#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3g1h s MET 12 N 0.00 4.35 -1.22 5.55 0.00 -1.26 -2.94 119.30 123.78 3g1h s MET 12 Ca 0.00 1.92 0.00 0.00 0.00 0.00 0.00 55.69 57.61 3g1h s MET 12 Cb 0.00 -3.37 0.00 0.00 0.00 0.00 0.00 34.83 31.46 3g1h s MET 12 CO 0.00 -0.40 0.00 0.09 0.00 0.00 0.00 175.02 174.71 3g1h n ASN 13 N 4.30 -5.10 -1.45 1.11 3.02 -1.26 -2.96 115.26 112.93 3g1h n ASN 13 Ca 0.11 0.28 -0.11 0.00 -0.03 0.00 0.00 54.58 54.83 3g1h n ASN 13 Cb 0.44 -3.61 -0.04 0.00 -0.61 0.00 0.00 39.78 35.96 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 -1.72 -1.36 -5.02 3.52 1.74 -1.15 -4.90 116.66 107.78 3g1h n ARG 14 Ca -0.12 0.66 -0.32 0.00 -0.77 0.00 0.00 57.85 57.30 3g1h n ARG 14 Cb 0.50 -4.91 -0.16 0.00 -1.02 0.00 0.00 32.46 26.86 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 -3.72 2.35 -0.15 0.55 2.96 -1.16 -0.92 118.68 118.59 3g1h s LEU 15 Ca 0.00 -0.46 -0.00 0.00 -0.22 0.00 0.00 54.13 53.44 3g1h s LEU 15 Cb 0.00 -1.49 -0.01 0.00 0.50 0.00 0.00 46.19 45.19 3g1h s LEU 15 CO 0.00 0.16 -0.13 -0.63 -1.32 0.00 0.00 176.35 174.43 3g1h s ILE 16 N 0.36 2.91 -0.22 6.68 1.01 0.08 -4.59 121.20 127.43 3g1h s ILE 16 Ca -0.15 -0.70 -0.25 0.00 0.00 0.00 0.00 60.65 59.55 3g1h s ILE 16 Cb -0.17 -2.23 -0.01 0.00 0.01 0.00 0.00 42.46 40.06 3g1h s ILE 16 CO 0.07 0.51 0.85 -0.22 0.00 0.00 0.00 174.94 176.15 3g1h s LEU 17 N 0.66 4.11 -0.62 2.97 2.96 -0.86 -1.56 118.68 126.34 3g1h s LEU 17 Ca -0.07 1.10 -0.20 0.00 -0.22 0.00 0.00 54.13 54.75 3g1h s LEU 17 Cb -0.15 -3.23 0.10 0.00 0.50 0.00 0.00 46.19 43.40 3g1h s LEU 17 CO 0.02 -0.50 0.77 0.00 -1.32 0.00 0.00 176.35 175.33 3g1h s ALA 18 N 2.69 3.36 -0.80 5.97 0.00 0.25 0.07 121.76 133.29 3g1h s ALA 18 Ca 0.37 -2.18 -0.19 0.00 0.00 0.00 0.00 51.96 49.96 3g1h s ALA 18 Cb -0.16 -3.62 0.13 0.00 0.00 0.00 0.00 23.12 19.48 3g1h s ALA 18 CO 0.09 -2.46 0.96 1.41 0.00 0.00 0.00 175.76 175.75 3g1h s MET 19 N 2.94 3.40 0.00 0.00 1.75 -0.86 -4.20 119.30 122.33 3g1h s MET 19 Ca 0.14 -1.61 0.17 0.00 -1.25 0.00 0.00 55.69 53.15 3g1h s MET 19 Cb -0.22 -4.59 0.12 0.00 2.84 0.00 0.00 34.83 32.98 3g1h s MET 19 CO 0.06 -1.66 1.03 -0.25 -0.65 0.00 0.00 175.02 173.55 3g1h n ASP 20 N 6.34 2.36 -4.70 1.11 8.00 -1.26 -4.29 116.55 124.11 3g1h n ASP 20 Ca 0.11 -1.68 -0.42 0.00 0.71 0.00 0.00 54.79 53.51 3g1h n ASP 20 Cb 0.47 0.04 0.00 0.00 -0.02 0.00 0.00 41.12 41.61 3g1h n ASP 20 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 3g1h n LEU 21 N 0.87 3.85 -2.07 0.64 4.77 -1.26 -4.56 117.00 119.24 3g1h n LEU 21 Ca 0.10 1.16 -0.17 0.00 -0.03 0.00 0.00 56.01 57.07 3g1h n LEU 21 Cb 0.42 -1.50 0.20 0.00 -2.33 0.00 0.00 43.42 40.21 3g1h n LEU 21 CO 0.12 -0.52 1.16 0.23 -1.33 0.00 0.00 177.39 177.04 3g1h n MET 22 N 0.31 2.54 -3.98 3.23 2.81 -1.26 -4.34 117.12 116.43 3g1h n MET 22 Ca 0.05 -2.77 -0.26 0.00 -1.81 0.00 0.00 57.70 52.91 3g1h n MET 22 Cb 0.38 -2.10 -0.17 0.00 -0.71 0.00 0.00 33.22 30.62 3g1h n MET 22 CO 0.00 0.00 0.00 1.21 1.51 0.00 0.00 175.97 178.69 3g1h s ASN 23 N -1.04 2.03 0.00 7.83 2.47 -1.26 -4.80 114.94 120.17 3g1h s ASN 23 Ca 0.52 -0.27 0.00 0.00 0.42 0.00 0.00 52.86 53.52 3g1h s ASN 23 Cb 0.43 -0.78 0.00 0.00 -1.45 0.00 0.00 41.25 39.44 3g1h s ASN 23 CO 0.11 -0.11 0.99 0.54 -3.72 0.00 0.00 177.10 174.91 3g1h n ARG 24 N 4.80 0.00 -0.38 0.43 1.74 -1.26 -0.35 116.66 121.64 3g1h n ARG 24 Ca -0.14 0.85 -0.03 0.00 -0.77 0.00 0.00 57.85 57.77 3g1h n ARG 24 Cb 0.50 -1.49 0.01 0.00 -1.02 0.00 0.00 32.46 30.46 3g1h n ARG 24 CO 0.00 0.00 0.00 -0.44 -1.52 0.00 0.00 177.63 175.67 3g1h h ASP 25 N 0.00 -1.58 -0.55 0.55 3.32 -1.98 0.30 116.42 116.47 3g1h h ASP 25 Ca 0.00 0.31 -0.10 0.00 0.02 0.00 0.00 57.03 57.26 3g1h h ASP 25 Cb 0.00 0.80 -0.02 0.00 0.22 0.00 0.00 39.33 40.32 3g1h h ASP 25 CO 0.00 -0.28 -0.04 0.44 -1.72 0.00 0.00 179.24 177.64 3g1h h ASP 26 N -0.01 1.00 -0.48 6.45 3.32 -1.94 0.12 116.42 124.88 3g1h h ASP 26 Ca 0.30 -0.29 -0.01 0.00 0.02 0.00 0.00 57.03 57.05 3g1h h ASP 26 Cb 0.56 -0.27 -0.02 0.00 0.22 0.00 0.00 39.33 39.82 3g1h h ASP 26 CO -0.97 1.07 0.25 0.00 -1.72 0.00 0.00 179.24 177.88 3g1h h ALA 27 N 1.02 0.61 -0.19 3.45 0.00 0.12 0.87 119.26 125.15 3g1h h ALA 27 Ca 0.16 -0.09 -0.08 0.00 0.00 0.00 0.00 54.91 54.89 3g1h h ALA 27 Cb 0.59 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 18.18 3g1h h ALA 27 CO 0.04 0.14 -0.21 -0.07 0.00 0.00 0.00 179.25 179.15 3g1h h LEU 28 N 0.63 0.52 0.96 0.00 3.38 -0.35 -1.50 115.31 118.95 3g1h h LEU 28 Ca 0.17 -0.49 -0.05 0.00 0.09 0.00 0.00 57.88 57.60 3g1h h LEU 28 Cb 0.07 -0.15 0.01 0.00 0.09 0.00 0.00 40.66 40.68 3g1h h LEU 28 CO -0.03 0.90 -0.47 -0.09 0.09 0.00 0.00 178.44 178.85 3g1h h ARG 29 N 0.15 -1.25 -0.63 1.13 2.43 -0.63 0.18 114.38 115.76 3g1h h ARG 29 Ca 0.03 0.09 0.06 0.00 -0.81 0.00 0.00 59.98 59.34 3g1h h ARG 29 Cb 0.76 0.28 -0.05 0.00 -0.42 0.00 0.00 29.97 30.54 3g1h h ARG 29 CO 0.05 -0.83 0.34 0.28 -1.51 0.00 0.00 179.97 178.30 3g1h h VAL 30 N -1.29 0.96 -0.31 0.20 2.07 -0.91 0.17 116.25 117.13 3g1h h VAL 30 Ca -0.13 -0.22 0.01 0.00 0.82 0.00 0.00 66.70 67.18 3g1h h VAL 30 Cb 0.99 0.27 -0.02 0.00 -1.52 0.00 0.00 31.29 31.02 3g1h h VAL 30 CO 0.21 0.12 0.19 0.74 0.02 0.00 0.00 177.57 178.84 3g1h h THR 31 N 0.63 1.05 -0.13 2.57 2.02 -1.22 -2.44 112.91 115.38 3g1h h THR 31 Ca 0.28 -0.13 0.01 0.00 0.77 0.00 0.00 66.41 67.34 3g1h h THR 31 Cb 0.18 0.63 -0.01 0.00 -1.74 0.00 0.00 68.15 67.20 3g1h h THR 31 CO -0.18 0.07 0.04 1.23 0.37 0.00 0.00 175.52 177.05 3g1h h GLY 32 N 0.38 0.15 0.04 2.16 0.00 -0.15 -0.87 103.07 104.79 3g1h h GLY 32 Ca 0.12 -0.02 0.22 0.00 0.00 0.00 0.00 47.33 47.65 3g1h h GLY 32 CO -0.05 0.01 0.63 0.83 0.00 0.00 0.00 176.54 177.96 3g1h h GLU 33 N 0.10 0.54 -0.45 4.80 5.08 -0.36 -0.75 114.58 123.53 3g1h h GLU 33 Ca 0.06 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.39 3g1h h GLU 33 Cb 0.04 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 29.17 3g1h h GLU 33 CO -0.07 0.35 0.00 1.33 -1.00 0.00 0.00 179.01 179.63 3g1h n VAL 34 N -4.68 2.06 0.10 3.13 0.24 -0.95 -4.53 118.33 113.69 3g1h n VAL 34 Ca 0.24 -1.46 0.02 0.00 -2.04 0.00 0.00 64.34 61.10 3g1h n VAL 34 Cb 0.72 -0.03 0.39 0.00 -1.47 0.00 0.00 33.84 33.45 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 2.93 0.30 0.00 7.34 9.65 0.31 -1.40 114.38 133.50 3g1h h ARG 35 Ca 0.00 -0.06 0.00 0.00 -1.10 0.00 0.00 59.98 58.82 3g1h h ARG 35 Cb 1.45 -0.05 0.00 0.00 -1.39 0.00 0.00 29.97 29.98 3g1h h ARG 35 CO 0.25 0.38 0.00 -0.85 2.80 0.00 0.00 179.97 182.55 3g1h n GLU 36 N -4.31 0.02 -0.10 0.20 0.28 -1.26 -3.19 120.64 112.27 3g1h n GLU 36 Ca -0.00 0.29 -0.14 0.00 -0.16 0.00 0.00 57.16 57.15 3g1h n GLU 36 Cb 0.24 -1.50 -0.11 0.00 1.43 0.00 0.00 31.44 31.50 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 -1.47 0.00 -4.19 -1.84 4.02 -0.55 -5.04 117.16 108.09 3g1h n TYR 37 Ca 0.03 0.00 -0.16 0.00 -0.01 0.00 0.00 57.90 57.76 3g1h n TYR 37 Cb 0.13 -0.83 -0.11 0.00 -0.02 0.00 0.00 39.34 38.50 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 -2.43 1.08 -0.15 -0.72 -5.25 -1.09 -4.52 121.20 108.12 3g1h s ILE 38 Ca -0.26 -1.54 0.01 0.00 -0.99 0.00 0.00 60.65 57.88 3g1h s ILE 38 Cb 0.07 -1.29 0.03 0.00 2.95 0.00 0.00 42.46 44.22 3g1h s ILE 38 CO 0.53 -0.41 0.79 -0.90 -1.79 0.00 0.00 174.94 173.16 3g1h n ASP 39 N 0.80 1.63 -4.00 4.36 5.75 -1.26 -4.67 116.55 119.15 3g1h n ASP 39 Ca -0.18 -1.54 -0.28 0.00 -0.01 0.00 0.00 54.79 52.79 3g1h n ASP 39 Cb 0.56 -0.01 -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 -0.57 1.32 -0.03 2.12 2.01 -1.26 0.35 115.64 119.57 3g1h s THR 40 Ca 0.02 -0.51 0.07 0.00 0.31 0.00 0.00 61.69 61.58 3g1h s THR 40 Cb 0.01 -1.24 -0.01 0.00 0.01 0.00 0.00 72.50 71.27 3g1h s THR 40 CO 0.02 0.41 -0.23 -0.69 -0.69 0.00 0.00 174.62 173.44 3g1h s VAL 41 N 1.24 1.84 -0.22 3.82 1.01 -0.23 -2.02 120.40 125.84 3g1h s VAL 41 Ca -0.02 -0.98 -0.09 0.00 0.00 0.00 0.00 61.98 60.88 3g1h s VAL 41 Cb -0.14 -1.54 -0.05 0.00 0.00 0.00 0.00 36.38 34.65 3g1h s VAL 41 CO -0.04 0.52 0.12 -0.75 0.00 0.00 0.00 175.10 174.95 3g1h s LYS 42 N -0.40 4.06 -0.14 2.72 2.20 0.11 -0.61 119.74 127.69 3g1h s LYS 42 Ca 0.05 -0.28 0.01 0.00 -0.36 0.00 0.00 55.97 55.38 3g1h s LYS 42 Cb -0.10 -3.42 -0.00 0.00 -1.51 0.00 0.00 37.83 32.79 3g1h s LYS 42 CO 0.00 0.17 -0.17 0.42 -0.36 0.00 0.00 175.35 175.42 3g1h s ILE 43 N 0.72 2.64 0.32 5.43 1.01 0.21 -2.03 121.20 129.49 3g1h s ILE 43 Ca 0.07 -0.79 0.04 0.00 0.00 0.00 0.00 60.65 59.96 3g1h s ILE 43 Cb -0.13 -2.09 0.04 0.00 0.01 0.00 0.00 42.46 40.29 3g1h s ILE 43 CO 0.01 0.53 0.30 0.61 0.00 0.00 0.00 174.94 176.39 3g1h n GLY 44 N 3.81 2.59 0.21 6.18 0.00 -1.26 -0.22 105.19 116.50 3g1h n GLY 44 Ca -0.19 -2.22 0.06 0.00 0.00 0.00 0.00 46.02 43.66 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 0.42 0.00 -0.73 1.61 0.99 -1.97 -2.80 116.97 114.50 3g1h h TYR 45 Ca -0.18 0.00 0.05 0.00 2.00 0.00 0.00 58.73 60.60 3g1h h TYR 45 Cb 0.71 0.00 -0.05 0.00 1.00 0.00 0.00 36.73 38.39 3g1h h TYR 45 CO 0.00 0.28 0.43 -1.35 -0.00 0.00 0.00 178.16 177.52 3g1h h PRO 46 N 0.00 0.78 0.10 4.88 0.11 -1.95 0.26 132.00 136.19 3g1h h PRO 46 Ca -0.00 -0.05 -0.14 0.00 0.11 0.00 0.00 66.00 65.92 3g1h h PRO 46 Cb 0.55 -0.18 0.01 0.00 0.11 0.00 0.00 31.00 31.50 3g1h h PRO 46 CO 0.04 0.52 -0.64 1.25 -0.21 0.00 0.00 178.00 178.96 3g1h h LEU 47 N 0.80 0.33 -1.00 2.35 5.85 -1.74 -3.03 115.31 118.88 3g1h h LEU 47 Ca 0.32 -0.96 -0.03 0.00 0.84 0.00 0.00 57.88 58.05 3g1h h LEU 47 Cb 0.14 -0.11 -0.03 0.00 0.37 0.00 0.00 40.66 41.03 3g1h h LEU 47 CO -0.16 1.30 0.32 0.58 -0.34 0.00 0.00 178.44 180.14 3g1h h VAL 48 N -0.54 1.23 0.00 1.05 2.07 -1.43 0.22 116.25 118.85 3g1h h VAL 48 Ca -0.12 -0.69 -0.12 0.00 0.82 0.00 0.00 66.70 66.59 3g1h h VAL 48 Cb 1.47 0.35 -0.02 0.00 -1.52 0.00 0.00 31.29 31.57 3g1h h VAL 48 CO 0.10 0.29 -0.56 -0.07 0.02 0.00 0.00 177.57 177.35 3g1h h LEU 49 N 1.02 0.00 0.00 2.57 3.38 -0.60 0.36 115.31 122.04 3g1h h LEU 49 Ca 0.24 0.00 -0.30 0.00 0.09 0.00 0.00 57.88 57.91 3g1h h LEU 49 Cb 0.14 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 40.84 3g1h h LEU 49 CO -0.03 0.56 -1.80 -1.20 0.09 0.00 0.00 178.44 176.07 3g1h n SER 50 N -3.44 0.75 -0.15 -0.43 7.64 -1.10 -4.48 113.62 112.41 3g1h n SER 50 Ca 0.00 0.36 0.03 0.00 1.01 0.00 0.00 58.87 60.27 3g1h n SER 50 Cb 0.67 0.09 0.01 0.00 -1.01 0.00 0.00 64.21 63.97 3g1h n SER 50 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 3g1h n GLU 51 N -3.00 1.68 0.00 1.43 -0.58 0.77 -5.06 120.64 115.87 3g1h n GLU 51 Ca -0.19 -0.56 0.00 0.00 -0.42 0.00 0.00 57.16 55.99 3g1h n GLU 51 Cb 1.07 -0.98 0.00 0.00 -0.57 0.00 0.00 31.44 30.95 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 0.60 0.27 0.19 0.62 0.00 0.13 -4.59 105.19 102.41 3g1h n GLY 52 Ca 0.03 -1.67 0.14 0.00 0.00 0.00 0.00 46.02 44.52 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 -1.92 -2.92 114.93 114.56 3g1h h MET 53 Ca 0.00 0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.63 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 0.00 -0.06 -0.44 1.06 0.00 0.00 176.91 177.47 3g1h h ASP 54 N 0.00 0.00 0.28 1.22 3.32 -1.92 -2.54 116.42 116.77 3g1h h ASP 54 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 3g1h h ASP 54 Cb 0.26 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.81 3g1h h ASP 54 CO 0.00 0.06 0.00 -0.29 -1.72 0.00 0.00 179.24 177.29 3g1h h ILE 55 N 0.00 0.00 0.02 0.35 2.10 -1.76 -1.46 117.51 116.77 3g1h h ILE 55 Ca -0.00 -0.13 -0.00 0.00 1.08 0.00 0.00 64.86 65.81 3g1h h ILE 55 Cb 0.48 1.05 0.00 0.00 -1.09 0.00 0.00 36.82 37.26 3g1h h ILE 55 CO 0.01 0.00 -0.01 0.40 -1.08 0.00 0.00 178.15 177.47 3g1h h ILE 56 N 0.00 1.38 -0.34 2.19 2.04 -1.70 -0.74 117.51 120.34 3g1h h ILE 56 Ca 0.00 -1.28 -0.01 0.00 1.00 0.00 0.00 64.86 64.57 3g1h h ILE 56 Cb 0.14 2.23 -0.02 0.00 -0.74 0.00 0.00 36.82 38.43 3g1h h ILE 56 CO 0.00 0.32 0.15 0.00 0.00 0.00 0.00 178.15 178.63 3g1h h ALA 57 N 0.36 1.62 0.03 1.87 0.00 -1.39 -1.03 119.26 120.71 3g1h h ALA 57 Ca -0.00 -0.09 -0.00 0.00 0.00 0.00 0.00 54.91 54.82 3g1h h ALA 57 Cb 0.56 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.20 3g1h h ALA 57 CO 0.01 0.30 -0.01 1.49 0.00 0.00 0.00 179.25 181.04 3g1h h GLU 58 N 0.48 -0.03 -0.69 0.00 4.81 -1.20 0.11 114.58 118.05 3g1h h GLU 58 Ca 0.12 0.00 0.06 0.00 -0.13 0.00 0.00 59.36 59.42 3g1h h GLU 58 Cb 0.08 0.01 -0.06 0.00 0.63 0.00 0.00 28.75 29.41 3g1h h GLU 58 CO -0.01 0.23 0.38 0.74 -0.73 0.00 0.00 179.01 179.62 3g1h h PHE 59 N -0.29 0.70 -0.21 0.92 -1.00 -0.73 0.72 116.94 117.05 3g1h h PHE 59 Ca -0.00 0.03 -0.01 0.00 2.81 0.00 0.00 57.97 60.79 3g1h h PHE 59 Cb 0.28 -0.21 -0.01 0.00 3.61 0.00 0.00 35.95 39.62 3g1h h PHE 59 CO 0.01 0.33 0.08 -0.09 -1.61 0.00 0.00 178.31 177.03 3g1h h ARG 60 N 0.70 0.31 0.20 1.51 2.43 -1.03 -1.07 114.38 117.43 3g1h h ARG 60 Ca 0.31 -0.06 -0.01 0.00 -0.81 0.00 0.00 59.98 59.42 3g1h h ARG 60 Cb 0.21 -0.05 0.00 0.00 -0.42 0.00 0.00 29.97 29.71 3g1h h ARG 60 CO -0.19 0.37 -0.10 0.87 -1.51 0.00 0.00 179.97 179.41 3g1h h LYS 61 N 0.18 -0.27 -0.40 0.20 1.57 -0.25 -0.73 116.57 116.88 3g1h h LYS 61 Ca 0.07 0.02 0.06 0.00 -1.87 0.00 0.00 60.65 58.93 3g1h h LYS 61 Cb 0.18 0.06 -0.05 0.00 0.08 0.00 0.00 32.23 32.50 3g1h h LYS 61 CO -0.01 0.08 0.08 0.00 -0.57 0.00 0.00 179.45 179.04 3g1h h ARG 62 N -0.66 0.21 -0.02 3.15 3.08 0.44 -3.33 114.38 117.26 3g1h h ARG 62 Ca -0.03 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.01 3g1h h ARG 62 Cb 0.47 -0.05 0.00 0.00 0.08 0.00 0.00 29.97 30.47 3g1h h ARG 62 CO 0.05 0.14 0.00 1.19 -1.07 0.00 0.00 179.97 180.27 3g1h n PHE 63 N -5.09 0.01 -3.42 3.04 3.01 -0.41 -5.01 117.46 109.59 3g1h n PHE 63 Ca 0.03 -0.03 -0.25 0.00 1.01 0.00 0.00 57.45 58.21 3g1h n PHE 63 Cb 0.18 -0.00 0.04 0.00 -0.01 0.00 0.00 39.48 39.69 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 0.27 -0.52 3.85 1.37 0.00 -0.28 -4.98 105.19 104.89 3g1h n GLY 64 Ca 0.03 0.18 -0.23 0.00 0.00 0.00 0.00 46.02 46.00 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 -3.70 4.57 -0.14 0.00 3.52 0.15 -4.65 118.95 118.71 3g1h s ARG 66 Ca 0.33 1.25 -0.01 0.00 -0.13 0.00 0.00 55.73 57.16 3g1h s ARG 66 Cb -0.09 -2.98 -0.02 0.00 -1.56 0.00 0.00 34.95 30.31 3g1h s ARG 66 CO 0.25 0.39 -0.10 0.42 -0.81 0.00 0.00 175.30 175.46 3g1h s ILE 67 N -1.45 3.31 -0.25 4.11 -1.09 -1.26 -1.07 121.20 123.51 3g1h s ILE 67 Ca 0.45 -0.57 -0.03 0.00 -2.23 0.00 0.00 60.65 58.27 3g1h s ILE 67 Cb -0.20 -2.41 0.01 0.00 -1.58 0.00 0.00 42.46 38.27 3g1h s ILE 67 CO 0.25 0.51 -0.03 -0.63 -1.23 0.00 0.00 174.94 173.81 3g1h s ILE 68 N 0.40 3.24 -0.53 2.92 1.01 0.22 -1.41 121.20 127.04 3g1h s ILE 68 Ca -0.08 -0.77 -0.25 0.00 0.00 0.00 0.00 60.65 59.55 3g1h s ILE 68 Cb -0.15 -2.58 0.04 0.00 0.01 0.00 0.00 42.46 39.77 3g1h s ILE 68 CO 0.04 0.26 0.96 0.00 0.00 0.00 0.00 174.94 176.21 3g1h s ALA 69 N 1.41 3.16 -1.35 9.38 0.00 0.84 0.67 121.76 135.88 3g1h s ALA 69 Ca 0.03 -1.11 -0.13 0.00 0.00 0.00 0.00 51.96 50.74 3g1h s ALA 69 Cb -0.16 -3.74 0.10 0.00 0.00 0.00 0.00 23.12 19.32 3g1h s ALA 69 CO -0.03 -2.34 1.93 -3.47 0.00 0.00 0.00 175.76 171.85 3g1h n ASP 70 N 7.48 4.59 -0.21 0.00 -0.08 0.70 -1.10 116.55 127.93 3g1h n ASP 70 Ca 0.03 -2.95 0.11 0.00 -1.51 0.00 0.00 54.79 50.47 3g1h n ASP 70 Cb 0.48 -1.62 0.02 0.00 2.34 0.00 0.00 41.12 42.34 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 5.87 0.00 -4.12 -0.67 0.99 -1.25 -4.25 117.46 114.03 3g1h n PHE 71 Ca 0.46 0.00 -0.29 0.00 -0.00 0.00 0.00 57.45 57.62 3g1h n PHE 71 Cb 0.40 -0.04 -0.05 0.00 -1.00 0.00 0.00 39.48 38.79 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 -0.85 -1.97 -1.63 -1.08 5.02 -0.05 -4.74 118.16 112.85 3g1h n LYS 72 Ca 0.07 0.24 -0.55 0.00 -2.02 0.00 0.00 58.31 56.06 3g1h n LYS 72 Cb 0.39 -3.97 -0.07 0.00 -0.02 0.00 0.00 35.03 31.36 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 -4.52 0.09 -2.70 -0.18 0.31 -0.97 -4.25 118.33 106.12 3g1h n VAL 73 Ca -0.30 -0.02 -0.09 0.00 -0.01 0.00 0.00 64.34 63.93 3g1h n VAL 73 Cb 0.68 -0.87 0.07 0.00 -0.91 0.00 0.00 33.84 32.80 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 3.37 2.38 -3.83 3.52 0.00 -1.26 -1.26 120.51 123.43 3g1h n ALA 74 Ca 0.21 -2.36 0.00 0.00 0.00 0.00 0.00 53.44 51.29 3g1h n ALA 74 Cb 0.16 -0.97 0.00 0.00 0.00 0.00 0.00 19.45 18.64 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 -0.25 1.81 -4.80 0.00 -0.08 -1.26 -4.97 116.55 107.00 3g1h n ASP 75 Ca 0.05 -0.92 -0.30 0.00 -1.51 0.00 0.00 54.79 52.10 3g1h n ASP 75 Cb 0.82 0.00 0.08 0.00 2.34 0.00 0.00 41.12 44.37 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 -0.94 3.35 0.17 5.18 -4.36 -1.26 -4.74 121.20 118.60 3g1h s ILE 76 Ca 0.00 0.44 -0.21 0.00 -0.26 0.00 0.00 60.65 60.62 3g1h s ILE 76 Cb 0.00 -3.14 0.09 0.00 1.25 0.00 0.00 42.46 40.66 3g1h s ILE 76 CO 0.00 -0.57 1.61 -0.65 0.24 0.00 0.00 174.94 175.57 3g1h h PRO 77 N -1.02 -0.19 -0.54 0.37 0.11 -1.87 -0.65 132.00 128.22 3g1h h PRO 77 Ca -0.46 0.01 0.10 0.00 0.11 0.00 0.00 66.00 65.77 3g1h h PRO 77 Cb 1.25 0.04 -0.08 0.00 0.11 0.00 0.00 31.00 32.32 3g1h h PRO 77 CO 0.58 -0.13 0.05 0.93 -0.21 0.00 0.00 178.00 179.22 3g1h h GLU 78 N -0.20 0.17 -0.07 1.05 3.07 -1.94 -1.24 114.58 115.42 3g1h h GLU 78 Ca 0.19 -0.01 -0.19 0.00 -0.50 0.00 0.00 59.36 58.86 3g1h h GLU 78 Cb 0.51 -0.04 -0.00 0.00 -0.84 0.00 0.00 28.75 28.37 3g1h h GLU 78 CO -0.54 0.11 -0.75 1.15 -1.40 0.00 0.00 179.01 177.58 3g1h h THR 79 N 0.17 1.38 -0.77 1.13 2.02 -1.86 -3.03 112.91 111.96 3g1h h THR 79 Ca 0.27 -2.17 0.00 0.00 0.77 0.00 0.00 66.41 65.28 3g1h h THR 79 Cb 0.41 2.14 -0.04 0.00 -1.74 0.00 0.00 68.15 68.92 3g1h h THR 79 CO -0.41 0.65 0.49 0.78 0.37 0.00 0.00 175.52 177.40 3g1h h ASN 80 N 0.27 0.90 -0.06 4.18 4.21 -0.56 -0.69 115.58 123.83 3g1h h ASN 80 Ca -0.03 -0.04 0.00 0.00 1.21 0.00 0.00 56.30 57.44 3g1h h ASN 80 Cb 1.33 -0.23 -0.00 0.00 -1.12 0.00 0.00 38.32 38.30 3g1h h ASN 80 CO 0.13 0.67 0.04 -0.33 -1.29 0.00 0.00 177.43 176.65 3g1h h GLU 81 N 1.05 0.08 -0.81 0.81 5.08 -1.13 -0.85 114.58 118.80 3g1h h GLU 81 Ca 0.28 -0.01 0.02 0.00 -1.00 0.00 0.00 59.36 58.65 3g1h h GLU 81 Cb -0.08 -0.02 -0.04 0.00 0.50 0.00 0.00 28.75 29.11 3g1h h GLU 81 CO -0.06 0.06 0.53 0.87 -1.00 0.00 0.00 179.01 179.42 3g1h h LYS 82 N 0.07 1.04 -0.50 2.33 1.57 -1.28 -0.36 116.57 119.44 3g1h h LYS 82 Ca 0.02 -0.06 -0.06 0.00 -1.87 0.00 0.00 60.65 58.68 3g1h h LYS 82 Cb 0.00 -0.23 -0.02 0.00 0.08 0.00 0.00 32.23 32.06 3g1h h LYS 82 CO -0.00 0.69 0.10 0.82 -0.57 0.00 0.00 179.45 180.48 3g1h h ILE 83 N 1.07 1.25 -0.26 1.86 2.04 -0.89 -0.56 117.51 122.01 3g1h h ILE 83 Ca 0.31 -0.90 -0.04 0.00 1.00 0.00 0.00 64.86 65.22 3g1h h ILE 83 Cb -0.08 0.86 -0.01 0.00 -0.74 0.00 0.00 36.82 36.85 3g1h h ILE 83 CO -0.08 0.32 -0.00 0.00 0.00 0.00 0.00 178.15 178.39 3g1h h ARG 85 N 0.25 0.83 0.00 0.00 2.43 -0.96 0.19 114.38 117.11 3g1h h ARG 85 Ca 0.07 -0.05 -0.07 0.00 -0.81 0.00 0.00 59.98 59.12 3g1h h ARG 85 Cb 0.43 -0.19 -0.01 0.00 -0.42 0.00 0.00 29.97 29.78 3g1h h ARG 85 CO 0.01 0.55 -0.35 0.00 -1.51 0.00 0.00 179.97 178.68 3g1h h ALA 86 N 1.26 1.12 0.17 2.80 0.00 -1.03 0.82 119.26 124.40 3g1h h ALA 86 Ca 0.25 -0.31 -0.29 0.00 0.00 0.00 0.00 54.91 54.55 3g1h h ALA 86 Cb -0.05 -0.06 0.02 0.00 0.00 0.00 0.00 17.79 17.70 3g1h h ALA 86 CO -0.08 0.43 -1.31 1.15 0.00 0.00 0.00 179.25 179.45 3g1h h THR 87 N 0.00 1.43 0.04 0.00 2.02 -0.31 -2.89 112.91 113.20 3g1h h THR 87 Ca -0.00 -2.93 -0.23 0.00 0.77 0.00 0.00 66.41 64.01 3g1h h THR 87 Cb 0.76 2.96 0.00 0.00 -1.74 0.00 0.00 68.15 70.14 3g1h h THR 87 CO 0.04 0.86 -1.01 -0.26 0.37 0.00 0.00 175.52 175.53 3g1h h PHE 88 N 0.10 0.51 -0.49 3.16 0.04 -0.58 -2.18 116.94 117.50 3g1h h PHE 88 Ca -0.17 -0.30 0.06 0.00 2.80 0.00 0.00 57.97 60.35 3g1h h PHE 88 Cb 2.03 -0.05 -0.03 0.00 2.20 0.00 0.00 35.95 40.10 3g1h h PHE 88 CO 0.08 1.15 0.33 -0.22 -0.60 0.00 0.00 178.31 179.05 3g1h h LYS 89 N 0.16 0.42 0.00 1.51 3.64 -0.85 0.82 116.57 122.27 3g1h h LYS 89 Ca -0.09 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.27 3g1h h LYS 89 Cb 1.67 -0.09 0.00 0.00 -0.41 0.00 0.00 32.23 33.40 3g1h h LYS 89 CO 0.17 0.28 0.00 0.00 -2.27 0.00 0.00 179.45 177.62 3g1h n ALA 90 N -2.51 2.62 -1.32 5.00 0.00 -1.09 -4.89 120.51 118.32 3g1h n ALA 90 Ca 0.07 -0.14 0.00 0.00 0.00 0.00 0.00 53.44 53.36 3g1h n ALA 90 Cb 0.24 -1.37 0.00 0.00 0.00 0.00 0.00 19.45 18.32 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 0.84 0.59 3.77 0.00 0.00 0.28 -3.48 105.19 107.19 3g1h n GLY 91 Ca 0.17 -0.80 -0.38 0.00 0.00 0.00 0.00 46.02 45.00 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 3.23 0.08 4.61 0.00 -0.83 -4.87 121.76 121.98 3g1h s ALA 92 Ca 0.00 0.77 0.02 0.00 0.00 0.00 0.00 51.96 52.75 3g1h s ALA 92 Cb 0.00 -3.29 -0.25 0.00 0.00 0.00 0.00 23.12 19.58 3g1h s ALA 92 CO 0.00 -0.16 1.15 -0.44 0.00 0.00 0.00 175.76 176.30 3g1h h ASP 93 N 3.12 0.21 -5.04 0.00 3.32 -1.58 -3.43 116.42 113.03 3g1h h ASP 93 Ca -0.47 -0.24 -0.11 0.00 0.02 0.00 0.00 57.03 56.22 3g1h h ASP 93 Cb 1.21 -0.07 -0.18 0.00 0.22 0.00 0.00 39.33 40.51 3g1h h ASP 93 CO 0.64 1.19 -0.34 0.00 -1.72 0.00 0.00 179.24 179.01 3g1h s ALA 94 N -2.67 -0.53 0.03 3.45 0.00 -0.90 -1.72 121.76 119.42 3g1h s ALA 94 Ca -0.02 -0.05 0.05 0.00 0.00 0.00 0.00 51.96 51.93 3g1h s ALA 94 Cb 0.08 0.22 -0.02 0.00 0.00 0.00 0.00 23.12 23.41 3g1h s ALA 94 CO 0.85 -0.33 -0.14 -1.50 0.00 0.00 0.00 175.76 174.64 3g1h s ILE 95 N -2.12 1.12 -0.17 0.00 2.07 -0.53 -0.11 121.20 121.46 3g1h s ILE 95 Ca -0.08 -0.94 -0.13 0.00 -1.41 0.00 0.00 60.65 58.08 3g1h s ILE 95 Cb -0.03 -1.00 -0.05 0.00 0.13 0.00 0.00 42.46 41.51 3g1h s ILE 95 CO -0.01 0.05 0.27 -0.63 -1.91 0.00 0.00 174.94 172.71 3g1h s ILE 96 N -0.77 5.32 -0.07 2.00 1.01 -0.26 -0.82 121.20 127.61 3g1h s ILE 96 Ca 0.02 0.50 0.03 0.00 0.00 0.00 0.00 60.65 61.20 3g1h s ILE 96 Cb -0.07 -3.61 0.00 0.00 0.01 0.00 0.00 42.46 38.79 3g1h s ILE 96 CO 0.01 0.40 -0.17 -0.69 0.00 0.00 0.00 174.94 174.49 3g1h s VAL 97 N 0.46 1.46 0.34 2.92 1.01 0.30 -0.87 120.40 126.02 3g1h s VAL 97 Ca 0.15 -0.69 -0.27 0.00 0.00 0.00 0.00 61.98 61.16 3g1h s VAL 97 Cb -0.13 -1.29 -0.09 0.00 0.00 0.00 0.00 36.38 34.87 3g1h s VAL 97 CO 0.03 0.43 1.18 -1.00 0.00 0.00 0.00 175.10 175.73 3g1h s HIS 98 N 0.37 3.24 -0.12 5.22 3.76 -0.39 -0.64 115.29 126.72 3g1h s HIS 98 Ca -0.12 1.57 0.17 0.00 -0.15 0.00 0.00 55.06 56.53 3g1h s HIS 98 Cb -0.15 -3.42 -0.19 0.00 1.11 0.00 0.00 32.58 29.93 3g1h s HIS 98 CO 0.04 -1.18 0.62 0.41 -0.85 0.00 0.00 174.74 173.79 3g1h n GLY 99 N 0.84 -1.12 0.40 -2.22 0.00 -1.14 -4.44 105.19 97.51 3g1h n GLY 99 Ca 0.01 -0.21 0.22 0.00 0.00 0.00 0.00 46.02 46.05 3g1h n GLY 99 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 173.32 173.59 3g1h h PHE 100 N 0.00 0.00 0.00 1.61 -0.00 -1.92 -1.50 116.94 115.13 3g1h h PHE 100 Ca -0.23 0.00 0.00 0.00 -0.00 0.00 0.00 57.97 57.74 3g1h h PHE 100 Cb 1.68 0.00 0.00 0.00 -0.00 0.00 0.00 35.95 37.63 3g1h h PHE 100 CO 0.00 0.00 0.00 -2.30 -0.00 0.00 0.00 178.31 176.01 3g1h n PRO 101 N -4.05 0.27 0.00 6.09 -0.02 -1.26 -4.99 135.00 131.05 3g1h n PRO 101 Ca 0.10 0.11 0.00 0.00 -2.02 0.00 0.00 63.50 61.69 3g1h n PRO 101 Cb 0.68 -1.50 0.00 0.00 -0.02 0.00 0.00 33.50 32.66 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 0.30 2.18 0.13 -1.23 0.00 -0.56 -4.67 105.19 101.34 3g1h n GLY 102 Ca 0.09 -2.03 -0.10 0.00 0.00 0.00 0.00 46.02 43.98 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 0.32 -0.85 4.61 0.00 -1.94 -2.79 119.26 118.61 3g1h h ALA 103 Ca 0.00 -0.06 0.05 0.00 0.00 0.00 0.00 54.91 54.89 3g1h h ALA 103 Cb 0.00 -0.10 -0.05 0.00 0.00 0.00 0.00 17.79 17.64 3g1h h ALA 103 CO 0.00 -0.15 0.56 0.38 0.00 0.00 0.00 179.25 180.04 3g1h h ASP 104 N 0.29 0.88 0.44 0.00 2.03 -1.99 0.82 116.42 118.89 3g1h h ASP 104 Ca 0.09 -0.00 -0.11 0.00 -0.73 0.00 0.00 57.03 56.28 3g1h h ASP 104 Cb 0.06 -0.19 -0.01 0.00 -0.83 0.00 0.00 39.33 38.35 3g1h h ASP 104 CO -0.01 0.59 -0.49 0.28 -1.03 0.00 0.00 179.24 178.57 3g1h h SER 105 N 1.01 0.07 -0.02 4.15 0.02 -1.80 -2.25 113.55 114.73 3g1h h SER 105 Ca 0.35 -0.03 -0.18 0.00 -0.84 0.00 0.00 61.79 61.09 3g1h h SER 105 Cb 0.11 -0.02 0.01 0.00 0.14 0.00 0.00 62.40 62.64 3g1h h SER 105 CO -0.11 0.55 -0.71 0.58 -1.14 0.00 0.00 176.83 176.00 3g1h h VAL 106 N 0.05 1.38 -0.84 2.27 2.07 -1.04 -3.23 116.25 116.91 3g1h h VAL 106 Ca -0.00 -2.09 0.04 0.00 0.82 0.00 0.00 66.70 65.47 3g1h h VAL 106 Cb 0.89 2.48 -0.05 0.00 -1.52 0.00 0.00 31.29 33.09 3g1h h VAL 106 CO 0.07 0.62 0.55 -0.09 0.02 0.00 0.00 177.57 178.74 3g1h h ARG 107 N 0.06 0.98 -0.92 1.57 9.65 -0.73 -1.27 114.38 123.72 3g1h h ARG 107 Ca -0.08 -0.06 -0.01 0.00 -1.10 0.00 0.00 59.98 58.73 3g1h h ARG 107 Cb 1.39 -0.22 -0.04 0.00 -1.39 0.00 0.00 29.97 29.71 3g1h h ARG 107 CO 0.14 0.65 0.55 0.00 2.80 0.00 0.00 179.97 184.11 3g1h h ALA 108 N 1.52 1.17 -0.52 2.80 0.00 -1.46 0.21 119.26 122.99 3g1h h ALA 108 Ca 0.34 -0.11 -0.12 0.00 0.00 0.00 0.00 54.91 55.03 3g1h h ALA 108 Cb 0.09 -0.37 -0.02 0.00 0.00 0.00 0.00 17.79 17.49 3g1h h ALA 108 CO -0.11 0.64 -0.14 0.00 0.00 0.00 0.00 179.25 179.63 3g1h h LEU 110 N 0.88 1.03 -0.24 0.00 3.38 -0.51 -1.68 115.31 118.17 3g1h h LEU 110 Ca 0.13 -0.24 -0.00 0.00 0.09 0.00 0.00 57.88 57.85 3g1h h LEU 110 Cb 0.71 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 41.18 3g1h h LEU 110 CO 0.05 1.02 0.13 0.78 0.09 0.00 0.00 178.44 180.52 3g1h h ASN 111 N 1.01 0.29 -0.45 -0.43 2.35 -0.49 -0.59 115.58 117.27 3g1h h ASN 111 Ca 0.20 -0.08 -0.06 0.00 -0.55 0.00 0.00 56.30 55.81 3g1h h ASN 111 Cb 0.43 -0.07 -0.02 0.00 0.05 0.00 0.00 38.32 38.71 3g1h h ASN 111 CO 0.01 0.29 0.04 0.58 -1.65 0.00 0.00 177.43 176.70 3g1h h VAL 112 N 0.27 1.25 -0.35 2.81 2.07 -1.40 -0.22 116.25 120.70 3g1h h VAL 112 Ca 0.08 -0.98 -0.04 0.00 0.82 0.00 0.00 66.70 66.58 3g1h h VAL 112 Cb 0.06 1.00 -0.02 0.00 -1.52 0.00 0.00 31.29 30.82 3g1h h VAL 112 CO -0.01 0.34 0.04 0.00 0.02 0.00 0.00 177.57 177.96 3g1h h ALA 113 N 0.93 1.43 -0.11 1.67 0.00 -1.18 0.09 119.26 122.09 3g1h h ALA 113 Ca 0.13 -0.17 -0.09 0.00 0.00 0.00 0.00 54.91 54.79 3g1h h ALA 113 Cb 0.44 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.09 3g1h h ALA 113 CO 0.02 0.41 -0.27 1.49 0.00 0.00 0.00 179.25 180.90 3g1h h GLU 114 N 0.50 0.38 -0.70 0.00 4.81 -0.81 0.75 114.58 119.52 3g1h h GLU 114 Ca 0.11 -0.26 0.02 0.00 -0.13 0.00 0.00 59.36 59.10 3g1h h GLU 114 Cb 0.26 0.04 -0.04 0.00 0.63 0.00 0.00 28.75 29.64 3g1h h GLU 114 CO 0.00 0.87 0.46 1.49 -0.73 0.00 0.00 179.01 181.10 3g1h h GLU 115 N -0.04 0.88 -0.52 1.92 4.81 -0.63 -2.51 114.58 118.48 3g1h h GLU 115 Ca -0.00 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.18 3g1h h GLU 115 Cb 0.87 -0.20 0.00 0.00 0.63 0.00 0.00 28.75 30.05 3g1h h GLU 115 CO 0.06 0.58 0.00 -1.33 -0.73 0.00 0.00 179.01 177.59 3g1h n MET 116 N -4.44 2.58 -3.38 1.92 2.81 -0.02 -4.97 117.12 111.62 3g1h n MET 116 Ca 0.08 -2.42 -0.19 0.00 -1.81 0.00 0.00 57.70 53.36 3g1h n MET 116 Cb 0.07 -1.52 0.07 0.00 -0.71 0.00 0.00 33.22 31.13 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 1.51 -0.32 2.18 3.03 0.00 -0.07 -5.03 105.19 106.49 3g1h n GLY 117 Ca 0.21 0.10 -0.19 0.00 0.00 0.00 0.00 46.02 46.14 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 -4.18 1.15 -4.67 1.61 5.12 0.24 -5.02 116.66 110.90 3g1h n ARG 118 Ca -0.08 -2.23 -0.29 0.00 -1.93 0.00 0.00 57.85 53.32 3g1h n ARG 118 Cb 0.59 0.71 -0.14 0.00 -1.16 0.00 0.00 32.46 32.46 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 -3.08 1.61 -0.06 5.56 0.41 -0.70 -4.46 118.70 117.97 3g1h s GLU 119 Ca 0.03 -1.21 0.03 0.00 -0.41 0.00 0.00 54.97 53.41 3g1h s GLU 119 Cb 0.00 -1.92 -0.02 0.00 -1.78 0.00 0.00 34.13 30.41 3g1h s GLU 119 CO 0.02 0.48 -0.14 0.08 -0.49 0.00 0.00 175.26 175.21 3g1h s VAL 120 N -0.92 3.10 -0.15 2.63 1.01 -1.26 -1.45 120.40 123.37 3g1h s VAL 120 Ca 0.12 -0.70 0.01 0.00 0.00 0.00 0.00 61.98 61.41 3g1h s VAL 120 Cb -0.10 -2.23 0.00 0.00 0.00 0.00 0.00 36.38 34.05 3g1h s VAL 120 CO 0.04 0.58 -0.17 -0.36 0.00 0.00 