#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1iq3 s SER 2 N 0.00 -0.16 -0.13 1.61 1.04 -1.26 -5.15 113.70 109.65 1iq3 s SER 2 Ca 0.00 -0.07 0.01 0.00 0.48 0.00 0.00 55.95 56.38 1iq3 s SER 2 Cb 0.00 0.22 0.02 0.00 0.10 0.00 0.00 66.02 66.35 1iq3 s SER 2 CO 0.00 -0.37 -0.16 -0.76 0.98 0.00 0.00 173.24 172.93 1iq3 s LEU 3 N -2.49 1.77 -0.01 2.42 1.43 -1.26 -5.12 118.68 115.42 1iq3 s LEU 3 Ca 0.10 -0.47 -0.04 0.00 -1.03 0.00 0.00 54.13 52.69 1iq3 s LEU 3 Cb 0.00 -1.17 -0.00 0.00 0.03 0.00 0.00 46.19 45.05 1iq3 s LEU 3 CO -0.05 0.00 0.07 -1.10 0.23 0.00 0.00 176.35 175.51 1iq3 s GLN 4 N 1.12 0.29 0.54 1.70 -0.21 -1.26 -5.02 119.66 116.82 1iq3 s GLN 4 Ca -0.03 -0.26 0.31 0.00 0.02 0.00 0.00 55.36 55.40 1iq3 s GLN 4 Cb -0.14 0.12 1.54 0.00 1.00 0.00 0.00 33.01 35.52 1iq3 s GLN 4 CO -0.05 -0.06 2.08 -0.44 -2.12 0.00 0.00 175.29 174.71 1iq3 h ASP 5 N 5.04 0.00 -1.49 5.90 5.19 -2.08 -3.43 116.42 125.55 1iq3 h ASP 5 Ca -0.29 0.00 0.17 0.00 -0.62 0.00 0.00 57.03 56.29 1iq3 h ASP 5 Cb 1.20 0.00 -0.26 0.00 0.18 0.00 0.00 39.33 40.45 1iq3 h ASP 5 CO 0.42 0.09 0.36 0.21 -3.12 0.00 0.00 179.24 177.20 1iq3 s ASN 6 N -5.92 -0.46 -0.30 6.45 2.47 -1.26 -5.14 114.94 110.79 1iq3 s ASN 6 Ca -0.02 0.66 -0.03 0.00 0.42 0.00 0.00 52.86 53.90 1iq3 s ASN 6 Cb 0.12 1.40 0.19 0.00 -1.45 0.00 0.00 41.25 41.51 1iq3 s ASN 6 CO 0.55 -0.10 0.76 -0.94 -3.72 0.00 0.00 177.10 173.66 1iq3 s SER 7 N 1.93 -1.13 1.41 -4.21 1.04 -1.26 -5.16 113.70 106.32 1iq3 s SER 7 Ca -0.05 0.37 -0.23 0.00 0.48 0.00 0.00 55.95 56.52 1iq3 s SER 7 Cb -0.04 1.81 0.36 0.00 0.10 0.00 0.00 66.02 68.25 1iq3 s SER 7 CO -0.16 -0.21 0.96 -0.44 0.98 0.00 0.00 173.24 174.37 1iq3 s SER 8 N 2.88 -0.91 0.00 7.02 0.01 -1.26 -5.06 113.70 116.38 1iq3 s SER 8 Ca 0.15 0.76 0.00 0.00 1.31 0.00 0.00 55.95 58.16 1iq3 s SER 8 Cb -0.10 -1.04 0.00 0.00 0.21 0.00 0.00 66.02 65.09 1iq3 s SER 8 CO -0.21 -5.26 0.00 -1.22 0.41 0.00 0.00 173.24 166.95 1iq3 n TYR 9 N -5.55 0.00 0.00 2.43 4.01 -1.26 -5.16 117.16 111.63 1iq3 n TYR 9 Ca 0.14 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.88 1iq3 n TYR 9 Cb 0.60 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.63 1iq3 n TYR 9 CO 0.00 0.00 0.00 -2.30 -0.46 0.00 0.00 176.86 174.10 1iq3 n PRO 10 N 0.00 2.03 -2.14 -0.72 -0.02 -1.26 -4.88 135.00 128.01 1iq3 n PRO 10 Ca 0.00 0.00 -0.03 0.00 -2.02 0.00 0.00 63.50 61.45 1iq3 n PRO 10 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.48 1iq3 n PRO 10 CO 0.00 0.00 0.00 -3.47 1.98 0.00 0.00 175.50 174.01 1iq3 n ASP 11 N 0.00 -4.91 0.09 2.55 2.03 -1.26 -5.00 116.55 110.05 1iq3 n ASP 11 Ca 0.00 0.35 0.00 0.00 0.52 0.00 0.00 54.79 55.66 1iq3 n ASP 11 Cb 0.00 -3.14 0.00 0.00 -0.72 0.00 0.00 41.12 37.26 1iq3 n ASP 11 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 1iq3 n GLU 12 N -0.26 0.00 0.00 -0.67 1.02 -1.26 -4.90 120.64 114.57 1iq3 n GLU 12 Ca 0.05 0.00 0.09 0.00 -0.02 0.00 0.00 57.16 57.27 1iq3 n GLU 12 Cb 0.18 0.00 0.44 0.00 -0.02 0.00 0.00 31.44 32.04 1iq3 n GLU 12 CO 0.00 0.00 0.00 -0.35 1.18 0.00 0.00 177.13 177.96 1iq3 n PRO 13 N -2.76 0.22 -0.61 3.49 -0.04 -1.26 -3.02 135.00 131.02 1iq3 n PRO 13 Ca 0.00 0.13 -0.11 0.00 -0.04 0.00 0.00 63.50 63.47 1iq3 n PRO 13 Cb 0.00 -1.50 0.09 0.00 -0.04 0.00 0.00 33.50 32.05 1iq3 n PRO 13 CO 0.00 0.00 0.00 0.91 -0.04 0.00 0.00 175.50 176.37 1iq3 n TRP 14 N -1.31 1.51 -1.50 0.54 5.03 -1.26 -4.92 117.44 115.53 1iq3 n TRP 14 Ca 0.08 -1.14 -0.27 0.00 3.03 0.00 0.00 57.50 59.19 1iq3 n TRP 14 Cb 0.15 -0.59 -0.20 0.00 -1.03 0.00 0.00 31.31 29.65 1iq3 n TRP 14 CO 0.00 0.00 0.00 -2.13 -0.03 0.00 0.00 177.69 175.53 1iq3 n ARG 