#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3g1h s MET 9 N 0.00 4.22 -0.52 7.34 -2.45 -1.26 -4.98 119.30 121.65 3g1h s MET 9 Ca 0.00 2.19 -0.07 0.00 -1.25 0.00 0.00 55.69 56.56 3g1h s MET 9 Cb 0.00 -2.96 0.14 0.00 1.25 0.00 0.00 34.83 33.26 3g1h s MET 9 CO 0.00 -0.29 0.38 0.34 1.05 0.00 0.00 175.02 176.50 3g1h s ASP 10 N -0.59 5.61 -0.34 1.11 3.68 -1.26 -5.06 116.67 119.82 3g1h s ASP 10 Ca 0.52 -2.21 -0.18 0.00 2.13 0.00 0.00 52.55 52.80 3g1h s ASP 10 Cb -0.39 -1.96 -0.01 0.00 -1.45 0.00 0.00 42.92 39.12 3g1h s ASP 10 CO 0.51 -0.58 0.51 -0.69 0.13 0.00 0.00 175.17 175.05 3g1h s VAL 11 N 0.90 5.02 0.16 1.11 1.01 -1.26 -4.98 120.40 122.37 3g1h s VAL 11 Ca 0.10 0.37 -0.34 0.00 0.00 0.00 0.00 61.98 62.11 3g1h s VAL 11 Cb -0.23 -3.95 -0.14 0.00 0.00 0.00 0.00 36.38 32.05 3g1h s VAL 11 CO -0.03 -0.20 1.50 0.80 0.00 0.00 0.00 175.10 177.17 3g1h n MET 12 N 5.73 1.94 -0.99 2.72 1.56 -1.26 -1.29 117.12 125.53 3g1h n MET 12 Ca -0.05 0.70 -0.03 0.00 -0.27 0.00 0.00 57.70 58.05 3g1h n MET 12 Cb 0.49 -2.42 -0.01 0.00 2.15 0.00 0.00 33.22 33.42 3g1h n MET 12 CO 0.00 0.00 0.00 0.09 -0.73 0.00 0.00 175.97 175.33 3g1h n ASN 13 N 3.02 -5.10 -1.75 6.12 3.02 -1.26 -2.40 115.26 116.92 3g1h n ASN 13 Ca 0.16 0.08 -0.19 0.00 -0.03 0.00 0.00 54.58 54.60 3g1h n ASN 13 Cb 0.27 -3.31 -0.07 0.00 -0.61 0.00 0.00 39.78 36.07 3g1h n ASN 13 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 3g1h n ARG 14 N 0.29 -1.50 -4.40 3.52 1.74 -0.41 -4.96 116.66 110.94 3g1h n ARG 14 Ca -0.03 1.09 -0.33 0.00 -0.77 0.00 0.00 57.85 57.81 3g1h n ARG 14 Cb 0.46 -5.52 -0.16 0.00 -1.02 0.00 0.00 32.46 26.23 3g1h n ARG 14 CO 0.00 0.00 0.00 -1.17 -1.52 0.00 0.00 177.63 174.94 3g1h s LEU 15 N -4.86 2.36 -0.18 0.55 0.20 -1.01 -0.99 118.68 114.74 3g1h s LEU 15 Ca 0.00 -0.53 -0.05 0.00 0.69 0.00 0.00 54.13 54.24 3g1h s LEU 15 Cb 0.00 -1.54 -0.03 0.00 -0.43 0.00 0.00 46.19 44.20 3g1h s LEU 15 CO 0.00 0.05 -0.01 -0.63 -0.29 0.00 0.00 176.35 175.48 3g1h s ILE 16 N 1.00 4.00 -0.17 6.68 1.01 0.11 -4.63 121.20 129.21 3g1h s ILE 16 Ca -0.02 -0.30 -0.26 0.00 0.00 0.00 0.00 60.65 60.06 3g1h s ILE 16 Cb -0.15 -2.79 -0.01 0.00 0.01 0.00 0.00 42.46 39.52 3g1h s ILE 16 CO -0.04 0.45 0.88 -0.22 0.00 0.00 0.00 174.94 176.01 3g1h s LEU 17 N 0.75 4.18 -0.69 2.97 2.96 -1.00 -1.15 118.68 126.70 3g1h s LEU 17 Ca -0.00 1.24 -0.19 0.00 -0.22 0.00 0.00 54.13 54.96 3g1h s LEU 17 Cb -0.14 -3.31 0.11 0.00 0.50 0.00 0.00 46.19 43.35 3g1h s LEU 17 CO 0.02 -0.43 0.84 0.00 -1.32 0.00 0.00 176.35 175.46 3g1h s ALA 18 N 2.23 3.41 -0.99 5.97 0.00 -0.96 0.82 121.76 132.23 3g1h s ALA 18 Ca 0.40 -2.36 -0.20 0.00 0.00 0.00 0.00 51.96 49.80 3g1h s ALA 18 Cb -0.17 -3.69 0.11 0.00 0.00 0.00 0.00 23.12 19.37 3g1h s ALA 18 CO 0.13 -2.55 1.28 1.41 0.00 0.00 0.00 175.76 176.03 3g1h s MET 19 N 2.71 3.65 -0.06 0.00 1.75 -0.27 -4.43 119.30 122.65 3g1h s MET 19 Ca 0.18 -1.63 0.16 0.00 -1.25 0.00 0.00 55.69 53.16 3g1h s MET 19 Cb -0.18 -5.09 0.53 0.00 2.84 0.00 0.00 34.83 32.93 3g1h s MET 19 CO 0.03 -1.93 1.45 -0.25 -0.65 0.00 0.00 175.02 173.67 3g1h n ASP 20 N 7.30 3.83 -4.76 1.11 8.00 -1.26 -4.40 116.55 126.37 3g1h n ASP 20 Ca 0.29 -2.26 -0.38 0.00 0.71 0.00 0.00 54.79 53.14 3g1h n ASP 20 Cb 0.49 -0.43 0.01 0.00 -0.02 0.00 0.00 41.12 41.17 3g1h n ASP 20 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 3g1h s LEU 21 N -1.48 4.04 0.00 0.64 1.43 -1.26 -4.65 118.68 117.40 3g1h s LEU 21 Ca 0.40 2.60 0.20 0.00 -1.03 0.00 0.00 54.13 56.30 3g1h s LEU 21 Cb 0.24 -4.12 0.53 0.00 0.03 0.00 0.00 46.19 42.88 3g1h s LEU 21 CO 0.21 -1.11 1.45 0.23 0.23 0.00 0.00 176.35 177.36 3g1h n MET 22 N -0.42 2.35 -4.25 1.70 2.81 -1.26 -4.23 117.12 113.82 3g1h n MET 22 Ca 0.07 -2.08 -0.18 0.00 -1.81 0.00 0.00 57.70 53.70 3g1h n MET 22 Cb 0.45 -1.47 -0.15 0.00 -0.71 0.00 0.00 33.22 31.34 3g1h n MET 22 CO 0.00 0.00 0.00 0.54 1.51 0.00 0.00 175.97 178.02 3g1h s ASN 23 N -1.21 0.87 0.31 7.83 2.20 -1.26 -4.67 114.94 119.02 3g1h s ASN 23 Ca 0.39 -0.13 0.08 0.00 -0.94 0.00 0.00 52.86 52.26 3g1h s ASN 23 Cb 0.21 -0.18 0.86 0.00 -2.00 0.00 0.00 41.25 40.14 3g1h s ASN 23 CO 0.29 0.06 1.69 -0.09 -2.94 0.00 0.00 177.10 176.10 3g1h h ARG 24 N 6.26 0.39 -0.08 3.55 2.43 -1.93 -2.08 114.38 122.91 3g1h h ARG 24 Ca -0.32 -0.02 -0.03 0.00 -0.81 0.00 0.00 59.98 58.80 3g1h h ARG 24 Cb 1.18 -0.09 -0.00 0.00 -0.42 0.00 0.00 29.97 30.64 3g1h h ARG 24 CO 0.49 0.26 -0.05 -0.44 -1.51 0.00 0.00 179.97 178.72 3g1h h ASP 25 N 0.40 0.19 -0.64 -3.80 3.32 -2.00 -2.39 116.42 111.51 3g1h h ASP 25 Ca 0.63 -0.44 -0.09 0.00 0.02 0.00 0.00 57.03 57.15 3g1h h ASP 25 Cb 1.27 -0.05 -0.02 0.00 0.22 0.00 0.00 39.33 40.74 3g1h h ASP 25 CO -0.55 0.59 0.06 0.44 -1.72 0.00 0.00 179.24 178.05 3g1h h ASP 26 N -0.20 1.06 0.19 6.45 3.32 -1.95 -2.37 116.42 122.91 3g1h h ASP 26 Ca 0.02 -0.28 -0.01 0.00 0.02 0.00 0.00 57.03 56.78 3g1h h ASP 26 Cb 0.52 -0.28 0.00 0.00 0.22 0.00 0.00 39.33 39.79 3g1h h ASP 26 CO 0.01 1.08 -0.10 0.00 -1.72 0.00 0.00 179.24 178.52 3g1h h ALA 27 N 1.02 -0.26 -0.79 3.45 0.00 -1.40 -1.42 119.26 119.87 3g1h h ALA 27 Ca 0.19 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 55.03 3g1h h ALA 27 Cb 0.50 0.11 -0.04 0.00 0.00 0.00 0.00 17.79 18.35 3g1h h ALA 27 CO 0.02 -0.65 0.44 -0.07 0.00 0.00 0.00 179.25 179.00 3g1h h LEU 28 N -0.26 0.96 0.10 0.00 3.38 -1.44 -1.52 115.31 116.53 3g1h h LEU 28 Ca -0.02 -0.07 -0.00 0.00 0.09 0.00 0.00 57.88 57.87 3g1h h LEU 28 Cb 0.21 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 40.71 3g1h h LEU 28 CO 0.04 0.76 -0.05 -0.09 0.09 0.00 0.00 178.44 179.19 3g1h h ARG 29 N 1.09 -0.12 -0.01 1.13 2.43 -1.11 -0.91 114.38 116.88 3g1h h ARG 29 Ca 0.28 0.01 -0.09 0.00 -0.81 0.00 0.00 59.98 59.37 3g1h h ARG 29 Cb 0.00 0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 29.57 3g1h h ARG 29 CO -0.05 0.08 -0.40 0.28 -1.51 0.00 0.00 179.97 178.37 3g1h h VAL 30 N -0.31 1.29 0.00 0.20 2.07 -1.17 -1.61 116.25 116.72 3g1h h VAL 30 Ca -0.01 -1.39 -0.13 0.00 0.82 0.00 0.00 66.70 65.99 3g1h h VAL 30 Cb 0.26 1.74 -0.02 0.00 -1.52 0.00 0.00 31.29 31.75 3g1h h VAL 30 CO 0.02 0.40 -0.61 0.74 0.02 0.00 0.00 177.57 178.14 3g1h h THR 31 N 0.01 1.21 -0.03 2.57 2.02 -1.19 -2.82 112.91 114.68 3g1h h THR 31 Ca -0.00 -2.28 -0.23 0.00 0.77 0.00 0.00 66.41 64.67 3g1h h THR 31 Cb 0.72 2.32 0.01 0.00 -1.74 0.00 0.00 68.15 69.45 3g1h h THR 31 CO 0.05 0.60 -0.91 1.23 0.37 0.00 0.00 175.52 176.87 3g1h h GLY 32 N 2.58 0.57 0.92 2.16 0.00 -0.67 -1.86 103.07 106.77 3g1h h GLY 32 Ca -0.01 -0.94 -0.02 0.00 0.00 0.00 0.00 47.33 46.36 3g1h h GLY 32 CO 0.08 0.83 -0.21 0.83 0.00 0.00 0.00 176.54 178.07 3g1h h GLU 33 N 0.31 -0.57 -0.01 4.80 5.08 -1.20 -2.94 114.58 120.05 3g1h h GLU 33 Ca -0.08 0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.32 3g1h h GLU 33 Cb 1.53 0.13 0.00 0.00 0.50 0.00 0.00 28.75 30.91 3g1h h GLU 33 CO 0.16 -0.33 0.00 1.33 -1.00 0.00 0.00 179.01 179.17 3g1h n VAL 34 N -5.31 0.00 -0.35 3.13 0.24 -1.08 -4.26 118.33 110.71 3g1h n VAL 34 Ca -0.11 -0.06 0.28 0.00 -2.04 0.00 0.00 64.34 62.41 3g1h n VAL 34 Cb 0.27 -0.25 0.58 0.00 -1.47 0.00 0.00 33.84 32.97 3g1h n VAL 34 CO 0.00 0.00 0.00 -0.09 -2.14 0.00 0.00 176.83 174.60 3g1h h ARG 35 N 0.56 0.26 -0.00 7.34 9.65 -1.14 0.19 114.38 131.23 