#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3iqh s ILE 3 N 0.00 3.19 0.22 0.00 1.01 -1.26 -5.10 121.20 119.26 3iqh s ILE 3 Ca 0.00 -0.56 -0.30 0.00 0.00 0.00 0.00 60.65 59.80 3iqh s ILE 3 Cb 0.00 -2.44 -0.08 0.00 0.01 0.00 0.00 42.46 39.95 3iqh s ILE 3 CO 0.00 0.44 1.04 -0.31 0.00 0.00 0.00 174.94 176.11 3iqh s TYR 4 N 1.43 3.72 0.35 3.97 2.02 -1.26 -4.94 117.35 122.64 3iqh s TYR 4 Ca 0.05 1.74 0.13 0.00 -0.37 0.00 0.00 57.07 58.62 3iqh s TYR 4 Cb -0.14 -3.17 0.68 0.00 -0.40 0.00 0.00 41.96 38.93 3iqh s TYR 4 CO -0.04 -0.20 1.80 0.00 -1.57 0.00 0.00 175.55 175.53 3iqh h ALA 5 N 4.50 1.30 -2.93 3.71 0.00 -1.99 -3.45 119.26 120.41 3iqh h ALA 5 Ca -0.45 -0.37 -0.05 0.00 0.00 0.00 0.00 54.91 54.04 3iqh h ALA 5 Cb 1.21 -0.06 -0.05 0.00 0.00 0.00 0.00 17.79 18.88 3iqh h ALA 5 CO 0.69 0.50 0.06 0.16 0.00 0.00 0.00 179.25 180.66 3iqh s ASP 6 N -6.88 0.06 0.43 0.00 1.47 -1.26 -5.06 116.67 105.43 3iqh s ASP 6 Ca -0.02 -1.00 0.19 0.00 1.18 0.00 0.00 52.55 52.90 3iqh s ASP 6 Cb 0.14 0.70 0.97 0.00 -0.34 0.00 0.00 42.92 44.40 3iqh s ASP 6 CO 0.73 -1.36 1.90 -1.13 0.68 0.00 0.00 175.17 175.98 3iqh h ASN 7 N 2.10 0.00 -0.69 2.11 -1.24 -1.87 -2.51 115.58 113.48 3iqh h ASN 7 Ca -0.26 0.00 0.07 0.00 0.71 0.00 0.00 56.30 56.82 3iqh h ASN 7 Cb 1.25 0.00 -0.04 0.00 0.73 0.00 0.00 38.32 40.26 3iqh h ASN 7 CO 0.34 0.27 0.45 0.77 -1.29 0.00 0.00 177.43 177.98 3iqh h SER 8 N 0.00 0.59 0.87 1.15 4.64 -1.92 -1.90 113.55 116.98 3iqh h SER 8 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3iqh h SER 8 Cb 0.58 -0.12 0.00 0.00 -0.31 0.00 0.00 62.40 62.55 3iqh h SER 8 CO 0.04 0.38 0.00 -1.22 -0.87 0.00 0.00 176.83 175.16 3iqh n TYR 9 N -4.48 0.42 1.47 4.77 4.01 -0.95 -3.28 117.16 119.13 3iqh n TYR 9 Ca 0.10 0.15 0.09 0.00 -0.16 0.00 0.00 57.90 58.08 3iqh n TYR 9 Cb 0.25 -0.74 0.39 0.00 -0.31 0.00 0.00 39.34 38.94 3iqh n TYR 9 CO 0.00 0.00 0.00 -1.13 -0.46 0.00 0.00 176.86 175.27 3iqh n SER 10 N -1.87 1.10 -4.70 7.72 3.41 -0.71 -4.96 113.62 113.61 3iqh n SER 10 Ca 0.04 -1.66 -0.37 0.00 -0.26 0.00 0.00 58.87 56.62 3iqh n SER 10 Cb 0.28 -0.08 0.06 0.00 -0.26 0.00 0.00 64.21 64.21 3iqh n SER 10 CO 0.00 0.00 0.00 2.30 -0.16 0.00 0.00 175.04 177.18 3iqh n ILE 11 N -0.04 4.54 -3.96 -1.33 -5.35 -1.20 -4.74 119.36 107.28 3iqh n ILE 11 Ca 0.14 -0.50 0.00 0.00 -0.27 0.00 0.00 62.75 62.12 3iqh n ILE 11 Cb 0.23 -1.43 0.00 0.00 -1.74 0.00 0.00 39.64 36.71 3iqh n ILE 11 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3iqh n GLY 12 N 1.00 -0.43 3.97 3.28 0.00 -1.26 -4.96 105.19 106.78 3iqh n GLY 12 Ca 0.15 -1.13 -0.29 0.00 0.00 0.00 0.00 46.02 44.75 3iqh n GLY 12 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3iqh n ASN 13 N 0.98 -2.76 -4.84 1.61 5.03 -1.26 -4.91 115.26 109.11 3iqh n ASN 13 Ca 0.00 -0.90 -0.33 0.00 0.87 0.00 0.00 54.58 54.22 3iqh n ASN 13 Cb 0.00 -3.44 -0.06 0.00 -1.02 0.00 0.00 39.78 35.26 3iqh n ASN 13 CO 0.00 0.00 0.00 0.42 -1.83 0.00 0.00 177.26 175.85 3iqh s THR 14 N -3.52 4.60 0.49 3.41 -4.23 -1.26 -5.05 115.64 110.09 3iqh s THR 14 Ca 0.42 1.11 -0.11 0.00 -1.18 0.00 0.00 61.69 61.93 3iqh s THR 14 Cb -0.22 -3.66 -0.06 0.00 1.34 0.00 0.00 72.50 69.90 3iqh s THR 14 CO 0.87 -0.13 0.88 -2.16 -0.54 0.00 0.00 174.62 173.54 3iqh s PRO 15 N -2.81 3.74 -0.18 3.99 0.04 -1.26 -4.78 135.00 133.74 3iqh s PRO 15 Ca 0.53 0.60 -0.07 0.00 0.04 0.00 0.00 61.00 62.10 3iqh s PRO 15 Cb -0.11 -2.26 -0.04 0.00 0.04 0.00 0.00 34.50 32.13 3iqh s PRO 15 CO 0.18 -0.24 0.06 -0.51 0.04 0.00 0.00 177.00 176.53 3iqh s LEU 16 N -4.35 3.82 -0.09 -3.56 1.43 -1.26 -1.86 118.68 112.80 3iqh s LEU 16 Ca 0.53 0.09 0.02 0.00 -1.03 0.00 0.00 54.13 53.74 3iqh s LEU 16 Cb -0.10 -1.96 0.01 0.00 0.03 0.00 0.00 46.19 44.17 3iqh s LEU 16 CO 0.39 0.19 -0.15 -0.69 0.23 0.00 0.00 176.35 176.32 3iqh s VAL 17 N 0.29 1.42 0.06 -1.59 1.01 0.19 -4.93 120.40 116.85 3iqh s VAL 17 Ca 0.03 -0.61 -0.30 0.00 0.00 0.00 0.00 61.98 61.10 3iqh s VAL 17 Cb -0.12 -1.29 -0.05 0.00 0.00 0.00 0.00 36.38 34.91 3iqh s VAL 17 CO 0.00 0.42 1.16 -0.60 0.00 0.00 0.00 175.10 176.08 3iqh s ARG 18 N 0.84 4.46 0.26 2.72 3.52 -1.26 -0.46 118.95 129.03 3iqh s ARG 18 Ca -0.10 1.71 -0.29 0.00 -0.13 0.00 0.00 55.73 56.93 3iqh s ARG 18 Cb -0.15 -3.36 -0.09 0.00 -1.56 0.00 0.00 34.95 29.78 3iqh s ARG 18 CO 0.01 -0.20 0.93 -0.51 -0.81 0.00 0.00 175.30 174.72 3iqh s LEU 19 N 0.95 4.56 -0.16 -0.88 1.43 -0.13 -4.96 118.68 119.50 3iqh s LEU 19 Ca 0.57 1.90 0.10 0.00 -1.03 0.00 0.00 54.13 55.67 3iqh s LEU 19 Cb -0.28 -3.71 -0.23 0.00 0.03 0.00 0.00 46.19 41.99 3iqh s LEU 19 CO 0.29 0.10 0.21 0.29 0.23 0.00 0.00 176.35 177.47 3iqh n LYS 20 N 1.22 0.68 -0.33 1.70 5.02 -1.26 -4.59 118.16 120.60 3iqh n LYS 20 Ca -0.01 0.14 0.07 0.00 -2.02 0.00 0.00 58.31 56.49 3iqh n LYS 20 Cb 0.48 -1.62 0.22 0.00 -0.02 0.00 0.00 35.03 34.09 3iqh n LYS 20 CO 0.00 0.00 0.00 0.72 -0.52 0.00 0.00 177.40 177.60 3iqh n HIS 21 N -3.02 0.78 -4.23 2.13 8.25 -1.26 -4.91 115.22 112.96 3iqh n HIS 21 Ca -0.31 -0.61 -0.13 0.00 -0.26 0.00 0.00 57.72 56.41 3iqh n HIS 21 Cb 1.08 -0.13 -0.10 0.00 1.12 0.00 0.00 29.99 31.96 3iqh n HIS 21 CO 0.00 0.00 0.00 -0.06 0.64 0.00 0.00 176.34 176.92 3iqh s PHE 22 N -1.60 1.15 0.00 4.41 0.08 -1.26 -5.11 117.98 115.65 3iqh s PHE 22 Ca 0.34 -0.88 0.00 0.00 0.12 0.00 0.00 56.93 56.51 3iqh s PHE 22 Cb 0.22 -0.63 0.00 0.00 -0.57 0.00 0.00 43.02 42.04 3iqh s PHE 22 CO 0.17 -0.06 0.00 0.41 -0.10 0.00 0.00 175.22 175.63 3iqh n GLY 23 N -0.17 -2.25 3.02 4.36 0.00 -1.26 -4.74 105.19 104.15 3iqh n GLY 23 Ca -0.10 -1.52 -0.30 0.00 0.00 0.00 0.00 46.02 44.10 3iqh n GLY 23 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 3iqh s HIS 24 N -0.80 2.13 -1.47 1.61 2.46 -1.26 -4.82 115.29 113.14 3iqh s HIS 24 Ca 0.00 -1.18 -0.09 0.00 0.47 0.00 0.00 55.06 54.26 3iqh s HIS 24 Cb 0.00 -1.57 0.06 0.00 -0.13 0.00 0.00 32.58 30.94 3iqh s HIS 24 CO 0.00 -0.65 0.86 0.09 -2.47 0.00 0.00 174.74 172.57 3iqh n ASN 25 N 4.73 -3.45 -0.50 9.88 3.02 -1.26 -2.58 115.26 125.10 3iqh n ASN 25 Ca -0.17 -0.81 -0.07 0.00 -0.03 0.00 0.00 54.58 53.50 3iqh n ASN 25 Cb 0.50 -3.85 -0.03 0.00 -0.61 0.00 0.00 39.78 35.79 3iqh n ASN 25 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3iqh n GLY 26 N -1.67 0.88 0.00 7.41 0.00 -1.26 -4.93 105.19 105.62 3iqh n GLY 26 Ca -0.08 -0.60 0.12 0.00 0.00 0.00 0.00 46.02 45.46 3iqh n GLY 26 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 3iqh n ASN 27 N 0.62 0.00 -4.38 1.61 6.94 -1.07 -4.68 115.26 114.30 3iqh n ASN 27 Ca -0.07 -0.28 -0.35 0.00 -0.02 0.00 0.00 54.58 53.87 3iqh n ASN 27 Cb 0.24 -0.20 -0.13 0.00 -2.36 0.00 0.00 39.78 37.32 3iqh n ASN 27 CO 0.00 0.00 0.00 -0.69 -1.03 0.00 0.00 177.26 175.54 3iqh s VAL 28 N -2.40 3.65 0.04 3.53 1.01 -1.26 -0.48 120.40 124.49 3iqh s VAL 28 Ca 0.28 -0.41 0.06 0.00 0.00 0.00 0.00 61.98 61.91 3iqh s VAL 28 Cb 0.17 -2.65 -0.02 0.00 0.00 0.00 0.00 36.38 33.87 3iqh s VAL 28 CO 0.35 0.43 -0.17 0.68 0.00 0.00 0.00 175.10 176.38 3iqh s VAL 29 N 1.22 1.38 0.01 2.92 -7.23 0.36 -0.95 120.40 118.12 3iqh s VAL 29 Ca 0.03 -1.09 0.08 0.00 -1.81 0.00 0.00 61.98 59.18 3iqh s VAL 29 Cb -0.14 -1.22 -0.03 0.00 0.56 0.00 0.00 36.38 35.55 3iqh s VAL 29 CO -0.00 0.11 -0.23 0.68 -0.31 0.00 0.00 175.10 175.35 3iqh s VAL 30 N -0.82 2.38 -0.27 1.32 -7.23 0.39 -1.01 120.40 115.16 3iqh s VAL 30 Ca 0.05 -1.17 -0.09 0.00 -1.81 0.00 0.00 61.98 58.96 3iqh s VAL 30 Cb -0.08 -1.92 -0.03 0.00 0.56 0.00 0.00 36.38 34.92 3iqh s VAL 30 CO 0.01 0.46 0.12 -0.75 -0.31 0.00 0.00 175.10 174.63 3iqh s LYS 31 N -1.02 3.61 -0.99 4.82 2.20 0.34 -0.64 119.74 128.05 3iqh s LYS 31 Ca 0.12 -0.52 -0.17 0.00 -0.36 0.00 0.00 55.97 55.03 3iqh s LYS 31 Cb -0.10 -3.46 0.15 0.00 -1.51 0.00 0.00 37.83 32.91 3iqh s LYS 31 CO 0.02 -0.26 1.17 0.42 -0.36 0.00 0.00 175.35 176.34 3iqh s ILE 32 N 1.64 4.91 -1.07 5.43 1.01 -0.78 -1.11 121.20 131.23 3iqh s ILE 32 Ca 0.06 -1.95 0.26 0.00 0.00 0.00 0.00 60.65 59.02 3iqh s ILE 32 Cb -0.16 -4.78 0.25 0.00 0.01 0.00 0.00 42.46 37.78 3iqh s ILE 32 CO 0.06 -1.49 1.83 -0.62 0.00 0.00 0.00 174.94 174.72 3iqh n GLU 33 N 6.03 0.06 0.30 2.79 -0.58 -0.61 -2.32 120.64 126.30 3iqh n GLU 33 Ca 0.26 0.06 0.17 0.00 -0.42 0.00 0.00 57.16 57.23 3iqh n GLU 33 Cb 0.47 -1.50 0.99 0.00 -0.57 0.00 0.00 31.44 30.83 3iqh n GLU 33 CO 0.00 0.00 0.00 0.78 -0.48 0.00 0.00 177.13 177.43 3iqh h GLY 34 N 4.40 0.00 -7.13 0.62 0.00 -1.73 -3.11 103.07 96.13 3iqh h GLY 34 Ca 0.00 0.00 -0.73 0.00 0.00 0.00 0.00 47.33 46.60 3iqh h GLY 34 CO 0.00 0.00 1.89 0.54 0.00 0.00 0.00 176.54 178.97 3iqh n ARG 35 N -3.62 3.38 -4.00 4.80 1.74 -0.98 -4.13 116.66 113.84 3iqh n ARG 35 Ca -0.02 -3.53 -0.10 0.00 -0.77 0.00 0.00 57.85 53.43 3iqh n ARG 35 Cb 0.12 -3.09 -0.07 0.00 -1.02 0.00 0.00 32.46 28.39 3iqh n ARG 35 CO 0.00 0.00 0.00 -0.80 -1.52 0.00 0.00 177.63 175.31 3iqh s ASN 36 N 2.39 0.07 0.31 0.55 0.01 -1.26 -4.65 114.94 112.35 3iqh s ASN 36 Ca 0.44 -0.95 0.06 0.00 -0.71 0.00 0.00 52.86 51.70 3iqh s ASN 36 Cb 0.04 0.43 0.73 0.00 0.41 0.00 0.00 41.25 42.86 3iqh s ASN 36 CO 0.00 -0.89 1.81 -0.65 -1.51 0.00 0.00 177.10 175.86 3iqh h PRO 37 N 2.56 0.77 -0.02 -0.60 0.11 -1.88 -1.07 132.00 131.87 3iqh h PRO 37 Ca -0.32 -0.05 -0.01 0.00 0.11 0.00 0.00 66.00 65.74 3iqh h PRO 37 Cb 1.23 -0.17 -0.00 0.00 0.11 0.00 0.00 31.00 32.16 3iqh h PRO 37 CO 0.49 0.51 -0.34 -1.13 -0.21 0.00 0.00 178.00 177.32 3iqh n SER 38 N -4.68 1.94 -0.88 -2.05 3.41 -1.26 -5.01 113.62 105.09 3iqh n SER 38 Ca 0.21 -3.67 -0.09 0.00 -0.26 0.00 0.00 58.87 55.06 3iqh n SER 38 Cb 0.51 -0.51 -0.02 0.00 -0.26 0.00 0.00 64.21 63.93 3iqh n SER 38 CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 3iqh n TYR 39 N -1.20 -0.22 -4.06 7.33 4.01 -0.41 -4.89 117.16 117.73 3iqh n TYR 39 Ca 0.19 0.00 -0.10 0.00 -0.16 0.00 0.00 57.90 57.83 3iqh n TYR 39 Cb 0.69 -2.07 -0.07 0.00 -0.31 0.00 0.00 39.34 37.58 3iqh n TYR 39 CO 0.00 0.00 0.00 -1.54 -0.46 0.00 0.00 176.86 174.86 3iqh s SER 40 N -2.75 -0.02 0.00 7.72 1.04 -1.23 -3.93 113.70 114.54 3iqh s SER 40 Ca 0.00 -1.07 0.00 0.00 0.48 0.00 0.00 55.95 55.36 3iqh s SER 40 Cb 0.00 0.52 0.00 0.00 0.10 0.00 0.00 66.02 66.64 3iqh s SER 40 CO 0.00 -1.04 0.00 0.55 0.98 0.00 0.00 173.24 173.73 3iqh n VAL 41 N -0.34 0.00 0.00 5.02 3.14 -0.14 -4.51 118.33 121.50 3iqh n VAL 41 Ca -0.01 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.37 3iqh n VAL 41 Cb 0.63 -0.64 0.00 0.00 -1.06 0.00 0.00 33.84 32.77 