#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3g7y h ILE 10 N 0.00 1.22 -0.21 0.53 2.04 -2.03 -2.86 117.51 116.20 3g7y h ILE 10 Ca 0.00 -0.72 0.06 0.00 1.00 0.00 0.00 64.86 65.20 3g7y h ILE 10 Cb 0.00 1.23 -0.01 0.00 -0.74 0.00 0.00 36.82 37.30 3g7y h ILE 10 CO 0.00 0.23 0.19 -0.07 0.00 0.00 0.00 178.15 178.50 3g7y h LEU 11 N 0.21 0.00 -0.14 1.44 4.07 -2.02 -0.98 115.31 117.88 3g7y h LEU 11 Ca 0.07 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.03 3g7y h LEU 11 Cb 0.30 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.04 3g7y h LEU 11 CO 0.00 0.00 -0.07 1.67 -1.08 0.00 0.00 178.44 178.97 3g7y n GLN 12 N -4.05 0.63 0.04 1.13 -0.06 -1.08 -3.18 117.38 110.80 3g7y n GLN 12 Ca 0.02 -0.14 0.11 0.00 -2.00 0.00 0.00 57.00 54.99 3g7y n GLN 12 Cb 0.32 -1.50 0.47 0.00 -4.06 0.00 0.00 30.24 25.47 3g7y n GLN 12 CO 0.00 0.00 0.00 1.28 -0.20 0.00 0.00 177.06 178.14 3g7y n LEU 13 N -1.06 0.23 -4.70 1.69 4.77 -0.37 -4.82 117.00 112.74 3g7y n LEU 13 Ca 0.15 0.54 -0.42 0.00 -0.03 0.00 0.00 56.01 56.25 3g7y n LEU 13 Cb 0.25 -0.48 -0.03 0.00 -2.33 0.00 0.00 43.42 40.83 3g7y n LEU 13 CO 0.23 -0.19 1.36 -0.54 -1.33 0.00 0.00 177.39 176.92 3g7y s LYS 14 N -3.06 4.16 0.09 3.23 1.02 -1.19 -4.59 119.74 119.40 3g7y s LYS 14 Ca 0.10 2.49 -0.02 0.00 0.02 0.00 0.00 55.97 58.56 3g7y s LYS 14 Cb 0.13 -3.36 0.02 0.00 -0.52 0.00 0.00 37.83 34.11 3g7y s LYS 14 CO 0.44 -0.74 0.10 -0.40 -0.92 0.00 0.00 175.35 173.82 3g7y n ASP 15 N 4.84 -0.64 0.10 2.83 5.68 -0.68 -4.76 116.55 123.92 3g7y n ASP 15 Ca 0.16 -0.75 0.10 0.00 -0.50 0.00 0.00 54.79 53.79 3g7y n ASP 15 Cb 0.38 -0.08 0.43 0.00 -1.14 0.00 0.00 41.12 40.70 3g7y n ASP 15 CO 0.00 0.00 0.00 -0.90 -1.33 0.00 0.00 177.20 174.97 3g7y n ASP 16 N -3.12 0.45 -0.45 -1.12 5.68 -1.26 -0.91 116.55 115.82 3g7y n ASP 16 Ca 0.01 0.63 0.13 0.00 -0.50 0.00 0.00 54.79 55.06 3g7y n ASP 16 Cb 0.05 -0.72 0.31 0.00 -1.14 0.00 0.00 41.12 39.62 3g7y n ASP 16 CO 0.00 0.00 0.00 0.35 -1.33 0.00 0.00 177.20 176.22 3g7y n THR 17 N -2.01 0.00 -1.00 2.12 -2.24 -1.26 -4.93 114.28 104.95 3g7y n THR 17 Ca 0.02 -0.23 0.00 0.00 -2.27 0.00 0.00 64.05 61.56 3g7y n THR 17 Cb 0.17 0.73 0.00 0.00 -2.10 0.00 0.00 70.33 69.13 3g7y n THR 17 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3g7y n GLY 18 N 1.31 0.40 3.43 3.38 0.00 -0.09 -4.75 105.19 108.87 3g7y n GLY 18 Ca 0.14 -0.93 -0.33 0.00 0.00 0.00 0.00 46.02 44.91 3g7y n GLY 18 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3g7y s VAL 19 N -2.00 2.91 -0.22 1.61 1.01 -1.26 -4.54 120.40 117.92 3g7y s VAL 19 Ca 0.00 -0.76 -0.10 0.00 0.00 0.00 0.00 61.98 61.12 3g7y s VAL 19 Cb 0.00 -2.14 -0.05 0.00 0.00 0.00 0.00 36.38 34.19 3g7y s VAL 19 CO 0.00 0.58 0.14 -0.63 0.00 0.00 0.00 175.10 175.18 3g7y s ILE 20 N -0.46 5.30 -0.18 2.22 1.01 0.41 -1.68 121.20 127.83 3g7y s ILE 20 Ca 0.06 0.16 -0.23 0.00 0.00 0.00 0.00 60.65 60.64 3g7y s ILE 20 Cb -0.12 -3.45 -0.02 0.00 0.01 0.00 0.00 42.46 38.88 3g7y s ILE 20 CO 0.02 0.39 0.71 -0.89 0.00 0.00 0.00 174.94 175.16 3g7y s THR 21 N 0.75 4.97 0.21 2.92 2.01 -1.26 -0.91 115.64 124.33 3g7y s THR 21 Ca 0.07 1.36 -0.30 0.00 0.31 0.00 0.00 61.69 63.14 3g7y s THR 21 Cb -0.12 -4.02 -0.08 0.00 0.01 0.00 0.00 72.50 68.28 3g7y s THR 21 CO 0.02 0.09 1.10 -0.69 -0.69 0.00 0.00 174.62 174.45 3g7y s VAL 22 N 1.89 3.74 0.40 3.82 1.01 -0.08 -4.93 120.40 126.26 3g7y s VAL 22 Ca 0.33 1.58 0.04 0.00 0.00 0.00 0.00 61.98 63.92 3g7y s VAL 22 Cb -0.16 -4.01 -0.04 0.00 0.00 0.00 0.00 36.38 32.17 3g7y s VAL 22 CO 0.12 0.31 0.06 0.42 0.00 0.00 0.00 175.10 176.00 3g7y s THR 23 N -0.53 1.17 0.17 3.92 -4.23 -1.26 -4.71 115.64 110.17 3g7y s THR 23 Ca 0.48 -2.00 0.28 0.00 -1.18 0.00 0.00 61.69 59.27 3g7y s THR 23 Cb -0.30 -2.57 0.30 0.00 1.34 0.00 0.00 72.50 71.27 3g7y s THR 23 CO 0.37 0.00 1.93 0.00 -0.54 0.00 0.00 174.62 176.37 3g7y h ALA 24 N 1.79 1.05 0.08 3.99 0.00 -1.96 -2.27 119.26 121.94 3g7y h ALA 24 Ca -0.41 -0.12 -0.17 0.00 0.00 0.00 0.00 54.91 54.22 3g7y h ALA 24 Cb 1.27 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.04 3g7y h ALA 24 CO 0.69 0.16 -0.83 0.22 0.00 0.00 0.00 179.25 179.49 3g7y h ASP 25 N 0.00 0.27 0.26 0.00 3.58 -1.95 -3.37 116.42 115.22 3g7y h ASP 25 Ca -0.00 -0.89 0.00 0.00 0.42 0.00 0.00 57.03 56.56 3g7y h ASP 25 Cb 0.59 -0.09 0.00 0.00 1.72 0.00 0.00 39.33 41.56 3g7y h ASP 25 CO 0.02 1.37 -0.31 -0.46 -2.88 0.00 0.00 179.24 176.97 3g7y n ASN 26 N -4.22 0.98 -0.04 2.28 0.23 -1.22 -4.38 115.26 108.88 3g7y n ASN 26 Ca -0.18 -0.82 -0.11 0.00 -0.53 0.00 0.00 54.58 52.94 3g7y n ASN 26 Cb 0.74 0.18 -0.05 0.00 -2.08 0.00 0.00 39.78 38.58 3g7y n ASN 26 CO 0.00 0.00 0.00 0.22 -0.93 0.00 0.00 177.26 176.55 3g7y h TYR 27 N 1.05 0.25 -0.95 -2.53 3.20 -1.56 -0.70 116.97 115.73 3g7y h TYR 27 Ca 0.00 -0.01 0.17 0.00 3.14 0.00 0.00 58.73 62.03 3g7y h TYR 27 Cb 0.52 -0.08 -0.08 0.00 1.54 0.00 0.00 36.73 38.63 3g7y h TYR 27 CO 0.00 0.27 0.60 -1.35 -1.64 0.00 0.00 178.16 176.05 3g7y h PRO 28 N 0.15 0.66 0.09 1.82 0.11 -1.82 0.12 132.00 133.12 3g7y h PRO 28 Ca 0.06 -0.04 -0.00 0.00 0.11 0.00 0.00 66.00 66.12 3g7y h PRO 28 Cb 0.12 -0.15 0.00 0.00 0.11 0.00 0.00 31.00 31.08 3g7y h PRO 28 CO -0.01 0.43 -0.04 1.25 -0.21 0.00 0.00 178.00 179.42 3g7y h LEU 29 N 0.68 -0.10 -1.24 2.35 5.85 -1.76 -3.32 115.31 117.76 3g7y h LEU 29 Ca 0.51 -0.49 0.03 0.00 0.84 0.00 0.00 57.88 58.77 3g7y h LEU 29 Cb 0.89 0.03 -0.04 0.00 0.37 0.00 0.00 40.66 41.90 3g7y h LEU 29 CO -0.27 0.51 0.52 -0.07 -0.34 0.00 0.00 178.44 178.80 3g7y h LEU 30 N -0.80 0.85 -0.64 2.25 3.38 -0.67 -1.19 115.31 118.50 3g7y h LEU 30 Ca -0.01 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.95 3g7y h LEU 30 Cb 0.59 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 41.14 3g7y h LEU 30 CO 0.02 0.59 0.00 -1.54 0.09 0.00 0.00 178.44 177.60 3g7y n SER 31 N -4.45 0.43 -0.23 -0.43 3.41 0.36 -1.06 113.62 111.65 3g7y n SER 31 Ca 0.10 0.63 0.14 0.00 -0.26 0.00 0.00 58.87 59.49 3g7y n SER 31 Cb 0.11 -0.71 0.56 0.00 -0.26 0.00 0.00 64.21 63.90 3g7y n SER 31 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 3g7y n ARG 32 N -2.00 1.00 -0.84 4.33 3.00 -0.45 -1.25 116.66 120.44 3g7y n ARG 32 Ca 0.01 -0.46 0.11 0.00 -0.01 0.00 0.00 57.85 57.51 3g7y n ARG 32 Cb 0.15 -1.49 -0.03 0.00 0.00 0.00 0.00 32.46 31.09 3g7y n ARG 32 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 3g7y n GLY 33 N 1.24 -1.70 2.94 -0.13 0.00 -0.23 -4.80 105.19 102.51 3g7y n GLY 33 Ca 0.16 -1.31 -0.26 0.00 0.00 0.00 0.00 46.02 44.60 3g7y n GLY 33 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3g7y s VAL 34 N -1.81 1.08 -0.11 1.61 1.01 -1.26 -4.93 120.40 115.99 3g7y s VAL 34 Ca 0.00 -0.35 -0.39 0.00 0.00 0.00 0.00 61.98 61.25 3g7y s VAL 34 Cb 0.00 -1.07 -0.16 0.00 0.00 0.00 0.00 36.38 35.15 3g7y s VAL 34 CO 0.00 0.37 1.54 -2.65 0.00 0.00 0.00 175.10 174.36 3g7y n PRO 35 N 4.68 1.11 0.00 2.72 -0.02 -1.26 -0.70 135.00 141.54 3g7y n PRO 35 Ca -0.15 0.40 0.00 0.00 -2.02 0.00 0.00 63.50 61.73 3g7y n PRO 35 Cb 0.50 -2.06 0.00 0.00 -0.02 0.00 0.00 33.50 31.92 3g7y n PRO 35 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3g7y n GLY 36 N 3.36 2.95 3.78 -1.23 0.00 -1.26 -5.02 105.19 107.76 3g7y n GLY 36 Ca 0.23 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.87 3g7y n GLY 36 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3g7y s TYR 37 N -1.85 3.61 0.45 1.61 1.51 0.13 -4.72 117.35 118.08 3g7y s TYR 37 Ca 0.00 0.89 -0.23 0.00 -1.01 0.00 0.00 57.07 56.72 3g7y s TYR 37 Cb 0.00 -2.39 -0.08 0.00 -0.11 0.00 0.00 41.96 39.38 3g7y s TYR 37 CO 0.00 0.40 1.15 -0.06 -1.11 0.00 0.00 175.55 175.93 3g7y s PHE 38 N -0.20 2.93 -0.24 2.71 0.40 0.07 -3.59 117.98 120.07 3g7y s PHE 38 Ca 0.23 1.55 -0.04 0.00 -0.60 0.00 0.00 56.93 58.07 3g7y s PHE 38 Cb -0.15 -3.34 0.00 0.00 0.51 0.00 0.00 43.02 40.04 3g7y s PHE 38 CO 0.11 -1.38 -0.02 -0.80 0.70 0.00 0.00 175.22 173.83 3g7y s ASN 39 N -1.39 4.46 -0.32 1.36 0.02 0.49 -0.82 114.94 118.74 3g7y s ASN 39 Ca 0.63 -0.56 -0.13 0.00 -1.02 0.00 0.00 52.86 51.77 3g7y s ASN 39 Cb -0.28 -1.75 -0.02 0.00 0.02 0.00 0.00 41.25 39.22 3g7y s ASN 39 CO 0.34 -0.08 0.28 -0.63 0.02 0.00 0.00 177.10 177.03 3g7y s ILE 40 N 1.45 5.24 -0.28 0.60 1.09 0.68 0.43 121.20 130.41 3g7y s ILE 40 Ca 0.04 0.01 -0.00 0.00 -1.10 0.00 0.00 60.65 59.60 3g7y s ILE 40 Cb -0.15 -3.71 0.05 0.00 -1.06 0.00 0.00 42.46 37.59 3g7y s ILE 40 CO -0.02 0.03 -0.04 -0.22 -0.10 0.00 0.00 174.94 174.58 3g7y s LEU 41 N 1.85 3.68 -0.32 2.97 2.96 0.36 0.34 118.68 130.52 3g7y s LEU 41 Ca 0.09 -1.26 -0.22 0.00 -0.22 0.00 0.00 54.13 52.52 3g7y s LEU 41 Cb -0.17 -1.66 -0.00 0.00 0.50 0.00 0.00 46.19 44.86 3g7y s LEU 41 CO 0.11 -0.22 0.72 -0.47 -1.32 0.00 0.00 176.35 175.17 3g7y s TYR 42 N 1.22 3.18 -0.32 5.38 5.04 -0.25 -1.55 117.35 130.05 3g7y s TYR 42 Ca -0.06 0.64 -0.11 0.00 -2.44 0.00 0.00 57.07 55.10 3g7y s TYR 42 Cb -0.19 -3.17 -0.01 0.00 0.35 0.00 0.00 41.96 38.93 3g7y s TYR 42 CO -0.03 -0.58 0.20 0.42 -1.34 0.00 0.00 175.55 174.22 3g7y s ILE 43 N 2.85 4.96 0.02 3.14 1.01 0.11 -0.62 121.20 132.66 3g7y s ILE 43 Ca 0.29 -0.30 0.00 0.00 0.00 0.00 0.00 60.65 60.65 3g7y s ILE 43 Cb -0.14 -3.53 -0.00 0.00 0.01 0.00 0.00 42.46 38.80 3g7y s ILE 43 CO 0.13 0.04 0.02 1.07 0.00 0.00 0.00 174.94 176.20 3g7y n THR 44 N 5.04 0.00 -3.23 2.92 5.66 0.55 -0.88 114.28 124.35 3g7y n THR 44 Ca -0.13 -0.13 -0.01 0.00 -3.05 0.00 0.00 64.05 60.72 3g7y n THR 44 Cb 0.50 0.07 -0.04 0.00 -1.55 0.00 0.00 70.33 69.31 3g7y n THR 44 CO 0.00 0.00 0.00 -0.32 -3.05 0.00 0.00 175.07 171.70 3g7y s MET 45 N -2.07 0.48 0.05 1.09 1.75 -1.26 -0.89 119.30 118.46 3g7y s MET 45 Ca 0.02 0.71 0.18 0.00 -1.25 0.00 0.00 55.69 55.36 3g7y s MET 45 Cb 0.00 0.11 -0.14 0.00 2.84 0.00 0.00 34.83 37.64 3g7y s MET 45 CO 0.02 -0.72 0.76 0.54 -0.65 0.00 0.00 175.02 174.96 3g7y n ARG 46 N 5.40 0.63 0.00 4.11 1.74 -1.26 -4.56 116.66 122.72 3g7y n ARG 46 Ca -0.01 0.14 0.00 0.00 -0.77 0.00 0.00 57.85 57.21 3g7y n ARG 46 Cb 0.51 -1.76 0.00 0.00 -1.02 0.00 0.00 32.46 30.19 3g7y n ARG 46 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3g7y n GLY 47 N 1.38 0.95 3.94 -0.13 0.00 -1.26 -4.90 105.19 105.16 3g7y n GLY 47 Ca -0.10 -1.74 -0.24 0.00 0.00 0.00 0.00 46.02 43.94 3g7y n GLY 47 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3g7y s THR 48 N 1.15 4.99 0.23 2.61 -4.23 -1.26 -4.34 115.64 114.79 3g7y s THR 48 Ca 0.00 -0.36 -0.04 0.00 -1.18 0.00 0.00 61.69 60.11 3g7y s THR 48 Cb 0.00 -3.83 0.05 0.00 1.34 0.00 0.00 72.50 70.06 3g7y s THR 48 CO 0.00 -0.59 0.29 -0.46 -0.54 0.00 0.00 174.62 173.32 3g7y n ASN 49 N -1.88 -0.19 0.08 3.99 0.23 -0.01 -4.86 115.26 112.62 3g7y n ASN 49 Ca -0.03 -1.03 0.03 0.00 -0.53 0.00 0.00 54.58 53.02 3g7y n ASN 49 Cb 0.56 -0.23 0.42 0.00 -2.08 0.00 0.00 39.78 38.45 3g7y n ASN 49 CO 0.00 0.00 0.00 -1.28 -0.93 0.00 0.00 177.26 175.05 3g7y h SER 50 N -0.56 0.32 0.00 0.53 0.87 -2.00 -1.66 113.55 111.05 3g7y h SER 50 Ca -0.10 -0.04 0.00 0.00 -1.23 0.00 0.00 61.79 60.43 3g7y h SER 50 Cb 0.27 -0.08 0.00 0.00 -0.44 0.00 0.00 62.40 62.15 3g7y h SER 50 CO 0.07 0.34 0.00 0.59 -0.53 0.00 0.00 176.83 177.30 3g7y n ASN 51 N -4.38 0.00 -0.05 6.23 5.03 -1.26 -4.86 115.26 115.97 3g7y n ASN 51 Ca 0.01 -1.20 -0.01 0.00 0.87 0.00 0.00 54.58 54.25 3g7y n ASN 51 Cb 0.17 0.00 -0.00 0.00 -1.02 0.00 0.00 39.78 38.92 3g7y n ASN 51 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 3g7y n GLY 52 N 0.76 0.48 3.80 7.41 0.00 -0.63 -5.02 105.19 112.00 3g7y n GLY 52 Ca 0.16 -0.31 -0.36 0.00 0.00 0.00 0.00 46.02 45.51 3g7y n GLY 52 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3g7y s MET 53 N -0.82 3.84 1.05 1.61 -1.94 -1.26 -4.74 119.30 117.04 3g7y s MET 53 Ca 0.00 -0.15 -0.15 0.00 -1.71 0.00 0.00 55.69 53.68 3g7y s MET 53 Cb 0.00 -3.31 0.21 0.00 2.01 0.00 0.00 34.83 33.74 3g7y s MET 53 CO 0.00 0.53 1.12 0.45 -0.01 0.00 0.00 175.02 177.11 3g7y s SER 54 N -0.31 2.27 -0.44 3.03 0.15 -1.26 -0.83 113.70 116.31 3g7y s SER 54 Ca 0.12 0.89 0.03 0.00 0.70 0.00 0.00 55.95 57.69 3g7y s SER 54 Cb -0.12 -1.36 0.12 0.00 -1.71 0.00 0.00 66.02 62.95 3g7y s SER 54 CO 0.01 -3.32 0.18 0.00 1.20 0.00 0.00 173.24 171.32 3g7y h GLN 56 N 6.97 0.95 -0.25 0.00 5.75 -1.96 -2.35 115.11 124.23 3g7y h GLN 56 Ca -0.06 -0.12 -0.00 0.00 -0.15 0.00 0.00 58.65 58.31 3g7y h GLN 56 Cb 0.94 -0.18 -0.01 0.00 1.07 0.00 0.00 27.48 29.30 3g7y h GLN 56 CO 0.60 0.73 0.14 1.25 -2.65 0.00 0.00 178.83 178.89 3g7y h LEU 57 N 0.95 0.31 -0.06 -2.39 5.85 -1.97 -0.01 115.31 117.99 3g7y h LEU 57 Ca 0.24 -0.08 0.04 0.00 0.84 0.00 0.00 57.88 58.91 3g7y h LEU 57 Cb 0.08 -0.08 -0.05 0.00 0.37 0.00 0.00 40.66 40.98 3g7y h LEU 57 CO -0.03 0.30 -0.25 0.00 -0.34 0.00 0.00 178.44 178.12 3g7y h HIS 59 N -0.35 0.86 0.15 0.00 -0.00 -1.24 -1.65 115.15 112.92 3g7y h HIS 59 Ca 0.08 0.02 -0.01 0.00 -0.00 0.00 0.00 60.37 60.47 3g7y h HIS 59 Cb 0.47 -0.29 0.00 0.00 -0.00 0.00 0.00 27.41 27.59 3g7y h HIS 59 CO -0.32 0.51 -0.07 -0.44 -0.00 0.00 0.00 177.93 177.61 3g7y h ASP 60 N 0.91 -0.17 0.50 3.26 3.32 -0.60 -3.10 116.42 120.54 3g7y h ASP 60 Ca 0.28 -0.17 -0.06 0.00 0.02 0.00 0.00 57.03 57.10 3g7y h ASP 60 Cb -0.02 0.04 -0.01 0.00 0.22 0.00 0.00 39.33 39.56 3g7y h ASP 60 CO -0.09 0.08 -0.30 0.15 -1.72 0.00 0.00 179.24 177.35 3g7y h PHE 61 N -0.41 0.00 -0.75 4.55 3.57 -1.09 -2.87 116.94 119.94 3g7y h PHE 61 Ca -0.02 0.00 0.17 0.00 3.53 0.00 0.00 57.97 61.65 3g7y h PHE 61 Cb 0.33 0.00 -0.12 0.00 2.79 0.00 0.00 35.95 38.95 3g7y h PHE 61 CO -0.00 0.30 0.15 1.49 -2.23 0.00 0.00 178.31 178.03 3g7y h GLU 62 N 0.00 0.23 -0.18 1.11 4.57 -1.21 0.85 114.58 119.95 3g7y h GLU 62 Ca -0.00 -0.01 -0.15 0.00 -1.18 0.00 0.00 59.36 58.02 3g7y h GLU 62 Cb 0.64 -0.05 -0.01 0.00 -0.16 0.00 0.00 28.75 29.17 