3g1h h ARG 35 Ca 0.00 -0.02 0.00 0.00 -1.10 0.00 0.00 59.98 58.86 3g1h h ARG 35 Cb 0.12 -0.06 0.00 0.00 -1.39 0.00 0.00 29.97 28.64 3g1h h ARG 35 CO 0.00 0.17 -0.01 -0.85 2.80 0.00 0.00 179.97 182.08 3g1h n GLU 36 N -4.57 0.89 -0.06 0.20 0.28 -1.26 -3.58 120.64 112.54 3g1h n GLU 36 Ca 0.28 -0.11 -0.05 0.00 -0.16 0.00 0.00 57.16 57.12 3g1h n GLU 36 Cb 1.07 -1.50 -0.12 0.00 1.43 0.00 0.00 31.44 32.32 3g1h n GLU 36 CO 0.00 0.00 0.00 0.66 -0.16 0.00 0.00 177.13 177.63 3g1h n TYR 37 N -0.96 0.00 -4.13 -1.84 4.02 0.66 -5.01 117.16 109.89 3g1h n TYR 37 Ca 0.20 0.00 -0.16 0.00 -0.01 0.00 0.00 57.90 57.94 3g1h n TYR 37 Cb 0.18 -0.68 -0.12 0.00 -0.02 0.00 0.00 39.34 38.71 3g1h n TYR 37 CO 0.00 0.00 0.00 0.96 -1.01 0.00 0.00 176.86 176.81 3g1h s ILE 38 N -2.44 0.88 0.00 -0.72 -5.25 -1.06 -4.45 121.20 108.16 3g1h s ILE 38 Ca -0.07 -1.29 0.00 0.00 -0.99 0.00 0.00 60.65 58.30 3g1h s ILE 38 Cb 0.05 -0.97 0.00 0.00 2.95 0.00 0.00 42.46 44.49 3g1h s ILE 38 CO 0.61 -0.34 0.63 -0.90 -1.79 0.00 0.00 174.94 173.14 3g1h n ASP 39 N 1.20 1.09 -3.97 4.36 5.75 -1.26 -4.62 116.55 119.11 3g1h n ASP 39 Ca -0.21 -1.39 -0.29 0.00 -0.01 0.00 0.00 54.79 52.90 3g1h n ASP 39 Cb 0.55 0.00 -0.17 0.00 -1.03 0.00 0.00 41.12 40.47 3g1h n ASP 39 CO 0.00 0.00 0.00 -0.89 -0.11 0.00 0.00 177.20 176.20 3g1h s THR 40 N -0.39 1.34 -0.07 2.12 2.01 -1.26 -0.29 115.64 119.10 3g1h s THR 40 Ca 0.00 -0.49 0.05 0.00 0.31 0.00 0.00 61.69 61.55 3g1h s THR 40 Cb 0.00 -1.30 -0.01 0.00 0.01 0.00 0.00 72.50 71.20 3g1h s THR 40 CO 0.00 0.41 -0.23 -0.69 -0.69 0.00 0.00 174.62 173.43 3g1h s VAL 41 N 1.58 2.26 -0.27 3.82 1.01 0.51 -2.37 120.40 126.95 3g1h s VAL 41 Ca 0.05 -0.98 -0.13 0.00 0.00 0.00 0.00 61.98 60.91 3g1h s VAL 41 Cb -0.13 -1.85 -0.04 0.00 0.00 0.00 0.00 36.38 34.36 3g1h s VAL 41 CO -0.10 0.57 0.29 -0.75 0.00 0.00 0.00 175.10 175.11 3g1h s LYS 42 N -0.08 4.01 -0.15 2.72 2.20 0.24 -1.18 119.74 127.50 3g1h s LYS 42 Ca -0.06 -0.10 -0.00 0.00 -0.36 0.00 0.00 55.97 55.45 3g1h s LYS 42 Cb -0.14 -3.64 -0.01 0.00 -1.51 0.00 0.00 37.83 32.53 3g1h s LYS 42 CO 0.04 -0.20 -0.13 0.42 -0.36 0.00 0.00 175.35 175.12 3g1h s ILE 43 N 1.83 2.91 0.13 5.43 1.01 0.44 -1.12 121.20 131.84 3g1h s ILE 43 Ca 0.12 -0.69 0.01 0.00 0.00 0.00 0.00 60.65 60.09 3g1h s ILE 43 Cb -0.16 -2.24 0.01 0.00 0.01 0.00 0.00 42.46 40.09 3g1h s ILE 43 CO 0.10 0.51 0.09 0.61 0.00 0.00 0.00 174.94 176.25 3g1h n GLY 44 N 3.93 3.08 0.24 6.18 0.00 -1.26 -0.74 105.19 116.62 3g1h n GLY 44 Ca -0.19 -2.21 0.08 0.00 0.00 0.00 0.00 46.02 43.71 3g1h n GLY 44 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 3g1h h TYR 45 N 0.59 0.00 -0.46 1.61 0.99 -1.96 -2.77 116.97 114.96 3g1h h TYR 45 Ca -0.09 0.00 0.05 0.00 2.00 0.00 0.00 58.73 60.69 3g1h h TYR 45 Cb 0.31 0.00 -0.04 0.00 1.00 0.00 0.00 36.73 38.00 3g1h h TYR 45 CO 0.00 0.14 0.21 -1.35 -0.00 0.00 0.00 178.16 177.16 3g1h h PRO 46 N 0.00 0.41 0.06 4.88 0.11 -1.94 0.23 132.00 135.74 3g1h h PRO 46 Ca -0.00 -0.02 -0.00 0.00 0.11 0.00 0.00 66.00 66.08 3g1h h PRO 46 Cb 0.28 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 31.30 3g1h h PRO 46 CO 0.02 0.27 -0.03 1.25 -0.21 0.00 0.00 178.00 179.30 3g1h h LEU 47 N 0.42 -0.06 -0.83 2.35 5.85 -1.71 -3.10 115.31 118.22 3g1h h LEU 47 Ca 0.21 -0.58 0.04 0.00 0.84 0.00 0.00 57.88 58.38 3g1h h LEU 47 Cb 0.15 0.02 -0.05 0.00 0.37 0.00 0.00 40.66 41.14 3g1h h LEU 47 CO -0.17 0.62 0.53 0.58 -0.34 0.00 0.00 178.44 179.66 3g1h h VAL 48 N -0.81 1.12 0.00 1.05 2.07 -1.47 0.19 116.25 118.40 3g1h h VAL 48 Ca -0.01 -0.35 -0.08 0.00 0.82 0.00 0.00 66.70 67.08 3g1h h VAL 48 Cb 0.64 0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 30.40 3g1h h VAL 48 CO 0.01 0.19 -0.36 -0.07 0.02 0.00 0.00 177.57 177.36 3g1h h LEU 49 N 1.03 0.00 0.19 2.57 3.38 -0.68 0.28 115.31 122.08 3g1h h LEU 49 Ca 0.34 0.00 -0.33 0.00 0.09 0.00 0.00 57.88 57.97 3g1h h LEU 49 Cb 0.02 0.00 0.01 0.00 0.09 0.00 0.00 40.66 40.79 3g1h h LEU 49 CO -0.12 0.36 -1.61 0.28 0.09 0.00 0.00 178.44 177.45 3g1h h SER 50 N 0.00 0.62 -0.01 -0.43 0.02 -1.31 -3.40 113.55 109.05 3g1h h SER 50 Ca -0.00 -0.81 0.00 0.00 -0.84 0.00 0.00 61.79 60.13 3g1h h SER 50 Cb 0.96 -0.20 0.00 0.00 0.14 0.00 0.00 62.40 63.29 3g1h h SER 50 CO 0.05 1.67 -0.10 -0.62 -1.14 0.00 0.00 176.83 176.69 3g1h n GLU 51 N -3.59 1.66 0.00 3.45 -0.58 0.60 -5.01 120.64 117.17 3g1h n GLU 51 Ca -0.20 -0.60 0.00 0.00 -0.42 0.00 0.00 57.16 55.94 3g1h n GLU 51 Cb 1.08 -1.01 0.00 0.00 -0.57 0.00 0.00 31.44 30.93 3g1h n GLU 51 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3g1h n GLY 52 N 0.64 0.64 0.25 0.62 0.00 0.97 -4.50 105.19 103.82 3g1h n GLY 52 Ca 0.03 -1.77 0.12 0.00 0.00 0.00 0.00 46.02 44.40 3g1h n GLY 52 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 3g1h h MET 53 N 0.00 0.00 0.00 1.61 2.86 -1.95 -2.33 114.93 115.12 3g1h h MET 53 Ca 0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 3g1h h MET 53 Cb 0.00 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.66 3g1h h MET 53 CO 0.00 0.17 0.00 -0.44 1.06 0.00 0.00 176.91 177.70 3g1h h ASP 54 N 0.00 0.00 -0.10 1.22 3.32 -1.92 -1.50 116.42 117.43 3g1h h ASP 54 Ca -0.00 0.00 0.03 0.00 0.02 0.00 0.00 57.03 57.08 3g1h h ASP 54 Cb 0.53 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.08 3g1h h ASP 54 CO 0.02 0.00 0.10 -0.29 -1.72 0.00 0.00 179.24 177.35 3g1h h ILE 55 N 0.00 0.67 -0.03 0.35 6.09 -1.64 -2.30 117.51 120.64 3g1h h ILE 55 Ca 0.00 0.00 -0.01 0.00 -1.37 0.00 0.00 64.86 63.48 3g1h h ILE 55 Cb 0.18 0.93 -0.00 0.00 0.47 0.00 0.00 36.82 38.40 3g1h h ILE 55 CO 0.00 0.00 -0.01 0.40 -3.07 0.00 0.00 178.15 175.47 3g1h h ILE 56 N 0.00 1.28 -0.55 2.19 2.04 -1.50 -2.11 117.51 118.87 3g1h h ILE 56 Ca 0.05 -0.86 -0.01 0.00 1.00 0.00 0.00 64.86 65.03 3g1h h ILE 56 Cb 0.24 1.80 -0.03 0.00 -0.74 0.00 0.00 36.82 38.09 3g1h h ILE 56 CO -0.00 0.23 0.28 0.00 0.00 0.00 0.00 178.15 178.67 3g1h h ALA 57 N 0.66 0.70 -0.95 1.87 0.00 -1.56 -1.99 119.26 117.99 3g1h h ALA 57 Ca 0.01 -0.11 0.07 0.00 0.00 0.00 0.00 54.91 54.88 3g1h h ALA 57 Cb 0.38 -0.22 -0.06 0.00 0.00 0.00 0.00 17.79 17.89 3g1h h ALA 57 CO 0.00 0.24 0.61 1.49 0.00 0.00 0.00 179.25 181.60 3g1h h GLU 58 N 0.73 1.05 -0.43 0.00 4.81 -1.39 0.27 114.58 119.62 3g1h h GLU 58 Ca 0.19 -0.06 -0.09 0.00 -0.13 0.00 0.00 59.36 59.27 3g1h h GLU 58 Cb 0.08 -0.24 -0.02 0.00 0.63 0.00 0.00 28.75 29.20 3g1h h GLU 58 CO -0.03 0.69 -0.08 0.74 -0.73 0.00 0.00 179.01 179.60 3g1h h PHE 59 N 1.08 0.82 -0.27 0.92 -1.00 -0.83 -0.98 116.94 116.69 3g1h h PHE 59 Ca 0.41 -0.14 -0.17 0.00 2.81 0.00 0.00 57.97 60.88 3g1h h PHE 59 Cb 0.21 -0.22 -0.00 0.00 3.61 0.00 0.00 35.95 39.55 3g1h h PHE 59 CO -0.00 0.81 -0.51 0.00 -1.61 0.00 0.00 178.31 177.00 3g1h h ARG 60 N 0.69 0.76 -0.13 1.51 3.08 -0.42 -0.53 114.38 119.35 3g1h h ARG 60 Ca 0.12 -0.46 -0.14 0.00 0.07 0.00 0.00 59.98 59.58 3g1h h ARG 60 Cb 0.55 0.04 -0.01 0.00 0.08 0.00 0.00 29.97 30.63 3g1h h ARG 60 CO 0.03 1.08 -0.52 0.87 -1.07 0.00 0.00 179.97 180.37 3g1h h LYS 61 N 0.59 0.35 0.03 0.04 1.57 -0.33 0.33 116.57 119.15 3g1h h LYS 61 Ca 0.02 -0.21 -0.28 0.00 -1.87 0.00 0.00 60.65 58.31 3g1h h LYS 61 Cb 1.08 0.02 -0.04 0.00 0.08 0.00 0.00 32.23 33.38 3g1h h LYS 61 CO 0.11 0.79 -1.54 0.00 -0.57 0.00 0.00 179.45 178.23 3g1h h