3iqh n VAL 41 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 3iqh h ARG 44 N 0.00 0.63 0.07 0.00 3.08 -1.97 -1.87 114.38 114.32 3iqh h ARG 44 Ca 0.00 -0.09 -0.24 0.00 0.07 0.00 0.00 59.98 59.71 3iqh h ARG 44 Cb 0.00 -0.11 -0.01 0.00 0.08 0.00 0.00 29.97 29.93 3iqh h ARG 44 CO 0.00 0.54 -1.13 -0.84 -1.07 0.00 0.00 179.97 177.47 3iqh h ILE 45 N 0.56 1.60 -0.17 2.04 3.07 -1.90 -1.67 117.51 121.04 3iqh h ILE 45 Ca 0.15 -3.23 0.05 0.00 1.55 0.00 0.00 64.86 63.38 3iqh h ILE 45 Cb 0.12 2.90 -0.06 0.00 -0.27 0.00 0.00 36.82 39.52 3iqh h ILE 45 CO -0.02 0.93 -0.18 1.23 -1.05 0.00 0.00 178.15 179.07 3iqh h GLY 46 N 2.24 -0.09 0.96 0.16 0.00 -1.86 0.01 103.07 104.48 3iqh h GLY 46 Ca -0.08 0.22 -0.02 0.00 0.00 0.00 0.00 47.33 47.46 3iqh h GLY 46 CO 0.17 -0.17 -0.17 0.00 0.00 0.00 0.00 176.54 176.37 3iqh h ALA 47 N 0.86 -0.47 -0.12 3.60 0.00 -1.29 -3.00 119.26 118.84 3iqh h ALA 47 Ca 0.11 -0.12 -0.14 0.00 0.00 0.00 0.00 54.91 54.76 3iqh h ALA 47 Cb 0.37 0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.34 3iqh h ALA 47 CO -0.29 -0.74 -0.55 -0.97 0.00 0.00 0.00 179.25 176.70 3iqh h ASN 48 N -0.52 0.39 -0.63 0.00 -1.24 -1.21 -0.35 115.58 112.02 3iqh h ASN 48 Ca -0.05 -0.21 -0.08 0.00 0.71 0.00 0.00 56.30 56.67 3iqh h ASN 48 Cb 0.39 -0.11 -0.03 0.00 0.73 0.00 0.00 38.32 39.30 3iqh h ASN 48 CO 0.08 0.86 0.08 0.24 -1.29 0.00 0.00 177.43 177.40 3iqh h MET 49 N 0.27 1.08 -0.04 6.67 2.86 -1.06 0.30 114.93 125.01 3iqh h MET 49 Ca 0.00 -0.30 -0.01 0.00 -2.06 0.00 0.00 59.70 57.34 3iqh h MET 49 Cb 1.05 -0.12 -0.00 0.00 0.06 0.00 0.00 31.60 32.59 3iqh h MET 49 CO 0.09 1.00 0.01 0.28 1.06 0.00 0.00 176.91 179.35 3iqh h VAL 50 N 1.00 1.21 -0.83 -2.22 2.07 -1.36 -2.27 116.25 113.85 3iqh h VAL 50 Ca 0.19 -0.62 0.03 0.00 0.82 0.00 0.00 66.70 67.12 3iqh h VAL 50 Cb 0.47 1.54 -0.05 0.00 -1.52 0.00 0.00 31.29 31.73 3iqh h VAL 50 CO 0.02 0.17 0.53 -0.50 0.02 0.00 0.00 177.57 177.81 3iqh h TRP 51 N -0.17 0.99 -0.46 1.57 6.55 -0.90 -1.04 115.95 122.50 3iqh h TRP 51 Ca 0.01 0.03 -0.12 0.00 0.95 0.00 0.00 58.89 59.76 3iqh h TRP 51 Cb 0.27 -0.33 -0.01 0.00 -0.86 0.00 0.00 29.16 28.22 3iqh h TRP 51 CO 0.01 0.57 -0.20 1.96 -1.05 0.00 0.00 178.44 179.73 3iqh h GLN 52 N 1.03 0.92 -0.15 0.49 1.08 -0.95 -1.21 115.11 116.31 3iqh h GLN 52 Ca 0.33 -0.37 -0.10 0.00 -1.45 0.00 0.00 58.65 57.06 3iqh h GLN 52 Cb 0.02 -0.04 -0.01 0.00 -0.05 0.00 0.00 27.48 27.40 3iqh h GLN 52 CO -0.12 1.03 -0.33 0.00 -0.95 0.00 0.00 178.83 178.46 3iqh h ALA 53 N 0.96 1.16 0.02 3.87 0.00 -1.04 0.10 119.26 124.34 3iqh h ALA 53 Ca 0.11 -0.36 -0.00 0.00 0.00 0.00 0.00 54.91 54.65 3iqh h ALA 53 Cb 0.75 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.44 3iqh h ALA 53 CO 0.06 0.55 -0.01 0.93 0.00 0.00 0.00 179.25 180.78 3iqh h GLU 54 N 0.27 -0.03 -0.45 0.00 5.08 -0.99 0.32 114.58 118.79 3iqh h GLU 54 Ca 0.03 0.00 -0.05 0.00 -1.00 0.00 0.00 59.36 58.35 3iqh h GLU 54 Cb 0.71 0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.95 3iqh h GLU 54 CO 0.05 0.14 0.09 0.87 -1.00 0.00 0.00 179.01 179.16 3iqh h LYS 55 N -0.18 0.68 -0.01 2.33 1.57 -0.89 -2.61 116.57 117.45 3iqh h LYS 55 Ca -0.00 -0.13 0.00 0.00 -1.87 0.00 0.00 60.65 58.64 3iqh h LYS 55 Cb 0.17 -0.11 0.00 0.00 0.08 0.00 0.00 32.23 32.38 3iqh h LYS 55 CO 0.00 0.64 -0.14 -0.40 -0.57 0.00 0.00 179.45 178.98 3iqh n ASP 56 N -4.29 1.52 0.00 0.86 5.68 -0.01 -4.94 116.55 115.36 3iqh n ASP 56 Ca 0.03 -1.32 0.00 0.00 -0.50 0.00 0.00 54.79 53.00 3iqh n ASP 56 Cb 0.22 0.10 0.00 0.00 -1.14 0.00 0.00 41.12 40.29 3iqh n ASP 56 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3iqh n GLY 57 N 1.28 0.73 0.17 6.12 0.00 -0.78 -4.91 105.19 107.79 3iqh n GLY 57 Ca 0.15 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.29 3iqh n GLY 57 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 3iqh h THR 58 N 0.00 0.00 -3.12 2.61 1.35 -1.34 -3.42 112.91 108.99 3iqh h THR 58 Ca 0.00 -0.86 -0.67 0.00 -0.55 0.00 0.00 66.41 64.34 3iqh h THR 58 Cb 0.00 1.74 -0.35 0.00 -1.73 0.00 0.00 68.15 67.82 3iqh h THR 58 CO 0.00 0.00 -0.86 -0.22 -0.25 0.00 0.00 175.52 174.19 3iqh s LEU 59 N -5.59 2.09 0.18 3.87 2.96 -0.07 -4.89 118.68 117.24 3iqh s LEU 59 Ca 0.06 -0.62 0.05 0.00 -0.22 0.00 0.00 54.13 53.40 3iqh s LEU 59 Cb 0.08 -1.44 -0.05 0.00 0.50 0.00 0.00 46.19 45.28 3iqh s LEU 59 CO 0.68 0.03 -0.07 0.42 -1.32 0.00 0.00 176.35 176.08 3iqh s THR 60 N 1.12 1.19 0.20 3.68 -4.23 -1.26 -4.09 115.64 112.25 3iqh s THR 60 Ca 0.00 -2.07 -0.32 0.00 -1.18 0.00 0.00 61.69 58.13 3iqh s THR 60 Cb -0.14 -2.05 -0.15 0.00 1.34 0.00 0.00 72.50 71.50 3iqh s THR 60 CO -0.09 -0.58 1.15 1.17 -0.54 0.00 0.00 174.62 175.73 3iqh n LYS 61 N -0.30 1.27 0.00 3.99 4.81 -1.26 -1.46 118.16 125.21 3iqh n LYS 61 Ca -0.08 0.45 0.00 0.00 -0.87 0.00 0.00 58.31 57.81 3iqh n LYS 61 Cb 0.62 -1.93 0.00 0.00 0.02 0.00 0.00 35.03 33.74 3iqh n LYS 61 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3iqh n GLY 62 N 1.87 2.52 3.72 3.14 0.00 -1.26 -5.02 105.19 110.16 3iqh n GLY 62 Ca 0.14 -0.08 -0.35 0.00 0.00 0.00 0.00 46.02 45.72 3iqh n GLY 62 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3iqh s LYS 63 N 0.00 2.32 -0.03 1.61 2.20 -0.54 -4.94 119.74 120.36 3iqh s LYS 63 Ca 0.00 1.90 0.07 0.00 -0.36 0.00 0.00 55.97 57.59 3iqh s LYS 63 Cb 0.00 -1.84 -0.02 0.00 -1.51 0.00 0.00 37.83 34.46 3iqh s LYS 63 CO 0.00 -1.73 -0.25 -2.00 -0.36 0.00 0.00 175.35 171.00 3iqh s GLU 64 N -3.65 2.24 0.08 4.03 2.12 0.87 -4.51 118.70 119.87 3iqh s GLU 64 Ca 0.78 -0.92 -0.26 0.00 0.36 0.00 0.00 54.97 54.94 3iqh s GLU 64 Cb -0.33 -2.08 -0.06 0.00 0.26 0.00 0.00 34.13 31.92 3iqh s GLU 64 CO 0.42 0.52 0.79 0.42 -0.54 0.00 0.00 175.26 176.87 3iqh s ILE 65 N -0.50 4.62 -0.04 -3.70 1.01 -0.45 -0.83 121.20 121.31 3iqh s ILE 65 Ca 0.07 1.69 0.03 0.00 0.00 0.00 0.00 60.65 62.44 3iqh s ILE 65 Cb -0.11 -4.14 0.00 0.00 0.01 0.00 0.00 42.46 38.22 3iqh s ILE 65 CO 0.00 0.40 -0.12 -0.69 0.00 0.00 0.00 174.94 174.53 3iqh s VAL 66 N -0.32 1.02 0.23 2.92 1.01 -0.24 -0.31 120.40 124.71 3iqh s VAL 66 Ca 0.39 -0.48 -0.14 0.00 0.00 0.00 0.00 61.98 61.75 3iqh s VAL 66 Cb -0.21 -0.90 0.00 0.00 0.00 0.00 0.00 36.38 35.27 3iqh s VAL 66 CO 0.24 0.31 0.50 -0.62 0.00 0.00 0.00 175.10 175.54 3iqh s ASP 67 N 0.24 -0.13 -0.36 3.32 -1.08 -0.65 -4.17 116.67 113.83 3iqh s ASP 67 Ca -0.05 -0.80 0.06 0.00 -0.52 0.00 0.00 52.55 51.24 3iqh s ASP 67 Cb -0.11 0.59 0.48 0.00 -1.46 0.00 0.00 42.92 42.42 3iqh s ASP 67 CO 0.01 -1.13 1.46 0.00 0.52 0.00 0.00 175.17 176.04 3iqh n ALA 68 N -0.37 4.96 -2.69 3.66 0.00 -1.26 -1.07 120.51 123.74 3iqh n ALA 68 Ca -0.04 -3.46 -0.32 0.00 0.00 0.00 0.00 53.44 49.61 3iqh n ALA 68 Cb 0.62 -0.76 -0.15 0.00 0.00 0.00 0.00 19.45 19.15 3iqh n ALA 68 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.50 177.42 3iqh s THR 69 N -4.06 2.53 -1.19 0.00 -1.32 -1.26 -4.79 115.64 105.55 3iqh s THR 69 Ca 0.51 -0.89 0.10 0.00 -1.21 0.00 0.00 61.69 60.19 3iqh s THR 69 Cb 0.43 -1.97 0.09 0.00 -1.51 0.00 0.00 72.50 69.53 3iqh s THR 69 CO 0.01 0.57 0.83 -1.20 -2.21 0.00 0.00 174.62 172.61 3iqh n SER 70 N 2.83 1.85 -2.31 8.08 7.64 -1.26 -4.05 113.62 126.40 3iqh n SER 70 Ca -0.17 -1.43 0.00 0.00 1.01 0.00 0.00 58.87 58.28 3iqh n SER 70 Cb 0.52 -0.01 0.00 0.00 -1.01 0.00 0.00 64.21 63.71 3iqh n SER 70 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3iqh n GLY 71 N 0.54 -0.04 0.34 0.23 0.00 -1.26 -4.68 105.19 100.31 3iqh n GLY 71 Ca 0.06 -1.71 0.02 0.00 0.00 0.00 0.00 46.02 44.39 3iqh n GLY 71 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 3iqh h ASN 72 N 0.00 0.72 -0.59 1.61 2.35 -1.99 -1.21 115.58 116.47 3iqh h ASN 72 Ca 0.00 -0.02 -0.02 0.00 -0.55 0.00 0.00 56.30 55.72 3iqh h ASN 72 Cb 0.00 -0.18 -0.03 0.00 0.05 0.00 0.00 38.32 38.17 3iqh h ASN 72 CO 0.00 0.52 0.30 0.74 -1.65 0.00 0.00 177.43 177.34 3iqh h THR 73 N 0.85 1.20 -0.60 2.81 2.02 -1.93 0.10 112.91 117.36 3iqh h THR 73 Ca 0.24 -0.55 0.03 0.00 0.77 0.00 0.00 66.41 66.90 3iqh h THR 73 Cb -0.05 0.48 -0.04 0.00 -1.74 0.00 0.00 68.15 66.80 3iqh h THR 73 CO -0.06 0.23 0.37 1.23 0.37 0.00 0.00 175.52 177.66 3iqh h GLY 74 N 0.80 0.86 1.00 2.16 0.00 -1.38 0.13 103.07 106.64 3iqh h GLY 74 Ca 0.20 -0.28 -0.09 0.00 0.00 0.00 0.00 47.33 47.17 3iqh h GLY 74 CO -0.03 0.23 -0.07 -2.22 0.00 0.00 0.00 176.54 174.46 3iqh h ILE 75 N 0.73 1.27 0.22 2.60 2.04 -1.13 0.72 117.51 123.96 3iqh h ILE 75 Ca 0.24 -1.16 -0.01 0.00 1.00 0.00 0.00 64.86 64.93 3iqh h ILE 75 Cb 0.02 1.11 0.00 0.00 -0.74 0.00 0.00 36.82 37.22 3iqh h ILE 75 CO -0.10 0.40 -0.11 0.00 0.00 0.00 0.00 178.15 178.34 3iqh h ALA 76 N 0.88 -0.30 -0.83 1.87 0.00 -0.49 -1.48 119.26 118.93 3iqh h ALA 76 Ca 0.12 -0.10 0.07 0.00 0.00 0.00 0.00 54.91 55.01 3iqh h ALA 76 Cb 0.59 0.12 -0.07 0.00 0.00 0.00 0.00 17.79 18.43 3iqh h ALA 76 CO 0.04 -0.63 0.49 -0.07 0.00 0.00 0.00 179.25 179.08 3iqh h LEU 77 N -0.38 0.74 0.16 0.00 3.38 -0.68 -1.91 115.31 116.62 3iqh h LEU 77 Ca -0.03 0.03 0.01 0.00 0.09 0.00 0.00 57.88 57.98 3iqh h LEU 77 Cb 0.29 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 40.90 3iqh h LEU 77 CO 0.05 0.46 -0.21 0.00 0.09 0.00 0.00 178.44 178.83 3iqh h ALA 78 N 1.42 -0.39 -0.69 1.53 0.00 -0.55 0.49 119.26 121.07 3iqh h ALA 78 Ca 0.38 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 55.21 3iqh h ALA 78 Cb 0.25 0.31 -0.03 0.00 0.00 0.00 0.00 17.79 18.32 3iqh h ALA 78 CO -0.20 -0.75 0.31 0.10 0.00 0.00 0.00 179.25 178.70 3iqh h TYR 79 N -0.42 0.99 -0.25 0.00 -0.00 -1.11 -1.58 116.97 114.60 3iqh h TYR 79 Ca 0.01 -0.05 -0.05 0.00 0.00 0.00 0.00 58.73 58.65 3iqh h TYR 79 Cb 0.42 -0.31 -0.01 0.00 0.00 0.00 0.00 36.73 36.83 3iqh h TYR 79 CO -0.17 0.74 -0.02 0.28 -0.00 0.00 0.00 178.16 178.98 3iqh h VAL 80 N 0.98 1.27 -0.42 -0.90 2.07 -1.11 0.12 116.25 118.27 3iqh h VAL 80 Ca 0.24 -0.97 0.05 0.00 0.82 0.00 0.00 66.70 66.83 3iqh h VAL 80 Cb 0.14 1.41 -0.04 0.00 -1.52 0.00 0.00 31.29 31.27 3iqh h VAL 80 CO -0.03 0.30 0.17 0.00 0.02 0.00 0.00 177.57 178.03 3iqh h ALA 81 N 0.79 0.50 -0.38 1.67 0.00 -0.74 0.44 119.26 121.53 3iqh h ALA 81 Ca 0.07 0.04 -0.03 0.00 0.00 0.00 0.00 54.91 54.99 3iqh h ALA 81 Cb 0.46 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.23 3iqh h ALA 81 CO 0.02 -0.22 0.12 0.00 0.00 0.00 0.00 179.25 179.17 3iqh h ALA 82 N 1.26 0.50 -0.26 0.00 0.00 -1.08 0.20 119.26 119.87 3iqh h ALA 82 Ca 0.19 -0.17 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 3iqh