3g7y h GLU 62 CO 0.04 0.15 -0.50 0.87 -1.18 0.00 0.00 179.01 178.39 3g7y h LYS 63 N 0.23 0.49 -0.46 1.92 1.79 -1.58 -1.89 116.57 117.07 3g7y h LYS 63 Ca 0.43 -0.28 -0.09 0.00 -2.18 0.00 0.00 60.65 58.52 3g7y h LYS 63 Cb 0.75 0.02 -0.01 0.00 -1.58 0.00 0.00 32.23 31.41 3g7y h LYS 63 CO -0.55 0.88 -0.08 1.15 -1.08 0.00 0.00 179.45 179.77 3g7y h THR 64 N 0.38 1.27 0.02 -0.16 2.02 -1.03 -2.03 112.91 113.38 3g7y h THR 64 Ca 0.02 -1.19 0.03 0.00 0.77 0.00 0.00 66.41 66.04 3g7y h THR 64 Cb 1.01 1.10 -0.04 0.00 -1.74 0.00 0.00 68.15 68.48 3g7y h THR 64 CO 0.09 0.41 -0.24 0.22 0.37 0.00 0.00 175.52 176.37 3g7y h TYR 65 N 0.71 -0.63 -0.50 3.16 3.20 0.84 -2.16 116.97 121.58 3g7y h TYR 65 Ca 0.12 0.02 -0.08 0.00 3.14 0.00 0.00 58.73 61.93 3g7y h TYR 65 Cb 0.62 0.28 -0.02 0.00 1.54 0.00 0.00 36.73 39.14 3g7y h TYR 65 CO 0.05 -0.33 0.01 0.45 -1.64 0.00 0.00 178.16 176.70 3g7y h HIS 66 N -0.38 0.89 -0.23 -3.82 3.86 -1.30 -1.01 115.15 113.14 3g7y h HIS 66 Ca 0.05 -0.13 -0.01 0.00 -1.16 0.00 0.00 60.37 59.13 3g7y h HIS 66 Cb 0.45 -0.24 -0.01 0.00 1.06 0.00 0.00 27.41 28.67 3g7y h HIS 66 CO -0.26 0.81 0.11 0.00 0.86 0.00 0.00 177.93 179.45 3g7y h ALA 67 N 1.23 0.30 -0.37 2.45 0.00 -1.20 -0.03 119.26 121.64 3g7y h ALA 67 Ca 0.15 -0.08 -0.09 0.00 0.00 0.00 0.00 54.91 54.89 3g7y h ALA 67 Cb 0.46 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 3g7y h ALA 67 CO 0.02 -0.14 -0.12 0.28 0.00 0.00 0.00 179.25 179.28 3g7y h VAL 68 N 0.25 1.28 -0.41 0.00 2.07 -1.26 -1.35 116.25 116.84 3g7y h VAL 68 Ca 0.08 -1.22 0.08 0.00 0.82 0.00 0.00 66.70 66.47 3g7y h VAL 68 Cb 0.11 1.31 -0.09 0.00 -1.52 0.00 0.00 31.29 31.10 3g7y h VAL 68 CO -0.01 0.40 -0.26 0.00 0.02 0.00 0.00 177.57 177.73 3g7y h ALA 69 N 0.81 -0.02 -0.86 1.67 0.00 -1.05 -0.43 119.26 119.39 3g7y h ALA 69 Ca 0.09 0.13 0.02 0.00 0.00 0.00 0.00 54.91 55.14 3g7y h ALA 69 Cb 0.65 0.58 -0.04 0.00 0.00 0.00 0.00 17.79 18.98 3g7y h ALA 69 CO 0.04 -0.63 0.57 -0.44 0.00 0.00 0.00 179.25 178.79 3g7y h ASP 70 N -0.18 0.97 -0.01 0.00 3.32 -0.63 0.00 116.42 119.89 3g7y h ASP 70 Ca 0.19 -0.02 -0.00 0.00 0.02 0.00 0.00 57.03 57.22 3g7y h ASP 70 Cb 0.49 -0.24 -0.00 0.00 0.22 0.00 0.00 39.33 39.80 3g7y h ASP 70 CO -0.52 0.69 0.01 0.58 -1.72 0.00 0.00 179.24 178.28 3g7y h VAL 71 N 1.14 1.04 -0.72 -1.35 2.07 -0.62 -1.94 116.25 115.86 3g7y h VAL 71 Ca 0.32 -0.11 -0.05 0.00 0.82 0.00 0.00 66.70 67.69 3g7y h VAL 71 Cb -0.10 1.09 -0.03 0.00 -1.52 0.00 0.00 31.29 30.73 3g7y h VAL 71 CO -0.08 0.03 0.26 0.40 0.02 0.00 0.00 177.57 178.20 3g7y h ILE 72 N -0.03 1.25 -0.15 4.57 2.04 -0.59 0.49 117.51 125.08 3g7y h ILE 72 Ca 0.00 -0.82 -0.04 0.00 1.00 0.00 0.00 64.86 65.00 3g7y h ILE 72 Cb 0.04 0.41 -0.01 0.00 -0.74 0.00 0.00 36.82 36.52 3g7y h ILE 72 CO -0.00 0.33 -0.08 -0.09 0.00 0.00 0.00 178.15 178.31 3g7y h ARG 73 N 1.06 0.23 0.10 2.37 2.43 -0.82 0.78 114.38 120.53 3g7y h ARG 73 Ca 0.24 -0.04 -0.32 0.00 -0.81 0.00 0.00 59.98 59.04 3g7y h ARG 73 Cb 0.24 -0.04 -0.02 0.00 -0.42 0.00 0.00 29.97 29.74 3g7y h ARG 73 CO -0.02 0.33 -1.73 1.03 -1.51 0.00 0.00 179.97 178.07 3g7y h SER 74 N 0.23 0.32 -0.00 -3.80 0.87 -0.64 -3.35 113.55 107.17 3g7y h SER 74 Ca 0.05 -0.57 0.00 0.00 -1.23 0.00 0.00 61.79 60.04 3g7y h SER 74 Cb 0.29 -0.10 0.00 0.00 -0.44 0.00 0.00 62.40 62.15 3g7y h SER 74 CO 0.01 1.49 -0.82 0.00 -0.53 0.00 0.00 176.83 176.99 3g7y n GLN 75 N -3.37 1.02 -2.99 2.24 6.02 0.10 -4.54 117.38 115.86 3g7y n GLN 75 Ca -0.22 -0.09 -0.17 0.00 -0.01 0.00 0.00 57.00 56.51 3g7y n GLN 75 Cb 1.05 -1.36 -0.01 0.00 1.02 0.00 0.00 30.24 30.93 3g7y n GLN 75 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3g7y n ALA 76 N -1.30 2.85 -0.02 -1.58 0.00 0.26 -4.95 120.51 115.77 3g7y n ALA 76 Ca 0.04 -3.54 0.12 0.00 0.00 0.00 0.00 53.44 50.06 3g7y n ALA 76 Cb 0.30 -0.89 0.54 0.00 0.00 0.00 0.00 19.45 19.40 3g7y n ALA 76 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 3g7y h PRO 77 N 2.97 0.29 0.00 0.00 0.13 -1.71 -0.91 132.00 132.79 3g7y h PRO 77 Ca 0.06 -0.02 -0.06 0.00 -0.87 0.00 0.00 66.00 65.11 3g7y h PRO 77 Cb 0.96 -0.07 -0.01 0.00 0.13 0.00 0.00 31.00 32.02 3g7y h PRO 77 CO 0.56 0.19 -0.31 1.96 -0.23 0.00 0.00 178.00 180.18 3g7y h GLN 78 N 0.30 0.00 -6.36 0.86 1.08 -1.92 -3.46 115.11 105.60 3g7y h GLN 78 Ca 0.23 0.00 -0.64 0.00 -1.45 0.00 0.00 58.65 56.79 3g7y h GLN 78 Cb 0.51 0.00 0.05 0.00 -0.05 0.00 0.00 27.48 27.99 3g7y h GLN 78 CO -0.05 0.31 0.70 0.45 -0.95 0.00 0.00 178.83 179.29 3g7y n SER 79 N -3.34 2.51 -4.32 1.46 2.88 -0.35 -4.87 113.62 107.60 3g7y n SER 79 Ca 0.01 1.09 -0.43 