ARG 62 N 0.27 0.06 0.00 3.15 3.08 -1.15 -3.41 114.38 116.39 3g1h h ARG 62 Ca 0.01 -0.10 0.00 0.00 0.07 0.00 0.00 59.98 59.95 3g1h h ARG 62 Cb 1.01 0.04 0.00 0.00 0.08 0.00 0.00 29.97 31.09 3g1h h ARG 62 CO 0.09 0.76 0.00 1.19 -1.07 0.00 0.00 179.97 180.94 3g1h n PHE 63 N -3.21 0.00 -2.75 3.04 3.01 -0.21 -5.01 117.46 112.33 3g1h n PHE 63 Ca -0.14 0.00 -0.18 0.00 1.01 0.00 0.00 57.45 58.14 3g1h n PHE 63 Cb 1.03 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 40.50 3g1h n PHE 63 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3g1h n GLY 64 N 0.81 -0.50 3.95 1.37 0.00 0.11 -4.96 105.19 105.97 3g1h n GLY 64 Ca 0.00 0.05 -0.23 0.00 0.00 0.00 0.00 46.02 45.83 3g1h n GLY 64 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3g1h s ARG 66 N -4.84 4.38 -0.15 0.00 6.06 0.60 -4.79 118.95 120.21 3g1h s ARG 66 Ca 0.55 0.94 0.01 0.00 -2.50 0.00 0.00 55.73 54.73 3g1h s ARG 66 Cb -0.10 -3.26 0.00 0.00 0.06 0.00 0.00 34.95 31.65 3g1h s ARG 66 CO 0.40 0.59 -0.17 0.42 -2.50 0.00 0.00 175.30 174.04 3g1h s ILE 67 N -1.05 2.50 -0.22 4.11 -1.09 -1.26 -0.36 121.20 123.82 3g1h s ILE 67 Ca 0.32 -0.83 -0.03 0.00 -2.23 0.00 0.00 60.65 57.88 3g1h s ILE 67 Cb -0.21 -2.04 -0.00 0.00 -1.58 0.00 0.00 42.46 38.63 3g1h s ILE 67 CO 0.22 0.53 -0.06 -0.63 -1.23 0.00 0.00 174.94 173.77 3g1h s ILE 68 N 0.78 3.22 -0.56 2.92 1.01 -0.32 -0.61 121.20 127.64 3g1h s ILE 68 Ca -0.06 -0.58 -0.24 0.00 0.00 0.00 0.00 60.65 59.77 3g1h s ILE 68 Cb -0.15 -2.47 0.04 0.00 0.01 0.00 0.00 42.46 39.89 3g1h s ILE 68 CO -0.00 0.41 0.94 0.00 0.00 0.00 0.00 174.94 176.30 3g1h s ALA 69 N 1.45 3.16 -1.39 9.38 0.00 0.10 -0.42 121.76 134.04 3g1h s ALA 69 Ca 0.05 -1.29 -0.13 0.00 0.00 0.00 0.00 51.96 50.59 3g1h s ALA 69 Cb -0.14 -3.74 0.08 0.00 0.00 0.00 0.00 23.12 19.31 3g1h s ALA 69 CO -0.04 -2.42 2.06 -3.47 0.00 0.00 0.00 175.76 171.90 3g1h n ASP 70 N 7.48 4.33 -0.18 0.00 -0.08 0.08 -1.57 116.55 126.60 3g1h n ASP 70 Ca 0.01 -2.92 0.11 0.00 -1.51 0.00 0.00 54.79 50.48 3g1h n ASP 70 Cb 0.47 -1.62 0.09 0.00 2.34 0.00 0.00 41.12 42.41 3g1h n ASP 70 CO 0.00 0.00 0.00 0.49 0.12 0.00 0.00 177.20 177.81 3g1h n PHE 71 N 5.75 0.00 -4.14 -0.67 0.99 -1.25 -4.29 117.46 113.85 3g1h n PHE 71 Ca 0.48 0.00 -0.30 0.00 -0.00 0.00 0.00 57.45 57.63 3g1h n PHE 71 Cb 0.39 -0.08 -0.05 0.00 -1.00 0.00 0.00 39.48 38.74 3g1h n PHE 71 CO 0.00 0.00 0.00 1.63 -0.00 0.00 0.00 176.76 178.39 3g1h n LYS 72 N -0.93 -2.36 -1.65 -1.08 5.02 -0.18 -4.73 118.16 112.25 3g1h n LYS 72 Ca 0.07 0.28 -0.57 0.00 -2.02 0.00 0.00 58.31 56.07 3g1h n LYS 72 Cb 0.37 -4.30 -0.07 0.00 -0.02 0.00 0.00 35.03 31.01 3g1h n LYS 72 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 3g1h n VAL 73 N -4.44 0.14 -2.71 -0.18 0.31 -1.12 -4.19 118.33 106.13 3g1h n VAL 73 Ca -0.24 -0.02 -0.09 0.00 -0.01 0.00 0.00 64.34 63.97 3g1h n VAL 73 Cb 0.65 -0.88 0.06 0.00 -0.91 0.00 0.00 33.84 32.76 3g1h n VAL 73 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3g1h n ALA 74 N 3.85 2.47 -3.85 3.52 0.00 -1.26 -1.27 120.51 123.97 3g1h n ALA 74 Ca 0.24 -2.51 0.00 0.00 0.00 0.00 0.00 53.44 51.16 3g1h n ALA 74 Cb 0.12 -0.97 0.00 0.00 0.00 0.00 0.00 19.45 18.61 3g1h n ALA 74 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 3g1h n ASP 75 N -0.19 1.96 -4.82 0.00 -0.08 -1.26 -4.98 116.55 107.18 3g1h n ASP 75 Ca 0.06 -0.86 -0.30 0.00 -1.51 0.00 0.00 54.79 52.17 3g1h n ASP 75 Cb 0.81 0.00 0.06 0.00 2.34 0.00 0.00 41.12 44.34 3g1h n ASP 75 CO 0.00 0.00 0.00 0.27 0.12 0.00 0.00 177.20 177.59 3g1h s ILE 76 N -0.75 3.65 0.17 5.18 -4.36 -1.26 -4.74 121.20 119.09 3g1h s ILE 76 Ca 0.00 0.54 -0.22 0.00 -0.26 0.00 0.00 60.65 60.71 3g1h s ILE 76 Cb 0.00 -3.32 0.09 0.00 1.25 0.00 0.00 42.46 40.48 3g1h s ILE 76 CO 0.00 -0.70 1.60 -0.65 0.24 0.00 0.00 174.94 175.43 3g1h h PRO 77 N -0.83 -0.20 -0.54 0.37 0.11 -1.88 -0.68 132.00 128.36 3g1h h PRO 77 Ca -0.45 0.01 0.10 0.00 0.11 0.00 0.00 66.00 65.77 3g1h h PRO 77 Cb 1.24 0.05 -0.08 0.00 0.11 0.00 0.00 31.00 32.31 3g1h h PRO 77 CO 0.59 -0.13 0.05 0.93 -0.21 0.00 0.00 178.00 179.23 3g1h h GLU 78 N -0.21 0.17 -0.12 1.05 3.07 -1.94 -1.83 114.58 114.77 3g1h h GLU 78 Ca 0.20 -0.01 -0.18 0.00 -0.50 0.00 0.00 59.36 58.87 3g1h h GLU 78 Cb 0.53 -0.04 -0.00 0.00 -0.84 0.00 0.00 28.75 28.39 3g1h h GLU 78 CO -0.57 0.11 -0.67 1.15 -1.40 0.00 0.00 179.01 177.63 3g1h h THR 79 N 0.17 1.35 -0.69 1.13 2.02 -1.84 -3.08 112.91 111.97 3g1h h THR 79 Ca 0.28 -2.01 0.02 0.00 0.77 0.00 0.00 66.41 65.47 3g1h h THR 79 Cb 0.41 1.99 -0.04 0.00 -1.74 0.00 0.00 68.15 68.77 3g1h h THR 79 CO -0.41 0.61 0.46 0.78 0.37 0.00 0.00 175.52 177.33 3g1h h ASN 80 N 0.34 0.75 -0.54 4.18 4.21 -0.52 -0.54 115.58 123.46 3g1h h ASN 80 Ca -0.02 -0.01 -0.08 0.00 1.21 0.00 0.00 56.30 57.40 3g1h h ASN 80 Cb 1.23 -0.18 -0.02 0.00 -1.12 0.00 0.00 38.32 38.23 3g1h h ASN 80 CO 0.12 0.53 0.03 -0.33 -1.29 0.00 0.00 177.43 176.50 3g1h h GLU 81 N 0.88 0.92 -0.69 0.81 5.08 -1.27 -0.92 114.58 119.39 3g1h h GLU 81 Ca 0.27 -0.28 -0.07 0.00 -1.00 0.00 0.00 59.36 58.27 3g1h h GLU 81 Cb -0.02 -0.09 -0.03 0.00 0.50 0.00 0.00 28.75 29.11 3g1h h GLU 81 CO -0.07 0.92 0.14 0.87 -1.00 0.00 0.00 179.01 179.88 3g1h h LYS 82 N 0.80 1.12 -0.22 2.33 1.57 -1.31 -0.06 116.57 120.80 3g1h h LYS 82 Ca 0.16 -0.29 -0.02 0.00 -1.87 0.00 0.00 60.65 58.63 3g1h h LYS 82 Cb 0.48 -0.14 -0.01 0.00 0.08 0.00 0.00 32.23 32.64 3g1h h LYS 82 CO 0.02 1.01 0.07 0.82 -0.57 0.00 0.00 179.45 180.80 3g1h h ILE 83 N 1.06 1.19 -0.23 1.86 2.04 -0.87 -2.35 117.51 120.20 3g1h h ILE 83 Ca 0.21 -0.61 -0.11 0.00 1.00 0.00 0.00 64.86 65.36 3g1h h ILE 83 Cb 0.41 1.17 -0.01 0.00 -0.74 0.00 0.00 36.82 37.65 3g1h h ILE 83 CO 0.01 0.19 -0.31 0.00 0.00 0.00 0.00 178.15 178.04 3g1h h ARG 85 N 0.42 0.69 -0.40 0.00 2.43 -0.86 -0.50 114.38 116.16 3g1h h ARG 85 Ca 0.05 -0.14 -0.12 0.00 -0.81 0.00 0.00 59.98 58.96 3g1h h ARG 85 Cb 0.76 -0.11 -0.01 0.00 -0.42 0.00 0.00 29.97 30.19 3g1h h ARG 85 CO 0.06 0.65 -0.24 0.00 -1.51 0.00 0.00 179.97 178.93 3g1h h ALA 86 N 1.01 0.84 -0.44 2.80 0.00 -1.31 0.42 119.26 122.58 3g1h h ALA 86 Ca 0.15 -0.38 -0.09 0.00 0.00 0.00 0.00 54.91 54.58 3g1h h ALA 86 Cb 0.23 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 3g1h h ALA 86 CO -0.01 0.64 -0.10 1.15 0.00 0.00 0.00 179.25 180.93 3g1h h THR 87 N 0.69 1.27 -0.20 0.00 2.02 -1.01 -0.62 112.91 115.07 3g1h h THR 87 Ca 0.09 -1.20 -0.14 0.00 0.77 0.00 0.00 66.41 65.93 3g1h h THR 87 Cb 0.76 1.15 0.00 0.00 -1.74 0.00 0.00 68.15 68.33 3g1h h THR 87 CO 0.06 0.41 -0.41 -0.26 0.37 0.00 0.00 175.52 175.69 3g1h h PHE 88 N 0.67 0.80 -0.77 3.16 0.04 -1.03 -2.70 116.94 117.11 3g1h h PHE 88 Ca 0.11 -0.29 0.15 0.00 2.80 0.00 0.00 57.97 60.74 3g1h h PHE 88 Cb 0.63 -0.15 -0.05 0.00 2.20 0.00 0.00 35.95 38.58 3g1h h PHE 88 CO 0.05 1.06 0.51 -0.22 -0.60 0.00 0.00 178.31 179.11 3g1h h LYS 89 N 0.32 0.41 0.00 1.51 3.64 -0.78 0.47 116.57 122.15 3g1h h LYS 89 Ca 0.01 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.36 3g1h h LYS 89 Cb 1.01 -0.09 0.00 0.00 -0.41 0.00 0.00 32.23 32.74 3g1h h LYS 89 CO 0.09 0.27 0.00 0.00 -2.27 0.00 0.00 179.45 177.54 3g1h n ALA 90 N -2.52 2.43 -0.11 5.00 0.00 -0.25 -4.90 120.51 120.16 3g1h n ALA 90 Ca 0.15 -0.15 0.00 0.00 0.00 0.00 0.00 53.44 53.43 3g1h n ALA 90 Cb 0.54 -1.42 