15 N -0.30 0.05 0.00 -0.99 0.63 -1.17 -4.56 116.66 110.32 1iq3 n ARG 15 Ca 0.29 -0.04 0.00 0.00 -0.92 0.00 0.00 57.85 57.18 1iq3 n ARG 15 Cb 1.07 -1.32 0.00 0.00 0.45 0.00 0.00 32.46 32.67 1iq3 n ARG 15 CO 0.00 0.00 0.00 1.51 -2.51 0.00 0.00 177.63 176.63 1iq3 n ILE 16 N 6.28 0.00 -0.97 5.15 3.06 -1.26 -5.13 119.36 126.49 1iq3 n ILE 16 Ca 0.66 0.00 0.00 0.00 -2.50 0.00 0.00 62.75 60.91 1iq3 n ILE 16 Cb 0.13 0.00 0.00 0.00 0.54 0.00 0.00 39.64 40.31 1iq3 n ILE 16 CO 0.00 0.00 0.00 0.35 -2.50 0.00 0.00 176.55 174.40 1iq3 n THR 17 N 0.00 0.00 0.18 9.51 -2.24 -1.26 -4.96 114.28 115.51 1iq3 n THR 17 Ca 0.00 0.00 0.11 0.00 -2.27 0.00 0.00 64.05 61.89 1iq3 n THR 17 Cb 0.00 0.00 0.57 0.00 -2.10 0.00 0.00 70.33 68.80 1iq3 n THR 17 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 1iq3 h GLU 18 N 0.00 0.00 -0.94 -0.78 3.07 -2.00 -1.58 114.58 112.35 1iq3 h GLU 18 Ca 0.00 0.00 0.26 0.00 -0.50 0.00 0.00 59.36 59.12 1iq3 h GLU 18 Cb 0.00 0.00 -0.14 0.00 -0.84 0.00 0.00 28.75 27.77 1iq3 h GLU 18 CO 0.00 0.00 0.44 0.93 -1.40 0.00 0.00 179.01 178.98 1iq3 h GLU 19 N 0.00 0.34 0.00 2.33 4.39 -1.99 -2.78 114.58 116.87 1iq3 h GLU 19 Ca 0.00 -0.02 0.00 0.00 0.34 0.00 0.00 59.36 59.68 1iq3 h GLU 19 Cb 0.19 -0.08 0.00 0.00 -0.10 0.00 0.00 28.75 28.77 1iq3 h GLU 19 CO 0.00 0.22 -0.47 0.00 -1.16 0.00 0.00 179.01 177.60 1iq3 n GLN 20 N -5.08 2.90 0.06 2.33 10.64 -0.97 -4.59 117.38 122.68 1iq3 n GLN 20 Ca 0.26 0.00 -0.05 0.00 -1.83 0.00 0.00 57.00 55.38 1iq3 n GLN 20 Cb 0.79 -0.73 0.14 0.00 -0.86 0.00 0.00 30.24 29.58 1iq3 n GLN 20 CO 0.00 0.00 0.00 -0.09 -1.83 0.00 0.00 177.06 175.14 1iq3 h ARG 21 N 0.00 0.35 0.03 2.61 9.65 -1.34 0.94 114.38 126.61 1iq3 h ARG 21 Ca 0.00 -0.20 -0.22 0.00 -1.10 0.00 0.00 59.98 58.46 1iq3 h ARG 21 Cb 0.10 0.01 -0.02 0.00 -1.39 0.00 0.00 29.97 28.68 1iq3 h ARG 21 CO 0.00 0.77 -1.02 0.93 2.80 0.00 0.00 179.97 183.44 1iq3 h GLU 22 N 0.28 0.09 0.00 0.20 5.08 -1.67 -2.64 114.58 115.91 1iq3 h GLU 22 Ca 0.01 -0.14 -0.02 0.00 -1.00 0.00 0.00 59.36 58.21 1iq3 h GLU 22 Cb 0.97 0.05 -0.00 0.00 0.50 0.00 0.00 28.75 30.27 1iq3 h GLU 22 CO 0.08 1.03 -0.38 -0.92 -1.00 0.00 0.00 179.01 177.82 1iq3 h TYR 23 N 0.03 0.00 0.21 4.33 3.20 -1.65 -3.00 116.97 120.09 1iq3 h TYR 23 Ca -0.04 0.00 -0.33 0.00 3.14 0.00 0.00 58.73 61.49 1iq3 h TYR 23 Cb 1.75 0.00 0.02 0.00 1.54 0.00 0.00 36.73 40.04 1iq3 h TYR 23 CO 0.02 0.07 -1.57 1.88 -1.64 0.00 0.00 178.16 176.92 1iq3 h TYR 24 N 0.00 0.82 0.00 -3.82 0.05 -0.83 -3.28 116.97 109.92 1iq3 h TYR 24 Ca -0.01 -0.60 -0.05 0.00 0.05 0.00 0.00 58.73 58.12 1iq3 h TYR 24 Cb 1.06 -0.03 -0.01 0.00 1.01 0.00 0.00 36.73 38.76 1iq3 h TYR 24 CO 0.00 1.61 -0.23 0.28 -1.05 0.00 0.00 178.16 178.77 1iq3 h VAL 25 N 0.08 0.63 0.00 -2.88 2.07 -1.56 -2.53 116.25 112.06 1iq3 h VAL 25 Ca -0.30 -1.04 -0.01 0.00 0.82 0.00 0.00 66.70 66.18 1iq3 h VAL 25 Cb 2.10 1.68 -0.00 0.00 -1.52 0.00 0.00 31.29 33.54 1iq3 h VAL 25 CO 0.22 0.22 -0.03 0.78 0.02 0.00 0.00 177.57 178.78 1iq3 h ASN 26 N 0.00 0.00 0.01 0.57 -0.26 -1.58 0.98 115.58 115.30 1iq3 h ASN 26 Ca -0.00 0.00 -0.21 0.00 -0.56 0.00 0.00 56.30 55.53 1iq3 h ASN 26 Cb 0.66 0.00 -0.03 0.00 -1.06 0.00 0.00 38.32 37.89 1iq3 h ASN 26 CO 0.03 0.03 -1.14 -0.61 -1.06 0.00 0.00 177.43 174.67 1iq3 h GLN 27 N 0.00 0.02 0.00 0.81 5.75 -1.59 -3.34 115.11 116.76 1iq3 h GLN 27 Ca -0.00 -0.03 0.00 0.00 -0.15 0.00 0.00 58.65 58.47 1iq3 h GLN 27 Cb 0.09 0.01 0.00 0.00 1.07 0.00 0.00 27.48 28.66 1iq3 h GLN 27 CO 0.00 1.02 0.00 0.34 -2.65 0.00 0.00 178.83 177.54 1iq3 n PHE 28 N -4.40 0.80 -0.03 3.99 -0.00 -1.09 -2.51 117.46 114.21 1iq3 n PHE 28 Ca -0.29 0.35 -0.15 0.00 -0.00 0.00 0.00 57.45 57.36 1iq3 n PHE 28 Cb 0.68 -1.07 -0.09 0.00 -0.00 0.00 0.00 39.48 39.00 1iq3 n PHE 28 CO 0.00 0.00 0.00 -0.09 -0.00 0.00 0.00 176.76 176.67 1iq3 h ARG 29 N 0.00 0.35 -1.19 -4.13 2.43 -0.92 0.03 114.38 110.94 1iq3 h ARG 29 Ca 0.00 -0.26 0.35 0.00 -0.81 0.00 0.00 59.98 59.25 1iq3 h ARG 29 Cb 0.22 0.05 -0.05 0.00 -0.42 0.00 0.00 29.97 29.77 1iq3 h ARG 29 CO 0.00 0.89 0.90 1.03 -1.51 0.00 0.00 179.97 181.28 1iq3 h SER 30 N -0.13 0.00 0.08 -3.80 0.87 -1.61 0.50 113.55 109.47 1iq3 h SER 30 Ca -0.01 0.00 -0.15 0.00 -1.23 0.00 0.00 61.79 60.40 1iq3 h SER 30 Cb 0.93 0.00 -0.03 0.00 -0.44 0.00 0.00 62.40 62.86 1iq3 h SER 30 CO 0.06 0.00 -2.07 0.18 -0.53 0.00 0.00 176.83 174.47 1iq3 n LEU 31 N -4.07 0.09 -3.41 2.23 4.32 -1.15 -4.77 117.00 110.23 1iq3 n LEU 31 Ca 0.26 0.04 -0.23 0.00 -0.02 0.00 0.00 56.01 56.05 1iq3 n LEU 31 Cb 1.29 0.19 -0.10 0.00 -1.62 0.00 0.00 43.42 43.18 1iq3 n LEU 31 CO 0.39 0.19 -0.24 -1.10 -1.22 0.00 0.00 177.39 175.41 1iq3 s GLN 32 N -3.09 0.60 0.55 3.23 -1.52 0.17 -4.96 119.66 114.64 1iq3 s GLN 32 Ca -0.08 -1.15 0.23 0.00 -1.95 0.00 0.00 55.36 52.41 1iq3 s GLN 32 Cb 0.11 -1.04 1.49 0.00 -0.22 0.00 0.00 33.01 33.35 1iq3 s GLN 32 CO 0.87 -1.21 2.13 -1.35 -0.25 0.00 0.00 175.29 175.48 1iq3 h PRO 33 N 6.96 0.00 -6.73 2.91 0.11 -1.63 -3.37 132.00 130.25 1iq3 h PRO 33 Ca 0.06 0.00 -0.57 0.00 0.11 0.00 0.00 66.00 65.61 1iq3 h PRO 33 Cb 1.01 0.00 0.10 0.00 0.11 0.00 0.00 31.00 32.22 1iq3 h PRO 33 CO 0.23 0.00 0.59 -0.25 -0.21 0.00 0.00 178.00 178.36 1iq3 n ASP 34 N -4.20 2.95 0.27 -2.05 8.00 -1.26 -4.84 116.55 115.42 1iq3 n ASP 34 Ca 0.00 1.19 0.18 0.00 0.71 0.00 0.00 54.79 56.87 1iq3 n ASP 34 Cb 0.24 -1.49 0.82 0.00 -0.02 0.00 0.00 41.12 40.67 1iq3 n ASP 34 CO 0.00 0.00 0.00 1.55 -0.39 0.00 0.00 177.20 178.36 1iq3 h PRO 35 N 3.20 0.00 -1.73 -0.24 0.13 -2.02 -3.35 132.00 128.00 1iq3 h PRO 35 Ca -0.46 0.00 -0.40 0.00 -0.87 0.00 0.00 66.00 64.27 1iq3 h PRO 35 Cb 1.27 0.00 -0.28 0.00 0.13 0.00 0.00 31.00 32.12 1iq3 h PRO 35 CO 0.67 0.00 -0.77 0.43 -0.23 0.00 0.00 178.00 178.10 1iq3 n SER 36 N -2.94 -1.74 -3.17 1.44 7.64 -1.26 -5.06 113.62 108.53 1iq3 n SER 36 Ca -0.00 -2.63 -0.19 0.00 1.01 0.00 0.00 58.87 57.06 1iq3 n SER 36 Cb 0.21 0.45 -0.07 0.00 -1.01 0.00 0.00 64.21 63.79 1iq3 n SER 36 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 1iq3 n SER 37 N 2.80 -0.34 -4.39 6.43 2.88 -1.26 -4.95 113.62 114.79 1iq3 n SER 37 Ca 0.24 -3.02 -0.32 0.00 -1.33 0.00 0.00 58.87 54.44 1iq3 n SER 37 Cb 0.52 1.45 -0.14 0.00 -0.75 0.00 0.00 64.21 65.28 1iq3 n SER 37 CO 0.00 0.00 0.00 0.72 -1.23 0.00 0.00 175.04 174.53 1iq3 s PHE 38 N -3.21 2.59 0.43 0.66 -0.12 -1.26 -0.36 117.98 116.72 1iq3 s PHE 38 Ca 0.34 -0.39 -0.02 0.00 -0.05 0.00 0.00 56.93 56.81 1iq3 s PHE 38 Cb 0.02 -1.63 -0.03 0.00 -0.63 0.00 0.00 43.02 40.75 1iq3 s PHE 38 CO 0.24 0.01 0.68 0.42 -0.05 0.00 0.00 175.22 176.52 1iq3 s ILE 39 N -0.46 4.86 0.24 -4.49 1.01 0.87 -4.82 121.20 118.40 1iq3 s ILE 39 Ca 0.05 -0.15 -0.04 0.00 0.00 0.00 0.00 60.65 60.51 1iq3 s ILE 39 Cb -0.12 -3.81 0.06 0.00 0.01 0.00 0.00 42.46 38.60 1iq3 s ILE 39 CO 0.01 -0.67 0.16 -0.24 0.00 0.00 0.00 174.94 174.21 1iq3 n SER 40 N -2.06 -1.92 -0.05 3.58 2.88 -1.26 -1.67 113.62 113.12 1iq3 n SER 40 Ca -0.01 -0.33 -0.05 0.00 -1.33 0.00 0.00 58.87 57.15 1iq3 n SER 40 Cb 0.56 -0.17 -0.02 0.00 -0.75 0.00 0.00 64.21 63.83 1iq3 n SER 40 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1iq3 n GLY 41 N -0.13 -0.62 0.21 0.46 0.00 0.67 -4.07 105.19 101.71 1iq3 n GLY 41 Ca 0.02 -0.17 0.02 0.00 0.00 0.00 0.00 46.02 45.89 1iq3 n