83 0.49 0.50 0.37 0.00 0.00 175.52 178.03 1ivz h LYS 36 N 0.01 0.98 -0.17 6.66 3.64 -1.93 0.86 116.57 126.62 1ivz h LYS 36 Ca -0.11 -0.06 -0.20 0.00 -1.27 0.00 0.00 60.65 59.00 1ivz h LYS 36 Cb 1.87 -0.22 0.00 0.00 -0.41 0.00 0.00 32.23 33.48 1ivz h LYS 36 CO 0.13 0.65 -0.71 -0.92 -2.27 0.00 0.00 179.45 176.33 1ivz h TYR 37 N 1.01 0.95 0.01 1.91 5.03 -1.70 -2.22 116.97 121.95 1ivz h TYR 37 Ca 0.27 -0.40 -0.20 0.00 2.58 0.00 0.00 58.73 60.99 1ivz h TYR 37 Cb -0.12 -0.16 -0.03 0.00 1.55 0.00 0.00 36.73 37.98 1ivz h TYR 37 CO 0.00 1.21 -0.94 1.96 -1.32 0.00 0.00 178.16 179.07 1ivz h GLN 38 N 0.51 0.02 0.30 1.82 4.20 -1.46 -2.79 115.11 117.70 1ivz h GLN 38 Ca -0.03 -0.03 -0.01 0.00 0.06 0.00 0.00 58.65 58.63 1ivz h GLN 38 Cb 1.31 0.01 0.00 0.00 0.30 0.00 0.00 27.48 29.11 1ivz h GLN 38 CO 0.14 0.94 -0.14 1.96 -0.67 0.00 0.00 178.83 181.06 1ivz h GLN 39 N 0.01 -0.39 -0.33 1.46 4.20 0.73 -2.29 115.11 118.50 1ivz h GLN 39 Ca -0.02 0.03 0.02 0.00 0.06 0.00 0.00 58.65 58.74 1ivz h GLN 39 Cb 1.64 0.09 -0.03 0.00 0.30 0.00 0.00 27.48 29.49 1ivz h GLN 39 CO 0.12 -0.05 0.17 1.15 -0.67 0.00 0.00 178.83 179.55 1ivz h THR 40 N -0.91 0.99 -0.73 -0.54 2.02 -1.53 0.82 112.91 113.04 1ivz h THR 40 Ca -0.04 -0.12 0.06 0.00 0.77 0.00 0.00 66.41 67.08 1ivz h THR 40 Cb 0.51 0.61 -0.04 0.00 -1.74 0.00 0.00 68.15 67.49 1ivz h THR 40 CO 0.07 0.06 0.48 0.50 0.37 0.00 0.00 175.52 177.00 1ivz h LYS 41 N 0.35 0.77 0.16 6.66 3.64 -1.58 0.19 116.57 126.75 1ivz h LYS 41 Ca 0.14 -0.05 -0.31 0.00 -1.27 0.00 0.00 60.65 59.16 1ivz h LYS 41 Cb 0.05 -0.17 0.01 0.00 -0.41 0.00 0.00 32.23 31.70 1ivz h LYS 41 CO -0.09 0.51 -1.51 -0.09 -2.27 0.00 0.00 179.45 176.00 1ivz h ARG 42 N 0.79 0.33 0.33 1.90 2.43 -0.77 -2.97 114.38 116.41 1ivz h ARG 42 Ca 0.31 -0.56 -0.02 0.00 -0.81 0.00 0.00 59.98 58.90 1ivz h ARG 42 Cb 0.22 0.21 0.00 0.00 -0.42 0.00 0.00 29.97 29.98 1ivz h ARG 42 CO -0.10 1.23 -0.16 0.77 -1.51 0.00 0.00 179.97 180.20 1ivz h SER 43 N 0.09 -0.37 -0.56 -3.80 0.02 0.12 -1.23 113.55 107.82 1ivz h SER 43 Ca -0.24 -0.07 -0.01 0.00 -0.84 0.00 0.00 61.79 60.63 1ivz h SER 43 Cb 2.05 0.10 -0.03 0.00 0.14 0.00 0.00 62.40 64.66 1ivz h SER 43 CO 0.19 -0.16 0.32 0.40 -1.14 0.00 0.00 176.83 176.44 1ivz h ILE 44 N -0.56 1.18 -0.24 3.27 2.04 -1.13 -0.09 117.51 121.97 1ivz h ILE 44 Ca -0.04 -0.43 0.01 0.00 1.00 0.00 0.00 64.86 65.39 1ivz h ILE 44 Cb 0.42 0.45 -0.01 0.00 -0.74 0.00 0.00 36.82 36.94 1ivz h ILE 44 CO 0.07 0.19 0.16 -0.33 0.00 0.00 0.00 178.15 178.24 1ivz h GLU 45 N 0.75 0.27 0.16 2.37 5.08 -1.45 0.15 114.58 121.90 1ivz h GLU 45 Ca 0.20 -0.02 -0.30 0.00 -1.00 0.00 0.00 59.36 58.25 1ivz h GLU 45 Cb 0.02 -0.06 0.03 0.00 0.50 0.00 0.00 28.75 29.24 1ivz h GLU 45 CO -0.03 0.18 -1.25 -0.97 -1.00 0.00 0.00 179.01 175.93 1ivz h ASN 46 N 0.28 0.83 0.02 1.42 -1.24 -0.53 -2.81 115.58 113.54 1ivz h ASN 46 Ca 0.09 -0.86 -0.08 0.00 0.71 0.00 0.00 56.30 56.16 1ivz h ASN 46 Cb 0.03 -0.26 -0.01 0.00 0.73 0.00 0.00 38.32 38.81 1ivz h ASN 46 CO -0.02 1.61 -0.22 0.00 -1.29 0.00 0.00 177.43 177.51 1ivz h ALA 47 N 0.23 1.27 -0.02 1.57 0.00 -0.43 -2.65 119.26 119.22 1ivz h ALA 47 Ca -0.20 -0.30 -0.17 0.00 0.00 0.00 0.00 54.91 