0.00 0.00 0.00 0.00 0.00 19.45 18.58 3g1h n ALA 90 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3g1h n GLY 91 N 0.65 0.94 3.73 0.00 0.00 0.17 -3.86 105.19 106.82 3g1h n GLY 91 Ca 0.18 -0.05 -0.41 0.00 0.00 0.00 0.00 46.02 45.74 3g1h n GLY 91 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3g1h s ALA 92 N -2.00 3.28 0.10 4.61 0.00 -1.04 -4.77 121.76 121.93 3g1h s ALA 92 Ca 0.00 0.62 -0.04 0.00 0.00 0.00 0.00 51.96 52.55 3g1h s ALA 92 Cb 0.00 -3.28 -0.21 0.00 0.00 0.00 0.00 23.12 19.63 3g1h s ALA 92 CO 0.00 -0.03 1.21 -0.44 0.00 0.00 0.00 175.76 176.50 3g1h h ASP 93 N 5.30 0.44 -5.13 0.00 3.32 -1.21 -3.42 116.42 115.72 3g1h h ASP 93 Ca -0.43 -0.43 -0.13 0.00 0.02 0.00 0.00 57.03 56.06 3g1h h ASP 93 Cb 1.21 -0.14 -0.17 0.00 0.22 0.00 0.00 39.33 40.45 3g1h h ASP 93 CO 0.71 1.29 -0.63 0.00 -1.72 0.00 0.00 179.24 178.90 3g1h s ALA 94 N -2.88 0.22 -0.02 3.45 0.00 -1.00 -2.10 121.76 119.44 3g1h s ALA 94 Ca -0.04 -0.85 0.03 0.00 0.00 0.00 0.00 51.96 51.09 3g1h s ALA 94 Cb 0.08 0.25 -0.00 0.00 0.00 0.00 0.00 23.12 23.44 3g1h s ALA 94 CO 0.87 -0.31 -0.10 -1.50 0.00 0.00 0.00 175.76 174.72 3g1h s ILE 95 N -2.97 0.83 -0.12 0.00 2.07 -0.56 -0.72 121.20 119.73 3g1h s ILE 95 Ca -0.02 -0.41 -0.17 0.00 -1.41 0.00 0.00 60.65 58.64 3g1h s ILE 95 Cb 0.01 -0.72 -0.04 0.00 0.13 0.00 0.00 42.46 41.83 3g1h s ILE 95 CO -0.06 0.25 0.42 -0.63 -1.91 0.00 0.00 174.94 173.01 3g1h s ILE 96 N 0.01 5.21 -0.01 2.00 1.01 -0.61 -0.67 121.20 128.15 3g1h s ILE 96 Ca -0.00 0.84 0.06 0.00 0.00 0.00 0.00 60.65 61.55 3g1h s ILE 96 Cb -0.07 -3.76 -0.02 0.00 0.01 0.00 0.00 42.46 38.62 3g1h s ILE 96 CO 0.00 0.35 -0.20 -0.69 0.00 0.00 0.00 174.94 174.40 3g1h s VAL 97 N 0.51 1.60 0.33 2.92 1.01 0.10 -1.01 120.40 125.86 3g1h s VAL 97 Ca 0.23 -0.89 -0.26 0.00 0.00 0.00 0.00 61.98 61.06 3g1h s VAL 97 Cb -0.15 -1.33 -0.10 0.00 0.00 0.00 0.00 36.38 34.80 3g1h s VAL 97 CO 0.09 0.43 0.97 -1.00 0.00 0.00 0.00 175.10 175.59 3g1h s HIS 98 N -0.50 3.63 -0.14 5.22 3.76 -0.40 -0.34 115.29 126.53 3g1h s HIS 98 Ca 0.08 1.76 0.17 0.00 -0.15 0.00 0.00 55.06 56.92 3g1h s HIS 98 Cb -0.08 -2.98 -0.24 0.00 1.11 0.00 0.00 32.58 30.39 3g1h s HIS 98 CO -0.01 0.05 0.33 0.41 -0.85 0.00 0.00 174.74 174.67 3g1h n GLY 99 N 0.59 -1.02 0.45 -2.22 0.00 -1.20 -4.48 105.19 97.31 3g1h n GLY 99 Ca 0.02 -0.26 0.33 0.00 0.00 0.00 0.00 46.02 46.11 3g1h n GLY 99 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 3g1h h PHE 100 N 0.00 0.54 0.00 1.61 3.57 -1.92 0.07 116.94 120.82 3g1h h PHE 100 Ca -0.39 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.13 3g1h h PHE 100 Cb 2.00 -0.14 0.00 0.00 2.79 0.00 0.00 35.95 40.60 3g1h h PHE 100 CO 0.00 -0.13 0.00 -2.30 -2.23 0.00 0.00 178.31 173.65 3g1h n PRO 101 N -4.66 0.15 0.00 6.41 -0.02 -1.26 -5.00 135.00 130.62 3g1h n PRO 101 Ca 0.34 0.18 0.00 0.00 -2.02 0.00 0.00 63.50 62.00 3g1h n PRO 101 Cb 1.29 -1.50 0.00 0.00 -0.02 0.00 0.00 33.50 33.27 3g1h n PRO 101 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3g1h n GLY 102 N -0.04 2.03 0.27 -1.23 0.00 0.01 -4.65 105.19 101.58 3g1h n GLY 102 Ca 0.06 -2.04 -0.08 0.00 0.00 0.00 0.00 46.02 43.96 3g1h n GLY 102 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3g1h h ALA 103 N 0.00 0.79 -0.78 4.61 0.00 -1.95 -2.54 119.26 119.39 3g1h h ALA 103 Ca 0.00 -0.20 0.03 0.00 0.00 0.00 0.00 54.91 54.75 3g1h h ALA 103 Cb 0.00 -0.23 -0.05 0.00 0.00 0.00 0.00 17.79 17.51 3g1h h ALA 103 CO 0.00 0.45 0.49 0.38 0.00 0.00 0.00 179.25 180.57 3g1h h ASP 104 N 0.85 0.81 -0.58 0.00 2.03 -1.98 0.30 116.42 117.85 3g1h h ASP 104 Ca 0.20 -0.00 -0.09 0.00 -0.73 0.00 0.00 57.03 56.41 3g1h h ASP 104 Cb 0.28 -0.17 -0.02 0.00 -0.83 0.00 0.00 39.33 38.58 3g1h h ASP 104 CO -0.01 0.55 0.02 0.28 -1.03 0.00 0.00 179.24 179.06 3g1h h SER 105 N 0.95 1.01 -0.23 4.15 0.02 -1.79 -1.42 113.55 116.24 3g1h h SER 105 Ca 0.32 -0.27 -0.18 0.00 -0.84 0.00 0.00 61.79 60.82 3g1h h SER 105 Cb 0.03 -0.27 0.00 0.00 0.14 0.00 0.00 62.40 62.31 3g1h h SER 105 CO -0.12 1.04 -0.56 0.58 -1.14 0.00 0.00 176.83 176.63 3g1h h VAL 106 N 0.95 1.29 -0.58 2.27 2.07 -1.01 -3.21 116.25 118.04 3g1h h VAL 106 Ca 0.18 -1.77 -0.03 0.00 0.82 0.00 0.00 66.70 65.90 3g1h h VAL 106 Cb 0.52 1.80 -0.03 0.00 -1.52 0.00 0.00 31.29 32.06 3g1h h VAL 106 CO 0.02 0.56 0.24 -0.09 0.02 0.00 0.00 177.57 178.33 3g1h h ARG 107 N 0.52 0.84 -0.41 1.57 9.65 -0.23 -1.20 114.38 125.13 3g1h h ARG 107 Ca -0.01 -0.12 -0.03 0.00 -1.10 0.00 0.00 59.98 58.72 3g1h h ARG 107 Cb 1.18 -0.15 -0.02 0.00 -1.39 0.00 0.00 29.97 29.59 3g1h h ARG 107 CO 0.12 0.68 0.11 0.00 2.80 0.00 0.00 179.97 183.68 3g1h h ALA 108 N 1.44 1.44 0.01 2.80 0.00 -1.28 0.24 119.26 123.91 3g1h h ALA 108 Ca 0.20 -0.15 -0.00 0.00 0.00 0.00 0.00 54.91 54.96 3g1h h ALA 108 Cb 0.14 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 17.76 3g1h h ALA 108 CO -0.02 0.41 -0.01 0.00 0.00 0.00 0.00 179.25 179.64 3g1h h LEU 110 N -0.51 0.92 0.03 0.00 3.38 -0.82 -0.67 115.31 117.64 3g1h h LEU 110 Ca -0.00 0.05 0.01 0.00 0.09 0.00 0.00 57.88 58.02 3g1h h LEU 110 Cb 0.49 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 41.10 3g1h h LEU 110 CO 0.00 0.48 -0.05 0.78 0.09 0.00 0.00 178.44 179.75 3g1h h ASN 111 N 0.99 -0.14 -0.75 -0.43 2.35 -0.51 -1.80 115.58 115.29 3g1h h ASN 111 Ca 0.50 0.02 -0.02 0.00 -0.55 0.00 0.00 56.30 56.25 3g1h h ASN 111 Cb 0.50 0.05 -0.03 0.00 0.05 0.00 0.00 38.32 38.88 3g1h h ASN 111 CO -0.27 -0.08 0.39 0.58 -1.65 0.00 0.00 177.43 176.41 3g1h h VAL 112 N -0.10 1.23 -0.38 2.81 2.07 -1.17 -0.84 116.25 119.86 3g1h h VAL 112 Ca 0.01 -0.60 -0.00 0.00 0.82 0.00 0.00 66.70 66.92 3g1h h VAL 112 Cb 0.11 0.26 -0.02 0.00 -1.52 0.00 0.00 31.29 30.12 3g1h h VAL 112 CO -0.03 0.26 0.21 0.00 0.02 0.00 0.00 177.57 178.03 3g1h h ALA 113 N 1.20 1.67 -0.02 1.67 0.00 -0.90 -0.75 119.26 122.12 3g1h h ALA 113 Ca 0.26 -0.06 -0.02 0.00 0.00 0.00 0.00 54.91 55.09 3g1h h ALA 113 Cb 0.06 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 17.70 3g1h h ALA 113 CO -0.04 0.29 -0.08 1.49 0.00 0.00 0.00 179.25 180.91 3g1h h GLU 114 N 0.52 0.09 -0.61 0.00 4.81 -0.59 0.38 114.58 119.19 3g1h h GLU 114 Ca 0.14 -0.07 0.15 0.00 -0.13 0.00 0.00 59.36 59.45 3g1h h GLU 114 Cb 0.00 0.01 -0.03 0.00 0.63 0.00 0.00 28.75 29.37 3g1h h GLU 114 CO -0.02 0.71 0.42 1.49 -0.73 0.00 0.00 179.01 180.88 3g1h h GLU 115 N -0.51 0.13 -0.07 1.92 4.81 -0.80 -2.06 114.58 118.00 3g1h h GLU 115 Ca -0.00 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.22 3g1h h GLU 115 Cb 0.72 -0.03 0.00 0.00 0.63 0.00 0.00 28.75 30.08 3g1h h GLU 115 CO 0.02 0.08 0.00 -1.33 -0.73 0.00 0.00 179.01 177.05 3g1h n MET 116 N -4.41 1.18 -3.32 1.92 2.81 -0.32 -5.01 117.12 109.98 3g1h n MET 116 Ca 0.11 -1.44 -0.17 0.00 -1.81 0.00 0.00 57.70 54.39 3g1h n MET 116 Cb 0.59 -1.28 0.07 0.00 -0.71 0.00 0.00 33.22 31.89 3g1h n MET 116 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3g1h n GLY 117 N 0.80 -0.27 2.37 3.03 0.00 0.98 -5.03 105.19 107.07 3g1h n GLY 117 Ca 0.09 0.06 -0.18 0.00 0.00 0.00 0.00 46.02 45.99 3g1h n GLY 117 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3g1h n ARG 118 N -3.97 0.69 -4.45 1.61 5.12 0.82 -5.02 116.66 111.45 3g1h n ARG 118 Ca -0.12 -2.44 -0.24 0.00 -1.93 0.00 0.00 57.85 53.12 3g1h n ARG 118 Cb 