GLY 41 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1iq3 h SER 42 N -0.61 0.12 -0.21 1.61 4.64 -1.96 -1.82 113.55 115.32 1iq3 h SER 42 Ca 0.00 -0.04 0.03 0.00 -0.47 0.00 0.00 61.79 61.31 1iq3 h SER 42 Cb 0.50 -0.03 -0.03 0.00 -0.31 0.00 0.00 62.40 62.53 1iq3 h SER 42 CO 0.00 0.43 0.03 0.58 -0.87 0.00 0.00 176.83 177.00 1iq3 h VAL 43 N 0.11 0.89 -0.12 0.95 2.07 -1.93 0.65 116.25 118.86 1iq3 h VAL 43 Ca 0.01 -0.04 -0.17 0.00 0.82 0.00 0.00 66.70 67.32 1iq3 h VAL 43 Cb 0.60 0.77 0.01 0.00 -1.52 0.00 0.00 31.29 31.15 1iq3 h VAL 43 CO 0.04 0.02 -0.60 0.00 0.02 0.00 0.00 177.57 177.05 1iq3 h ALA 44 N 1.16 0.24 0.00 1.67 0.00 -1.67 -2.93 119.26 117.74 1iq3 h ALA 44 Ca 0.10 -0.54 0.00 0.00 0.00 0.00 0.00 54.91 54.47 1iq3 h ALA 44 Cb 0.10 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.88 1iq3 h ALA 44 CO -0.14 0.49 0.00 0.87 0.00 0.00 0.00 179.25 180.47 1iq3 h LYS 45 N 0.28 0.00 0.77 0.00 1.57 -1.10 -1.22 116.57 116.87 1iq3 h LYS 45 Ca -0.04 0.00 -0.04 0.00 -1.87 0.00 0.00 60.65 58.70 1iq3 h LYS 45 Cb 1.24 0.00 0.01 0.00 0.08 0.00 0.00 32.23 33.56 1iq3 h LYS 45 CO 0.12 0.00 -0.37 -0.97 -0.57 0.00 0.00 179.45 177.67 1iq3 h ASN 46 N 0.00 -0.87 1.47 0.86 -1.24 -0.67 -3.22 115.58 111.91 1iq3 h ASN 46 Ca 0.00 0.03 -0.07 0.00 0.71 0.00 0.00 56.30 56.97 1iq3 h ASN 46 Cb 0.11 0.23 -0.01 0.00 0.73 0.00 0.00 38.32 39.38 1iq3 h ASN 46 CO 0.00 -0.52 -0.34 2.19 -1.29 0.00 0.00 177.43 177.47 1iq3 h PHE 47 N -1.23 0.00 -0.94 0.67 -5.15 -1.64 -3.26 116.94 105.39 1iq3 h PHE 47 Ca -0.11 0.00 0.27 0.00 -0.20 0.00 0.00 57.97 57.94 1iq3 h PHE 47 Cb 0.79 0.00 -0.14 0.00 0.22 0.00 0.00 35.95 36.81 1iq3 h PHE 47 CO 0.01 0.34 0.40 0.74 -2.00 0.00 0.00 178.31 177.79 1iq3 h PHE 48 N 0.00 0.64 -1.58 6.09 -1.00 -1.23 -1.05 116.94 118.81 1iq3 h PHE 48 Ca -0.00 0.04 -0.57 0.00 2.81 0.00 0.00 57.97 60.25 1iq3 h PHE 48 Cb 1.16 -0.13 -0.42 0.00 3.61 0.00 0.00 35.95 40.18 1iq3 h PHE 48 CO 0.00 -0.18 -0.77 -2.37 -1.61 0.00 0.00 178.31 173.37 1iq3 n THR 49 N -5.14 2.29 -0.34 -1.55 5.66 -1.23 -4.91 114.28 109.06 1iq3 n THR 49 Ca 0.26 -4.84 0.03 0.00 -3.05 0.00 0.00 64.05 56.45 1iq3 n THR 49 Cb 0.82 -1.08 0.09 0.00 -1.55 0.00 0.00 70.33 68.61 1iq3 n THR 49 CO 0.00 0.00 0.00 2.29 -3.05 0.00 0.00 175.07 174.31 1iq3 n LYS 50 N -0.40 -0.14 -2.61 1.09 2.85 -0.40 -2.24 118.16 116.31 1iq3 n LYS 50 Ca 0.35 1.42 -0.11 0.00 -1.05 0.00 0.00 58.31 58.92 1iq3 n LYS 50 Cb 0.64 -2.11 0.03 0.00 -0.65 0.00 0.00 35.03 32.94 1iq3 n LYS 50 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 177.40 177.78 1iq3 n SER 51 N -5.43 2.45 -2.37 -5.58 7.64 -1.26 -4.94 113.62 104.13 1iq3 n SER 51 Ca 0.12 -2.77 -0.00 0.00 1.01 0.00 0.00 58.87 57.23 1iq3 n SER 51 Cb 0.42 -0.48 -0.00 0.00 -1.01 0.00 0.00 64.21 63.14 1iq3 n SER 51 CO 0.00 0.00 0.00 2.29 -3.01 0.00 0.00 175.04 174.32 1iq3 n LYS 52 N -0.39 -2.85 -1.10 1.43 2.85 -0.95 -3.48 118.16 113.66 1iq3 n LYS 52 Ca 0.18 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.44 1iq3 n LYS 52 Cb 0.81 -4.19 0.00 0.00 -0.65 0.00 0.00 35.03 31.00 1iq3 n LYS 52 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 177.40 178.63 1iq3 n LEU 53 N -2.33 0.00 0.00 -5.58 4.77 -1.26 -3.59 117.00 109.00 1iq3 n LEU 53 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.98 1iq3 n LEU 53 Cb 0.47 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.56 1iq3 n LEU 53 CO 0.00 0.00 0.00 -0.24 -1.33 0.00 0.00 177.39 175.82 1iq3 n SER 54 N 0.42 0.00 -3.11 -1.43 2.88 -1.23 -3.62 113.62 107.54 1iq3 n SER 54 Ca 0.00 0.00 -0.22 0.00 -1.33 0.00 0.00 58.87 57.32 1iq3 n SER 54 Cb 0.00 0.00 -0.04 0.00 -0.75 0.00 0.00 64.21 