0.00 -1.33 0.00 0.00 58.87 58.20 3g7y n SER 79 Cb 0.53 -1.31 0.00 0.00 -0.75 0.00 0.00 64.21 62.69 3g7y n SER 79 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 3g7y n LEU 80 N 3.54 5.56 -4.08 2.46 4.77 -1.26 -4.94 117.00 123.05 3g7y n LEU 80 Ca 0.19 -4.34 -0.14 0.00 -0.03 0.00 0.00 56.01 51.69 3g7y n LEU 80 Cb 0.24 -1.63 -0.11 0.00 -2.33 0.00 0.00 43.42 39.59 3g7y n LEU 80 CO 0.65 0.75 -0.41 0.54 -1.33 0.00 0.00 177.39 177.59 3g7y s ASN 81 N 2.81 0.97 -0.07 -1.43 2.20 -1.26 -0.75 114.94 117.41 3g7y s ASN 81 Ca 0.45 -0.58 0.02 0.00 -0.94 0.00 0.00 52.86 51.81 3g7y s ASN 81 Cb 0.03 0.03 0.01 0.00 -2.00 0.00 0.00 41.25 39.32 3g7y s ASN 81 CO 0.01 -0.20 -0.11 -0.76 -2.94 0.00 0.00 177.10 173.10 3g7y s LEU 82 N -1.68 1.58 -0.20 3.54 1.43 0.00 -4.90 118.68 118.45 3g7y s LEU 82 Ca -0.08 -0.28 -0.14 0.00 -1.03 0.00 0.00 54.13 52.60 3g7y s LEU 82 Cb -0.09 -0.79 -0.04 0.00 0.03 0.00 0.00 46.19 45.30 3g7y s LEU 82 CO 0.00 0.01 0.33 -0.36 0.23 0.00 0.00 176.35 176.57 3g7y s PHE 83 N 0.77 3.39 0.16 0.29 0.40 -1.26 -0.23 117.98 121.50 3g7y s PHE 83 Ca -0.13 0.55 0.10 0.00 -0.60 0.00 0.00 56.93 56.86 3g7y s PHE 83 Cb -0.15 -2.44 -0.04 0.00 0.51 0.00 0.00 43.02 40.90 3g7y s PHE 83 CO 0.02 0.07 -0.23 -0.06 0.70 0.00 0.00 175.22 175.72 3g7y s PHE 84 N 1.05 2.17 -0.04 0.36 0.08 0.15 -0.45 117.98 121.30 3g7y s PHE 84 Ca 0.17 -0.39 0.02 0.00 0.12 0.00 0.00 56.93 56.85 3g7y s PHE 84 Cb -0.14 -1.11 0.01 0.00 -0.57 0.00 0.00 43.02 41.21 3g7y s PHE 84 CO 0.06 0.40 -0.08 0.99 -0.10 0.00 0.00 175.22 176.49 3g7y s THR 85 N -1.53 0.80 -0.04 0.64 2.01 -0.09 -1.08 115.64 116.34 3g7y s THR 85 Ca 0.17 -0.32 0.04 0.00 0.31 0.00 0.00 61.69 61.90 3g7y s THR 85 Cb -0.08 -0.74 -0.00 0.00 0.01 0.00 0.00 72.50 71.68 3g7y s THR 85 CO 0.08 0.27 -0.18 0.54 -0.69 0.00 0.00 174.62 174.64 3g7y s VAL 86 N 0.55 1.48 -0.18 3.82 0.11 0.21 -0.91 120.40 125.48 3g7y s VAL 86 Ca -0.09 -0.75 -0.11 0.00 -2.93 0.00 0.00 61.98 58.10 3g7y s VAL 86 Cb -0.13 -1.27 -0.05 0.00 -1.53 0.00 0.00 36.38 33.41 3g7y s VAL 86 CO 0.01 0.42 0.19 -0.62 -3.33 0.00 0.00 175.10 171.78 3g7y s ASP 87 N 0.01 6.30 0.41 3.54 -1.08 -1.26 -0.33 116.67 124.26 3g7y s ASP 87 Ca -0.03 0.34 0.29 0.00 -0.52 0.00 0.00 52.55 52.63 3g7y s ASP 87 Cb -0.12 -2.12 1.36 0.00 -1.46 0.00 0.00 42.92 40.58 3g7y s ASP 87 CO 0.02 0.16 1.87 -0.37 0.52 0.00 0.00 175.17 177.38 3g7y h VAL 88 N 4.64 0.00 0.00 1.11 -1.51 -1.35 -1.18 116.25 117.96 3g7y h VAL 88 Ca -0.42 -0.21 0.00 0.00 -1.23 0.00 0.00 66.70 64.85 3g7y h VAL 88 Cb 1.16 0.99 0.00 0.00 -2.13 0.00 0.00 31.29 31.30 3g7y h VAL 88 CO 0.75 0.00 -0.45 0.59 -1.23 0.00 0.00 177.57 177.23 3g7y n ASN 89 N -2.58 0.63 -0.05 4.19 5.03 -1.26 -4.15 115.26 117.06 3g7y n ASN 89 Ca 0.00 0.16 -0.01 0.00 0.87 0.00 0.00 54.58 55.60 3g7y n ASN 89 Cb 0.18 -0.03 -0.14 0.00 -1.02 0.00 0.00 39.78 38.76 3g7y n ASN 89 CO 0.00 0.00 0.00 -0.62 -1.83 0.00 0.00 177.26 174.81 3g7y n GLU 90 N -1.99 0.94 -3.59 3.52 1.02 -0.49 -4.78 120.64 115.28 3g7y n GLU 90 Ca 0.04 -0.07 -0.27 0.00 -0.02 0.00 0.00 57.16 56.84 3g7y n GLU 90 Cb 0.41 -1.44 -0.10 0.00 -0.02 0.00 0.00 31.44 30.29 3g7y n GLU 90 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 3g7y n VAL 91 N -2.44 0.43 0.25 2.62 0.31 -0.94 -4.23 118.33 114.34 3g7y n VAL 91 Ca -0.18 -4.29 0.09 0.00 -0.01 0.00 0.00 64.34 59.95 3g7y n VAL 91 Cb 0.83 -1.96 0.65 0.00 -0.91 0.00 0.00 33.84 32.45 3g7y n VAL 91 CO 0.00 0.00 0.00 1.55 -1.32 0.00 0.00 176.83 177.06 3g7y h PRO 92 N 5.21 0.00 -0.22 5.55 0.13 -1.86 -2.67 132.00 138.14 3g7y h PRO 92 Ca 0.19 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 65.27 3g7y h PRO 92 Cb 0.81 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.94 3g7y h PRO 92 CO 0.58 0.09 -0.07 0.37 -0.23 0.00 0.00 178.00 178.74 3g7y h GLN 93 N 0.00 0.43 -0.73 0.86 5.75 -1.95 -1.32 115.11 118.15 3g7y h GLN 93 Ca -0.00 -0.17 0.09 0.00 -0.15 0.00 0.00 58.65 58.42 3g7y h GLN 93 Cb 0.18 -0.02 -0.05 0.00 1.07 0.00 0.00 27.48 28.67 3g7y h GLN 93 CO 0.01 0.68 0.48 1.25 -2.65 0.00 0.00 178.83 178.61 3g7y h LEU 94 N 0.15 0.57 -0.63 -2.39 6.46 -1.91 0.26 115.31 117.83 3g7y h LEU 94 Ca 0.05 0.01 -0.10 0.00 -0.12 0.00 0.00 57.88 57.73 3g7y h LEU 94 Cb 0.53 -0.11 -0.02 0.00 -0.73 0.00 0.00 40.66 40.33 3g7y h LEU 94 CO 0.02 0.35 -0.00 0.58 -0.62 0.00 0.00 178.44 178.77 3g7y h VAL 95 N 0.64 1.27 0.06 1.05 2.07 -1.22 -0.44 116.25 119.67 3g7y h VAL 95 Ca 0.33 -1.16 -0.00 0.00 0.82 0.00 0.00 66.70 66.69 3g7y h VAL 95 Cb 0.45 0.80 0.00 0.00 -1.52 0.00 0.00 31.29 31.02 3g7y h VAL 95 CO -0.12 0.42 -0.03 0.50 0.02 