#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 2.61 -0.28 1.61 0.01 -1.26 -5.09 113.70 111.30 1ivz s SER 2 Ca 0.00 -2.69 -0.24 0.00 1.31 0.00 0.00 55.95 54.33 1ivz s SER 2 Cb 0.00 -0.59 0.12 0.00 0.21 0.00 0.00 66.02 65.76 1ivz s SER 2 CO 0.00 -0.24 1.00 -0.94 0.41 0.00 0.00 173.24 173.47 1ivz s SER 3 N 0.42 -0.49 0.00 2.44 1.04 -1.26 -5.12 113.70 110.73 1ivz s SER 3 Ca 0.24 0.92 0.00 0.00 0.48 0.00 0.00 55.95 57.59 1ivz s SER 3 Cb -0.12 0.97 0.00 0.00 0.10 0.00 0.00 66.02 66.97 1ivz s SER 3 CO -0.08 -0.16 0.00 0.61 0.98 0.00 0.00 173.24 174.59 1ivz n GLY 4 N 2.44 -0.16 3.01 7.32 0.00 -1.26 -5.04 105.19 111.51 1ivz n GLY 4 Ca -0.13 -0.06 -0.31 0.00 0.00 0.00 0.00 46.02 45.52 1ivz n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1ivz s SER 5 N -4.00 3.47 0.00 1.61 1.04 -1.26 -4.91 113.70 109.64 1ivz s SER 5 Ca 0.00 -0.91 0.00 0.00 0.48 0.00 0.00 55.95 55.52 1ivz s SER 5 Cb 0.00 -1.29 0.00 0.00 0.10 0.00 0.00 66.02 64.83 1ivz s SER 5 CO 0.00 -0.13 0.00 -0.24 0.98 0.00 0.00 173.24 173.85 1ivz n SER 6 N 4.65 0.00 0.00 7.02 2.88 -1.26 -4.73 113.62 122.18 1ivz n SER 6 Ca -0.15 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.39 1ivz n SER 6 Cb 0.46 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.92 1ivz n SER 6 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1ivz n GLY 7 N 0.00 2.27 0.22 0.46 0.00 -1.26 -4.76 105.19 102.12 1ivz n GLY 7 Ca 0.00 -0.68 -0.08 0.00 0.00 0.00 0.00 46.02 45.26 1ivz n GLY 7 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1ivz h SER 8 N 0.00 0.64 -4.13 1.61 0.02 -2.04 -3.49 113.55 106.16 1ivz h SER 8 Ca 0.00 -0.13 0.00 0.00 -0.84 0.00 0.00 61.79 60.82 1ivz h SER 8 Cb 0.00 -0.16 0.00 0.00 0.14 0.00 0.00 62.40 62.38 1ivz h SER 8 CO 0.00 0.59 -0.81 -0.24 -1.14 0.00 0.00 176.83 175.23 1ivz n SER 9 N -4.61 -8.00 -4.23 3.07 2.88 -1.26 -5.05 113.62 96.42 1ivz n SER 9 Ca 0.02 1.12 -0.14 0.00 -1.33 0.00 0.00 58.87 58.54 1ivz n SER 9 Cb 0.12 -4.17 -0.10 0.00 -0.75 0.00 0.00 64.21 59.31 1ivz n SER 9 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 1ivz s SER 10 N -2.77 1.70 1.00 -3.46 0.01 -1.26 -5.02 113.70 103.91 1ivz s SER 10 Ca 0.00 -0.94 -0.00 0.00 1.31 0.00 0.00 55.95 56.32 1ivz s SER 10 Cb 0.00 -0.01 0.00 0.00 0.21 0.00 0.00 66.02 66.22 1ivz s SER 10 CO 0.00 -0.30 0.01 -1.54 0.41 0.00 0.00 173.24 171.83 1ivz n SER 11 N 0.09 -0.09 -3.71 2.44 3.41 -1.26 -4.56 113.62 109.94 1ivz n SER 11 Ca -0.12 -0.96 -0.12 0.00 -0.26 0.00 0.00 58.87 57.41 1ivz n SER 11 Cb 0.59 -0.01 -0.10 0.00 -0.26 0.00 0.00 64.21 64.43 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 -3.03 0.47 -0.19 4.33 -2.07 -1.26 -4.94 119.66 112.97 1ivz s GLN 12 Ca 0.01 0.70 0.00 0.00 -1.82 0.00 0.00 55.36 54.25 1ivz s GLN 12 Cb -0.00 0.13 0.04 0.00 -1.09 0.00 0.00 33.01 32.10 1ivz s GLN 12 CO 0.01 -0.10 -0.07 -1.01 -1.32 0.00 0.00 175.29 172.79 1ivz s HIS 13 N 0.75 2.09 -0.21 9.60 3.76 -1.26 -2.50 115.29 127.51 1ivz s HIS 13 Ca -0.04 -1.38 -0.04 0.00 -0.15 0.00 0.00 55.06 53.45 1ivz s HIS 13 Cb -0.05 -1.49 -0.02 0.00 1.11 0.00 0.00 32.58 32.13 1ivz s HIS 13 CO -0.05 -0.69 -0.02 -0.06 -0.85 0.00 0.00 174.74 173.06 1ivz s PHE 14 N 1.50 2.99 0.04 1.40 0.08 -1.10 -2.85 117.98 120.05 1ivz s PHE 14 Ca -0.01 -0.71 -0.30 0.00 0.12 0.00 0.00 56.93 56.03 1ivz s PHE 14 Cb -0.16 -2.10 -0.08 0.00 -0.57 0.00 0.00 43.02 40.11 1ivz s PHE 14 CO -0.08 -0.41 1.78 1.21 -0.10 0.00 0.00 175.22 177.62 1ivz s ASN 15 N 1.27 6.54 -0.33 1.36 3.84 0.31 0.11 114.94 128.03 1ivz s ASN 15 Ca 0.03 2.54 -0.09 0.00 0.21 0.00 0.00 52.86 55.55 1ivz s ASN 15 Cb -0.14 -2.55 0.01 0.00 -0.55 0.00 0.00 41.25 38.02 1ivz s ASN 15 CO -0.00 -0.97 0.14 -0.22 -2.79 0.00 0.00 177.10 173.26 1ivz s LEU 16 N 3.48 4.21 0.02 3.21 2.96 0.22 -2.25 118.68 130.52 1ivz s LEU 16 Ca 0.79 -0.77 0.02 0.00 -0.22 0.00 0.00 54.13 53.96 1ivz s LEU 16 Cb -0.40 -1.96 -0.01 0.00 0.50 0.00 0.00 46.19 44.32 1ivz s LEU 16 CO 0.35 -0.26 -0.07 0.20 -1.32 0.00 0.00 176.35 175.26 1ivz s ASN 17 N 1.54 0.74 -0.30 3.68 -0.87 -0.99 0.86 114.94 119.61 1ivz s ASN 17 Ca 0.03 -0.31 -0.19 0.00 -1.57 0.00 0.00 52.86 50.82 1ivz s ASN 17 Cb -0.18 -0.02 0.20 0.00 -0.02 0.00 0.00 41.25 41.23 1ivz s ASN 17 CO 0.05 -0.06 1.27 0.72 -2.57 0.00 0.00 177.10 176.51 1ivz s PHE 18 N -0.70 -0.11 0.19 2.20 -0.71 -1.04 -1.69 117.98 116.12 1ivz s PHE 18 Ca -0.03 0.19 -0.30 0.00 -1.04 0.00 0.00 56.93 55.74 1ivz s PHE 18 Cb -0.06 0.06 -0.08 0.00 -1.21 0.00 0.00 43.02 41.74 1ivz s PHE 18 CO 0.00 -0.05 1.14 0.99 -1.34 0.00 0.00 175.22 175.96 1ivz s THR 19 N 1.96 3.71 -0.07 -4.49 2.01 -1.26 -2.88 115.64 114.63 1ivz s THR 19 Ca -0.00 1.48 -0.04 0.00 0.31 0.00 0.00 61.69 63.43 1ivz s THR 19 Cb -0.01 -3.94 -0.04 0.00 0.01 0.00 0.00 72.50 68.52 1ivz s THR 19 CO -0.16 0.25 0.12 -0.63 -0.69 0.00 0.00 174.62 173.52 1ivz s ILE 20 N -0.22 5.17 -0.24 1.82 1.01 0.16 -3.46 121.20 125.43 1ivz s ILE 20 Ca 0.50 -0.06 0.13 0.00 0.00 0.00 0.00 60.65 61.23 1ivz s ILE 20 Cb -0.31 -3.30 0.60 0.00 0.01 0.00 0.00 42.46 39.46 1ivz s ILE 20 CO 0.36 0.50 1.55 0.35 0.00 0.00 0.00 174.94 177.70 1ivz n THR 21 N 1.61 2.54 -0.00 2.92 -2.24 -0.14 -0.75 114.28 118.22 1ivz n THR 21 Ca -0.16 -1.97 -0.00 0.00 -2.27 0.00 0.00 64.05 59.65 1ivz n THR 21 Cb 0.54 -0.30 -0.00 0.00 -2.10 0.00 0.00 70.33 68.47 1ivz n THR 21 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 1ivz n ASN 22 N -0.49 4.81 -4.47 3.42 5.15 -1.06 -4.86 115.26 117.76 1ivz n ASN 22 Ca 0.29 -0.00 -0.43 0.00 -0.60 0.00 0.00 54.58 53.84 1ivz n ASN 22 Cb 1.07 0.48 -0.06 0.00 -0.53 0.00 0.00 39.78 40.74 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 -4.11 4.73 -0.28 1.20 1.98 -1.26 -5.01 118.68 115.93 1ivz s LEU 23 Ca -0.00 -0.75 -0.29 0.00 -2.89 0.00 0.00 54.13 50.20 1ivz s LEU 23 Cb 0.00 -2.55 -0.01 0.00 0.66 0.00 0.00 46.19 44.29 1ivz s LEU 23 CO 0.02 -0.97 1.50 -2.16 -1.89 0.00 0.00 176.35 172.85 1ivz s PRO 24 N 2.97 3.77 0.07 0.98 0.04 -1.25 -4.03 135.00 137.55 1ivz s PRO 24 Ca 0.19 1.42 -0.30 0.00 0.04 0.00 0.00 61.00 62.35 1ivz s PRO 24 Cb -0.17 -3.99 -0.09 0.00 0.04 0.00 0.00 34.50 30.28 1ivz s PRO 24 CO 0.14 -1.31 1.81 -0.47 0.04 0.00 0.00 177.00 177.21 1ivz s TYR 25 N 5.08 1.94 0.43 0.56 6.14 -1.11 -4.98 117.35 125.40 1ivz s TYR 25 Ca 0.66 -0.05 0.04 0.00 0.64 0.00 0.00 57.07 58.36 1ivz s TYR 25 Cb -0.21 -4.12 -0.02 0.00 0.42 0.00 0.00 41.96 38.03 1ivz s TYR 25 CO 0.28 -4.74 0.13 -1.54 0.64 0.00 0.00 175.55 170.32 1ivz s SER 26 N 3.21 2.95 0.50 4.32 1.04 -1.26 -4.91 113.70 119.54 1ivz s SER 26 Ca 0.81 -1.71 0.14 0.00 0.48 0.00 0.00 55.95 55.67 1ivz s SER 26 Cb -0.42 0.56 1.18 0.00 0.10 0.00 0.00 66.02 67.44 1ivz s SER 26 CO 0.36 -0.96 2.12 1.56 0.98 0.00 0.00 173.24 177.30 1ivz h GLN 27 N 1.72 0.12 -0.15 4.02 1.08 -1.99 -2.35 115.11 117.57 1ivz h GLN 27 Ca -0.35 -0.01 -0.00 0.00 -1.45 0.00 0.00 58.65 56.84 1ivz h GLN 27 Cb 1.28 -0.03 -0.01 0.00 -0.05 0.00 0.00 27.48 28.67 1ivz h GLN 27 CO 0.56 0.08 0.07 -0.44 -0.95 0.00 0.00 178.83 178.16 1ivz h ASP 28 N 0.13 0.19 0.63 1.46 5.19 -1.96 -2.10 116.42 119.96 1ivz h ASP 28 Ca 0.05 -0.11 0.00 0.00 -0.62 0.00 0.00 57.03 56.35 1ivz h ASP 28 Cb 0.05 -0.05 0.00 0.00 0.18 0.00 0.00 39.33 39.51 1ivz h ASP 28 CO -0.01 0.25 0.00 -0.38 -3.12 0.00 0.00 179.24 175.98 1ivz n ILE 29 N -4.92 0.90 0.36 0.35 2.08 -0.91 -2.20 119.36 115.02 1ivz n ILE 29 Ca -0.05 0.24 0.12 0.00 0.56 0.00 0.00 62.75 63.63 1ivz n ILE 29 Cb 0.09 -1.10 0.15 0.00 -0.75 0.00 0.00 39.64 38.02 1ivz n ILE 29 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 1ivz h ALA 30 N 2.35 0.70 -3.25 -1.39 0.00 -1.05 -3.44 119.26 113.17 1ivz h ALA 30 Ca 0.00 0.00 -0.58 0.00 0.00 0.00 0.00 54.91 54.33 1ivz h ALA 30 Cb 0.31 0.00 -0.37 0.00 0.00 0.00 0.00 17.79 17.74 1ivz h ALA 30 CO 0.00 0.00 -0.81 -0.65 0.00 0.00 0.00 179.25 177.79 1ivz s GLN 31 N -3.23 1.86 -0.64 0.00 -0.21 -0.93 -5.03 119.66 111.47 1ivz s GLN 31 Ca 0.05 -0.55 -0.09 0.00 0.02 0.00 0.00 55.36 54.79 1ivz s GLN 31 Cb 0.10 -2.04 -0.08 0.00 1.00 0.00 0.00 33.01 31.99 1ivz s GLN 31 CO 0.72 -0.33 1.81 -2.30 -2.12 0.00 0.00 175.29 173.06 1ivz n PRO 32 N 4.81 1.42 0.00 2.91 -0.02 -1.26 -2.98 135.00 139.87 1ivz n PRO 32 Ca -0.14 -1.31 0.00 0.00 -2.02 0.00 0.00 63.50 60.03 1ivz n PRO 32 Cb 0.49 -2.45 0.00 0.00 -0.02 0.00 0.00 33.50 31.52 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 5.29 0.00 -3.58 2.55 2.88 -1.26 -5.06 113.62 114.44 1ivz n SER 33 Ca 0.36 0.00 -0.30 0.00 -1.33 0.00 0.00 58.87 57.60 1ivz n SER 33 Cb 0.17 0.02 0.29 0.00 -0.75 0.00 0.00 64.21 63.94 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 -1.08 