63.42 1iq3 n SER 54 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1iq3 n ILE 55 N 0.00 1.03 -1.02 2.46 0.13 -1.24 -5.08 119.36 115.65 1iq3 n ILE 55 Ca 0.00 -4.94 0.00 0.00 -1.10 0.00 0.00 62.75 56.71 1iq3 n ILE 55 Cb 0.00 -0.78 0.00 0.00 -0.84 0.00 0.00 39.64 38.02 1iq3 n ILE 55 CO 0.00 0.00 0.00 -0.81 2.80 0.00 0.00 176.55 178.54 1iq3 n PRO 56 N 0.15 2.44 -3.38 9.51 -0.04 -1.24 -5.09 135.00 137.35 1iq3 n PRO 56 Ca 0.27 0.00 -0.25 0.00 -0.04 0.00 0.00 63.50 63.48 1iq3 n PRO 56 Cb 0.55 0.00 -0.10 0.00 -0.04 0.00 0.00 33.50 33.91 1iq3 n PRO 56 CO 0.00 0.00 0.00 -2.00 -0.04 0.00 0.00 175.50 173.46 1iq3 s GLU 57 N 1.83 0.74 0.00 0.54 2.12 -1.26 -4.95 118.70 117.72 1iq3 s GLU 57 Ca 0.00 -1.60 0.25 0.00 0.36 0.00 0.00 54.97 53.98 1iq3 s GLU 57 Cb 0.00 -1.21 0.54 0.00 0.26 0.00 0.00 34.13 33.72 1iq3 s GLU 57 CO 0.00 -1.29 1.43 1.28 -0.54 0.00 0.00 175.26 176.14 1iq3 n LEU 58 N 3.48 0.76 -0.03 2.70 4.77 -1.26 -3.81 117.00 123.61 1iq3 n LEU 58 Ca 0.20 -0.14 -0.14 0.00 -0.03 0.00 0.00 56.01 55.89 1iq3 n LEU 58 Cb 0.44 -0.18 -0.10 0.00 -2.33 0.00 0.00 43.42 41.24 1iq3 n LEU 58 CO 0.10 0.16 0.49 0.28 -1.33 0.00 0.00 177.39 177.09 1iq3 h SER 59 N 0.50 0.20 0.87 -1.43 0.02 -2.01 -2.94 113.55 108.76 1iq3 h SER 59 Ca 0.00 -0.67 -0.08 0.00 -0.84 0.00 0.00 61.79 60.20 1iq3 h SER 59 Cb 0.51 -0.06 -0.01 0.00 0.14 0.00 0.00 62.40 62.98 1iq3 h SER 59 CO 0.00 0.83 -0.39 0.10 -1.14 0.00 0.00 176.83 176.23 1iq3 h TYR 60 N -0.43 0.00 -0.70 3.45 -0.00 -2.00 -2.61 116.97 114.68 1iq3 h TYR 60 Ca -0.01 0.00 -0.07 0.00 -0.00 0.00 0.00 58.73 58.65 1iq3 h TYR 60 Cb 0.83 0.00 -0.03 0.00 -0.00 0.00 0.00 36.73 37.53 1iq3 h TYR 60 CO 0.15 0.39 0.16 0.97 -0.00 0.00 0.00 178.16 179.82 1iq3 h ILE 61 N 0.00 1.26 -0.15 -0.90 6.09 -1.65 -2.53 117.51 119.63 1iq3 h ILE 61 Ca -0.00 -0.99 -0.10 0.00 -1.37 0.00 0.00 64.86 62.39 1iq3 h ILE 61 Cb 0.93 0.56 0.00 0.00 0.47 0.00 0.00 36.82 38.78 1iq3 h ILE 61 CO 0.05 0.38 -0.30 -0.25 -3.07 0.00 0.00 178.15 174.96 1iq3 h TRP 62 N 1.07 0.60 -0.23 2.19 2.91 -1.37 -1.63 115.95 119.49 1iq3 h TRP 62 Ca 0.22 -0.22 0.07 0.00 1.13 0.00 0.00 58.89 60.09 1iq3 h TRP 62 Cb 0.39 -0.11 -0.01 0.00 -0.51 0.00 0.00 29.16 28.92 1iq3 h TRP 62 CO 0.03 0.93 0.35 0.93 -1.03 0.00 0.00 178.44 179.65 1iq3 h GLU 63 N 0.10 0.00 0.00 2.65 5.08 -1.29 0.20 114.58 121.31 1iq3 h GLU 63 Ca 0.01 0.00 -0.29 0.00 -1.00 0.00 0.00 59.36 58.08 1iq3 h GLU 63 Cb 0.89 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 30.09 1iq3 h GLU 63 CO 0.07 0.00 -1.81 1.28 -1.00 0.00 0.00 179.01 177.55 1iq3 n LEU 64 N -3.44 0.68 0.20 1.33 4.77 -0.97 -3.99 117.00 115.58 1iq3 n LEU 64 Ca 0.03 0.32 0.08 0.00 -0.03 0.00 0.00 56.01 56.41 1iq3 n LEU 64 Cb 0.48 0.22 0.38 0.00 -2.33 0.00 0.00 43.42 42.16 1iq3 n LEU 64 CO 0.23 0.37 0.73 0.77 -1.33 0.00 0.00 177.39 178.16 1iq3 h SER 65 N 0.00 0.00 -3.52 -1.43 4.64 0.32 -3.44 113.55 110.12 1iq3 h SER 65 Ca -0.32 0.00 -0.50 0.00 -0.47 0.00 0.00 61.79 60.51 1iq3 h SER 65 Cb 1.99 0.00 0.02 0.00 -0.31 0.00 0.00 62.40 64.09 1iq3 h SER 65 CO 0.06 0.30 0.06 -0.62 -0.87 0.00 0.00 176.83 175.77 1iq3 s ASP 66 N -6.31 6.38 0.00 4.97 -1.08 -0.46 -4.98 116.67 115.18 1iq3 s ASP 66 Ca 0.01 0.94 0.00 0.00 -0.52 0.00 0.00 52.55 52.98 1iq3 s ASP 66 Cb 0.10 -2.25 0.00 0.00 -1.46 0.00 0.00 42.92 39.31 1iq3 s ASP 66 CO 0.66 -0.45 0.44 0.00 0.52 0.00 0.00 175.17 176.35 1iq3 n ALA 67 N -1.72 1.22 -1.79 3.66 0.00 -1.26 -4.88 120.51 115.73 1iq3 n ALA 67 Ca 0.01 -0.41 -0.00 0.00 0.00 0.00 0.00 53.44 53.04 1iq3 n ALA 67 Cb 0.55 -0.07 -0.00 0.00 0.00 0.00 0.00 19.45 19.92 1iq3 n ALA 67 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 