54.24 1ivz h ALA 47 Cb 1.94 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 19.61 1ivz h ALA 47 CO 0.24 0.48 -0.76 -0.07 0.00 0.00 0.00 179.25 179.14 1ivz h LEU 48 N 0.31 0.17 0.83 0.00 3.38 -1.05 -2.87 115.31 116.09 1ivz h LEU 48 Ca 0.05 -0.12 -0.04 0.00 0.09 0.00 0.00 57.88 57.86 1ivz h LEU 48 Cb 0.56 -0.05 0.01 0.00 0.09 0.00 0.00 40.66 41.27 1ivz h LEU 48 CO 0.04 0.86 -0.40 -1.13 0.09 0.00 0.00 178.44 177.90 1ivz h ASN 49 N 0.09 -0.96 -0.06 -0.43 -0.73 -1.20 -2.10 115.58 110.19 1ivz h ASN 49 Ca -0.02 0.03 -0.01 0.00 1.87 0.00 0.00 56.30 58.17 1ivz h ASN 49 Cb 1.33 0.25 -0.01 0.00 0.27 0.00 0.00 38.32 40.17 1ivz h ASN 49 CO 0.11 -0.68 0.02 0.06 -0.37 0.00 0.00 177.43 176.57 1ivz h GLN 50 N -1.12 0.14 -0.80 6.67 3.07 -1.62 -2.10 115.11 119.34 1ivz h GLN 50 Ca -0.11 -0.01 -0.02 0.00 0.09 0.00 0.00 58.65 58.60 1ivz h GLN 50 Cb 0.86 -0.03 -0.04 0.00 0.08 0.00 0.00 27.48 28.36 1ivz h GLN 50 CO 0.18 0.14 0.43 1.25 0.09 0.00 0.00 178.83 180.92 1ivz h LEU 51 N 0.14 1.00 -0.77 0.06 6.46 -1.24 0.11 115.31 121.07 1ivz h LEU 51 Ca 0.04 -0.10 -0.13 0.00 -0.12 0.00 0.00 57.88 57.56 1ivz h LEU 51 Cb 0.07 -0.26 -0.01 0.00 -0.73 0.00 0.00 40.66 39.74 1ivz h LEU 51 CO -0.00 0.82 -0.50 -0.26 -0.62 0.00 0.00 178.44 177.88 1ivz h PHE 52 N 1.11 0.37 0.00 1.25 0.04 -0.71 0.59 116.94 119.59 1ivz h PHE 52 Ca 0.28 -0.12 -0.12 0.00 2.80 0.00 0.00 57.97 60.82 1ivz h PHE 52 Cb 0.04 -0.07 -0.02 0.00 2.20 0.00 0.00 35.95 38.10 1ivz h PHE 52 CO 0.00 0.74 -0.56 0.00 -0.60 0.00 0.00 178.31 177.90 1ivz h ARG 53 N 0.24 0.00 0.00 1.51 3.08 -1.11 -3.23 114.38 114.87 1ivz h ARG 53 Ca 0.01 0.00 -0.19 0.00 0.07 0.00 0.00 59.98 59.87 1ivz h ARG 53 Cb 0.96 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.98 1ivz h ARG 53 CO 0.08 0.56 -1.85 0.09 -1.07 0.00 0.00 179.97 177.78 1ivz n ASN 54 N -3.51 0.39 -4.36 7.04 3.02 -0.02 -4.79 115.26 113.03 1ivz n ASN 54 Ca -0.00 0.17 -0.31 0.00 -0.03 0.00 0.00 54.58 54.42 1ivz n ASN 54 Cb 0.64 0.85 0.21 0.00 -0.61 0.00 0.00 39.78 40.88 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 -2.70 -2.12 0.14 6.41 3.41 0.21 -4.90 113.62 114.07 1ivz n SER 55 Ca -0.15 -0.14 -0.01 0.00 -0.26 0.00 0.00 58.87 58.31 1ivz n SER 55 Cb 0.87 -1.09 0.21 0.00 -0.26 0.00 0.00 64.21 63.94 1ivz n SER 55 CO 0.00 0.00 0.00 -1.28 -0.16 0.00 0.00 175.04 173.60 1ivz h SER 56 N -2.34 0.01 -1.82 4.04 0.87 -1.87 -3.18 113.55 109.24 1ivz h SER 56 Ca -0.57 -0.00 -0.75 0.00 -1.23 0.00 0.00 61.79 59.24 1ivz h SER 56 Cb 1.35 -0.00 -0.27 0.00 -0.44 0.00 0.00 62.40 63.04 1ivz h SER 56 CO 0.43 0.57 1.02 2.30 -0.53 0.00 0.00 176.83 180.63 1ivz n ILE 57 N -3.86 3.60 -1.55 2.23 -5.35 -1.26 -4.81 119.36 108.35 1ivz n ILE 57 Ca -0.01 -4.05 -0.34 0.00 -0.27 0.00 0.00 62.75 58.08 1ivz n ILE 57 Cb 0.57 -1.24 -0.04 0.00 -1.74 0.00 0.00 39.64 37.19 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 -0.56 3.61 0.00 6.28 2.85 -1.21 -3.86 118.16 125.28 1ivz n LYS 58 Ca 0.55 -2.53 0.00 0.00 -1.05 0.00 0.00 58.31 55.28 1ivz n LYS 58 Cb 0.30 -2.53 0.00 0.00 -0.65 0.00 0.00 35.03 32.16 1ivz n LYS 58 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 177.40 176.22 1ivz n SER 59 N 2.32 0.00 -1.45 -5.58 