#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1i6w s ASN 4 N 0.00 5.47 0.57 0.41 0.01 -1.26 -4.95 114.94 115.19 1i6w s ASN 4 Ca 0.00 1.98 -0.21 0.00 -0.71 0.00 0.00 52.86 53.93 1i6w s ASN 4 Cb 0.00 -2.55 -0.04 0.00 0.41 0.00 0.00 41.25 39.07 1i6w s ASN 4 CO 0.00 -1.38 1.31 -2.84 -1.51 0.00 0.00 177.10 172.68 1i6w s PRO 5 N -3.89 3.03 -0.17 -0.60 0.02 -1.26 -4.64 135.00 127.50 1i6w s PRO 5 Ca 0.67 2.12 -0.04 0.00 0.02 0.00 0.00 61.00 63.77 1i6w s PRO 5 Cb -0.20 -2.14 -0.03 0.00 0.02 0.00 0.00 34.50 32.16 1i6w s PRO 5 CO 0.36 -1.24 -0.03 0.08 -0.33 0.00 0.00 177.00 175.84 1i6w s VAL 6 N -1.37 3.88 -0.23 3.83 1.01 -0.50 -1.13 120.40 125.89 1i6w s VAL 6 Ca 0.74 -0.35 -0.05 0.00 0.00 0.00 0.00 61.98 62.31 1i6w s VAL 6 Cb -0.38 -2.72 -0.02 0.00 0.00 0.00 0.00 36.38 33.27 1i6w s VAL 6 CO 0.43 0.47 0.01 -0.69 0.00 0.00 0.00 175.10 175.33 1i6w s VAL 7 N 0.57 3.83 -0.18 2.92 1.01 0.02 0.09 120.40 128.67 1i6w s VAL 7 Ca -0.02 -0.34 -0.08 0.00 0.00 0.00 0.00 61.98 61.53 1i6w s VAL 7 Cb -0.14 -2.76 -0.04 0.00 0.00 0.00 0.00 36.38 33.43 1i6w s VAL 7 CO 0.02 0.39 0.10 -0.04 0.00 0.00 0.00 175.10 175.58 1i6w s MET 8 N 1.45 4.00 -0.23 2.72 -1.94 0.79 -1.93 119.30 124.15 1i6w s MET 8 Ca 0.05 -0.27 -0.00 0.00 -1.71 0.00 0.00 55.69 53.76 1i6w s MET 8 Cb -0.15 -3.30 0.03 0.00 2.01 0.00 0.00 34.83 33.43 1i6w s MET 8 CO 0.00 0.35 -0.11 0.08 -0.01 0.00 0.00 175.02 175.33 1i6w s VAL 9 N 0.19 2.55 0.75 -6.03 1.01 -0.09 -2.05 120.40 116.74 1i6w s VAL 9 Ca 0.07 -1.09 -0.11 0.00 0.00 0.00 0.00 61.98 60.85 1i6w s VAL 9 Cb -0.12 -2.27 0.06 0.00 0.00 0.00 0.00 36.38 34.05 1i6w s VAL 9 CO -0.01 0.26 1.12 -1.38 0.00 0.00 0.00 175.10 175.09 1i6w s HIS 10 N 1.28 3.06 0.00 5.22 -3.43 -1.26 -0.82 115.29 119.33 1i6w s HIS 10 Ca 0.00 0.77 0.00 0.00 -0.80 0.00 0.00 55.06 55.03 1i6w s HIS 10 Cb -0.16 -3.30 0.00 0.00 -1.43 0.00 0.00 32.58 27.69 1i6w s HIS 10 CO -0.07 -1.51 0.00 0.41 -2.00 0.00 0.00 174.74 171.57 1i6w n GLY 11 N -3.13 1.39 3.69 -1.38 0.00 -1.16 -3.35 105.19 101.23 1i6w n GLY 11 Ca 0.07 -2.03 -0.43 0.00 0.00 0.00 0.00 46.02 43.64 1i6w n GLY 11 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1i6w n ILE 12 N -0.91 0.39 -0.94 -0.61 5.41 -1.26 -1.05 119.36 120.38 1i6w n ILE 12 Ca 0.00 -0.07 0.00 0.00 1.00 0.00 0.00 62.75 63.68 1i6w n ILE 12 Cb 0.00 -2.08 0.00 0.00 -0.71 0.00 0.00 39.64 36.85 1i6w n ILE 12 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1i6w n GLY 13 N 4.21 0.52 0.39 7.39 0.00 -1.26 -5.00 105.19 111.44 1i6w n GLY 13 Ca 0.19 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.18 1i6w n GLY 13 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1i6w n GLY 14 N -1.96 -0.32 3.40 -0.02 0.00 -0.22 -5.13 105.19 100.94 1i6w n GLY 14 Ca 0.00 -1.80 -0.11 0.00 0.00 0.00 0.00 46.02 44.11 1i6w n GLY 14 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1i6w s ALA 15 N -3.47 -1.33 0.47 4.61 0.00 -1.26 -4.85 121.76 115.93 1i6w s ALA 15 Ca 0.07 0.25 0.20 0.00 0.00 0.00 0.00 51.96 52.48 1i6w s ALA 15 Cb -0.00 0.82 1.20 0.00 0.00 0.00 0.00 23.12 25.14 1i6w s ALA 15 CO 0.05 -0.74 1.95 0.66 0.00 0.00 0.00 175.76 177.68 1i6w h SER 16 N 2.13 0.22 0.27 0.00 4.64 -1.87 -0.40 113.55 118.54 1i6w h SER 16 Ca -0.33 0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.00 1i6w h SER 16 Cb 1.29 -0.03 0.00 0.00 -0.31 0.00 0.00 62.40 63.35 1i6w h SER 16 CO 0.40 0.12 0.00 -0.26 -0.87 0.00 0.00 176.83 176.22 1i6w h PHE 17 N 0.23 0.00 -0.00 4.77 0.04 -1.94 -2.51 116.94 117.53 1i6w h PHE 17 Ca 0.32 0.00 0.00 0.00 2.80 0.00 0.00 57.97 61.09 1i6w h PHE 17 Cb 0.92 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 39.07 1i6w h PHE 17 CO -0.00 0.00 0.00 -0.91 -0.60 0.00 0.00 178.31 176.80 1i6w h ASN 18 N 0.00 0.00 -0.49 2.17 2.35 -1.48 -2.40 115.58 115.73 1i6w h ASN 18 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 1i6w h ASN 18 Cb 0.13 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.50 1i6w h ASN 18 CO 0.00 0.00 0.00 0.49 -1.65 0.00 0.00 177.43 176.27 1i6w n PHE 19 N -3.66 1.06 -0.27 1.19 3.72 -0.94 -4.50 117.46 114.06 1i6w n PHE 19 Ca -0.03 -0.43 -0.01 0.00 -0.05 0.00 0.00 57.45 56.93 1i6w n PHE 19 Cb 0.08 -0.17 0.11 0.00 -0.94 0.00 0.00 39.48 38.56 1i6w n PHE 19 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1i6w h ALA 20 N 3.77 1.02 -0.49 4.37 0.00 -1.64 -0.80 119.26 125.49 1i6w h ALA 20 Ca 0.00 -0.00 -0.06 0.00 0.00 0.00 0.00 54.91 54.85 1i6w h ALA 20 Cb 1.08 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.66 1i6w h ALA 20 CO 0.15 0.18 0.07 0.78 0.00 0.00 0.00 179.25 180.43 1i6w h GLY 21 N 0.85 0.89 1.21 0.00 0.00 -1.82 -2.00 103.07 102.20 1i6w h GLY 21 Ca 0.33 -0.60 -0.11 0.00 0.00 0.00 0.00 47.33 46.95 1i6w h GLY 21 CO -0.16 0.55 -0.13 -2.22 0.00 0.00 0.00 176.54 174.58 1i6w h ILE 22 N 0.69 1.27 -0.21 2.60 2.04 -1.65 -2.33 117.51 119.92 1i6w h ILE 22 Ca 0.15 -1.26 -0.02 0.00 1.00 0.00 0.00 64.86 64.73 1i6w h ILE 22 Cb 0.41 1.02 -0.01 0.00 -0.74 0.00 0.00 36.82 37.51 1i6w h ILE 22 CO 0.01 0.44 0.05 0.11 0.00 0.00 0.00 178.15 178.76 1i6w h LYS 23 N 0.82 0.34 -1.00 2.37 1.57 -1.05 -0.95 116.57 118.68 1i6w h LYS 23 Ca 0.13 -0.08 0.02 0.00 -1.87 0.00 0.00 60.65 58.85 1i6w h LYS 23 Cb 0.67 -0.04 -0.05 0.00 0.08 0.00 0.00 32.23 32.88 1i6w h LYS 23 CO 0.05 0.46 0.66 0.77 -0.57 0.00 0.00 179.45 180.82 1i6w h SER 24 N 0.16 1.11 -0.04 0.86 0.02 -1.32 0.06 113.55 114.41 1i6w h SER 24 Ca 0.07 -0.02 -0.00 0.00 -0.84 0.00 0.00 61.79 60.99 1i6w h SER 24 Cb 0.28 -0.27 -0.00 0.00 0.14 0.00 0.00 62.40 62.55 1i6w h SER 24 CO 0.00 0.79 0.01 0.22 -1.14 0.00 0.00 176.83 176.71 1i6w h TYR 25 N 1.31 0.06 -0.93 3.45 3.20 -1.24 -1.61 116.97 121.21 1i6w h TYR 25 Ca 0.38 -0.01 0.00 0.00 3.14 0.00 0.00 58.73 62.25 1i6w h TYR 25 Cb -0.08 -0.02 -0.05 0.00 1.54 0.00 0.00 36.73 38.13 1i6w h TYR 25 CO -0.00 0.23 0.59 -0.07 -1.64 0.00 0.00 178.16 177.27 1i6w h LEU 26 N -0.12 1.10 -0.71 2.82 3.38 -0.70 -1.08 115.31 120.00 1i6w h LEU 26 Ca 0.01 -0.05 -0.02 