1iq3 n ASP 68 N 0.00 -0.00 -2.41 0.00 5.75 -1.26 -4.98 116.55 113.66 1iq3 n ASP 68 Ca 0.00 -0.79 -0.05 0.00 -0.01 0.00 0.00 54.79 53.94 1iq3 n ASP 68 Cb 0.53 0.00 -0.01 0.00 -1.03 0.00 0.00 41.12 40.61 1iq3 n ASP 68 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1iq3 n ASP 70 N -1.33 0.00 0.00 0.00 5.75 -1.26 -4.81 116.55 114.89 1iq3 n ASP 70 Ca 0.01 -0.26 0.00 0.00 -0.01 0.00 0.00 54.79 54.54 1iq3 n ASP 70 Cb 0.41 -0.16 0.00 0.00 -1.03 0.00 0.00 41.12 40.34 1iq3 n ASP 70 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1iq3 n GLY 71 N 0.24 0.31 3.07 6.12 0.00 -1.26 -4.95 105.19 108.72 1iq3 n GLY 71 Ca 0.11 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.05 1iq3 n GLY 71 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1iq3 s ALA 72 N -1.78 0.21 -0.04 4.61 0.00 -1.26 0.24 121.76 123.74 1iq3 s ALA 72 Ca 0.00 -0.83 -0.05 0.00 0.00 0.00 0.00 51.96 51.07 1iq3 s ALA 72 Cb 0.00 0.24 0.01 0.00 0.00 0.00 0.00 23.12 23.37 1iq3 s ALA 72 CO 0.00 -0.31 0.14 -0.51 0.00 0.00 0.00 175.76 175.08 1iq3 s LEU 73 N -2.31 1.48 0.90 0.00 1.02 -0.67 -4.91 118.68 114.19 1iq3 s LEU 73 Ca -0.02 0.20 -0.14 0.00 0.02 0.00 0.00 54.13 54.18 1iq3 s LEU 73 Cb 0.01 0.52 0.15 0.00 0.02 0.00 0.00 46.19 46.88 1iq3 s LEU 73 CO -0.06 -0.10 1.24 0.42 0.02 0.00 0.00 176.35 177.86 1iq3 s THR 74 N -0.18 1.98 0.18 5.49 -4.23 -1.26 -0.09 115.64 117.54 1iq3 s THR 74 Ca -0.03 0.00 -0.13 0.00 -1.18 0.00 0.00 61.69 60.35 1iq3 s THR 74 Cb -0.02 -2.96 0.09 0.00 1.34 0.00 0.00 72.50 70.95 1iq3 s THR 74 CO 0.00 0.00 1.74 0.25 -0.54 0.00 0.00 174.62 176.07 1iq3 h LEU 75 N -1.42 0.13 -1.86 4.79 5.85 -1.06 0.95 115.31 122.69 1iq3 h LEU 75 Ca -0.46 0.07 0.18 0.00 0.84 0.00 0.00 57.88 58.51 1iq3 h LEU 75 Cb 1.29 0.06 -0.04 0.00 0.37 0.00 0.00 40.66 42.34 1iq3 h LEU 75 CO 0.52 0.10 0.49 -0.65 -0.34 0.00 0.00 178.44 178.56 1iq3 h PRO 76 N 0.31 0.13 -0.04 5.25 0.11 -1.92 0.19 132.00 136.03 1iq3 h PRO 76 Ca 0.23 -0.01 -0.19 0.00 0.11 0.00 0.00 66.00 66.15 1iq3 h PRO 76 Cb 0.26 -0.03 -0.01 0.00 0.11 0.00 0.00 31.00 31.34 1iq3 h PRO 76 CO -0.26 0.09 -0.78 0.93 -0.21 0.00 0.00 178.00 177.76 1iq3 h GLU 77 N 0.13 0.31 0.00 1.05 5.08 -1.16 -3.00 114.58 116.99 1iq3 h GLU 77 Ca 0.34 -0.28 -0.02 0.00 -1.00 0.00 0.00 59.36 58.40 1iq3 h GLU 77 Cb 1.16 0.07 -0.00 0.00 0.50 0.00 0.00 28.75 30.47 1iq3 h GLU 77 CO -0.05 0.95 -0.10 0.35 -1.00 0.00 0.00 179.01 179.16 1iq3 h PHE 78 N 0.20 0.00 0.32 4.33 3.57 -0.14 -2.88 116.94 122.33 1iq3 h PHE 78 Ca -0.04 0.00 -0.02 0.00 3.53 0.00 0.00 57.97 61.45 1iq3 h PHE 78 Cb 1.37 0.00 0.00 0.00 2.79 0.00 0.00 35.95 40.11 1iq3 h PHE 78 CO 0.04 0.10 -0.16 0.00 -2.23 0.00 0.00 178.31 176.05 1iq3 h ALA 80 N -1.76 1.29 0.23 0.00 0.00 -1.68 -2.50 119.26 114.84 1iq3 h ALA 80 Ca -0.04 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.81 1iq3 h ALA 80 Cb 0.34 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.12 1iq3 h ALA 80 CO 0.07 0.07 -0.13 0.00 0.00 0.00 0.00 179.25 179.25 1iq3 h ALA 81 N 1.95 -1.03 -0.82 0.00 0.00 -1.26 -2.38 119.26 115.72 1iq3 h ALA 81 Ca -0.00 -0.07 0.01 0.00 0.00 0.00 0.00 54.91 54.85 1iq3 h ALA 81 Cb 0.18 0.21 -0.04 0.00 0.00 0.00 0.00 17.79 18.14 1iq3 h ALA 81 CO 0.01 -1.01 0.54 0.74 0.00 0.00 0.00 179.25 179.53 1iq3 h PHE 82 N -0.34 1.03 -0.78 0.00 -1.00 -1.42 -1.13 116.94 113.30 1iq3 h PHE 82 Ca -0.03 0.02 0.23 0.00 2.81 0.00 0.00 57.97 61.00 1iq3 h PHE 82 Cb 0.27 -0.35 -0.03 0.00 3.61 0.00 0.00 35.95 39.45 1iq3 h PHE 82 CO 0.08 0.64 0.60 0.45 -1.61 0.00 0.00 178.31 178.48 1iq3 h HIS 83 N 1.10 0.00 0.01 -0.55 3.86 -1.32 -1.20 115.15 117.06 1iq3 h HIS 83 