0.60 1.31 -0.10 0.00 -1.16 0.00 0.00 32.46 33.11 3g1h n ARG 118 CO 0.00 0.00 0.00 -1.21 -1.93 0.00 0.00 177.63 174.49 3g1h s GLU 119 N -3.10 1.77 -0.02 5.56 2.02 -0.89 -4.45 118.70 119.59 3g1h s GLU 119 Ca 0.14 -1.74 0.07 0.00 0.02 0.00 0.00 54.97 53.46 3g1h s GLU 119 Cb 0.01 -1.81 -0.02 0.00 0.10 0.00 0.00 34.13 32.40 3g1h s GLU 119 CO 0.10 0.31 -0.23 0.08 0.02 0.00 0.00 175.26 175.54 3g1h s VAL 120 N -2.50 2.32 -0.12 2.63 1.01 -1.26 -1.50 120.40 120.98 3g1h s VAL 120 Ca 0.31 -1.04 0.03 0.00 0.00 0.00 0.00 61.98 61.27 3g1h s VAL 120 Cb -0.04 -1.84 -0.00 0.00 0.00 0.00 0.00 36.38 34.50 3g1h s VAL 120 CO 0.16 0.56 -0.21 -0.36 0.00 0.00 0.00 175.10 175.25 3g1h s PHE 121 N -0.66 2.64 -0.27 5.22 0.40 0.16 -4.28 117.98 121.20 3g1h s PHE 121 Ca 0.11 -1.02 -0.13 0.00 -0.60 0.00 0.00 56.93 55.29 3g1h s PHE 121 Cb -0.10 -1.77 -0.04 0.00 0.51 0.00 0.00 43.02 41.62 3g1h s PHE 121 CO -0.00 -0.42 0.27 -1.17 0.70 0.00 0.00 175.22 174.60 3g1h s LEU 122 N 0.46 4.05 -0.36 -0.37 2.96 0.09 0.00 118.68 125.51 3g1h s LEU 122 Ca -0.14 0.15 -0.25 0.00 -0.22 0.00 0.00 54.13 53.67 3g1h s LEU 122 Cb -0.17 -2.26 0.01 0.00 0.50 0.00 0.00 46.19 44.27 3g1h s LEU 122 CO 0.06 -0.09 0.89 -0.22 -1.32 0.00 0.00 176.35 175.67 3g1h s LEU 123 N 1.76 4.03 -0.19 -0.68 2.96 0.54 -0.41 118.68 126.68 3g1h s LEU 123 Ca 0.11 0.58 -0.15 0.00 -0.22 0.00 0.00 54.13 54.45 3g1h s LEU 123 Cb -0.16 -3.22 -0.08 0.00 0.50 0.00 0.00 46.19 43.24 3g1h s LEU 123 CO 0.10 -0.81 -0.24 0.35 -1.32 0.00 0.00 176.35 174.43 3g1h n THR 124 N 5.88 1.49 -4.90 3.68 -2.24 -0.93 -3.27 114.28 113.99 3g1h n THR 124 Ca 0.06 0.05 -0.26 0.00 -2.27 0.00 0.00 64.05 61.64 3g1h n THR 124 Cb 0.48 -2.25 -0.15 0.00 -2.10 0.00 0.00 70.33 66.31 3g1h n THR 124 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 3g1h s GLU 125 N -2.59 1.52 0.39 -0.78 2.12 -1.25 -4.62 118.70 113.49 3g1h s GLU 125 Ca -0.27 -0.66 -0.08 0.00 0.36 0.00 0.00 54.97 54.32 3g1h s GLU 125 Cb 0.06 -1.46 -0.05 0.00 0.26 0.00 0.00 34.13 32.93 3g1h s GLU 125 CO 0.40 0.39 0.71 -1.64 -0.54 0.00 0.00 175.26 174.58 3g1h s MET 126 N -0.42 3.69 0.28 4.30 -1.94 -1.26 -3.57 119.30 120.38 3g1h s MET 126 Ca 0.07 0.28 0.24 0.00 -1.71 0.00 0.00 55.69 54.57 3g1h s MET 126 Cb -0.07 -2.46 0.37 0.00 2.01 0.00 0.00 34.83 34.68 3g1h s MET 126 CO -0.01 0.00 1.47 0.66 -0.01 0.00 0.00 175.02 177.13 3g1h h SER 127 N 1.16 0.00 -4.32 3.03 4.64 -1.93 -3.44 113.55 112.68 3g1h h SER 127 Ca -0.47 -0.04 -0.50 0.00 -0.47 0.00 0.00 61.79 60.31 3g1h h SER 127 Cb 1.19 0.00 0.07 0.00 -0.31 0.00 0.00 62.40 63.35 3g1h h SER 127 CO 0.64 0.02 0.38 -1.38 -0.87 0.00 0.00 176.83 175.62 3g1h s HIS 128 N -3.21 3.46 0.27 4.77 -3.43 -1.26 -4.69 115.29 111.20 3g1h s HIS 128 Ca 0.06 1.10 -0.02 0.00 -0.80 0.00 0.00 55.06 55.40 3g1h s HIS 128 Cb 0.09 -2.87 0.43 0.00 -1.43 0.00 0.00 32.58 28.80 3g1h s HIS 128 CO 0.69 -0.91 1.89 -1.35 -2.00 0.00 0.00 174.74 173.06 3g1h h PRO 129 N -0.44 1.13 0.00 -0.38 0.11 -2.01 -2.04 132.00 128.37 3g1h h PRO 129 Ca -0.45 -0.07 0.00 0.00 0.11 0.00 0.00 66.00 65.60 3g1h h PRO 129 Cb 1.23 -0.25 0.00 0.00 0.11 0.00 0.00 31.00 32.08 3g1h h PRO 129 CO 0.63 0.75 0.00 0.41 -0.21 0.00 0.00 178.00 179.57 3g1h n GLY 130 N -1.37 -0.91 0.25 -0.55 0.00 -1.26 -2.16 105.19 99.20 3g1h n GLY 130 Ca 0.15 0.15 0.17 0.00 0.00 0.00 0.00 46.02 46.49 3g1h n GLY 130 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3g1h h ALA 131 N 2.07 1.00 0.00 4.61 0.00 -1.67 -2.64 119.26 122.63 3g1h h ALA 131 Ca 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 54.91 54.85 3g1h h ALA 131 Cb 0.08 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 3g1h h ALA 131 CO 0.00 0.00 -0.28 0.93 0.00 0.00 0.00 179.25 179.90 3g1h h GLU 132 N 0.00 0.00 0.07 0.00 5.08 -1.65 0.56 114.58 118.64 3g1h h GLU 132 Ca 0.00 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.36 3g1h h GLU 132 Cb 0.13 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.38 3g1h h GLU 132 CO 0.00 0.28 -0.03 0.52 -1.00 0.00 0.00 179.01 178.78 3g1h h MET 133 N 0.00 -0.09 0.00 2.33 2.86 -1.70 -3.41 114.93 114.93 3g1h h MET 133 Ca -0.00 0.01 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 3g1h h MET 133 Cb 1.12 0.02 0.00 0.00 0.06 0.00 0.00 31.60 32.80 3g1h h MET 133 CO 0.04 0.04 -0.45 1.19 1.06 0.00 0.00 176.91 178.79 3g1h n PHE 134 N -5.08 0.00 -0.11 -0.22 3.01 -1.26 -4.83 117.46 108.97 3g1h n PHE 134 Ca -0.08 0.00 -0.11 0.00 1.01 0.00 0.00 57.45 58.27 3g1h n PHE 134 Cb 0.11 0.00 -0.03 0.00 -0.01 0.00 0.00 39.48 39.55 3g1h n PHE 134 CO 0.00 0.00 0.00 0.82 1.01 0.00 0.00 176.76 178.59 3g1h h ILE 135 N 0.00 1.26 -0.85 4.37 2.04 -1.79 -3.20 117.51 119.33 3g1h h ILE 135 Ca 0.00 -0.97 0.04 0.00 1.00 0.00 0.00 64.86 64.93 3g1h h ILE 135 Cb 0.45 1.23 -0.05 0.00 -0.74 0.00 0.00 36.82 37.71 3g1h h ILE 135 CO 0.00 0.32 0.55 -0.61 0.00 0.00 0.00 178.15 178.40 3g1h h GLN 136 N 0.40 1.01 0.00 2.37 4.15 -1.11 0.40 115.11 122.33 3g1h h GLN 136 Ca 0.09 -0.06 0.00 0.00 0.77 0.00 0.00 58.65 59.45 3g1h h GLN 136 Cb 0.45 -0.23 0.00 0.00 0.21 0.00 0.00 27.48 27.91 3g1h h GLN 136 CO 0.02 0.67 0.00 0.78 -1.93 0.00 0.00 178.83 178.37 3g1h h GLY 137 N 1.05 0.00 -0.26 2.39 0.00 -1.80 -2.75 103.07 101.69 3g1h h GLY 137 Ca 0.35 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.68 3g1h h GLY 137 CO -0.13 0.00 -0.36 0.00 0.00 0.00 0.00 176.54 176.05 3g1h n ALA 138 N -1.82 3.13 -0.13 3.60 0.00 -0.55 -4.75 120.51 119.99 3g1h n ALA 138 Ca 0.01 -0.38 -0.04 0.00 0.00 0.00 0.00 53.44 53.03 3g1h n ALA 138 Cb 0.19 -0.39 0.03 0.00 0.00 0.00 0.00 19.45 19.29 3g1h n ALA 138 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3g1h h ALA 139 N 1.71 0.38 -0.38 0.00 0.00 -0.65 -1.58 119.26 118.75 3g1h h ALA 139 Ca 0.00 0.13 0.02 0.00 0.00 0.00 0.00 54.91 55.06 3g1h h ALA 139 Cb 0.31 0.23 -0.03 0.00 0.00 0.00 0.00 17.79 18.31 3g1h h ALA 139 CO 0.00 -0.40 0.22 -0.44 0.00 0.00 0.00 179.25 178.63 3g1h h ASP 140 N 0.09 0.35 0.12 0.00 5.19 -1.85 0.10 116.42 120.43 3g1h h ASP 140 Ca 0.21 0.00 -0.06 0.00 -0.62 0.00 0.00 57.03 56.56 3g1h h ASP 140 Cb 0.31 -0.07 -0.01 0.00 0.18 0.00 0.00 39.33 39.73 3g1h h ASP 140 CO -0.36 0.26 -0.21 -0.08 -3.12 0.00 0.00 179.24 175.72 3g1h h GLU 141 N 0.45 0.18 -0.23 3.56 4.81 -1.80 -0.91 114.58 120.64 3g1h h GLU 141 Ca 0.15 -0.05 -0.14 0.00 -0.13 0.00 0.00 59.36 59.19 3g1h h GLU 141 Cb 0.01 -0.02 0.00 0.00 0.63 0.00 0.00 28.75 29.37 3g1h h GLU 141 CO -0.07 0.39 -0.42 0.82 -0.73 0.00 0.00 179.01 179.00 3g1h h ILE 142 N 0.16 1.31 -0.75 2.32 2.04 -0.72 -1.26 117.51 120.61 3g1h h ILE 142 Ca 0.03 -1.63 -0.04 0.00 1.00 0.00 0.00 64.86 64.22 3g1h h ILE 142 Cb 0.48 1.79 -0.03 0.00 -0.74 0.00 0.00 36.82 38.31 3g1h h ILE 142 CO 0.03 0.51 0.32 0.00 0.00 0.00 0.00 178.15 179.02 3g1h h ALA 143 N 0.63 0.97 -0.03 1.87 0.00 -0.48 -0.08 119.26 122.15 3g1h h ALA 143 Ca 0.01 -0.18 -0.09 0.00 0.00 0.00 0.00 54.91 54.66 3g1h h ALA 143 Cb 1.01 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 18.50 3g1h h ALA 143 CO 0.09 0.58 -0.40 0.00 0.00 0.00 0.00 179.25 179.52 3g1h h ARG 144 N 1.07 0.05 -0.31 0.00 3.08 -1.09 -2.22 114.38 114.96 3g1h h ARG 144 Ca 0.25 -0.02 -0.06 0.00 0.07 0.00 0.00 59.98 60.23 3g1h h ARG 144 Cb 0.18 -0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.22 3g1h h