0.00 0.09 0.00 0.00 57.88 57.91 1i6w h LEU 26 Cb 0.19 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.63 1i6w h LEU 26 CO -0.00 0.82 0.35 0.58 0.09 0.00 0.00 178.44 180.28 1i6w h VAL 27 N 1.28 1.23 0.00 1.22 2.07 -0.89 -0.78 116.25 120.38 1i6w h VAL 27 Ca 0.34 -0.64 -0.03 0.00 0.82 0.00 0.00 66.70 67.19 1i6w h VAL 27 Cb -0.10 0.35 -0.00 0.00 -1.52 0.00 0.00 31.29 30.01 1i6w h VAL 27 CO -0.07 0.27 -0.12 0.28 0.02 0.00 0.00 177.57 177.95 1i6w h SER 28 N 0.99 0.00 -0.10 0.57 0.02 -0.48 -2.07 113.55 112.48 1i6w h SER 28 Ca 0.24 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.19 1i6w h SER 28 Cb 0.11 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.65 1i6w h SER 28 CO -0.03 0.12 0.00 0.00 -1.14 0.00 0.00 176.83 175.78 1i6w n GLN 29 N -3.96 1.77 0.00 3.45 1.13 -0.49 -4.93 117.38 114.34 1i6w n GLN 29 Ca -0.02 -1.13 0.00 0.00 -1.94 0.00 0.00 57.00 53.90 1i6w n GLN 29 Cb 0.21 -1.44 0.00 0.00 0.11 0.00 0.00 30.24 29.12 1i6w n GLN 29 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1i6w n GLY 30 N 1.18 1.65 3.78 1.08 0.00 -0.78 -5.06 105.19 107.04 1i6w n GLY 30 Ca 0.17 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.84 1i6w n GLY 30 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1i6w s TRP 31 N -2.03 2.82 -0.16 1.61 0.51 -0.41 -4.98 118.94 116.30 1i6w s TRP 31 Ca 0.00 1.55 -0.25 0.00 -2.12 0.00 0.00 56.10 55.28 1i6w s TRP 31 Cb 0.00 -3.29 -0.02 0.00 -0.81 0.00 0.00 33.47 29.35 1i6w s TRP 31 CO 0.00 -1.41 0.83 -1.12 -0.51 0.00 0.00 176.95 174.74 1i6w s SER 32 N -1.63 6.98 0.36 2.95 0.01 -1.26 -4.22 113.70 116.89 1i6w s SER 32 Ca 0.68 1.20 0.11 0.00 1.31 0.00 0.00 55.95 59.25 1i6w s SER 32 Cb -0.25 -2.46 0.90 0.00 0.21 0.00 0.00 66.02 64.42 1i6w s SER 32 CO 0.29 -0.38 1.82 -0.09 0.41 0.00 0.00 173.24 175.29 1i6w h ARG 33 N 7.28 0.59 0.00 12.44 9.65 -1.94 0.12 114.38 142.52 1i6w h ARG 33 Ca -0.30 -0.04 0.00 0.00 -1.10 0.00 0.00 59.98 58.54 1i6w h ARG 33 Cb 1.14 -0.13 0.00 0.00 -1.39 0.00 0.00 29.97 29.58 1i6w h ARG 33 CO 0.83 0.39 0.00 -0.40 2.80 0.00 0.00 179.97 183.59 1i6w n ASP 34 N -4.62 0.00 -0.94 -3.80 5.75 -1.26 -2.71 116.55 108.97 1i6w n ASP 34 Ca 0.21 0.41 0.08 0.00 -0.01 0.00 0.00 54.79 55.47 1i6w n ASP 34 Cb 0.62 -0.46 0.26 0.00 -1.03 0.00 0.00 41.12 40.50 1i6w n ASP 34 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 1i6w n LYS 35 N -1.46 2.89 -4.51 0.11 5.02 0.41 -4.91 118.16 115.71 1i6w n LYS 35 Ca 0.05 -2.88 -0.33 0.00 -2.02 0.00 0.00 58.31 53.14 1i6w n LYS 35 Cb 0.21 -1.86 -0.15 0.00 -0.02 0.00 0.00 35.03 33.21 1i6w n LYS 35 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1i6w s LEU 36 N -2.86 2.52 0.16 -0.35 1.43 -1.10 -1.41 118.68 117.07 1i6w s LEU 36 Ca 0.43 -0.45 0.06 0.00 -1.03 0.00 0.00 54.13 53.14 1i6w s LEU 36 Cb 0.35 -1.58 -0.04 0.00 0.03 0.00 0.00 46.19 44.95 1i6w s LEU 36 CO 0.08 0.09 -0.13 -0.31 0.23 0.00 0.00 176.35 176.31 1i6w s TYR 37 N 0.81 1.45 -0.11 0.29 1.51 0.11 -4.97 117.35 116.45 1i6w s TYR 37 Ca -0.05 -0.65 -0.04 0.00 -1.01 0.00 0.00 57.07 55.32 1i6w s TYR 37 Cb -0.15 -0.72 0.06 0.00 -0.11 0.00 0.00 41.96 41.04 1i6w s TYR 37 CO 0.00 0.19 0.24 0.00 -1.11 0.00 0.00 175.55 174.87 1i6w s ALA 38 N -2.93 -0.46 0.75 3.71 0.00 -1.26 -0.15 121.76 121.41 1i6w s ALA 38 Ca 0.17 0.86 -0.11 0.00 0.00 0.00 0.00 51.96 52.87 1i6w s ALA 38 Cb -0.00 -0.91 0.04 0.00 0.00 0.00 0.00 23.12 22.25 1i6w s ALA 38 CO 0.03 -0.55 1.09 0.54 0.00 0.00 0.00 175.76 176.87 1i6w s VAL 39 N 2.20 3.44 -0.14 0.00 0.11 -0.87 -4.81 120.40 120.32 1i6w s VAL 39 Ca -0.00 0.47 -0.01 0.00 -2.93 0.00 0.00 61.98 59.50 1i6w s VAL 39 Cb -0.12 -3.29 0.04 0.00 -1.53 0.00 0.00 36.38 31.48 1i6w s VAL 39 CO -0.08 -0.61 -0.03 -1.81 -3.33 0.00 0.00 175.10 169.24 1i6w s ASP 40 N -4.02 2.46 -0.05 3.54 1.01 -1.26 -3.80 116.67 114.56 1i6w s ASP 40 Ca 0.59 -0.50 -0.14 0.00 0.71 0.00 0.00 52.55 53.21 1i6w s ASP 40 Cb -0.13 -0.75 -0.05 0.00 1.01 0.00 0.00 42.92 43.00 1i6w s ASP 40 CO 0.54 -0.19 0.37 -0.36 0.21 0.00 0.00 175.17 175.73 1i6w s PHE 41 N 1.76 3.65 -0.60 4.23 0.08 -1.26 -4.98 117.98 120.86 1i6w s PHE 41 Ca 0.02 0.88 0.23 0.00 0.12 0.00 0.00 56.93 58.17 1i6w s PHE 41 Cb -0.14 -2.29 -0.01 0.00 -0.57 0.00 0.00 43.02 40.00 1i6w s PHE 41 CO -0.07 0.54 0.97 -2.67 -0.10 0.00 0.00 175.22 173.88 1i6w n TRP 42 N 2.33 0.22 -2.41 0.36 4.27 -1.26 -4.83 117.44 116.12 1i6w n TRP 42 Ca -0.13 0.06 -0.42 0.00 -3.89 0.00 0.00 57.50 53.12 1i6w n TRP 42 Cb 0.52 -0.40 -0.02 0.00 -1.36 0.00 0.00 31.31 30.05 1i6w n TRP 42 CO 0.00 0.00 0.00 0.34 -2.29 0.00 0.00 177.69 175.74 1i6w s ASP 43 N -3.89 6.25 0.00 -0.67 -1.08 -1.26 -4.87 116.67 111.15 1i6w s ASP 43 Ca 0.03 0.46 0.15 0.00 -0.52 0.00 0.00 52.55 52.67 1i6w s ASP 43 Cb 0.14 -2.54 0.69 0.00 -1.46 0.00 0.00 42.92 39.75 1i6w s ASP 43 CO 0.82 -1.57 1.46 0.29 0.52 0.00 0.00 175.17 176.69 1i6w n LYS 44 N 8.40 0.08 0.00 4.34 4.76 -1.26 -1.80 118.16 132.68 1i6w n LYS 44 Ca 0.13 0.20 0.10 0.00 -2.87 0.00 0.00 58.31 55.88 1i6w n LYS 44 Cb 0.49 -1.50 -0.06 0.00 -1.84 0.00 0.00 35.03 32.12 1i6w n LYS 44 CO 0.00 0.00 0.00 0.25 -1.37 0.00 0.00 177.40 176.28 1i6w n THR 45 N -1.42 0.00 -1.98 -0.18 -2.24 -1.26 -4.28 114.28 102.92 1i6w n THR 45 Ca 0.05 -0.07 -0.18 0.00 -2.27 0.00 0.00 64.05 61.58 1i6w n THR 45 Cb 0.16 1.02 -0.04 0.00 -2.10 0.00 0.00 70.33 69.37 1i6w n THR 45 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1i6w n GLY 46 N 1.47 0.54 3.74 3.38 0.00 -0.75 -4.98 105.19 108.61 1i6w n GLY 46 Ca 0.06 -0.16 -0.37 0.00 0.00 0.00 0.00 46.02 45.55 1i6w n GLY 46 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1i6w s THR 47 N -2.78 2.09 0.24 2.61 -4.23 -1.26 -4.85 115.64 107.45 1i6w s THR 47 Ca 0.00 0.06 -0.03 0.00 -1.18 0.00 0.00 61.69 60.55 1i6w s THR 47 Cb 0.00 -3.03 0.07 0.00 1.34 0.00 0.00 72.50 70.88 1i6w s THR 47 CO 0.00 -0.01 1.69 0.78 -0.54 0.00 0.00 174.62 176.54 1i6w h ASN 48 N 0.97 0.73 -0.76 3.99 2.35 -1.95 -1.54 115.58 119.38 1i6w h ASN 48 Ca -0.51 -0.23 0.17 0.00 -0.55 0.00 0.00 56.30 55.18 1i6w h ASN 48 Cb 1.32 -0.20 -0.12 0.00 0.05 0.00 0.00 38.32 39.38 1i6w h ASN 48 CO 0.55 0.89 0.17 0.22 -1.65 0.00 0.00 177.43 177.62 1i6w h TYR 49 N 0.66 0.26 0.08 1.19 3.20 -2.00 0.83 116.97 121.19 1i6w h TYR 49 Ca 0.11 0.04 -0.37 0.00 3.14 0.00 0.00 58.73 61.65 1i6w h TYR 49 Cb 0.63 0.00 -0.04 0.00 1.54 0.00 0.00 36.73 38.86 1i6w h TYR 49 CO 0.03 -0.11 -2.17 0.09 -1.64 0.00 0.00 178.16 174.36 1i6w n ASN 50 N -5.18 2.07 0.07 -2.11 3.02 -1.18 -4.45 115.26 107.50 1i6w n ASN 50 Ca 0.15 0.08 -0.07 0.00 -0.03 0.00 0.00 54.58 54.72 1i6w n ASN 50 Cb 0.49 -0.70 0.08 0.00 -0.61 0.00 0.00 39.78 39.04 1i6w n ASN 50 CO 0.00 0.00 0.00 0.78 -2.62 0.00 0.00 177.26 175.42 1i6w h ASN 51 N 0.05 0.32 0.10 6.41 4.21 -1.21 -3.15 115.58 122.31 1i6w h ASN 51 Ca -0.48 -0.20 0.02 0.00 1.21 0.00 0.00 56.30 56.85 1i6w h ASN 51 Cb 1.99 -0.09 -0.04 0.00 -1.12 0.00 0.00 38.32 39.05 1i6w h ASN 51 CO 0.02 0.89 -0.28 1.23 -1.29 0.00 0.00 177.43 178.01 1i6w h GLY 52 N 1.48 -0.50 1.01 2.83 0.00 -1.03 0.03 103.07 106.89 1i6w h GLY 52 Ca -0.02 0.33 0.01 0.00 0.00 0.00 0.00 47.33 47.65 1i6w h GLY 52 CO 0.11 -0.23 0.56 -2.55 0.00 0.00 0.00 176.54 174.42 1i6w h PRO 53 N -0.48 1.13 -0.57 4.80 0.11 -1.77 -0.37 132.00 134.85 1i6w h PRO 53 Ca 0.04 -0.08 0.00 0.00 0.11 0.00 0.00 66.00 66.07 1i6w h PRO 53 Cb 0.52 -0.25 -0.03 0.00 0.11 0.00 0.00 31.00 31.35 1i6w h PRO 53 CO -0.18 0.76 0.36 0.28 -0.21 0.00 0.00 178.00 179.02 1i6w h VAL 54 N 1.16 1.16 -0.55 3.15 2.07 -1.44 -1.37 116.25 120.43 1i6w h VAL 54 Ca 0.31 -0.32 -0.07 0.00 0.82 0.00 0.00 66.70 67.44 1i6w h VAL 54 Cb -0.12 0.34 -0.02 0.00 -1.52 0.00 0.00 31.29 29.98 1i6w h VAL 54 CO -0.07 0.16 0.06 0.25 0.02 0.00 0.00 177.57 177.99 1i6w h LEU 55 N 0.77 0.89 -0.30 2.57 5.85 -0.55 -1.52 115.31 123.02 1i6w h LEU 55 Ca 0.21 -0.28 0.04 0.00 0.84 0.00 0.00 57.88 58.69 1i6w h LEU 55 Cb -0.06 -0.24 -0.04 0.00 0.37 0.00 0.00 40.66 40.70 1i6w h LEU 55 CO -0.04 0.95 0.08 -1.28 -0.34 0.00 0.00 178.44 177.81 1i6w h SER 56 N 0.81 0.07 -0.13 1.25 0.87 -0.63 -0.19 113.55 115.59 1i6w h SER 56 Ca 0.16 0.04 -0.10 0.00 -1.23 0.00 0.00 61.79 60.66 1i6w h SER 56 Cb 0.45 0.04 -0.01 0.00 -0.44 0.00 0.00 62.40 62.44 1i6w h SER 56 CO 0.02 0.07 -0.25 0.03 -0.53 0.00 0.00 176.83 176.17 1i6w h ARG 57 N 0.21 0.58 -0.25 2.24 3.08 -1.17 -1.90 114.38 117.16 1i6w h ARG 57 Ca 0.14 -0.23 -0.03 0.00 0.07 0.00 0.00 59.98 59.93 1i6w h ARG 57 Cb 0.12 -0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.13 1i6w h ARG 57 CO -0.16 0.78 0.05 0.35 -1.07 0.00 0.00 179.97 179.93 1i6w h PHE 58 N 0.51 0.43 -0.45 3.04 3.57 -0.73 -1.25 116.94 122.07 1i6w h PHE 58 Ca 0.07 -0.05 -0.02 0.00 3.53 0.00 0.00 57.97 61.50 1i6w h PHE 58 Cb 0.70 -0.12 -0.02 0.00 2.79 0.00 0.00 35.95 39.30 1i6w h PHE 58 CO 0.03 0.51 0.20 0.28 -2.23 0.00 0.00 178.31 177.09 1i6w h VAL 59 N 0.23 1.19 -0.88 1.41 2.07 -0.97 -1.34 116.25 117.96 1i6w h VAL 59 Ca 0.08 -0.57 0.01 0.00 0.82 0.00 0.00 66.70 67.04 1i6w h VAL 59 Cb 0.30 0.74 -0.04 0.00 -1.52 0.00 0.00 31.29 30.77 1i6w h VAL 59 CO 0.00 0.21 0.58 -0.61 0.02 0.00 0.00 177.57 177.77 1i6w h GLN 60 N 0.58 1.16 -0.57 1.57 5.75 -1.23 0.33 115.11 122.70 1i6w h GLN 60 Ca 0.15 -0.07 -0.03 0.00 -0.15 0.00 0.00 58.65 58.55 1i6w h GLN 60 Cb 0.15 -0.26 -0.03 0.00 1.07 0.00 0.00 27.48 28.42 1i6w h GLN 60 CO -0.02 0.77 0.24 -0.22 -2.65 0.00 0.00 178.83 176.95 1i6w h LYS 61 N 1.19 0.84 -0.59 1.69 3.64 -0.83 -0.70 116.57 121.82 1i6w h LYS 61 Ca 0.32 -0.15 -0.04 0.00 -1.27 0.00 0.00 60.65 59.51 1i6w h LYS 61 Cb -0.13 -0.14 -0.03 0.00 -0.41 0.00 0.00 32.23 31.52 1i6w h LYS 61 CO -0.07 0.72 0.21 0.28 -2.27 0.00 0.00 179.45 178.32 1i6w h VAL 62 N 0.78 1.23 -0.50 2.00 2.07 -0.27 -2.11 116.25 119.45 1i6w h VAL 62 Ca 0.19 -0.76 -0.07 0.00 0.82 0.00 0.00 66.70 66.88 1i6w h VAL 62 Cb 0.18 0.62 -0.02 0.00 -1.52 0.00 0.00 31.29 30.55 1i6w h VAL 62 CO -0.02 0.29 0.01 -0.07 0.02 0.00 0.00 177.57 177.81 1i6w h LEU 63 N 0.82 0.80 -0.37 2.57 3.38 -0.64 -1.66 115.31 120.21 1i6w h LEU 63 Ca 0.19 -0.19 -0.10 0.00 0.09 0.00 0.00 57.88 57.87 1i6w h LEU 63 Cb 0.24 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.77 1i6w h LEU 63 CO -0.01 0.86 -0.18 0.44 0.09 0.00 0.00 178.44 179.64 1i6w h ASP 64 N 0.78 0.80 0.33 -0.43 3.32 -0.91 0.43 116.42 120.74 1i6w h ASP 64 Ca 0.15 -0.40 -0.17 0.00 0.02 0.00 0.00 57.03 56.62 1i6w h ASP 64 Cb 0.45 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 39.77 1i6w h ASP 64 CO 0.02 1.03 -0.71 -0.33 -1.72 0.00 0.00 179.24 177.53 1i6w h GLU 65 N 0.57 0.33 0.00 3.56 5.08 -1.30 -3.29 114.58 119.52 1i6w h GLU 65 Ca 0.08 -0.26 -0.05 0.00 -1.00 0.00 0.00 59.36 58.13 1i6w h GLU 65 Cb 0.72 0.05 -0.01 0.00 0.50 0.00 0.00 28.75 30.02 1i6w h GLU 65 CO 0.05 0.91 -1.29 0.25 -1.00 0.00 0.00 179.01 177.93 1i6w n THR 66 N -3.82 0.67 -0.98 1.13 -2.24 -0.63 -4.96 114.28 103.44 1i6w n THR 66 Ca -0.04 -0.58 0.00 0.00 -2.27 0.00 0.00 64.05 61.16 1i6w n THR 66 Cb 0.69 -0.38 0.00 0.00 -2.10 0.00 0.00 70.33 68.54 1i6w n THR 66 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1i6w n GLY 67 N 1.26 0.46 3.81 3.38 0.00 0.14 -5.01 105.19 109.24 1i6w n GLY 67 Ca -0.04 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.66 1i6w n GLY 67 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1i6w s ALA 68 N -2.06 2.81 0.01 4.61 0.00 -1.21 -4.99 121.76 120.94 1i6w s ALA 68 Ca 0.00 0.31 -0.03 0.00 0.00 0.00 0.00 51.96 52.24 1i6w s ALA 68 Cb 0.00 -3.20 -0.28 0.00 0.00 0.00 0.00 23.12 19.64 1i6w s ALA 68 CO 0.00 -0.73 0.89 -0.22 0.00 0.00 0.00 175.76 175.70 1i6w h LYS 69 N 0.41 0.26 -3.99 0.00 3.64 -1.95 -3.45 116.57 111.49 1i6w h LYS 69 Ca -0.46 -0.44 -0.10 0.00 -1.27 0.00 0.00 60.65 58.38 1i6w h LYS 69 Cb 1.21 0.16 -0.14 0.00 -0.41 0.00 0.00 32.23 33.05 1i6w h LYS 69 CO 0.58 1.13 -0.48 0.15 -2.27 0.00 0.00 179.45 178.56 1i6w s LYS 70 N -2.62 0.79 0.36 1.90 1.02 -1.26 -4.73 119.74 115.20 1i6w s LYS 70 Ca -0.08 -1.09 0.08 0.00 0.02 0.00 