3.41 -1.26 -4.89 113.62 106.17 1ivz n SER 59 Ca 0.63 0.00 -0.01 0.00 -0.26 0.00 0.00 58.87 59.23 1ivz n SER 59 Cb 0.38 0.09 0.26 0.00 -0.26 0.00 0.00 64.21 64.68 1ivz n SER 59 CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 1ivz n TYR 60 N -2.23 1.67 -3.74 7.33 4.01 -1.25 -4.89 117.16 118.06 1ivz n TYR 60 Ca 0.00 -1.22 -0.38 0.00 -0.16 0.00 0.00 57.90 56.14 1ivz n TYR 60 Cb 0.00 -0.53 -0.12 0.00 -0.31 0.00 0.00 39.34 38.38 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 -3.02 3.36 0.00 -0.72 2.19 -1.25 -1.46 117.98 117.08 1ivz s PHE 61 Ca 0.49 -1.76 -0.01 0.00 0.33 0.00 0.00 56.93 55.98 1ivz s PHE 61 Cb 0.40 -2.68 -0.00 0.00 -1.31 0.00 0.00 43.02 39.42 1ivz s PHE 61 CO 0.09 -0.84 0.64 1.03 1.83 0.00 0.00 175.22 177.97 1ivz h SER 62 N 8.20 -0.03 -0.44 6.13 0.87 -1.84 -3.46 113.55 122.99 1ivz h SER 62 Ca -0.20 0.00 0.06 0.00 -1.23 0.00 0.00 61.79 60.41 1ivz h SER 62 Cb 1.07 0.01 -0.01 0.00 -0.44 0.00 0.00 62.40 63.03 1ivz h SER 62 CO 0.66 -0.01 0.15 -0.67 -0.53 0.00 0.00 176.83 176.43 1ivz n ASP 63 N -2.12 -0.18 -4.52 6.23 -0.08 -1.23 -5.05 116.55 109.60 1ivz n ASP 63 Ca -0.00 -1.03 -0.33 0.00 -1.51 0.00 0.00 54.79 51.91 1ivz n ASP 63 Cb 0.01 0.28 -0.12 0.00 2.34 0.00 0.00 41.12 43.63 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 -0.75 2.47 -0.25 0.00 0.74 -0.90 -4.89 119.66 116.08 1ivz s GLN 65 Ca 0.11 -2.42 -0.28 0.00 0.05 0.00 0.00 55.36 52.82 1ivz s GLN 65 Cb -0.11 -3.70 -0.04 0.00 1.10 0.00 0.00 33.01 30.26 1ivz s GLN 65 CO 0.01 -1.16 2.16 0.54 -0.55 0.00 0.00 175.29 176.29 1ivz s VAL 66 N 0.12 3.09 -0.03 1.34 0.11 -1.26 -1.85 120.40 121.91 1ivz s VAL 66 Ca 0.16 0.09 -0.11 0.00 -2.93 0.00 0.00 61.98 59.18 1ivz s VAL 66 Cb -0.21 -3.13 -0.06 0.00 -1.53 0.00 0.00 36.38 31.46 1ivz s VAL 66 CO -0.03 -0.08 0.53 -0.07 -3.33 0.00 0.00 175.10 172.11 1ivz h LEU 67 N 15.08 -0.34 -7.66 2.54 3.38 0.32 -3.48 115.31 125.16 1ivz h LEU 67 Ca -0.39 0.01 0.25 0.00 0.09 0.00 0.00 57.88 57.85 1ivz h LEU 67 Cb 1.23 0.09 -0.08 0.00 0.09 0.00 0.00 40.66 41.99 1ivz h LEU 67 CO 0.98 0.02 0.70 0.00 0.09 0.00 0.00 178.44 180.23 1ivz s ALA 68 N -3.65 -1.98 0.08 1.53 0.00 -1.12 -5.04 121.76 111.59 1ivz s ALA 68 Ca -0.06 0.17 0.02 0.00 0.00 0.00 0.00 51.96 52.09 1ivz s ALA 68 Cb 0.01 0.63 -0.04 0.00 0.00 0.00 0.00 23.12 23.72 1ivz s ALA 68 CO 0.18 -1.07 0.15 -0.06 0.00 0.00 0.00 175.76 174.95 1ivz s PHE 69 N -2.47 3.34 0.30 0.00 0.08 -1.26 -1.50 117.98 116.47 1ivz s PHE 69 Ca 0.19 0.14 0.11 0.00 0.12 0.00 0.00 56.93 57.48 1ivz s PHE 69 Cb 0.00 -1.67 -0.05 0.00 -0.57 0.00 0.00 43.02 40.73 1ivz s PHE 69 CO 0.01 0.55 -0.11 1.03 -0.10 0.00 0.00 175.22 176.59 1ivz s ARG 70 N -2.56 1.87 -0.38 0.44 1.81 0.20 -4.91 118.95 115.42 1ivz s ARG 70 Ca 0.32 -1.74 -0.01 0.00 -1.72 0.00 0.00 55.73 52.58 1ivz s ARG 70 Cb -0.12 -1.85 0.10 0.00 -0.45 0.00 0.00 34.95 32.63 1ivz s ARG 70 CO 0.25 0.27 0.14 0.45 -0.68 0.00 0.00 175.30 175.73 1ivz s SER 71 N -3.59 5.08 0.51 0.23 0.15 -1.26 -0.97 113.70 113.85 1ivz s SER 71 Ca 0.31 -1.94 0.16 0.00 0.70 0.00 0.00 55.95 55.18 1ivz s SER 71 Cb -0.03 -1.76 1.23 0.00 -1.71 0.00 0.00 66.02 63.75 1ivz s SER 71 CO 0.17 -0.46 2.13 -0.37 1.20 0.00 0.00 