ARG 144 CO -0.03 0.44 -0.02 1.98 -1.07 0.00 0.00 179.97 181.28 3g1h h MET 145 N 0.04 0.57 -0.31 0.04 4.05 -0.52 -1.87 114.93 116.92 3g1h h MET 145 Ca 0.00 -0.19 0.06 0.00 -0.28 0.00 0.00 59.70 59.29 3g1h h MET 145 Cb 0.72 -0.05 -0.05 0.00 -0.80 0.00 0.00 31.60 31.43 3g1h h MET 145 CO 0.05 0.72 -0.01 0.78 0.23 0.00 0.00 176.91 178.69 3g1h h GLY 146 N 0.35 0.30 0.55 1.39 0.00 -0.51 -0.74 103.07 104.41 3g1h h GLY 146 Ca 0.09 0.04 0.04 0.00 0.00 0.00 0.00 47.33 47.50 3g1h h GLY 146 CO 0.02 -0.07 -0.09 -2.08 0.00 0.00 0.00 176.54 174.32 3g1h h VAL 147 N 0.08 0.71 -0.62 4.60 2.07 -1.28 0.12 116.25 121.94 3g1h h VAL 147 Ca 0.15 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.71 3g1h h VAL 147 Cb 0.20 0.71 -0.03 0.00 -1.52 0.00 0.00 31.29 30.65 3g1h h VAL 147 CO -0.26 0.00 0.41 0.44 0.02 0.00 0.00 177.57 178.18 3g1h h ASP 148 N -0.08 0.62 0.16 0.57 3.32 -0.77 -0.69 116.42 119.54 3g1h h ASP 148 Ca 0.09 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.14 3g1h h ASP 148 Cb 0.22 -0.14 0.00 0.00 0.22 0.00 0.00 39.33 39.63 3g1h h ASP 148 CO -0.22 0.42 -0.01 0.18 -1.72 0.00 0.00 179.24 177.90 3g1h n LEU 149 N -4.46 0.14 0.00 1.55 4.77 -0.34 -4.90 117.00 113.77 3g1h n LEU 149 Ca 0.08 0.03 0.00 0.00 -0.03 0.00 0.00 56.01 56.09 3g1h n LEU 149 Cb 0.14 -0.08 0.00 0.00 -2.33 0.00 0.00 43.42 41.15 3g1h n LEU 149 CO 0.35 0.02 0.00 0.61 -1.33 0.00 0.00 177.39 177.04 3g1h n GLY 150 N 1.10 0.54 3.73 -0.72 0.00 -0.27 -5.03 105.19 104.55 3g1h n GLY 150 Ca 0.21 -0.55 -0.41 0.00 0.00 0.00 0.00 46.02 45.26 3g1h n GLY 150 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3g1h s VAL 151 N -2.00 3.71 -1.01 1.61 1.01 0.34 -4.94 120.40 119.13 3g1h s VAL 151 Ca 0.00 1.36 0.09 0.00 0.00 0.00 0.00 61.98 63.43 3g1h s VAL 151 Cb 0.00 -3.87 0.10 0.00 0.00 0.00 0.00 36.38 32.61 3g1h s VAL 151 CO 0.00 0.18 0.85 0.29 0.00 0.00 0.00 175.10 176.42 3g1h n LYS 152 N 2.98 0.71 -4.08 2.72 5.02 -1.26 -4.41 118.16 119.82 3g1h n LYS 152 Ca 0.06 -1.19 -0.21 0.00 -2.02 0.00 0.00 58.31 54.95 3g1h n LYS 152 Cb 0.45 -1.17 -0.17 0.00 -0.02 0.00 0.00 35.03 34.12 3g1h n LYS 152 CO 0.00 0.00 0.00 -0.80 -0.52 0.00 0.00 177.40 176.08 3g1h s ASN 153 N -0.77 1.24 0.22 4.39 0.01 -1.26 -0.58 114.94 118.20 3g1h s ASN 153 Ca 0.12 -0.14 0.06 0.00 -0.71 0.00 0.00 52.86 52.18 3g1h s ASN 153 Cb 0.08 -0.50 -0.05 0.00 0.41 0.00 0.00 41.25 41.18 3g1h s ASN 153 CO 0.11 -0.08 -0.07 -0.31 -1.51 0.00 0.00 177.10 175.23 3g1h s TYR 154 N 1.19 1.67 -0.12 2.20 1.51 0.38 -0.74 117.35 123.45 3g1h s TYR 154 Ca -0.07 -0.74 0.00 0.00 -1.01 0.00 0.00 57.07 55.26 3g1h s TYR 154 Cb -0.14 -0.89 0.02 0.00 -0.11 0.00 0.00 41.96 40.84 3g1h s TYR 154 CO -0.02 0.18 -0.11 0.08 -1.11 0.00 0.00 175.55 174.58 3g1h s VAL 155 N -3.16 1.25 0.19 0.71 1.01 0.45 -1.74 120.40 119.11 3g1h s VAL 155 Ca 0.25 -0.46 0.06 0.00 0.00 0.00 0.00 61.98 61.84 3g1h s VAL 155 Cb 0.03 -1.21 -0.05 0.00 0.00 0.00 0.00 36.38 35.16 3g1h s VAL 155 CO 0.08 0.40 -0.12 -0.83 0.00 0.00 0.00 175.10 174.63 3g1h s GLY 156 N 1.41 1.32 -0.23 4.51 0.00 -0.80 -2.20 107.32 111.33 3g1h s GLY 156 Ca 0.01 -1.61 -0.29 0.00 0.00 0.00 0.00 44.72 42.82 3g1h s GLY 156 CO -0.06 -1.70 1.31 2.56 0.00 0.00 0.00 173.10 175.21 3g1h s PRO 157 N -3.70 4.05 0.41 2.90 0.04 -1.23 -3.48 135.00 133.98 3g1h s PRO 157 Ca 0.21 1.46 0.20 0.00 0.04 0.00 0.00 61.00 62.91 3g1h s PRO 157 Cb 0.01 -3.84 0.83 0.00 0.04 0.00 0.00 34.50 31.54 3g1h s PRO 157 CO 0.05 -0.95 1.80 1.03 0.04 0.00 0.00 177.00 178.97 3g1h h SER 158 N 8.91 0.00 0.26 6.66 0.87 -1.55 -3.07 113.55 125.63 3g1h h SER 158 Ca -0.27 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.29 3g1h h SER 158 Cb 1.10 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.06 3g1h h SER 158 CO 1.00 0.31 0.00 0.35 -0.53 0.00 0.00 176.83 177.97 3g1h n THR 159 N -3.56 0.13 -3.22 2.23 -2.24 -1.26 -4.07 114.28 102.29 3g1h n THR 159 Ca -0.00 0.03 -0.23 0.00 -2.27 0.00 0.00 64.05 61.58 3g1h n THR 159 Cb 0.45 -0.64 -0.07 0.00 -2.10 0.00 0.00 70.33 67.97 3g1h n THR 159 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 3g1h n ARG 160 N -1.16 0.46 -0.28 -0.78 1.74 -1.16 -4.97 116.66 110.51 3g1h n ARG 160 Ca 0.15 -3.01 0.21 0.00 -0.77 0.00 0.00 57.85 54.43 3g1h n ARG 160 Cb 0.15 -1.46 0.51 0.00 -1.02 0.00 0.00 32.46 30.64 3g1h n ARG 160 CO 0.00 0.00 0.00 -1.00 -1.52 0.00 0.00 177.63 175.11 3g1h h PRO 161 N 4.83 0.39 -0.06 5.56 0.13 -1.75 0.14 132.00 141.24 3g1h h PRO 161 Ca 0.15 -0.02 -0.11 0.00 -0.87 0.00 0.00 66.00 65.15 3g1h h PRO 161 Cb 0.92 -0.09 -0.01 0.00 0.13 0.00 0.00 31.00 31.95 3g1h h PRO 161 CO 0.37 0.26 -0.46 1.05 -0.23 0.00 0.00 178.00 178.99 3g1h h GLU 162 N 0.40 0.14 0.05 0.86 9.09 -1.94 0.11 114.58 123.28 3g1h h GLU 162 Ca 0.52 -0.07 -0.23 0.00 0.05 0.00 0.00 59.36 59.63 3g1h h GLU 162 Cb 1.33 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 28.42 3g1h h GLU 162 CO -0.22 0.58 -1.07 0.00 0.05 0.00 0.00 179.01 178.35 3g1h h ARG 163 N 0.11 0.12 -0.27 1.06 2.47 -1.17 -2.19 114.38 114.52 3g1h h ARG 163 Ca 0.01 -0.20 -0.14 0.00 -1.26 0.00 0.00 59.98 58.39 3g1h h ARG 163 Cb 0.86 0.07 -0.01 0.00 -1.65 0.00 0.00 29.97 29.25 3g1h h ARG 163 CO 0.07 1.07 -0.41 1.25 0.56 0.00 0.00 179.97 182.51 3g1h h LEU 164 N 0.04 0.69 -0.33 3.04 5.85 -0.67 -2.13 115.31 121.81 3g1h h LEU 164 Ca -0.06 -0.31 -0.02 0.00 0.84 0.00 0.00 57.88 58.33 3g1h h LEU 164 Cb 1.80 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 42.62 3g1h h LEU 164 CO 0.16 1.01 0.11 -1.28 -0.34 0.00 0.00 178.44 178.10 3g1h h SER 165 N 0.53 0.47 -0.69 1.25 0.87 -0.74 -2.22 113.55 113.02 3g1h h SER 165 Ca 0.04 -0.19 0.00 0.00 -1.23 0.00 0.00 61.79 60.42 3g1h h SER 165 Cb 0.93 -0.12 -0.03 0.00 -0.44 0.00 0.00 62.40 62.73 3g1h h SER 165 CO 0.08 0.54 0.44 -0.09 -0.53 0.00 0.00 176.83 177.27 3g1h h ARG 166 N 0.38 0.92 -0.44 2.24 9.65 -1.19 -2.18 114.38 123.76 3g1h h ARG 166 Ca 0.11 -0.06 -0.04 0.00 -1.10 0.00 0.00 59.98 58.89 3g1h h ARG 166 Cb 0.22 -0.20 -0.02 0.00 -1.39 0.00 0.00 29.97 28.58 3g1h h ARG 166 CO -0.01 0.63 0.13 1.25 2.80 0.00 0.00 179.97 184.77 3g1h h LEU 167 N 0.95 0.65 -0.75 3.80 6.46 -1.11 -2.39 115.31 122.92 3g1h h LEU 167 Ca 0.25 -0.21 -0.01 0.00 -0.12 0.00 0.00 57.88 57.79 3g1h h LEU 167 Cb -0.08 -0.17 -0.04 0.00 -0.73 0.00 0.00 40.66 39.64 3g1h h LEU 167 CO -0.05 0.69 0.42 -0.09 -0.62 0.00 0.00 178.44 178.79 3g1h h ARG 168 N 0.58 1.04 -0.36 1.25 9.65 -0.95 -0.60 114.38 124.98 3g1h h ARG 168 Ca 0.14 -0.11 0.03 0.00 -1.10 0.00 0.00 59.98 58.93 3g1h h ARG 168 Cb 0.28 -0.21 -0.03 0.00 -1.39 0.00 0.00 29.97 28.62 3g1h h ARG 168 CO -0.00 0.76 0.18 0.93 2.80 0.00 0.00 179.97 184.64 3g1h h GLU 169 N 1.03 0.36 -0.42 0.20 5.08 -1.21 0.38 114.58 120.00 3g1h h GLU 169 Ca 0.26 -0.02 -0.03 0.00 -1.00 0.00 0.00 59.36 58.58 3g1h h GLU 169 Cb 0.02 -0.08 -0.02 0.00 0.50 0.00 0.00 28.75 29.17 3g1h h GLU 169 CO -0.04 0.24 0.16 0.82 -1.00 0.00 0.00 179.01 179.18 3g1h h ILE 170 N 0.37 1.20 0.00 3.13 2.04 -1.02 -3.18 117.51 120.05 3g1h h ILE 170 Ca 0.15 -0.65 0.00 0.00 1.00 0.00 0.00 64.86 65.37 3g1h h ILE 170 Cb 0.06 0.84 0.00 0.00 -0.74 0.00 0.00 36.82 36.98 3g1h h ILE 170 CO -0.10 0.23 -0.39 0.16 0.00 0.00 0.00 178.15 178.05 3g1h h ILE 171 N 0.54 0.00 -0.07 -0.67 3.07 -0.85 -3.48 117.51 116.05 3g1h h ILE 171 