0.00 175.10 175.19 3g1h s PHE 121 N -0.60 2.75 -0.26 5.22 0.40 -0.00 -4.11 117.98 121.38 3g1h s PHE 121 Ca 0.09 -1.12 -0.18 0.00 -0.60 0.00 0.00 56.93 55.12 3g1h s PHE 121 Cb -0.11 -1.87 -0.03 0.00 0.51 0.00 0.00 43.02 41.52 3g1h s PHE 121 CO 0.01 -0.51 0.50 -1.17 0.70 0.00 0.00 175.22 174.75 3g1h s LEU 122 N 0.82 4.05 -0.43 -0.37 2.96 -0.06 -0.54 118.68 125.11 3g1h s LEU 122 Ca -0.06 0.51 -0.25 0.00 -0.22 0.00 0.00 54.13 54.11 3g1h s LEU 122 Cb -0.15 -2.65 0.02 0.00 0.50 0.00 0.00 46.19 43.91 3g1h s LEU 122 CO -0.01 -0.27 0.90 -0.22 -1.32 0.00 0.00 176.35 175.43 3g1h s LEU 123 N 2.26 4.04 -0.19 -0.68 2.96 0.19 -0.95 118.68 126.30 3g1h s LEU 123 Ca 0.21 0.21 -0.10 0.00 -0.22 0.00 0.00 54.13 54.23 3g1h s LEU 123 Cb -0.16 -3.17 -0.21 0.00 0.50 0.00 0.00 46.19 43.15 3g1h s LEU 123 CO 0.09 -0.97 0.11 0.35 -1.32 0.00 0.00 176.35 174.61 3g1h n THR 124 N 6.25 1.63 -4.43 3.68 -2.24 -0.99 -2.91 114.28 115.28 3g1h n THR 124 Ca 0.06 -0.44 -0.21 0.00 -2.27 0.00 0.00 64.05 61.19 3g1h n THR 124 Cb 0.48 -1.77 -0.14 0.00 -2.10 0.00 0.00 70.33 66.80 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 -2.49 0.99 0.45 -0.78 2.12 -1.26 -4.38 118.70 113.34 3g1h s GLU 125 Ca -0.29 -0.69 0.03 0.00 0.36 0.00 0.00 54.97 54.39 3g1h s GLU 125 Cb 0.08 -0.99 0.01 0.00 0.26 0.00 0.00 34.13 33.49 3g1h s GLU 125 CO 0.65 0.25 0.64 -1.64 -0.54 0.00 0.00 175.26 174.62 3g1h s MET 126 N -0.92 2.89 -0.04 4.30 -1.94 -1.26 -3.90 119.30 118.43 3g1h s MET 126 Ca 0.03 -0.83 0.18 0.00 -1.71 0.00 0.00 55.69 53.35 3g1h s MET 126 Cb -0.07 -2.64 -0.27 0.00 2.01 0.00 0.00 34.83 33.86 3g1h s MET 126 CO 0.01 -0.32 0.36 -1.13 -0.01 0.00 0.00 175.02 173.93 3g1h n SER 127 N -2.01 0.95 -4.68 3.03 3.41 -1.26 -4.72 113.62 108.34 3g1h n SER 127 Ca 0.04 0.00 -0.29 0.00 -0.26 0.00 0.00 58.87 58.36 3g1h n SER 127 Cb 0.59 1.73 0.17 0.00 -0.26 0.00 0.00 64.21 66.44 3g1h n SER 127 CO 0.00 0.00 0.00 -1.38 -0.16 0.00 0.00 175.04 173.50 3g1h s HIS 128 N -3.16 2.14 0.11 7.33 -3.43 -1.26 -4.78 115.29 112.24 3g1h s HIS 128 Ca -0.07 1.04 -0.20 0.00 -0.80 0.00 0.00 55.06 55.03 3g1h s HIS 128 Cb 0.11 -3.25 -0.08 0.00 -1.43 0.00 0.00 32.58 27.93 3g1h s HIS 128 CO 0.73 -2.81 1.76 -1.35 -2.00 0.00 0.00 174.74 171.07 3g1h h PRO 129 N -1.84 0.17 0.00 -0.38 0.11 -2.00 -2.82 132.00 125.24 3g1h h PRO 129 Ca -0.54 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.56 3g1h h PRO 129 Cb 1.32 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.39 3g1h h PRO 129 CO 0.57 0.11 0.04 0.41 -0.21 0.00 0.00 178.00 178.92 3g1h n GLY 130 N -1.14 -0.53 0.18 -0.55 0.00 -1.26 -1.72 105.19 100.16 3g1h n GLY 130 Ca -0.04 0.04 0.13 0.00 0.00 0.00 0.00 46.02 46.15 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 1.86 1.00 0.00 4.61 0.00 -1.84 -2.04 119.26 122.85 3g1h h ALA 131 Ca 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 54.91 54.76 3g1h h ALA 131 Cb 0.08 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.85 3g1h h ALA 131 CO 0.00 0.00 -0.71 0.93 0.00 0.00 0.00 179.25 179.47 3g1h h GLU 132 N 0.00 0.00 -0.13 0.00 5.08 -1.56 0.98 114.58 118.95 3g1h h GLU 132 Ca 0.00 0.00 0.03 0.00 -1.00 0.00 0.00 59.36 58.39 3g1h h GLU 132 Cb 0.17 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.39 3g1h h GLU 132 CO 0.00 0.71 -0.05 0.52 -1.00 0.00 0.00 179.01 179.19 3g1h h MET 133 N 0.00 -0.03 0.00 2.33 2.86 -1.60 -3.41 114.93 115.09 3g1h h MET 133 Ca -0.01 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.63 3g1h h MET 133 Cb 1.36 0.01 0.00 0.00 0.06 0.00 0.00 31.60 33.03 3g1h h MET 133 CO 0.09 -0.02 -0.36 1.19 1.06 0.00 0.00 176.91 178.88 3g1h n PHE 134 N -5.18 0.00 0.31 -0.22 3.01 -1.26 -4.89 117.46 109.24 3g1h n PHE 134 Ca -0.04 0.00 -0.17 0.00 1.01 0.00 0.00 57.45 58.25 3g1h n PHE 134 Cb 0.11 0.00 -0.09 0.00 -0.01 0.00 0.00 39.48 39.50 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 0.44 -0.75 4.37 2.04 -1.78 -3.11 117.51 118.73 3g1h h ILE 135 Ca 0.00 0.00 0.17 0.00 1.00 0.00 0.00 64.86 66.03 3g1h h ILE 135 Cb 0.36 0.44 -0.12 0.00 -0.74 0.00 0.00 36.82 36.76 3g1h h ILE 135 CO 0.00 0.00 0.15 -0.61 0.00 0.00 0.00 178.15 177.69 3g1h h GLN 136 N -0.75 0.23 0.00 2.37 4.15 -1.02 0.22 115.11 120.30 3g1h h GLN 136 Ca -0.07 -0.01 -0.02 0.00 0.77 0.00 0.00 58.65 59.32 3g1h h GLN 136 Cb 0.58 -0.05 -0.00 0.00 0.21 0.00 0.00 27.48 28.22 3g1h h GLN 136 CO 0.12 0.15 -0.08 0.78 -1.93 0.00 0.00 178.83 177.87 3g1h h GLY 137 N 0.23 0.00 0.04 2.39 0.00 -1.79 -2.86 103.07 101.08 3g1h h GLY 137 Ca 0.42 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.75 3g1h h GLY 137 CO -0.55 0.00 -1.34 0.00 0.00 0.00 0.00 176.54 174.65 3g1h n ALA 138 N -2.28 4.01 -0.28 3.60 0.00 0.56 -4.66 120.51 121.46 3g1h n ALA 138 Ca -0.02 -0.56 0.09 0.00 0.00 0.00 0.00 53.44 52.95 3g1h n ALA 138 Cb 0.19 -0.78 0.22 0.00 0.00 0.00 0.00 19.45 19.08 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 2.63 1.02 -0.36 0.00 0.00 -0.72 -0.09 119.26 121.74 3g1h h ALA 139 Ca 0.00 0.24 -0.07 0.00 0.00 0.00 0.00 54.91 55.07 3g1h h ALA 139 Cb 0.68 0.38 -0.01 0.00 0.00 0.00 0.00 17.79 18.84 3g1h h ALA 139 CO 0.00 -0.44 -0.06 -0.44 0.00 0.00 0.00 179.25 178.31 3g1h h ASP 140 N 0.15 0.68 0.02 0.00 5.19 -1.83 -0.49 116.42 120.15 3g1h h ASP 140 Ca 0.48 -0.35 -0.10 0.00 -0.62 0.00 0.00 57.03 56.45 3g1h h ASP 140 Cb 0.91 -0.18 -0.01 0.00 0.18 0.00 0.00 39.33 40.23 3g1h h ASP 140 CO -0.67 0.87 -0.30 -0.08 -3.12 0.00 0.00 179.24 175.94 3g1h h GLU 141 N 0.48 0.41 -0.07 3.56 4.81 -1.66 -1.30 114.58 120.81 3g1h h GLU 141 Ca 0.10 -0.16 -0.02 0.00 -0.13 0.00 0.00 59.36 59.14 3g1h h GLU 141 Cb 0.56 -0.02 -0.00 0.00 0.63 0.00 0.00 28.75 29.91 3g1h h GLU 141 CO 0.03 0.67 -0.04 0.82 -0.73 0.00 0.00 179.01 179.76 3g1h h ILE 142 N 0.36 1.33 -0.67 2.32 2.04 -0.90 0.14 117.51 122.13 3g1h h ILE 142 Ca 0.05 -1.06 0.07 0.00 1.00 0.00 0.00 64.86 64.91 3g1h h ILE 142 Cb 0.70 1.90 -0.06 0.00 -0.74 0.00 0.00 36.82 38.62 3g1h h ILE 142 CO 0.05 0.29 0.36 0.00 0.00 0.00 0.00 178.15 178.86 3g1h h ALA 143 N 0.61 0.90 -0.47 1.87 0.00 -0.97 0.96 119.26 122.15 3g1h h ALA 143 Ca 0.01 0.03 -0.04 0.00 0.00 0.00 0.00 54.91 54.91 3g1h h ALA 143 Cb 0.49 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.15 3g1h h ALA 143 CO 0.01 0.02 0.14 0.00 0.00 0.00 0.00 179.25 179.42 3g1h h ARG 144 N 0.66 0.69 -0.59 0.00 3.08 -1.12 -1.40 114.38 115.69 3g1h h ARG 144 Ca 0.31 -0.12 -0.06 0.00 0.07 0.00 0.00 59.98 60.17 3g1h h ARG 144 Cb 0.22 -0.12 -0.03 0.00 0.08 0.00 0.00 29.97 30.13 3g1h h ARG 144 CO -0.20 0.61 0.11 1.98 -1.07 0.00 0.00 179.97 181.41 3g1h h MET 145 N 0.68 0.95 -0.55 0.04 4.05 0.16 -2.03 114.93 118.22 3g1h h MET 145 Ca 0.16 -0.22 -0.02 0.00 -0.28 0.00 0.00 59.70 59.33 3g1h h MET 145 Cb 0.22 -0.13 -0.02 0.00 -0.80 0.00 0.00 31.60 30.86 3g1h h MET 145 CO -0.01 0.87 0.26 0.78 0.23 0.00 0.00 176.91 179.03 3g1h h GLY 146 N 1.02 0.85 0.94 1.39 0.00 0.05 -1.08 103.07 106.23 3g1h h GLY 146 Ca 0.19 -0.43 -0.00 0.00 0.00 0.00 0.00 47.33 47.08 3g1h h GLY 146 CO 0.01 0.41 0.08 -2.08 0.00 0.00 0.00 176.54 174.95 3g1h h VAL 147 N 0.74 1.10 -0.42 4.60 2.07 -1.09 -0.45 116.25 122.80 3g1h h VAL 147 Ca 0.19 -0.27 0.07 0.00 0.82 0.00 0.00 66.70 67.50 3g1h h VAL 147 Cb 0.13 1.01 -0.02 0.00 -1.52 0.00 0.00 31.29 30.89 3g1h h VAL 147 CO -0.02 0.09 0.29 0.44 0.02 0.00 0.00 177.57 178.39 3g1h h ASP 148 N 0.14 0.25 1.47 0.57 3.32 -1.07 -1.45 116.42 119.65 3g1h h ASP 148 Ca 0.05 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.10 3g1h h ASP 148 Cb 0.08 -0.05 0.00 0.00 0.22 0.00 0.00 39.33 39.57 3g1h h ASP 148 CO -0.01 0.16 -0.18 -0.07 -1.72 0.00 0.00 179.24 177.42 3g1h h LEU 149 N 0.28 0.00 0.00 1.55 3.38 -0.49 -3.48 115.31 116.56 3g1h h LEU 149 Ca 0.19 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.12 3g1h h LEU 149 Cb 0.39 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.14 3g1h h LEU 149 CO -0.04 0.02 0.00 0.61 0.09 0.00 0.00 178.44 179.12 3g1h n GLY 150 N 1.25 0.66 3.66 0.83 0.00 -0.30 -5.06 105.19 106.24 3g1h n GLY 150 Ca 0.04 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.65 3g1h n GLY 150 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3g1h n VAL 151 N -2.00 2.46 0.00 1.61 0.31 -0.50 -4.91 118.33 115.29 3g1h n VAL 151 Ca 0.00 -0.50 0.00 0.00 -0.01 0.00 0.00 64.34 63.83 3g1h n VAL 151 Cb 0.00 -1.39 0.00 0.00 -0.91 0.00 0.00 33.84 31.54 3g1h n VAL 151 CO 0.00 0.00 0.00 0.29 -1.32 0.00 0.00 176.83 175.80 3g1h n LYS 152 N 0.15 2.07 -5.13 5.55 4.76 -1.26 -4.67 118.16 119.63 3g1h n LYS 152 Ca 0.08 0.00 -0.32 0.00 -2.87 0.00 0.00 58.31 55.20 3g1h n LYS 152 Cb 0.39 -0.85 -0.16 0.00 -1.84 0.00 0.00 35.03 32.57 3g1h n LYS 152 CO 0.00 0.00 0.00 -0.80 -1.37 0.00 0.00 177.40 175.23 3g1h s ASN 153 N -1.69 3.35 0.07 4.39 0.01 -1.26 -0.26 114.94 119.56 3g1h s ASN 153 Ca 0.00 -0.44 0.02 0.00 -0.71 0.00 0.00 52.86 51.72 3g1h s ASN 153 Cb 0.00 -1.04 -0.03 0.00 0.41 0.00 0.00 41.25 40.59 3g1h s ASN 153 CO 0.00 0.24 -0.07 -0.31 -1.51 0.00 0.00 177.10 175.45 3g1h s TYR 154 N -0.10 0.76 -0.11 2.20 1.51 -0.24 -0.88 117.35 120.49 3g1h s TYR 154 Ca -0.05 -0.75 0.03 0.00 -1.01 0.00 0.00 57.07 55.30 3g1h s TYR 154 Cb -0.14 -0.45 0.01 0.00 -0.11 0.00 0.00 41.96 41.26 3g1h s TYR 154 CO 0.04 -0.14 -0.19 0.08 -1.11 0.00 0.00 175.55 174.23 3g1h s VAL 155 N -2.67 1.75 0.29 0.71 1.01 -0.12 -1.05 120.40 120.32 3g1h s VAL 155 Ca 0.02 -0.82 0.07 0.00 0.00 0.00 0.00 61.98 61.25 3g1h s VAL 155 Cb -0.01 -1.56 -0.06 0.00 0.00 0.00 0.00 36.38 34.75 3g1h s VAL 155 CO -0.03 0.49 -0.05 -0.83 0.00 0.00 0.00 175.10 174.68 3g1h s GLY 156 N 0.69 1.91 0.07 4.51 0.00 -0.61 -2.34 107.32 111.54 3g1h s GLY 156 Ca -0.12 -1.95 -0.24 0.00 0.00 0.00 0.00 44.72 42.41 3g1h s GLY 156 CO 0.03 -1.87 0.75 2.56 0.00 0.00 0.00 173.10 174.56 3g1h s PRO 157 N -3.72 4.49 0.05 2.90 0.04 -1.25 -3.58 135.00 133.92 3g1h s PRO 157 Ca 0.31 1.05 0.18 0.00 0.04 0.00 0.00 61.00 62.57 3g1h s PRO 157 Cb 0.04 -3.33 -0.14 0.00 0.04 0.00 0.00 34.50 31.10 3g1h s PRO 157 CO 0.13 0.37 0.76 -1.13 0.04 0.00 0.00 177.00 177.17 3g1h n SER 158 N 2.49 0.73 0.31 6.66 3.41 -0.94 -3.69 113.62 122.59 3g1h n SER 158 Ca -0.04 0.32 0.21 0.00 -0.26 0.00 0.00 58.87 59.10 3g1h n SER 158 Cb 0.50 0.38 1.11 0.00 -0.26 0.00 0.00 64.21 65.95 3g1h n SER 158 CO 0.00 0.00 0.00 0.71 -0.16 0.00 0.00 175.04 175.59 3g1h h THR 159 N 0.00 0.00 -2.45 6.66 1.35 -1.81 -3.21 112.91 113.45 3g1h h THR 159 Ca -0.16 0.00 -0.60 0.00 -0.55 0.00 0.00 66.41 65.10 3g1h h THR 159 Cb 1.53 0.91 -0.41 0.00 -1.73 0.00 0.00 68.15 68.45 3g1h h THR 159 CO 0.04 0.00 -0.72 0.54 -0.25 0.00 0.00 175.52 175.13 3g1h n ARG 160 N -2.94 1.72 -0.44 4.72 1.74 -1.24 -4.95 116.66 115.26 3g1h n ARG 160 Ca -0.03 -4.19 0.41 0.00 -0.77 0.00 0.00 57.85 53.27 3g1h n ARG 160 Cb 0.07 -2.02 0.77 0.00 -1.02 0.00 0.00 32.46 30.27 3g1h n ARG 160 CO 0.00 0.00 0.00 -1.35 -1.52 0.00 0.00 177.63 174.76 3g1h h PRO 161 N 4.70 0.01 0.23 5.56 0.11 -1.76 -0.85 132.00 139.98 3g1h h PRO 161 Ca 0.17 -0.00 -0.31 0.00 0.11 0.00 0.00 66.00 65.98 3g1h h PRO 161 Cb 0.76 -0.00 0.04 0.00 0.11 0.00 0.00 31.00 31.90 3g1h h PRO 161 CO 0.68 0.01 -1.33 1.05 -0.21 0.00 0.00 178.00 178.19 3g1h h GLU 162 N 0.01 0.50 -0.46 1.05 9.09 -1.93 -3.10 114.58 119.75 3g1h h GLU 162 Ca 0.69 -0.84 -0.01 0.00 0.05 0.00 0.00 59.36 59.24 3g1h h GLU 162 Cb 2.73 0.31 -0.02 0.00 -1.65 0.00 0.00 28.75 30.12 3g1h h GLU 162 CO -0.02 1.40 0.23 0.00 0.05 0.00 0.00 179.01 180.67 3g1h h ARG 163 N 0.05 0.64 -0.37 1.06 2.47 -1.52 -2.14 114.38 114.57 3g1h h ARG 163 Ca -0.23 -0.07 -0.11 0.00 -1.26 0.00 0.00 59.98 58.31 3g1h h ARG 163 Cb 2.05 -0.13 -0.01 0.00 -1.65 0.00 0.00 29.97 30.23 3g1h h ARG 163 CO 0.25 0.49 -0.23 1.25 0.56 0.00 0.00 179.97 182.29 3g1h h LEU 164 N 0.64 0.75 -0.77 3.04 5.85 -1.52 -2.40 115.31 120.89 3g1h h LEU 164 Ca 0.16 -0.27 -0.08 0.00 0.84 0.00 0.00 57.88 58.54 3g1h h LEU 164 Cb 0.05 -0.20 -0.02 0.00 0.37 0.00 0.00 40.66 40.85 3g1h h LEU 164 CO -0.02 0.95 0.05 -1.28 -0.34 0.00 0.00 178.44 177.80 3g1h h SER 165 N 0.64 0.94 -0.28 1.25 0.87 -1.31 -2.17 113.55 113.50 3g1h h SER 165 Ca 0.09 -0.23 -0.11 0.00 -1.23 0.00 0.00 61.79 60.30 3g1h h SER 165 Cb 0.73 -0.25 -0.01 0.00 -0.44 0.00 0.00 62.40 62.42 3g1h h SER 165 CO 0.06 0.97 -0.22 -0.09 -0.53 0.00 0.00 176.83 177.02 3g1h h ARG 166 N 0.91 0.76 -0.10 2.24 9.65 -1.39 -2.72 114.38 123.74 3g1h h ARG 166 Ca 0.18 -0.30 0.02 0.00 -1.10 0.00 0.00 59.98 58.78 3g1h h ARG 166 Cb 0.46 -0.04 -0.02 0.00 -1.39 0.00 0.00 29.97 28.98 3g1h h ARG 166 CO 0.02 0.91 -0.03 1.25 2.80 0.00 0.00 179.97 184.92 3g1h h LEU 167 N 0.66 -0.11 -1.14 3.80 5.85 -0.91 -0.77 115.31 122.70 3g1h h LEU 167 Ca 0.09 0.03 0.05 0.00 0.84 0.00 0.00 57.88 58.90 3g1h h LEU 167 Cb 0.72 0.07 -0.06 0.00 0.37 0.00 0.00 40.66 41.76 3g1h h LEU 167 CO 0.06 -0.04 0.59 -0.09 -0.34 0.00 0.00 178.44 178.62 3g1h h ARG 168 N -0.01 1.05 -0.67 1.25 9.65 -1.35 -0.95 114.38 123.35 3g1h h ARG 168 Ca 0.05 -0.06 0.03 0.00 -1.10 0.00 0.00 59.98 58.90 3g1h h ARG 168 Cb 0.08 -0.24 -0.04 0.00 -1.39 0.00 0.00 29.97 28.38 3g1h h ARG 168 CO -0.11 0.69 0.41 1.49 2.80 0.00 0.00 179.97 185.26 3g1h h GLU 169 N 1.08 0.78 -0.12 0.20 4.81 -0.95 -0.59 114.58 119.79 3g1h h GLU 169 Ca 0.37 -0.05 -0.19 0.00 -0.13 0.00 0.00 59.36 59.36 3g1h h GLU 169 Cb 0.11 -0.18 0.00 0.00 0.63 0.00 0.00 28.75 29.31 3g1h h GLU 169 CO -0.13 0.52 -0.72 0.82 -0.73 0.00 0.00 179.01 178.77 3g1h h ILE 170 N 0.81 1.33 0.00 2.32 2.04 -0.25 -3.31 117.51 120.44 3g1h h ILE 170 Ca 0.27 -2.03 0.00 0.00 1.00 0.00 0.00 64.86 64.10 3g1h h ILE 170 Cb 0.03 2.01 0.00 0.00 -0.74 0.00 0.00 36.82 38.12 3g1h h ILE 170 CO -0.11 0.62 -0.42 0.16 0.00 0.00 0.00 178.15 178.41 3g1h h ILE 171 N 0.40 0.00 0.00 -0.67 3.07 -0.91 -3.48 117.51 115.91 3g1h h ILE 171 Ca -0.03 -0.50 0.00 0.00 1.55 0.00 0.00 64.86 65.88 3g1h h ILE 171 Cb 1.31 1.22 0.00 0.00 -0.27 0.00 0.00 36.82 39.08 3g1h h ILE 171 CO 0.13 0.00 0.00 0.61 -1.05 0.00 0.00 178.15 177.84 3g1h n GLY 172 N 1.32 -0.55 0.12 0.16 0.00 -0.26 -4.24 105.19 101.73 3g1h n GLY 172 