h ALA 82 Cb 0.15 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 3iqh h ALA 82 CO -0.17 0.15 0.10 0.00 0.00 0.00 0.00 179.25 179.32 3iqh h ALA 83 N 0.96 1.69 -0.15 0.00 0.00 -0.25 -3.10 119.26 118.41 3iqh h ALA 83 Ca 0.12 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.95 3iqh h ALA 83 Cb 0.26 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.94 3iqh h ALA 83 CO -0.00 0.25 0.00 0.54 0.00 0.00 0.00 179.25 180.04 3iqh n ARG 84 N -4.42 1.50 -1.63 0.00 1.74 0.10 -4.83 116.66 109.12 3iqh n ARG 84 Ca 0.01 -1.54 0.00 0.00 -0.77 0.00 0.00 57.85 55.55 3iqh n ARG 84 Cb 0.13 -1.25 0.00 0.00 -1.02 0.00 0.00 32.46 30.32 3iqh n ARG 84 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3iqh n GLY 85 N 0.62 0.45 3.86 -0.13 0.00 0.28 -5.03 105.19 105.24 3iqh n GLY 85 Ca 0.09 -0.89 -0.36 0.00 0.00 0.00 0.00 46.02 44.85 3iqh n GLY 85 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3iqh s TYR 86 N -2.00 3.64 0.48 1.61 2.02 0.43 -4.87 117.35 118.67 3iqh s TYR 86 Ca 0.00 0.76 -0.22 0.00 -0.37 0.00 0.00 57.07 57.24 3iqh s TYR 86 Cb 0.00 -2.12 -0.07 0.00 -0.40 0.00 0.00 41.96 39.37 3iqh s TYR 86 CO 0.00 0.64 1.14 0.15 -1.57 0.00 0.00 175.55 175.91 3iqh s LYS 87 N -1.36 3.70 -0.02 -0.62 -0.14 -1.26 -4.30 119.74 115.74 3iqh s LYS 87 Ca 0.24 1.69 -0.00 0.00 -1.36 0.00 0.00 55.97 56.53 3iqh s LYS 87 Cb -0.14 -2.30 0.01 0.00 -1.68 0.00 0.00 37.83 33.72 3iqh s LYS 87 CO 0.13 -0.58 0.03 -1.50 -0.76 0.00 0.00 175.35 172.67 3iqh s ILE 88 N -1.64 -0.03 -0.15 2.17 2.07 -1.26 -1.34 121.20 121.02 3iqh s ILE 88 Ca 0.65 0.09 -0.03 0.00 -1.41 0.00 0.00 60.65 59.96 3iqh s ILE 88 Cb -0.26 -0.06 -0.02 0.00 0.13 0.00 0.00 42.46 42.24 3iqh s ILE 88 CO 0.31 0.04 -0.06 -0.89 -1.91 0.00 0.00 174.94 172.43 3iqh s THR 89 N 0.49 3.64 -0.08 4.00 2.01 0.57 -1.02 115.64 125.24 3iqh s THR 89 Ca -0.04 -0.45 0.05 0.00 0.31 0.00 0.00 61.69 61.56 3iqh s THR 89 Cb -0.06 -2.58 -0.00 0.00 0.01 0.00 0.00 72.50 69.86 3iqh s THR 89 CO -0.01 0.49 -0.24 -0.76 -0.69 0.00 0.00 174.62 173.41 3iqh s LEU 90 N 0.46 2.10 -0.01 4.42 1.43 -0.73 -1.64 118.68 124.70 3iqh s LEU 90 Ca -0.05 -0.54 -0.06 0.00 -1.03 0.00 0.00 54.13 52.45 3iqh s LEU 90 Cb -0.15 -1.40 -0.05 0.00 0.03 0.00 0.00 46.19 44.63 3iqh s LEU 90 CO 0.03 0.19 0.24 0.42 0.23 0.00 0.00 176.35 177.47 3iqh s THR 91 N 0.14 5.35 -0.06 5.49 -4.23 -0.23 -1.42 115.64 120.68 3iqh s THR 91 Ca -0.13 0.12 -0.30 0.00 -1.18 0.00 0.00 61.69 60.20 3iqh s THR 91 Cb -0.16 -3.54 0.08 0.00 1.34 0.00 0.00 72.50 70.22 3iqh s THR 91 CO 0.07 0.39 0.76 0.00 -0.54 0.00 0.00 174.62 175.29 3iqh s MET 92 N -1.70 0.96 0.23 3.99 0.23 -0.66 -4.04 119.30 118.30 3iqh s MET 92 Ca 0.26 0.15 -0.31 0.00 -1.03 0.00 0.00 55.69 54.76 3iqh s MET 92 Cb -0.13 0.45 -0.14 0.00 -1.53 0.00 0.00 34.83 33.48 3iqh s MET 92 CO 0.15 -0.32 1.21 -2.30 -2.03 0.00 0.00 175.02 171.74 3iqh n PRO 93 N 0.71 1.54 0.06 3.16 -0.02 -1.26 0.17 135.00 139.36 3iqh n PRO 93 Ca -0.16 0.54 0.04 0.00 -2.02 0.00 0.00 63.50 61.90 3iqh n PRO 93 Cb 0.58 -2.07 0.23 0.00 -0.02 0.00 0.00 33.50 32.22 3iqh n PRO 93 CO 0.00 0.00 0.00 -0.85 1.98 0.00 0.00 175.50 176.63 3iqh n GLU 94 N 1.52 0.05 0.00 -0.52 0.28 -0.30 -1.87 120.64 119.81 3iqh n GLU 94 Ca 0.12 0.55 0.13 0.00 -0.16 0.00 0.00 57.16 57.80 3iqh n GLU 94 Cb 0.29 -1.67 0.37 0.00 1.43 0.00 0.00 31.44 31.86 3iqh n GLU 94 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 177.13 177.22 3iqh n THR 95 N -1.79 0.00 -1.57 3.84 -2.24 -1.26 -4.92 114.28 106.33 3iqh n THR 95 Ca -0.00 -0.29 -0.39 0.00 -2.27 0.00 0.00 64.05 61.09 3iqh n THR 95 Cb 0.02 0.77 0.04 0.00 -2.10 0.00 0.00 70.33 69.06 3iqh n THR 95 CO 0.00 0.00 0.00 0.23 -0.57 0.00 0.00 175.07 174.73 3iqh n MET 96 N 0.34 0.88 -1.78 -0.78 2.81 -0.78 -4.93 117.12 112.87 3iqh n MET 96 Ca 0.16 0.33 -0.39 0.00 -1.81 0.00 0.00 57.70 56.00 3iqh n MET 96 Cb 0.42 -2.00 0.03 0.00 -0.71 0.00 0.00 33.22 30.96 3iqh n MET 96 CO 0.00 0.00 0.00 -1.54 1.51 0.00 0.00 175.97 175.94 3iqh s SER 97 N -1.12 5.52 0.33 7.83 1.04 -1.26 -4.87 113.70 121.18 3iqh s SER 97 Ca 0.71 2.84 0.02 0.00 0.48 0.00 0.00 55.95 60.00 3iqh s SER 97 Cb -0.46 -2.64 0.60 0.00 0.10 0.00 0.00 66.02 63.62 3iqh s SER 97 CO 0.51 -1.41 1.98 0.25 0.98 0.00 0.00 173.24 175.55 3iqh h LEU 98 N 1.83 0.79 -0.29 2.42 5.85 -1.97 -1.77 115.31 122.17 3iqh h LEU 98 Ca -0.51 -0.01 0.06 0.00 0.84 0.00 0.00 57.88 58.26 3iqh h LEU 98 Cb 1.29 -0.19 -0.05 0.00 0.37 0.00 0.00 40.66 42.08 3iqh h LEU 98 CO 0.59 0.55 -0.06 -0.33 -0.34 0.00 0.00 178.44 178.85 3iqh h GLU 99 N 0.92 0.01 -0.40 1.25 3.07 -1.99 0.55 114.58 117.99 3iqh h GLU 99 Ca 0.29 -0.00 -0.07 0.00 -0.50 0.00 0.00 59.36 59.07 3iqh h GLU 99 Cb 0.01 -0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 27.91 3iqh h GLU 99 CO -0.08 0.01 -0.04 -0.09 -1.40 0.00 0.00 179.01 177.41 3iqh h ARG 100 N 0.01 0.73 0.02 2.33 9.65 -1.82 -0.54 114.38 124.76 3iqh h ARG 100 Ca 0.14 -0.25 0.02 0.00 -1.10 0.00 0.00 59.98 58.78 3iqh h ARG 100 Cb 0.21 -0.06 -0.02 0.00 -1.39 0.00 0.00 29.97 28.71 3iqh h ARG 100 CO -0.29 0.84 -0.11 0.87 2.80 0.00 0.00 179.97 184.08 3iqh h LYS 101 N 0.55 -0.19 -0.31 0.20 1.57 -1.17 -1.85 116.57 115.37 3iqh h LYS 101 Ca 0.11 0.01 0.06 0.00 -1.87 0.00 0.00 60.65 58.96 3iqh h LYS 101 Cb 0.54 0.04 -0.05 0.00 0.08 0.00 0.00 32.23 32.84 3iqh h LYS 101 CO 0.03 -0.13 -0.03 0.00 -0.57 0.00 0.00 179.45 178.75 3iqh h ARG 102 N -0.20 0.06 -0.41 3.15 3.08 -0.84 0.33 114.38 119.55 3iqh h ARG 102 Ca 0.03 -0.00 0.03 0.00 0.07 0.00 0.00 59.98 60.11 3iqh h ARG 102 Cb 0.24 -0.01 -0.03 0.00 0.08 0.00 0.00 29.97 30.24 3iqh h ARG 102 CO -0.10 0.04 0.21 1.25 -1.07 0.00 0.00 179.97 180.30 3iqh h LEU 103 N 0.06 0.31 -0.42 3.04 5.85 -0.98 0.12 115.31 123.29 3iqh h LEU 103 Ca 0.15 0.02 -0.12 0.00 0.84 0.00 0.00 57.88 58.77 3iqh h LEU 103 Cb 0.21 -0.04 -0.01 0.00 0.37 0.00 0.00 40.66 41.19 3iqh h LEU 103 CO -0.27 0.22 -0.22 -0.07 -0.34 0.00 0.00 178.44 177.76 3iqh h LEU 104 N 0.42 0.92 -0.77 2.25 3.38 -1.01 -2.19 115.31 118.31 3iqh h LEU 104 Ca 0.17 -0.41 -0.04 0.00 0.09 0.00 0.00 57.88 57.70 3iqh h LEU 104 Cb 0.07 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 40.53 3iqh h LEU 104 CO -0.12 1.12 0.33 0.00 0.09 0.00 0.00 178.44 179.87 3iqh h GLY 106 N 1.11 1.16 0.70 0.00 0.00 -0.56 -1.25 103.07 104.23 3iqh h GLY 106 Ca 0.26 -0.33 0.00 0.00 0.00 0.00 0.00 47.33 47.26 3iqh h GLY 106 CO -0.03 0.19 0.00 1.04 0.00 0.00 0.00 176.54 177.74 3iqh n LEU 107 N -4.52 0.05 0.00 3.11 4.77 -0.84 -4.89 117.00 114.68 3iqh n LEU 107 Ca 0.14 -0.02 0.00 0.00 -0.03 0.00 0.00 56.01 56.11 3iqh n LEU 107 Cb 0.32 -0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.41 3iqh n LEU 107 CO 0.32 0.01 0.00 0.61 -1.33 0.00 0.00 177.39 176.99 3iqh n GLY 108 N 0.88 0.72 3.76 -0.72 0.00 -0.47 -4.67 105.19 104.69 3iqh n GLY 108 Ca 0.18 -0.01 -0.41 0.00 0.00 0.00 0.00 46.02 45.78 3iqh n GLY 108 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3iqh s VAL 109 N -2.00 2.81 -0.66 1.61 1.01 -0.85 -4.75 120.40 117.57 3iqh s VAL 109 Ca 0.00 0.76 -0.25 0.00 0.00 0.00 0.00 61.98 62.49 3iqh s VAL 109 Cb 0.00 -3.49 0.05 0.00 0.00 0.00 0.00 36.38 32.94 3iqh s VAL 109 CO 0.00 0.16 1.10 0.21 0.00 0.00 0.00 175.10 176.58 3iqh s ASN 110 N -0.23 6.22 -0.15 3.32 2.47 -0.19 -4.56 114.94 121.83 3iqh s ASN 110 Ca 0.52 -0.57 -0.25 0.00 0.42 0.00 0.00 52.86 52.98 3iqh s ASN 110 Cb -0.39 -2.49 -0.02 0.00 -1.45 0.00 0.00 41.25 36.90 3iqh s ASN 110 CO 0.49 -1.56 0.81 -0.76 -3.72 0.00 0.00 177.10 172.35 3iqh s LEU 111 N 4.78 4.20 -0.36 3.21 1.43 -1.26 -1.78 118.68 128.90 3iqh s LEU 111 Ca 0.31 1.18 -0.10 0.00 -1.03 0.00 0.00 54.13 54.48 3iqh s LEU 111 Cb -0.12 -3.21 0.03 0.00 0.03 0.00 0.00 46.19 42.92 3iqh s LEU 111 CO 0.15 -0.35 0.18 -0.69 0.23 0.00 0.00 176.35 175.87 3iqh s VAL 112 N 1.92 4.43 -0.23 -1.59 1.01 -0.51 -4.98 120.40 120.45 3iqh s VAL 112 Ca 0.38 -0.87 -0.25 0.00 0.00 0.00 0.00 61.98 61.24 3iqh s VAL 112 Cb -0.17 -3.45 -0.00 0.00 0.00 0.00 0.00 36.38 32.75 3iqh s VAL 112 CO 0.14 -0.19 0.87 -0.76 0.00 0.00 0.00 175.10 175.15 3iqh s LEU 113 N 1.53 4.10 0.69 3.92 1.43 -1.26 -1.65 118.68 127.44 3iqh s LEU 113 Ca 0.02 1.12 -0.01 0.00 -1.03 0.00 0.00 54.13 54.23 3iqh s LEU 113 Cb -0.19 -3.26 0.10 0.00 0.03 0.00 0.00 46.19 42.87 3iqh s LEU 113 CO 0.06 -0.52 0.96 0.42 0.23 0.00 0.00 176.35 177.49 3iqh s THR 114 N 2.78 2.26 0.01 5.49 -4.23 0.13 -4.81 115.64 117.26 3iqh s THR 114 Ca 0.37 -0.57 -0.30 0.00 -1.18 0.00 0.00 61.69 60.01 3iqh s THR 114 Cb -0.15 -2.69 -0.06 0.00 1.34 0.00 0.00 72.50 70.94 3iqh s THR 114 CO 0.08 0.00 1.46 -0.70 -0.54 0.00 0.00 174.62 174.92 3iqh s GLU 115 N -5.09 4.26 0.18 3.99 2.12 -1.26 -1.15 118.70 121.75 3iqh s GLU 115 Ca 0.64 2.04 -0.16 0.00 0.36 0.00 0.00 54.97 57.85 3iqh s GLU 115 Cb -0.07 -3.60 0.14 0.00 0.26 0.00 0.00 34.13 30.86 3iqh s GLU 115 CO 0.43 -0.62 1.66 0.78 -0.54 0.00 0.00 175.26 176.97 3iqh h GLY 116 N 8.50 0.35 0.58 -1.50 0.00 -1.93 -0.87 103.07 108.19 3iqh h GLY 116 Ca -0.39 0.15 0.00 0.00 0.00 0.00 0.00 47.33 47.09 3iqh h GLY 116 CO 0.91 -0.18 0.00 0.00 0.00 0.00 0.00 176.54 177.27 3iqh n ALA 117 N -2.80 1.83 0.14 3.60 0.00 -1.26 -2.26 120.51 119.76 3iqh n ALA 117 Ca 0.04 -0.03 0.06 0.00 0.00 0.00 0.00 53.44 53.50 3iqh n ALA 117 Cb 0.25 -1.09 -0.09 0.00 0.00 0.00 0.00 19.45 18.53 3iqh n ALA 117 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 3iqh n LYS 118 N -0.79 1.10 0.00 0.00 5.02 -0.33 -5.09 118.16 118.06 3iqh n LYS 118 Ca 0.04 -0.08 0.00 0.00 -2.02 0.00 0.00 58.31 56.25 3iqh n LYS 118 Cb 0.02 -1.23 0.00 0.00 -0.02 0.00 0.00 35.03 33.80 3iqh n LYS 118 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3iqh n GLY 119 N 1.67 0.52 0.33 0.72 0.00 -0.96 -3.05 105.19 104.42 3iqh n GLY 119 Ca -0.01 -0.80 -0.05 0.00 0.00 0.00 0.00 46.02 45.17 3iqh n GLY 119 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 3iqh h MET 120 N 0.00 1.04 -0.67 1.61 2.86 -1.94 -3.04 114.93 114.80 3iqh h MET 120 Ca 0.00 -0.20 0.09 0.00 -2.06 0.00 0.00 59.70 57.53 3iqh h MET 120 Cb 0.00 -0.16 -0.07 0.00 0.06 0.00 0.00 31.60 31.43 3iqh h MET 120 CO 0.00 0.88 0.32 -0.22 1.06 0.00 0.00 176.91 178.94 3iqh h LYS 121 N 1.01 0.53 -0.40 1.72 3.64 -2.00 0.67 116.57 121.75 3iqh h LYS 121 Ca 0.23 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.58 3iqh h LYS 121 Cb 0.25 -0.12 -0.02 0.00 -0.41 0.00 0.00 32.23 31.93 3iqh h LYS 121 CO -0.01 0.35 0.26 0.78 -2.27 0.00 0.00 179.45 178.56 3iqh h