#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3g1f s MET 9 N 0.00 4.30 -0.35 7.34 0.00 -1.26 -5.04 119.30 124.29 3g1f s MET 9 Ca 0.00 0.61 -0.25 0.00 0.00 0.00 0.00 55.69 56.05 3g1f s MET 9 Cb 0.00 -3.37 0.01 0.00 0.00 0.00 0.00 34.83 31.47 3g1f s MET 9 CO 0.00 0.29 0.89 0.34 0.00 0.00 0.00 175.02 176.55 3g1f s ASP 10 N 0.12 6.68 -0.10 -1.18 3.68 -1.26 -5.04 116.67 119.58 3g1f s ASP 10 Ca 0.29 0.61 -0.06 0.00 2.13 0.00 0.00 52.55 55.52 3g1f s ASP 10 Cb -0.17 -2.45 -0.04 0.00 -1.45 0.00 0.00 42.92 38.81 3g1f s ASP 10 CO 0.14 -0.79 0.15 -0.69 0.13 0.00 0.00 175.17 174.11 3g1f s VAL 11 N 3.33 5.49 -0.10 1.11 1.01 -1.26 -5.03 120.40 124.96 3g1f s VAL 11 Ca 0.37 0.13 -0.30 0.00 0.00 0.00 0.00 61.98 62.18 3g1f s VAL 11 Cb -0.13 -3.43 -0.02 0.00 0.00 0.00 0.00 36.38 32.80 3g1f s VAL 11 CO 0.17 0.56 1.21 -0.32 0.00 0.00 0.00 175.10 176.71 3g1f s MET 12 N -1.22 4.31 -1.40 2.72 1.75 -1.26 -3.46 119.30 120.73 3g1f s MET 12 Ca 0.18 1.65 -0.06 0.00 -1.25 0.00 0.00 55.69 56.20 3g1f s MET 12 Cb -0.12 -3.63 0.04 0.00 2.84 0.00 0.00 34.83 33.95 3g1f s MET 12 CO 0.07 -0.54 0.50 0.09 -0.65 0.00 0.00 175.02 174.49 3g1f n ASN 13 N 5.72 -4.84 -2.85 1.11 3.02 -1.26 -2.90 115.26 113.25 3g1f n ASN 13 Ca 0.12 -0.29 -0.11 0.00 -0.03 0.00 0.00 54.58 54.26 3g1f n ASN 13 Cb 0.46 -3.96 -0.02 0.00 -0.61 0.00 0.00 39.78 35.65 3g1f n ASN 13 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 3g1f n ARG 14 N -3.78 -2.17 -4.69 3.52 1.74 -1.22 -4.90 116.66 105.16 3g1f n ARG 14 Ca -0.07 0.04 -0.25 0.00 -0.77 0.00 0.00 57.85 56.79 3g1f n ARG 14 Cb 0.58 -4.05 -0.16 0.00 -1.02 0.00 0.00 32.46 27.81 3g1f n ARG 14 CO 0.00 0.00 0.00 -1.17 -1.52 0.00 0.00 177.63 174.94 3g1f s LEU 15 N -5.06 1.75 -0.11 0.55 2.96 -1.14 -1.54 118.68 116.09 3g1f s LEU 15 Ca 0.22 -0.33 0.03 0.00 -0.22 0.00 0.00 54.13 53.84 3g1f s LEU 15 Cb -0.13 -0.90 0.00 0.00 0.50 0.00 0.00 46.19 45.67 3g1f s LEU 15 CO 0.27 0.07 -0.23 -0.63 -1.32 0.00 0.00 176.35 174.52 3g1f s ILE 16 N 0.47 2.11 0.22 6.68 1.01 -0.09 -4.59 121.20 127.01 3g1f s ILE 16 Ca -0.12 -0.99 -0.30 0.00 0.00 0.00 0.00 60.65 59.24 3g1f s ILE 16 Cb -0.15 -1.81 -0.08 0.00 0.01 0.00 0.00 42.46 40.43 3g1f s ILE 16 CO 0.04 0.56 0.99 -0.22 0.00 0.00 0.00 174.94 176.31 3g1f s LEU 17 N 0.46 4.59 -0.86 2.97 2.96 -0.93 -1.86 118.68 126.01 3g1f s LEU 17 Ca -0.16 2.00 -0.03 0.00 -0.22 0.00 0.00 54.13 55.72 3g1f s LEU 17 Cb -0.17 -3.61 0.21 0.00 0.50 0.00 0.00 46.19 43.12 3g1f s LEU 17 CO 0.06 0.02 0.75 0.00 -1.32 0.00 0.00 176.35 175.86 3g1f s ALA 18 N -0.88 4.16 -1.09 5.97 0.00 -1.02 -0.02 121.76 128.87 3g1f s ALA 18 Ca 0.44 -3.70 -0.23 0.00 0.00 0.00 0.00 51.96 48.46 3g1f s ALA 18 Cb -0.27 -2.91 -0.08 0.00 0.00 0.00 0.00 23.12 19.86 3g1f s ALA 18 CO 0.34 -2.16 1.94 1.41 0.00 0.00 0.00 175.76 177.29 3g1f s MET 19 N -1.01 2.51 -0.12 0.00 1.75 -0.96 -4.45 119.30 117.02 3g1f s MET 19 Ca 0.25 -0.89 0.17 0.00 -1.25 0.00 0.00 55.69 53.98 3g1f s MET 19 Cb -0.10 -5.18 0.71 0.00 2.84 0.00 0.00 34.83 33.09 3g1f s MET 19 CO -0.10 -3.80 1.61 -0.25 -0.65 0.00 0.00 175.02 171.83 3g1f n ASP 20 N 14.28 4.71 -4.75 1.11 8.00 -1.26 -4.49 116.55 134.15 3g1f n ASP 20 Ca 0.43 -2.48 -0.30 0.00 0.71 0.00 0.00 54.79 53.15 3g1f n ASP 20 Cb 0.47 -0.58 0.11 0.00 -0.02 0.00 0.00 41.12 41.09 3g1f n ASP 20 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 3g1f s LEU 21 N -1.88 2.69 -0.21 0.64 1.43 -1.26 -4.73 118.68 115.36 3g1f s LEU 21 Ca 0.50 1.63 0.14 0.00 -1.03 0.00 0.00 54.13 55.36 3g1f s LEU 21 Cb 0.33 -4.22 0.45 0.00 0.03 0.00 0.00 46.19 42.77 3g1f s LEU 21 CO 0.23 -2.23 1.34 0.23 0.23 0.00 0.00 176.35 176.14 3g1f n MET 22 N -3.63 1.93 -3.70 1.70 2.81 -1.26 -4.09 117.12 110.88 3g1f n MET 22 Ca 0.08 -2.99 -0.11 0.00 -1.81 0.00 0.00 57.70 52.88 3g1f n MET 22 Cb 0.54 -1.72 -0.11 0.00 -0.71 0.00 0.00 33.22 31.23 3g1f n MET 22 CO 0.00 0.00 0.00 0.54 1.51 0.00 0.00 175.97 178.02 3g1f s ASN 23 N -2.60 -0.52 0.08 7.83 2.20 -1.26 -4.84 114.94 115.83 3g1f s ASN 23 Ca 0.40 0.91 -0.16 0.00 -0.94 0.00 0.00 52.86 53.06 3g1f s ASN 23 Cb 0.35 0.81 -0.04 0.00 -2.00 0.00 0.00 41.25 40.38 3g1f s ASN 23 CO 0.01 -0.19 1.00 0.54 -2.94 0.00 0.00 177.10 175.53 3g1f n ARG 24 N 4.03 -0.23 -0.03 3.55 1.74 -1.26 -1.61 116.66 122.85 3g1f n ARG 24 Ca -0.22 0.98 -0.09 0.00 -0.77 0.00 0.00 57.85 57.76 3g1f n ARG 24 Cb 0.56 -1.45 -0.03 0.00 -1.02 0.00 0.00 32.46 30.51 3g1f n ARG 24 CO 0.00 0.00 0.00 -0.44 -1.52 0.00 0.00 177.63 175.67 3g1f h ASP 25 N 0.00 -0.17 -0.76 0.55 3.32 -1.97 1.36 116.42 118.75 3g1f h ASP 25 Ca 0.08 0.06 0.02 0.00 0.02 0.00 0.00 57.03 57.21 3g1f h ASP 25 Cb 0.22 0.12 -0.04 0.00 0.22 0.00 0.00 39.33 39.84 3g1f h ASP 25 CO -0.50 -0.06 0.49 0.44 -1.72 0.00 0.00 179.24 177.89 3g1f h ASP 26 N -0.00 0.83 0.20 6.45 3.32 -1.89 0.65 116.42 125.97 3g1f h ASP 26 Ca 0.09 -0.01 -0.01 0.00 0.02 0.00 0.00 57.03 57.12 3g1f h ASP 26 Cb 0.14 -0.19 0.00 0.00 0.22 0.00 0.00 39.33 39.49 3g1f h ASP 26 CO -0.19 0.59 -0.09 0.00 -1.72 0.00 0.00 179.24 177.82 3g1f h ALA 27 N 1.30 -0.26 -0.88 3.45 0.00 -0.65 -2.08 119.26 120.13 3g1f h ALA 27 Ca 0.29 -0.21 0.07 0.00 0.00 0.00 0.00 54.91 55.06 3g1f h ALA 27 Cb -0.05 0.10 -0.06 0.00 0.00 0.00 0.00 17.79 17.78 3g1f h ALA 27 CO -0.09 -0.41 0.57 -0.07 0.00 0.00 0.00 179.25 179.26 3g1f h LEU 28 N -0.75 0.86 0.60 0.00 3.38 0.19 -0.51 115.31 119.08 3g1f h LEU 28 Ca -0.03 0.01 -0.03 0.00 0.09 0.00 0.00 57.88 57.92 3g1f h LEU 28 Cb 0.51 -0.17 0.01 0.00 0.09 0.00 0.00 40.66 41.09 3g1f h LEU 28 CO 0.04 0.54 -0.29 -0.09 0.09 0.00 0.00 178.44 178.74 3g1f h ARG 29 N 0.97 -0.77 -0.36 1.13 2.43 -0.86 -1.38 114.38 115.53 3g1f h ARG 29 Ca 0.38 0.05 0.08 0.00 -0.81 0.00 0.00 59.98 59.68 3g1f h ARG 29 Cb 0.24 0.18 -0.08 0.00 -0.42 0.00 0.00 29.97 29.89 3g1f h ARG 29 CO -0.14 -0.52 -0.13 0.28 -1.51 0.00 0.00 179.97 177.95 3g1f h VAL 30 N -0.91 0.55 -0.83 0.20 2.07 -1.22 0.19 116.25 116.31 3g1f h VAL 30 Ca -0.08 0.00 0.08 0.00 0.82 0.00 0.00 66.70 67.52 3g1f h VAL 30 Cb 0.62 0.55 -0.06 0.00 -1.52 0.00 0.00 31.29 30.88 3g1f h VAL 30 CO 0.13 0.00 0.54 0.74 0.02 0.00 0.00 177.57 179.00 3g1f h THR 31 N -0.06 0.99 -0.23 2.57 2.02 -1.14 -1.73 112.91 115.33 3g1f h THR 31 Ca 0.18 -0.29 -0.14 0.00 0.77 0.00 0.00 66.41 66.93 3g1f h THR 31 Cb 0.33 0.09 -0.01 0.00 -1.74 0.00 0.00 68.15 66.82 3g1f h THR 31 CO -0.41 0.15 -0.46 1.23 0.37 0.00 0.00 175.52 176.41 3g1f h GLY 32 N 0.83 0.64 1.69 2.16 0.00 0.14 -2.43 103.07 106.10 3g1f h GLY 32 Ca 0.37 -0.67 -0.05 0.00 0.00 0.00 0.00 47.33 46.98 3g1f h GLY 32 CO -0.14 0.60 -0.06 0.83 0.00 0.00 0.00 176.54 177.77 3g1f h GLU 33 N 0.47 0.38 -0.09 4.80 5.08 -0.15 -3.11 114.58 121.96 3g1f h GLU 33 Ca 0.03 -0.08 0.00 0.00 -1.00 0.00 0.00 59.36 58.31 3g1f h GLU 33 Cb 0.98 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 30.17 3g1f h GLU 33 CO 0.09 0.46 0.00 1.33 -1.00 0.00 0.00 179.01 179.89 3g1f n VAL 34 N -4.28 0.11 -0.28 3.13 0.24 -1.05 -4.59 118.33 111.60 3g1f n VAL 34 Ca 0.00 -0.56 0.09 0.00 -2.04 0.00 0.00 64.34 61.84 3g1f n VAL 34 Cb 0.25 1.31 0.23 0.00 -1.47 0.00 0.00 33.84 34.15 3g1f n VAL 34 CO 0.00 0.00 0.00 -0.09 -2.14 0.00 0.00 176.83 174.60 3g1f h ARG 35 N 3.83 0.15 -0.00 7.34 9.65 -1.36 -0.21 114.38 133.78 3g1f h ARG 35 Ca 0.00 -0.01 