0.00 55.97 54.90 1i6w s LYS 70 Cb 0.07 0.30 -0.05 0.00 -0.52 0.00 0.00 37.83 37.62 1i6w s LYS 70 CO 0.86 -0.23 0.07 0.14 -0.92 0.00 0.00 175.35 175.27 1i6w s VAL 71 N -3.90 2.61 0.12 3.17 -7.23 -0.33 -4.22 120.40 110.62 1i6w s VAL 71 Ca 0.08 -1.87 0.06 0.00 -1.81 0.00 0.00 61.98 58.43 1i6w s VAL 71 Cb 0.06 -2.88 -0.04 0.00 0.56 0.00 0.00 36.38 34.08 1i6w s VAL 71 CO -0.09 -0.15 -0.01 -1.81 -0.31 0.00 0.00 175.10 172.72 1i6w s ASP 72 N -3.77 4.87 -0.03 4.85 1.01 -0.28 -1.11 116.67 122.20 1i6w s ASP 72 Ca 0.36 -0.27 0.04 0.00 0.71 0.00 0.00 52.55 53.40 1i6w s ASP 72 Cb 0.01 -1.10 -0.00 0.00 1.01 0.00 0.00 42.92 42.83 1i6w s ASP 72 CO 0.20 0.15 -0.15 -0.63 0.21 0.00 0.00 175.17 174.96 1i6w s ILE 73 N -1.41 1.22 -0.24 0.77 1.01 0.25 -0.80 121.20 122.01 1i6w s ILE 73 Ca 0.26 -0.62 0.02 0.00 0.00 0.00 0.00 60.65 60.31 1i6w s ILE 73 Cb -0.11 -1.05 0.05 0.00 0.01 0.00 0.00 42.46 41.37 1i6w s ILE 73 CO 0.18 0.36 -0.12 -0.69 0.00 0.00 0.00 174.94 174.67 1i6w s VAL 74 N -0.05 2.05 0.00 2.92 1.01 -0.82 -0.50 120.40 125.02 1i6w s VAL 74 Ca -0.01 -1.46 0.07 0.00 0.00 0.00 0.00 61.98 60.58 1i6w s VAL 74 Cb -0.09 -2.14 -0.03 0.00 0.00 0.00 0.00 36.38 34.13 1i6w s VAL 74 CO 0.01 0.05 -0.20 0.00 0.00 0.00 0.00 175.10 174.96 1i6w s ALA 75 N 1.18 2.47 -0.04 5.51 0.00 0.22 -0.91 121.76 130.19 1i6w s ALA 75 Ca -0.06 -1.12 0.06 0.00 0.00 0.00 0.00 51.96 50.83 1i6w s ALA 75 Cb -0.19 -0.73 -0.02 0.00 0.00 0.00 0.00 23.12 22.19 1i6w s ALA 75 CO -0.06 0.55 -0.21 -1.58 0.00 0.00 0.00 175.76 174.46 1i6w s HIS 76 N -0.78 2.50 0.00 0.00 5.65 -0.00 0.11 115.29 122.76 1i6w s HIS 76 Ca 0.12 -0.37 0.00 0.00 0.25 0.00 0.00 55.06 55.06 1i6w s HIS 76 Cb -0.10 -1.57 0.00 0.00 -1.18 0.00 0.00 32.58 29.73 1i6w s HIS 76 CO 0.02 0.02 0.00 0.45 -0.65 0.00 0.00 174.74 174.58 1i6w n SER 77 N 2.48 0.00 0.28 9.88 2.88 -0.63 -0.42 113.62 128.10 1i6w n SER 77 Ca -0.17 0.00 0.19 0.00 -1.33 0.00 0.00 58.87 57.56 1i6w n SER 77 Cb 0.52 0.00 0.98 0.00 -0.75 0.00 0.00 64.21 64.96 1i6w n SER 77 CO 0.00 0.00 0.00 -0.03 -1.23 0.00 0.00 175.04 173.78 1i6w h MET 78 N 0.00 0.00 0.00 -1.46 1.85 -1.85 -0.44 114.93 113.03 1i6w h MET 78 Ca 0.00 0.00 -0.01 0.00 -0.61 0.00 0.00 59.70 59.08 1i6w h MET 78 Cb 0.00 0.00 -0.00 0.00 0.43 0.00 0.00 31.60 32.03 1i6w h MET 78 CO 0.00 0.00 -0.06 0.78 -0.40 0.00 0.00 176.91 177.23 1i6w h GLY 79 N 0.16 0.00 0.99 1.39 0.00 -0.74 -1.29 103.07 103.58 1i6w h GLY 79 Ca 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 47.33 47.26 1i6w h GLY 79 CO 0.00 0.00 0.03 -1.33 0.00 0.00 0.00 176.54 175.24 1i6w h GLY 80 N 0.23 0.88 0.95 4.60 0.00 -1.22 -0.77 103.07 107.75 1i6w h GLY 80 Ca -0.00 -0.63 -0.04 0.00 0.00 0.00 0.00 47.33 46.66 1i6w h GLY 80 CO 0.01 0.58 0.13 0.00 0.00 0.00 0.00 176.54 177.26 1i6w h ALA 81 N 0.93 0.58 -0.82 3.60 0.00 -1.41 -2.16 119.26 119.99 1i6w h ALA 81 Ca 0.14 -0.19 -0.03 0.00 0.00 0.00 0.00 54.91 54.83 1i6w h ALA 81 Cb 0.47 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 18.05 1i6w h ALA 81 CO 0.02 0.25 0.38 -0.91 0.00 0.00 0.00 179.25 178.99 1i6w h ASN 82 N 0.58 1.08 -0.31 0.00 2.35 -1.14 -2.01 115.58 116.14 1i6w h ASN 82 Ca 0.14 -0.13 -0.02 0.00 -0.55 0.00 0.00 56.30 55.74 1i6w h ASN 82 Cb 0.29 -0.28 -0.01 0.00 0.05 0.00 0.00 38.32 38.37 1i6w h ASN 82 CO -0.00 0.92 0.11 0.74 -1.65 0.00 0.00 177.43 177.55 1i6w h THR 83 N 1.17 1.19 -0.39 2.81 2.02 -0.95 -1.48 112.91 117.27 1i6w h THR 83 Ca 0.28 -0.60 -0.05 0.00 0.77 0.00 0.00 66.41 66.82 1i6w h THR 83 Cb 0.13 1.01 -0.02 0.00 -1.74 0.00 0.00 68.15 67.53 1i6w h THR 83 CO -0.03 0.20 0.05 -0.07 0.37 0.00 0.00 175.52 176.04 1i6w h LEU 84 N 0.34 0.55 -0.47 2.58 3.38 -1.22 -1.96 115.31 118.51 1i6w h LEU 84 Ca 0.10 -0.10 -0.07 0.00 0.09 0.00 0.00 57.88 57.90 1i6w h LEU 84 Cb 0.21 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 40.80 1i6w h LEU 84 CO -0.01 0.59 0.02 0.22 0.09 0.00 0.00 178.44 179.35 1i6w h TYR 85 N 0.58 0.89 -0.96 1.13 3.20 -1.08 0.21 116.97 120.93 1i6w h TYR 85 Ca 0.13 -0.15 0.03 0.00 3.14 0.00 0.00 58.73 61.88 1i6w h TYR 85 Cb 0.29 -0.23 -0.05 0.00 1.54 0.00 0.00 36.73 38.28 1i6w h TYR 85 CO 0.01 0.84 0.63 -0.92 -1.64 0.00 0.00 178.16 177.09 1i6w h TYR 86 N 0.67 1.19 -0.06 -3.82 3.20 -0.83 0.37 116.97 117.70 1i6w h TYR 86 Ca 0.14 0.03 -0.22 0.00 3.14 0.00 0.00 58.73 61.82 1i6w h TYR 86 Cb 0.48 -0.40 0.01 0.00 1.54 0.00 0.00 36.73 38.36 1i6w h TYR 86 CO 0.04 0.71 -0.80 0.82 -1.64 0.00 0.00 178.16 177.28 1i6w h ILE 87 N 1.24 1.32 0.05 1.81 2.04 -1.07 -1.50 117.51 121.40 1i6w h ILE 87 Ca 0.37 -2.07 -0.07 0.00 1.00 0.00 0.00 64.86 64.10 1i6w h ILE 87 Cb -0.05 2.28 0.01 0.00 -0.74 0.00 0.00 36.82 38.31 1i6w h ILE 87 CO -0.11 0.64 -0.29 0.50 0.00 0.00 0.00 178.15 178.89 1i6w h LYS 88 N 0.30 0.11 0.00 2.37 3.64 -0.31 -3.26 116.57 119.42 1i6w h LYS 88 Ca -0.08 -0.18 0.00 0.00 -1.27 0.00 0.00 60.65 59.11 1i6w h LYS 88 Cb 1.46 0.07 0.00 0.00 -0.41 0.00 0.00 32.23 33.35 1i6w h LYS 88 CO 0.16 1.08 -1.67 0.09 -2.27 0.00 0.00 179.45 176.83 1i6w n ASN 89 N -4.44 0.53 0.00 4.20 4.13 0.13 -5.00 115.26 114.81 1i6w n ASN 89 Ca -0.11 -0.24 0.00 0.00 1.68 0.00 0.00 54.58 55.91 1i6w n ASN 89 Cb 0.60 1.69 0.00 0.00 -1.54 0.00 0.00 39.78 40.53 1i6w n ASN 89 CO 0.00 0.00 0.00 0.18 0.28 0.00 0.00 177.26 177.72 1i6w n LEU 90 N -2.02 0.00 -1.40 3.41 4.77 -1.04 -5.03 117.00 115.70 1i6w n LEU 90 Ca -0.02 0.00 0.10 0.00 -0.03 0.00 0.00 56.01 56.06 1i6w n LEU 90 Cb 0.47 0.00 0.33 0.00 -2.33 0.00 0.00 43.42 41.88 1i6w n LEU 90 CO 0.42 0.00 0.78 -0.90 -1.33 0.00 0.00 177.39 176.36 1i6w n ASP 91 N 0.00 4.37 0.00 -1.43 5.75 -1.20 -4.56 116.55 119.48 1i6w n ASP 91 Ca 0.00 -2.34 0.10 0.00 -0.01 0.00 0.00 54.79 52.54 1i6w n ASP 91 Cb 0.00 -0.52 0.44 0.00 -1.03 0.00 0.00 41.12 40.01 1i6w n ASP 91 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1i6w n GLY 92 N 1.08 -1.21 0.48 6.12 0.00 -0.59 -4.09 105.19 106.98 1i6w n GLY 92 Ca 0.24 -0.07 0.30 0.00 0.00 0.00 0.00 46.02 46.48 1i6w n GLY 92 