GLY 122 N 0.55 0.56 1.01 5.01 0.00 -1.45 -1.38 103.07 107.36 3iqh h GLY 122 Ca 0.33 -0.22 -0.01 0.00 0.00 0.00 0.00 47.33 47.43 3iqh h GLY 122 CO -0.26 0.21 0.39 0.00 0.00 0.00 0.00 176.54 176.88 3iqh h ALA 123 N 1.13 0.90 -0.54 3.60 0.00 -1.28 -1.74 119.26 121.35 3iqh h ALA 123 Ca 0.14 -0.11 -0.12 0.00 0.00 0.00 0.00 54.91 54.83 3iqh h ALA 123 Cb -0.05 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.45 3iqh h ALA 123 CO -0.03 0.41 -0.13 0.82 0.00 0.00 0.00 179.25 180.32 3iqh h ILE 124 N 0.97 1.27 -0.44 0.00 2.04 -0.72 -2.05 117.51 118.58 3iqh h ILE 124 Ca 0.25 -1.29 -0.07 0.00 1.00 0.00 0.00 64.86 64.75 3iqh h ILE 124 Cb 0.03 0.99 -0.02 0.00 -0.74 0.00 0.00 36.82 37.08 3iqh h ILE 124 CO -0.04 0.46 0.02 0.00 0.00 0.00 0.00 178.15 178.58 3iqh h ALA 125 N 0.93 0.58 -0.45 1.87 0.00 -1.21 -1.66 119.26 119.31 3iqh h ALA 125 Ca 0.14 -0.26 0.03 0.00 0.00 0.00 0.00 54.91 54.82 3iqh h ALA 125 Cb 0.70 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 18.30 3iqh h ALA 125 CO 0.05 0.36 0.25 -0.22 0.00 0.00 0.00 179.25 179.69 3iqh h LYS 126 N 0.60 0.48 -0.47 0.00 1.63 -1.22 0.23 116.57 117.83 3iqh h LYS 126 Ca 0.13 -0.03 0.01 0.00 -0.85 0.00 0.00 60.65 59.91 3iqh h LYS 126 Cb 0.47 -0.11 -0.03 0.00 -0.60 0.00 0.00 32.23 31.96 3iqh h LYS 126 CO 0.02 0.32 0.30 0.00 -3.45 0.00 0.00 179.45 176.64 3iqh h ALA 127 N 1.22 0.59 -0.86 5.00 0.00 -1.24 0.26 119.26 124.23 3iqh h ALA 127 Ca 0.19 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 55.05 3iqh h ALA 127 Cb 0.06 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 17.63 3iqh h ALA 127 CO -0.11 0.02 0.45 0.93 0.00 0.00 0.00 179.25 180.55 3iqh h GLU 128 N 0.61 1.21 -0.14 0.00 5.08 -1.03 -2.15 114.58 118.16 3iqh h GLU 128 Ca 0.17 -0.15 -0.01 0.00 -1.00 0.00 0.00 59.36 58.37 3iqh h GLU 128 Cb -0.05 -0.23 -0.01 0.00 0.50 0.00 0.00 28.75 28.96 3iqh h GLU 128 CO -0.05 0.90 0.04 1.49 -1.00 0.00 0.00 179.01 180.39 3iqh h GLU 129 N 1.20 0.21 -0.55 2.33 4.81 -0.07 -2.01 114.58 120.51 3iqh h GLU 129 Ca 0.30 -0.05 0.06 0.00 -0.13 0.00 0.00 59.36 59.54 3iqh h GLU 129 Cb 0.05 -0.03 -0.05 0.00 0.63 0.00 0.00 28.75 29.35 3iqh h GLU 129 CO -0.05 0.35 0.26 0.82 -0.73 0.00 0.00 179.01 179.66 3iqh h ILE 130 N 0.04 0.91 -0.31 2.32 2.04 -0.38 -1.86 117.51 120.27 3iqh h ILE 130 Ca 0.04 -0.17 -0.03 0.00 1.00 0.00 0.00 64.86 65.70 3iqh h ILE 130 Cb 0.22 0.37 -0.01 0.00 -0.74 0.00 0.00 36.82 36.66 3iqh h ILE 130 CO -0.00 0.09 0.08 0.58 0.00 0.00 0.00 178.15 178.90 3iqh h VAL 131 N 0.50 1.22 0.00 1.67 2.07 -1.36 -2.67 116.25 117.68 3iqh h VAL 131 Ca 0.25 -0.73 -0.01 0.00 0.82 0.00 0.00 66.70 67.03 3iqh h VAL 131 Cb 0.20 1.10 -0.00 0.00 -1.52 0.00 0.00 31.29 31.07 3iqh h VAL 131 CO -0.20 0.24 -0.04 0.00 0.02 0.00 0.00 177.57 177.60 3iqh h ALA 132 N 0.91 1.16 0.00 1.67 0.00 -1.14 -1.21 119.26 120.65 3iqh h ALA 132 Ca 0.10 -0.03 -0.04 0.00 0.00 0.00 0.00 54.91 54.94 3iqh h ALA 132 Cb 0.29 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 3iqh h ALA 132 CO 0.00 0.04 -0.18 0.66 0.00 0.00 0.00 179.25 179.78 3iqh h SER 133 N 0.00 0.00 -0.77 0.00 4.64 -0.97 -3.38 113.55 113.07 3iqh h SER 133 Ca -0.00 0.00 -0.14 0.00 -0.47 0.00 0.00 61.79 61.18 3iqh h SER 133 Cb 0.19 0.00 -0.16 0.00 -0.31 0.00 0.00 62.40 62.13 3iqh h SER 133 CO 0.00 0.18 -0.44 -0.67 -0.87 0.00 0.00 176.83 175.03 3iqh n ASP 134 N -3.30 -3.14 0.28 4.97 -0.08 -0.91 -5.05 116.55 109.33 3iqh n ASP 134 Ca 0.01 -2.73 0.18 0.00 -1.51 0.00 0.00 54.79 50.74 3iqh n ASP 134 Cb 0.43 1.64 0.94 0.00 2.34 0.00 0.00 41.12 46.47 3iqh n ASP 134 CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 3iqh h PRO 135 N 4.75 0.00 0.00 -0.67 0.11 -1.44 -0.48 132.00 134.28 3iqh h PRO 135 Ca 0.02 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.13 3iqh h PRO 135 Cb 1.11 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.22 3iqh h PRO 135 CO 0.03 0.00 0.00 0.66 -0.21 0.00 0.00 178.00 178.48 3iqh h SER 136 N 0.00 0.00 0.09 -2.05 4.64 -1.97 -3.31 113.55 110.95 3iqh h SER 136 Ca 0.04 0.00 -0.36 0.00 -0.47 0.00 0.00 61.79 61.00 3iqh h SER 136 Cb 0.40 0.00 -0.07 0.00 -0.31 0.00 0.00 62.40 62.42 3iqh h SER 136 CO -0.00 0.00 -2.27 -1.14 -0.87 0.00 0.00 176.83 172.55 3iqh n ARG 137 N -2.34 0.68 -5.28 4.77 0.63 -0.21 -4.90 116.66 110.01 3iqh n ARG 137 Ca 0.05 0.05 -0.31 0.00 -0.92 0.00 0.00 57.85 56.73 3iqh n ARG 137 Cb 0.43 -1.57 -0.16 0.00 0.45 0.00 0.00 32.46 31.61 3iqh n ARG 137 CO 0.00 0.00 0.00 0.71 -2.51 0.00 0.00 177.63 175.83 3iqh s TYR 138 N -2.51 2.31 -0.09 -0.14 2.02 -1.05 -0.09 117.35 117.80 3iqh s TYR 138 Ca -0.10 -0.48 0.02 0.00 -0.37 0.00 0.00 57.07 56.14 3iqh s TYR 138 Cb 0.06 -1.49 0.01 0.00 -0.40 0.00 0.00 41.96 40.14 3iqh s TYR 138 CO 0.82 -0.07 -0.14 0.08 -1.57 0.00 0.00 175.55 174.68 3iqh s VAL 139 N -0.53 1.34 -0.21 0.71 1.01 -0.01 -4.80 120.40 117.91 3iqh s VAL 139 Ca 0.08 -0.56 -0.04 0.00 0.00 0.00 0.00 61.98 61.46 3iqh s VAL 139 Cb -0.10 -1.23 -0.01 0.00 0.00 0.00 0.00 36.38 35.04 3iqh s VAL 139 CO -0.00 0.41 -0.04 -0.32 0.00 0.00 0.00 175.10 175.14 3iqh s MET 140 N 0.90 3.44 0.21 2.72 1.75 -1.26 -1.08 119.30 125.97 3iqh s MET 140 Ca -0.09 -0.61 0.19 0.00 -1.25 0.00 0.00 55.69 53.93 3iqh s MET 140 Cb -0.15 -2.99 0.02 0.00 2.84 0.00 0.00 34.83 34.55 3iqh s MET 140 CO 0.00 -0.11 1.15 -0.07 -0.65 0.00 0.00 175.02 175.34 3iqh h LEU 141 N 7.82 0.00 -2.39 4.11 3.38 -1.99 -3.49 115.31 122.74 3iqh h LEU 141 Ca -0.39 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.56 3iqh h LEU 141 Cb 1.17 0.00 0.02 0.00 0.09 0.00 0.00 40.66 41.94 3iqh h LEU 141 CO 0.60 0.31 -0.09 0.29 0.09 0.00 0.00 178.44 179.64 3iqh n LYS 142 N -2.93 -1.38 0.19 1.13 5.02 -1.26 -4.52 118.16 114.40 3iqh n LYS 142 Ca -0.02 1.41 0.18 0.00 -2.02 0.00 0.00 58.31 57.85 3iqh n LYS 142 Cb 0.69 -5.67 0.81 0.00 -0.02 0.00 0.00 35.03 30.84 3iqh n LYS 142 CO 0.00 0.00 0.00 -0.56 -0.52 0.00 0.00 177.40 176.32 3iqh h GLN 143 N 0.29 0.00 0.00 1.97 3.07 -1.95 -1.06 115.11 117.44 3iqh h GLN 143 Ca -0.06 0.00 -0.04 0.00 0.09 0.00 0.00 58.65 58.63 3iqh h GLN 143 Cb 1.03 0.00 -0.01 0.00 0.08 0.00 0.00 27.48 28.58 3iqh h GLN 143 CO 0.31 0.00 -0.21 0.74 0.09 0.00 0.00 178.83 179.75 3iqh h PHE 144 N 0.00 0.00 0.00 0.06 0.04 -1.91 -3.37 116.94 111.76 3iqh h PHE 144 Ca 0.10 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.87 3iqh h PHE 144 Cb 0.58 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.73 3iqh h PHE 144 CO 0.00 0.21 -0.56 -0.85 -0.60 0.00 0.00 178.31 176.52 3iqh n GLU 145 N -3.29 2.96 -2.06 1.51 0.28 -0.78 -1.24 120.64 118.03 3iqh n GLU 145 Ca 0.01 0.00 -0.43 0.00 -0.16 0.00 0.00 57.16 56.58 3iqh n GLU 145 Cb 0.48 -0.77 -0.03 0.00 1.43 0.00 0.00 31.44 32.55 3iqh n GLU 145 CO 0.00 0.00 0.00 1.21 -0.16 0.00 0.00 177.13 178.18 3iqh s ASN 146 N -1.52 6.32 0.61 -1.84 3.84 -0.47 -4.78 114.94 117.10 3iqh s ASN 146 Ca 0.00 1.67 0.41 0.00 0.21 0.00 0.00 52.86 55.15 3iqh s ASN 146 Cb 0.00 -2.53 2.11 0.00 -0.55 0.00 0.00 41.25 40.28 3iqh s ASN 146 CO 0.00 -1.30 2.24 1.55 -2.79 0.00 0.00 177.10 176.79 3iqh h PRO 147 N 11.02 0.00 -0.10 0.43 0.13 -1.94 -1.06 132.00 140.49 3iqh h PRO 147 Ca -0.35 0.00 0.03 0.00 -0.87 0.00 0.00 66.00 64.81 3iqh h PRO 147 Cb 1.16 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.29 3iqh h PRO 147 CO 1.00 0.00 0.15 0.00 -0.23 0.00 0.00 178.00 178.91 3iqh h ALA 148 N 2.01 1.55 0.03 -0.56 0.00 -1.92 -1.09 119.26 119.27 3iqh h ALA 148 Ca 0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 3iqh h ALA 148 Cb 0.11 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.91 3iqh h ALA 148 CO 0.00 -0.20 -0.01 -0.97 0.00 0.00 0.00 179.25 178.07 3iqh h ASN 149 N 0.00 -0.03 0.17 0.00 -0.73 -1.52 -2.85 115.58 110.62 3iqh h ASN 149 Ca 0.05 0.00 -0.02 0.00 1.87 0.00 0.00 56.30 58.20 3iqh h ASN 149 Cb 0.34 0.01 -0.00 0.00 0.27 0.00 0.00 38.32 38.93 3iqh h ASN 149 CO -0.00 -0.02 -0.09 1.55 -0.37 0.00 0.00 177.43 178.50 3iqh h PRO 150 N -0.04 0.00 -0.66 6.67 0.13 -1.72 -2.83 132.00 133.54 3iqh h PRO 150 Ca -0.00 0.00 0.01 0.00 -0.87 0.00 0.00 66.00 65.14 3iqh h PRO 150 Cb 0.03 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 31.12 3iqh h PRO 150 CO 0.01 0.09 0.43 0.37 -0.23 0.00 0.00 178.00 178.67 3iqh h GLN 151 N 0.00 0.86 -0.16 0.86 5.75 -1.26 -0.71 115.11 120.44 3iqh h GLN 151 Ca -0.00 -0.05 -0.05 0.00 -0.15 0.00 0.00 58.65 58.40 3iqh h GLN 151 Cb 0.20 -0.19 -0.01 0.00 1.07 0.00 0.00 27.48 28.54 3iqh h GLN 151 CO 0.01 0.57 -0.12 0.97 -2.65 0.00 0.00 178.83 177.60 3iqh h ILE 152 N 0.88 1.18 -0.32 2.39 6.09 -1.25 -0.37 117.51 126.11 3iqh h ILE 152 Ca 0.24 -0.78 -0.13 0.00 -1.37 0.00 0.00 64.86 62.82 3iqh h ILE 152 Cb -0.09 1.20 -0.01 0.00 0.47 0.00 0.00 36.82 38.39 3iqh h ILE 152 CO -0.06 0.24 -0.34 0.45 -3.07 0.00 0.00 178.15 175.38 3iqh h HIS 153 N 0.24 0.85 -0.45 2.19 3.86 -1.44 -0.91 115.15 119.50 3iqh h HIS 153 Ca 0.05 -0.23 -0.03 0.00 -1.16 0.00 0.00 60.37 58.99 3iqh h HIS 153 Cb 0.37 -0.19 -0.02 0.00 1.06 0.00 0.00 27.41 28.63 3iqh h HIS 153 CO 0.01 0.97 0.13 -0.09 0.86 0.00 0.00 177.93 179.80 3iqh h ARG 154 N 0.61 0.66 0.00 2.45 2.43 -0.55 0.14 114.38 120.11 3iqh h ARG 154 Ca 0.06 -0.11 -0.12 0.00 -0.81 0.00 0.00 59.98 59.01 3iqh h ARG 154 Cb 0.87 -0.11 -0.02 0.00 -0.42 0.00 0.00 29.97 30.29 3iqh h ARG 154 CO 0.08 0.58 -1.15 0.93 -1.51 0.00 0.00 179.97 178.89 3iqh h GLU 155 N 0.64 0.00 0.00 0.20 5.08 -0.91 -3.39 114.58 116.20 3iqh h GLU 155 Ca 0.15 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.51 3iqh h GLU 155 Cb 0.21 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.46 3iqh h GLU 155 CO -0.01 0.25 0.00 0.25 -1.00 0.00 0.00 179.01 178.50 3iqh n THR 156 N -2.90 0.47 0.03 1.13 -2.24 -0.36 -4.68 114.28 105.73 3iqh n THR 156 Ca -0.06 0.16 -0.11 0.00 -2.27 0.00 0.00 64.05 61.77 3iqh n THR 156 Cb 0.75 -0.99 -0.06 0.00 -2.10 0.00 0.00 70.33 67.93 3iqh n THR 156 CO 0.00 0.00 0.00 0.74 -0.57 0.00 0.00 175.07 175.24 3iqh h THR 157 N 0.00 0.89 0.55 4.28 2.02 -1.57 -1.00 112.91 118.09 3iqh h THR 157 Ca 0.00 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.16 3iqh h THR 157 Cb 0.00 0.89 -0.01 0.00 -1.74 0.00 0.00 68.15 67.29 3iqh h THR 157 CO 0.00 0.00 -0.39 1.23 0.37 0.00 0.00 175.52 176.73 3iqh h GLY 158 N -0.06 -1.02 0.29 2.16 0.00 -0.99 -2.31 103.07 101.16 3iqh h GLY 158 Ca 0.03 0.44 0.15 0.00 0.00 0.00 0.00 47.33 47.94 3iqh h GLY 158 CO -0.06 -0.35 0.54 -2.55 0.00 0.00 0.00 176.54 174.12 3iqh h PRO 159 N -0.92 0.76 -0.49 4.80 0.11 -1.73 -1.10 132.00 133.43 3iqh h PRO 159 Ca -0.06 -0.05 0.04 0.00 0.11 0.00 0.00 66.00 66.04 3iqh h PRO 159 Cb 0.76 -0.17 -0.04 0.00 0.11 0.00 0.00 31.00 31.66 3iqh h PRO 159 CO 0.03 0.50 0.24 0.93 -0.21 0.00 0.00 178.00 179.49 3iqh h GLU 160 N 0.78 0.46 -0.07 1.05 5.08 -1.10 0.90 114.58 121.68 3iqh h GLU 160 Ca 0.50 -0.03 0.03 0.00 -1.00 0.00 0.00 59.36 58.85 3iqh h GLU 160 Cb 0.65 -0.10 -0.03 0.00 0.50 0.00 0.00 28.75 29.76 3iqh h GLU 160 CO -0.33 0.31 -0.08 0.82 -1.00 0.00 0.00 179.01 178.72 3iqh h ILE 161 N 0.48 0.77 -0.34 3.13 2.04 -0.89 -1.14 117.51 121.54 3iqh h ILE 161 Ca 0.22 0.00 0.07 0.00 1.00 0.00 0.00 64.86 66.14 3iqh h ILE 161 Cb 0.13 0.77 -0.06 0.00 -0.74 0.00 0.00 36.82 36.92 3iqh h ILE 161 CO -0.16 0.00 -0.04 -0.25 0.00 0.00 0.00 178.15 177.70 3iqh h TRP 162 N -0.11 -0.10 -0.21 1.37 2.91 -0.88 -1.99 115.95 116.93 3iqh h TRP 162 Ca 0.06 0.03 -0.05 0.00 1.13 0.00 0.00 58.89 60.06 3iqh h TRP 162 Cb 0.19 0.10 -0.01 0.00 -0.51 0.00 0.00 29.16 28.93 3iqh h TRP 162 CO -0.18 -0.11 -0.05 0.87 -1.03 0.00 0.00 178.44 177.94 3iqh h LYS 163 N 0.05 0.41 0.00 2.65 1.57 -0.74 0.12 116.57 120.63 3iqh h LYS 163 Ca 0.17 -0.16 -0.01 0.00 -1.87 0.00 0.00 60.65 58.78 3iqh h LYS 163 Cb 0.24 -0.02 -0.00 0.00 0.08 0.00 0.00 32.23 32.53 3iqh h LYS 163 CO -0.32 0.65 -0.04 -0.44 -0.57 0.00 0.00 179.45 178.74 3iqh h ASP 164 N 0.14 0.00 -0.24 0.86 3.32 -1.13 -2.03 116.42 117.34 3iqh h ASP 164 Ca 0.05 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.10 3iqh h ASP 164 Cb 0.50 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.05 3iqh h ASP 164 CO 0.02 0.04 0.00 0.35 -1.72 0.00 0.00 179.24 177.93 3iqh n THR 165 N -3.12 0.30 -3.98 0.35 -2.24 -0.76 -4.96 114.28 99.86 3iqh n THR 165 Ca 0.03 -0.57 -0.31 0.00 -2.27 0.00 0.00 64.05 60.92 3iqh n THR 165 Cb 0.46 0.93 0.01 0.00 -2.10 0.00 0.00 70.33 69.64 3iqh n THR 165 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 3iqh n ASP 166 N 1.13 -4.18 -0.24 3.42 8.00 -0.76 -1.28 116.55 122.64 3iqh n ASP 166 Ca 0.18 -0.84 -0.03 0.00 0.71 0.00 0.00 54.79 54.80 3iqh n ASP 166 Cb 0.53 -3.59 -0.01 0.00 -0.02 0.00 0.00 41.12 38.02 3iqh n ASP 166 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3iqh n GLY 167 N -1.63 0.48 0.02 0.44 0.00 0.34 -4.90 105.19 99.94 3iqh n GLY 167 Ca 0.03 -0.10 0.12 0.00 0.00 0.00 0.00 46.02 46.06 3iqh n GLY 167 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3iqh n LYS 168 N -1.06 0.08 -1.62 1.61 5.02 -0.40 -4.90 118.16 116.88 3iqh n LYS 168 Ca -0.03 0.02 -0.55 0.00 -2.02 0.00 0.00 58.31 55.73 3iqh n LYS 168 Cb 0.33 -1.55 -0.07 0.00 -0.02 0.00 0.00 35.03 33.73 3iqh n LYS 168 CO 0.00 0.00 0.00 1.55 -0.52 0.00 0.00 177.40 178.43 3iqh n VAL 169 N -1.66 0.09 -0.05 -0.18 3.14 -1.26 -4.38 118.33 114.03 3iqh n VAL 169 Ca 0.05 -0.02 -0.04 0.00 -2.96 0.00 0.00 64.34 61.37 3iqh n VAL 169 Cb 0.36 -0.83 -0.09 0.00 -1.06 0.00 0.00 33.84 32.22 3iqh n VAL 169 CO 0.00 0.00 0.00 0.47 -6.46 0.00 0.00 176.83 170.84 3iqh n ASP 170 N 3.32 2.31 -3.84 6.55 8.00 -0.03 -4.89 116.55 127.96 3iqh n ASP 170 Ca 0.22 0.00 -0.14 0.00 0.71 0.00 0.00 54.79 55.58 3iqh n ASP 170 Cb 0.15 0.85 -0.15 0.00 -0.02 0.00 0.00 41.12 41.95 3iqh n ASP 170 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 3iqh s VAL 171 N -2.32 0.04 -0.12 2.53 1.01 -0.76 -0.95 120.40 119.83 3iqh s VAL 171 Ca -0.05 0.06 0.01 0.00 0.00 0.00 0.00 61.98 62.00 3iqh s VAL 171 Cb 0.04 -0.10 -0.01 0.00 0.00 0.00 0.00 36.38 36.31 3iqh s VAL 171 CO 0.45 0.06 -0.16 -0.69 0.00 0.00 0.00 175.10 174.76 3iqh s VAL 172 N 0.46 2.78 -0.17 2.92 1.01 -0.43 -0.83 120.40 126.14 3iqh s VAL 172 Ca -0.04 -0.76 0.01 0.00 0.00 0.00 0.00 61.98 61.19 3iqh s VAL 172 Cb -0.06 -2.14 0.01 0.00 0.00 0.00 0.00 36.38 34.19 3iqh s VAL 172 CO -0.01 0.54 -0.18 -0.69 0.00 0.00 0.00 175.10 174.75 3iqh s VAL 173 N 0.30 2.27 -0.10 2.92 1.01 0.36 -0.69 120.40 126.47 3iqh s VAL 173 Ca -0.12 -0.89 -0.04 0.00 0.00 0.00 0.00 61.98 60.93 3iqh s VAL 173 Cb -0.16 -1.95 0.05 0.00 0.00 0.00 0.00 36.38 34.32 3iqh s VAL 173 CO 0.06 0.53 0.22 0.00 0.00 0.00 0.00 175.10 175.91 3iqh s ALA 174 N 1.09 -0.46 0.59 5.51 0.00 -0.73 -1.57 121.76 126.19 3iqh s ALA 174 Ca -0.00 0.88 -0.20 0.00 0.00 0.00 0.00 51.96 52.64 3iqh s ALA 174 Cb -0.14 -0.66 -0.03 0.00 0.00 0.00 0.00 23.12 22.29 3iqh s ALA 174 CO -0.07 -0.27 1.30 0.20 0.00 0.00 0.00 175.76 176.92 3iqh s GLY 175 N 1.47 2.85 -0.26 0.00 0.00 -1.26 -1.37 107.32 108.75 3iqh s GLY 175 Ca -0.07 1.22 -0.05 0.00 0.00 0.00 0.00 44.72 45.82 3iqh s GLY 175 CO -0.08 1.68 0.02 0.14 0.00 0.00 0.00 173.10 174.86 3iqh s VAL 176 N -1.40 3.62 0.00 1.40 1.01 -0.59 -4.79 120.40 119.66 3iqh s VAL 176 Ca 0.76 -0.68 0.00 0.00 0.00 0.00 0.00 61.98 62.07 3iqh s VAL 176 Cb -0.37 -2.80 0.00 0.00 0.00 0.00 0.00 36.38 33.21 3iqh s VAL 176 CO 0.41 0.20 0.00 0.61 0.00 0.00 0.00 175.10 176.33 3iqh n GLY 177 N 4.81 -0.18 0.13 4.51 0.00 -1.25 -2.71 105.19 110.50 3iqh n GLY 177 Ca -0.16 0.00 0.13 0.00 0.00 0.00 0.00 46.02 45.99 3iqh n GLY 177 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 3iqh h THR 178 N 0.00 0.00 0.00 2.61 1.35 -1.91 -3.43 112.91 111.53 3iqh h THR 178 Ca 0.00 -0.61 0.00 0.00 -0.55 0.00 0.00 66.41 65.25 3iqh h THR 178 Cb 0.00 1.55 0.00 0.00 -1.73 0.00 0.00 68.15 67.97 3iqh h THR 178 CO 0.00 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.88 3iqh n GLY 179 N 1.26 2.99 0.30 5.82 0.00 -1.26 -3.12 105.19 111.19 3iqh n GLY 179 Ca 0.05 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.10 3iqh n GLY 179 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 3iqh h GLY 180 N 0.00 1.29 0.87 -0.02 0.00 -1.89 -1.53 103.07 101.79 3iqh h GLY 180 Ca 0.00 -0.30 -0.03 0.00 0.00 0.00 0.00 47.33 47.00 3iqh h GLY 180 CO 0.00 0.10 -0.30 1.76 0.00 0.00 0.00 176.54 178.09 3iqh h SER 181 N 0.75 -0.72 -0.80 0.19 0.02 -1.89 -0.19 113.55 110.92 3iqh h SER 181 Ca 0.41 -0.01 -0.03 0.00 -0.84 0.00 0.00 61.79 61.31 3iqh h SER 181 Cb 0.42 0.19 -0.04 0.00 0.14 0.00 0.00 62.40 63.10 3iqh h SER 181 CO -0.27 -0.42 0.39 -0.29 -1.14 0.00 0.00 176.83 175.10 3iqh h ILE 182 N -0.99 1.25 0.67 3.27 2.10 -1.86 -0.74 117.51 121.22 3iqh h ILE 182 Ca -0.09 -0.69 -0.03 0.00 1.08 0.00 0.00 64.86 65.13 3iqh h ILE 182 Cb 0.69 0.23 0.00 0.00 -1.09 0.00 0.00 36.82 36.65 3iqh h ILE 182 CO 0.14 0.30 -0.35 0.74 -1.08 0.00 0.00 178.15 177.90 3iqh h THR 183 N 1.13 0.29 -0.22 2.19 2.02 -1.23 -1.07 112.91 116.02 3iqh h THR 183 Ca 0.28 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.44 3iqh h THR 183 Cb 0.11 0.29 -0.01 0.00 -1.74 0.00 0.00 68.15 66.80 3iqh h THR 183 CO -0.04 0.00 0.09 1.23 0.37 0.00 0.00 175.52 177.17 3iqh h GLY 184 N -0.94 0.36 0.88 2.16 0.00 -0.94 -0.87 103.07 103.73 3iqh h GLY 184 Ca -0.09 -0.20 0.02 0.00 0.00 0.00 0.00 47.33 47.07 3iqh h GLY 184 CO 0.14 0.19 0.36 -2.22 0.00 0.00 0.00 176.54 175.00 3iqh h ILE 185 N 0.21 1.07 -0.41 2.60 2.04 -1.17 -1.51 117.51 120.35 3iqh h ILE 185 Ca 0.07 -0.24 -0.12 0.00 1.00 0.00 0.00 64.86 65.57 3iqh h ILE 185 Cb 0.18 0.30 -0.01 0.00 -0.74 0.00 0.00 36.82 36.55 3iqh h ILE 185 CO -0.01 0.13 -0.21 0.28 0.00 0.00 0.00 178.15 178.34 3iqh h SER 186 N 0.71 0.90 -0.47 1.72 0.02 -1.04 -1.28 113.55 114.10 3iqh h SER 186 Ca 0.23 -0.41 -0.00 0.00 -0.84 0.00 0.00 61.79 60.77 3iqh h SER 186 Cb 0.01 -0.25 -0.02 0.00 0.14 0.00 0.00 62.40 62.28 3iqh h SER 186 CO -0.10 1.11 0.28 0.03 -1.14 0.00 0.00 176.83 177.02 3iqh h ARG 187 N 0.68 0.64 0.17 3.45 3.08 -0.99 -0.23 114.38 121.19 3iqh h ARG 187 Ca 0.09 -0.06 0.01 0.00 0.07 0.00 0.00 59.98 60.09 3iqh h ARG 187 Cb 0.78 -0.13 -0.04 0.00 0.08 0.00 0.00 29.97 30.65 3iqh h ARG 187 CO 0.06 0.48 -0.48 0.00 -1.07 0.00 0.00 179.97 178.96 3iqh h ALA 188 N 1.13 -0.91 -0.13 0.04 0.00 -1.01 0.72 119.26 119.09 3iqh h ALA 188 Ca 0.17 -0.11 -0.05 0.00 0.00 0.00 0.00 54.91 54.92 3iqh h ALA 188 Cb -0.00 0.80 -0.00 0.00 0.00 0.00 0.00 17.79 18.58 3iqh h ALA 188 CO -0.03 -1.08 -0.12 0.82 0.00 0.00 0.00 179.25 178.84 3iqh h ILE 189 N -0.75 1.35 0.03 0.00 2.04 -1.13 0.96 117.51 120.01 3iqh h ILE 189 Ca -0.00 -1.27 -0.26 0.00 1.00 0.00 0.00 64.86 64.33 3iqh h ILE 189 Cb 0.75 1.90 0.01 0.00 -0.74 0.00 0.00 36.82 38.74 3iqh h ILE 189 CO -0.24 0.37 -1.05 0.11 0.00 0.00 0.00 178.15 177.34 3iqh h LYS 190 N -0.07 0.54 0.00 2.37 1.57 -1.11 0.28 116.57 120.15 3iqh h LYS 190 Ca 0.02 -0.62 -0.46 0.00 -1.87 0.00 0.00 60.65 57.72 3iqh h LYS 190 Cb 0.64 0.19 -0.07 0.00 0.08 0.00 0.00 32.23 33.07 3iqh h LYS 190 CO 0.03 1.24 -2.52 1.28 -0.57 0.00 0.00 179.45 178.91 3iqh n LEU 191 N -3.78 1.93 0.07 2.94 4.77 0.20 -3.06 117.00 120.07 3iqh n LEU 191 Ca -0.10 0.33 -0.17 0.00 -0.03 0.00 0.00 56.01 56.04 3iqh n LEU 191 Cb 0.89 -0.80 -0.08 0.00 -2.33 0.00 0.00 43.42 41.09 3iqh n LEU 191 CO 0.54 0.57 0.08 0.44 -1.33 0.00 0.00 177.39 177.70 3iqh h ASP 192 N -0.97 0.68 -0.01 -1.43 3.32 -0.59 -3.32 116.42 114.11 3iqh h ASP 192 Ca -0.69 -0.58 0.00 0.00 0.02 0.00 0.00 57.03 55.78 3iqh h ASP 192 Cb 1.61 -0.21 0.00 0.00 0.22 0.00 0.00 39.33 40.95 3iqh h ASP 192 CO -0.42 1.39 -0.52 0.49 -1.72 0.00 0.00 179.24 178.46 3iqh n PHE 193 N -3.76 0.00 -1.38 4.55 3.72 0.15 -5.00 117.46 115.75 3iqh n PHE 193 Ca -0.09 0.00 -0.10 0.00 -0.05 0.00 0.00 57.45 57.21 3iqh n PHE 193 Cb 0.90 0.00 -0.04 0.00 -0.94 0.00 0.00 39.48 39.40 3iqh n PHE 193 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3iqh n GLY 194 N 1.32 1.03 3.69 1.37 0.00 -0.53 -4.95 105.19 107.12 3iqh n GLY 194 Ca 0.07 -0.57 -0.35 0.00 0.00 0.00 0.00 46.02 45.17 3iqh n GLY 194 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3iqh s LYS 195 N -3.01 4.11 -1.43 1.61 2.20 -0.03 -4.95 119.74 118.24 3iqh s LYS 195 Ca 0.00 -0.27 -0.13 0.00 -0.36 0.00 0.00 55.97 55.22 3iqh s LYS 195 Cb 0.00 -3.36 0.06 0.00 -1.51 0.00 0.00 37.83 33.02 3iqh s LYS 195 CO 0.00 0.27 2.21 0.94 -0.36 0.00 0.00 175.35 178.41 3iqh n GLN 196 N 3.59 3.08 -1.94 4.03 -0.06 -1.26 -3.75 117.38 121.06 3iqh n GLN 196 Ca -0.16 -2.76 -0.29 0.00 -2.00 0.00 0.00 57.00 51.79 3iqh n GLN 196 Cb 0.52 -3.18 0.11 0.00 -4.06 0.00 0.00 30.24 23.63 3iqh n GLN 196 CO 0.00 0.00 0.00 0.96 -0.20 0.00 0.00 177.06 177.82 3iqh s ILE 197 N 2.54 2.03 -0.37 1.69 -4.36 -1.26 -5.06 121.20 116.40 3iqh s ILE 197 Ca 0.47 -0.03 -0.15 0.00 -0.26 0.00 0.00 60.65 60.68 3iqh s ILE 197 Cb 0.14 -2.99 -0.00 0.00 1.25 0.00 0.00 42.46 40.85 3iqh s ILE 197 CO -0.07 0.00 0.32 -0.89 0.24 0.00 0.00 174.94 174.54 3iqh s