1.30 -0.00 2.46 -4.23 -1.16 -4.95 115.64 107.98 1ivz s THR 34 Ca 0.00 0.00 -0.10 0.00 -1.18 0.00 0.00 61.69 60.41 1ivz s THR 34 Cb 0.00 -2.06 -0.31 0.00 1.34 0.00 0.00 72.50 71.47 1ivz s THR 34 CO 0.00 0.00 0.85 0.74 -0.54 0.00 0.00 174.62 175.67 1ivz h THR 35 N -3.35 1.14 -0.91 3.99 2.02 -1.92 -3.32 112.91 110.56 1ivz h THR 35 Ca -0.46 -2.68 0.04 0.00 0.77 0.00 0.00 66.41 64.07 1ivz h THR 35 Cb 1.34 2.86 -0.05 0.00 -1.74 0.00 0.00 68.15 70.56 1ivz h THR 35 CO 0.31 0.84 0.60 0.50 0.37 0.00 0.00 175.52 178.14 1ivz h LYS 36 N 0.11 1.09 -0.13 6.66 1.63 -1.93 0.40 116.57 124.40 1ivz h LYS 36 Ca -0.28 -0.07 0.00 0.00 -0.85 0.00 0.00 60.65 59.46 1ivz h LYS 36 Cb 2.09 -0.25 -0.01 0.00 -0.60 0.00 0.00 32.23 33.47 1ivz h LYS 36 CO 0.21 0.72 0.08 -0.92 -3.45 0.00 0.00 179.45 176.09 1ivz h TYR 37 N 1.12 0.14 -0.09 1.91 5.03 -1.70 0.23 116.97 123.62 1ivz h TYR 37 Ca 0.37 0.00 -0.19 0.00 2.58 0.00 0.00 58.73 61.49 1ivz h TYR 37 Cb 0.04 -0.05 -0.00 0.00 1.55 0.00 0.00 36.73 38.27 1ivz h TYR 37 CO -0.00 0.09 -0.74 1.96 -1.32 0.00 0.00 178.16 178.15 1ivz h GLN 38 N 0.16 0.46 0.71 1.82 7.50 -1.55 -2.08 115.11 122.13 1ivz h GLN 38 Ca 0.05 -0.38 -0.03 0.00 0.50 0.00 0.00 58.65 58.78 1ivz h GLN 38 Cb -0.01 0.08 0.01 0.00 0.05 0.00 0.00 27.48 27.61 1ivz h GLN 38 CO -0.02 1.02 -0.34 1.96 -1.50 0.00 0.00 178.83 179.95 1ivz h GLN 39 N 0.32 -0.91 -0.79 1.46 4.20 0.02 -0.72 115.11 118.68 1ivz h GLN 39 Ca -0.03 0.06 -0.03 0.00 0.06 0.00 0.00 58.65 58.71 1ivz h GLN 39 Cb 1.32 0.21 -0.04 0.00 0.30 0.00 0.00 27.48 29.28 1ivz h GLN 39 CO 0.13 -0.60 0.39 1.15 -0.67 0.00 0.00 178.83 179.24 1ivz h THR 40 N -0.98 1.25 -0.77 -0.54 2.02 -1.04 0.43 112.91 113.28 1ivz h THR 40 Ca -0.10 -0.67 0.03 0.00 0.77 0.00 0.00 66.41 66.44 1ivz h THR 40 Cb 0.74 0.23 -0.04 0.00 -1.74 0.00 0.00 68.15 67.33 1ivz h THR 40 CO 0.16 0.29 0.50 0.50 0.37 0.00 0.00 175.52 177.34 1ivz h LYS 41 N 1.12 0.91 0.04 6.66 3.64 -1.26 -1.41 116.57 126.27 1ivz h LYS 41 Ca 0.27 -0.05 -0.27 0.00 -1.27 0.00 0.00 60.65 59.33 1ivz h LYS 41 Cb 0.10 -0.21 -0.03 0.00 -0.41 0.00 0.00 32.23 31.68 1ivz h LYS 41 CO -0.04 0.60 -1.44 -0.09 -2.27 0.00 0.00 179.45 176.22 1ivz h ARG 42 N 0.94 0.09 -0.30 1.90 9.65 -0.62 -3.02 114.38 123.02 1ivz h ARG 42 Ca 0.30 -0.15 0.00 0.00 -1.10 0.00 0.00 59.98 59.03 1ivz h ARG 42 Cb 0.04 0.06 -0.01 0.00 -1.39 0.00 0.00 29.97 28.66 1ivz h ARG 42 CO -0.09 0.87 0.19 1.03 2.80 0.00 0.00 179.97 184.78 1ivz h SER 43 N 0.02 0.34 -0.16 -3.80 0.87 0.38 0.62 113.55 111.83 1ivz h SER 43 Ca -0.19 -0.02 -0.09 0.00 -1.23 0.00 0.00 61.79 60.26 1ivz h SER 43 Cb 1.94 -0.09 -0.00 0.00 -0.44 0.00 0.00 62.40 63.81 1ivz h SER 43 CO 0.12 0.26 -0.27 0.40 -0.53 0.00 0.00 176.83 176.82 1ivz h ILE 44 N 0.39 1.36 -0.27 2.23 2.04 -1.41 -2.00 117.51 119.85 1ivz h ILE 44 Ca 0.11 -1.51 0.02 0.00 1.00 0.00 0.00 64.86 64.48 1ivz h ILE 44 Cb -0.03 1.95 -0.01 0.00 -0.74 0.00 0.00 36.82 37.99 1ivz h ILE 44 CO -0.02 0.45 0.18 -0.08 0.00 0.00 0.00 178.15 178.68 1ivz h GLU 45 N 0.08 0.28 0.01 2.37 4.81 -1.40 0.14 114.58 120.88 1ivz h GLU 45 Ca 0.01 -0.02 -0.25 0.00 -0.13 0.00 0.00 59.36 58.97 1ivz h GLU 45 Cb 0.85 -0.06 0.02 0.00 0.63 0.00 0.00 28.75 30.19 1ivz h GLU 45 CO 0.06 0.19 -0.98 -0.97 -0.73 0.00 0.00 179.01 176.58 1ivz h ASN 46 N 0.29 0.85 -0.39 1.04 -1.24 -0.79 -2.11 115.58 113.24 1ivz h ASN 46 Ca 0.11 -0.75 -0.13 0.00 0.71 0.00 0.00 56.30 56.24 1ivz h ASN 46 Cb 0.08 -0.26 -0.01 0.00 0.73 0.00 0.00 38.32 38.86 1ivz h ASN 46 CO -0.02 1.49 -0.25 0.00 -1.29 0.00 0.00 177.43 177.35 1ivz h ALA 47 N 0.38 0.74 -0.05 1.57 0.00 -0.65 -2.92 119.26 118.32 1ivz h ALA 47 Ca -0.13 -0.40 -0.13 0.00 0.00 0.00 0.00 54.91 54.25 1ivz h ALA 47 Cb 1.65 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 19.27 1ivz h ALA 47 CO 0.19 0.66 -0.58 -0.07 0.00 0.00 0.00 179.25 179.46 1ivz h LEU 48 N 0.77 0.18 0.85 0.00 3.38 -0.81 -2.63 115.31 117.05 1ivz h LEU 48 Ca 0.09 -0.10 -0.04 0.00 0.09 0.00 0.00 57.88 57.92 1ivz h LEU 48 Cb 0.81 -0.05 0.01 0.00 0.09 0.00 0.00 40.66 41.52 1ivz h LEU 48 CO 0.07 0.72 -0.41 -1.13 0.09 0.00 0.00 178.44 177.78 1ivz h ASN 49 N 0.12 -0.96 -0.12 -0.43 -0.73 -1.21 -2.38 115.58 109.87 1ivz h ASN 49 Ca -0.00 0.03 -0.01 0.00 1.87 0.00 0.00 56.30 58.19 1ivz h ASN 49 Cb 1.06 0.25 -0.01 0.00 0.27 0.00 