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1i6w h GLY 93 N 3.54 0.44 -0.57 -0.02 0.00 -1.76 -2.08 103.07 102.61 1i6w h GLY 93 Ca 0.00 -0.07 -0.01 0.00 0.00 0.00 0.00 47.33 47.24 1i6w h GLY 93 CO 0.00 -0.05 -0.26 1.16 0.00 0.00 0.00 176.54 177.39 1i6w n ASN 94 N -4.36 1.69 0.00 0.19 6.94 -1.26 -0.53 115.26 117.94 1i6w n ASN 94 Ca 0.24 -2.96 0.00 0.00 -0.02 0.00 0.00 54.58 51.84 1i6w n ASN 94 Cb 1.06 -0.40 0.00 0.00 -2.36 0.00 0.00 39.78 38.09 1i6w n ASN 94 CO 0.00 0.00 0.00 0.29 -1.03 0.00 0.00 177.26 176.52 1i6w n LYS 95 N -0.98 0.62 -4.84 -3.83 5.02 -0.79 -4.86 118.16 108.51 1i6w n LYS 95 Ca 0.13 -0.88 -0.26 0.00 -2.02 0.00 0.00 58.31 55.28 1i6w n LYS 95 Cb 0.69 -0.98 -0.16 0.00 -0.02 0.00 0.00 35.03 34.57 1i6w n LYS 95 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1i6w s VAL 96 N -0.40 1.42 -0.03 -0.18 1.01 -1.19 -1.19 120.40 119.84 1i6w s VAL 96 Ca 0.00 -0.73 -0.04 0.00 0.00 0.00 0.00 61.98 61.22 1i6w s VAL 96 Cb 0.00 -1.21 -0.01 0.00 0.00 0.00 0.00 36.38 35.16 1i6w s VAL 96 CO 0.00 0.41 -0.07 0.00 0.00 0.00 0.00 175.10 175.43 1i6w n ALA 97 N 3.01 1.16 -2.79 5.51 0.00 -0.27 -4.72 120.51 122.41 1i6w n ALA 97 Ca -0.17 -0.29 -0.34 0.00 0.00 0.00 0.00 53.44 52.65 1i6w n ALA 97 Cb 0.53 0.03 -0.12 0.00 0.00 0.00 0.00 19.45 19.89 1i6w n ALA 97 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 1i6w s ASN 98 N -4.83 4.52 -0.07 0.00 0.01 -1.26 -1.85 114.94 111.46 1i6w s ASN 98 Ca -0.06 -0.13 0.04 0.00 -0.71 0.00 0.00 52.86 52.00 1i6w s ASN 98 Cb 0.01 -1.43 0.00 0.00 0.41 0.00 0.00 41.25 40.24 1i6w s ASN 98 CO 0.09 0.26 -0.19 -0.69 -1.51 0.00 0.00 177.10 175.06 1i6w s VAL 99 N -0.20 1.62 -0.09 1.60 1.01 0.01 -0.58 120.40 123.76 1i6w s VAL 99 Ca 0.02 -0.79 0.00 0.00 0.00 0.00 0.00 61.98 61.21 1i6w s VAL 99 Cb -0.13 -1.41 0.02 0.00 0.00 0.00 0.00 36.38 34.87 1i6w s VAL 99 CO 0.03 0.46 -0.07 -0.69 0.00 0.00 0.00 175.10 174.83 1i6w s VAL 100 N 0.26 0.92 0.03 2.92 1.01 0.35 -1.10 120.40 124.79 1i6w s VAL 100 Ca -0.11 -0.26 0.05 0.00 0.00 0.00 0.00 61.98 61.67 1i6w s VAL 100 Cb -0.15 -0.94 -0.03 0.00 0.00 0.00 0.00 36.38 35.26 1i6w s VAL 100 CO 0.05 0.34 -0.10 0.42 0.00 0.00 0.00 175.10 175.80 1i6w s THR 101 N 1.49 3.36 -0.26 3.92 -4.23 -0.38 -0.61 115.64 118.92 1i6w s THR 101 Ca 0.00 -0.98 0.02 0.00 -1.18 0.00 0.00 61.69 59.55 1i6w s THR 101 Cb -0.13 -2.47 0.06 0.00 1.34 0.00 0.00 72.50 71.30 1i6w s THR 101 CO -0.05 0.32 -0.10 -0.76 -0.54 0.00 0.00 174.62 173.49 1i6w s LEU 102 N -1.58 3.46 -1.41 4.79 1.43 0.12 -0.91 118.68 124.58 1i6w s LEU 102 Ca 0.17 -1.36 -0.09 0.00 -1.03 0.00 0.00 54.13 51.82 1i6w s LEU 102 Cb -0.11 -1.56 0.05 0.00 0.03 0.00 0.00 46.19 44.60 1i6w s LEU 102 CO 0.08 -0.19 0.62 0.61 0.23 0.00 0.00 176.35 177.70 1i6w n GLY 103 N 4.45 -0.50 3.77 -3.19 0.00 0.18 -1.60 105.19 108.31 1i6w n GLY 103 Ca -0.14 0.12 -0.40 0.00 0.00 0.00 0.00 46.02 45.60 1i6w n GLY 103 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1i6w s GLY 104 N -2.82 2.99 -0.62 -0.02 0.00 -1.26 -3.45 107.32 102.15 1i6w s GLY 104 Ca 0.41 1.21 -0.04 0.00 0.00 0.00 0.00 44.72 46.30 1i6w s GLY 104 CO 0.51 1.84 2.70 0.00 0.00 0.00 0.00 173.10 178.15 1i6w n ALA 105 N 0.71 6.52 0.00 3.20 0.00 -0.72 -3.07 120.51 127.16 1i6w n ALA 105 Ca 0.01 -3.25 -0.09 0.00 0.00 0.00 0.00 53.44 50.10 1i6w n ALA 105 Cb 0.43 -2.27 -0.03 0.00 0.00 0.00 0.00 19.45 17.58 1i6w n ALA 105 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.50 176.59 1i6w h ASN 106 N 3.31 -0.57 0.06 0.00 2.35 -1.66 -2.77 115.58 116.31 1i6w h ASN 106 Ca 0.45 0.10 0.00 0.00 -0.55 0.00 0.00 56.30 56.30 1i6w h ASN 106 Cb 0.64 0.26 0.00 0.00 0.05 0.00 0.00 38.32 39.27 1i6w h ASN 106 CO 0.99 -0.23 0.00 0.54 -1.65 0.00 0.00 177.43 177.07 1i6w n ARG 107 N -5.32 0.01 0.24 0.81 1.74 -0.13 -1.04 116.66 112.96 1i6w n ARG 107 Ca -0.03 0.38 0.10 0.00 -0.77 0.00 0.00 57.85 57.53 1i6w n ARG 107 Cb 0.24 -1.50 0.57 0.00 -1.02 0.00 0.00 32.46 30.75 1i6w n ARG 107 CO 0.00 0.00 0.00 -0.07 -1.52 0.00 0.00 177.63 176.04 1i6w h LEU 108 N 0.00 0.00 0.00 0.55 3.38 -1.76 -3.29 115.31 114.19 1i6w h LEU 108 Ca 0.00 0.00 -0.23 0.00 0.09 0.00 0.00 57.88 57.74 1i6w h LEU 108 Cb 0.03 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.74 1i6w h LEU 108 CO 0.00 0.20 -1.71 0.41 0.09 0.00 0.00 178.44 177.43 1i6w n THR 109 N -3.63 1.44 -3.54 0.22 -1.04 -0.21 -5.08 114.28 102.45 1i6w n THR 109 Ca -0.01 -0.11 -0.17 0.00 -2.04 0.00 0.00 64.05 61.72 1i6w n THR 109 Cb 0.33 -2.06 -0.06 0.00 -1.82 0.00 0.00 70.33 66.72 1i6w n THR 109 CO 0.00 0.00 0.00 0.28 -0.64 0.00 0.00 175.07 174.71 1i6w s THR 110 N -2.65 0.01 -2.61 12.58 -1.32 -0.93 -5.02 115.64 115.70 1i6w s THR 110 Ca -0.31 -0.07 0.23 0.00 -1.21 0.00 0.00 61.69 60.33 1i6w s THR 110 Cb 0.09 -0.96 0.37 0.00 -1.51 0.00 0.00 72.50 70.49 1i6w s THR 110 CO 0.42 -0.04 1.40 0.61 -2.21 0.00 0.00 174.62 174.81 1i6w n GLY 111 N 0.82 1.26 3.64 6.08 0.00 -1.26 -3.30 105.19 112.42 1i6w n GLY 111 Ca -0.19 -0.67 -0.29 0.00 0.00 0.00 0.00 46.02 44.86 1i6w n GLY 111 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1i6w s LYS 112 N -1.70 2.37 -0.97 1.61 1.02 -1.26 -0.09 119.74 120.72 1i6w s LYS 112 Ca 0.35 -0.94 -0.21 0.00 0.02 0.00 0.00 55.97 55.18 1i6w s LYS 112 Cb 0.21 -2.43 0.08 0.00 -0.52 0.00 0.00 37.83 35.18 1i6w s LYS 112 CO 0.31 0.52 1.29 0.00 -0.92 0.00 0.00 175.35 176.55 1i6w s ALA 113 N -1.33 3.00 -0.08 5.17 0.00 -0.43 -4.78 121.76 123.32 1i6w s ALA 113 Ca 0.24 -2.45 -0.35 0.00 0.00 0.00 0.00 51.96 49.41 1i6w s ALA 113 Cb -0.11 -4.30 -0.12 0.00 0.00 0.00 0.00 23.12 18.59 1i6w s ALA 113 CO 0.17 -3.32 1.84 1.28 0.00 0.00 0.00 175.76 175.73 1i6w n LEU 114 N 7.87 3.32 0.25 0.00 4.77 -1.26 -4.89 117.00 127.05 1i6w n LEU 114 Ca 0.27 0.99 0.12 0.00 -0.03 0.00 0.00 56.01 57.36 1i6w n LEU 114 Cb 0.50 -1.36 0.66 0.00 -2.33 0.00 0.00 43.42 40.89 1i6w n LEU 114 CO 0.59 -0.11 0.93 1.55 -1.33 0.00 0.00 177.39 179.02 1i6w h PRO 115 N 8.73 0.00 0.00 3.23 0.13 -1.93 -3.40 132.00 138.75 