0.00 0.00 177.57 178.37 3g7y h LYS 96 N 0.98 -0.07 -0.51 1.57 3.64 -0.26 -2.13 116.57 119.79 3g7y h LYS 96 Ca 0.17 0.00 0.08 0.00 -1.27 0.00 0.00 60.65 59.64 3g7y h LYS 96 Cb 0.57 0.02 -0.06 0.00 -0.41 0.00 0.00 32.23 32.34 3g7y h LYS 96 CO 0.03 0.46 0.15 -0.44 -2.27 0.00 0.00 179.45 177.38 3g7y h ASP 97 N -0.66 0.10 -0.19 4.20 3.32 -0.52 -1.63 116.42 121.05 3g7y h ASP 97 Ca -0.01 0.08 0.00 0.00 0.02 0.00 0.00 57.03 57.12 3g7y h ASP 97 Cb 0.56 0.08 0.00 0.00 0.22 0.00 0.00 39.33 40.20 3g7y h ASP 97 CO 0.01 0.08 0.00 0.18 -1.72 0.00 0.00 179.24 177.80 3g7y n LEU 98 N -5.05 1.28 -3.79 1.55 4.32 -0.18 -4.90 117.00 110.23 3g7y n LEU 98 Ca 0.06 -0.59 -0.29 0.00 -0.02 0.00 0.00 56.01 55.16 3g7y n LEU 98 Cb 0.23 -0.12 -0.01 0.00 -1.62 0.00 0.00 43.42 41.89 3g7y n LEU 98 CO 0.22 0.30 -0.02 0.29 -1.22 0.00 0.00 177.39 176.96 3g7y n LYS 99 N 0.13 -3.38 -2.02 3.23 5.02 -0.61 -4.86 118.16 115.67 3g7y n LYS 99 Ca 0.12 0.42 -0.41 0.00 -2.02 0.00 0.00 58.31 56.41 3g7y n LYS 99 Cb 0.23 -5.14 -0.02 0.00 -0.02 0.00 0.00 35.03 30.08 3g7y n LYS 99 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 3g7y s LEU 100 N -6.87 4.39 0.00 -0.35 1.43 -0.83 -4.91 118.68 111.54 3g7y s LEU 100 Ca 0.58 2.69 0.00 0.00 -1.03 0.00 0.00 54.13 56.37 3g7y s LEU 100 Cb -0.31 -3.63 0.00 0.00 0.03 0.00 0.00 46.19 42.28 3g7y s LEU 100 CO 0.71 -0.68 0.00 0.00 0.23 0.00 0.00 176.35 176.61 3g7y n GLN 101 N 1.94 3.35 -3.84 1.70 6.02 -1.26 -4.96 117.38 120.34 3g7y n GLN 101 Ca 0.05 0.00 -0.09 0.00 -0.01 0.00 0.00 57.00 56.95 3g7y n GLN 101 Cb 0.40 -0.72 0.01 0.00 1.02 0.00 0.00 30.24 30.96 3g7y n GLN 101 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 3g7y s ASN 102 N -1.39 0.05 0.13 1.08 2.20 -1.26 -5.19 114.94 110.57 3g7y s ASN 102 Ca 0.00 -1.11 -0.03 0.00 -0.94 0.00 0.00 52.86 50.78 3g7y s ASN 102 Cb 0.00 0.82 -0.03 0.00 -2.00 0.00 0.00 41.25 40.04 3g7y s ASN 102 CO 0.00 -1.62 0.09 0.68 -2.94 0.00 0.00 177.10 173.32 3g7y s VAL 103 N -2.57 0.10 0.43 3.54 -7.23 -1.26 -4.68 120.40 108.73 3g7y s VAL 103 Ca 0.16 -1.80 -0.02 0.00 -1.81 0.00 0.00 61.98 58.51 3g7y s VAL 103 Cb -0.05 -1.96 -0.03 0.00 0.56 0.00 0.00 36.38 34.90 3g7y s VAL 103 CO 0.12 -0.47 0.69 -2.16 -0.31 0.00 0.00 175.10 172.96 3g7y s PRO 104 N -4.02 3.46 0.10 4.82 0.04 -1.26 -4.93 135.00 133.20 3g7y s PRO 104 Ca 0.21 -0.08 0.09 0.00 0.04 0.00 0.00 61.00 61.26 3g7y s PRO 104 Cb 0.07 -2.50 -0.03 0.00 0.04 0.00 0.00 34.50 32.07 3g7y s PRO 104 CO 0.00 -0.09 -0.22 -1.01 0.04 0.00 0.00 177.00 175.73 3g7y s HIS 105 N -2.57 1.91 -0.18 0.56 3.76 -0.06 -4.78 115.29 113.94 3g7y s HIS 105 Ca 0.45 -0.40 -0.00 0.00 -0.15 0.00 0.00 55.06 54.95 3g7y s HIS 105 Cb -0.10 -1.06 0.04 0.00 1.11 0.00 0.00 32.58 32.57 3g7y s HIS 105 CO 0.41 0.21 -0.06 -1.17 -0.85 0.00 0.00 174.74 173.27 3g7y s LEU 106 N -1.79 1.82 0.19 0.89 1.98 -1.26 0.06 118.68 120.56 3g7y s LEU 106 Ca 0.08 -0.75 0.10 0.00 -2.89 0.00 0.00 54.13 50.67 3g7y s LEU 106 Cb -0.10 -1.00 -0.04 0.00 0.66 0.00 0.00 46.19 45.71 3g7y s LEU 106 CO 0.04 -0.18 -0.21 0.68 -1.89 0.00 0.00 176.35 174.80 3g7y s VAL 107 N 1.57 2.09 -0.11 1.68 -7.23 -0.59 -1.26 120.40 116.54 3g7y s VAL 107 Ca -0.00 -2.01 0.00 0.00 -1.81 0.00 0.00 61.98 58.16 3g7y s VAL 107 Cb -0.16 -2.00 0.02 0.00 0.56 0.00 0.00 36.38 34.81 3g7y s VAL 107 CO -0.08 -0.25 -0.09 -0.69 -0.31 0.00 0.00 175.10 173.68 3g7y s VAL 108 N -1.95 1.11 -0.24 1.32 1.01 0.17 -0.49 120.40 121.34 3g7y s VAL 108 Ca 0.19 -0.37 -0.14 0.00 0.00 0.00 0.00 61.98 61.66 3g7y s VAL 108 Cb -0.06 -1.09 -0.04 0.00 0.00 0.00 0.00 36.38 35.18 3g7y s VAL 108 CO 0.09 0.37 0.31 -0.31 0.00 0.00 0.00 175.10 175.56 3g7y s TYR 109 N 1.43 3.30 0.79 5.22 2.02 0.17 -0.57 117.35 129.72 3g7y s TYR 109 Ca 0.00 0.40 -0.11 0.00 -0.37 0.00 0.00 57.07 57.00 3g7y s TYR 109 Cb -0.13 -2.46 0.07 0.00 -0.40 0.00 0.00 41.96 39.03 3g7y s TYR 109 CO -0.06 -0.08 1.09 -1.25 -1.57 0.00 0.00 175.55 173.69 3g7y s PRO 110 N 1.54 2.09 0.52 -1.71 0.04 -1.26 -0.38 135.00 135.84 3g7y s PRO 110 Ca 0.14 1.11 -0.22 0.00 0.04 0.00 0.00 61.00 62.08 3g7y s PRO 110 Cb -0.15 -1.88 -0.07 0.00 0.04 0.00 0.00 34.50 32.44 3g7y s PRO 110 CO 0.08 -1.75 1.16 -2.30 0.04 0.00 0.00 177.00 174.23 3g7y n PRO 111 N -3.59 1.41 -1.78 0.56 -0.02 -1.24 -4.73 135.00 125.62 3g7y n PRO 111 Ca 0.09 0.52 -0.37 0.00 -2.02 0.00 0.00 63.50 61.72 3g7y n PRO 111 Cb 0.53 -2.32 0.06 0.00 -0.02 0.00 0.00 33.50 31.75 3g7y n PRO 111 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3g7y s ALA 112 N -1.35 2.47 0.26 3.55 0.00 -1.26 -4.96 121.76 120.47 3g7y s ALA 112 Ca 0.70 