0.00 38.32 39.89 1ivz h ASN 49 CO 0.09 -0.68 0.06 0.06 -0.37 0.00 0.00 177.43 176.59 1ivz h GLN 50 N -1.16 0.19 -0.53 6.67 3.07 -1.58 -1.62 115.11 120.16 1ivz h GLN 50 Ca -0.12 -0.02 -0.01 0.00 0.09 0.00 0.00 58.65 58.60 1ivz h GLN 50 Cb 0.87 -0.04 -0.03 0.00 0.08 0.00 0.00 27.48 28.37 1ivz h GLN 50 CO 0.19 0.16 0.30 1.25 0.09 0.00 0.00 178.83 180.82 1ivz h LEU 51 N 0.20 0.63 -0.37 0.06 6.46 -1.17 -0.22 115.31 120.90 1ivz h LEU 51 Ca 0.05 -0.04 -0.19 0.00 -0.12 0.00 0.00 57.88 57.59 1ivz h LEU 51 Cb 0.03 -0.16 -0.00 0.00 -0.73 0.00 0.00 40.66 39.80 1ivz h LEU 51 CO -0.01 0.50 -0.68 -0.26 -0.62 0.00 0.00 178.44 177.37 1ivz h PHE 52 N 0.73 0.76 0.00 1.25 0.04 -0.79 0.37 116.94 119.30 1ivz h PHE 52 Ca 0.19 -0.31 -0.11 0.00 2.80 0.00 0.00 57.97 60.54 1ivz h PHE 52 Cb -0.01 -0.13 -0.02 0.00 2.20 0.00 0.00 35.95 38.00 1ivz h PHE 52 CO 0.00 1.08 -0.54 0.00 -0.60 0.00 0.00 178.31 178.26 1ivz h ARG 53 N 0.41 0.00 0.00 1.51 2.47 -1.20 -3.14 114.38 114.43 1ivz h ARG 53 Ca -0.02 0.00 -0.16 0.00 -1.26 0.00 0.00 59.98 58.53 1ivz h ARG 53 Cb 1.26 0.00 -0.03 0.00 -1.65 0.00 0.00 29.97 29.55 1ivz h ARG 53 CO 0.13 0.54 -1.57 0.09 0.56 0.00 0.00 179.97 179.71 1ivz n ASN 54 N -3.76 0.66 -4.33 7.04 3.02 -0.15 -4.81 115.26 112.93 1ivz n ASN 54 Ca -0.01 0.29 -0.30 0.00 -0.03 0.00 0.00 54.58 54.53 1ivz n ASN 54 Cb 0.57 0.48 0.22 0.00 -0.61 0.00 0.00 39.78 40.44 1ivz n ASN 54 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 1ivz n SER 55 N -2.79 -2.21 0.12 6.41 3.41 0.13 -4.91 113.62 113.77 1ivz n SER 55 Ca -0.11 -0.20 -0.02 0.00 -0.26 0.00 0.00 58.87 58.27 1ivz n SER 55 Cb 0.83 -1.09 0.10 0.00 -0.26 0.00 0.00 64.21 63.79 1ivz n SER 55 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 1ivz h SER 56 N -2.48 0.00 -1.10 4.04 0.02 -1.87 -3.24 113.55 108.91 1ivz h SER 56 Ca -0.58 0.00 -0.54 0.00 -0.84 0.00 0.00 61.79 59.83 1ivz h SER 56 Cb 1.34 0.00 -0.20 0.00 0.14 0.00 0.00 62.40 63.68 1ivz h SER 56 CO 0.44 0.71 0.61 2.30 -1.14 0.00 0.00 176.83 179.75 1ivz n ILE 57 N -3.65 3.30 -1.50 3.27 -5.35 -1.26 -4.72 119.36 109.45 1ivz n ILE 57 Ca -0.01 -2.92 -0.27 0.00 -0.27 0.00 0.00 62.75 59.28 1ivz n ILE 57 Cb 0.70 -1.39 -0.06 0.00 -1.74 0.00 0.00 39.64 37.15 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 0.17 2.63 0.00 6.28 2.85 -1.22 -3.93 118.16 124.94 1ivz n LYS 58 Ca 0.48 -2.34 0.00 0.00 -1.05 0.00 0.00 58.31 55.40 1ivz n LYS 58 Cb 0.51 -2.19 0.00 0.00 -0.65 0.00 0.00 35.03 32.70 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 1.16 0.49 -1.07 -5.58 3.41 -1.26 -4.86 113.62 105.92 1ivz n SER 59 Ca 0.50 0.00 0.02 0.00 -0.26 0.00 0.00 58.87 59.13 1ivz n SER 59 Cb 0.55 0.00 0.23 0.00 -0.26 0.00 0.00 64.21 64.73 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 -2.26 1.12 -3.91 7.33 4.01 -1.26 -4.97 117.16 117.24 1ivz n TYR 60 Ca 0.00 -1.19 -0.36 0.00 -0.16 0.00 0.00 57.90 56.19 1ivz n TYR 60 Cb 0.14 -0.42 -0.12 0.00 -0.31 0.00 0.00 39.34 38.64 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 -3.01 3.12 0.00 -0.72 2.19 -1.25 -0.53 117.98 117.78 1ivz s PHE 61 Ca 0.44 -0.26 0.00 0.00 0.33 0.00 0.00 56.93 57.44 1ivz s PHE 61 Cb 0.37 -2.16 0.00 0.00 -1.31 0.00 0.00 43.02 39.92 1ivz s PHE 61 CO 0.06 -0.17 0.00 0.43 1.83 0.00 0.00 175.22 177.36 1ivz n SER 62 N 4.37 0.00 -2.46 6.13 7.64 -1.24 -4.78 113.62 123.29 1ivz n SER 62 Ca -0.16 0.20 -0.01 0.00 1.01 0.00 0.00 58.87 59.91 1ivz n SER 62 Cb 0.52 -0.30 0.01 0.00 -1.01 0.00 0.00 64.21 63.43 1ivz n SER 62 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 1ivz n ASP 63 N -1.62 -1.02 -4.71 6.43 8.00 -1.25 -5.05 116.55 117.33 1ivz n ASP 63 Ca 0.00 -1.50 -0.20 0.00 0.71 0.00 0.00 54.79 53.80 1ivz n ASP 63 Cb 0.00 1.64 0.04 0.00 -0.02 0.00 0.00 41.12 42.78 1ivz n ASP 63 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1ivz s GLN 65 N -4.34 0.81 -0.43 0.00 0.74 -0.51 -4.86 119.66 111.07 1ivz s GLN 65 Ca 0.47 -0.69 -0.27 0.00 0.05 0.00 0.00 55.36 54.93 1ivz s GLN 65 Cb -0.04 -0.28 -0.04 0.00 1.10 0.00 0.00 33.01 33.75 1ivz s GLN 65 CO 0.30 -1.22 2.08 0.54 -0.55 0.00 0.00 175.29 176.43 1ivz s VAL 66 N 1.46 3.22 0.00 1.34 0.11 -1.26 -1.28 120.40 123.99 1ivz s VAL 66 Ca 0.19 0.18 -0.15 0.00 -2.93 0.00 0.00 61.98 59.27 1ivz s VAL 66 Cb -0.07 -3.41 -0.08 0.00 -1.53 0.00 0.00 36.38 