1i6w h PRO 115 Ca -0.48 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 1i6w h PRO 115 Cb 1.27 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.40 1i6w h PRO 115 CO 0.94 0.15 0.00 0.41 -0.23 0.00 0.00 178.00 179.28 1i6w n GLY 116 N -0.53 -2.40 0.63 1.56 0.00 -1.26 -1.21 105.19 101.99 1i6w n GLY 116 Ca -0.01 -1.83 0.06 0.00 0.00 0.00 0.00 46.02 44.23 1i6w n GLY 116 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1i6w n THR 117 N -0.13 0.92 -3.28 2.61 -2.24 0.31 -4.90 114.28 107.58 1i6w n THR 117 Ca 0.00 -0.96 -0.44 0.00 -2.27 0.00 0.00 64.05 60.38 1i6w n THR 117 Cb 0.00 0.56 -0.07 0.00 -2.10 0.00 0.00 70.33 68.72 1i6w n THR 117 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1i6w s ASP 118 N -0.99 6.19 0.63 3.42 2.15 -1.26 -4.89 116.67 121.92 1i6w s ASP 118 Ca 0.23 -1.01 0.36 0.00 0.43 0.00 0.00 52.55 52.56 1i6w s ASP 118 Cb 0.12 -2.24 2.06 0.00 -0.30 0.00 0.00 42.92 42.57 1i6w s ASP 118 CO 0.16 -0.73 2.26 1.55 -0.17 0.00 0.00 175.17 178.24 1i6w h PRO 119 N 8.85 0.00 0.00 4.34 0.13 -1.96 -2.37 132.00 140.99 1i6w h PRO 119 Ca -0.28 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.85 1i6w h PRO 119 Cb 1.10 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.23 1i6w h PRO 119 CO 0.90 0.00 -0.45 0.09 -0.23 0.00 0.00 178.00 178.30 1i6w n ASN 120 N -3.42 0.52 -3.17 1.44 3.02 -1.26 -4.80 115.26 107.59 1i6w n ASN 120 Ca -0.02 0.04 0.02 0.00 -0.03 0.00 0.00 54.58 54.59 1i6w n ASN 120 Cb 0.14 0.06 -0.02 0.00 -0.61 0.00 0.00 39.78 39.34 1i6w n ASN 120 CO 0.00 0.00 0.00 -1.58 -2.62 0.00 0.00 177.26 173.06 1i6w s GLN 121 N -3.07 0.54 0.49 3.52 0.74 -0.89 -5.15 119.66 115.84 1i6w s GLN 121 Ca 0.10 0.86 -0.21 0.00 0.05 0.00 0.00 55.36 56.16 1i6w s GLN 121 Cb 0.16 0.38 -0.08 0.00 1.10 0.00 0.00 33.01 34.57 1i6w s GLN 121 CO 0.68 -0.70 1.07 0.15 -0.55 0.00 0.00 175.29 175.94 1i6w s LYS 122 N 2.82 3.73 0.18 1.67 1.02 -1.26 -4.54 119.74 123.35 1i6w s LYS 122 Ca 0.18 1.47 -0.30 0.00 0.02 0.00 0.00 55.97 57.34 1i6w s LYS 122 Cb -0.14 -2.15 -0.09 0.00 -0.52 0.00 0.00 37.83 34.93 1i6w s LYS 122 CO -0.22 -0.51 1.36 0.42 -0.92 0.00 0.00 175.35 175.49 1i6w s ILE 123 N -1.86 3.14 -0.14 2.17 1.01 -0.35 -5.00 121.20 120.19 1i6w s ILE 123 Ca 0.67 0.90 -0.07 0.00 0.00 0.00 0.00 60.65 62.15 1i6w s ILE 123 Cb -0.20 -3.58 -0.04 0.00 0.01 0.00 0.00 42.46 38.66 1i6w s ILE 123 CO 0.24 0.11 0.12 -0.76 0.00 0.00 0.00 174.94 174.65 1i6w s LEU 124 N 0.26 4.23 0.05 2.97 1.43 -0.77 -4.65 118.68 122.19 1i6w s LEU 124 Ca 0.60 0.36 0.08 0.00 -1.03 0.00 0.00 54.13 54.14 1i6w s LEU 124 Cb -0.38 -2.04 -0.03 0.00 0.03 0.00 0.00 46.19 43.78 1i6w s LEU 124 CO 0.36 0.35 -0.23 -0.31 0.23 0.00 0.00 176.35 176.75 1i6w s TYR 125 N -0.66 2.06 -0.11 0.29 1.51 -0.35 -0.81 117.35 119.28 1i6w s TYR 125 Ca 0.13 -0.39 -0.02 0.00 -1.01 0.00 0.00 57.07 55.78 1i6w s TYR 125 Cb -0.12 -1.23 0.04 0.00 -0.11 0.00 0.00 41.96 40.54 1i6w s TYR 125 CO 0.02 0.11 -0.00 0.99 -1.11 0.00 0.00 175.55 175.57 1i6w s THR 126 N -0.81 0.50 -0.31 -0.71 2.01 -0.26 -1.11 115.64 114.95 1i6w s THR 126 Ca 0.10 -0.10 -0.05 0.00 0.31 0.00 0.00 61.69 61.95 1i6w s THR 126 Cb -0.09 -0.73 0.03 0.00 0.01 0.00 0.00 72.50 71.72 1i6w s THR 126 CO 0.02 0.16 0.05 -0.55 -0.69 0.00 0.00 174.62 173.60 1i6w s SER 127 N 1.91 5.01 -0.22 3.53 0.15 -0.02 -1.25 113.70 122.80 1i6w s SER 127 Ca 0.03 -1.05 -0.09 0.00 0.70 0.00 0.00 55.95 55.54 1i6w s SER 127 Cb -0.13 -1.80 -0.05 0.00 -1.71 0.00 0.00 66.02 62.33 1i6w s SER 127 CO -0.06 -0.25 0.13 -0.63 1.20 0.00 0.00 173.24 173.62 1i6w s ILE 128 N 1.37 5.16 -0.00 6.45 1.01 -0.08 -0.33 121.20 134.77 1i6w s ILE 128 Ca -0.02 0.11 -0.07 0.00 0.00 0.00 0.00 60.65 60.68 1i6w s ILE 128 Cb -0.19 -3.38 0.00 0.00 0.01 0.00 0.00 42.46 38.90 1i6w s ILE 128 CO 0.01 0.39 0.13 -0.72 0.00 0.00 0.00 174.94 174.74 1i6w s TYR 129 N 0.83 0.03 -0.09 3.97 -0.85 -0.48 -0.64 117.35 120.11 1i6w s TYR 129 Ca 0.06 -0.09 -0.01 0.00 -0.52 0.00 0.00 57.07 56.52 1i6w s TYR 129 Cb -0.13 -0.04 -0.03 0.00 0.38 0.00 0.00 41.96 42.14 1i6w s TYR 129 CO 0.02 -0.25 -0.05 0.45 -1.52 0.00 0.00 175.55 174.20 1i6w s SER 130 N -1.19 4.80 0.34 -0.18 0.15 -1.26 -0.85 113.70 115.51 1i6w s SER 130 Ca -0.13 -0.02 0.26 0.00 0.70 0.00 0.00 55.95 56.76 1i6w s SER 130 Cb -0.07 -1.38 1.18 0.00 -1.71 0.00 0.00 66.02 64.04 1i6w s SER 130 CO 0.01 0.32 1.78 0.77 1.20 0.00 0.00 173.24 177.32 1i6w h SER 131 N 5.59 0.00 -0.18 5.45 4.64 -1.57 -1.48 113.55 126.00 1i6w h SER 131 Ca -0.45 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.87 1i6w h SER 131 Cb 1.18 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.27 1i6w h SER 131 CO 0.55 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 176.51 1i6w n ALA 132 N -1.84 2.51 -2.26 5.18 0.00 -1.26 -4.88 120.51 117.96 1i6w n ALA 132 Ca 0.01 -0.55 -0.43 0.00 0.00 0.00 0.00 53.44 52.47 1i6w n ALA 132 Cb 0.18 -1.07 -0.02 0.00 0.00 0.00 0.00 19.45 18.53 1i6w n ALA 132 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1i6w s ASP 133 N -1.56 6.77 0.00 0.00 -1.08 -0.56 -4.60 116.67 115.63 1i6w s ASP 133 Ca 0.33 1.80 0.21 0.00 -0.52 0.00 0.00 52.55 54.37 1i6w s ASP 133 Cb 0.18 -2.54 0.33 0.00 -1.46 0.00 0.00 42.92 39.43 1i6w s ASP 133 CO 0.27 -0.90 1.31 0.23 0.52 0.00 0.00 175.17 176.59 1i6w n MET 134 N 6.96 2.30 -0.11 4.34 2.81 -1.26 -4.53 117.12 127.63 1i6w n MET 134 Ca 0.16 -2.09 -0.23 0.00 -1.81 0.00 0.00 57.70 53.73 1i6w n MET 134 Cb 0.44 -1.46 -0.08 0.00 -0.71 0.00 0.00 33.22 31.41 1i6w n MET 134 CO 0.00 0.00 0.00 -0.89 1.51 0.00 0.00 175.97 176.59 1i6w n ILE 135 N 1.32 1.21 -4.04 2.02 2.08 -1.26 -4.96 119.36 115.74 1i6w n ILE 135 Ca 0.16 -0.33 -0.34 0.00 0.56 0.00 0.00 62.75 62.81 1i6w n ILE 135 Cb 0.56 -1.72 -0.15 0.00 -0.75 0.00 0.00 39.64 37.58 1i6w n ILE 135 CO 0.00 0.00 0.00 -0.69 0.56 0.00 0.00 176.55 176.42 1i6w s VAL 136 N -2.41 2.56 0.33 1.39 1.01 -1.26 -5.10 120.40 116.92 1i6w s VAL 136 Ca -0.31 -0.81 -0.29 0.00 0.00 0.00 0.00 61.98 60.57 1i6w s VAL 136 