1.22 -0.31 0.00 0.00 0.00 0.00 51.96 53.57 3g7y s ALA 112 Cb -0.46 -3.55 -0.12 0.00 0.00 0.00 0.00 23.12 19.00 3g7y s ALA 112 CO 0.51 -1.52 1.65 -1.21 0.00 0.00 0.00 175.76 175.20 3g7y s GLU 113 N -3.30 4.12 0.20 0.00 0.41 -1.26 -4.70 118.70 114.17 3g7y s GLU 113 Ca 0.80 2.60 -0.16 0.00 -0.41 0.00 0.00 54.97 57.80 3g7y s GLU 113 Cb -0.37 -3.04 0.18 0.00 -1.78 0.00 0.00 34.13 29.11 3g7y s GLU 113 CO 0.40 -0.69 1.62 0.77 -0.49 0.00 0.00 175.26 176.87 3g7y h SER 114 N 5.72 -0.72 0.00 -0.19 0.02 -1.99 0.47 113.55 116.85 3g7y h SER 114 Ca -0.45 0.19 0.00 0.00 -0.84 0.00 0.00 61.79 60.69 3g7y h SER 114 Cb 1.21 0.42 0.00 0.00 0.14 0.00 0.00 62.40 64.17 3g7y h SER 114 CO 0.87 -0.23 0.00 -0.46 -1.14 0.00 0.00 176.83 175.87 3g7y n ASN 115 N -5.42 0.32 -0.60 3.07 6.94 -1.26 -2.08 115.26 116.23 3g7y n ASN 115 Ca 0.05 0.65 0.06 0.00 -0.02 0.00 0.00 54.58 55.33 3g7y n ASN 115 Cb 0.32 -0.69 0.16 0.00 -2.36 0.00 0.00 39.78 37.21 3g7y n ASN 115 CO 0.00 0.00 0.00 0.29 -1.03 0.00 0.00 177.26 176.52 3g7y n LYS 116 N -1.94 1.22 0.05 -3.83 5.02 0.16 -4.86 118.16 113.98 3g7y n LYS 116 Ca -0.01 -2.85 -0.12 0.00 -2.02 0.00 0.00 58.31 53.31 3g7y n LYS 116 Cb 0.02 -1.31 -0.07 0.00 -0.02 0.00 0.00 35.03 33.65 3g7y n LYS 116 CO 0.00 0.00 0.00 0.37 -0.52 0.00 0.00 177.40 177.25 3g7y h GLN 117 N 0.73 -0.03 0.00 1.97 5.75 -0.83 -2.95 115.11 119.75 3g7y h GLN 117 Ca -0.03 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.47 3g7y h GLN 117 Cb 1.14 0.01 0.00 0.00 1.07 0.00 0.00 27.48 29.70 3g7y h GLN 117 CO 0.01 0.02 0.00 0.66 -2.65 0.00 0.00 178.83 176.88 3g7y h SER 118 N -0.08 0.00 -0.69 -0.69 4.64 -1.89 -0.66 113.55 114.18 3g7y h SER 118 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3g7y h SER 118 Cb 0.07 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.16 3g7y h SER 118 CO 0.01 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.97 3g7y n GLN 119 N -2.49 3.22 -2.69 4.77 10.64 -1.11 -4.95 117.38 124.76 3g7y n GLN 119 Ca -0.00 -2.77 -0.42 0.00 -1.83 0.00 0.00 57.00 51.97 3g7y n GLN 119 Cb 0.13 -1.72 -0.03 0.00 -0.86 0.00 0.00 30.24 27.76 3g7y n GLN 119 CO 0.00 0.00 0.00 0.12 -1.83 0.00 0.00 177.06 175.35 3g7y s PHE 120 N -1.41 3.54 -0.12 2.61 5.36 -0.26 -4.86 117.98 122.85 3g7y s PHE 120 Ca 0.50 1.62 -0.09 0.00 -0.96 0.00 0.00 56.93 58.00 3g7y s PHE 120 Cb 0.29 -3.17 0.04 0.00 -0.34 0.00 0.00 43.02 39.84 3g7y s PHE 120 CO 0.29 -0.18 0.31 -1.21 -1.46 0.00 0.00 175.22 172.97 3g7y s GLU 121 N 1.80 0.32 0.41 10.12 2.02 -1.26 -4.44 118.70 127.67 3g7y s GLU 121 Ca 0.49 0.52 0.22 0.00 0.02 0.00 0.00 54.97 56.22 3g7y s GLU 121 Cb -0.19 0.05 1.20 0.00 0.10 0.00 0.00 34.13 35.30 3g7y s GLU 121 CO 0.20 -0.10 1.72 -1.49 0.02 0.00 0.00 175.26 175.62 3g7y h TRP 122 N 6.38 0.62 -0.13 1.61 6.55 -1.53 0.44 115.95 129.90 3g7y h TRP 122 Ca -0.32 0.02 -0.10 0.00 0.95 0.00 0.00 58.89 59.44 3g7y h TRP 122 Cb 1.18 -0.17 -0.01 0.00 -0.86 0.00 0.00 29.16 29.29 3g7y h TRP 122 CO 0.36 -0.03 -0.36 -0.22 -1.05 0.00 0.00 178.44 177.15 3g7y h LYS 123 N 0.29 0.26 0.00 0.49 3.64 -1.90 -3.33 116.57 116.02 3g7y h LYS 123 Ca 0.66 -0.11 0.00 0.00 -1.27 0.00 0.00 60.65 59.93 3g7y h LYS 123 Cb 1.83 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 33.64 3g7y h LYS 123 CO -0.34 0.59 -0.08 0.25 -2.27 0.00 0.00 179.45 177.61 3g7y n THR 124 N -4.07 0.00 -2.76 1.00 -2.24 -0.00 -4.92 114.28 101.29 3g7y n THR 124 Ca -0.01 -0.46 -0.41 0.00 -2.27 0.00 0.00 64.05 60.89 3g7y n THR 124 Cb 0.44 0.97 -0.04 0.00 -2.10 0.00 0.00 70.33 69.60 3g7y n THR 124 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 3g7y s SER 125 N -1.10 7.44 0.81 3.42 0.01 0.14 -4.93 113.70 119.50 3g7y s SER 125 Ca 0.00 1.73 -0.14 0.00 1.31 0.00 0.00 55.95 58.85 3g7y s SER 125 Cb 0.00 -2.57 0.02 0.00 0.21 0.00 0.00 66.02 63.69 3g7y s SER 125 CO 0.02 -0.08 0.73 -2.65 0.41 0.00 0.00 173.24 171.67 3g7y n PRO 126 N 2.93 0.10 -3.69 12.44 -0.02 -1.26 -4.90 135.00 140.60 3g7y n PRO 126 Ca 0.02 0.09 -0.12 0.00 -2.02 0.00 0.00 63.50 61.47 3g7y n PRO 126 Cb 0.50 -2.05 -0.07 0.00 -0.02 0.00 0.00 33.50 31.86 3g7y n PRO 126 CO 0.00 0.00 0.00 -0.59 1.98 0.00 0.00 175.50 176.89 3g7y s PHE 127 N -2.12 -0.22 0.16 6.00 -0.12 -1.26 -4.48 117.98 115.95 3g7y s PHE 127 Ca 0.66 0.16 -0.23 0.00 -0.05 0.00 0.00 56.93 57.46 3g7y s PHE 127 Cb -0.29 0.19 -0.08 0.00 -0.63 0.00 0.00 43.02 42.21 3g7y s PHE 127 CO 0.58 -0.56 0.73 0.71 -0.05 0.00 0.00 175.22 176.63 3g7y s TYR 128 N -2.52 3.83 -0.14 3.49 2.02 0.27 -4.87 117.35 119.43 3g7y s TYR 128 Ca -0.05 1.52 0.02 0.00 -0.37 0.00 0.00 57.07 58.19 3g7y