173.24 175.91 1ivz h VAL 72 N 6.44 1.00 -4.97 4.45 -1.51 -1.95 -3.46 116.25 116.24 1ivz h VAL 72 Ca -0.12 -0.02 -0.41 0.00 -1.23 0.00 0.00 66.70 64.92 1ivz h VAL 72 Cb 1.04 0.94 0.09 0.00 -2.13 0.00 0.00 31.29 31.23 1ivz h VAL 72 CO 0.63 0.01 -0.64 -0.24 -1.23 0.00 0.00 177.57 176.10 1ivz n SER 73 N -4.53 -6.27 0.00 4.19 2.88 -1.26 -4.94 113.62 103.70 1ivz n SER 73 Ca -0.02 -0.38 0.00 0.00 -1.33 0.00 0.00 58.87 57.14 1ivz n SER 73 Cb 0.11 -5.01 0.00 0.00 -0.75 0.00 0.00 64.21 58.56 1ivz n SER 73 CO 0.00 0.00 0.00 -3.20 -1.23 0.00 0.00 175.04 170.61 1ivz n ASN 74 N -2.71 0.00 -0.51 -3.46 5.15 -1.26 -4.78 115.26 107.70 1ivz n ASN 74 Ca -0.07 0.07 0.06 0.00 -0.60 0.00 0.00 54.58 54.05 1ivz n ASN 74 Cb 0.60 -0.31 0.16 0.00 -0.53 0.00 0.00 39.78 39.70 1ivz n ASN 74 CO 0.00 0.00 0.00 -3.20 1.40 0.00 0.00 177.26 175.46 1ivz n ASN 75 N -1.96 2.97 -2.37 1.20 5.15 -1.26 -4.96 115.26 114.03 1ivz n ASN 75 Ca 0.00 -2.52 -0.14 0.00 -0.60 0.00 0.00 54.58 51.32 1ivz n ASN 75 Cb 0.00 -0.33 -0.01 0.00 -0.53 0.00 0.00 39.78 38.91 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 -0.35 -4.29 -0.93 1.20 4.13 -1.26 -4.77 115.26 108.98 1ivz n ASN 76 Ca 0.13 0.16 0.01 0.00 1.68 0.00 0.00 54.58 56.57 1ivz n ASN 76 Cb 0.58 -3.65 0.01 0.00 -1.54 0.00 0.00 39.78 35.18 1ivz n ASN 76 CO 0.00 0.00 0.00 -3.20 0.28 0.00 0.00 177.26 174.34 1ivz n ASN 77 N -1.78 0.37 -4.22 6.41 4.05 -1.26 -4.36 115.26 114.47 1ivz n ASN 77 Ca -0.17 -1.95 -0.13 0.00 0.45 0.00 0.00 54.58 52.79 1ivz n ASN 77 Cb 0.62 -0.21 -0.10 0.00 1.23 0.00 0.00 39.78 41.32 1ivz n ASN 77 CO 0.00 0.00 0.00 -1.00 -3.05 0.00 0.00 177.26 173.21 1ivz s HIS 78 N 0.00 1.15 -0.11 1.20 0.09 -1.25 -3.87 115.29 112.50 1ivz s HIS 78 Ca 0.14 -1.06 -0.05 0.00 -0.00 0.00 0.00 55.06 54.09 1ivz s HIS 78 Cb 0.16 -0.65 0.05 0.00 -0.00 0.00 0.00 32.58 32.14 1ivz s HIS 78 CO -0.07 -0.27 0.26 0.99 -0.00 0.00 0.00 174.74 175.65 1ivz s THR 79 N -3.73 -0.06 -0.32 1.30 2.01 -1.15 -3.78 115.64 109.91 1ivz s THR 79 Ca 0.24 0.15 -0.24 0.00 0.31 0.00 0.00 61.69 62.15 1ivz s THR 79 Cb 0.06 -0.40 0.01 0.00 0.01 0.00 0.00 72.50 72.18 1ivz s THR 79 CO 0.03 0.06 0.84 -0.83 -0.69 0.00 0.00 174.62 174.04 1ivz s GLY 80 N 1.34 1.67 -0.10 4.40 0.00 -0.14 -0.52 107.32 113.97 1ivz s GLY 80 Ca -0.09 -0.39 -0.26 0.00 0.00 0.00 0.00 44.72 43.99 1ivz s GLY 80 CO -0.09 1.85 0.83 0.14 0.00 0.00 0.00 173.10 175.84 1ivz s VAL 81 N 3.12 4.92 -0.79 1.40 1.01 -1.13 0.59 120.40 129.52 1ivz s VAL 81 Ca 0.35 1.69 0.02 0.00 0.00 0.00 0.00 61.98 64.04 1ivz s VAL 81 Cb -0.14 -4.16 0.19 0.00 0.00 0.00 0.00 36.38 32.28 1ivz s VAL 81 CO 0.14 0.12 0.63 -0.67 0.00 0.00 0.00 175.10 175.32 1ivz n ASP 82 N 4.50 3.58 -4.95 3.32 2.03 -0.56 -2.51 116.55 121.96 1ivz n ASP 82 Ca 0.03 -3.19 -0.20 0.00 0.52 0.00 0.00 54.79 51.96 1ivz n ASP 82 Cb 0.50 -0.89 0.00 0.00 -0.72 0.00 0.00 41.12 40.02 1ivz n ASP 82 CO 0.00 0.00 0.00 -0.94 -1.92 0.00 0.00 177.20 174.34 1ivz s SER 83 N -0.95 5.22 -0.24 1.67 1.04 0.18 1.00 113.70 121.61 1ivz s SER 83 Ca 0.27 -0.71 -0.00 0.00 0.48 0.00 0.00 55.95 55.98 1ivz s SER 83 Cb -0.05 -0.33 0.07 0.00 0.10 0.00 0.00 66.02 65.81 1ivz s SER 83 CO -0.15 -0.87 -0.01 -0.22 0.98 