Cb 0.11 -2.14 -0.11 0.00 0.00 0.00 0.00 36.38 34.24 1i6w s VAL 136 CO 0.40 0.46 1.53 0.80 0.00 0.00 0.00 175.10 178.30 1i6w n MET 137 N 4.68 2.64 -0.13 2.72 1.56 -1.26 -4.85 117.12 122.48 1i6w n MET 137 Ca -0.20 0.93 0.13 0.00 -0.27 0.00 0.00 57.70 58.30 1i6w n MET 137 Cb 0.50 -2.68 0.50 0.00 2.15 0.00 0.00 33.22 33.69 1i6w n MET 137 CO 0.00 0.00 0.00 -0.91 -0.73 0.00 0.00 175.97 174.33 1i6w h ASN 138 N 3.91 0.39 -0.86 6.12 2.35 -1.90 -0.53 115.58 125.06 1i6w h ASN 138 Ca -0.48 0.01 0.04 0.00 -0.55 0.00 0.00 56.30 55.32 1i6w h ASN 138 Cb 1.24 -0.06 -0.05 0.00 0.05 0.00 0.00 38.32 39.49 1i6w h ASN 138 CO 0.72 0.22 0.57 0.22 -1.65 0.00 0.00 177.43 177.51 1i6w h TYR 139 N 0.42 1.03 0.00 1.19 3.20 -1.95 -1.15 116.97 119.71 1i6w h TYR 139 Ca 0.32 0.03 -0.04 0.00 3.14 0.00 0.00 58.73 62.18 1i6w h TYR 139 Cb 0.69 -0.34 -0.01 0.00 1.54 0.00 0.00 36.73 38.61 1i6w h TYR 139 CO -0.00 0.60 -0.21 -0.07 -1.64 0.00 0.00 178.16 176.84 1i6w h LEU 140 N 1.06 0.00 0.02 2.82 3.38 -1.41 -3.07 115.31 118.11 1i6w h LEU 140 Ca 0.34 0.00 -0.25 0.00 0.09 0.00 0.00 57.88 58.06 1i6w h LEU 140 Cb 0.04 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.76 1i6w h LEU 140 CO -0.10 0.21 -1.29 0.28 0.09 0.00 0.00 178.44 177.63 1i6w h SER 141 N 0.00 0.08 -3.41 -0.43 0.02 -1.16 -0.15 113.55 108.51 1i6w h SER 141 Ca -0.00 -0.10 -0.53 0.00 -0.84 0.00 0.00 61.79 60.32 1i6w h SER 141 Cb 0.55 -0.03 0.06 0.00 0.14 0.00 0.00 62.40 63.13 1i6w h SER 141 CO 0.03 1.09 0.75 -0.13 -1.14 0.00 0.00 176.83 177.43 1i6w s ARG 142 N -2.66 4.27 -0.14 3.45 0.52 -0.85 -4.75 118.95 118.79 1i6w s ARG 142 Ca -0.02 2.30 0.02 0.00 -0.52 0.00 0.00 55.73 57.51 1i6w s ARG 142 Cb 0.09 -3.11 0.01 0.00 0.52 0.00 0.00 34.95 32.46 1i6w s ARG 142 CO 0.83 -0.41 -0.22 -0.51 0.02 0.00 0.00 175.30 175.01 1i6w s LEU 143 N -0.46 2.13 -0.20 2.53 1.43 -1.26 -4.72 118.68 118.13 1i6w s LEU 143 Ca 0.59 -0.60 -0.29 0.00 -1.03 0.00 0.00 54.13 52.80 1i6w s LEU 143 Cb -0.42 -1.45 -0.04 0.00 0.03 0.00 0.00 46.19 44.31 1i6w s LEU 143 CO 0.44 0.08 1.87 -1.81 0.23 0.00 0.00 176.35 177.16 1i6w s ASP 144 N 0.82 6.06 0.00 2.29 1.01 0.88 -1.89 116.67 125.83 1i6w s ASP 144 Ca -0.07 1.81 0.00 0.00 0.71 0.00 0.00 52.55 55.00 1i6w s ASP 144 Cb -0.15 -2.52 0.00 0.00 1.01 0.00 0.00 42.92 41.25 1i6w s ASP 144 CO -0.02 -1.49 0.00 0.61 0.21 0.00 0.00 175.17 174.48 1i6w n GLY 145 N 5.07 1.84 3.98 0.21 0.00 -1.26 -1.31 105.19 113.72 1i6w n GLY 145 Ca 0.23 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 46.01 1i6w n GLY 145 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1i6w s ALA 146 N -2.28 3.64 -0.55 4.61 0.00 -0.79 0.13 121.76 126.52 1i6w s ALA 146 Ca 0.00 -1.57 -0.21 0.00 0.00 0.00 0.00 51.96 50.18 1i6w s ALA 146 Cb 0.00 -2.10 0.06 0.00 0.00 0.00 0.00 23.12 21.09 1i6w s ALA 146 CO 0.00 -1.35 0.77 0.50 0.00 0.00 0.00 175.76 175.69 1i6w s ARG 147 N -5.10 3.16 -0.27 0.00 3.52 -0.66 -4.86 118.95 114.74 1i6w s ARG 147 Ca 0.64 -0.77 -0.18 0.00 -0.13 0.00 0.00 55.73 55.29 1i6w s ARG 147 Cb -0.07 -4.13 -0.02 0.00 -1.56 0.00 0.00 34.95 29.17 1i6w s ARG 147 CO 0.43 -1.43 0.52 -0.80 -0.81 0.00 0.00 175.30 173.22 1i6w s ASN 148 N 3.02 6.43 -0.23 -2.12 0.01 -1.26 -0.84 114.94 119.93 1i6w s ASN 148 Ca 0.20 0.47 -0.02 0.00 -0.71 0.00 0.00 52.86 52.80 1i6w s ASN 148 Cb -0.18 -2.28 0.02 0.00 0.41 0.00 0.00 41.25 39.22 1i6w s ASN 148 CO 0.13 -0.32 -0.07 -0.69 -1.51 0.00 0.00 177.10 174.64 1i6w s VAL 149 N 2.34 2.88 -0.22 1.60 1.01 0.55 -4.97 120.40 123.59 1i6w s VAL 149 Ca 0.21 -0.90 -0.11 0.00 0.00 0.00 0.00 61.98 61.18 1i6w s VAL 149 Cb -0.16 -2.41 -0.05 0.00 0.00 0.00 0.00 36.38 33.77 1i6w s VAL 149 CO 0.10 0.28 0.16 -1.58 0.00 0.00 0.00 175.10 174.06 1i6w s GLN 150 N 1.35 4.13 0.51 2.72 0.74 -1.26 -1.39 119.66 126.47 1i6w s GLN 150 Ca 0.02 -0.22 0.01 0.00 0.05 0.00 0.00 55.36 55.22 1i6w s GLN 150 Cb -0.16 -3.48 -0.01 0.00 1.10 0.00 0.00 33.01 30.46 1i6w s GLN 150 CO -0.05 0.17 0.01 0.96 -0.55 0.00 0.00 175.29 175.83 1i6w s ILE 151 N 0.72 1.19 0.12 -2.34 -4.36 -0.03 -4.98 121.20 111.53 1i6w s ILE 151 Ca 0.08 -1.99 -0.01 0.00 -0.26 0.00 0.00 60.65 58.47 1i6w s ILE 151 Cb -0.12 -2.18 -0.04 0.00 1.25 0.00 0.00 42.46 41.36 1i6w s ILE 151 CO 0.02 0.00 0.04 -1.00 0.24 0.00 0.00 174.94 174.23 1i6w s HIS 152 N -2.87 0.86 0.00 1.37 3.76 -1.26 -1.51 115.29 115.64 1i6w s HIS 152 Ca 0.07 -1.18 0.00 0.00 -0.15 0.00 0.00 55.06 53.79 1i6w s HIS 152 Cb 0.02 -0.50 0.00 0.00 1.11 0.00 0.00 32.58 33.21 1i6w s HIS 152 CO 0.04 -0.46 0.00 0.41 -0.85 0.00 0.00 174.74 173.88 1i6w n GLY 153 N -0.08 0.70 3.67 -2.22 0.00 -1.26 -4.93 105.19 101.06 1i6w n GLY 153 Ca -0.07 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.60 1i6w n GLY 153 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1i6w s VAL 154 N -2.59 4.76 0.80 1.61 1.01 -1.26 -4.98 120.40 119.76 1i6w s VAL 154 Ca 0.00 -0.05 -0.12 0.00 0.00 0.00 0.00 61.98 61.81 1i6w s VAL 154 Cb 0.00 -3.11 0.07 0.00 0.00 0.00 0.00 36.38 33.34 1i6w s VAL 154 CO 0.00 0.51 1.15 -0.83 0.00 0.00 0.00 175.10 175.93 1i6w s GLY 155 N -0.05 1.60 0.14 4.51 0.00 -1.26 -3.82 107.32 108.43 1i6w s GLY 155 Ca 0.06 -0.52 -0.19 0.00 0.00 0.00 0.00 44.72 44.07 1i6w s GLY 155 CO 0.01 -0.05 1.70 0.84 0.00 0.00 0.00 173.10 175.60 1i6w h HIS 156 N -1.05 -0.13 -0.01 1.90 2.76 -1.94 -2.07 115.15 114.61 1i6w h HIS 156 Ca -0.47 0.02 -0.18 0.00 -2.20 0.00 0.00 60.37 57.54 1i6w h HIS 156 Cb 1.31 0.10 -0.01 0.00 1.55 0.00 0.00 27.41 30.35 1i6w h HIS 156 CO 0.36 -0.11 -0.81 0.82 -1.30 0.00 0.00 177.93 176.90 1i6w h ILE 157 N -0.00 1.48 0.00 6.26 1.08 -2.00 -3.11 117.51 121.22 1i6w h ILE 157 Ca 0.12 -2.48 0.00 0.00 -0.39 0.00 0.00 64.86 62.10 1i6w h ILE 157 Cb 0.18 2.36 0.00 0.00 -3.07 0.00 0.00 36.82 36.29 1i6w h ILE 157 CO -0.25 0.72 0.00 1.23 -0.69 0.00 0.00 178.15 179.17 1i6w h GLY 158 N 1.80 0.00 1.95 5.37 0.00 -1.76 -1.86 103.07 108.57 1i6w h GLY 158 Ca -0.03 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.30 1i6w h