THR 198 N -3.62 5.22 -0.25 8.37 2.01 -0.13 -4.99 115.64 122.25 3iqh s THR 198 Ca 0.65 -0.28 -0.19 0.00 0.31 0.00 0.00 61.69 62.18 3iqh s THR 198 Cb -0.09 -3.84 -0.02 0.00 0.01 0.00 0.00 72.50 68.55 3iqh s THR 198 CO 0.50 -0.17 0.57 -0.44 -0.69 0.00 0.00 174.62 174.39 3iqh s SER 199 N 1.73 6.52 -0.26 3.53 0.01 -1.26 -1.32 113.70 122.64 3iqh s SER 199 Ca 0.08 0.63 -0.02 0.00 1.31 0.00 0.00 55.95 57.96 3iqh s SER 199 Cb -0.18 -2.31 0.03 0.00 0.21 0.00 0.00 66.02 63.78 3iqh s SER 199 CO 0.11 -0.31 -0.04 -0.69 0.41 0.00 0.00 173.24 172.72 3iqh s VAL 200 N 2.31 2.93 0.19 3.43 1.01 0.14 -0.99 120.40 129.41 3iqh s VAL 200 Ca 0.24 -1.12 -0.24 0.00 0.00 0.00 0.00 61.98 60.86 3iqh s VAL 200 Cb -0.16 -2.55 -0.08 0.00 0.00 0.00 0.00 36.38 33.60 3iqh s VAL 200 CO 0.09 0.11 0.77 0.00 0.00 0.00 0.00 175.10 176.07 3iqh s ALA 201 N 1.31 3.43 -0.06 5.51 0.00 -0.12 -1.77 121.76 130.05 3iqh s ALA 201 Ca -0.01 0.32 0.05 0.00 0.00 0.00 0.00 51.96 52.32 3iqh s ALA 201 Cb -0.18 -2.94 -0.01 0.00 0.00 0.00 0.00 23.12 20.00 3iqh s ALA 201 CO -0.03 0.29 -0.23 0.08 0.00 0.00 0.00 175.76 175.87 3iqh s VAL 202 N -1.27 2.21 0.07 0.00 1.01 -0.47 -0.70 120.40 121.25 3iqh s VAL 202 Ca 0.38 -1.01 -0.03 0.00 0.00 0.00 0.00 61.98 61.32 3iqh s VAL 202 Cb -0.21 -1.82 -0.03 0.00 0.00 0.00 0.00 36.38 34.32 3iqh s VAL 202 CO 0.25 0.57 0.04 -1.83 0.00 0.00 0.00 175.10 174.13 3iqh s GLU 203 N -0.15 0.70 0.23 2.72 -1.05 -0.85 -1.54 118.70 118.77 3iqh s GLU 203 Ca -0.04 -1.16 -0.30 0.00 -0.15 0.00 0.00 54.97 53.33 3iqh s GLU 203 Cb -0.14 0.25 -0.09 0.00 -0.44 0.00 0.00 34.13 33.71 3iqh s GLU 203 CO 0.04 -0.17 1.27 -2.14 0.95 0.00 0.00 175.26 175.21 3iqh s PRO 204 N -3.91 4.42 0.56 -4.83 0.02 -1.26 -1.85 135.00 128.15 3iqh s PRO 204 Ca 0.07 2.03 0.28 0.00 0.02 0.00 0.00 61.00 63.40 3iqh s PRO 204 Cb 0.07 -3.18 1.47 0.00 0.02 0.00 0.00 34.50 32.88 3iqh s PRO 204 CO -0.09 -0.16 1.97 -0.24 -0.33 0.00 0.00 177.00 178.14 3iqh h VAL 205 N 3.53 0.57 0.00 3.83 3.04 -1.43 -1.28 116.25 124.52 3iqh h VAL 205 Ca -0.46 0.00 -0.03 0.00 -1.01 0.00 0.00 66.70 65.20 3iqh h VAL 205 Cb 1.22 0.69 -0.00 0.00 -2.01 0.00 0.00 31.29 31.18 3iqh h VAL 205 CO 0.73 0.00 -0.15 -0.33 -1.01 0.00 0.00 177.57 176.81 3iqh h GLU 206 N 0.00 0.00 -1.77 4.17 3.07 -1.88 -3.34 114.58 114.83 3iqh h GLU 206 Ca 0.25 0.00 -0.50 0.00 -0.50 0.00 0.00 59.36 58.60 3iqh h GLU 206 Cb 1.09 0.00 -0.36 0.00 -0.84 0.00 0.00 28.75 28.64 3iqh h GLU 206 CO -0.00 0.15 -1.06 0.45 -1.40 0.00 0.00 179.01 177.16 3iqh n SER 207 N -3.27 -0.02 -3.41 1.42 2.88 -0.51 -2.88 113.62 107.84 3iqh n SER 207 Ca 0.01 -2.85 -0.39 0.00 -1.33 0.00 0.00 58.87 54.31 3iqh n SER 207 Cb 0.42 -0.34 -0.00 0.00 -0.75 0.00 0.00 64.21 63.53 3iqh n SER 207 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 3iqh n PRO 208 N 1.13 4.51 0.15 -1.46 -0.04 -1.07 -4.42 135.00 133.81 3iqh n PRO 208 Ca 0.20 -3.55 0.01 0.00 -0.04 0.00 0.00 63.50 60.13 3iqh n PRO 208 Cb 0.57 -2.56 0.21 0.00 -0.04 0.00 0.00 33.50 31.69 3iqh n PRO 208 CO 0.00 0.00 0.00 -0.39 -0.04 0.00 0.00 175.50 175.07 3iqh h VAL 209 N 2.47 1.21 -0.05 0.52 -1.51 -1.88 -0.72 116.25 116.29 3iqh h VAL 209 Ca 0.65 -1.97 -0.01 0.00 -1.23 0.00 0.00 66.70 64.14 3iqh h VAL 209 Cb 0.34 2.12 -0.00 0.00 -2.13 0.00 0.00 31.29 31.61 3iqh h VAL 209 CO 1.38 0.53 -0.01 0.40 -1.23 0.00 0.00 177.57 178.64 3iqh h ILE 210 N 0.00 1.28 -0.37 7.19 2.04 -1.92 -0.36 117.51 125.38 3iqh h ILE 210 Ca -0.01 -0.88 0.07 0.00 1.00 0.00 0.00 64.86 65.05 3iqh h ILE 210 Cb 1.07 1.77 -0.07 0.00 -0.74 0.00 0.00 36.82 38.86 3iqh h ILE 210 CO 0.07 0.24 -0.06 0.28 0.00 0.00 0.00 178.15 178.68 3iqh h SER 211 N -0.24 -0.27 -0.14 1.72 0.02 -1.89 -0.55 113.55 112.20 3iqh h SER 211 Ca 0.01 0.10 -0.02 0.00 -0.84 0.00 0.00 61.79 61.05 3iqh h SER 211 Cb 0.39 0.20 -0.01 0.00 0.14 0.00 0.00 62.40 63.12 3iqh h SER 211 CO 0.00 -0.09 0.03 1.56 -1.14 0.00 0.00 176.83 177.20 3iqh h GLN 212 N 0.04 0.23 -0.07 3.45 4.20 -1.16 -1.65 115.11 120.14 3iqh h GLN 212 Ca 0.18 -0.06 0.04 0.00 0.06 0.00 0.00 58.65 58.87 3iqh h GLN 212 Cb 0.26 -0.03 -0.06 0.00 0.30 0.00 0.00 27.48 27.96 3iqh h GLN 212 CO -0.35 0.40 -0.37 1.15 -0.67 0.00 0.00 178.83 178.99 3iqh h THR 213 N 0.03 0.22 0.00 -0.54 2.02 -0.90 0.60 112.91 114.33 3iqh h THR 213 Ca 0.04 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.22 3iqh h THR 213 Cb 0.27 0.22 -0.00 0.00 -1.74 0.00 0.00 68.15 66.90 3iqh h THR 213 CO 0.00 0.00 -0.02 -0.07 0.37 0.00 0.00 175.52 175.80 3iqh h LEU 214 N -0.48 0.00 -0.16 2.58 3.38 -1.03 -0.13 115.31 119.47 3iqh h LEU 214 Ca 0.07 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.04 3iqh h LEU 214 Cb 0.60 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.35 3iqh h LEU 214 CO -0.34 0.02 -0.27 0.00 0.09 0.00 0.00 178.44 177.95 3iqh n ALA 215 N -2.11 3.06 -1.93 1.53 0.00 -0.63 -4.93 120.51 115.50 3iqh n ALA 215 Ca -0.00 -0.30 -0.12 0.00 0.00 0.00 0.00 53.44 53.01 3iqh n ALA 215 Cb 0.27 -1.23 -0.02 0.00 0.00 0.00 0.00 19.45 18.47 3iqh n ALA 215 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3iqh n GLY 216 N 1.41 0.37 3.95 0.00 0.00 -0.06 -5.03 105.19 105.83 3iqh n GLY 216 Ca 0.09 -0.39 -0.23 0.00 0.00 0.00 0.00 46.02 45.49 3iqh n GLY 216 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3iqh s GLU 217 N -4.08 3.32 0.24 1.61 2.02 0.11 -5.02 118.70 116.90 3iqh s GLU 217 Ca 0.00 -0.49 -0.31 0.00 0.02 0.00 0.00 54.97 54.19 3iqh s GLU 217 Cb 0.00 -2.67 -0.13 0.00 0.10 0.00 0.00 34.13 31.43 3iqh s GLU 217 CO 0.00 0.04 1.38 -1.91 0.02 0.00 0.00 175.26 174.78 3iqh n GLU 218 N -1.83 1.97 -3.01 1.61 2.13 -1.26 -4.33 120.64 115.92 3iqh n GLU 218 Ca -0.03 0.70 -0.42 0.00 0.66 0.00 0.00 57.16 58.07 3iqh n GLU 218 Cb 0.57 -2.34 -0.06 0.00 0.27 0.00 0.00 31.44 29.88 3iqh n GLU 218 CO 0.00 0.00 0.00 0.08 -0.41 0.00 0.00 177.13 176.80 3iqh s VAL 219 N -0.16 4.80 -0.52 6.31 1.01 -1.26 -4.86 120.40 125.72 3iqh s VAL 219 Ca 0.67 0.85 0.03 0.00 0.00 0.00 0.00 61.98 63.53 3iqh s VAL 219 Cb -0.66 -4.14 0.15 0.00 0.00 0.00 0.00 36.38 31.73 3iqh s VAL 219 CO 0.51 -0.35 0.32 -0.54 0.00 0.00 0.00 175.10 175.04 3iqh s LYS 220 N 2.93 1.67 0.81 2.72 1.02 -1.26 -5.11 119.74 122.51 3iqh s LYS 220 Ca 0.29 -2.48 -0.12 0.00 0.02 0.00 0.00 55.97 53.69 3iqh s LYS 220 Cb -0.14 -2.68 0.08 0.00 -0.52 0.00 0.00 37.83 34.57 3iqh s LYS 220 CO 0.15 -1.21 1.14 -1.25 -0.92 0.00 0.00 175.35 173.26 3iqh s PRO 221 N -0.26 1.80 0.20 -1.68 0.04 -1.26 -4.54 135.00 129.30 3iqh s PRO 221 Ca 0.21 1.48 -0.17 0.00 0.04 0.00 0.00 61.00 62.57 3iqh s PRO 221 Cb -0.16 -1.82 0.02 0.00 0.04 0.00 0.00 34.50 32.58 3iqh s PRO 221 CO -0.07 -2.04 0.51 0.20 0.04 0.00 0.00 177.00 175.65 3iqh s GLY 222 N -2.71 0.01 0.47 0.56 0.00 -1.14 -4.95 107.32 99.57 3iqh s GLY 222 Ca 0.67 -0.34 -0.22 0.00 0.00 0.00 0.00 44.72 44.83 3iqh s GLY 222 CO 0.53 -0.33 1.12 2.56 0.00 0.00 0.00 173.10 176.98 3iqh s PRO 223 N -3.90 3.73 0.29 2.90 0.04 -1.26 -4.31 135.00 132.49 3iqh s PRO 223 Ca 0.11 1.65 -0.18 0.00 0.04 0.00 0.00 61.00 62.62 3iqh s PRO 223 Cb -0.01 -2.30 0.02 0.00 0.04 0.00 0.00 34.50 32.25 3iqh s PRO 223 CO -0.01 -0.55 0.67 -3.38 0.04 0.00 0.00 177.00 173.78 3iqh s HIS 224 N -1.67 -0.02 -0.54 0.56 -3.43 -1.26 -4.80 115.29 104.14 3iqh s HIS 224 Ca 0.65 -0.44 0.10 0.00 -0.80 0.00 0.00 55.06 54.57 3iqh s HIS 224 Cb -0.25 0.60 0.27 0.00 -1.43 0.00 0.00 32.58 31.77 3iqh s HIS 224 CO 0.30 -1.22 1.21 1.63 -2.00 0.00 0.00 174.74 174.66 3iqh n LYS 225 N -0.45 2.81 -2.88 -0.38 5.02 -1.26 -4.86 118.16 116.16 3iqh n LYS 225 Ca -0.04 -2.07 -0.44 0.00 -2.02 0.00 0.00 58.31 53.74 3iqh n LYS 225 Cb 0.60 -1.31 -0.01 0.00 -0.02 0.00 0.00 35.03 34.29 3iqh n LYS 225 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 3iqh s ILE 226 N -1.40 4.81 0.15 -0.18 1.01 -1.26 -4.95 121.20 119.38 3iqh s ILE 226 Ca 0.21 -2.27 -0.34 0.00 0.00 0.00 0.00 60.65 58.25 3iqh s ILE 226 Cb 0.14 -4.93 -0.14 0.00 0.01 0.00 0.00 42.46 37.54 3iqh s ILE 226 CO 0.10 -1.66 1.59 0.00 0.00 0.00 0.00 174.94 174.97 3iqh n GLN 227 N 6.30 2.17 0.00 2.79 6.02 -1.26 -2.53 117.38 130.87 3iqh n GLN 227 Ca 0.36 0.78 0.00 0.00 -0.01 0.00 0.00 57.00 58.13 3iqh n GLN 227 Cb 0.45 -2.56 0.00 0.00 1.02 0.00 0.00 30.24 29.15 3iqh n GLN 227 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3iqh n GLY 228 N 3.47 1.30 3.42 1.08 0.00 -1.26 -4.20 105.19 109.00 3iqh n GLY 228 Ca 0.17 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.91 3iqh n GLY 228 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 3iqh n ILE 229 N -1.67 0.00 -3.16 -0.61 -5.35 -1.05 -3.92 119.36 103.60 3iqh n ILE 229 Ca 0.00 -2.34 -0.14 0.00 -0.27 0.00 0.00 62.75 60.00 3iqh n ILE 229 Cb 0.00 0.65 0.07 0.00 -1.74 0.00 0.00 39.64 38.62 3iqh n ILE 229 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3iqh n GLY 230 N -0.83 -0.95 0.21 3.28 0.00 -1.10 -4.91 105.19 100.90 3iqh n GLY 230 Ca -0.13 0.48 0.15 0.00 0.00 0.00 0.00 46.02 46.51 3iqh n GLY 230 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3iqh h ALA 231 N 0.03 1.00 0.00 4.61 0.00 -1.83 -3.47 119.26 119.60 3iqh h ALA 231 Ca -0.57 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.34 3iqh h ALA 231 Cb 1.29 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.08 3iqh h ALA 231 CO 0.42 0.00 0.00 0.41 0.00 0.00 0.00 179.25 180.08 3iqh n GLY 232 N 0.21 0.72 3.52 0.00 0.00 -1.26 -5.03 105.19 103.34 3iqh n GLY 232 Ca 0.02 -0.07 -0.09 0.00 0.00 0.00 0.00 46.02 45.87 3iqh n GLY 232 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 3iqh s PHE 233 N -2.00 0.29 -0.48 1.61 -0.12 -1.26 -4.68 117.98 111.33 3iqh s PHE 233 Ca 0.00 -0.65 -0.23 0.00 -0.05 0.00 0.00 56.93 56.01 3iqh s PHE 233 Cb 0.00 0.17 0.03 0.00 -0.63 0.00 0.00 43.02 42.59 3iqh s PHE 233 CO 0.00 -0.92 0.80 0.42 -0.05 0.00 0.00 175.22 175.47 3iqh s ILE 234 N -3.98 4.62 0.54 -4.49 -1.09 -1.26 -4.93 121.20 110.61 3iqh s ILE 234 Ca 0.19 0.25 -0.17 0.00 -2.23 0.00 0.00 60.65 58.68 3iqh s ILE 234 Cb 0.00 -4.37 -0.06 0.00 -1.58 0.00 0.00 42.46 36.45 3iqh s ILE 234 CO 0.05 -0.83 1.03 -2.16 -1.23 0.00 0.00 174.94 171.80 3iqh s PRO 235 N 3.36 3.64 0.44 2.79 0.04 -1.26 -4.93 135.00 139.07 3iqh s PRO 235 Ca 0.28 1.17 0.15 0.00 0.04 0.00 0.00 61.00 62.64 3iqh s PRO 235 Cb -0.13 -2.08 1.07 0.00 0.04 0.00 0.00 34.50 33.39 3iqh s PRO 235 CO 0.20 -0.54 1.96 0.87 0.04 0.00 0.00 177.00 179.53 3iqh h LYS 236 N 0.90 0.36 -0.14 4.56 1.57 -1.82 -1.37 116.57 120.63 3iqh h LYS 236 Ca -0.48 