0.00 0.00 173.24 172.98 1ivz s LEU 84 N -4.32 2.27 -1.12 2.42 1.98 -0.77 0.93 118.68 120.06 1ivz s LEU 84 Ca 0.51 -1.18 -0.24 0.00 -2.89 0.00 0.00 54.13 50.33 1ivz s LEU 84 Cb -0.06 -1.01 -0.15 0.00 0.66 0.00 0.00 46.19 45.63 1ivz s LEU 84 CO 0.31 -0.28 1.99 0.00 -1.89 0.00 0.00 176.35 176.48 1ivz s ASN 86 N 7.17 6.61 0.11 0.00 0.01 -0.88 -2.53 114.94 125.44 1ivz s ASN 86 Ca 0.73 2.16 0.03 0.00 -0.71 0.00 0.00 52.86 55.07 1ivz s ASN 86 Cb -0.01 -2.60 -0.04 0.00 0.41 0.00 0.00 41.25 39.01 1ivz s ASN 86 CO 0.16 -0.60 -0.09 -0.36 -1.51 0.00 0.00 177.10 174.70 1ivz s PHE 87 N -1.57 1.04 0.43 2.20 0.40 -1.06 -3.42 117.98 116.00 1ivz s PHE 87 Ca 0.58 -0.78 -0.23 0.00 -0.60 0.00 0.00 56.93 55.90 1ivz s PHE 87 Cb -0.25 -0.57 -0.08 0.00 0.51 0.00 0.00 43.02 42.63 1ivz s PHE 87 CO 0.31 -0.04 1.10 -1.12 0.70 0.00 0.00 175.22 176.18 1ivz s SER 88 N -2.88 6.49 0.55 1.36 0.01 -0.54 -4.20 113.70 114.50 1ivz s SER 88 Ca 0.11 2.14 0.27 0.00 1.31 0.00 0.00 55.95 59.78 1ivz s SER 88 Cb 0.02 -2.59 1.60 0.00 0.21 0.00 0.00 66.02 65.26 1ivz s SER 88 CO -0.02 -0.69 2.17 -0.65 0.41 0.00 0.00 173.24 174.47 1ivz h PRO 89 N 2.25 0.00 -0.40 12.44 0.11 -1.91 -2.42 132.00 142.08 1ivz h PRO 89 Ca -0.49 0.00 0.12 0.00 0.11 0.00 0.00 66.00 65.74 1ivz h PRO 89 Cb 1.23 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.32 1ivz h PRO 89 CO 0.61 0.05 0.42 -0.07 -0.21 0.00 0.00 178.00 178.81 1ivz h LEU 90 N 0.00 0.00-10.34 2.35 4.07 -1.92 -3.42 115.31 106.05 1ivz h LEU 90 Ca -0.00 0.00 -0.49 0.00 0.08 0.00 0.00 57.88 57.47 1ivz h LEU 90 Cb 0.13 0.00 0.05 0.00 1.08 0.00 0.00 40.66 41.92 1ivz h LEU 90 CO 0.01 0.00 0.19 0.00 -1.08 0.00 0.00 178.44 177.56 1ivz s ALA 91 N -4.64 3.31 -0.05 1.53 0.00 -0.91 -5.00 121.76 116.00 1ivz s ALA 91 Ca -0.04 -0.46 0.02 0.00 0.00 0.00 0.00 51.96 51.47 1ivz s ALA 91 Cb 0.16 -2.70 0.06 0.00 0.00 0.00 0.00 23.12 20.64 1ivz s ALA 91 CO 0.56 -0.53 0.87 -2.13 0.00 0.00 0.00 175.76 174.53 1ivz n ARG 92 N -2.44 0.19 -1.18 0.00 0.63 -1.26 -4.91 116.66 107.69 1ivz n ARG 92 Ca 0.03 -0.81 -0.05 0.00 -0.92 0.00 0.00 57.85 56.10 1ivz n ARG 92 Cb 0.55 0.47 -0.05 0.00 0.45 0.00 0.00 32.46 33.89 1ivz n ARG 92 CO 0.00 0.00 0.00 -2.13 -2.51 0.00 0.00 177.63 172.99 1ivz n ARG 93 N -0.22 0.10 -3.57 -0.14 0.00 -1.26 -5.12 116.66 106.45 1ivz n ARG 93 Ca -0.20 -1.17 -0.37 0.00 -0.00 0.00 0.00 57.85 56.11 1ivz n ARG 93 Cb 0.63 0.41 -0.06 0.00 0.00 0.00 0.00 32.46 33.44 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 -0.03 5.19 0.26 5.15 1.01 -1.26 -5.09 120.40 125.63 1ivz s VAL 94 Ca 0.05 0.66 0.07 0.00 0.00 0.00 0.00 61.98 62.76 1ivz s VAL 94 Cb 0.08 -3.64 -0.05 0.00 0.00 0.00 0.00 36.38 32.77 1ivz s VAL 94 CO -0.03 0.53 -0.08 -1.81 0.00 0.00 0.00 175.10 173.71 1ivz s ASP 95 N -0.64 2.69 0.41 3.32 1.11 -1.26 -5.03 116.67 117.27 1ivz s ASP 95 Ca 0.21 -1.15 0.07 0.00 0.18 0.00 0.00 52.55 51.86 1ivz s ASP 95 Cb -0.15 -0.16 0.87 0.00 1.07 0.00 0.00 42.92 44.56 1ivz s ASP 95 CO 0.09 -0.31 2.06 0.08 1.18 0.00 0.00 175.17 178.28 1ivz h ARG 96 N 2.35 0.53 -0.72 8.23 0.11 -1.94 -1.97 114.38 120.97 1ivz h ARG 96 Ca -0.39 -0.03 -0.07 0.00 0.10 0.00 0.00 59.98 59.59 1ivz h ARG 96 Cb 1.23 -0.12 -0.03 0.00 1.11 0.00 0.00 29.97 32.16 1ivz h ARG 96 CO 0.66 0.35 0.19 0.28 0.10 0.00 0.00 179.97 181.55 1ivz h VAL 97 N 0.55 1.26 -0.23 0.08 2.07 -1.96 0.16 116.25 118.19 1ivz h VAL 97 Ca 0.16 -0.95 -0.02 0.00 0.82 0.00 0.00 66.70 66.70 1ivz h VAL 97 Cb -0.04 0.50 -0.01 0.00 -1.52 0.00 0.00 31.29 30.23 1ivz h VAL 97 CO -0.03 0.37 0.05 0.00 0.02 0.00 0.00 177.57 177.98 1ivz h ALA 98 N 1.10 0.30 0.00 1.67 0.00 -1.78 0.37 119.26 120.92 1ivz h ALA 98 Ca 0.23 -0.16 -0.10 0.00 0.00 0.00 0.00 54.91 54.87 1ivz h ALA 98 Cb 0.35 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 1ivz h ALA 98 CO -0.00 -0.05 -0.50 0.82 0.00 0.00 0.00 179.25 179.52 1ivz h ILE 99 N 0.19 1.26 0.01 0.00 2.04 -1.36 -2.31 117.51 117.34 1ivz h ILE 99 Ca 0.07 -1.77 -0.16 0.00 1.00 0.00 0.00 64.86 64.00 1ivz h ILE 99 Cb 0.28 1.98 0.01 0.00 -0.74 0.00 0.00 36.82 38.35 1ivz h ILE 99 CO 0.00 0.49 -0.63 0.22 0.00 0.00 0.00 178.15 178.23 1ivz h TYR 100 N 0.00 0.62 0.35 1.37 3.20 -0.44 -2.82 116.97 119.25 1ivz h TYR 100 Ca -0.00 -0.34 -0.02 0.00 3.14 0.00 0.00 58.73 61.50 1ivz h TYR 100 Cb 0.94 -0.07 0.00 0.00 1.54 0.00 0.00 36.73 39.14 1ivz h TYR 100 CO 0.00 1.17 -0.17 0.93 -1.64 0.00 0.00 178.16 178.45 1ivz h GLU 101 N -0.11 -0.46 -0.52 1.82 5.08 -0.24 -1.36 114.58 118.80 1ivz h GLU 101 Ca -0.08 0.03 0.07 0.00 -1.00 0.00 0.00 59.36 58.38 1ivz h GLU 101 Cb 1.35 0.10 -0.03 0.00 0.50 0.00 0.00 28.75 30.68 1ivz h GLU 101 CO 0.12 -0.23 0.35 1.05 -1.00 0.00 0.00 179.01 179.30 1ivz h GLU 102 N -0.60 0.40 -0.12 2.33 -0.00 -1.55 -0.82 114.58 114.23 1ivz h GLU 102 Ca -0.05 -0.02 -0.15 0.00 -0.00 0.00 0.00 59.36 59.14 1ivz h GLU 102 Cb 0.44 -0.09 -0.01 0.00 -0.00 0.00 0.00 28.75 29.09 1ivz h GLU 102 CO 0.08 0.27 -0.56 0.35 -0.00 0.00 0.00 179.01 179.15 1ivz h PHE 103 N 0.41 0.46 -0.30 2.06 3.57 -1.24 -3.17 116.94 118.74 1ivz h PHE 103 Ca 0.23 -0.16 -0.03 0.00 3.53 0.00 0.00 57.97 61.54 1ivz h PHE 103 Cb 0.37 -0.09 -0.01 0.00 2.79 0.00 0.00 35.95 39.01 1ivz h PHE 103 CO -0.00 0.84 0.09 -0.07 -2.23 0.00 0.00 178.31 176.94 1ivz h LEU 104 N 0.28 0.45 0.45 0.59 3.38 -0.00 -1.80 115.31 118.66 1ivz h LEU 104 Ca 0.00 -0.22 -0.01 0.00 0.09 0.00 0.00 57.88 57.75 1ivz h LEU 104 Cb 1.06 -0.12 -0.03 0.00 0.09 0.00 0.00 40.66 41.67 1ivz h LEU 104 CO 0.09 0.55 -0.51 -0.09 0.09 0.00 0.00 178.44 178.57 1ivz h ARG 105 N 0.33 -0.94 -0.07 1.13 2.43 -1.47 0.42 114.38 116.21 1ivz h ARG 105 Ca 0.10 0.06 0.02 0.00 -0.81 0.00 0.00 59.98 59.35 1ivz h ARG 105 Cb 0.26 0.21 -0.00 0.00 -0.42 0.00 0.00 29.97 30.02 1ivz h ARG 105 CO -0.00 -0.63 0.06 1.98 -1.51 0.00 0.00 179.97 179.87 1ivz h MET 106 N -0.98 0.00 -0.64 0.20 4.05 -1.58 0.52 114.93 116.51 1ivz h MET 106 Ca -0.05 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.37 1ivz h MET 106 Cb 0.86 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.66 1ivz h MET 106 CO -0.09 0.00 0.00 0.25 0.23 0.00 0.00 176.91 177.30 1ivz n THR 107 N -4.20 1.42 -3.36 -0.77 -2.24 -0.68 -4.16 114.28 100.29 1ivz n THR 107 Ca -0.01 -0.84 -0.13 0.00 -2.27 0.00 0.00 64.05 60.79 1ivz n THR 107 Cb 0.16 -0.09 0.02 0.00 -2.10 0.00 0.00 70.33 68.32 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 0.63 -2.52 -2.93 4.78 -0.00 0.18 0.26 115.22 115.61 1ivz n HIS 108 Ca 0.18 0.91 -0.19 0.00 -0.00 0.00 0.00 57.72 58.63 1ivz n HIS 108 Cb 0.72 -3.69 0.03 0.00 -0.00 0.00 0.00 29.99 27.05 1ivz n HIS 108 CO 0.00 0.00 0.00 -1.71 -0.00 0.00 0.00 176.34 174.63 1ivz n ASN 109 N -2.29 -5.38 -3.34 0.41 5.15 0.13 -3.18 115.26 106.76 1ivz n ASN 109 Ca -0.10 -0.26 -0.17 0.00 -0.60 0.00 0.00 54.58 53.46 1ivz n ASN 109 Cb 0.57 -4.20 0.07 0.00 -0.53 0.00 0.00 39.78 35.69 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 -1.43 -0.99 0.62 8.20 0.00 -0.90 -4.90 105.19 105.79 1ivz n GLY 110 Ca -0.09 0.48 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 -3.50 0.00 -3.85 2.61 -2.24 0.79 -3.09 114.28 104.99 1ivz n THR 111 Ca -0.12 0.00 -0.30 0.00 -2.27 0.00 0.00 64.05 61.36 1ivz n THR 111 Cb 0.63 -0.14 -0.15 0.00 -2.10 0.00 0.00 70.33 68.57 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 -1.31 1.05 -0.85 -0.78 0.74 0.14 0.22 119.66 118.88 1ivz s GLN 112 Ca 0.00 -1.38 -0.24 0.00 0.05 0.00 0.00 55.36 53.80 1ivz s GLN 112 Cb 0.00 -2.49 0.06 0.00 1.10 0.00 0.00 33.01 31.68 1ivz s GLN 112 CO 0.00 -0.95 1.25 -1.17 -0.55 0.00 0.00 175.29 173.88 1ivz s LEU 113 N 1.33 3.79 0.00 3.68 1.98 0.03 -3.89 118.68 125.60 1ivz s LEU 113 Ca 0.09 -1.12 0.00 0.00 -2.89 0.00 0.00 54.13 50.21 1ivz s LEU 113 Cb -0.18 -2.51 0.00 0.00 0.66 0.00 0.00 46.19 44.16 1ivz s LEU 113 CO -0.18 -1.54 0.00 0.18 -1.89 0.00 0.00 176.35 172.93 1ivz n LEU 114 N 8.48 0.00 -0.90 -0.68 4.77 -1.26 -0.39 117.00 127.02 1ivz n LEU 114 Ca 0.15 0.00 0.04 0.00 -0.03 0.00 0.00 56.01 56.17 1ivz n LEU 114 Cb 0.49 0.00 0.06 0.00 -2.33 0.00 0.00 43.42 41.64 1ivz n LEU 114 CO 0.65 0.00 0.23 0.59 -1.33 0.00 0.00 177.39 177.53 1ivz n ASN 115 N 1.52 1.02 -3.65 -1.43 3.02 -1.26 -5.00 115.26 109.49 1ivz n ASN 115 Ca 0.00 -2.49 -0.29 0.00 -0.03 0.00 0.00 54.58 51.78 1ivz n ASN 115 Cb 0.00 -0.33 -0.16 0.00 -0.61 0.00 0.00 39.78 38.68 1ivz n ASN 115 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 1ivz s PHE 116 N -0.94 0.85 -0.28 3.10 0.40 0.48 -5.10 117.98 116.48 1ivz s PHE 116 Ca 0.25 -1.04 -0.29 0.00 -0.60 0.00 0.00 56.93 55.25 1ivz s PHE 116 Cb 0.27 -1.13 -0.01 0.00 0.51 0.00 0.00 43.02 42.66 1ivz s PHE 116 CO -0.08 -0.75 1.56 0.95 0.70 0.00 0.00 175.22 177.59 1ivz s THR 117 N 1.92 3.77 0.23 0.64 -4.23 -1.26 -0.79 115.64 115.92 1ivz s THR 117 Ca 0.06 0.85 0.09 0.00 -1.18 0.00 0.00 61.69 61.51 1ivz s THR 117 Cb -0.17 -3.85 -0.05 0.00 1.34 0.00 0.00 72.50 69.77 1ivz s THR 117 CO -0.24 -0.42 -0.16 -1.48 -0.54 0.00 0.00 174.62 171.79 1ivz s LEU 118 N 5.35 2.57 1.26 4.79 0.05 0.13 -1.74 118.68 131.09 1ivz s LEU 118 Ca 0.68 -1.02 -0.15 0.00 0.05 0.00 0.00 54.13 53.69 1ivz s LEU 118 Cb -0.21 -0.81 0.32 0.00 -2.05 0.00 0.00 46.19 43.44 1ivz s LEU 118 CO 0.29 -0.10 0.96 -0.67 -0.55 0.00 0.00 176.35 176.28 1ivz n ASP 119 N -0.45 -2.41 -0.05 1.48 -0.08 -1.17 -3.98 116.55 109.89 1ivz n ASP 119 Ca -0.07 -0.36 -0.10 0.00 -1.51 0.00 0.00 54.79 52.75 1ivz n ASP 119 Cb 0.60 -1.19 -0.03 0.00 2.34 0.00 0.00 41.12 42.84 1ivz n ASP 119 CO 0.00 0.00 0.00 -1.14 0.12 0.00 0.00 177.20 176.18 1ivz n ARG 120 N -5.17 0.25 -0.05 -0.67 0.63 -1.18 -4.44 116.66 106.04 