Ca 0.04 -1.71 -0.00 0.00 0.00 0.00 0.00 46.02 44.34 3g1h n GLY 172 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 3g1h h GLN 173 N 0.00 0.00 0.00 1.61 1.08 -1.94 -3.27 115.11 112.60 3g1h h GLN 173 Ca 0.00 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 3g1h h GLN 173 Cb 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.43 3g1h h GLN 173 CO 0.00 0.64 0.00 0.38 -0.95 0.00 0.00 178.83 178.90 3g1h h ASP 174 N 0.00 0.00 -4.32 1.46 -0.00 -1.97 -3.45 116.42 108.14 3g1h h ASP 174 Ca -0.01 0.00 -0.51 0.00 -0.00 0.00 0.00 57.03 56.51 3g1h h ASP 174 Cb 1.50 0.00 0.07 0.00 -0.00 0.00 0.00 39.33 40.90 3g1h h ASP 174 CO 0.08 0.00 0.39 -0.44 -0.00 0.00 0.00 179.24 179.28 3g1h s SER 175 N -4.56 5.95 -0.18 4.15 0.01 -1.23 -5.05 113.70 112.78 3g1h s SER 175 Ca 0.07 1.53 -0.05 0.00 1.31 0.00 0.00 55.95 58.81 3g1h s SER 175 Cb 0.10 -2.49 -0.03 0.00 0.21 0.00 0.00 66.02 63.82 3g1h s SER 175 CO 0.50 -1.06 0.00 0.12 0.41 0.00 0.00 173.24 173.21 3g1h s PHE 176 N -3.02 3.08 -0.08 2.43 5.36 0.64 -5.01 117.98 121.39 3g1h s PHE 176 Ca 0.57 -0.27 0.03 0.00 -0.96 0.00 0.00 56.93 56.30 3g1h s PHE 176 Cb -0.12 -2.04 0.01 0.00 -0.34 0.00 0.00 43.02 40.53 3g1h s PHE 176 CO 0.51 -0.07 -0.15 -1.17 -1.46 0.00 0.00 175.22 172.87 3g1h s LEU 177 N 0.62 1.75 0.12 6.12 2.96 -1.26 -1.08 118.68 127.90 3g1h s LEU 177 Ca -0.00 -0.37 0.09 0.00 -0.22 0.00 0.00 54.13 53.63 3g1h s LEU 177 Cb -0.14 -0.98 -0.04 0.00 0.50 0.00 0.00 46.19 45.53 3g1h s LEU 177 CO 0.02 0.06 -0.23 0.27 -1.32 0.00 0.00 176.35 175.15 3g1h s ILE 178 N 0.64 1.94 -0.04 6.68 -4.36 -0.21 -0.15 121.20 125.70 3g1h s ILE 178 Ca -0.15 -1.68 -0.01 0.00 -0.26 0.00 0.00 60.65 58.56 3g1h s ILE 178 Cb -0.16 -1.76 0.03 0.00 1.25 0.00 0.00 42.46 41.82 3g1h s ILE 178 CO 0.04 -0.04 0.03 -0.55 0.24 0.00 0.00 174.94 174.67 3g1h s SER 179 N -2.07 0.76 0.65 4.36 0.15 -0.95 -1.58 113.70 115.02 3g1h s SER 179 Ca 0.11 0.03 -0.01 0.00 0.70 0.00 0.00 55.95 56.78 3g1h s SER 179 Cb -0.10 -0.17 0.08 0.00 -1.71 0.00 0.00 66.02 64.13 3g1h s SER 179 CO 0.05 -0.18 0.91 -2.16 1.20 0.00 0.00 173.24 173.06 3g1h s PRO 180 N 1.63 2.08 0.00 5.44 0.04 -1.23 -1.37 135.00 141.58 3g1h s PRO 180 Ca -0.02 -0.88 0.00 0.00 0.04 0.00 0.00 61.00 60.15 3g1h s PRO 180 Cb -0.13 -2.37 0.00 0.00 0.04 0.00 0.00 34.50 32.04 3g1h s PRO 180 CO -0.03 -1.13 0.00 0.41 0.04 0.00 0.00 177.00 176.29 3g1h n GLY 181 N -2.65 0.22 3.74 0.56 0.00 -1.26 -2.21 105.19 103.58 3g1h n GLY 181 Ca 0.11 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.72 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 -2.07 3.41 0.00 1.61 1.01 -1.26 -2.07 120.40 121.04 3g1h s VAL 182 Ca 0.00 1.16 0.00 0.00 0.00 0.00 0.00 61.98 63.14 3g1h s VAL 182 Cb 0.00 -3.74 0.00 0.00 0.00 0.00 0.00 36.38 32.64 3g1h s VAL 182 CO 0.00 0.17 0.00 0.61 0.00 0.00 0.00 175.10 175.88 3g1h n GLY 183 N 2.38 1.21 0.31 4.51 0.00 -0.86 -4.48 105.19 108.25 3g1h n GLY 183 Ca 0.06 -0.69 0.12 0.00 0.00 0.00 0.00 46.02 45.51 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 1.31 0.00 4.61 0.00 -1.92 0.52 119.26 123.78 3g1h h ALA 184 Ca 0.00 0.19 0.00 0.00 0.00 0.00 0.00 54.91 55.10 3g1h h ALA 184 Cb 0.00 0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.02 3g1h h ALA 184 CO 0.00 -0.40 0.00 1.04 0.00 0.00 0.00 179.25 179.89 3g1h n GLN 185 N -5.14 0.77 -0.91 0.00 6.02 -1.23 -4.91 117.38 111.99 3g1h n GLN 185 Ca 0.21 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.20 3g1h n GLN 185 Cb 0.65 -1.50 0.00 0.00 1.02 0.00 0.00 30.24 30.41 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 1.03 0.95 3.91 1.08 0.00 0.18 -4.92 105.19 107.42 3g1h n GLY 186 Ca 0.20 -0.53 -0.31 0.00 0.00 0.00 0.00 46.02 45.38 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 -2.55 2.19 -0.21 -0.02 0.00 -0.88 -4.83 107.32 101.02 3g1h s GLY 187 Ca 0.00 -0.76 -0.16 0.00 0.00 0.00 0.00 44.72 43.81 3g1h s GLY 187 CO 0.00 -0.72 0.39 -0.35 0.00 0.00 0.00 173.10 172.42 3g1h s ASP 188 N -2.51 6.40 0.00 1.64 2.15 -1.26 -2.03 116.67 121.06 3g1h s ASP 188 Ca 0.37 0.47 0.00 0.00 0.43 0.00 0.00 52.55 53.82 3g1h s ASP 188 Cb -0.13 -2.23 0.00 0.00 -0.30 0.00 0.00 42.92 40.27 3g1h s ASP 188 CO 0.27 -0.09 0.85 -2.65 -0.17 0.00 0.00 175.17 173.37 3g1h n PRO 189 N 4.62 0.00 -0.34 4.34 -0.02 -1.26 -1.09 135.00 141.25 3g1h n PRO 189 Ca -0.08 0.59 0.18 0.00 -2.02 0.00 0.00 63.50 62.16 3g1h n PRO 189 Cb 0.51 -1.35 0.40 0.00 -0.02 0.00 0.00 33.50 33.04 3g1h n PRO 189 CO 0.00 0.00 0.00 0.78 1.98 0.00 0.00 175.50 178.26 3g1h h GLY 190 N 0.00 1.75 0.90 -1.23 0.00 -1.95 -0.40 103.07 102.14 3g1h h GLY 190 Ca 0.00 -0.30 -0.03 0.00 0.00 0.00 0.00 47.33 47.00 3g1h h GLY 190 CO 0.00 -0.19 0.07 0.83 0.00 0.00 0.00 176.54 177.25 3g1h h GLU 191 N 0.58 0.50 -0.79 4.80 4.39 -1.95 -2.87 114.58 119.24 3g1h h GLU 191 Ca 0.62 -0.12 0.04 0.00 0.34 0.00 0.00 59.36 60.24 3g1h h GLU 191 Cb 1.22 -0.06 -0.05 0.00 -0.10 0.00 0.00 28.75 29.76 3g1h h GLU 191 CO -0.42 0.57 0.52 1.15 -1.16 0.00 0.00 179.01 179.67 3g1h h THR 192 N 0.34 1.11 0.00 1.13 2.02 0.54 -2.50 112.91 115.57 3g1h h THR 192 Ca 0.10 -0.33 0.00 0.00 0.77 0.00 0.00 66.41 66.95 3g1h h THR 192 Cb 0.30 0.07 0.00 0.00 -1.74 0.00 0.00 68.15 66.78 3g1h h THR 192 CO 0.00 0.17 0.00 0.18 0.37 0.00 0.00 175.52 176.25 3g1h n LEU 193 N -4.45 0.45 0.11 2.58 4.77 -0.79 -2.51 117.00 117.16 3g1h n LEU 193 Ca 0.10 -0.22 -0.18 0.00 -0.03 0.00 0.00 56.01 55.68 3g1h n LEU 193 Cb 0.13 -0.22 -0.14 0.00 -2.33 0.00 0.00 43.42 40.85 3g1h n LEU 193 CO 0.35 0.11 -0.11 0.03 -1.33 0.00 0.00 177.39 176.43 3g1h h ARG 194 N 0.04 0.32 0.00 3.23 3.08 -1.49 -3.38 114.38 116.19 3g1h h ARG 194 Ca 0.00 -0.55 0.00 0.00 0.07 0.00 0.00 59.98 59.50 3g1h h ARG 194 Cb 0.22 0.21 0.00 0.00 0.08 0.00 0.00 29.97 30.48 3g1h h ARG 194 CO 0.00 1.26 -0.50 1.19 -1.07 0.00 0.00 179.97 180.85 3g1h n PHE 195 N -3.56 0.00 -3.59 3.04 3.01 -1.24 -5.04 117.46 110.09 3g1h n PHE 195 Ca -0.11 0.00 -0.35 0.00 1.01 0.00 0.00 57.45 58.00 3g1h n PHE 195 Cb 1.04 0.00 -0.05 0.00 -0.01 0.00 0.00 39.48 40.46 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 -1.44 3.73 0.19 4.37 0.00 -1.04 -4.87 121.76 122.70 3g1h s ALA 196 Ca 0.00 -0.38 0.11 0.00 0.00 0.00 0.00 51.96 51.69 3g1h s ALA 196 Cb 0.00 -2.26 0.23 0.00 0.00 0.00 0.00 23.12 21.08 3g1h s ALA 196 CO 0.00 0.56 1.53 -0.44 0.00 0.00 0.00 175.76 177.41 3g1h h ASP 197 N 3.88 0.00 -4.97 0.00 3.32 -0.87 -3.41 116.42 114.37 3g1h h ASP 197 Ca -0.50 0.00 -0.04 0.00 0.02 0.00 0.00 57.03 56.52 3g1h h ASP 197 Cb 1.20 0.00 -0.16 0.00 0.22 0.00 0.00 39.33 40.58 3g1h h ASP 197 CO 0.66 0.68 0.21 0.00 -1.72 0.00 0.00 179.24 179.08 3g1h s ALA 198 N -3.33 -1.71 0.27 3.45 0.00 -1.11 -4.75 121.76 114.58 3g1h s ALA 198 Ca -0.00 1.01 0.08 0.00 0.00 0.00 0.00 51.96 53.05 3g1h s ALA 198 Cb 0.11 0.32 -0.04 0.00 0.00 0.00 0.00 23.12 23.52 3g1h s ALA 198 CO 0.77 -0.53 0.09 0.96 0.00 0.00 0.00 175.76 177.06 3g1h s ILE 199 N -2.19 3.77 -0.01 0.00 -4.36 -0.10 -2.24 121.20 116.07 3g1h s ILE 199 Ca -0.06 -1.69 0.06 