0.00 0.00 -1.10 0.00 0.00 59.98 58.87 3g1f h ARG 35 Cb 0.83 -0.03 -0.00 0.00 -1.39 0.00 0.00 29.97 29.37 3g1f h ARG 35 CO 0.00 0.10 0.16 1.05 2.80 0.00 0.00 179.97 184.08 3g1f h GLU 36 N 0.16 0.00 0.00 0.20 4.11 -1.84 -3.00 114.58 114.21 3g1f h GLU 36 Ca 0.49 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.92 3g1f h GLU 36 Cb 0.93 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.18 3g1f h GLU 36 CO -0.66 0.00 -0.39 1.88 0.07 0.00 0.00 179.01 179.90 3g1f h TYR 37 N 0.00 0.00 -2.42 2.06 0.99 -1.36 -3.49 116.97 112.76 3g1f h TYR 37 Ca 0.00 0.00 -0.52 0.00 2.00 0.00 0.00 58.73 60.21 3g1f h TYR 37 Cb 0.32 0.00 -0.04 0.00 1.00 0.00 0.00 36.73 38.01 3g1f h TYR 37 CO 0.00 0.00 -0.49 0.96 -0.00 0.00 0.00 178.16 178.63 3g1f s ILE 38 N -2.07 4.92 -0.03 -2.88 -5.25 -1.13 -4.48 121.20 110.28 3g1f s ILE 38 Ca -0.11 -1.01 0.04 0.00 -0.99 0.00 0.00 60.65 58.57 3g1f s ILE 38 Cb 0.02 -3.60 0.06 0.00 2.95 0.00 0.00 42.46 41.89 3g1f s ILE 38 CO 0.17 -0.21 0.93 -0.90 -1.79 0.00 0.00 174.94 173.13 3g1f n ASP 39 N -0.86 0.65 -3.73 4.36 5.75 -1.26 -4.62 116.55 116.83 3g1f n ASP 39 Ca -0.08 -2.02 -0.21 0.00 -0.01 0.00 0.00 54.79 52.47 3g1f n ASP 39 Cb 0.56 -0.19 -0.18 0.00 -1.03 0.00 0.00 41.12 40.28 3g1f n ASP 39 CO 0.00 0.00 0.00 -0.89 -0.11 0.00 0.00 177.20 176.20 3g1f s THR 40 N -0.67 0.13 -0.06 2.12 2.01 -1.26 -1.78 115.64 116.14 3g1f s THR 40 Ca 0.07 0.27 0.06 0.00 0.31 0.00 0.00 61.69 62.39 3g1f s THR 40 Cb 0.06 -0.34 -0.01 0.00 0.01 0.00 0.00 72.50 72.22 3g1f s THR 40 CO 0.01 0.22 -0.24 -0.69 -0.69 0.00 0.00 174.62 173.22 3g1f s VAL 41 N 2.01 2.17 -0.13 3.82 1.01 0.15 -2.18 120.40 127.25 3g1f s VAL 41 Ca 0.04 -1.03 -0.12 0.00 0.00 0.00 0.00 61.98 60.88 3g1f s VAL 41 Cb -0.12 -1.79 -0.05 0.00 0.00 0.00 0.00 36.38 34.42 3g1f s VAL 41 CO -0.04 0.57 0.25 -0.75 0.00 0.00 0.00 175.10 175.13 3g1f s LYS 42 N -0.19 4.00 -0.04 2.72 2.20 0.97 -1.19 119.74 128.20 3g1f s LYS 42 Ca -0.02 0.05 0.04 0.00 -0.36 0.00 0.00 55.97 55.67 3g1f s LYS 42 Cb -0.14 -3.33 0.00 0.00 -1.51 0.00 0.00 37.83 32.85 3g1f s LYS 42 CO 0.03 0.45 -0.15 0.42 -0.36 0.00 0.00 175.35 175.75 3g1f s ILE 43 N -0.16 1.25 0.00 5.43 -1.09 0.45 -2.26 121.20 124.82 3g1f s ILE 43 Ca 0.16 -0.61 0.00 0.00 -2.23 0.00 0.00 60.65 57.97 3g1f s ILE 43 Cb -0.13 -1.09 0.00 0.00 -1.58 0.00 0.00 42.46 39.66 3g1f s ILE 43 CO 0.05 0.37 0.00 0.61 -1.23 0.00 0.00 174.94 174.73 3g1f n GLY 44 N 3.27 4.69 0.23 6.18 0.00 -1.26 -0.17 105.19 118.13 3g1f n GLY 44 Ca -0.19 -2.14 -0.03 0.00 0.00 0.00 0.00 46.02 43.66 3g1f n GLY 44 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 3g1f h TYR 45 N 0.86 0.50 -0.74 1.61 0.99 -1.96 -1.80 116.97 116.43 3g1f h TYR 45 Ca 0.00 -0.10 0.16 0.00 2.00 0.00 0.00 58.73 60.79 3g1f h TYR 45 Cb 0.00 -0.12 -0.11 0.00 1.00 0.00 0.00 36.73 37.50 3g1f h TYR 45 CO 0.00 0.67 0.17 -1.35 -0.00 0.00 0.00 178.16 177.65 3g1f h PRO 46 N 0.40 0.26 0.07 4.88 0.11 -1.92 0.32 132.00 136.11 3g1f h PRO 46 Ca 0.06 -0.02 -0.15 0.00 0.11 0.00 0.00 66.00 66.01 3g1f h PRO 46 Cb 0.66 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 31.71 3g1f h PRO 46 CO 0.05 0.17 -0.72 1.25 -0.21 0.00 0.00 178.00 178.54 3g1f h LEU 47 N 0.26 0.22 -0.79 2.35 5.85 -1.69 -3.23 115.31 118.29 3g1f h LEU 47 Ca 0.42 -0.89 -0.07 0.00 0.84 0.00 0.00 57.88 58.18 3g1f h LEU 47 Cb 0.71 -0.07 -0.03 0.00 0.37 0.00 0.00 40.66 41.64 3g1f h LEU 47 CO -0.52 1.32 0.16 0.58 -0.34 0.00 0.00 178.44 179.64 3g1f h VAL 48 N -0.66 1.26 -0.68 1.05 2.07 -1.13 -0.94 116.25 117.21 3g1f h VAL 48 Ca -0.16 -0.95 -0.08 0.00 0.82 0.00 0.00 66.70 66.33 3g1f h VAL 48 Cb 1.40 0.57 -0.03 0.00 -1.52 0.00 0.00 31.29 31.71 3g1f h VAL 48 CO 0.03 0.36 0.12 -0.07 0.02 0.00 0.00 177.57 178.03 3g1f h LEU 49 N 1.01 1.07 -1.17 2.57 3.38 -0.52 0.48 115.31 122.13 3g1f h LEU 49 Ca 0.21 -0.25 0.00 0.00 0.09 0.00 0.00 57.88 57.93 3g1f h LEU 49 Cb 0.36 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 40.83 3g1f h LEU 49 CO 0.00 1.05 0.00 -1.54 0.09 0.00 0.00 178.44 178.05 3g1f n SER 50 N -4.22 1.81 0.00 -0.43 3.41 -1.10 -4.21 113.62 108.89 3g1f n SER 50 Ca 0.05 -1.62 0.00 0.00 -0.26 0.00 0.00 58.87 57.04 3g1f n SER 50 Cb 0.29 -0.02 0.00 0.00 -0.26 0.00 0.00 64.21 64.22 3g1f n SER 50 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 3g1f n GLU 51 N 0.42 1.40 0.00 4.33 -0.58 -0.38 -4.98 120.64 120.85 3g1f n GLU 51 Ca 0.18 -0.01 0.00 0.00 -0.42 0.00 0.00 57.16 56.91 3g1f n GLU 51 Cb 0.40 -0.14 0.00 0.00 -0.57 0.00 0.00 31.44 31.13 3g1f n GLU 51 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3g1f n GLY 52 N 0.20 0.14 0.34 0.62 0.00 0.17 -4.57 105.19 102.08 3g1f n GLY 52 Ca 0.00 -1.58 0.20 0.00 0.00 0.00 0.00 46.02 44.64 3g1f n GLY 52 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 3g1f h MET 53 N 0.00 0.00 0.00 1.61 2.86 -1.94 -1.01 114.93 116.46 3g1f h MET 53 Ca 0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 3g1f h MET 53 Cb 0.00 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.66 3g1f h MET 53 CO 0.00 0.00 0.00 -0.25 1.06 0.00 0.00 176.91 177.72 3g1f n ASP 54 N -3.14 0.00 0.15 1.22 9.92 -1.26 -1.66 116.55 121.78 3g1f n ASP 54 Ca -0.02 0.07 0.01 0.00 -0.53 0.00 0.00 54.79 54.32 3g1f n ASP 54 Cb 0.17 -0.29 0.32 0.00 -0.64 0.00 0.00 41.12 40.69 3g1f n ASP 54 CO 0.00 0.00 0.00 -0.29 0.13 0.00 0.00 177.20 177.04 3g1f h ILE 55 N 0.00 1.26 0.01 0.53 6.09 -1.42 -3.04 117.51 120.93 3g1f h ILE 55 Ca 0.00 -1.26 0.02 0.00 -1.37 0.00 0.00 64.86 62.25 3g1f h ILE 55 Cb 0.15 1.60 -0.03 0.00 0.47 0.00 0.00 36.82 39.01 3g1f h ILE 55 CO 0.00 0.37 -0.16 0.40 -3.07 0.00 0.00 178.15 175.69 3g1f h ILE 56 N 0.10 0.62 -0.17 2.19 2.04 -1.54 -2.09 117.51 118.66 3g1f h ILE 56 Ca 0.01 0.00 -0.05 0.00 1.00 0.00 0.00 64.86 65.82 3g1f h ILE 56 Cb 0.65 0.62 -0.01 0.00 -0.74 0.00 0.00 36.82 37.34 3g1f h ILE 56 CO 0.05 0.00 -0.14 0.00 0.00 0.00 0.00 178.15 178.06 3g1f h ALA 57 N 0.67 1.45 0.00 1.87 0.00 -1.68 -2.53 119.26 119.04 3g1f h ALA 57 Ca 0.05 -0.22 -0.08 0.00 0.00 0.00 0.00 54.91 54.65 3g1f h ALA 57 Cb 0.33 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 3g1f h ALA 57 CO -0.15 0.38 -0.40 1.49 0.00 0.00 0.00 179.25 180.58 3g1f h GLU 58 N 0.26 0.00 -0.03 0.00 4.81 -1.40 0.30 114.58 118.52 3g1f h GLU 58 Ca 0.05 0.00 -0.24 0.00 -0.13 0.00 0.00 59.36 59.04 3g1f h GLU 58 Cb 0.41 0.00 0.01 0.00 0.63 0.00 0.00 28.75 29.80 3g1f h GLU 58 CO 0.02 0.40 -0.94 0.74 -0.73 0.00 0.00 179.01 178.50 3g1f h PHE 59 N 0.00 0.85 0.00 0.92 -1.00 -0.99 -0.99 116.94 115.74 3g1f h PHE 59 Ca -0.00 -0.44 -0.00 0.00 2.81 0.00 0.00 57.97 60.33 3g1f h PHE 59 Cb 0.73 -0.10 0.00 0.00 3.61 0.00 0.00 35.95 40.19 3g1f h PHE 59 CO 0.00 1.27 -0.00 0.00 -1.61 0.00 0.00 178.31 177.96 3g1f h ARG 60 N 0.35 -0.00 0.67 1.51 3.08 -1.10 -0.46 114.38 118.42 3g1f h ARG 60 Ca -0.09 0.00 -0.03 0.00 0.07 0.00 0.00 59.98 59.92 3g1f h ARG 60 Cb 1.58 0.00 0.01 0.00 0.08 0.00 0.00 29.97 31.64 3g1f h ARG 60 CO 0.18 0.44 -0.32 0.87 -1.07 0.00 0.00 179.97 180.06 3g1f h LYS 61 N -0.44 -0.86 0.00 0.04 1.57 -0.49 1.37 116.57 117.75 3g1f h LYS 61 Ca -0.00 0.06 0.00 0.00 -1.87 0.00 0.00 60.65 58.84 3g1f h LYS 61 Cb 0.44 0.20 0.00 0.00 0.08 0.00 0.00 32.23 32.95 3g1f h LYS 61 CO 0.00 -0.58 0.00 0.54 -0.57 0.00 0.00 179.45 