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.28 3iqh h LYS 236 Cb 1.21 -0.08 0.00 0.00 0.08 0.00 0.00 32.23 33.44 3iqh h LYS 236 CO 0.59 0.24 0.00 0.09 -0.57 0.00 0.00 179.45 179.80 3iqh n ASN 237 N -4.46 0.78 -4.48 0.86 3.02 -0.37 -4.60 115.26 106.00 3iqh n ASN 237 Ca 0.11 -1.94 -0.43 0.00 -0.03 0.00 0.00 54.58 52.29 3iqh n ASN 237 Cb 0.44 -0.09 -0.08 0.00 -0.61 0.00 0.00 39.78 39.43 3iqh n ASN 237 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 3iqh s LEU 238 N -1.07 4.87 -0.91 3.41 2.96 -0.52 -2.92 118.68 124.50 3iqh s LEU 238 Ca 0.12 -0.70 -0.21 0.00 -0.22 0.00 0.00 54.13 53.12 3iqh s LEU 238 Cb 0.06 -2.43 0.09 0.00 0.50 0.00 0.00 46.19 44.42 3iqh s LEU 238 CO 0.09 -0.65 1.22 -0.62 -1.32 0.00 0.00 176.35 175.07 3iqh s ASP 239 N 1.98 6.50 0.53 3.68 -1.08 -1.26 -4.87 116.67 122.14 3iqh s ASP 239 Ca 0.13 -1.61 0.20 0.00 -0.52 0.00 0.00 52.55 50.76 3iqh s ASP 239 Cb -0.17 -2.47 1.35 0.00 -1.46 0.00 0.00 42.92 40.17 3iqh s ASP 239 CO 0.14 -1.31 2.10 -0.07 0.52 0.00 0.00 175.17 176.54 3iqh h LEU 240 N 11.50 0.00 -2.08 -1.34 3.38 -1.95 -2.27 115.31 122.54 3iqh h LEU 240 Ca 0.09 0.00 0.10 0.00 0.09 0.00 0.00 57.88 58.15 3iqh h LEU 240 Cb 1.03 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.76 3iqh h LEU 240 CO 1.24 0.00 0.29 0.28 0.09 0.00 0.00 178.44 180.33 3iqh h SER 241 N 0.00 0.00 -0.17 -0.43 0.02 -2.05 -2.46 113.55 108.46 3iqh h SER 241 Ca 0.09 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.04 3iqh h SER 241 Cb 0.38 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.92 3iqh h SER 241 CO -0.00 0.00 0.00 2.30 -1.14 0.00 0.00 176.83 177.99 3iqh n ILE 242 N -4.11 0.22 -2.98 3.27 -6.64 -0.86 -4.93 119.36 103.34 3iqh n ILE 242 Ca 0.05 -0.61 -0.41 0.00 -1.77 0.00 0.00 62.75 60.01 3iqh n ILE 242 Cb 0.45 1.24 -0.05 0.00 -1.44 0.00 0.00 39.64 39.84 3iqh n ILE 242 CO 0.00 0.00 0.00 -0.63 -1.77 0.00 0.00 176.55 174.15 3iqh s ILE 243 N -1.62 4.93 -0.10 7.28 -1.09 -0.93 -4.56 121.20 125.12 3iqh s ILE 243 Ca 0.30 1.44 0.13 0.00 -2.23 0.00 0.00 60.65 60.28 3iqh s ILE 243 Cb 0.19 -4.05 -0.24 0.00 -1.58 0.00 0.00 42.46 36.78 3iqh s ILE 243 CO 0.28 0.05 0.45 0.47 -1.23 0.00 0.00 174.94 174.96 3iqh n ASP 244 N 5.25 0.71 -3.76 3.58 8.00 -0.16 -4.99 116.55 125.18 3iqh n ASP 244 Ca 0.02 0.27 -0.13 0.00 0.71 0.00 0.00 54.79 55.66 3iqh n ASP 244 Cb 0.49 0.20 -0.10 0.00 -0.02 0.00 0.00 41.12 41.69 3iqh n ASP 244 CO 0.00 0.00 0.00 -0.60 -0.39 0.00 0.00 177.20 176.21 3iqh s ARG 245 N -2.56 0.50 -0.13 -1.24 3.52 -0.97 -5.01 118.95 113.06 3iqh s ARG 245 Ca -0.08 0.22 0.02 0.00 -0.13 0.00 0.00 55.73 55.76 3iqh s ARG 245 Cb 0.07 0.23 0.02 0.00 -1.56 0.00 0.00 34.95 33.71 3iqh s ARG 245 CO 0.82 -0.10 -0.17 0.08 -0.81 0.00 0.00 175.30 175.12 3iqh s VAL 246 N -0.39 1.71 -0.11 7.11 1.01 -1.26 -0.94 120.40 127.53 3iqh s VAL 246 Ca -0.05 -0.76 -0.02 0.00 0.00 0.00 0.00 61.98 61.16 3iqh s VAL 246 Cb -0.03 -1.56 -0.03 0.00 0.00 0.00 0.00 36.38 34.76 3iqh s VAL 246 CO 0.02 0.48 -0.04 -1.61 0.00 0.00 0.00 175.10 173.96 3iqh s GLU 247 N 1.08 3.18 -0.03 2.72 0.41 0.12 -4.97 118.70 121.21 3iqh s GLU 247 Ca -0.03 -0.49 -0.03 0.00 -0.41 0.00 0.00 54.97 54.01 3iqh s GLU 247 Cb -0.14 -2.78 -0.04 0.00 -1.78 0.00 0.00 34.13 29.39 3iqh s GLU 247 CO -0.05 0.51 0.14 0.95 -0.49 0.00 0.00 175.26 176.33 3iqh s THR 248 N -0.38 5.22 0.01 3.63 -4.23 -1.26 -2.01 115.64 116.63 3iqh s THR 248 Ca 0.06 -0.17 0.02 0.00 -1.18 0.00 0.00 61.69 60.42 3iqh s THR 248 Cb -0.12 -3.39 -0.01 0.00 1.34 0.00 0.00 72.50 70.32 3iqh s THR 248 CO 0.02 0.39 -0.05 -0.69 -0.54 0.00 0.00 174.62 173.75 3iqh s VAL 249 N -1.23 0.40 0.42 2.29 1.01 -0.77 -4.80 120.40 117.72 3iqh s VAL 249 Ca 0.24 -0.41 -0.05 0.00 0.00 0.00 0.00 61.98 61.76 3iqh s VAL 249 Cb -0.12 -0.37 -0.04 0.00 0.00 0.00 0.00 36.38 35.84 3iqh s VAL 249 CO 0.15 -0.02 0.72 1.51 0.00 0.00 0.00 175.10 177.45 3iqh s ASP 250 N -0.46 6.34 0.17 3.32 -4.77 -1.26 -1.10 116.67 118.90 3iqh s ASP 250 Ca -0.01 0.86 -0.12 0.00 -3.30 0.00 0.00 52.55 49.98 3iqh s ASP 250 Cb -0.04 -2.21 0.08 0.00 -1.09 0.00 0.00 42.92 39.66 3iqh s ASP 250 CO -0.00 -0.45 1.75 0.28 0.70 0.00 0.00 175.17 177.45 3iqh h SER 251 N 0.67 0.80 -0.16 2.11 0.02 -1.99 -1.30 113.55 113.70 3iqh h SER 251 Ca -0.47 -0.14 0.01 0.00 -0.84 0.00 0.00 61.79 60.34 3iqh h SER 251 Cb 1.20 -0.21 -0.01 0.00 0.14 0.00 0.00 62.40 63.52 3iqh h SER 251 CO 0.63 0.72 0.07 0.44 -1.14 0.00 0.00 176.83 177.54 3iqh h ASP 252 N 0.82 0.10 -0.71 3.07 3.32 -1.99 -1.07 116.42 119.96 3iqh h ASP 252 Ca 0.20 0.01 -0.03 0.00 0.02 0.00 0.00 57.03 57.24 3iqh h ASP 252 Cb 0.14 -0.01 -0.03 0.00 0.22 0.00 0.00 39.33 39.65 3iqh h ASP 252 CO -0.02 0.08 0.34 0.74 -1.72 0.00 0.00 179.24 178.66 3iqh h THR 253 N 0.16 1.23 -0.36 0.35 2.02 -1.93 0.30 112.91 114.69 3iqh h THR 253 Ca 0.06 -0.66 0.06 0.00 0.77 0.00 0.00 66.41 66.65 3iqh h THR 253 Cb 0.02 0.35 -0.06 0.00 -1.74 0.00 0.00 68.15 66.73 3iqh h THR 253 CO -0.05 0.28 0.01 0.00 0.37 0.00 0.00 175.52 176.13 3iqh h ALA 254 N 1.17 0.33 -0.23 6.16 0.00 -0.97 0.06 119.26 125.78 3iqh h ALA 254 Ca 0.25 0.10 -0.02 0.00 0.00 0.00 0.00 54.91 55.23 3iqh h ALA 254 Cb 0.12 0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 3iqh h ALA 254 CO -0.03 -0.39 0.07 -0.07 0.00 0.00 0.00 179.25 178.83 3iqh h LEU 255 N 0.11 0.34 -1.10 0.00 3.38 -0.90 -1.28 115.31 115.86 3iqh h LEU 255 Ca 0.17 -0.21 -0.01 0.00 0.09 0.00 0.00 57.88 57.92 3iqh h LEU 255 Cb 0.23 -0.09 -0.04 0.00 0.09 0.00 0.00 40.66 40.86 3iqh h LEU 255 CO -0.28 0.46 0.41 0.00 0.09 0.00 0.00 178.44 179.12 3iqh h ALA 256 N 0.89 1.31 -0.35 1.53 0.00 -0.78 -1.17 119.26 120.70 3iqh h ALA 256 Ca 0.07 -0.11 -0.12 0.00 0.00 0.00 0.00 54.91 54.75 3iqh h ALA 256 Cb 0.24 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 3iqh h ALA 256 CO -0.00 0.56 -0.24 1.15 0.00 0.00 0.00 179.25 180.72 3iqh h THR 257 N 1.04 1.29 -0.58 0.00 2.02 -0.72 -0.96 112.91 114.99 3iqh h THR 257 Ca 0.26 -1.39 -0.01 0.00 0.77 0.00 0.00 66.41 66.04 3iqh h THR 257 Cb 0.02 1.42 -0.03 0.00 -1.74 0.00 0.00 68.15 67.83 3iqh h THR 257 CO -0.04 0.46 0.31 0.00 0.37 0.00 0.00 175.52 176.62 3iqh h ALA 258 N 0.76 0.74 -0.96 6.16 0.00 -0.83 0.55 119.26 125.68 3iqh h ALA 258 Ca 0.07 -0.10 0.04 0.00 0.00 0.00 0.00 54.91 54.92 3iqh h ALA 258 Cb 0.80 -0.23 -0.06 0.00 0.00 0.00 0.00 17.79 18.31 3iqh h ALA 258 CO 0.07 0.26 0.63 0.00 0.00 0.00 0.00 179.25 180.20 3iqh h ARG 259 N 0.78 1.15 -0.50 0.00 3.08 -1.05 -1.97 114.38 115.86 3iqh h ARG 259 Ca 0.20 -0.07 -0.11 0.00 0.07 0.00 0.00 59.98 60.08 3iqh h ARG 259 Cb 0.05 -0.26 -0.02 0.00 0.08 0.00 0.00 29.97 29.82 3iqh h ARG 259 CO -0.03 0.76 -0.11 0.00 -1.07 0.00 0.00 179.97 179.52 3iqh h ARG 260 N 1.18 0.96 -0.69 0.04 3.08 -0.54 -1.10 114.38 117.31 3iqh h ARG 260 Ca 0.39 -0.36 0.11 0.00 0.07 0.00 0.00 59.98 60.19 3iqh h ARG 260 Cb 0.05 -0.06 -0.08 0.00 0.08 0.00 0.00 29.97 29.96 3iqh h ARG 260 CO -0.13 1.03 0.29 -0.07 -1.07 0.00 0.00 179.97 180.02 3iqh h LEU 261 N 0.82 0.31 0.76 3.04 3.38 -0.56 0.23 115.31 123.28 3iqh h LEU 261 Ca 0.13 0.09 -0.04 0.00 0.09 0.00 0.00 57.88 58.15 3iqh h LEU 261 Cb 0.66 0.05 0.01 0.00 0.09 0.00 0.00 40.66 41.47 3iqh h LEU 261 CO 0.05 0.16 -0.37 0.24 0.09 0.00 0.00 178.44 178.61 3iqh h MET 262 N 0.48 -0.98 -0.04 1.13 2.86 -0.91 -1.41 114.93 116.05 3iqh h MET 262 Ca 0.36 0.07 -0.15 0.00 -2.06 0.00 0.00 59.70 57.92 3iqh h MET 262 Cb 0.47 0.22 -0.01 0.00 0.06 0.00 0.00 31.60 32.34 3iqh h MET 262 CO -0.34 -0.64 -0.65 0.00 1.06 0.00 0.00 176.91 176.35 3iqh h ALA 263 N -1.13 0.85 0.00 6.32 0.00 -1.10 -1.58 119.26 122.62 3iqh h ALA 263 Ca -0.10 -0.58 -0.14 0.00 0.00 0.00 0.00 54.91 54.09 3iqh h ALA 263 Cb 0.80 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.47 3iqh h ALA 263 CO 0.17 0.77 -1.88 0.39 0.00 0.00 0.00 179.25 178.71 3iqh n GLU 264 N -3.82 1.03 -0.00 0.00 1.02 0.78 -4.62 120.64 115.03 3iqh n GLU 264 Ca -0.02 -0.08 0.03 0.00 -0.02 0.00 0.00 57.16 57.07 3iqh n GLU 264 Cb 0.64 -1.38 -0.04 0.00 -0.02 0.00 0.00 31.44 30.64 3iqh n GLU 264 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 3iqh n GLU 265 N -2.30 3.84 -2.44 3.49 -0.58 -0.79 -4.89 120.64 116.97 3iqh n GLU 265 Ca -0.14 -0.01 -0.12 0.00 -0.42 0.00 0.00 57.16 56.47 3iqh n GLU 265 Cb 0.70 -0.87 0.01 0.00 -0.57 0.00 0.00 31.44 30.71 3iqh n GLU 265 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3iqh n GLY 266 N 1.39 -0.05 3.28 0.62 0.00 -0.59 -4.99 105.19 104.85 3iqh n GLY 266 Ca 0.01 -0.34 -0.35 0.00 0.00 0.00 0.00 46.02 45.33 3iqh n GLY 266 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3iqh s ILE 267 N -2.73 3.30 -1.24 -0.61 1.01 -0.62 -4.97 121.20 115.34 3iqh s ILE 267 Ca 0.08 -0.65 -0.17 0.00 0.00 0.00 0.00 60.65 59.91 3iqh s ILE 267 Cb -0.04 -2.56 0.10 0.00 0.01 0.00 0.00 42.46 39.97 3iqh s ILE 267 CO 0.10 0.33 1.60 -0.76 0.00 0.00 0.00 174.94 176.22 3iqh s LEU 268 N 1.44 4.23 0.10 2.97 1.43 -1.26 -2.25 118.68 125.34 3iqh s LEU 268 Ca 0.04 -2.53 -0.06 0.00 -1.03 0.00 0.00 54.13 50.55 3iqh s LEU 268 Cb -0.15 -2.52 -0.05 0.00 0.03 0.00 0.00 46.19 43.50 3iqh s LEU 268 CO -0.03 -1.06 0.37 0.00 0.23 0.00 0.00 176.35 175.85 3iqh s ALA 269 N 3.42 3.78 0.86 4.21 0.00 -1.26 -1.80 121.76 130.98 3iqh s ALA 269 Ca 0.49 -0.51 -0.11 0.00 0.00 0.00 0.00 51.96 51.83 3iqh s ALA 269 Cb 0.01 -2.16 0.16 0.00 0.00 0.00 0.00 23.12 21.13 3iqh s ALA 269 CO 0.04 0.64 1.20 0.20 0.00 0.00 0.00 175.76 177.84 3iqh s GLY 270 N -2.13 1.75 0.10 0.00 0.00 -0.49 -3.74 107.32 102.82 3iqh s GLY 270 Ca 0.37 -1.23 -0.22 0.00 0.00 0.00 0.00 44.72 43.64 3iqh s GLY 270 CO 0.21 -0.57 1.73 -2.22 0.00 0.00 0.00 173.10 172.25 3iqh h ILE 271 N -1.22 0.95 0.00 0.90 2.04 -1.90 -2.01 117.51 116.27 3iqh h ILE 271 Ca -0.43 -0.00 -0.02 0.00 1.00 0.00 0.00 64.86 65.41 3iqh h ILE 271 Cb 1.26 0.94 -0.00 0.00 -0.74 0.00 0.00 36.82 38.27 3iqh h ILE 271 CO 0.44 0.00 -0.08 0.77 0.00 0.00 0.00 178.15 179.28 3iqh h SER 272 N 0.01 0.00 -0.59 1.72 4.64 -1.89 -0.89 113.55 116.55 3iqh h SER 272 Ca 0.03 0.00 -0.10 0.00 -0.47 0.00 0.00 61.79 61.25 3iqh h SER 272 Cb 0.04 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.11 3iqh h SER 272 CO -0.06 0.08 -0.01 0.28 -0.87 0.00 0.00 176.83 176.26 3iqh h SER 273 N 0.00 1.03 -0.80 4.97 0.02 -1.69 -0.88 113.55 116.21 3iqh h SER 273 Ca -0.00 -0.31 -0.04 0.00 -0.84 0.00 0.00 61.79 60.60 3iqh h SER 273 Cb 0.21 -0.28 -0.04 0.00 0.14 0.00 0.00 62.40 62.44 3iqh h SER 273 CO 0.01 1.09 