31.28 1ivz s VAL 66 CO -0.06 -0.34 0.87 -0.07 -3.33 0.00 0.00 175.10 172.17 1ivz h LEU 67 N 16.41 -0.46 0.00 2.54 3.38 0.48 -3.48 115.31 134.19 1ivz h LEU 67 Ca -0.30 0.02 0.03 0.00 0.09 0.00 0.00 57.88 57.71 1ivz h LEU 67 Cb 1.21 0.12 -0.00 0.00 0.09 0.00 0.00 40.66 42.07 1ivz h LEU 67 CO 1.10 -0.22 0.14 0.00 0.09 0.00 0.00 178.44 179.55 1ivz n ALA 68 N -2.44 -0.66 -3.08 1.53 0.00 -1.13 -5.04 120.51 109.70 1ivz n ALA 68 Ca -0.07 -0.29 -0.32 0.00 0.00 0.00 0.00 53.44 52.76 1ivz n ALA 68 Cb 0.22 0.18 -0.15 0.00 0.00 0.00 0.00 19.45 19.70 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 -5.53 2.70 -0.25 0.00 0.08 -1.26 -2.00 117.98 111.71 1ivz s PHE 69 Ca 0.06 -0.76 -0.06 0.00 0.12 0.00 0.00 56.93 56.28 1ivz s PHE 69 Cb -0.01 -1.77 -0.02 0.00 -0.57 0.00 0.00 43.02 40.65 1ivz s PHE 69 CO 0.02 -0.26 0.03 0.50 -0.10 0.00 0.00 175.22 175.41 1ivz s ARG 70 N 0.26 3.48 0.02 0.44 6.06 0.20 -4.95 118.95 124.46 1ivz s ARG 70 Ca -0.12 -0.58 -0.30 0.00 -2.50 0.00 0.00 55.73 52.22 1ivz s ARG 70 Cb -0.16 -3.22 -0.05 0.00 0.06 0.00 0.00 34.95 31.57 1ivz s ARG 70 CO 0.06 -0.23 1.25 0.45 -2.50 0.00 0.00 175.30 174.33 1ivz s SER 71 N 1.55 7.02 0.82 -2.12 0.15 -1.26 0.52 113.70 120.38 1ivz s SER 71 Ca 0.06 1.99 -0.12 0.00 0.70 0.00 0.00 55.95 58.58 1ivz s SER 71 Cb -0.15 -2.57 0.08 0.00 -1.71 0.00 0.00 66.02 61.67 1ivz s SER 71 CO 0.01 -0.56 1.12 0.68 1.20 0.00 0.00 173.24 175.69 1ivz s VAL 72 N 1.63 2.71 -0.54 4.45 -7.23 -1.26 -4.91 120.40 115.25 1ivz s VAL 72 Ca 0.59 0.23 0.05 0.00 -1.81 0.00 0.00 61.98 61.04 1ivz s VAL 72 Cb -0.29 -3.04 0.18 0.00 0.56 0.00 0.00 36.38 33.79 1ivz s VAL 72 CO 0.27 -0.30 0.44 -0.24 -0.31 0.00 0.00 175.10 174.96 1ivz n SER 73 N -3.45 1.22 0.20 4.85 2.88 -1.26 -4.59 113.62 113.46 1ivz n SER 73 Ca 0.07 -2.80 0.00 0.00 -1.33 0.00 0.00 58.87 54.81 1ivz n SER 73 Cb 0.58 -0.65 0.00 0.00 -0.75 0.00 0.00 64.21 63.39 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 2.26 -3.52 -0.00 -3.46 5.15 -1.26 -4.97 115.26 109.46 1ivz n ASN 74 Ca 0.25 0.82 0.05 0.00 -0.60 0.00 0.00 54.58 55.10 1ivz n ASN 74 Cb 0.43 3.35 -0.07 0.00 -0.53 0.00 0.00 39.78 42.95 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 -3.34 2.20 -1.98 1.20 5.15 -1.26 -5.01 115.26 112.22 1ivz n ASN 75 Ca 0.00 -0.16 -0.17 0.00 -0.60 0.00 0.00 54.58 53.65 1ivz n ASN 75 Cb 0.00 1.35 0.00 0.00 -0.53 0.00 0.00 39.78 40.60 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 -1.71 -4.91 0.00 1.20 5.03 -1.26 -4.84 115.26 108.77 1ivz n ASN 76 Ca -0.01 -0.06 0.00 0.00 0.87 0.00 0.00 54.58 55.38 1ivz n ASN 76 Cb 0.24 -3.96 0.00 0.00 -1.02 0.00 0.00 39.78 35.04 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 -1.22 0.86 -4.28 6.41 2.85 -1.26 -4.71 115.26 113.92 1ivz n ASN 77 Ca -0.17 0.00 -0.29 0.00 -0.11 0.00 0.00 54.58 54.01 1ivz n ASN 77 Cb 0.63 0.00 0.25 0.00 1.24 0.00 0.00 39.78 41.90 1ivz n ASN 77 CO 0.00 0.00 0.00 -1.00 -2.11 0.00 0.00 177.26 174.15 1ivz s HIS 78 N -1.84 1.06 -0.10 1.20 3.76 -1.26 -2.76 115.29 115.35 1ivz s HIS 78 Ca 0.00 0.94 -0.05 0.00 -0.15 0.00 0.00 55.06 55.81 1ivz s HIS 78 Cb 0.00 -3.12 0.05 0.00 1.11 0.00 0.00 32.58 30.61 1ivz s HIS 78 CO 0.00 -3.93 0.23 0.99 -0.85 0.00 0.00 174.74 171.18 1ivz s THR 79 N -2.58 -0.09 -0.24 1.30 2.01 0.07 -4.24 115.64 111.87 1ivz s THR 79 Ca 0.68 0.17 -0.24 0.00 0.31 0.00 0.00 61.69 62.61 1ivz s THR 79 Cb -0.20 -0.37 -0.01 0.00 0.01 0.00 0.00 72.50 71.93 1ivz s THR 79 CO 0.61 0.07 0.82 -0.83 -0.69 0.00 0.00 174.62 174.60 1ivz s GLY 80 N 1.42 1.76 -0.19 4.40 0.00 0.19 0.35 107.32 115.25 1ivz s GLY 80 Ca -0.08 -0.16 -0.16 0.00 0.00 0.00 0.00 44.72 44.33 1ivz s GLY 80 CO -0.08 1.79 0.38 0.14 0.00 0.00 0.00 173.10 175.33 1ivz s VAL 81 N 2.83 5.22 -0.75 1.40 1.01 -1.14 0.58 120.40 129.56 1ivz s VAL 81 Ca 0.34 0.69 -0.00 0.00 0.00 0.00 0.00 61.98 63.01 1ivz s VAL 81 Cb -0.15 -3.71 0.19 0.00 0.00 0.00 0.00 36.38 32.70 1ivz s VAL 81 CO 0.07 0.29 0.58 -1.81 0.00 0.00 0.00 175.10 174.23 1ivz s ASP 82 N 0.90 5.40 0.44 3.32 1.11 -0.85 -2.50 116.67 124.50 1ivz s ASP 82 Ca 0.19 -3.44 0.05 0.00 0.18 0.00 0.00 52.55 49.54 1ivz s ASP 82 Cb -0.14 -1.82 0.05 0.00 1.07 0.00 0.00 42.92 42.08 1ivz s ASP 82 CO 0.07 -0.22 0.43 -1.54 1.18 0.00 0.00 175.17 175.09 1ivz n SER 83 N 2.67 2.14 -3.76 0.27 3.41 0.25 0.11 