178.84 3g1f n ARG 62 N -4.45 0.09 0.00 3.15 1.74 -0.37 -3.91 116.66 112.90 3g1f n ARG 62 Ca -0.11 0.53 0.00 0.00 -0.77 0.00 0.00 57.85 57.50 3g1f n ARG 62 Cb 0.35 -1.76 0.00 0.00 -1.02 0.00 0.00 32.46 30.04 3g1f n ARG 62 CO 0.00 0.00 0.00 1.19 -1.52 0.00 0.00 177.63 177.30 3g1f n PHE 63 N -1.94 0.00 -2.84 -1.55 0.99 -0.19 -5.03 117.46 106.91 3g1f n PHE 63 Ca -0.00 0.00 -0.10 0.00 -0.00 0.00 0.00 57.45 57.35 3g1f n PHE 63 Cb 0.06 0.00 0.05 0.00 -1.00 0.00 0.00 39.48 38.59 3g1f n PHE 63 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 3g1f n GLY 64 N 0.78 -0.07 3.54 1.37 0.00 0.47 -5.01 105.19 106.28 3g1f n GLY 64 Ca 0.00 -0.10 -0.25 0.00 0.00 0.00 0.00 46.02 45.67 3g1f n GLY 64 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3g1f s ARG 66 N -3.60 4.79 -0.10 0.00 1.81 -0.73 -4.69 118.95 116.43 3g1f s ARG 66 Ca 0.32 1.47 0.04 0.00 -1.72 0.00 0.00 55.73 55.83 3g1f s ARG 66 Cb -0.01 -3.18 0.00 0.00 -0.45 0.00 0.00 34.95 31.32 3g1f s ARG 66 CO 0.17 0.46 -0.22 0.42 -0.68 0.00 0.00 175.30 175.44 3g1f s ILE 67 N -1.27 1.94 -0.24 1.52 -1.09 -1.26 -0.67 121.20 120.13 3g1f s ILE 67 Ca 0.43 -0.94 -0.03 0.00 -2.23 0.00 0.00 60.65 57.87 3g1f s ILE 67 Cb -0.25 -1.69 0.01 0.00 -1.58 0.00 0.00 42.46 38.95 3g1f s ILE 67 CO 0.31 0.53 -0.04 -0.63 -1.23 0.00 0.00 174.94 173.88 3g1f s ILE 68 N 0.46 3.24 -0.55 2.92 1.01 -0.34 -1.09 121.20 126.86 3g1f s ILE 68 Ca -0.17 -0.72 -0.26 0.00 0.00 0.00 0.00 60.65 59.50 3g1f s ILE 68 Cb -0.17 -2.56 0.04 0.00 0.01 0.00 0.00 42.46 39.77 3g1f s ILE 68 CO 0.07 0.30 1.03 0.00 0.00 0.00 0.00 174.94 176.34 3g1f s ALA 69 N 1.42 3.11 -1.32 9.38 0.00 0.36 -0.41 121.76 134.32 3g1f s ALA 69 Ca 0.03 -1.02 -0.13 0.00 0.00 0.00 0.00 51.96 50.84 3g1f s ALA 69 Cb -0.15 -3.83 0.11 0.00 0.00 0.00 0.00 23.12 19.25 3g1f s ALA 69 CO -0.03 -2.44 1.84 -3.47 0.00 0.00 0.00 175.76 171.66 3g1f n ASP 70 N 7.77 4.77 -0.38 0.00 -0.08 0.77 -1.78 116.55 127.62 3g1f n ASP 70 Ca 0.05 -2.97 0.11 0.00 -1.51 0.00 0.00 54.79 50.47 3g1f n ASP 70 Cb 0.48 -1.60 0.04 0.00 2.34 0.00 0.00 41.12 42.37 3g1f n ASP 70 CO 0.00 0.00 0.00 0.49 0.12 0.00 0.00 177.20 177.81 3g1f n PHE 71 N 5.82 0.00 -4.16 -0.67 0.99 -1.26 -4.28 117.46 113.90 3g1f n PHE 71 Ca 0.44 0.00 -0.29 0.00 -0.00 0.00 0.00 57.45 57.60 3g1f n PHE 71 Cb 0.41 -0.02 -0.06 0.00 -1.00 0.00 0.00 39.48 38.80 3g1f n PHE 71 CO 0.00 0.00 0.00 1.63 -0.00 0.00 0.00 176.76 178.39 3g1f n LYS 72 N -0.34 -2.02 -1.64 -1.08 5.02 -0.62 -4.74 118.16 112.74 3g1f n LYS 72 Ca 0.09 0.23 -0.55 0.00 -2.02 0.00 0.00 58.31 56.06 3g1f n LYS 72 Cb 0.43 -4.06 -0.07 0.00 -0.02 0.00 0.00 35.03 31.32 3g1f n LYS 72 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 3g1f n VAL 73 N -4.49 0.13 -2.67 -0.18 0.31 -1.06 -4.26 118.33 106.10 3g1f n VAL 73 Ca -0.30 -0.02 -0.08 0.00 -0.01 0.00 0.00 64.34 63.92 3g1f n VAL 73 Cb 0.68 -0.94 0.06 0.00 -0.91 0.00 0.00 33.84 32.74 3g1f n VAL 73 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3g1f n ALA 74 N 3.73 2.69 -3.84 3.52 0.00 -1.26 -1.00 120.51 124.35 3g1f n ALA 74 Ca 0.22 -2.52 0.00 0.00 0.00 0.00 0.00 53.44 51.14 3g1f n ALA 74 Cb 0.15 -0.96 0.00 0.00 0.00 0.00 0.00 19.45 18.64 3g1f n ALA 74 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 3g1f n ASP 75 N -0.24 1.98 -4.82 0.00 -0.08 -1.26 -4.96 116.55 107.18 3g1f n ASP 75 Ca 0.05 -0.85 -0.30 0.00 -1.51 0.00 0.00 54.79 52.17 3g1f n ASP 75 Cb 0.83 0.00 0.07 0.00 2.34 0.00 0.00 41.12 44.36 3g1f n ASP 75 CO 0.00 0.00 0.00 0.27 0.12 0.00 0.00 177.20 177.59 3g1f s ILE 76 N -0.71 3.57 0.18 5.18 -4.36 -1.26 -4.74 121.20 119.06 3g1f s ILE 76 Ca 0.00 0.51 -0.19 0.00 -0.26 0.00 0.00 60.65 60.71 3g1f s ILE 76 Cb 0.00 -3.28 0.12 0.00 1.25 0.00 0.00 42.46 40.56 3g1f s ILE 76 CO 0.00 -0.67 1.61 -0.65 0.24 0.00 0.00 174.94 175.47 3g1f h PRO 77 N -0.87 -0.14 -0.45 0.37 0.11 -1.86 -0.33 132.00 128.82 3g1f h PRO 77 Ca -0.45 0.01 0.09 0.00 0.11 0.00 0.00 66.00 65.75 3g1f h PRO 77 Cb 1.24 0.03 -0.08 0.00 0.11 0.00 0.00 31.00 32.30 3g1f h PRO 77 CO 0.59 -0.10 -0.05 0.93 -0.21 0.00 0.00 178.00 179.16 3g1f h GLU 78 N -0.15 0.06 -0.27 1.05 3.07 -1.95 -1.85 114.58 114.55 3g1f h GLU 78 Ca 0.22 -0.00 -0.18 0.00 -0.50 0.00 0.00 59.36 58.90 3g1f h GLU 78 Cb 0.50 -0.01 -0.00 0.00 -0.84 0.00 0.00 28.75 28.40 3g1f h GLU 78 CO -0.58 0.04 -0.54 1.15 -1.40 0.00 0.00 179.01 177.67 3g1f h THR 79 N 0.06 1.28 -0.98 1.13 2.02 -1.83 -3.12 112.91 111.47 3g1f h THR 79 Ca 0.22 -1.74 0.07 0.00 0.77 0.00 0.00 66.41 65.73 3g1f h THR 79 Cb 0.33 1.65 -0.07 0.00 -1.74 0.00 0.00 68.15 68.33 3g1f h THR 79 CO -0.41 0.56 0.63 0.78 0.37 0.00 0.00 175.52 177.46 3g1f h ASN 80 N 0.62 1.00 -0.58 4.18 4.21 -0.63 -2.02 115.58 122.36 3g1f h ASN 80 Ca 0.01 0.01 0.04 0.00 1.21 0.00 0.00 56.30 57.57 3g1f h ASN 80 Cb 1.14 -0.20 -0.04 0.00 -1.12 0.00 0.00 38.32 38.09 3g1f h ASN 80 CO 0.12 0.64 0.33 -0.33 -1.29 0.00 0.00 177.43 176.90 3g1f h GLU 81 N 1.13 0.63 -0.30 0.81 5.08 -1.29 -1.25 114.58 119.39 3g1f h GLU 81 Ca 0.42 -0.04 -0.03 0.00 -1.00 0.00 0.00 59.36 58.72 3g1f h GLU 81 Cb 0.19 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.28 3g1f h GLU 81 CO -0.17 0.42 0.08 0.87 -1.00 0.00 0.00 179.01 179.21 3g1f h LYS 82 N 0.65 0.48 0.01 2.33 1.57 -1.43 0.18 116.57 120.35 3g1f h LYS 82 Ca 0.24 -0.11 0.02 0.00 -1.87 0.00 0.00 60.65 58.93 3g1f h LYS 82 Cb 0.07 -0.07 -0.02 0.00 0.08 0.00 0.00 32.23 32.29 3g1f h LYS 82 CO -0.13 0.54 -0.12 0.82 -0.57 0.00 0.00 179.45 180.00 3g1f h ILE 83 N 0.33 0.70 -0.10 1.86 2.04 -1.13 -0.78 117.51 120.44 3g1f h ILE 83 Ca 0.10 0.00 0.02 0.00 1.00 0.00 0.00 64.86 65.97 3g1f h ILE 83 Cb 0.27 0.70 -0.02 0.00 -0.74 0.00 0.00 36.82 37.03 3g1f h ILE 83 CO -0.00 0.00 -0.00 0.00 0.00 0.00 0.00 178.15 178.15 3g1f h ARG 85 N 0.03 1.04 -0.22 0.00 2.43 -0.38 -0.32 114.38 116.97 3g1f h ARG 85 Ca 0.05 -0.06 -0.05 0.00 -0.81 0.00 0.00 59.98 59.11 3g1f h ARG 85 Cb 0.06 -0.24 -0.01 0.00 -0.42 0.00 0.00 29.97 29.36 3g1f h ARG 85 CO -0.08 0.69 -0.04 0.00 -1.51 0.00 0.00 179.97 179.03 3g1f h ALA 86 N 1.49 0.31 -0.33 2.80 0.00 -0.67 0.15 119.26 123.01 3g1f h ALA 86 Ca 0.46 -0.25 -0.01 0.00 0.00 0.00 0.00 54.91 55.11 3g1f h ALA 86 Cb 0.31 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.01 3g1f h ALA 86 CO -0.22 0.08 0.17 1.15 0.00 0.00 0.00 179.25 180.44 3g1f h THR 87 N 0.16 1.14 0.21 0.00 2.02 -0.64 -1.12 112.91 114.68 3g1f h THR 87 Ca 0.06 -0.39 -0.01 0.00 0.77 0.00 0.00 66.41 66.84 3g1f h THR 87 Cb 0.49 0.81 0.00 0.00 -1.74 0.00 0.00 68.15 67.70 3g1f h THR 87 CO 0.02 0.15 -0.10 -0.26 0.37 0.00 0.00 175.52 175.70 3g1f h PHE 88 N 0.40 -0.26 -1.09 3.16 0.04 -1.05 -2.32 116.94 115.83 3g1f h PHE 88 Ca 0.11 -0.01 0.36 0.00 2.80 0.00 0.00 57.97 61.24 3g1f h PHE 88 Cb 0.08 0.09 -0.15 0.00 2.20 0.00 0.00 35.95 38.17 3g1f h PHE 88 CO -0.02 0.05 0.64 -0.22 -0.60 0.00 0.00 178.31 178.15 3g1f h LYS 89 N -0.57 0.21 0.00 1.51 3.64 -0.85 0.76 116.57 121.28 3g1f h LYS 89 Ca -0.03 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.34 3g1f h LYS 89 Cb 0.42 -0.05 0.00 0.00 -0.41 0.00 0.00 32.23 32.19 3g1f h LYS 89 CO 0.05 0.14 0.00 0.00 -2.27 0.00 0.00 179.45 177.36 3g1f n ALA 90 N -2.36 2.46 -0.02 5.00 0.00 -0.43 -4.88 120.51 120.28 3g1f n ALA 90 Ca 0.34 -0.08 0.00 0.00 0.00 0.00 