Ca 0.14 -0.69 0.01 0.00 1.55 0.00 0.00 64.86 65.87 3g1h h ILE 171 Cb 0.21 1.46 -0.00 0.00 -0.27 0.00 0.00 36.82 38.22 3g1h h ILE 171 CO -0.01 0.00 -0.01 0.61 -1.05 0.00 0.00 178.15 177.69 3g1h n GLY 172 N 1.25 -1.54 0.06 0.16 0.00 0.13 -4.16 105.19 101.09 3g1h n GLY 172 Ca 0.03 -1.52 0.13 0.00 0.00 0.00 0.00 46.02 44.67 3g1h n GLY 172 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3g1h n GLN 173 N -1.63 0.16 0.04 1.61 1.13 -1.26 -3.27 117.38 114.16 3g1h n GLN 173 Ca -0.00 0.11 0.13 0.00 -1.94 0.00 0.00 57.00 55.30 3g1h n GLN 173 Cb 0.01 -1.66 0.36 0.00 0.11 0.00 0.00 30.24 29.06 3g1h n GLN 173 CO 0.00 0.00 0.00 -0.40 -1.44 0.00 0.00 177.06 175.22 3g1h n ASP 174 N -1.93 0.48 -4.85 1.08 5.75 -1.26 -4.85 116.55 110.97 3g1h n ASP 174 Ca 0.06 0.23 -0.35 0.00 -0.01 0.00 0.00 54.79 54.72 3g1h n ASP 174 Cb 0.39 -0.20 -0.06 0.00 -1.03 0.00 0.00 41.12 40.23 3g1h n ASP 174 CO 0.00 0.00 0.00 -0.44 -0.11 0.00 0.00 177.20 176.65 3g1h s SER 175 N -3.64 6.78 -0.11 -1.12 0.01 -1.20 -5.03 113.70 109.38 3g1h s SER 175 Ca 0.10 1.02 -0.17 0.00 1.31 0.00 0.00 55.95 58.21 3g1h s SER 175 Cb 0.16 -2.26 -0.04 0.00 0.21 0.00 0.00 66.02 64.08 3g1h s SER 175 CO 0.64 0.10 0.43 0.12 0.41 0.00 0.00 173.24 174.94 3g1h s PHE 176 N -1.48 3.53 -0.07 2.43 5.36 0.26 -4.96 117.98 123.05 3g1h s PHE 176 Ca 0.38 0.84 0.02 0.00 -0.96 0.00 0.00 56.93 57.20 3g1h s PHE 176 Cb -0.14 -2.47 0.02 0.00 -0.34 0.00 0.00 43.02 40.08 3g1h s PHE 176 CO 0.19 0.25 -0.10 -1.17 -1.46 0.00 0.00 175.22 172.93 3g1h s LEU 177 N 0.36 1.51 0.18 6.12 2.96 -1.26 -0.47 118.68 128.08 3g1h s LEU 177 Ca 0.24 -0.26 0.11 0.00 -0.22 0.00 0.00 54.13 54.00 3g1h s LEU 177 Cb -0.15 -0.75 -0.04 0.00 0.50 0.00 0.00 46.19 45.75 3g1h s LEU 177 CO 0.09 -0.01 -0.25 0.27 -1.32 0.00 0.00 176.35 175.14 3g1h s ILE 178 N 0.87 2.34 -0.03 6.68 -4.36 -0.71 0.66 121.20 126.64 3g1h s ILE 178 Ca -0.11 -1.97 -0.00 0.00 -0.26 0.00 0.00 60.65 58.31 3g1h s ILE 178 Cb -0.15 -2.10 0.03 0.00 1.25 0.00 0.00 42.46 41.49 3g1h s ILE 178 CO 0.01 -0.07 0.02 -0.55 0.24 0.00 0.00 174.94 174.60 3g1h s SER 179 N -2.53 0.40 0.25 4.36 0.15 0.36 -1.90 113.70 114.78 3g1h s SER 179 Ca 0.19 0.02 0.05 0.00 0.70 0.00 0.00 55.95 56.91 3g1h s SER 179 Cb -0.08 -0.14 -0.03 0.00 -1.71 0.00 0.00 66.02 64.06 3g1h s SER 179 CO 0.09 -0.14 0.36 -2.16 1.20 0.00 0.00 173.24 172.59 3g1h s PRO 180 N 1.25 3.38 0.00 5.44 0.04 -1.23 -0.04 135.00 143.85 3g1h s PRO 180 Ca -0.07 -0.80 0.00 0.00 0.04 0.00 0.00 61.00 60.18 3g1h s PRO 180 Cb -0.13 -2.86 0.00 0.00 0.04 0.00 0.00 34.50 31.55 3g1h s PRO 180 CO -0.03 0.40 0.00 0.41 0.04 0.00 0.00 177.00 177.82 3g1h n GLY 181 N -1.41 1.18 3.59 0.56 0.00 -1.26 -1.46 105.19 106.38 3g1h n GLY 181 Ca -0.08 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.52 3g1h n GLY 181 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3g1h s VAL 182 N -2.00 4.88 0.00 1.61 1.01 -1.26 -0.84 120.40 123.81 3g1h s VAL 182 Ca 0.00 0.82 0.00 0.00 0.00 0.00 0.00 61.98 62.80 3g1h s VAL 182 Cb 0.00 -4.06 0.00 0.00 0.00 0.00 0.00 36.38 32.32 3g1h s VAL 182 CO 0.00 -0.24 0.00 0.61 0.00 0.00 0.00 175.10 175.47 3g1h n GLY 183 N 4.48 0.94 0.65 4.51 0.00 0.15 -4.58 105.19 111.34 3g1h n GLY 183 Ca -0.00 -0.91 0.49 0.00 0.00 0.00 0.00 46.02 45.60 3g1h n GLY 183 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3g1h h ALA 184 N 0.00 3.60 -0.02 4.61 0.00 -1.90 2.24 119.26 127.80 3g1h h ALA 184 Ca 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.88 3g1h h ALA 184 Cb 0.00 0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.94 3g1h h ALA 184 CO 0.00 -2.16 -0.20 1.04 0.00 0.00 0.00 179.25 177.93 3g1h n GLN 185 N -4.10 1.44 0.00 0.00 6.02 -1.26 -4.96 117.38 114.52 3g1h n GLN 185 Ca 0.41 -1.04 0.00 0.00 -0.01 0.00 0.00 57.00 56.36 3g1h n GLN 185 Cb 1.84 -1.48 0.00 0.00 1.02 0.00 0.00 30.24 31.62 3g1h n GLN 185 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3g1h n GLY 186 N 1.33 0.28 3.75 1.08 0.00 0.76 -4.90 105.19 107.48 3g1h n GLY 186 Ca 0.13 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.76 3g1h n GLY 186 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3g1h s GLY 187 N -1.62 3.09 -0.03 -0.02 0.00 -0.02 -4.72 107.32 104.00 3g1h s GLY 187 Ca 0.00 0.64 -0.24 0.00 0.00 0.00 0.00 44.72 45.12 3g1h s GLY 187 CO 0.00 1.20 0.71 -0.35 0.00 0.00 0.00 173.10 174.66 3g1h s ASP 188 N -1.19 7.05 0.07 1.64 2.15 -1.26 -0.67 116.67 124.46 3g1h s ASP 188 Ca 0.42 1.26 -0.30 0.00 0.43 0.00 0.00 52.55 54.37 3g1h s ASP 188 Cb -0.26 -2.42 -0.14 0.00 -0.30 0.00 0.00 42.92 39.80 3g1h s ASP 188 CO 0.32 -0.06 1.46 -0.65 -0.17 0.00 0.00 175.17 176.07 3g1h h PRO 189 N 6.35 -0.77 -0.45 4.34 0.11 -1.96 -1.77 132.00 137.87 3g1h h PRO 189 Ca -0.42 0.05 0.09 0.00 0.11 0.00 0.00 66.00 65.83 3g1h h PRO 189 Cb 1.20 0.17 -0.08 0.00 0.11 0.00 0.00 31.00 32.40 3g1h h PRO 189 CO 0.74 -0.51 -0.07 0.78 -0.21 0.00 0.00 178.00 178.72 3g1h h GLY 190 N -0.80 0.37 0.79 -0.55 0.00 -1.95 -0.95 103.07 99.99 3g1h h GLY 190 Ca -0.04 0.11 0.02 0.00 0.00 0.00 0.00 47.33 47.43 3g1h h GLY 190 CO -0.09 -0.15 0.05 0.83 0.00 0.00 0.00 176.54 177.17 3g1h h GLU 191 N 0.04 0.13 -0.74 4.80 4.39 -1.98 -2.29 114.58 118.93 3g1h h GLU 191 Ca 0.22 -0.01 0.10 0.00 0.34 0.00 0.00 59.36 60.01 3g1h h GLU 191 Cb 0.33 -0.03 -0.07 0.00 -0.10 0.00 0.00 28.75 28.88 3g1h h GLU 191 CO -0.43 0.09 0.38 1.15 -1.16 0.00 0.00 179.01 179.04 3g1h h THR 192 N 0.14 0.84 0.00 1.13 2.02 -0.71 -1.07 112.91 115.26 3g1h h THR 192 Ca 0.09 -0.22 0.00 0.00 0.77 0.00 0.00 66.41 67.05 3g1h h THR 192 Cb 0.08 0.15 0.00 0.00 -1.74 0.00 0.00 68.15 66.64 3g1h h THR 192 CO -0.11 0.12 0.00 0.18 0.37 0.00 0.00 175.52 176.07 3g1h n LEU 193 N -4.84 0.00 0.12 2.58 4.77 -0.42 -1.36 117.00 117.85 3g1h n LEU 193 Ca 0.12 0.00 -0.01 0.00 -0.03 0.00 0.00 56.01 56.09 3g1h n LEU 193 Cb 0.29 0.00 0.09 0.00 -2.33 0.00 0.00 43.42 41.47 3g1h n LEU 193 CO 0.25 0.00 0.42 0.03 -1.33 0.00 0.00 177.39 176.76 3g1h h ARG 194 N 0.00 0.00 0.00 3.23 3.08 -1.07 -3.37 114.38 116.24 3g1h h ARG 194 Ca 0.00 0.00 -0.07 0.00 0.07 0.00 0.00 59.98 59.98 3g1h h ARG 194 Cb 0.00 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.04 3g1h h ARG 194 CO 0.00 0.66 -1.26 1.19 -1.07 0.00 0.00 179.97 179.49 3g1h n PHE 195 N -3.50 0.00 -3.20 3.04 3.01 -1.01 -5.04 117.46 110.76 3g1h n PHE 195 Ca -0.00 0.00 -0.33 0.00 1.01 0.00 0.00 57.45 58.13 3g1h n PHE 195 Cb 0.71 -0.18 -0.06 0.00 -0.01 0.00 0.00 39.48 39.94 3g1h n PHE 195 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 3g1h s ALA 196 N -2.09 3.38 -0.37 4.37 0.00 -0.47 -4.88 121.76 121.71 3g1h s ALA 196 Ca -0.04 -0.03 0.23 0.00 0.00 0.00 0.00 51.96 52.13 3g1h s ALA 196 Cb 0.01 -2.69 0.13 0.00 0.00 0.00 0.00 23.12 20.57 3g1h s ALA 196 CO 0.13 0.37 1.19 -0.44 0.00 0.00 0.00 175.76 177.02 3g1h h ASP 197 N 2.39 0.00 -4.42 0.00 3.32 -0.09 -3.40 116.42 114.22 3g1h h ASP 197 Ca -0.48 -0.05 -0.06 0.00 0.02 0.00 0.00 57.03 56.46 3g1h h ASP 197 Cb 1.17 0.00 -0.21 0.00 0.22 0.00 0.00 39.33 40.52 3g1h h ASP 197 CO 0.66 0.03 0.08 0.00 -1.72 0.00 0.00 179.24 178.29 3g1h s ALA 198 N -3.29 -1.62 0.05 3.45 0.00 -1.11 -4.78 121.76 114.46 3g1h s ALA 198 Ca 0.02 1.55 0.02 0.00 0.00 0.00 0.00 51.96 53.55 3g1h s ALA 198 Cb 0.10 -0.60 -0.04 0.00 0.00 0.00 0.00 23.12 22.58 