Ca 0.30 0.00 -0.18 0.00 -1.16 0.00 0.00 60.37 59.33 1iq3 h HIS 83 Cb -0.12 0.00 -0.02 0.00 1.06 0.00 0.00 27.41 28.33 1iq3 h HIS 83 CO -0.00 0.00 -1.00 -0.07 0.86 0.00 0.00 177.93 177.72 1iq3 h LEU 84 N 0.00 0.03 0.23 2.43 3.38 -0.68 -3.29 115.31 117.40 1iq3 h LEU 84 Ca 0.37 -0.65 0.00 0.00 0.09 0.00 0.00 57.88 57.69 1iq3 h LEU 84 Cb 1.57 -0.01 -0.04 0.00 0.09 0.00 0.00 40.66 42.27 1iq3 h LEU 84 CO -0.00 1.40 -0.51 0.40 0.09 0.00 0.00 178.44 179.81 1iq3 h ILE 85 N -0.94 0.00 -0.47 1.22 5.03 -0.94 0.11 117.51 121.53 1iq3 h ILE 85 Ca -0.27 0.00 0.14 0.00 -0.12 0.00 0.00 64.86 64.61 1iq3 h ILE 85 Cb 1.28 0.00 -0.02 0.00 -3.03 0.00 0.00 36.82 35.05 1iq3 h ILE 85 CO -0.14 0.00 0.54 0.58 -0.68 0.00 0.00 178.15 178.45 1iq3 h VAL 86 N -0.81 0.30 0.23 1.67 2.07 -1.45 -1.20 116.25 117.05 1iq3 h VAL 86 Ca -0.02 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.49 1iq3 h VAL 86 Cb 0.77 0.56 0.00 0.00 -1.52 0.00 0.00 31.29 31.10 1iq3 h VAL 86 CO -0.21 0.00 -0.11 0.00 0.02 0.00 0.00 177.57 177.27 1iq3 h ALA 87 N 1.35 -0.30 -0.12 1.67 0.00 -0.87 -0.52 119.26 120.47 1iq3 h ALA 87 Ca 0.22 -0.21 0.03 0.00 0.00 0.00 0.00 54.91 54.96 1iq3 h ALA 87 Cb 1.31 0.12 -0.00 0.00 0.00 0.00 0.00 17.79 19.21 1iq3 h ALA 87 CO -0.00 -0.42 0.12 -0.09 0.00 0.00 0.00 179.25 178.86 1iq3 h ARG 88 N -0.81 0.00 0.00 0.00 9.65 -0.63 0.16 114.38 122.75 1iq3 h ARG 88 Ca -0.03 0.00 -0.04 0.00 -1.10 0.00 0.00 59.98 58.81 1iq3 h ARG 88 Cb 0.51 0.00 -0.01 0.00 -1.39 0.00 0.00 29.97 29.09 1iq3 h ARG 88 CO 0.05 0.00 -0.79 -0.22 2.80 0.00 0.00 179.97 181.81 1iq3 h LYS 89 N 0.00 0.00 -0.38 0.20 3.11 -1.33 -3.31 116.57 114.87 1iq3 h LYS 89 Ca 0.06 0.00 0.00 0.00 -2.81 0.00 0.00 60.65 57.90 1iq3 h LYS 89 Cb 0.30 0.00 0.00 0.00 -1.00 0.00 0.00 32.23 31.53 1iq3 h LYS 89 CO -0.00 0.10 0.00 -1.71 -2.81 0.00 0.00 179.45 175.03 1iq3 n ASN 90 N -2.87 3.16 -2.81 4.20 2.85 0.04 -4.98 115.26 114.86 1iq3 n ASN 90 Ca -0.01 -1.92 -0.12 0.00 -0.11 0.00 0.00 54.58 52.43 1iq3 n ASN 90 Cb 0.61 -0.25 0.06 0.00 1.24 0.00 0.00 39.78 41.44 1iq3 n ASN 90 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1iq3 n GLY 91 N 1.11 -0.52 3.36 8.20 0.00 0.34 -5.01 105.19 112.67 1iq3 n GLY 91 Ca 0.16 0.27 -0.33 0.00 0.00 0.00 0.00 46.02 46.12 1iq3 n GLY 91 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1iq3 s TYR 92 N -3.28 2.74 0.33 1.61 2.02 -0.57 -5.02 117.35 115.17 1iq3 s TYR 92 Ca 0.26 -0.62 -0.29 0.00 -0.37 0.00 0.00 57.07 56.05 1iq3 s TYR 92 Cb -0.03 -1.78 -0.12 0.00 -0.40 0.00 0.00 41.96 39.63 1iq3 s TYR 92 CO 0.55 -0.17 1.47 -0.35 -1.57 0.00 0.00 175.55 175.48 1iq3 n PRO 93 N 3.29 2.50 -3.94 -1.71 -0.04 -1.26 -4.60 135.00 129.25 1iq3 n PRO 93 Ca -0.18 0.88 -0.36 0.00 -0.04 0.00 0.00 63.50 63.80 1iq3 n PRO 93 Cb 0.53 -2.59 -0.07 0.00 -0.04 0.00 0.00 33.50 31.32 1iq3 n PRO 93 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1iq3 s LEU 94 N -1.10 4.21 0.22 1.53 1.02 -1.26 -4.99 118.68 118.30 1iq3 s LEU 94 Ca 0.59 0.36 -0.07 0.00 0.02 0.00 0.00 54.13 55.03 1iq3 s LEU 94 Cb -0.52 -2.03 0.18 0.00 0.02 0.00 0.00 46.19 43.84 1iq3 s LEU 94 CO 0.57 0.36 1.77 1.55 0.02 0.00 0.00 176.35 180.61 1iq3 h PRO 95 N 5.37 1.13 0.00 1.29 0.13 -2.02 -3.46 132.00 134.44 1iq3 h PRO 95 Ca -0.51 -0.23 0.00 0.00 -0.87 0.00 0.00 66.00 64.39 1iq3 h PRO 95 Cb 1.21 -0.17 0.00 0.00 0.13 0.00 0.00 31.00 32.17 1iq3 h PRO 95 CO 0.61 0.95 0.00 -0.85 -0.23 0.00 0.00 178.00 178.48 1iq3 n GLU 96 N -4.26 1.96 0.00 0.86 0.28 -1.26 -5.09 120.64 113.13 1iq3 n GLU 96 Ca 0.06 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.06 1iq3 n GLU 96 Cb 0.22 0.00 0.00 0.00 1.43 0.00 0.00 31.44 