0.00 53.44 53.70 3g1f n ALA 90 Cb 1.15 -1.21 0.00 0.00 0.00 0.00 0.00 19.45 19.38 3g1f n ALA 90 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3g1f n GLY 91 N 0.56 0.83 3.72 0.00 0.00 0.27 -4.07 105.19 106.50 3g1f n GLY 91 Ca 0.10 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.70 3g1f n GLY 91 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3g1f s ALA 92 N -2.02 3.20 0.17 4.61 0.00 -1.08 -4.78 121.76 121.87 3g1f s ALA 92 Ca 0.00 0.56 -0.07 0.00 0.00 0.00 0.00 51.96 52.44 3g1f s ALA 92 Cb 0.00 -3.31 0.05 0.00 0.00 0.00 0.00 23.12 19.86 3g1f s ALA 92 CO 0.00 -0.13 1.51 -0.44 0.00 0.00 0.00 175.76 176.70 3g1f h ASP 93 N 6.22 0.86 -5.18 0.00 3.32 -1.46 -3.42 116.42 116.76 3g1f h ASP 93 Ca -0.42 -0.39 -0.11 0.00 0.02 0.00 0.00 57.03 56.13 3g1f h ASP 93 Cb 1.22 -0.24 -0.15 0.00 0.22 0.00 0.00 39.33 40.37 3g1f h ASP 93 CO 0.73 1.15 -0.52 0.00 -1.72 0.00 0.00 179.24 178.88 3g1f s ALA 94 N -4.33 0.10 -0.03 3.45 0.00 -1.04 -1.53 121.76 118.37 3g1f s ALA 94 Ca -0.10 -0.84 0.02 0.00 0.00 0.00 0.00 51.96 51.04 3g1f s ALA 94 Cb 0.12 0.36 0.01 0.00 0.00 0.00 0.00 23.12 23.60 3g1f s ALA 94 CO 0.86 -0.42 -0.06 -1.50 0.00 0.00 0.00 175.76 174.64 3g1f s ILE 95 N -3.66 0.57 -0.01 0.00 2.07 -0.51 -0.48 121.20 119.17 3g1f s ILE 95 Ca 0.04 -0.21 -0.24 0.00 -1.41 0.00 0.00 60.65 58.83 3g1f s ILE 95 Cb 0.05 -0.54 -0.05 0.00 0.13 0.00 0.00 42.46 42.05 3g1f s ILE 95 CO -0.09 0.20 0.73 -0.63 -1.91 0.00 0.00 174.94 173.23 3g1f s ILE 96 N 0.46 4.90 0.01 2.00 1.01 -0.73 -1.33 121.20 127.51 3g1f s ILE 96 Ca -0.06 1.52 0.05 0.00 0.00 0.00 0.00 60.65 62.16 3g1f s ILE 96 Cb -0.10 -4.07 -0.02 0.00 0.01 0.00 0.00 42.46 38.29 3g1f s ILE 96 CO 0.00 0.31 -0.17 -0.69 0.00 0.00 0.00 174.94 174.40 3g1f s VAL 97 N 0.35 1.32 0.22 2.92 1.01 0.39 -1.59 120.40 125.02 3g1f s VAL 97 Ca 0.38 -0.84 -0.29 0.00 0.00 0.00 0.00 61.98 61.23 3g1f s VAL 97 Cb -0.19 -1.12 -0.09 0.00 0.00 0.00 0.00 36.38 34.98 3g1f s VAL 97 CO 0.20 0.27 0.91 -1.00 0.00 0.00 0.00 175.10 175.49 3g1f s HIS 98 N -0.54 3.97 -0.13 5.22 3.76 -0.17 -1.42 115.29 125.99 3g1f s HIS 98 Ca 0.06 1.87 0.20 0.00 -0.15 0.00 0.00 55.06 57.03 3g1f s HIS 98 Cb -0.07 -2.95 -0.20 0.00 1.11 0.00 0.00 32.58 30.48 3g1f s HIS 98 CO 0.00 0.46 0.62 0.41 -0.85 0.00 0.00 174.74 175.38 3g1f n GLY 99 N 1.53 -1.15 0.43 -2.22 0.00 -1.24 -4.35 105.19 98.20 3g1f n GLY 99 Ca -0.02 -0.31 0.27 0.00 0.00 0.00 0.00 46.02 45.95 3g1f n GLY 99 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 3g1f h PHE 100 N 0.00 0.58 0.00 1.61 3.04 -1.93 0.32 116.94 120.57 3g1f h PHE 100 Ca -0.15 0.02 0.00 0.00 3.98 0.00 0.00 57.97 61.82 3g1f h PHE 100 Cb 1.41 -0.16 0.00 0.00 2.56 0.00 0.00 35.95 39.75 3g1f h PHE 100 CO 0.00 -0.01 0.00 -2.30 -2.02 0.00 0.00 178.31 173.98 3g1f n PRO 101 N -4.62 0.36 0.00 6.41 -0.02 -1.26 -4.98 135.00 130.90 3g1f n PRO 101 Ca 0.28 0.08 0.00 0.00 -2.02 0.00 0.00 63.50 61.84 3g1f n PRO 101 Cb 1.03 -1.50 0.00 0.00 -0.02 0.00 0.00 33.50 33.01 3g1f n PRO 101 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3g1f n GLY 102 N 0.27 2.49 0.29 -1.23 0.00 0.11 -4.64 105.19 102.48 3g1f n GLY 102 Ca 0.10 -1.88 0.07 0.00 0.00 0.00 0.00 46.02 44.31 3g1f n GLY 102 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3g1f h ALA 103 N 0.00 1.13 -0.90 4.61 0.00 -1.94 -1.81 119.26 120.35 3g1f h ALA 103 Ca 0.00 0.12 -0.00 0.00 0.00 0.00 0.00 54.91 55.03 3g1f h ALA 103 Cb 0.00 0.10 -0.04 0.00 0.00 0.00 0.00 17.79 17.85 3g1f h ALA 103 CO 0.00 -0.23 0.56 0.38 0.00 0.00 0.00 179.25 179.96 3g1f h ASP 104 N 0.44 1.06 0.01 0.00 2.03 -1.98 0.35 116.42 118.33 3g1f h ASP 104 Ca 0.44 -0.05 -0.16 0.00 -0.73 0.00 0.00 57.03 56.53 3g1f h ASP 104 Cb 0.70 -0.27 -0.01 0.00 -0.83 0.00 0.00 39.33 38.93 3g1f h ASP 104 CO -0.43 0.80 -0.52 0.28 -1.03 0.00 0.00 179.24 178.34 3g1f h SER 105 N 1.23 0.62 -0.23 4.15 0.02 -1.66 -2.33 113.55 115.35 3g1f h SER 105 Ca 0.32 -0.32 -0.16 0.00 -0.84 0.00 0.00 61.79 60.79 3g1f h SER 105 Cb -0.08 -0.18 -0.00 0.00 0.14 0.00 0.00 62.40 62.28 3g1f h SER 105 CO -0.06 1.02 -0.47 0.58 -1.14 0.00 0.00 176.83 176.76 3g1f h VAL 106 N 0.44 1.28 -0.47 2.27 2.07 -0.78 -3.11 116.25 117.95 3g1f h VAL 106 Ca 0.01 -1.66 -0.07 0.00 0.82 0.00 0.00 66.70 65.81 3g1f h VAL 106 Cb 1.06 1.55 -0.02 0.00 -1.52 0.00 0.00 31.29 32.36 3g1f h VAL 106 CO 0.10 0.54 0.00 -0.09 0.02 0.00 0.00 177.57 178.14 3g1f h ARG 107 N 0.63 0.77 -0.16 1.57 9.65 -0.23 -2.11 114.38 124.52 3g1f h ARG 107 Ca 0.03 -0.21 -0.02 0.00 -1.10 0.00 0.00 59.98 58.69 3g1f h ARG 107 Cb 1.05 -0.09 -0.01 0.00 -1.39 0.00 0.00 29.97 29.53 3g1f h ARG 107 CO 0.10 0.78 0.02 0.00 2.80 0.00 0.00 179.97 183.68 3g1f h ALA 108 N 1.27 1.75 -0.03 2.80 0.00 -1.35 -1.29 119.26 122.41 3g1f h ALA 108 Ca 0.14 -0.08 -0.14 0.00 0.00 0.00 0.00 54.91 54.83 3g1f h ALA 108 Cb 0.44 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.14 3g1f h ALA 108 CO 0.02 0.20 -0.64 0.00 0.00 0.00 0.00 179.25 178.83 3g1f h LEU 110 N 0.09 0.89 -0.44 0.00 3.38 -0.97 -2.06 115.31 116.20 3g1f h LEU 110 Ca -0.01 -0.65 0.06 0.00 0.09 0.00 0.00 57.88 57.37 3g1f h LEU 110 Cb 1.14 -0.27 -0.05 0.00 0.09 0.00 0.00 40.66 41.57 3g1f h LEU 110 CO 0.09 1.45 0.14 0.78 0.09 0.00 0.00 178.44 180.99 3g1f h ASN 111 N 0.44 0.12 -0.51 -0.43 2.35 -1.38 0.17 115.58 116.34 3g1f h ASN 111 Ca -0.09 0.06 -0.04 0.00 -0.55 0.00 0.00 56.30 55.67 3g1f h ASN 111 Cb 1.56 0.05 -0.02 0.00 0.05 0.00 0.00 38.32 39.97 3g1f h ASN 111 CO 0.18 0.10 0.15 0.58 -1.65 0.00 0.00 177.43 176.80 3g1f h VAL 112 N 0.30 1.23 -0.63 2.81 2.07 -1.54 0.19 116.25 120.68 3g1f h VAL 112 Ca 0.21 -0.79 -0.03 0.00 0.82 0.00 0.00 66.70 66.91 3g1f h VAL 112 Cb 0.22 0.78 -0.03 0.00 -1.52 0.00 0.00 31.29 30.74 3g1f h VAL 112 CO -0.23 0.29 0.27 0.00 0.02 0.00 0.00 177.57 177.92 3g1f h ALA 113 N 1.01 1.31 -0.05 1.67 0.00 -0.65 -1.84 119.26 120.71 3g1f h ALA 113 Ca 0.16 -0.15 -0.20 0.00 0.00 0.00 0.00 54.91 54.73 3g1f h ALA 113 Cb 0.29 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 17.82 3g1f h ALA 113 CO -0.00 0.53 -0.81 1.49 0.00 0.00 0.00 179.25 180.45 3g1f h GLU 114 N 0.89 0.42 0.00 0.00 4.81 -0.39 0.63 114.58 120.94 3g1f h GLU 114 Ca 0.22 -0.39 0.00 0.00 -0.13 0.00 0.00 59.36 59.06 3g1f h GLU 114 Cb 0.13 0.09 0.00 0.00 0.63 0.00 0.00 28.75 29.61 3g1f h GLU 114 CO -0.02 1.04 0.00 1.49 -0.73 0.00 0.00 179.01 180.78 3g1f h GLU 115 N 0.27 0.00 0.00 1.92 4.81 -0.16 -3.11 114.58 118.31 3g1f h GLU 115 Ca -0.05 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.18 3g1f h GLU 115 Cb 1.42 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.80 3g1f h GLU 115 CO 0.14 0.00 0.00 -1.33 -0.73 0.00 0.00 179.01 177.09 3g1f n MET 116 N -2.95 0.37 -3.23 1.92 2.81 -0.74 -5.01 117.12 110.29 3g1f n MET 116 Ca 0.00 -0.72 -0.16 0.00 -1.81 0.00 0.00 57.70 55.01 3g1f n MET 116 Cb 0.25 -0.89 0.06 0.00 -0.71 0.00 0.00 33.22 31.93 3g1f n MET 116 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3g1f n GLY 117 N -0.14 -0.17 2.35 3.03 0.00 0.45 -5.02 105.19 105.68 3g1f n GLY 117 Ca 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.83 3g1f n GLY 117 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3g1f n ARG 118 N -3.69 0.89 -4.31 1.61 5.12 0.19 -5.02 116.66 111.46 3g1f n ARG 118 Ca -0.08 -2.41 -0.26 0.00 -1.93 0.00 0.00 57.85 53.17 3g1f n ARG 118 Cb 0.58 1.02 -0.09 0.00 -1.16 0.00 0.00 32.46 32.81 3g1f n ARG 118 CO 0.00 0.00 0.00 -1.21 -1.93 0.00 0.00 177.63 174.49 3g1f s GLU 119 N -3.13 2.07 -0.07 5.56 0.41 -0.58 -4.47 118.70 118.47 3g1f s GLU 119 Ca 0.08 -1.34 0.03 0.00 -0.41 0.00 0.00 54.97 53.33 3g1f s GLU 119 Cb 0.00 -2.12 0.01 0.00 -1.78 0.00 0.00 34.13 30.24 3g1f s GLU 119 CO 0.06 0.41 -0.16 0.08 -0.49 0.00 0.00 175.26 175.16 3g1f s VAL 120 N -1.89 1.41 -0.15 2.63 1.01 -1.26 -1.43 120.40 120.73 3g1f s VAL 120 Ca 0.26 -0.64 -0.02 0.00 0.00 0.00 0.00 61.98 61.59 3g1f s VAL 120 Cb -0.08 -1.26 -0.02 0.00 0.00 0.00 0.00 36.38 35.03 3g1f s VAL 120 CO 0.16 0.42 -0.09 -0.36 0.00 0.00 0.00 175.10 175.22 3g1f s PHE 121 N 0.54 2.89 -0.21 5.22 0.40 -0.44 -4.06 117.98 122.32 3g1f s PHE 121 Ca -0.15 -0.58 -0.12 0.00 -0.60 0.00 0.00 56.93 55.48 3g1f s PHE 121 Cb -0.16 -1.91 -0.05 0.00 0.51 0.00 0.00 43.02 41.41 3g1f s PHE 121 CO 0.05 -0.20 0.20 -1.17 0.70 0.00 0.00 175.22 174.80 3g1f s LEU 122 N 0.49 4.16 -0.23 -0.37 2.96 -0.50 -0.46 118.68 124.74 3g1f s LEU 122 Ca -0.07 0.25 -0.20 0.00 -0.22 0.00 0.00 54.13 53.90 3g1f s LEU 122 Cb -0.15 -2.19 -0.02 0.00 0.50 0.00 0.00 46.19 44.32 3g1f s LEU 122 CO 0.04 0.08 0.59 -0.22 -1.32 0.00 0.00 176.35 175.52 3g1f s LEU 123 N 0.81 4.10 -0.12 -0.68 2.96 -0.51 -0.97 118.68 124.27 3g1f s LEU 123 Ca 0.10 0.71 0.19 0.00 -0.22 0.00 0.00 54.13 54.91 3g1f s LEU 123 Cb -0.13 -2.81 -0.27 0.00 0.50 0.00 0.00 46.19 43.48 3g1f s LEU 123 CO 0.03 -0.30 0.24 0.35 -1.32 0.00 0.00 176.35 175.35 3g1f n THR 124 N 4.94 0.72 -3.67 3.68 -2.24 -1.14 -3.61 114.28 112.96 3g1f n THR 124 Ca -0.02 -0.66 -0.14 0.00 -2.27 0.00 0.00 64.05 60.96 3g1f n THR 124 Cb 0.49 -0.26 -0.08 0.00 -2.10 0.00 0.00 70.33 68.39 3g1f n THR 124 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 3g1f s GLU 125 N -2.90 0.71 0.27 -0.78 2.12 -1.26 -3.92 118.70 112.94 3g1f s GLU 125 Ca -0.09 0.71 -0.00 0.00 0.36 0.00 0.00 54.97 55.96 3g1f s GLU 125 Cb 0.09 0.35 -0.04 0.00 0.26 0.00 0.00 34.13 34.79 3g1f s GLU 125 CO 0.82 -0.11 0.46 -1.64 -0.54 0.00 0.00 175.26 174.25 3g1f s MET 126 N 0.10 3.51 0.20 4.30 -1.94 -1.26 -3.61 119.30 120.60 3g1f s MET 126 Ca -0.02 -0.35 0.25 0.00 -1.71 0.00 0.00 55.69 53.86 3g1f s MET 126 Cb -0.04 -2.76 0.58 0.00 2.01 0.00 0.00 34.83 34.62 3g1f s MET 126 CO 0.02 0.29 1.58 0.66 -0.01 0.00 0.00 175.02 177.56 3g1f h SER 127 N 1.40 0.00 -4.47 3.03 4.64 -1.95 -3.44 113.55 112.77 3g1f h SER 127 Ca -0.49 -0.07 -0.47 0.00 -0.47 0.00 0.00 61.79 60.28 3g1f h SER 127 Cb 1.21 0.00 0.11 0.00 -0.31 0.00 0.00 62.40 63.40 3g1f h SER 127 CO 0.64 0.04 0.38 -1.38 -0.87 0.00 0.00 176.83 175.64 3g1f s HIS 128 N -3.14 2.89 0.10 4.77 -3.43 -1.26 -4.86 115.29 110.36 3g1f s HIS 128 Ca 0.08 0.86 -0.21 0.00 -0.80 0.00 0.00 55.06 54.99 3g1f s HIS 128 Cb 0.12 -3.37 -0.10 0.00 -1.43 0.00 0.00 32.58 27.80 3g1f s HIS 128 CO 0.65 -1.84 1.74 -1.35 -2.00 0.00 0.00 174.74 171.95 3g1f h PRO 129 N -1.11 0.16 -1.47 -0.38 0.11 -2.01 -2.54 132.00 124.76 3g1f h PRO 129 Ca -0.47 -0.01 0.43 0.00 0.11 0.00 0.00 66.00 66.05 3g1f h PRO 129 Cb 1.31 -0.03 -0.06 0.00 0.11 0.00 0.00 31.00 32.33 3g1f h PRO 129 CO 0.64 0.13 1.07 0.78 -0.21 0.00 0.00 178.00 180.40 3g1f h GLY 130 N 0.15 0.00 -0.85 -0.55 0.00 -1.96 -0.95 103.07 98.90 3g1f h GLY 130 Ca 0.04 0.00 0.41 0.00 0.00 0.00 0.00 47.33 47.78 3g1f h GLY 130 CO -0.01 0.00 1.01 0.00 0.00 0.00 0.00 176.54 177.54 3g1f h ALA 131 N 1.25 3.29 -0.15 3.60 0.00 -1.74 -1.54 119.26 123.97 3g1f h ALA 131 Ca 0.70 -0.04 -0.04 0.00 0.00 0.00 0.00 54.91 55.53 3g1f h ALA 131 Cb 2.82 0.11 -0.00 0.00 0.00 0.00 0.00 17.79 20.71 3g1f h ALA 131 CO -0.01 -1.71 -0.05 0.93 0.00 0.00 0.00 179.25 178.42 3g1f h GLU 132 N 0.02 0.29 -0.56 0.00 5.08 -1.38 1.12 114.58 119.15 3g1f h GLU 132 Ca 0.68 -0.12 0.05 0.00 -1.00 0.00 0.00 59.36 58.98 3g1f h GLU 132 Cb 2.68 -0.01 -0.07 0.00 0.50 0.00 0.00 28.75 31.85 3g1f h GLU 132 CO -0.04 0.59 -0.39 0.52 -1.00 0.00 0.00 179.01 178.69 3g1f h MET 133 N -0.02 -0.07 0.00 2.33 2.86 -1.49 -3.31 114.93 115.23 3g1f h MET 133 Ca 0.04 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.68 3g1f h MET 133 Cb 0.49 0.02 0.00 0.00 0.06 0.00 0.00 31.60 32.16 3g1f h MET 133 CO 0.02 -0.05 -0.96 1.19 1.06 0.00 0.00 176.91 178.17 3g1f n PHE 134 N -4.50 0.00 -0.20 -0.22 3.01 -1.26 -4.79 117.46 109.51 3g1f n PHE 134 Ca 0.00 0.00 -0.04 0.00 1.01 0.00 0.00 57.45 58.42 3g1f n PHE 134 Cb 0.19 0.00 0.13 0.00 -0.01 0.00 0.00 39.48 39.79 3g1f n PHE 134 CO 0.00 0.00 0.00 0.82 1.01 0.00 0.00 176.76 178.59 3g1f h ILE 135 N 0.00 1.24 -0.37 4.37 2.04 -1.67 -3.17 117.51 119.95 3g1f h ILE 135 Ca 0.00 -0.84 0.08 0.00 1.00 0.00 0.00 64.86 65.09 3g1f h ILE 135 Cb 0.96 0.54 -0.09 0.00 -0.74 0.00 0.00 36.82 37.49 3g1f h ILE 135 CO 0.00 0.33 -0.30 -0.61 0.00 0.00 0.00 178.15 177.57 3g1f h GLN 136 N 0.96 -0.23 0.00 2.37 5.75 0.12 -1.74 115.11 122.34 3g1f h GLN 136 Ca 0.21 0.02 0.00 0.00 -0.15 0.00 0.00 58.65 58.73 3g1f h GLN 136 Cb 0.28 0.05 0.00 0.00 1.07 0.00 0.00 27.48 28.89 3g1f h GLN 136 CO -0.01 -0.15 0.00 0.41 -2.65 0.00 0.00 178.83 176.43 3g1f n GLY 137 N -1.41 -1.30 0.01 2.39 0.00 -1.20 -3.22 105.19 100.47 3g1f n GLY 137 Ca 0.01 0.04 0.11 0.00 0.00 0.00 0.00 46.02 46.17 3g1f n GLY 137 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3g1f n ALA 138 N -1.71 3.72 -0.35 4.61 0.00 -0.70 -4.68 120.51 121.39 3g1f n ALA 138 Ca 0.03 -0.51 0.00 0.00 0.00 0.00 0.00 53.44 52.96 3g1f n ALA 138 Cb 0.25 -0.83 0.00 0.00 0.00 0.00 0.00 19.45 18.88 3g1f n ALA 138 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3g1f n ALA 139 N -1.84 -0.04 -0.28 0.00 0.00 -0.91 0.27 120.51 117.71 3g1f n ALA 139 Ca 0.01 0.00 0.09 0.00 0.00 0.00 0.00 53.44 53.54 3g1f n ALA 139 Cb 0.44 0.36 0.24 0.00 0.00 0.00 0.00 19.45 20.49 3g1f n ALA 139 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 3g1f h ASP 140 N 0.00 0.25 0.07 0.00 5.19 -1.83 0.80 116.42 120.90 3g1f h ASP 140 Ca 0.00 0.14 -0.05 0.00 -0.62 0.00 0.00 57.03 56.49 3g1f h ASP 140 Cb 0.00 0.13 -0.01 0.00 0.18 0.00 0.00 39.33 39.63 3g1f h ASP 140 CO 0.00 0.03 -0.16 -0.08 -3.12 0.00 0.00 179.24 175.91 3g1f h GLU 141 N 0.40 0.20 -0.08 3.56 4.81 -1.70 0.43 114.58 122.19 3g1f h GLU 141 Ca 0.48 -0.05 -0.24 0.00 -0.13 0.00 0.00 59.36 59.43 3g1f h GLU 141 Cb 0.84 -0.03 0.02 0.00 0.63 0.00 0.00 28.75 30.21 3g1f h GLU 141 CO -0.48 0.37 -0.88 0.82 -0.73 0.00 0.00 179.01 178.10 3g1f h ILE 142 N 0.19 1.28 -0.46 2.32 2.04 0.48 -0.72 117.51 122.64 3g1f h ILE 142 Ca 0.04 -2.09 -0.05 0.00 1.00 0.00 0.00 64.86 63.76 3g1f h ILE 142 Cb 0.41 2.18 -0.02 0.00 -0.74 0.00 0.00 36.82 38.65 3g1f h ILE 142 CO 0.03 0.65 0.11 0.00 0.00 0.00 0.00 178.15 178.93 3g1f h ALA 143 N 0.47 0.61 -0.71 1.87 0.00 0.89 0.18 119.26 122.58 3g1f h ALA 143 Ca -0.09 -0.21 0.04 0.00 0.00 0.00 0.00 54.91 54.66 3g1f h ALA 143 Cb 1.52 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 19.10 3g1f h ALA 143 CO 0.18 0.30 0.47 0.00 0.00 0.00 0.00 179.25 180.19 3g1f h ARG 144 N 0.62 0.80 -0.14 0.00 3.08 -0.11 0.39 114.38 119.01 3g1f h ARG 144 Ca 0.14 -0.05 -0.14 0.00 0.07 0.00 0.00 59.98 60.01 3g1f h ARG 144 Cb 0.33 -0.18 -0.01 0.00 0.08 0.00 0.00 29.97 30.19 3g1f