113.62 118.71 1ivz n SER 83 Ca 0.16 -2.40 -0.23 0.00 -0.26 0.00 0.00 58.87 56.13 1ivz n SER 83 Cb 0.36 -0.14 -0.17 0.00 -0.26 0.00 0.00 64.21 64.00 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 0.60 -1.27 1.04 1.98 -0.40 -0.61 118.68 120.02 1ivz s LEU 84 Ca 0.33 -0.13 -0.15 0.00 -2.89 0.00 0.00 54.13 51.28 1ivz s LEU 84 Cb -0.03 -0.43 0.12 0.00 0.66 0.00 0.00 46.19 46.51 1ivz s LEU 84 CO 0.21 -0.21 1.63 0.00 -1.89 0.00 0.00 176.35 176.09 1ivz s ASN 86 N 3.38 5.38 0.22 0.00 0.01 -0.87 -2.69 114.94 120.36 1ivz s ASN 86 Ca 0.48 1.87 0.01 0.00 -0.71 0.00 0.00 52.86 54.51 1ivz s ASN 86 Cb 0.02 -2.54 -0.05 0.00 0.41 0.00 0.00 41.25 39.09 1ivz s ASN 86 CO 0.03 -1.45 0.08 -0.36 -1.51 0.00 0.00 177.10 173.90 1ivz s PHE 87 N -2.50 1.33 0.70 2.20 0.40 -1.04 -3.61 117.98 115.46 1ivz s PHE 87 Ca 0.64 -1.20 -0.15 0.00 -0.60 0.00 0.00 56.93 55.62 1ivz s PHE 87 Cb -0.18 -0.75 0.02 0.00 0.51 0.00 0.00 43.02 42.63 1ivz s PHE 87 CO 0.42 -0.40 1.15 -1.12 0.70 0.00 0.00 175.22 175.97 1ivz s SER 88 N -3.23 4.59 0.32 1.36 0.01 0.31 -4.45 113.70 112.62 1ivz s SER 88 Ca 0.34 2.16 0.15 0.00 1.31 0.00 0.00 55.95 59.91 1ivz s SER 88 Cb 0.07 -2.57 0.51 0.00 0.21 0.00 0.00 66.02 64.25 1ivz s SER 88 CO 0.10 -1.98 1.67 1.55 0.41 0.00 0.00 173.24 174.99 1ivz h PRO 89 N -0.22 0.00 -0.44 12.44 0.13 -1.90 -3.21 132.00 138.80 1ivz h PRO 89 Ca -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 1ivz h PRO 89 Cb 1.27 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.38 1ivz h PRO 89 CO 0.51 0.50 0.28 -0.07 -0.23 0.00 0.00 178.00 178.99 1ivz h LEU 90 N 0.00 0.51 0.00 1.56 4.07 -1.92 -3.35 115.31 116.18 1ivz h LEU 90 Ca -0.00 -0.03 -0.33 0.00 0.08 0.00 0.00 57.88 57.59 1ivz h LEU 90 Cb 1.00 -0.13 0.20 0.00 1.08 0.00 0.00 40.66 42.81 1ivz h LEU 90 CO 0.06 0.39 -0.16 0.00 -1.08 0.00 0.00 178.44 177.65 1ivz n ALA 91 N -2.23 -4.78 0.00 1.53 0.00 -1.21 -4.87 120.51 108.95 1ivz n ALA 91 Ca 0.01 -1.39 0.00 0.00 0.00 0.00 0.00 53.44 52.06 1ivz n ALA 91 Cb 0.03 -0.12 0.00 0.00 0.00 0.00 0.00 19.45 19.36 1ivz n ALA 91 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 1ivz n ARG 92 N -5.38 0.00 -1.43 0.00 0.63 -1.26 -4.57 116.66 104.65 1ivz n ARG 92 Ca 0.12 0.00 -0.26 0.00 -0.92 0.00 0.00 57.85 56.80 1ivz n ARG 92 Cb 0.54 0.00 -0.05 0.00 0.45 0.00 0.00 32.46 33.40 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 2.34 -3.58 -0.14 3.00 -1.26 -4.86 116.66 111.67 1ivz n ARG 93 Ca 0.00 -2.26 -0.41 0.00 -0.01 0.00 0.00 57.85 55.17 1ivz n ARG 93 Cb 0.00 -2.10 -0.09 0.00 0.00 0.00 0.00 32.46 30.27 1ivz n ARG 93 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.63 177.71 1ivz s VAL 94 N -2.22 4.22 0.58 1.55 1.01 -1.26 -5.08 120.40 119.20 1ivz s VAL 94 Ca 0.57 -1.58 -0.16 0.00 0.00 0.00 0.00 61.98 60.81 1ivz s VAL 94 Cb 0.37 -3.68 -0.04 0.00 0.00 0.00 0.00 36.38 33.03 1ivz s VAL 94 CO -0.20 -0.63 1.04 -1.81 0.00 0.00 0.00 175.10 173.50 1ivz s ASP 95 N 2.38 5.96 0.21 3.32 1.01 -1.26 -4.96 116.67 123.33 1ivz s ASP 95 Ca 0.04 1.75 -0.09 0.00 0.71 0.00 0.00 52.55 54.97 1ivz s ASP 95 Cb -0.24 -2.53 0.16 0.00 1.01 0.00 0.00 42.92 41.32 1ivz s ASP 95 CO 0.01 -1.04 1.84 0.08 0.21 0.00 0.00 175.17 176.26 1ivz h ARG 96 N 0.51 1.10 -0.18 8.23 0.11 -1.98 -1.87 114.38 120.30 1ivz h ARG 96 Ca -0.47 -0.12 0.05 0.00 0.10 0.00 0.00 59.98 59.54 1ivz h ARG 96 Cb 1.21 -0.22 -0.01 0.00 1.11 0.00 0.00 29.97 32.07 1ivz h ARG 96 CO 0.58 0.81 0.18 0.28 0.10 0.00 0.00 179.97 181.92 1ivz h VAL 97 N 1.10 0.56 0.37 0.08 2.07 -1.93 -2.44 116.25 116.06 1ivz h VAL 97 Ca 0.28 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.79 1ivz h VAL 97 Cb 0.02 0.86 -0.01 0.00 -1.52 0.00 0.00 31.29 30.64 1ivz h VAL 97 CO -0.05 0.00 -0.24 0.00 0.02 0.00 0.00 177.57 177.30 1ivz h ALA 98 N 1.81 -0.59 0.00 1.67 0.00 -1.71 0.59 119.26 121.03 1ivz h ALA 98 Ca 0.09 -0.11 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 1ivz h ALA 98 Cb 0.44 0.31 -0.00 0.00 0.00 0.00 0.00 17.79 18.54 1ivz h ALA 98 CO -0.00 -0.85 -0.07 0.82 0.00 0.00 0.00 179.25 179.15 1ivz h ILE 99 N -0.60 0.23 0.14 0.00 2.04 -1.55 -1.79 117.51 115.98 1ivz h ILE 99 Ca -0.04 -0.53 -0.22 0.00 1.00 0.00 0.00 64.86 65.07 1ivz h ILE 99 Cb 0.50 1.43 0.01 0.00 -0.74 0.00 0.00 36.82 38.02 1ivz h ILE 99 CO 0.03 0.06 -1.03 0.22 0.00 0.00 