GLY 158 CO 0.12 0.00 0.02 1.41 0.00 0.00 0.00 176.54 178.09 1i6w h LEU 159 N 0.00 0.00 0.00 3.11 3.38 -1.32 -0.80 115.31 119.68 1i6w h LEU 159 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1i6w h LEU 159 Cb 0.01 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.76 1i6w h LEU 159 CO 0.00 0.00 -0.30 0.18 0.09 0.00 0.00 178.44 178.41 1i6w n LEU 160 N -3.60 0.48 -2.66 1.67 4.77 -0.70 -4.16 117.00 112.80 1i6w n LEU 160 Ca -0.03 0.31 -0.14 0.00 -0.03 0.00 0.00 56.01 56.12 1i6w n LEU 160 Cb 0.10 -0.31 0.02 0.00 -2.33 0.00 0.00 43.42 40.90 1i6w n LEU 160 CO 0.25 -0.02 -0.05 -1.22 -1.33 0.00 0.00 177.39 175.03 1i6w n TYR 161 N -1.82 1.70 -4.93 -1.77 4.01 -0.32 -4.23 117.16 109.81 1i6w n TYR 161 Ca 0.05 -2.98 -0.29 0.00 -0.16 0.00 0.00 57.90 54.52 1i6w n TYR 161 Cb 0.38 -0.31 -0.17 0.00 -0.31 0.00 0.00 39.34 38.93 1i6w n TYR 161 CO 0.00 0.00 0.00 0.45 -0.46 0.00 0.00 176.86 176.85 1i6w s SER 162 N -3.18 2.60 0.20 7.72 0.15 -1.14 -5.00 113.70 115.04 1i6w s SER 162 Ca 0.34 -0.46 -0.08 0.00 0.70 0.00 0.00 55.95 56.44 1i6w s SER 162 Cb 0.43 -1.19 0.13 0.00 -1.71 0.00 0.00 66.02 63.68 1i6w s SER 162 CO -0.03 0.10 1.71 0.28 1.20 0.00 0.00 173.24 176.50 1i6w h SER 163 N 6.87 1.06 -0.52 5.45 0.02 -1.95 -0.41 113.55 124.07 1i6w h SER 163 Ca -0.24 -0.24 -0.02 0.00 -0.84 0.00 0.00 61.79 60.44 1i6w h SER 163 Cb 1.22 -0.28 -0.02 0.00 0.14 0.00 0.00 62.40 63.45 1i6w h SER 163 CO 0.48 1.03 0.24 -0.61 -1.14 0.00 0.00 176.83 176.83 1i6w h GLN 164 N 1.05 0.75 -0.56 3.45 4.15 -1.99 -2.38 115.11 119.57 1i6w h GLN 164 Ca 0.21 -0.12 -0.09 0.00 0.77 0.00 0.00 58.65 59.42 1i6w h GLN 164 Cb 0.41 -0.13 -0.02 0.00 0.21 0.00 0.00 27.48 27.95 1i6w h GLN 164 CO 0.01 0.63 -0.00 0.28 -1.93 0.00 0.00 178.83 177.81 1i6w h VAL 165 N 0.69 1.26 -0.49 2.39 2.07 -1.84 -2.78 116.25 117.56 1i6w h VAL 165 Ca 0.18 -1.13 0.06 0.00 0.82 0.00 0.00 66.70 66.63 1i6w h VAL 165 Cb 0.13 0.87 -0.06 0.00 -1.52 0.00 0.00 31.29 30.72 1i6w h VAL 165 CO -0.02 0.41 0.18 0.78 0.02 0.00 0.00 177.57 178.93 1i6w h ASN 166 N 0.88 0.19 -0.72 0.57 2.35 -0.80 0.10 115.58 118.15 1i6w h ASN 166 Ca 0.16 0.06 -0.01 0.00 -0.55 0.00 0.00 56.30 55.96 1i6w h ASN 166 Cb 0.55 0.04 -0.04 0.00 0.05 0.00 0.00 38.32 38.92 1i6w h ASN 166 CO 0.03 0.14 0.41 0.28 -1.65 0.00 0.00 177.43 176.64 1i6w h SER 167 N 0.36 0.89 0.01 5.81 0.02 -1.32 -1.20 113.55 118.12 1i6w h SER 167 Ca 0.23 -0.06 -0.15 0.00 -0.84 0.00 0.00 61.79 60.97 1i6w h SER 167 Cb 0.24 -0.23 -0.01 0.00 0.14 0.00 0.00 62.40 62.55 1i6w h SER 167 CO -0.23 0.71 -0.50 -0.07 -1.14 0.00 0.00 176.83 175.59 1i6w h LEU 168 N 1.01 0.60 -0.67 5.07 3.38 -1.01 -2.04 115.31 121.65 1i6w h LEU 168 Ca 0.26 -0.30 -0.04 0.00 0.09 0.00 0.00 57.88 57.89 1i6w h LEU 168 Cb 0.01 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 40.55 1i6w h LEU 168 CO -0.04 1.00 0.26 0.40 0.09 0.00 0.00 178.44 180.15 1i6w h ILE 169 N 0.43 1.24 -0.44 1.22 2.04 -0.31 -1.48 117.51 120.21 1i6w h ILE 169 Ca 0.02 -0.77 -0.01 0.00 1.00 0.00 0.00 64.86 65.10 1i6w h ILE 169 Cb 1.03 0.48 -0.02 0.00 -0.74 0.00 0.00 36.82 37.57 1i6w h ILE 169 CO 0.09 0.30 0.24 0.50 0.00 0.00 0.00 178.15 179.29 1i6w h LYS 170 N 0.96 0.61 -0.83 2.37 3.64 -1.00 -0.23 116.57 122.09 1i6w h LYS 170 Ca 0.22 -0.07 0.03 0.00 -1.27 0.00 0.00 60.65 59.56 1i6w h LYS 170 Cb 0.22 -0.12 -0.05 0.00 -0.41 0.00 0.00 32.23 31.87 1i6w h LYS 170 CO -0.02 0.49 0.55 0.93 -2.27 0.00 0.00 179.45 179.13 1i6w h GLU 171 N 0.58 1.02 -0.38 1.90 5.08 -1.07 -0.06 114.58 121.65 1i6w h GLU 171 Ca 0.15 -0.06 -0.08 0.00 -1.00 0.00 0.00 59.36 58.37 1i6w h GLU 171 Cb 0.05 -0.23 -0.01 0.00 0.50 0.00 0.00 28.75 29.06 1i6w h GLU 171 CO -0.02 0.68 -0.09 0.78 -1.00 0.00 0.00 179.01 179.35 1i6w h GLY 172 N 1.06 0.80 2.00 -3.84 0.00 -0.63 0.43 103.07 102.88 1i6w h GLY 172 Ca 0.32 -0.66 0.00 0.00 0.00 0.00 0.00 47.33 47.00 1i6w h GLY 172 CO -0.09 0.60 0.00 1.41 0.00 0.00 0.00 176.54 178.46 1i6w h LEU 173 N 0.54 0.00 -0.42 3.11 3.38 -0.49 -1.90 115.31 119.53 1i6w h LEU 173 Ca 0.10 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.07 1i6w h LEU 173 Cb 0.61 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.36 1i6w h LEU 173 CO 0.04 0.00 -0.01 0.59 0.09 0.00 0.00 178.44 179.14 1i6w n ASN 174 N -2.63 0.67 0.00 -0.43 3.02 -0.09 -4.88 115.26 110.91 1i6w n ASN 174 Ca 0.02 -1.15 0.00 0.00 -0.03 0.00 0.00 54.58 53.42 1i6w n ASN 174 Cb 0.31 -0.01 0.00 0.00 -0.61 0.00 0.00 39.78 39.47 1i6w n ASN 174 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1i6w n GLY 175 N 1.11 0.91 0.00 7.41 0.00 -0.71 -4.98 105.19 108.92 1i6w n GLY 175 Ca 0.21 -0.12 0.13 0.00 0.00 0.00 0.00 46.02 46.23 1i6w n GLY 175 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1i6w n GLY 176 N -2.14 -0.98 3.68 -0.02 0.00 0.12 -4.87 105.19 100.97 1i6w n GLY 176 Ca 0.00 -0.16 -0.29 0.00 0.00 0.00 0.00 46.02 45.56 1i6w n GLY 176 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1i6w s GLY 177 N -1.83 1.60 0.16 -0.02 0.00 -1.26 -4.88 107.32 101.09 1i6w s GLY 177 Ca 0.39 -0.78 -0.02 0.00 0.00 0.00 0.00 44.72 44.31 1i6w s GLY 177 CO 0.30 -0.02 0.12 1.20 0.00 0.00 0.00 173.10 174.70 1i6w s GLN 178 N -5.34 1.07 -0.51 2.90 -0.21 -0.27 -4.67 119.66 112.64 1i6w s GLN 178 Ca 0.69 -1.49 0.06 0.00 0.02 0.00 0.00 55.36 54.64 1i6w s GLN 178 Cb -0.12 0.27 0.20 0.00 1.00 0.00 0.00 33.01 34.36 1i6w s GLN 178 CO 0.56 -0.34 0.77 -1.71 -2.12 0.00 0.00 175.29 172.45 1i6w n ASN 179 N -0.18 -3.31 -1.23 5.90 2.85 -0.92 -1.21 115.26 117.16 1i6w n ASN 179 Ca -0.03 -2.89 0.00 0.00 -0.11 0.00 0.00 54.58 51.56 1i6w n ASN 179 Cb 0.64 1.73 0.00 0.00 1.24 0.00 0.00 39.78 43.39 1i6w n ASN 179 CO 0.00 0.00 0.00 0.35 -2.11 0.00 0.00 177.26 175.50 1i6w n THR 180 N 2.75 0.91 0.85 -0.44 -2.24 0.12 -4.99 114.28 111.25 1i6w n THR 180 Ca 0.17 -0.12 0.10 0.00 -2.27 0.00 0.00 64.05 61.93 1i6w n THR 180 Cb 0.57 -1.01 0.09 0.00 -2.10 0.00 0.00 70.33 67.88 1i6w n THR 180 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09