3g1h s ALA 198 CO 0.76 -0.33 0.08 0.96 0.00 0.00 0.00 175.76 177.23 3g1h s ILE 199 N -0.33 4.61 -0.16 0.00 -4.36 -0.17 -0.49 121.20 120.30 3g1h s ILE 199 Ca -0.05 -0.64 -0.04 0.00 -0.26 0.00 0.00 60.65 59.67 3g1h s ILE 199 Cb -0.03 -3.18 -0.03 0.00 1.25 0.00 0.00 42.46 40.47 3g1h s ILE 199 CO 0.04 0.21 -0.03 -0.63 0.24 0.00 0.00 174.94 174.77 3g1h s ILE 200 N -1.32 3.96 -0.08 8.37 1.01 0.94 0.04 121.20 134.12 3g1h s ILE 200 Ca 0.27 -0.33 -0.01 0.00 0.00 0.00 0.00 60.65 60.58 3g1h s ILE 200 Cb -0.12 -2.74 0.03 0.00 0.01 0.00 0.00 42.46 39.64 3g1h s ILE 200 CO 0.19 0.49 -0.03 -0.69 0.00 0.00 0.00 174.94 174.91 3g1h s VAL 201 N 0.33 0.58 0.00 2.92 1.01 -0.30 -4.05 120.40 120.89 3g1h s VAL 201 Ca -0.03 -0.03 0.00 0.00 0.00 0.00 0.00 61.98 61.92 3g1h s VAL 201 Cb -0.14 -0.68 0.00 0.00 0.00 0.00 0.00 36.38 35.56 3g1h s VAL 201 CO 0.03 0.28 0.00 0.61 0.00 0.00 0.00 175.10 176.02 3g1h n GLY 202 N 4.90 -0.12 0.37 4.51 0.00 -1.26 -2.27 105.19 111.32 3g1h n GLY 202 Ca -0.11 0.00 0.16 0.00 0.00 0.00 0.00 46.02 46.07 3g1h n GLY 202 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 3g1h h ARG 203 N 0.00 0.62 -0.49 1.61 3.08 -1.93 -1.42 114.38 115.85 3g1h h ARG 203 Ca 0.00 -0.04 0.14 0.00 0.07 0.00 0.00 59.98 60.15 3g1h h ARG 203 Cb 0.00 -0.14 -0.02 0.00 0.08 0.00 0.00 29.97 29.89 3g1h h ARG 203 CO 0.00 0.41 0.37 0.77 -1.07 0.00 0.00 179.97 180.45 3g1h h SER 204 N 0.63 0.00 0.00 7.04 0.02 -1.89 -0.63 113.55 118.73 3g1h h SER 204 Ca 0.58 0.00 -0.31 0.00 -0.84 0.00 0.00 61.79 61.21 3g1h h SER 204 Cb 1.07 0.00 -0.06 0.00 0.14 0.00 0.00 62.40 63.56 3g1h h SER 204 CO -0.35 0.00 -2.18 -0.38 -1.14 0.00 0.00 176.83 172.77 3g1h n ILE 205 N -4.25 1.19 1.05 3.27 5.41 -0.63 -4.24 119.36 121.16 3g1h n ILE 205 Ca 0.09 -0.48 0.13 0.00 1.00 0.00 0.00 62.75 63.49 3g1h n ILE 205 Cb 0.58 -1.19 0.35 0.00 -0.71 0.00 0.00 39.64 38.67 3g1h n ILE 205 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 3g1h n TYR 206 N -3.07 0.00 0.44 1.39 0.18 -0.66 -3.71 117.16 111.74 3g1h n TYR 206 Ca -0.36 0.00 0.08 0.00 1.88 0.00 0.00 57.90 59.49 3g1h n TYR 206 Cb 0.90 -0.28 0.09 0.00 -0.38 0.00 0.00 39.34 39.68 3g1h n TYR 206 CO 0.00 0.00 0.00 1.28 -2.08 0.00 0.00 176.86 176.06 3g1h n LEU 207 N -1.39 2.47 -4.84 -3.48 4.77 -0.25 -4.99 117.00 109.29 3g1h n LEU 207 Ca 0.07 -1.21 -0.33 0.00 -0.03 0.00 0.00 56.01 54.51 3g1h n LEU 207 Cb 0.33 -0.07 -0.06 0.00 -2.33 0.00 0.00 43.42 41.29 3g1h n LEU 207 CO 0.32 0.49 0.48 0.00 -1.33 0.00 0.00 177.39 177.35 3g1h s ALA 208 N -1.20 3.26 0.49 -1.18 0.00 -1.24 -4.95 121.76 116.94 3g1h s ALA 208 Ca 0.20 0.15 0.20 0.00 0.00 0.00 0.00 51.96 52.51 3g1h s ALA 208 Cb 0.13 -2.87 1.24 0.00 0.00 0.00 0.00 23.12 21.62 3g1h s ALA 208 CO 0.19 0.28 2.01 -0.44 0.00 0.00 0.00 175.76 177.80 3g1h h ASP 209 N 2.31 0.14 -3.06 0.00 3.45 -1.94 -3.33 116.42 114.00 3g1h h ASP 209 Ca -0.48 0.00 -0.56 0.00 0.43 0.00 0.00 57.03 56.42 3g1h h ASP 209 Cb 1.18 -0.03 -0.40 0.00 -0.56 0.00 0.00 39.33 39.52 3g1h h ASP 209 CO 0.64 0.08 -0.76 0.21 -1.57 0.00 0.00 179.24 177.84 3g1h s ASN 210 N -6.32 3.83 0.14 6.45 2.47 -1.26 -5.03 114.94 115.22 3g1h s ASN 210 Ca -0.06 -1.49 -0.23 0.00 0.42 0.00 0.00 52.86 51.50 3g1h s ASN 210 Cb 0.19 -0.70 0.01 0.00 -1.45 0.00 0.00 41.25 39.30 3g1h s ASN 210 CO 0.73 -0.42 1.64 -0.65 -3.72 0.00 0.00 177.10 174.68 3g1h h PRO 211 N 8.19 -0.26 -0.92 0.43 0.11 -1.72 -1.66 132.00 136.18 3g1h h PRO 211 Ca -0.16 0.02 0.02 0.00 0.11 0.00 0.00 66.00 65.99 3g1h h PRO 211 Cb 1.02 0.06 -0.05 0.00 0.11 0.00 0.00 31.00 32.14 3g1h h PRO 211 CO 0.46 -0.17 0.60 0.00 -0.21 0.00 0.00 178.00 178.68 3g1h h ALA 212 N 0.74 1.17 -0.28 -0.75 0.00 -1.87 -0.76 119.26 117.51 3g1h h ALA 212 Ca 0.12 -0.06 -0.09 0.00 0.00 0.00 0.00 54.91 54.88 3g1h h ALA 212 Cb 0.44 -0.36 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 3g1h h ALA 212 CO -0.33 0.54 -0.20 0.00 0.00 0.00 0.00 179.25 179.26 3g1h h ALA 213 N 1.35 1.13 -0.19 0.00 0.00 -1.89 0.28 119.26 119.94 3g1h h ALA 213 Ca 0.34 -0.32 -0.03 0.00 0.00 0.00 0.00 54.91 54.91 3g1h h ALA 213 Cb -0.11 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.54 3g1h h ALA 213 CO -0.08 0.54 0.00 0.00 0.00 0.00 0.00 179.25 179.71 3g1h h ALA 214 N 1.33 0.26 0.10 0.00 0.00 -0.69 -0.43 119.26 119.83 3g1h h ALA 214 Ca 0.08 -0.20 -0.00 0.00 0.00 0.00 0.00 54.91 54.78 3g1h h ALA 214 Cb 0.60 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.32 3g1h h ALA 214 CO 0.04 -0.03 -0.06 0.00 0.00 0.00 0.00 179.25 179.19 3g1h h ALA 215 N 0.79 -0.95 -0.98 0.00 0.00 -0.87 -1.45 119.26 115.79 3g1h h ALA 215 Ca 0.05 -0.03 0.34 0.00 0.00 0.00 0.00 54.91 55.27 3g1h h ALA 215 Cb 0.38 0.16 -0.17 0.00 0.00 0.00 0.00 17.79 18.17 3g1h h ALA 215 CO 0.01 -0.94 0.41 0.00 0.00 0.00 0.00 179.25 178.73 3g1h h ALA 216 N -1.81 1.79 0.05 0.00 0.00 -1.01 0.64 119.26 118.92 3g1h h ALA 216 Ca -0.01 0.25 0.02 0.00 0.00 0.00 0.00 54.91 55.16 3g1h h ALA 216 Cb 0.13 0.33 -0.02 0.00 0.00 0.00 0.00 17.79 18.22 3g1h h ALA 216 CO 0.01 -0.70 -0.13 0.78 0.00 0.00 0.00 179.25 179.21 3g1h h GLY 217 N 0.13 -0.21 0.64 0.00 0.00 -0.81 0.93 103.07 103.75 3g1h h GLY 217 Ca 0.73 0.16 0.01 0.00 0.00 0.00 0.00 47.33 48.22 3g1h h GLY 217 CO -0.73 -0.14 -0.27 -2.22 0.00 0.00 0.00 176.54 173.18 3g1h h ILE 218 N -0.25 0.42 -0.81 2.60 2.04 0.13 -1.57 117.51 120.06 3g1h h ILE 218 Ca 0.03 0.00 0.17 0.00 1.00 0.00 0.00 64.86 66.06 3g1h h ILE 218 Cb 0.28 0.42 -0.06 0.00 -0.74 0.00 0.00 36.82 36.73 3g1h h ILE 218 CO -0.10 0.00 0.54 0.40 0.00 0.00 0.00 178.15 178.99 3g1h h ILE 219 N -0.54 0.75 -0.18 -0.67 2.04 -0.64 -1.42 117.51 116.85 3g1h h ILE 219 Ca 0.00 -0.14 -0.07 0.00 1.00 0.00 0.00 64.86 65.66 3g1h h ILE 219 Cb 0.52 0.31 -0.00 0.00 -0.74 0.00 0.00 36.82 36.91 3g1h h ILE 219 CO -0.09 0.07 -0.15 -0.33 0.00 0.00 0.00 178.15 177.66 3g1h h GLU 220 N 0.40 0.41 -0.22 2.37 4.39 0.06 0.32 114.58 122.31 3g1h h GLU 220 Ca 0.41 -0.21 0.06 0.00 0.34 0.00 0.00 59.36 59.96 3g1h h GLU 220 Cb 0.99 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.63 3g1h h GLU 220 CO -0.14 0.76 0.22 0.66 -1.16 0.00 0.00 179.01 179.35 3g1h h SER 221 N 0.07 0.00 -0.10 1.42 4.64 -0.34 -0.14 113.55 119.10 3g1h h SER 221 Ca 0.03 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.35 3g1h h SER 221 Cb 0.67 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.76 3g1h h SER 221 CO 0.04 0.00 0.00 2.30 -0.87 0.00 0.00 176.83 178.30 3g1h n ILE 222 N -3.88 0.34 0.18 0.95 -5.35 -1.04 -4.63 119.36 105.92 3g1h n ILE 222 Ca 0.02 -0.67 0.16 0.00 -0.27 0.00 0.00 62.75 62.00 3g1h n ILE 222 Cb 0.35 0.95 0.60 0.00 -1.74 0.00 0.00 39.64 39.81 3g1h n ILE 222 CO 0.00 0.00 0.00 0.50 -1.76 0.00 0.00 176.55 175.29 3g1h h LYS 223 N 1.68 0.00 0.00 6.28 1.63 0.16 0.16 116.57 126.47 3g1h h LYS 223 Ca 0.00 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.80 3g1h h LYS 223 Cb 0.47 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.10 3g1h h LYS 223 CO 0.00 0.00 0.00 -0.25 -3.45 0.00 0.00 179.45 175.75 3g1h n ASP 224 N -3.12 0.00 0.00 4.20 8.00 -1.26 -5.07 116.55 119.30 3g1h n ASP 224 Ca 0.05 -0.04 0.00 0.00 0.71 0.00 0.00 54.79 55.51 3g1h n ASP 224 Cb 0.72 -0.14 0.00 0.00 -0.02 0.00 0.00 41.12 41.68 3g1h n ASP 224 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99