h ARG 144 CO 0.00 0.53 -0.50 1.98 -1.07 0.00 0.00 179.97 180.91 3g1f h MET 145 N 0.82 0.39 0.49 0.04 4.05 -0.17 -0.41 114.93 120.14 3g1f h MET 145 Ca 0.29 -0.22 -0.02 0.00 -0.28 0.00 0.00 59.70 59.46 3g1f h MET 145 Cb 0.11 0.02 0.00 0.00 -0.80 0.00 0.00 31.60 30.93 3g1f h MET 145 CO -0.09 0.80 -0.24 0.78 0.23 0.00 0.00 176.91 178.39 3g1f h GLY 146 N 1.22 -0.69 -0.38 1.39 0.00 1.00 0.44 103.07 106.04 3g1f h GLY 146 Ca 0.01 0.26 0.26 0.00 0.00 0.00 0.00 47.33 47.86 3g1f h GLY 146 CO 0.08 -0.25 0.41 -2.08 0.00 0.00 0.00 176.54 174.70 3g1f h VAL 147 N -0.90 0.37 0.00 4.60 2.07 -1.05 1.39 116.25 122.73 3g1f h VAL 147 Ca -0.07 -0.11 -0.03 0.00 0.82 0.00 0.00 66.70 67.32 3g1f h VAL 147 Cb 0.51 0.02 -0.00 0.00 -1.52 0.00 0.00 31.29 30.29 3g1f h VAL 147 CO 0.11 0.06 -0.12 -0.78 0.02 0.00 0.00 177.57 176.86 3g1f h ASP 148 N 0.33 0.00 0.05 0.57 1.82 -0.90 -2.85 116.42 115.44 3g1f h ASP 148 Ca 0.62 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 57.26 3g1f h ASP 148 Cb 1.27 0.00 0.00 0.00 0.68 0.00 0.00 39.33 41.28 3g1f h ASP 148 CO -0.59 0.12 -0.50 0.18 -1.61 0.00 0.00 179.24 176.84 3g1f n LEU 149 N -3.94 1.66 0.00 2.28 4.77 0.47 -4.95 117.00 117.28 3g1f n LEU 149 Ca -0.02 -0.61 0.00 0.00 -0.03 0.00 0.00 56.01 55.35 3g1f n LEU 149 Cb 0.21 -0.03 0.00 0.00 -2.33 0.00 0.00 43.42 41.27 3g1f n LEU 149 CO 0.32 0.32 0.00 0.61 -1.33 0.00 0.00 177.39 177.31 3g1f n GLY 150 N 1.42 0.80 3.74 -0.72 0.00 -0.60 -5.06 105.19 104.76 3g1f n GLY 150 Ca 0.09 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.69 3g1f n GLY 150 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3g1f s VAL 151 N -2.00 2.74 -0.41 1.61 1.01 -1.02 -4.91 120.40 117.42 3g1f s VAL 151 Ca 0.00 0.60 0.06 0.00 0.00 0.00 0.00 61.98 62.63 3g1f s VAL 151 Cb 0.00 -3.38 -0.03 0.00 0.00 0.00 0.00 36.38 32.97 3g1f s VAL 151 CO 0.00 0.08 0.37 0.29 0.00 0.00 0.00 175.10 175.84 3g1f n LYS 152 N 2.79 3.58 -5.14 2.72 5.02 -1.26 -4.52 118.16 121.35 3g1f n LYS 152 Ca 0.08 -0.26 -0.30 0.00 -2.02 0.00 0.00 58.31 55.81 3g1f n LYS 152 Cb 0.40 -0.87 -0.17 0.00 -0.02 0.00 0.00 35.03 34.38 3g1f n LYS 152 CO 0.00 0.00 0.00 -0.80 -0.52 0.00 0.00 177.40 176.08 3g1f s ASN 153 N -1.20 2.86 0.16 4.39 0.01 -1.26 0.13 114.94 120.03 3g1f s ASN 153 Ca 0.04 -0.50 0.01 0.00 -0.71 0.00 0.00 52.86 51.70 3g1f s ASN 153 Cb 0.04 -1.06 -0.04 0.00 0.41 0.00 0.00 41.25 40.60 3g1f s ASN 153 CO 0.18 0.18 0.01 -0.31 -1.51 0.00 0.00 177.10 175.65 3g1f s TYR 154 N 0.15 1.09 -0.09 2.20 1.51 -0.33 -1.41 117.35 120.48 3g1f s TYR 154 Ca -0.11 -1.07 -0.00 0.00 -1.01 0.00 0.00 57.07 54.87 3g1f s TYR 154 Cb -0.16 -0.62 0.02 0.00 -0.11 0.00 0.00 41.96 41.10 3g1f s TYR 154 CO 0.06 -0.29 -0.05 0.08 -1.11 0.00 0.00 175.55 174.24 3g1f s VAL 155 N -3.76 0.79 0.08 0.71 1.01 -0.15 -2.19 120.40 116.90 3g1f s VAL 155 Ca 0.23 -0.16 0.07 0.00 0.00 0.00 0.00 61.98 62.12 3g1f s VAL 155 Cb 0.06 -0.85 -0.03 0.00 0.00 0.00 0.00 36.38 35.57 3g1f s VAL 155 CO 0.03 0.32 -0.18 -0.83 0.00 0.00 0.00 175.10 174.44 3g1f s GLY 156 N 1.65 1.07 -0.04 4.51 0.00 -0.22 -2.90 107.32 111.38 3g1f s GLY 156 Ca 0.02 -1.10 -0.30 0.00 0.00 0.00 0.00 44.72 43.35 3g1f s GLY 156 CO -0.06 -1.09 1.62 2.56 0.00 0.00 0.00 173.10 176.13 3g1f s PRO 157 N -1.64 4.19 0.38 2.90 0.04 -1.24 -3.59 135.00 136.04 3g1f s PRO 157 Ca 0.04 2.17 0.20 0.00 0.04 0.00 0.00 61.00 63.45 3g1f s PRO 157 Cb -0.10 -3.91 0.64 0.00 0.04 0.00 0.00 34.50 31.18 3g1f s PRO 157 CO 0.03 -0.81 1.71 1.03 0.04 0.00 0.00 177.00 179.00 3g1f h SER 158 N 9.24 0.00 0.00 6.66 0.87 -1.76 -3.12 113.55 125.44 3g1f h SER 158 Ca -0.39 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.17 3g1f h SER 158 Cb 1.18 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.14 3g1f h SER 158 CO 0.95 0.35 0.00 0.35 -0.53 0.00 0.00 176.83 177.95 3g1f n THR 159 N -3.43 0.00 -2.96 2.23 -2.24 -1.26 -3.96 114.28 102.66 3g1f n THR 159 Ca 0.00 0.00 -0.12 0.00 -2.27 0.00 0.00 64.05 61.66 3g1f n THR 159 Cb 0.53 -0.50 -0.02 0.00 -2.10 0.00 0.00 70.33 68.23 3g1f n THR 159 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 3g1f n ARG 160 N -0.74 0.45 -0.29 -0.78 1.74 -1.18 -4.91 116.66 110.95 3g1f n ARG 160 Ca 0.06 -2.40 0.06 0.00 -0.77 0.00 0.00 57.85 54.79 3g1f n ARG 160 Cb 0.03 -1.52 0.27 0.00 -1.02 0.00 0.00 32.46 30.22 3g1f n ARG 160 CO 0.00 0.00 0.00 -1.35 -1.52 0.00 0.00 177.63 174.76 3g1f h PRO 161 N 5.09 0.92 -0.45 5.56 0.11 -1.79 -1.63 132.00 139.81 3g1f h PRO 161 Ca 0.11 -0.06 0.11 0.00 0.11 0.00 0.00 66.00 66.28 3g1f h PRO 161 Cb 1.04 -0.21 -0.02 0.00 0.11 0.00 0.00 31.00 31.92 3g1f h PRO 161 CO 0.16 0.61 0.32 1.05 -0.21 0.00 0.00 178.00 179.92 3g1f h GLU 162 N 0.95 0.10 -0.00 1.05 9.09 -1.95 -1.41 114.58 122.40 3g1f h GLU 162 Ca 0.40 -0.01 -0.01 0.00 0.05 0.00 0.00 59.36 59.79 3g1f h GLU 162 Cb 0.31 -0.02 0.00 0.00 -1.65 0.00 0.00 28.75 27.38 3g1f h GLU 162 CO -0.16 0.07 -0.03 0.00 0.05 0.00 0.00 179.01 178.93 3g1f h ARG 163 N 0.10 0.02 -0.13 1.06 2.47 -1.67 -3.18 114.38 113.05 3g1f h ARG 163 Ca 0.21 -0.02 0.04 0.00 -1.26 0.00 0.00 59.98 58.95 3g1f h ARG 163 Cb 0.72 0.01 -0.01 0.00 -1.65 0.00 0.00 29.97 29.04 3g1f h ARG 163 CO -0.02 0.79 0.39 -0.07 0.56 0.00 0.00 179.97 181.62 3g1f h LEU 164 N -0.74 0.00 0.24 3.04 4.07 -1.01 -0.17 115.31 120.74 3g1f h LEU 164 Ca -0.00 0.00 -0.01 0.00 0.08 0.00 0.00 57.88 57.94 3g1f h LEU 164 Cb 0.80 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.54 3g1f h LEU 164 CO 0.01 0.00 -0.12 -1.28 -1.08 0.00 0.00 178.44 175.97 3g1f h SER 165 N 0.00 -0.27 0.62 -0.43 0.87 -1.37 -2.51 113.55 110.46 3g1f h SER 165 Ca 0.06 -0.25 -0.10 0.00 -1.23 0.00 0.00 61.79 60.26 3g1f h SER 165 Cb 0.83 0.07 -0.01 0.00 -0.44 0.00 0.00 62.40 62.85 3g1f h SER 165 CO -0.00 0.20 -0.50 -0.09 -0.53 0.00 0.00 176.83 175.91 3g1f h ARG 166 N -0.85 0.00 0.13 2.24 9.65 -1.16 -2.22 114.38 122.17 3g1f h ARG 166 Ca -0.03 0.00 -0.01 0.00 -1.10 0.00 0.00 59.98 58.84 3g1f h ARG 166 Cb 0.51 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.09 3g1f h ARG 166 CO 0.05 0.50 -0.06 1.25 2.80 0.00 0.00 179.97 184.51 3g1f h LEU 167 N 0.00 -0.15 -2.10 3.80 6.46 -1.21 -1.12 115.31 120.99 3g1f h LEU 167 Ca -0.00 -0.36 0.09 0.00 -0.12 0.00 0.00 57.88 57.48 3g1f h LEU 167 Cb 0.94 0.04 -0.01 0.00 -0.73 0.00 0.00 40.66 40.90 3g1f h LEU 167 CO 0.06 0.33 0.29 -0.09 -0.62 0.00 0.00 178.44 178.41 3g1f h ARG 168 N -0.68 0.00 0.05 1.25 9.65 -1.42 0.52 114.38 123.75 3g1f h ARG 168 Ca -0.02 0.00 -0.23 0.00 -1.10 0.00 0.00 59.98 58.63 3g1f h ARG 168 Cb 0.51 0.00 -0.01 0.00 -1.39 0.00 0.00 29.97 29.08 3g1f h ARG 168 CO 0.03 0.00 -1.04 1.49 2.80 0.00 0.00 179.97 183.25 3g1f h GLU 169 N 0.00 0.19 0.09 0.20 4.81 -1.04 -0.82 114.58 118.02 3g1f h GLU 169 Ca 0.15 -0.27 -0.28 0.00 -0.13 0.00 0.00 59.36 58.83 3g1f h GLU 169 Cb 0.73 0.09 0.02 0.00 0.63 0.00 0.00 28.75 30.22 3g1f h GLU 169 CO -0.00 1.07 -1.18 0.82 -0.73 0.00 0.00 179.01 178.98 3g1f h ILE 170 N 0.08 1.33 0.00 2.32 2.04 0.34 -3.27 117.51 120.35 3g1f h ILE 170 Ca -0.07 -2.53 0.00 0.00 1.00 0.00 0.00 64.86 63.26 3g1f h ILE 170 Cb 1.73 2.66 0.00 0.00 -0.74 0.00 0.00 36.82 40.47 3g1f h ILE 170 CO 0.16 0.76 -0.52 0.16 0.00 0.00 0.00 178.15 178.71 3g1f h ILE 171 N 0.25 0.00 0.00 -0.67 3.07 -1.31 -3.48 117.51 