0.35 1.23 -1.14 0.00 0.00 176.83 178.37 3iqh h GLY 274 N 0.95 1.25 0.90 -3.77 0.00 -0.83 -1.51 103.07 100.06 3iqh h GLY 274 Ca 0.17 -0.65 -0.00 0.00 0.00 0.00 0.00 47.33 46.84 3iqh h GLY 274 CO 0.03 0.62 -0.03 0.00 0.00 0.00 0.00 176.54 177.17 3iqh h ALA 275 N 1.18 -0.07 -0.47 3.60 0.00 -1.16 -0.34 119.26 122.01 3iqh h ALA 275 Ca 0.27 -0.06 0.04 0.00 0.00 0.00 0.00 54.91 55.16 3iqh h ALA 275 Cb 0.17 0.03 -0.04 0.00 0.00 0.00 0.00 17.79 17.95 3iqh h ALA 275 CO -0.03 -0.49 0.23 0.00 0.00 0.00 0.00 179.25 178.96 3iqh h ALA 276 N 0.77 0.59 -0.52 0.00 0.00 -1.00 -1.76 119.26 117.34 3iqh h ALA 276 Ca -0.01 0.02 -0.10 0.00 0.00 0.00 0.00 54.91 54.82 3iqh h ALA 276 Cb 0.15 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 17.86 3iqh h ALA 276 CO 0.01 -0.13 -0.07 0.28 0.00 0.00 0.00 179.25 179.34 3iqh h VAL 277 N 0.45 1.26 -0.78 0.00 2.07 -1.23 -0.85 116.25 117.19 3iqh h VAL 277 Ca 0.20 -1.19 -0.01 0.00 0.82 0.00 0.00 66.70 66.53 3iqh h VAL 277 Cb 0.12 0.94 -0.04 0.00 -1.52 0.00 0.00 31.29 30.79 3iqh h VAL 277 CO -0.15 0.42 0.46 0.00 0.02 0.00 0.00 177.57 178.32 3iqh h ALA 278 N 1.06 0.99 -0.31 1.67 0.00 -0.67 0.20 119.26 122.19 3iqh h ALA 278 Ca 0.14 -0.10 -0.03 0.00 0.00 0.00 0.00 54.91 54.93 3iqh h ALA 278 Cb 0.60 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 3iqh h ALA 278 CO 0.04 0.47 0.09 0.00 0.00 0.00 0.00 179.25 179.85 3iqh h ALA 279 N 1.24 0.40 -0.72 0.00 0.00 -1.16 -2.80 119.26 116.22 3iqh h ALA 279 Ca 0.28 -0.16 -0.03 0.00 0.00 0.00 0.00 54.91 55.00 3iqh h ALA 279 Cb -0.02 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.62 3iqh h ALA 279 CO -0.05 0.05 0.34 0.00 0.00 0.00 0.00 179.25 179.59 3iqh h ALA 280 N 0.92 1.24 -0.50 0.00 0.00 -0.78 -2.47 119.26 117.68 3iqh h ALA 280 Ca 0.10 -0.15 -0.08 0.00 0.00 0.00 0.00 54.91 54.78 3iqh h ALA 280 Cb 0.26 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 3iqh h ALA 280 CO -0.00 0.58 -0.02 0.22 0.00 0.00 0.00 179.25 180.03 3iqh h ASP 281 N 1.03 0.82 -0.23 0.00 3.58 -0.58 0.13 116.42 121.16 3iqh h ASP 281 Ca 0.25 -0.21 -0.02 0.00 0.42 0.00 0.00 57.03 57.46 3iqh h ASP 281 Cb 0.12 -0.22 -0.01 0.00 1.72 0.00 0.00 39.33 40.94 3iqh h ASP 281 CO -0.03 0.90 0.05 -0.09 -2.88 0.00 0.00 179.24 177.19 3iqh h ARG 282 N 0.78 0.37 -0.77 0.28 2.43 -1.22 -2.33 114.38 113.93 3iqh h ARG 282 Ca 0.15 -0.09 -0.03 0.00 -0.81 0.00 0.00 59.98 59.19 3iqh h ARG 282 Cb 0.50 -0.05 -0.04 0.00 -0.42 0.00 0.00 29.97 29.96 3iqh h ARG 282 CO 0.02 0.49 0.34 -0.07 -1.51 0.00 0.00 179.97 179.24 3iqh h LEU 283 N 0.19 1.01 -1.85 3.80 3.38 -1.21 -3.14 115.31 117.50 3iqh h LEU 283 Ca 0.07 -0.13 -0.02 0.00 0.09 0.00 0.00 57.88 57.89 3iqh h LEU 283 Cb 0.28 -0.26 -0.00 0.00 0.09 0.00 0.00 40.66 40.77 3iqh h LEU 283 CO 0.00 0.87 -0.09 0.00 0.09 0.00 0.00 178.44 179.31 3iqh h ALA 284 N 1.28 1.14 -0.69 1.53 0.00 -0.36 -1.63 119.26 120.53 3iqh h ALA 284 Ca 0.26 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.09 3iqh h ALA 284 Cb 0.15 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.92 3iqh h ALA 284 CO -0.03 0.12 0.00 1.63 0.00 0.00 0.00 179.25 180.97 3iqh n LYS 285 N -3.40 2.62 -3.14 0.00 5.02 -0.91 -4.20 118.16 114.14 3iqh n LYS 285 Ca -0.01 -2.52 -0.39 0.00 -2.02 0.00 0.00 58.31 53.37 3iqh n LYS 285 Cb 0.26 -1.55 -0.05 0.00 -0.02 0.00 0.00 35.03 33.67 3iqh n LYS 285 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 3iqh s LEU 286 N -1.03 4.29 0.44 -0.35 1.43 -0.61 -4.98 118.68 117.87 3iqh s LEU 286 Ca 0.47 1.04 0.25 0.00 -1.03 0.00 0.00 54.13 54.86 3iqh s LEU 286 Cb 0.24 -2.94 1.28 0.00 0.03 0.00 0.00 46.19 44.81 3iqh s LEU 286 CO 0.32 -0.08 1.75 -0.65 0.23 0.00 0.00 176.35 177.91 3iqh h PRO 287 N 6.78 0.23 0.00 1.29 0.11 -1.88 0.11 132.00 138.63 3iqh h PRO 287 Ca -0.41 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 65.69 3iqh h PRO 287 Cb 1.19 -0.05 -0.00 0.00 0.11 0.00 0.00 31.00 32.25 3iqh h PRO 287 CO 0.76 0.15 -0.03 1.05 -0.21 0.00 0.00 178.00 179.72 3iqh h GLU 288 N 0.24 0.00 -0.40 1.05 4.11 -1.93 -1.89 114.58 115.76 3iqh h GLU 288 Ca 0.64 0.00 0.00 0.00 0.07 0.00 0.00 59.36 60.07 3iqh h GLU 288 Cb 1.93 0.00 0.00 0.00 0.50 0.00 0.00 28.75 31.18 3iqh h GLU 288 CO -0.25 0.03 0.00 1.19 0.07 0.00 0.00 179.01 180.05 3iqh n PHE 289 N -3.45 1.00 -0.30 2.06 3.72 0.36 -4.70 117.46 116.14 3iqh n PHE 289 Ca -0.02 -0.69 -0.04 0.00 -0.05 0.00 0.00 57.45 56.64 3iqh n PHE 289 Cb 0.13 -0.22 0.08 0.00 -0.94 0.00 0.00 39.48 38.53 3iqh n PHE 289 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3iqh h ALA 290 N 2.54 1.04 -0.53 4.37 0.00 -1.27 -2.73 119.26 122.68 3iqh h ALA 290 Ca 0.00 -0.07 -0.19 0.00 0.00 0.00 0.00 54.91 54.65 3iqh h ALA 290 Cb 1.27 -0.33 -0.11 0.00 0.00 0.00 0.00 17.79 18.61 3iqh h ALA 290 CO 0.18 0.47 0.15 -0.25 0.00 0.00 0.00 179.25 179.79 3iqh n ASP 291 N -4.49 3.73 -4.50 0.00 8.00 -1.26 -4.92 116.55 113.09 3iqh n ASP 291 Ca 0.08 -3.40 -0.33 0.00 0.71 0.00 0.00 54.79 51.85 3iqh n ASP 291 Cb 0.03 -0.67 -0.12 0.00 -0.02 0.00 0.00 41.12 40.33 3iqh n ASP 291 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 3iqh s LYS 292 N -3.08 3.00 -0.33 -1.24 1.02 -1.03 -5.08 119.74 112.99 3iqh s LYS 292 Ca 0.49 -0.60 -0.24 0.00 0.02 0.00 0.00 55.97 55.64 3iqh s LYS 292 Cb 0.41 -2.62 0.01 0.00 -0.52 0.00 0.00 37.83 35.11 3iqh s LYS 292 CO 0.08 0.49 0.83 -1.17 -0.92 0.00 0.00 175.35 174.66 3iqh s LEU 293 N -0.35 4.07 -0.28 3.17 2.96 -1.26 -4.79 118.68 122.20 3iqh s LEU 293 Ca 0.05 0.62 -0.09 0.00 -0.22 0.00 0.00 54.13 54.48 3iqh s LEU 293 Cb -0.12 -3.13 -0.03 0.00 0.50 0.00 0.00 46.19 43.40 3iqh s LEU 293 CO 0.02 -0.70 0.14 -0.63 -1.32 0.00 0.00 176.35 173.87 3iqh s ILE 294 N 3.12 4.78 -0.16 6.68 1.01 0.37 -0.85 121.20 136.14 3iqh s ILE 294 Ca 0.34 -0.12 -0.04 0.00 0.00 0.00 0.00 60.65 60.83 3iqh s ILE 294 Cb -0.13 -3.31 -0.03 0.00 0.01 0.00 0.00 42.46 39.00 3iqh s ILE 294 CO 0.15 0.22 -0.03 -0.69 0.00 0.00 0.00 174.94 174.59 3iqh s VAL 295 N 1.67 3.94 -0.09 2.92 1.01 -0.01 -0.48 120.40 129.36 3iqh s VAL 295 Ca 0.06 -0.34 0.04 0.00 0.00 0.00 0.00 61.98 61.75 3iqh s VAL 295 Cb -0.16 -2.74 -0.00 0.00 0.00 0.00 0.00 36.38 33.48 3iqh s VAL 295 CO 0.07 0.48 -0.23 -0.69 0.00 0.00 0.00 175.10 174.73 3iqh s VAL 296 N 0.48 1.99 -0.11 2.92 1.01 -0.18 -0.49 120.40 126.03 3iqh s VAL 296 Ca -0.03 -0.99 -0.29 0.00 0.00 0.00 0.00 61.98 60.67 3iqh s VAL 296 Cb -0.14 -1.72 -0.01 0.00 0.00 0.00 0.00 36.38 34.51 3iqh s VAL 296 CO 0.03 0.55 0.97 -0.63 0.00 0.00 0.00 175.10 176.02 3iqh s ILE 297 N 0.24 4.81 -0.54 2.22 -1.09 -0.61 -0.51 121.20 125.72 3iqh s ILE 297 Ca -0.15 1.97 -0.10 0.00 -2.23 0.00 0.00 60.65 60.14 3iqh s ILE 297 Cb -0.17 -4.28 0.14 0.00 -1.58 0.00 0.00 42.46 36.57 3iqh s ILE 297 CO 0.07 0.02 0.43 -0.76 -1.23 0.00 0.00 174.94 173.47 3iqh s LEU 298 N 1.96 5.86 0.54 2.97 1.43 -0.27 -4.77 118.68 126.41 3iqh s LEU 298 Ca 0.47 -2.08 0.28 0.00 -1.03 0.00 0.00 54.13 51.77 3iqh s LEU 298 Cb -0.18 -2.05 1.57 0.00 0.03 0.00 0.00 46.19 45.55 3iqh s LEU 298 CO 0.17 -0.68 2.13 -0.65 0.23 0.00 0.00 176.35 177.56 3iqh h PRO 299 N 8.31 0.00 -3.38 1.29 0.11 -1.89 -1.62 132.00 134.82 3iqh h PRO 299 Ca -0.17 0.00 -0.08 0.00 0.11 0.00 0.00 66.00 65.86 3iqh h PRO 299 Cb 1.06 0.00 -0.04 0.00 0.11 0.00 0.00 31.00 32.13 3iqh h PRO 299 CO 0.86 0.08 0.09 -1.54 -0.21 0.00 0.00 178.00 177.29 3iqh s SER 300 N -6.15 0.18 0.17 -2.05 1.04 -1.26 -0.96 113.70 104.67 3iqh s SER 300 Ca -0.03 -1.12 0.08 0.00 0.48 0.00 0.00 55.95 55.36 3iqh s SER 300 Cb 0.14 0.75 -0.04 0.00 0.10 0.00 0.00 66.02 66.96 3iqh s SER 300 CO 0.57 -1.46 -0.06 0.00 0.98 0.00 0.00 173.24 173.27 3iqh s ALA 301 N -2.99 3.03 0.28 5.32 0.00 -1.25 -1.39 121.76 124.76 3iqh s ALA 301 Ca 0.20 -1.43 -0.01 0.00 0.00 0.00 0.00 51.96 50.72 3iqh s ALA 301 Cb -0.03 -0.83 0.48 0.00 0.00 0.00 0.00 23.12 22.73 3iqh s ALA 301 CO 0.13 0.48 1.88 0.77 0.00 0.00 0.00 175.76 179.02 3iqh h SER 302 N 2.87 0.98 0.38 0.00 0.02 -1.44 -2.96 113.55 113.40 3iqh h SER 302 Ca -0.47 0.02 -0.03 0.00 -0.84 0.00 0.00 61.79 60.47 3iqh h SER 302 Cb 1.20 -0.19 -0.00 0.00 0.14 0.00 0.00 62.40 63.55 3iqh h SER 302 CO 0.55 0.61 -0.13 -0.33 -1.14 0.00 0.00 176.83 176.39 3iqh h GLU 303 N 1.10 0.00 0.00 3.45 5.08 -1.91 0.11 114.58 122.40 3iqh h GLU 303 Ca 0.43 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.79 3iqh h GLU 303 Cb 0.24 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.49 3iqh h GLU 303 CO -0.18 0.13 0.00 -2.13 -1.00 0.00 0.00 179.01 175.83 3iqh n ARG 304 N -3.67 0.01 -0.14 2.33 0.63 -1.12 -3.07 116.66 111.64 3iqh n ARG 304 Ca -0.02 0.37 0.07 0.00 -0.92 0.00 0.00 57.85 57.35 3iqh n ARG 304 Cb 0.25 -1.50 0.10 0.00 0.45 0.00 0.00 32.46 31.76 3iqh n ARG 304 CO 0.00 0.00 0.00 0.66 -2.51 0.00 0.00 177.63 175.78 3iqh n TYR 305 N -1.48 0.00 -0.21 -0.14 4.01 0.02 -4.85 117.16 114.51 3iqh n TYR 305 Ca 0.02 -0.77 0.05 0.00 -0.16 0.00 0.00 57.90 57.04 3iqh n TYR 305 Cb 0.08 -0.12 0.32 0.00 -0.31 0.00 0.00 39.34 39.31 3iqh n TYR 305 CO 0.00 0.00 0.00 -0.07 -0.46 0.00 0.00 176.86 176.33 3iqh h LEU 306 N 0.00 0.73 -2.84 7.72 3.38 -1.56 -1.71 115.31 121.02 3iqh h LEU 306 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3iqh h LEU 306 Cb 1.03 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 41.62 3iqh h LEU 306 CO 0.00 0.47 0.00 -1.54 0.09 0.00 0.00 178.44 177.46 3iqh n SER 307 N -4.48 4.42 -4.96 -0.43 3.41 -1.26 -4.52 113.62 105.81 3iqh n SER 307 Ca 0.11 -2.66 -0.20 0.00 -0.26 0.00 0.00 58.87 55.86 3iqh n SER 307 Cb 0.20 -0.63 0.01 0.00 -0.26 0.00 0.00 64.21 63.53 3iqh n SER 307 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 3iqh s THR 308 N -2.26 2.46 0.63 6.66 -4.23 -0.64 -4.98 115.64 113.28 3iqh s THR 308 Ca 0.40 -1.19 0.21 0.00 -1.18 0.00 0.00 61.69 59.93 3iqh s THR 308 Cb 0.30 -2.65 0.26 0.00 1.34 0.00 0.00 72.50 71.75 3iqh s THR 308 CO 0.12 0.00 1.51 0.00 -0.54 0.00 0.00 174.62 175.71 3iqh h ALA 309 N 0.67 2.10 -0.99 3.99 0.00 -1.92 -2.53 119.26 120.58 3iqh h ALA 309 Ca -0.37 -0.01 0.07 0.00 0.00 0.00 0.00 54.91 54.60 3iqh h ALA 309 Cb 1.28 0.03 -0.07 0.00 0.00 0.00 0.00 17.79 19.03 3iqh h ALA 309 CO 0.50 -0.94 0.64 1.25 0.00 0.00 0.00 179.25 180.69 3iqh h LEU 310 N 0.00 1.01 -1.39 0.00 5.85 -1.92 -3.51 115.31 115.35 3iqh h LEU 310 Ca 0.17 0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.90 3iqh h LEU 310 Cb 1.69 -0.20 0.00 0.00 0.37 0.00 0.00 40.66 42.52 3iqh h LEU 310 CO -0.00 0.63 0.00 0.49 -0.34 0.00 0.00 178.44 179.22