0.00 178.15 177.43 1ivz h TYR 100 N 0.00 0.53 0.05 1.37 3.20 -1.13 -2.76 116.97 118.22 1ivz h TYR 100 Ca -0.00 -0.39 -0.00 0.00 3.14 0.00 0.00 58.73 61.48 1ivz h TYR 100 Cb 0.42 -0.02 0.00 0.00 1.54 0.00 0.00 36.73 38.67 1ivz h TYR 100 CO 0.00 1.40 -0.02 0.93 -1.64 0.00 0.00 178.16 178.82 1ivz h GLU 101 N -0.33 -0.06 -0.64 1.82 5.08 0.32 -2.05 114.58 118.71 1ivz h GLU 101 Ca -0.20 0.00 -0.05 0.00 -1.00 0.00 0.00 59.36 58.11 1ivz h GLU 101 Cb 1.70 0.01 -0.03 0.00 0.50 0.00 0.00 28.75 30.94 1ivz h GLU 101 CO 0.13 0.27 0.19 1.05 -1.00 0.00 0.00 179.01 179.64 1ivz h GLU 102 N -0.40 0.98 -0.29 2.33 -0.00 -1.50 -1.94 114.58 113.76 1ivz h GLU 102 Ca -0.01 -0.20 -0.06 0.00 -0.00 0.00 0.00 59.36 59.09 1ivz h GLU 102 Cb 0.36 -0.15 -0.02 0.00 -0.00 0.00 0.00 28.75 28.95 1ivz h GLU 102 CO 0.01 0.85 -0.10 0.35 -0.00 0.00 0.00 179.01 180.12 1ivz h PHE 103 N 0.94 0.51 -0.00 2.06 3.57 -1.46 -2.57 116.94 119.99 1ivz h PHE 103 Ca 0.21 -0.07 -0.17 0.00 3.53 0.00 0.00 57.97 61.47 1ivz h PHE 103 Cb 0.28 -0.14 -0.02 0.00 2.79 0.00 0.00 35.95 38.86 1ivz h PHE 103 CO 0.02 0.57 -0.78 -0.07 -2.23 0.00 0.00 178.31 175.82 1ivz h LEU 104 N 0.45 0.06 -1.12 0.59 3.38 -0.96 -1.69 115.31 116.02 1ivz h LEU 104 Ca 0.09 -0.04 -0.09 0.00 0.09 0.00 0.00 57.88 57.93 1ivz h LEU 104 Cb 0.45 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 41.17 1ivz h LEU 104 CO 0.02 0.81 -0.41 -0.09 0.09 0.00 0.00 178.44 178.86 1ivz h ARG 105 N 0.03 0.00 0.00 1.13 2.43 -0.98 0.38 114.38 117.36 1ivz h ARG 105 Ca -0.01 0.00 -0.10 0.00 -0.81 0.00 0.00 59.98 59.05 1ivz h ARG 105 Cb 1.37 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 30.90 1ivz h ARG 105 CO 0.11 0.41 -1.46 -0.12 -1.51 0.00 0.00 179.97 177.40 1ivz n MET 106 N -3.87 0.63 -0.81 0.20 1.56 -1.04 -4.03 117.12 109.77 1ivz n MET 106 Ca -0.01 0.10 -0.03 0.00 -0.27 0.00 0.00 57.70 57.49 1ivz n MET 106 Cb 0.47 -1.74 0.26 0.00 2.15 0.00 0.00 33.22 34.35 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 -2.71 2.40 -3.45 1.12 -2.24 -0.64 -4.72 114.28 104.04 1ivz n THR 107 Ca -0.08 -1.26 -0.18 0.00 -2.27 0.00 0.00 64.05 60.27 1ivz n THR 107 Cb 0.73 -0.42 0.02 0.00 -2.10 0.00 0.00 70.33 68.56 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 0.02 -2.35 -2.41 4.78 -0.00 -1.11 0.15 115.22 114.31 1ivz n HIS 108 Ca 0.31 0.80 -0.19 0.00 -0.00 0.00 0.00 57.72 58.64 1ivz n HIS 108 Cb 1.16 -3.61 -0.01 0.00 -0.00 0.00 0.00 29.99 27.54 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 -2.44 -5.52 -2.80 0.41 5.15 0.13 -2.92 115.26 107.27 1ivz n ASN 109 Ca -0.11 -0.04 -0.12 0.00 -0.60 0.00 0.00 54.58 53.72 1ivz n ASN 109 Cb 0.59 -4.55 0.06 0.00 -0.53 0.00 0.00 39.78 35.34 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 -1.05 -0.47 0.69 8.20 0.00 -0.83 -4.78 105.19 106.96 1ivz n GLY 110 Ca -0.22 0.22 0.00 0.00 0.00 0.00 0.00 46.02 46.03 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 -2.96 0.00 -3.82 2.61 -2.24 0.12 -2.15 114.28 105.84 1ivz n THR 111 Ca -0.11 0.00 -0.26 0.00 -2.27 0.00 0.00 64.05 61.41 1ivz n THR 111 Cb 0.60 -0.66 -0.17 0.00 -2.10 0.00 0.00 70.33 68.00 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 -1.78 1.01 -0.84 -0.78 0.74 -0.69 -0.24 119.66 117.09 1ivz s GLN 112 Ca 0.00 -0.26 -0.17 0.00 0.05 0.00 0.00 55.36 54.98 1ivz s GLN 112 Cb 0.00 -1.64 0.16 0.00 1.10 0.00 0.00 33.01 32.63 1ivz s GLN 112 CO 0.00 -0.41 0.93 -1.17 -0.55 0.00 0.00 175.29 174.08 1ivz s LEU 113 N 1.80 5.74 0.00 3.68 1.98 0.12 -4.28 118.68 127.73 1ivz s LEU 113 Ca 0.02 -2.19 0.00 0.00 -2.89 0.00 0.00 54.13 49.08 1ivz s LEU 113 Cb -0.14 -2.31 0.00 0.00 0.66 0.00 0.00 46.19 44.39 1ivz s LEU 113 CO -0.07 -0.89 0.00 0.18 -1.89 0.00 0.00 176.35 173.68 1ivz n LEU 114 N 5.56 0.00 -2.25 -0.68 4.77 -1.26 -1.42 117.00 121.72 1ivz n LEU 114 Ca 0.15 0.00 -0.05 0.00 -0.03 0.00 0.00 56.01 56.08 1ivz n LEU 114 Cb 0.47 0.00 0.05 0.00 -2.33 0.00 0.00 43.42 41.61 1ivz n LEU 114 CO 0.45 0.00 0.08 0.59 -1.33 0.00 0.00 177.39 177.18 1ivz n ASN 115 N 1.40 2.36 -3.34 -1.43 3.02 -1.26 -5.01 115.26 111.00 1ivz n ASN 115 Ca 0.00 -2.61 -0.06 0.00 -0.03 0.00 0.00 54.58 51.88 1ivz n ASN 115 Cb 0.00 -0.42 -0.06 0.00 -0.61 0.00 0.00 39.78 38.69 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 -3.13 -1.01 -0.15 3.10 0.40 -0.51 -5.08 117.98 