33.09 1iq3 n GLU 96 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1iq3 n GLY 97 N 2.45 0.26 3.76 -1.84 0.00 -1.26 -5.02 105.19 103.53 1iq3 n GLY 97 Ca 0.00 -1.52 -0.36 0.00 0.00 0.00 0.00 46.02 44.14 1iq3 n GLY 97 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 1iq3 s LEU 98 N 0.00 3.74 0.15 0.99 2.34 -1.26 -4.92 118.68 119.71 1iq3 s LEU 98 Ca 0.00 2.36 -0.17 0.00 0.06 0.00 0.00 54.13 56.39 1iq3 s LEU 98 Cb 0.00 -4.53 0.02 0.00 -0.56 0.00 0.00 46.19 41.11 1iq3 s LEU 98 CO 0.00 -1.44 1.79 -0.65 -1.06 0.00 0.00 176.35 174.99 1iq3 h PRO 99 N 1.12 0.39 -7.01 1.48 0.11 -2.03 -3.43 132.00 122.64 1iq3 h PRO 99 Ca -0.50 -0.02 -0.45 0.00 0.11 0.00 0.00 66.00 65.13 1iq3 h PRO 99 Cb 1.29 -0.09 0.22 0.00 0.11 0.00 0.00 31.00 32.53 1iq3 h PRO 99 CO 0.56 0.26 -0.28 -2.30 -0.21 0.00 0.00 178.00 176.03 1iq3 n PRO 100 N -4.90 -2.04 -2.59 1.05 -0.02 -1.26 -5.00 135.00 120.23 1iq3 n PRO 100 Ca 0.00 -0.57 -0.05 0.00 -2.02 0.00 0.00 63.50 60.87 1iq3 n PRO 100 Cb 0.06 -2.06 0.07 0.00 -0.02 0.00 0.00 33.50 31.55 1iq3 n PRO 100 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 1iq3 n THR 101 N -4.75 0.00 -2.66 3.45 -2.24 -1.26 -5.01 114.28 101.81 1iq3 n THR 101 Ca 0.03 -1.04 -0.04 0.00 -2.27 0.00 0.00 64.05 60.74 1iq3 n THR 101 Cb 0.56 0.82 -0.00 0.00 -2.10 0.00 0.00 70.33 69.61 1iq3 n THR 101 CO 0.00 0.00 0.00 -0.11 -0.57 0.00 0.00 175.07 174.39 1iq3 n LEU 102 N -0.65 -1.16 -4.21 3.22 7.94 -1.26 -5.16 117.00 115.72 1iq3 n LEU 102 Ca -0.13 -1.84 -0.28 0.00 -1.11 0.00 0.00 56.01 52.64 1iq3 n LEU 102 Cb 0.76 0.85 0.27 0.00 0.53 0.00 0.00 43.42 45.82 1iq3 n LEU 102 CO -0.10 1.20 0.31 0.00 -1.11 0.00 0.00 177.39 177.69 1iq3 n GLN 103 N -0.42 -4.29 -1.64 1.96 10.64 -1.26 -4.67 117.38 117.69 1iq3 n GLN 103 Ca -0.25 -1.27 -0.16 0.00 -1.83 0.00 0.00 57.00 53.49 1iq3 n GLN 103 Cb 0.66 -1.87 -0.09 0.00 -0.86 0.00 0.00 30.24 28.08 1iq3 n GLN 103 CO 0.00 0.00 0.00 -2.14 -1.83 0.00 0.00 177.06 173.09 1iq3 s PRO 104 N -4.75 1.49 0.00 2.61 0.02 -1.26 -4.62 135.00 128.49 1iq3 s PRO 104 Ca 0.62 -0.10 0.00 0.00 0.02 0.00 0.00 61.00 61.55 1iq3 s PRO 104 Cb -0.12 -4.92 0.00 0.00 0.02 0.00 0.00 34.50 29.48 1iq3 s PRO 104 CO 0.54 -4.90 0.00 0.39 -0.33 0.00 0.00 177.00 172.70 1iq3 n GLU 105 N 8.48 0.00 -2.02 5.54 1.02 -1.26 -4.88 120.64 127.52 1iq3 n GLU 105 Ca 0.44 0.00 -0.25 0.00 -0.02 0.00 0.00 57.16 57.33 1iq3 n GLU 105 Cb 0.45 -0.06 0.02 0.00 -0.02 0.00 0.00 31.44 31.84 1iq3 n GLU 105 CO 0.00 0.00 0.00 1.97 1.18 0.00 0.00 177.13 180.28 1iq3 n PHE 106 N -1.55 2.83 0.10 -0.32 1.16 -1.26 -4.84 117.46 113.58 1iq3 n PHE 106 Ca 0.00 -2.34 -0.04 0.00 -1.87 0.00 0.00 57.45 53.20 1iq3 n PHE 106 Cb 0.00 -0.39 -0.02 0.00 -1.61 0.00 0.00 39.48 37.46 1iq3 n PHE 106 CO 0.00 0.00 0.00 0.82 -1.87 0.00 0.00 176.76 175.71 1iq3 h ILE 107 N 2.14 0.00 -4.55 1.97 1.08 -1.89 -3.46 117.51 112.80 1iq3 h ILE 107 Ca 0.38 -0.15 0.00 0.00 -0.39 0.00 0.00 64.86 64.70 1iq3 h ILE 107 Cb 1.44 0.00 0.00 0.00 -3.07 0.00 0.00 36.82 35.19 1iq3 h ILE 107 CO 0.82 0.00 -0.39 0.55 -0.69 0.00 0.00 178.15 178.44 1iq3 n VAL 108 N -3.16 -1.08 -3.37 1.67 3.14 -1.26 -0.09 118.33 114.17 1iq3 n VAL 108 Ca -0.03 0.19 -0.19 0.00 -2.96 0.00 0.00 64.34 61.35 1iq3 n VAL 108 Cb 0.11 -1.94 -0.03 0.00 -1.06 0.00 0.00 33.84 30.92 1iq3 n VAL 108 CO 0.00 0.00 0.00 0.41 -6.46 0.00 0.00 176.83 170.78 1iq3 n THR 109 N 1.51 -0.09 0.70 1.55 -1.04 -1.26 -5.25 114.28 110.40 1iq3 n THR 109 Ca 0.00 0.00 0.06 0.00 -2.04 0.00 0.00 64.05 62.07 1iq3 n THR 109 Cb 0.19 -0.37 0.33 0.00 -1.82 0.00 0.00 70.33 68.66 1iq3 n THR 109 CO 0.00 0.00 0.00 -0.67 -0.64 0.00 0.00 175.07 173.76