115.37 3g1f h ILE 171 Ca -0.16 -0.72 0.00 0.00 1.55 0.00 0.00 64.86 65.53 3g1f h ILE 171 Cb 1.85 1.42 0.00 0.00 -0.27 0.00 0.00 36.82 39.82 3g1f h ILE 171 CO 0.22 0.00 0.00 0.61 -1.05 0.00 0.00 178.15 177.93 3g1f n GLY 172 N 1.25 -1.68 0.01 0.16 0.00 -0.31 -4.16 105.19 100.46 3g1f n GLY 172 Ca 0.03 -1.59 0.07 0.00 0.00 0.00 0.00 46.02 44.53 3g1f n GLY 172 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3g1f n GLN 173 N 0.00 0.48 0.18 1.61 1.13 -1.26 -4.48 117.38 115.03 3g1f n GLN 173 Ca 0.00 -0.14 0.06 0.00 -1.94 0.00 0.00 57.00 54.98 3g1f n GLN 173 Cb 0.00 -1.36 0.26 0.00 0.11 0.00 0.00 30.24 29.25 3g1f n GLN 173 CO 0.00 0.00 0.00 0.38 -1.44 0.00 0.00 177.06 176.00 3g1f h ASP 174 N 0.00 0.00 -3.43 1.08 2.03 -1.96 -3.46 116.42 110.69 3g1f h ASP 174 Ca -0.01 0.00 -0.49 0.00 -0.73 0.00 0.00 57.03 55.81 3g1f h ASP 174 Cb 0.71 0.00 0.03 0.00 -0.83 0.00 0.00 39.33 39.24 3g1f h ASP 174 CO 0.00 0.36 0.05 -0.44 -1.03 0.00 0.00 179.24 178.19 3g1f s SER 175 N -6.36 6.27 0.22 4.15 0.01 -1.26 -4.93 113.70 111.80 3g1f s SER 175 Ca 0.02 0.84 -0.12 0.00 1.31 0.00 0.00 55.95 58.00 3g1f s SER 175 Cb 0.09 -2.21 -0.07 0.00 0.21 0.00 0.00 66.02 64.04 3g1f s SER 175 CO 0.69 -0.52 0.58 0.12 0.41 0.00 0.00 173.24 174.52 3g1f s PHE 176 N -2.65 3.47 -0.13 2.43 5.36 0.35 -4.98 117.98 121.83 3g1f s PHE 176 Ca 0.46 0.99 -0.09 0.00 -0.96 0.00 0.00 56.93 57.33 3g1f s PHE 176 Cb -0.10 -2.34 0.04 0.00 -0.34 0.00 0.00 43.02 40.28 3g1f s PHE 176 CO 0.43 0.29 0.33 -1.17 -1.46 0.00 0.00 175.22 173.64 3g1f s LEU 177 N -2.57 0.43 0.01 6.12 2.96 -1.26 -1.19 118.68 123.19 3g1f s LEU 177 Ca 0.45 0.70 0.03 0.00 -0.22 0.00 0.00 54.13 55.09 3g1f s LEU 177 Cb -0.12 1.10 -0.01 0.00 0.50 0.00 0.00 46.19 47.66 3g1f s LEU 177 CO 0.20 -0.15 -0.08 0.27 -1.32 0.00 0.00 176.35 175.27 3g1f s ILE 178 N 0.76 0.65 -0.11 6.68 -4.36 -0.93 -0.87 121.20 123.03 3g1f s ILE 178 Ca -0.05 -0.56 0.01 0.00 -0.26 0.00 0.00 60.65 59.80 3g1f s ILE 178 Cb -0.06 -0.59 0.02 0.00 1.25 0.00 0.00 42.46 43.08 3g1f s ILE 178 CO -0.05 0.04 -0.13 -0.44 0.24 0.00 0.00 174.94 174.59 3g1f s SER 179 N -0.57 2.32 0.42 4.36 0.01 -0.74 -1.06 113.70 118.44 3g1f s SER 179 Ca 0.00 -0.40 0.07 0.00 1.31 0.00 0.00 55.95 56.93 3g1f s SER 179 Cb -0.05 -1.02 0.01 0.00 0.21 0.00 0.00 66.02 65.17 3g1f s SER 179 CO 0.00 -0.01 0.58 -2.16 0.41 0.00 0.00 173.24 172.06 3g1f s PRO 180 N 1.10 2.85 0.00 12.44 0.04 -1.24 0.13 135.00 150.33 3g1f s PRO 180 Ca -0.05 -1.11 0.00 0.00 0.04 0.00 0.00 61.00 59.88 3g1f s PRO 180 Cb -0.14 -2.73 0.00 0.00 0.04 0.00 0.00 34.50 31.67 3g1f s PRO 180 CO -0.03 -0.27 0.00 0.41 0.04 0.00 0.00 177.00 177.15 3g1f n GLY 181 N -1.89 0.85 3.74 0.56 0.00 -1.22 -2.30 105.19 104.95 3g1f n GLY 181 Ca 0.06 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.69 3g1f n GLY 181 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3g1f s VAL 182 N -2.00 4.97 0.00 1.61 1.01 -1.25 0.43 120.40 125.17 3g1f s VAL 182 Ca 0.00 1.30 0.00 0.00 0.00 0.00 0.00 61.98 63.28 3g1f s VAL 182 Cb 0.00 -3.96 0.00 0.00 0.00 0.00 0.00 36.38 32.42 3g1f s VAL 182 CO 0.00 0.35 0.00 0.61 0.00 0.00 0.00 175.10 176.06 3g1f n GLY 183 N 2.73 1.36 1.92 4.51 0.00 -1.22 -4.62 105.19 109.88 3g1f n GLY 183 Ca -0.05 -0.77 -0.18 0.00 0.00 0.00 0.00 46.02 45.02 3g1f n GLY 183 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3g1f n ALA 184 N 0.15 4.87 0.00 4.61 0.00 -1.26 -4.12 120.51 124.75 3g1f n ALA 184 Ca 0.00 -2.18 0.00 0.00 0.00 0.00 0.00 53.44 51.26 3g1f n ALA 184 Cb 0.00 -1.35 0.00 0.00 0.00 0.00 0.00 19.45 18.10 3g1f n ALA 184 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 3g1f n GLN 185 N -0.69 3.88 0.00 0.00 6.02 -1.25 -5.05 117.38 120.28 3g1f n GLN 185 Ca 0.45 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.44 3g1f n GLN 185 Cb 1.32 -0.43 0.00 0.00 1.02 0.00 0.00 30.24 32.15 3g1f n GLN 185 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3g1f n GLY 186 N 0.09 3.36 3.27 1.08 0.00 -1.10 -5.00 105.19 106.90 3g1f n GLY 186 Ca 0.00 -0.67 -0.38 0.00 0.00 0.00 0.00 46.02 44.97 3g1f n GLY 186 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3g1f n GLY 187 N 0.00 -2.96 3.12 -0.02 0.00 0.17 -4.75 105.19 100.75 3g1f n GLY 187 Ca 0.00 -0.27 -0.32 0.00 0.00 0.00 0.00 46.02 45.43 3g1f n GLY 187 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3g1f s ASP 188 N -1.07 3.01 0.00 1.61 2.15 -1.26 -3.42 116.67 117.69 3g1f s ASP 188 Ca 0.58 -0.60 0.00 0.00 0.43 0.00 0.00 52.55 52.96 3g1f s ASP 188 Cb -0.44 -1.40 0.00 0.00 -0.30 0.00 0.00 42.92 40.78 3g1f s ASP 188 CO 0.65 0.02 0.92 -2.65 -0.17 0.00 0.00 175.17 173.94 3g1f n PRO 189 N 4.43 0.00 -0.14 4.34 -0.02 -1.26 -2.06 135.00 140.29 3g1f n PRO 189 Ca -0.20 0.71 -0.05 0.00 -2.02 0.00 0.00 63.50 61.94 3g1f n PRO 189 Cb 0.51 -1.42 -0.04 0.00 -0.02 0.00 0.00 33.50 32.53 3g1f n PRO 189 CO 0.00 0.00 0.00 0.78 1.98 0.00 0.00 175.50 178.26 3g1f h GLY 190 N 0.00 -1.86 0.65 -1.23 0.00 -1.98 -0.35 103.07 98.31 3g1f h GLY 190 Ca 0.00 0.96 0.04 0.00 0.00 0.00 0.00 47.33 48.32 3g1f h GLY 190 CO 0.00 -0.57 -0.00 0.83 0.00 0.00 0.00 176.54 176.79 3g1f h GLU 191 N -0.05 0.06 -0.75 4.80 4.39 -1.96 -2.21 114.58 118.86 3g1f h GLU 191 Ca 0.05 -0.00 0.11 0.00 0.34 0.00 0.00 59.36 59.86 3g1f h GLU 191 Cb 0.19 -0.01 -0.08 0.00 -0.10 0.00 0.00 28.75 28.74 3g1f h GLU 191 CO -0.34 0.04 0.36 1.15 -1.16 0.00 0.00 179.01 179.07 3g1f h THR 192 N 0.06 0.79 0.00 1.13 2.02 -1.16 0.17 112.91 115.92 3g1f h THR 192 Ca 0.10 -0.20 0.00 0.00 0.77 0.00 0.00 66.41 67.08 3g1f h THR 192 Cb 0.13 0.16 0.00 0.00 -1.74 0.00 0.00 68.15 66.70 3g1f h THR 192 CO -0.18 0.11 0.00 0.18 0.37 0.00 0.00 175.52 176.00 3g1f n LEU 193 N -4.89 0.43 -0.26 2.58 4.77 -0.16 -1.07 117.00 118.40 3g1f n LEU 193 Ca 0.13 0.70 -0.06 0.00 -0.03 0.00 0.00 56.01 56.74 3g1f n LEU 193 Cb 0.33 -0.74 0.05 0.00 -2.33 0.00 0.00 43.42 40.73 3g1f n LEU 193 CO 0.23 -0.82 1.04 -0.09 -1.33 0.00 0.00 177.39 176.41 3g1f h ARG 194 N 0.00 1.07 0.00 3.23 2.43 -0.49 -3.30 114.38 117.32 3g1f h ARG 194 Ca 0.00 -0.19 -0.28 0.00 -0.81 0.00 0.00 59.98 58.71 3g1f h ARG 194 Cb 0.03 -0.18 -0.05 0.00 -0.42 0.00 0.00 29.97 29.35 3g1f h ARG 194 CO 0.00 0.87 -2.04 1.19 -1.51 0.00 0.00 179.97 178.48 3g1f n PHE 195 N -4.37 0.00 -3.58 2.20 3.01 -0.71 -5.01 117.46 109.01 3g1f n PHE 195 Ca 0.06 0.00 -0.36 0.00 1.01 0.00 0.00 57.45 58.16 3g1f n PHE 195 Cb 0.17 -0.75 -0.06 0.00 -0.01 0.00 0.00 39.48 38.83 3g1f n PHE 195 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 3g1f s ALA 196 N -2.37 3.73 0.32 4.37 0.00 -0.24 -4.93 121.76 122.65 3g1f s ALA 196 Ca -0.08 -0.35 0.08 0.00 0.00 0.00 0.00 51.96 51.61 3g1f s ALA 196 Cb 0.05 -2.28 0.53 0.00 0.00 0.00 0.00 23.12 21.42 3g1f s ALA 196 CO 0.62 0.54 1.74 -0.44 0.00 0.00 0.00 175.76 178.23 3g1f h ASP 197 N 4.17 0.21 -4.81 0.00 3.32 -1.29 -3.40 116.42 114.61 3g1f h ASP 197 Ca -0.50 -0.08 -0.01 0.00 0.02 0.00 0.00 57.03 56.46 3g1f h ASP 197 Cb 1.21 -0.06 -0.17 0.00 0.22 0.00 0.00 39.33 40.52 3g1f h ASP 197 CO 0.64 0.57 0.29 0.00 -1.72 0.00 0.00 179.24 179.02 3g1f s ALA 198 N -4.22 -1.76 0.25 3.45 0.00 -1.18 -4.69 121.76 113.61 3g1f s ALA 198 Ca -0.04 1.11 0.08 0.00 0.00 0.00 0.00 51.96 53.11 3g1f s ALA 198 Cb 0.14 0.17 -0.04 0.00 0.00 0.00 0.00 