0.00 -0.26 0.00 0.00 60.65 58.70 3g1h s ILE 199 Cb -0.00 -3.07 -0.03 0.00 1.25 0.00 0.00 42.46 40.61 3g1h s ILE 199 CO 0.01 -0.34 -0.17 -0.63 0.24 0.00 0.00 174.94 174.05 3g1h s ILE 200 N -2.27 2.85 -0.01 8.37 1.01 -0.47 -0.74 121.20 129.94 3g1h s ILE 200 Ca 0.33 -0.96 -0.00 0.00 0.00 0.00 0.00 60.65 60.02 3g1h s ILE 200 Cb -0.06 -2.14 0.01 0.00 0.01 0.00 0.00 42.46 40.28 3g1h s ILE 200 CO 0.22 0.48 0.01 -0.69 0.00 0.00 0.00 174.94 174.97 3g1h s VAL 201 N -0.80 -0.03 0.00 2.92 1.01 -0.60 -4.08 120.40 118.82 3g1h s VAL 201 Ca 0.13 0.11 0.00 0.00 0.00 0.00 0.00 61.98 62.21 3g1h s VAL 201 Cb -0.10 -0.04 0.00 0.00 0.00 0.00 0.00 36.38 36.23 3g1h s VAL 201 CO 0.02 0.04 0.00 0.61 0.00 0.00 0.00 175.10 175.78 3g1h n GLY 202 N 3.62 0.65 0.36 4.51 0.00 -1.26 0.84 105.19 113.90 3g1h n GLY 202 Ca -0.20 0.00 0.19 0.00 0.00 0.00 0.00 46.02 46.01 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 0.00 -0.13 1.61 3.08 -1.93 0.13 114.38 117.14 3g1h h ARG 203 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 3g1h h ARG 203 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.05 3g1h h ARG 203 CO 0.00 0.00 0.00 0.43 -1.07 0.00 0.00 179.97 179.33 3g1h n SER 204 N -3.77 0.13 0.00 7.04 7.64 -1.26 -2.83 113.62 120.56 3g1h n SER 204 Ca 0.04 -1.11 0.00 0.00 1.01 0.00 0.00 58.87 58.81 3g1h n SER 204 Cb 0.46 -0.06 0.00 0.00 -1.01 0.00 0.00 64.21 63.59 3g1h n SER 204 CO 0.00 0.00 0.00 -0.38 -3.01 0.00 0.00 175.04 171.65 3g1h n ILE 205 N -0.33 0.00 1.47 0.44 5.41 -0.41 -4.76 119.36 121.18 3g1h n ILE 205 Ca 0.00 0.00 0.15 0.00 1.00 0.00 0.00 62.75 63.90 3g1h n ILE 205 Cb 0.03 -0.03 0.69 0.00 -0.71 0.00 0.00 39.64 39.62 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 -1.69 0.00 0.05 1.39 0.18 -0.10 -2.93 117.16 114.05 3g1h n TYR 206 Ca 0.00 0.00 0.00 0.00 1.88 0.00 0.00 57.90 59.78 3g1h n TYR 206 Cb 0.00 -0.19 -0.00 0.00 -0.38 0.00 0.00 39.34 38.77 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 -1.03 0.33 -4.75 -3.48 4.77 -1.13 -4.96 117.00 106.74 3g1h n LEU 207 Ca 0.15 -0.63 -0.41 0.00 -0.03 0.00 0.00 56.01 55.09 3g1h n LEU 207 Cb 0.25 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.32 3g1h n LEU 207 CO 0.23 0.08 1.12 0.00 -1.33 0.00 0.00 177.39 177.48 3g1h s ALA 208 N -0.82 3.63 0.41 -1.18 0.00 -1.15 -4.88 121.76 117.77 3g1h s ALA 208 Ca 0.01 1.37 0.14 0.00 0.00 0.00 0.00 51.96 53.48 3g1h s ALA 208 Cb 0.01 -3.57 0.99 0.00 0.00 0.00 0.00 23.12 20.55 3g1h s ALA 208 CO 0.03 -0.79 1.90 -0.44 0.00 0.00 0.00 175.76 176.47 3g1h h ASP 209 N 4.73 0.47 -3.79 0.00 5.19 -1.96 -3.25 116.42 117.81 3g1h h ASP 209 Ca -0.47 0.03 -0.62 0.00 -0.62 0.00 0.00 57.03 55.35 3g1h h ASP 209 Cb 1.22 -0.06 -0.40 0.00 0.18 0.00 0.00 39.33 40.26 3g1h h ASP 209 CO 0.76 0.24 -0.70 0.21 -3.12 0.00 0.00 179.24 176.63 3g1h s ASN 210 N -5.88 4.06 0.12 6.45 3.04 -1.26 -5.02 114.94 116.45 3g1h s ASN 210 Ca -0.08 -2.59 -0.32 0.00 0.04 0.00 0.00 52.86 49.90 3g1h s ASN 210 Cb 0.21 -1.30 -0.11 0.00 -1.54 0.00 0.00 41.25 38.52 3g1h s ASN 210 CO 0.77 -0.29 1.57 -0.65 -3.04 0.00 0.00 177.10 175.46 3g1h h PRO 211 N 6.92 -0.59 -0.88 0.43 0.11 -1.73 -2.19 132.00 134.06 3g1h h PRO 211 Ca -0.05 0.04 0.14 0.00 0.11 0.00 0.00 66.00 66.24 3g1h h PRO 211 Cb 0.94 0.13 -0.09 0.00 0.11 0.00 0.00 31.00 32.09 3g1h h PRO 211 CO 0.56 -0.39 0.48 0.00 -0.21 0.00 0.00 178.00 178.43 3g1h h ALA 212 N -0.23 1.33 0.23 -0.75 0.00 -1.88 -2.59 119.26 115.36 3g1h h ALA 212 Ca 0.03 0.07 0.01 0.00 0.00 0.00 0.00 54.91 55.02 3g1h h ALA 212 Cb 0.69 -0.07 -0.04 0.00 0.00 0.00 0.00 17.79 18.38 3g1h h ALA 212 CO -0.37 -0.02 -0.48 0.00 0.00 0.00 0.00 179.25 178.39 3g1h h ALA 213 N 1.55 -0.94 -0.15 0.00 0.00 -1.80 -2.44 119.26 115.47 3g1h h ALA 213 Ca 0.47 -0.12 0.03 0.00 0.00 0.00 0.00 54.91 55.29 3g1h h ALA 213 Cb 0.61 0.78 -0.07 0.00 0.00 0.00 0.00 17.79 19.11 3g1h h ALA 213 CO -0.33 -1.09 -0.53 0.00 0.00 0.00 0.00 179.25 177.30 3g1h h ALA 214 N -0.49 -0.84 -0.78 0.00 0.00 -1.07 0.19 119.26 116.28 3g1h h ALA 214 Ca -0.01 -0.05 0.23 0.00 0.00 0.00 0.00 54.91 55.08 3g1h h ALA 214 Cb 0.76 0.98 -0.03 0.00 0.00 0.00 0.00 17.79 19.51 3g1h h ALA 214 CO -0.21 -1.07 0.75 0.00 0.00 0.00 0.00 179.25 178.72 3g1h h ALA 215 N -0.21 2.60 0.02 0.00 0.00 -1.39 0.53 119.26 120.80 3g1h h ALA 215 Ca 0.04 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 54.89 3g1h h ALA 215 Cb 0.67 0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.53 3g1h h ALA 215 CO -0.44 -1.15 -0.14 0.00 0.00 0.00 0.00 179.25 177.52 3g1h h ALA 216 N 1.24 -0.00 -0.04 0.00 0.00 -0.22 -3.22 119.26 117.02 3g1h h ALA 216 Ca 0.37 -0.49 0.00 0.00 0.00 0.00 0.00 54.91 54.79 3g1h h ALA 216 Cb 1.86 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 19.66 3g1h h ALA 216 CO -0.00 0.03 0.02 0.78 0.00 0.00 0.00 179.25 180.08 3g1h h GLY 217 N -0.78 0.05 0.34 0.00 0.00 0.19 0.29 103.07 103.16 3g1h h GLY 217 Ca -0.02 -0.02 0.08 0.00 0.00 0.00 0.00 47.33 47.36 3g1h h GLY 217 CO 0.03 0.02 0.01 -2.22 0.00 0.00 0.00 176.54 174.38 3g1h h ILE 218 N 0.03 0.69 -0.34 2.60 2.04 -0.94 -1.64 117.51 119.95 3g1h h ILE 218 Ca 0.01 -0.04 -0.09 0.00 1.00 0.00 0.00 64.86 65.74 3g1h h ILE 218 Cb 0.01 0.56 -0.01 0.00 -0.74 0.00 0.00 36.82 36.64 3g1h h ILE 218 CO -0.00 0.02 -0.15 0.40 0.00 0.00 0.00 178.15 178.42 3g1h h ILE 219 N 0.12 1.29 -1.00 -0.67 2.04 -1.53 -3.23 117.51 114.53 3g1h h ILE 219 Ca 0.21 -1.25 0.23 0.00 1.00 0.00 0.00 64.86 65.05 3g1h h ILE 219 Cb 0.29 1.38 -0.19 0.00 -0.74 0.00 0.00 36.82 37.56 3g1h h ILE 219 CO -0.34 0.41 -0.14 -0.33 0.00 0.00 0.00 178.15 177.75 3g1h h GLU 220 N 0.47 0.00 0.27 2.37 4.39 0.56 0.13 114.58 122.78 3g1h h GLU 220 Ca 0.08 -0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.76 3g1h h GLU 220 Cb 0.67 -0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.33 3g1h h GLU 220 CO 0.05 0.00 -0.13 0.66 -1.16 0.00 0.00 179.01 178.42 3g1h h SER 221 N 0.00 -0.31 0.00 1.42 4.64 -1.54 -3.25 113.55 114.50 3g1h h SER 221 Ca 0.53 -0.16 0.00 0.00 -0.47 0.00 0.00 61.79 61.69 3g1h h SER 221 Cb 0.94 0.08 0.00 0.00 -0.31 0.00 0.00 62.40 63.11 3g1h h SER 221 CO -0.99 0.18 0.08 -0.38 -0.87 0.00 0.00 176.83 174.84 3g1h n ILE 222 N -5.02 1.05 0.30 0.95 5.41 -0.88 -1.85 119.36 119.32 3g1h n ILE 222 Ca -0.07 0.71 0.17 0.00 1.00 0.00 0.00 62.75 64.55 3g1h n ILE 222 Cb 0.23 -1.71 0.96 0.00 -0.71 0.00 0.00 39.64 38.41 3g1h n ILE 222 CO 0.00 0.00 0.00 0.11 0.00 0.00 0.00 176.55 176.66 3g1h h LYS 223 N 0.00 0.00 -0.46 0.38 1.57 -0.79 -2.40 116.57 114.86 3g1h h LYS 223 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3g1h h LYS 223 Cb 0.15 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.46 3g1h h LYS 223 CO 0.00 0.01 0.00 -0.25 -0.57 0.00 0.00 179.45 178.64 3g1h n ASP 224 N -3.65 0.46 -0.23 0.86 8.00 -0.77 -5.12 116.55 116.10 3g1h n ASP 224 Ca -0.03 -1.62 0.03 0.00 0.71 0.00 0.00 54.79 53.88 3g1h n ASP 224 Cb 0.10 -0.23 0.02 0.00 -0.02 0.00 0.00 41.12 40.99 3g1h n ASP 224 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99