1ivz n ARG 120 Ca 0.04 0.11 0.06 0.00 -0.92 0.00 0.00 57.85 57.14 1ivz n ARG 120 Cb 0.55 -0.93 0.44 0.00 0.45 0.00 0.00 32.46 32.97 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 -0.44 0.53 -0.08 -0.14 2.10 -1.95 -0.86 116.57 115.73 1ivz h LYS 121 Ca -0.21 -0.03 -0.07 0.00 -2.00 0.00 0.00 60.65 58.34 1ivz h LYS 121 Cb 1.01 -0.12 -0.01 0.00 -0.90 0.00 0.00 32.23 32.21 1ivz h LYS 121 CO -0.13 0.35 -0.26 0.66 -2.00 0.00 0.00 179.45 178.07 1ivz h SER 122 N 0.54 0.13 -3.19 7.07 4.64 -1.94 -3.43 113.55 117.37 1ivz h SER 122 Ca 0.21 -0.04 -0.53 0.00 -0.47 0.00 0.00 61.79 60.96 1ivz h SER 122 Cb 0.14 -0.04 0.07 0.00 -0.31 0.00 0.00 62.40 62.26 1ivz h SER 122 CO -0.05 0.40 0.87 -0.69 -0.87 0.00 0.00 176.83 176.48 1ivz s VAL 123 N -4.46 2.28 -0.06 0.95 1.01 -0.33 -4.44 120.40 115.35 1ivz s VAL 123 Ca -0.04 0.23 -0.30 0.00 0.00 0.00 0.00 61.98 61.86 1ivz s VAL 123 Cb 0.15 -3.14 0.11 0.00 0.00 0.00 0.00 36.38 33.50 1ivz s VAL 123 CO 0.73 0.03 0.96 0.12 0.00 0.00 0.00 175.10 176.94 1ivz s PHE 124 N 0.30 -0.32 -0.18 5.22 2.19 -0.33 -5.00 117.98 119.87 1ivz s PHE 124 Ca 0.65 0.27 -0.10 0.00 0.33 0.00 0.00 56.93 58.08 1ivz s PHE 124 Cb -0.46 0.52 0.06 0.00 -1.31 0.00 0.00 43.02 41.83 1ivz s PHE 124 CO 0.43 -0.46 0.43 0.54 1.83 0.00 0.00 175.22 177.99 1ivz s VAL 125 N -2.64 -0.02 0.35 3.12 0.11 -1.26 -1.81 120.40 118.25 1ivz s VAL 125 Ca 0.04 0.09 0.04 0.00 -2.93 0.00 0.00 61.98 59.22 1ivz s VAL 125 Cb -0.01 -0.63 -0.06 0.00 -1.53 0.00 0.00 36.38 34.14 1ivz s VAL 125 CO -0.06 0.04 0.05 -1.81 -3.33 0.00 0.00 175.10 169.98 1ivz s ASP 126 N 1.41 2.71 -0.82 3.54 1.01 -1.00 -4.78 116.67 118.74 1ivz s ASP 126 Ca -0.10 -1.40 -0.25 0.00 0.71 0.00 0.00 52.55 51.51 1ivz s ASP 126 Cb -0.08 -0.10 0.01 0.00 1.01 0.00 0.00 42.92 43.76 1ivz s ASP 126 CO -0.13 -0.60 1.58 -0.55 0.21 0.00 0.00 175.17 175.68 1ivz s SER 127 N -3.54 5.86 0.81 0.27 0.15 -1.26 -0.23 113.70 115.76 1ivz s SER 127 Ca 0.35 -0.60 -0.11 0.00 0.70 0.00 0.00 55.95 56.29 1ivz s SER 127 Cb 0.09 -2.56 0.08 0.00 -1.71 0.00 0.00 66.02 61.92 1ivz s SER 127 CO 0.16 -2.04 1.09 -0.83 1.20 0.00 0.00 173.24 172.82 1ivz s GLY 128 N 5.86 1.63 1.10 9.45 0.00 -0.99 -4.85 107.32 119.52 1ivz s GLY 128 Ca 0.52 -0.15 -0.13 0.00 0.00 0.00 0.00 44.72 44.96 1ivz s GLY 128 CO 0.06 0.29 0.81 -1.05 0.00 0.00 0.00 173.10 173.21 1ivz n PRO 129 N -3.52 -1.75 0.00 2.90 -0.02 -1.26 -4.65 135.00 126.70 1ivz n PRO 129 Ca 0.07 -0.47 0.00 0.00 -2.02 0.00 0.00 63.50 61.08 1ivz n PRO 129 Cb 0.56 -2.10 0.00 0.00 -0.02 0.00 0.00 33.50 31.94 1ivz n PRO 129 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1ivz n SER 130 N -3.93 0.00 0.00 2.55 2.88 -1.26 -4.72 113.62 109.14 1ivz n SER 130 Ca 0.05 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.59 1ivz n SER 130 Cb 0.55 0.18 0.00 0.00 -0.75 0.00 0.00 64.21 64.19 1ivz n SER 130 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 1ivz n SER 131 N -1.81 0.00 0.00 -3.46 7.64 -1.26 -5.05 113.62 109.67 1ivz n SER 131 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 1ivz n SER 131 Cb 0.00 0.04 0.00 0.00 -1.01 0.00 0.00 64.21 63.24 1ivz n SER 131 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64