23.12 23.39 3g1f s ALA 198 CO 0.76 -0.50 0.06 0.96 0.00 0.00 0.00 175.76 177.04 3g1f s ILE 199 N -2.09 3.81 -0.27 0.00 -4.36 -0.59 -1.79 121.20 115.92 3g1f s ILE 199 Ca -0.04 -1.68 -0.04 0.00 -0.26 0.00 0.00 60.65 58.62 3g1f s ILE 199 Cb -0.00 -3.03 0.01 0.00 1.25 0.00 0.00 42.46 40.69 3g1f s ILE 199 CO 0.00 -0.33 0.01 -0.63 0.24 0.00 0.00 174.94 174.23 3g1f s ILE 200 N -2.18 3.47 -0.24 8.37 1.01 0.12 -0.91 121.20 130.83 3g1f s ILE 200 Ca 0.31 -0.79 -0.00 0.00 0.00 0.00 0.00 60.65 60.17 3g1f s ILE 200 Cb -0.07 -2.75 0.03 0.00 0.01 0.00 0.00 42.46 39.68 3g1f s ILE 200 CO 0.21 0.17 -0.09 -0.69 0.00 0.00 0.00 174.94 174.55 3g1f s VAL 201 N 1.43 2.59 0.00 2.92 1.01 -0.78 -3.37 120.40 124.21 3g1f s VAL 201 Ca 0.02 -1.17 0.00 0.00 0.00 0.00 0.00 61.98 60.83 3g1f s VAL 201 Cb -0.17 -2.34 0.00 0.00 0.00 0.00 0.00 36.38 33.88 3g1f s VAL 201 CO -0.01 0.18 0.00 0.61 0.00 0.00 0.00 175.10 175.88 3g1f n GLY 202 N 4.61 -0.00 0.37 4.51 0.00 -1.26 -2.44 105.19 110.97 3g1f n GLY 202 Ca -0.16 0.00 0.01 0.00 0.00 0.00 0.00 46.02 45.86 3g1f n GLY 202 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 3g1f h ARG 203 N 0.00 -0.02 -1.65 1.61 3.08 -1.94 0.13 114.38 115.59 3g1f h ARG 203 Ca 0.00 0.00 0.51 0.00 0.07 0.00 0.00 59.98 60.57 3g1f h ARG 203 Cb 0.00 0.00 -0.11 0.00 0.08 0.00 0.00 29.97 29.95 3g1f h ARG 203 CO 0.00 -0.01 1.13 0.77 -1.07 0.00 0.00 179.97 180.79 3g1f h SER 204 N -0.02 0.11 0.00 7.04 0.02 -1.88 0.64 113.55 119.46 3g1f h SER 204 Ca 0.38 0.08 -0.38 0.00 -0.84 0.00 0.00 61.79 61.02 3g1f h SER 204 Cb 0.63 0.08 -0.07 0.00 0.14 0.00 0.00 62.40 63.18 3g1f h SER 204 CO -0.95 -0.13 -2.41 -0.38 -1.14 0.00 0.00 176.83 171.82 3g1f n ILE 205 N -4.35 1.41 0.06 3.27 5.41 0.39 -4.13 119.36 121.43 3g1f n ILE 205 Ca 0.42 -0.50 -0.03 0.00 1.00 0.00 0.00 62.75 63.63 3g1f n ILE 205 Cb 1.75 -1.47 -0.08 0.00 -0.71 0.00 0.00 39.64 39.14 3g1f n ILE 205 CO 0.00 0.00 0.00 0.10 0.00 0.00 0.00 176.55 176.65 3g1f h TYR 206 N -0.19 0.00 0.00 1.39 -0.00 -0.65 -3.30 116.97 114.22 3g1f h TYR 206 Ca -0.57 0.00 -0.07 0.00 0.00 0.00 0.00 58.73 58.09 3g1f h TYR 206 Cb 1.79 0.00 -0.01 0.00 0.00 0.00 0.00 36.73 38.51 3g1f h TYR 206 CO 0.01 0.75 -0.32 -0.07 -0.00 0.00 0.00 178.16 178.53 3g1f h LEU 207 N 0.00 0.00 -9.89 0.10 3.38 0.03 -3.46 115.31 105.47 3g1f h LEU 207 Ca -0.10 0.00 -0.50 0.00 0.09 0.00 0.00 57.88 57.36 3g1f h LEU 207 Cb 1.67 0.00 0.22 0.00 0.09 0.00 0.00 40.66 42.63 3g1f h LEU 207 CO 0.08 0.32 -0.48 0.00 0.09 0.00 0.00 178.44 178.45 3g1f n ALA 208 N -2.19 -2.64 0.17 1.53 0.00 -1.22 -4.96 120.51 111.20 3g1f n ALA 208 Ca 0.02 -0.81 -0.07 0.00 0.00 0.00 0.00 53.44 52.59 3g1f n ALA 208 Cb 0.63 -1.83 -0.03 0.00 0.00 0.00 0.00 19.45 18.21 3g1f n ALA 208 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 3g1f h ASP 209 N -1.86 -0.37 -3.79 0.00 3.45 -1.89 -3.35 116.42 108.61 3g1f h ASP 209 Ca -0.47 0.01 -0.75 0.00 0.43 0.00 0.00 57.03 56.25 3g1f h ASP 209 Cb 1.30 0.10 -0.30 0.00 -0.56 0.00 0.00 39.33 39.86 3g1f h ASP 209 CO 0.38 -0.23 0.01 0.21 -1.57 0.00 0.00 179.24 178.03 3g1f s ASN 210 N -3.00 6.32 0.23 6.45 2.47 -1.26 -4.93 114.94 121.23 3g1f s ASN 210 Ca -0.06 -3.09 -0.09 0.00 0.42 0.00 0.00 52.86 50.04 3g1f s ASN 210 Cb 0.01 -2.06 0.37 0.00 -1.45 0.00 0.00 41.25 38.11 3g1f s ASN 210 CO 0.19 -0.39 1.65 -0.65 -3.72 0.00 0.00 177.10 174.18 3g1f h PRO 211 N 7.05 0.11 -1.06 0.43 0.11 -1.73 0.17 132.00 137.08 3g1f h PRO 211 Ca 0.10 -0.01 0.31 0.00 0.11 0.00 0.00 66.00 66.51 3g1f h PRO 211 Cb 0.95 -0.02 -0.04 0.00 0.11 0.00 0.00 31.00 31.99 3g1f h PRO 211 CO 0.81 0.07 0.78 0.00 -0.21 0.00 0.00 178.00 179.44 3g1f h ALA 212 N 1.64 3.00 0.28 -0.75 0.00 -1.84 -1.63 119.26 119.96 3g1f h ALA 212 Ca 0.37 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 55.23 3g1f h ALA 212 Cb 0.63 0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.50 3g1f h ALA 212 CO -0.60 -1.32 -0.13 0.00 0.00 0.00 0.00 179.25 177.19 3g1f h ALA 213 N 1.45 -0.56 -0.94 0.00 0.00 -1.03 -3.32 119.26 114.86 3g1f h ALA 213 Ca 0.50 -0.08 0.24 0.00 0.00 0.00 0.00 54.91 55.58 3g1f h ALA 213 Cb 2.05 0.14 -0.13 0.00 0.00 0.00 0.00 17.79 19.86 3g1f h ALA 213 CO -0.01 -0.53 0.47 0.00 0.00 0.00 0.00 179.25 179.19 3g1f h ALA 214 N -1.50 1.61 0.00 0.00 0.00 -1.33 0.51 119.26 118.55 3g1f h ALA 214 Ca -0.04 0.16 0.00 0.00 0.00 0.00 0.00 54.91 55.03 3g1f h ALA 214 Cb 0.29 0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.20 3g1f h ALA 214 CO 0.06 -0.36 0.00 0.00 0.00 0.00 0.00 179.25 178.95 3g1f n ALA 215 N -2.42 1.54 0.00 0.00 0.00 -0.68 -1.39 120.51 117.56 3g1f n ALA 215 Ca 0.25 -0.01 0.00 0.00 0.00 0.00 0.00 53.44 53.68 3g1f n ALA 215 Cb 0.74 -1.01 0.00 0.00 0.00 0.00 0.00 19.45 19.17 3g1f n ALA 215 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3g1f n ALA 216 N -0.93 1.76 -0.35 0.00 0.00 0.17 -4.53 120.51 116.63 3g1f n ALA 216 Ca 0.01 0.00 -0.03 0.00 0.00 0.00 0.00 53.44 53.42 3g1f n ALA 216 Cb 0.00 0.21 0.11 0.00 0.00 0.00 0.00 19.45 19.77 3g1f n ALA 216 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 3g1f h GLY 217 N 0.00 1.37 1.12 0.00 0.00 0.06 -1.41 103.07 104.20 3g1f h GLY 217 Ca 0.00 -0.56 -0.10 0.00 0.00 0.00 0.00 47.33 46.66 3g1f h GLY 217 CO 0.00 0.55 -0.03 -2.22 0.00 0.00 0.00 176.54 174.84 3g1f h ILE 218 N 1.30 1.27 -0.09 2.60 2.04 -1.60 -1.65 117.51 121.39 3g1f h ILE 218 Ca 0.34 -1.18 0.03 0.00 1.00 0.00 0.00 64.86 65.04 3g1f h ILE 218 Cb -0.07 0.84 -0.00 0.00 -0.74 0.00 0.00 36.82 36.85 3g1f h ILE 218 CO -0.06 0.43 0.17 0.40 0.00 0.00 0.00 178.15 179.08 3g1f h ILE 219 N 0.95 0.24 0.04 -0.67 1.08 -1.51 -0.42 117.51 117.23 3g1f h ILE 219 Ca 0.16 0.00 -0.00 0.00 -0.39 0.00 0.00 64.86 64.63 3g1f h ILE 219 Cb 0.59 0.85 0.00 0.00 -3.07 0.00 0.00 36.82 35.19 3g1f h ILE 219 CO 0.04 0.00 -0.02 -0.33 -0.69 0.00 0.00 178.15 177.14 3g1f h GLU 220 N 0.00 -0.06 -1.94 2.37 4.39 -0.81 0.11 114.58 118.64 3g1f h GLU 220 Ca 0.04 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.75 3g1f h GLU 220 Cb 0.38 0.01 0.00 0.00 -0.10 0.00 0.00 28.75 29.04 3g1f h GLU 220 CO -0.00 0.55 0.00 -1.13 -1.16 0.00 0.00 179.01 177.27 3g1f n SER 221 N -4.81 3.62 0.00 1.42 3.41 -0.17 -0.45 113.62 116.64 3g1f n SER 221 Ca -0.09 -1.94 0.00 0.00 -0.26 0.00 0.00 58.87 56.58 3g1f n SER 221 Cb 0.31 -0.76 0.00 0.00 -0.26 0.00 0.00 64.21 63.51 3g1f n SER 221 CO 0.00 0.00 0.00 -0.38 -0.16 0.00 0.00 175.04 174.50 3g1f n ILE 222 N 1.56 0.00 -0.23 -1.33 5.41 -1.18 -3.95 119.36 119.63 3g1f n ILE 222 Ca 0.00 0.00 -0.06 0.00 1.00 0.00 0.00 62.75 63.69 3g1f n ILE 222 Cb 0.35 0.00 -0.06 0.00 -0.71 0.00 0.00 39.64 39.23 3g1f n ILE 222 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 176.55 176.84 3g1f n LYS 223 N 0.00 -0.25 -0.23 0.38 4.76 0.40 0.17 118.16 123.39 3g1f n LYS 223 Ca 0.00 0.92 0.00 0.00 -2.87 0.00 0.00 58.31 56.36 3g1f n LYS 223 Cb 0.00 -1.36 0.00 0.00 -1.84 0.00 0.00 35.03 31.83 3g1f n LYS 223 CO 0.00 0.00 0.00 -0.40 -1.37 0.00 0.00 177.40 175.63 3g1f n ASP 224 N -4.52 3.45 0.00 4.39 5.75 -1.26 -5.08 116.55 119.27 3g1f n ASP 224 Ca 0.01 -1.89 0.00 0.00 -0.01 0.00 0.00 54.79 52.90 3g1f n ASP 224 Cb 0.14 -0.68 0.00 0.00 -1.03 0.00 0.00 41.12 39.55 3g1f n ASP 224 CO 0.00 0.00 0.00 0.18 -0.11 0.00 0.00 177.20 177.27