111.62 1ivz s PHE 116 Ca 0.35 1.12 -0.29 0.00 -0.60 0.00 0.00 56.93 57.51 1ivz s PHE 116 Cb 0.36 0.18 -0.02 0.00 0.51 0.00 0.00 43.02 44.05 1ivz s PHE 116 CO -0.04 -0.73 1.26 0.95 0.70 0.00 0.00 175.22 177.35 1ivz s THR 117 N 2.63 4.26 0.11 0.64 -4.23 -1.26 0.11 115.64 117.90 1ivz s THR 117 Ca 0.13 1.54 0.03 0.00 -1.18 0.00 0.00 61.69 62.21 1ivz s THR 117 Cb -0.15 -3.99 -0.04 0.00 1.34 0.00 0.00 72.50 69.66 1ivz s THR 117 CO -0.17 -0.12 -0.08 -1.48 -0.54 0.00 0.00 174.62 172.24 1ivz s LEU 118 N 3.31 2.49 0.82 4.79 0.05 0.67 -0.97 118.68 129.84 1ivz s LEU 118 Ca 0.55 -0.97 -0.11 0.00 0.05 0.00 0.00 54.13 53.65 1ivz s LEU 118 Cb -0.22 -0.17 0.08 0.00 -2.05 0.00 0.00 46.19 43.83 1ivz s LEU 118 CO 0.16 -0.40 1.09 -0.62 -0.55 0.00 0.00 176.35 176.03 1ivz s ASP 119 N -2.95 4.15 -0.21 1.48 2.15 -1.22 -3.83 116.67 116.24 1ivz s ASP 119 Ca 0.11 1.65 -0.11 0.00 0.43 0.00 0.00 52.55 54.63 1ivz s ASP 119 Cb 0.03 -2.35 -0.19 0.00 -0.30 0.00 0.00 42.92 40.11 1ivz s ASP 119 CO -0.03 -2.23 0.04 -1.14 -0.17 0.00 0.00 175.17 171.64 1ivz n ARG 120 N -3.64 0.64 -0.06 4.34 0.63 -0.91 -3.95 116.66 113.71 1ivz n ARG 120 Ca 0.08 0.33 0.08 0.00 -0.92 0.00 0.00 57.85 57.42 1ivz n ARG 120 Cb 0.54 -1.63 0.44 0.00 0.45 0.00 0.00 32.46 32.26 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 -0.50 0.51 -0.02 -0.14 1.57 -1.94 -0.53 116.57 115.51 1ivz h LYS 121 Ca -0.50 -0.03 -0.10 0.00 -1.87 0.00 0.00 60.65 58.15 1ivz h LYS 121 Cb 1.70 -0.12 -0.01 0.00 0.08 0.00 0.00 32.23 33.88 1ivz h LYS 121 CO -0.15 0.34 -0.45 0.66 -0.57 0.00 0.00 179.45 179.28 1ivz h SER 122 N 0.53 0.05 -3.39 0.86 4.64 -1.92 -3.44 113.55 110.88 1ivz h SER 122 Ca 0.23 -0.02 -0.52 0.00 -0.47 0.00 0.00 61.79 61.00 1ivz h SER 122 Cb 0.23 -0.01 0.05 0.00 -0.31 0.00 0.00 62.40 62.36 1ivz h SER 122 CO -0.06 0.50 0.71 -0.69 -0.87 0.00 0.00 176.83 176.42 1ivz s VAL 123 N -4.02 2.88 -0.20 0.95 1.01 -0.21 -4.22 120.40 116.60 1ivz s VAL 123 Ca -0.03 0.74 -0.31 0.00 0.00 0.00 0.00 61.98 62.38 1ivz s VAL 123 Cb 0.14 -3.47 0.15 0.00 0.00 0.00 0.00 36.38 33.20 1ivz s VAL 123 CO 0.75 0.12 1.16 0.12 0.00 0.00 0.00 175.10 177.24 1ivz s PHE 124 N 0.02 -0.19 -0.08 5.22 2.19 -0.68 -5.00 117.98 119.46 1ivz s PHE 124 Ca 0.58 0.26 -0.03 0.00 0.33 0.00 0.00 56.93 58.07 1ivz s PHE 124 Cb -0.40 0.49 0.04 0.00 -1.31 0.00 0.00 43.02 41.84 1ivz s PHE 124 CO 0.41 -0.22 0.09 0.54 1.83 0.00 0.00 175.22 177.87 1ivz s VAL 125 N -1.63 -0.14 0.31 3.12 0.11 -1.26 -2.34 120.40 118.57 1ivz s VAL 125 Ca 0.05 0.30 0.07 0.00 -2.93 0.00 0.00 61.98 59.47 1ivz s VAL 125 Cb -0.01 -0.26 -0.06 0.00 -1.53 0.00 0.00 36.38 34.52 1ivz s VAL 125 CO -0.04 0.08 -0.05 -0.62 -3.33 0.00 0.00 175.10 171.15 1ivz s ASP 126 N 2.19 3.07 -0.21 3.54 2.15 -0.96 -4.66 116.67 121.80 1ivz s ASP 126 Ca 0.04 -1.23 -0.29 0.00 0.43 0.00 0.00 52.55 51.51 1ivz s ASP 126 Cb -0.13 -0.23 -0.03 0.00 -0.30 0.00 0.00 42.92 42.23 1ivz s ASP 126 CO -0.05 -0.34 1.70 -0.94 -0.17 0.00 0.00 175.17 175.37 1ivz s SER 127 N -3.51 6.27 0.08 -0.34 1.04 -1.26 0.11 113.70 116.09 1ivz s SER 127 Ca 0.31 1.70 -0.30 0.00 0.48 0.00 0.00 55.95 58.14 1ivz s SER 127 Cb 0.04 -2.53 -0.14 0.00 0.10 0.00 0.00 66.02 63.50 1ivz s SER 127 CO 0.14 -1.33 1.47 1.23 0.98 0.00 0.00 173.24 175.73 1ivz h GLY 128 N 12.04 -1.18 -6.61 7.32 0.00 -1.85 -3.40 103.07 109.39 1ivz h GLY 128 Ca -0.35 0.59 -0.58 0.00 0.00 0.00 0.00 47.33 46.99 1ivz h GLY 128 CO 1.00 -0.33 1.36 2.56 0.00 0.00 0.00 176.54 181.12 1ivz s PRO 129 N -5.37 3.40 0.11 4.80 0.04 -1.26 -4.62 135.00 132.10 1ivz s PRO 129 Ca -0.14 1.91 0.00 0.00 0.04 0.00 0.00 61.00 62.81 1ivz s PRO 129 Cb 0.04 -4.26 0.00 0.00 0.04 0.00 0.00 34.50 30.33 1ivz s PRO 129 CO 0.51 -1.78 0.00 0.43 0.04 0.00 0.00 177.00 176.20 1ivz n SER 130 N 10.37 -0.56 -3.64 6.66 7.64 -1.26 -5.14 113.62 127.69 1ivz n SER 130 Ca 0.25 0.20 -0.07 0.00 1.01 0.00 0.00 58.87 60.27 1ivz n SER 130 Cb 0.45 0.70 -0.07 0.00 -1.01 0.00 0.00 64.21 64.28 1ivz n SER 130 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 1ivz s SER 131 N -3.81 -0.70 0.00 6.43 1.04 -1.26 -5.27 113.70 110.14 1ivz s SER 131 Ca 0.00 1.17 0.00 0.00 0.48 0.00 0.00 55.95 57.60 1ivz s SER 131 Cb 0.00 1.26 0.00 0.00 0.10 0.00 0.00 66.02 67.38 1ivz s SER 131 CO 0.00 -0.19 0.00 0.61 0.98 0.00 0.00 173.24 174.64