s TYR 128 Cb -0.01 -2.69 0.01 0.00 -0.40 0.00 0.00 41.96 38.87 3g7y s TYR 128 CO -0.03 0.49 -0.22 -1.14 -1.57 0.00 0.00 175.55 173.08 3g7y s GLN 129 N -1.34 2.98 -0.28 -0.62 0.74 -1.26 0.44 119.66 120.32 3g7y s GLN 129 Ca 0.36 -0.84 -0.25 0.00 0.05 0.00 0.00 55.36 54.68 3g7y s GLN 129 Cb -0.21 -2.41 0.00 0.00 1.10 0.00 0.00 33.01 31.49 3g7y s GLN 129 CO 0.24 -0.01 0.87 -0.47 -0.55 0.00 0.00 175.29 175.36 3g7y s TYR 130 N 0.81 3.24 -0.12 1.67 5.04 -0.39 -4.99 117.35 122.61 3g7y s TYR 130 Ca -0.07 1.03 -0.29 0.00 -2.44 0.00 0.00 57.07 55.30 3g7y s TYR 130 Cb -0.16 -3.25 -0.06 0.00 0.35 0.00 0.00 41.96 38.85 3g7y s TYR 130 CO -0.02 -0.54 1.91 -1.54 -1.34 0.00 0.00 175.55 174.02 3g7y s SER 131 N 1.50 6.17 -0.30 4.32 1.04 -1.26 -4.25 113.70 120.92 3g7y s SER 131 Ca 0.36 2.10 -0.14 0.00 0.48 0.00 0.00 55.95 58.76 3g7y s SER 131 Cb -0.14 -2.53 -0.03 0.00 0.10 0.00 0.00 66.02 63.42 3g7y s SER 131 CO 0.11 -1.36 0.30 -0.76 0.98 0.00 0.00 173.24 172.51 3g7y s LEU 132 N 5.73 4.16 0.08 2.42 1.02 -1.26 -4.96 118.68 125.87 3g7y s LEU 132 Ca 0.85 0.02 -0.03 0.00 0.02 0.00 0.00 54.13 55.00 3g7y s LEU 132 Cb -0.34 -2.29 -0.03 0.00 0.02 0.00 0.00 46.19 43.55 3g7y s LEU 132 CO 0.35 -0.18 0.04 0.68 0.02 0.00 0.00 176.35 177.26 3g7y s VAL 133 N 1.94 0.17 0.38 -1.59 -7.23 -1.26 -4.95 120.40 107.86 3g7y s VAL 133 Ca 0.11 -1.70 0.08 0.00 -1.81 0.00 0.00 61.98 58.66 3g7y s VAL 133 Cb -0.16 -1.62 0.30 0.00 0.56 0.00 0.00 36.38 35.46 3g7y s VAL 133 CO 0.11 -0.79 1.97 -0.65 -0.31 0.00 0.00 175.10 175.43 3g7y h PRO 134 N 2.99 0.62 -0.09 4.82 0.11 -1.98 -0.80 132.00 137.67 3g7y h PRO 134 Ca -0.34 -0.04 0.03 0.00 0.11 0.00 0.00 66.00 65.76 3g7y h PRO 134 Cb 1.17 -0.14 -0.00 0.00 0.11 0.00 0.00 31.00 32.13 3g7y h PRO 134 CO 0.62 0.41 0.15 1.49 -0.21 0.00 0.00 178.00 180.46 3g7y h GLU 135 N 0.64 0.00 0.00 1.05 4.81 -2.00 -2.51 114.58 116.57 3g7y h GLU 135 Ca 0.30 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.53 3g7y h GLU 135 Cb 0.34 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.72 3g7y h GLU 135 CO -0.10 0.00 -0.04 0.27 -0.73 0.00 0.00 179.01 178.41 3g7y n ASN 136 N -3.51 1.89 0.18 1.04 0.23 -0.37 -4.78 115.26 109.94 3g7y n ASN 136 Ca -0.01 -2.48 0.18 0.00 -0.53 0.00 0.00 54.58 51.75 3g7y n ASN 136 Cb 0.25 -0.23 0.77 0.00 -2.08 0.00 0.00 39.78 38.49 3g7y n ASN 136 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 3g7y h ALA 137 N 0.00 1.84 0.00 -2.53 0.00 -0.92 -2.58 119.26 115.07 3g7y h ALA 137 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 3g7y h ALA 137 Cb 0.85 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.66 3g7y h ALA 137 CO 0.00 -0.53 -0.12 0.39 0.00 0.00 0.00 179.25 178.99 3g7y n GLU 138 N -3.44 1.12 -2.89 0.00 1.02 -1.26 -3.17 120.64 112.02 3g7y n GLU 138 Ca 0.04 -1.45 -0.44 0.00 -0.02 0.00 0.00 57.16 55.29 3g7y n GLU 138 Cb 0.52 -0.90 -0.03 0.00 -0.02 0.00 0.00 31.44 31.01 3g7y n GLU 138 CO 0.00 0.00 0.00 1.21 1.18 0.00 0.00 177.13 179.52 3g7y s ASN 139 N -1.29 6.58 0.35 1.62 3.84 -0.97 -4.83 114.94 120.23 3g7y s ASN 139 Ca 0.09 -1.91 0.17 0.00 0.21 0.00 0.00 52.86 51.42 3g7y s ASN 139 Cb 0.08 -2.42 0.60 0.00 -0.55 0.00 0.00 41.25 38.96 3g7y s ASN 139 CO 0.01 -1.13 1.70 0.71 -2.79 0.00 0.00 177.10 175.60 3g7y h THR 140 N 5.93 1.00 0.52 -5.21 1.35 -1.91 -2.70 112.91 111.89 3g7y h THR 140 Ca 0.12 -1.65 -0.03 0.00 -0.55 0.00 0.00 66.41 64.31 3g7y h THR 140 Cb 1.03 1.98 0.01 0.00 -1.73 0.00 0.00 68.15 69.43 3g7y h THR 140 CO 1.14 0.42 -0.25 0.25 -0.25 0.00 0.00 175.52 176.83 3g7y h LEU 141 N 0.00 -0.59 -0.64 3.87 5.85 -1.94 0.12 115.31 121.98 3g7y h LEU 141 Ca -0.00 -0.04 -0.00 0.00 0.84 0.00 0.00 57.88 58.67 3g7y h LEU 141 Cb 0.95 0.15 -0.03 0.00 0.37 0.00 0.00 40.66 42.10 3g7y h LEU 141 CO 0.06 -0.31 0.40 -0.61 -0.34 0.00 0.00 178.44 177.64 3g7y h GLN 142 N -0.86 0.86 -0.49 1.25 4.15 -1.97 0.12 115.11 118.18 3g7y h GLN 142 Ca -0.07 -0.07 -0.11 0.00 0.77 0.00 0.00 58.65 59.17 3g7y h GLN 142 Cb 0.60 -0.18 -0.02 0.00 0.21 0.00 0.00 27.48 28.09 3g7y h GLN 142 CO 0.12 0.61 -0.11 0.35 -1.93 0.00 0.00 178.83 177.86 3g7y h PHE 143 N 0.87 1.05 -0.80 3.99 3.57 -1.52 -1.19 116.94 122.90 3g7y h PHE 143 Ca 0.23 -0.22 0.06 0.00 3.53 0.00 0.00 57.97 61.57 3g7y h PHE 143 Cb -0.04 -0.26 -0.06 0.00 2.79 0.00 0.00 35.95 38.38 3g7y h PHE 143 CO -0.02 1.01 0.49 0.78 -2.23 0.00 0.00 178.31 178.34 3g7y h GLY 144 N 0.79 1.20 1.28 2.40 0.00 -0.40 -1.56 103.07 106.78 3g7y h GLY 144 Ca 0.12 -0.35 -0.12 0.00 0.00 0.00 0.00 47.33 46.98 3g7y h GLY 144 CO 0.05 0.24 -0.22 -0.55 0.00 0.00 0.00 176.54 176.06 3g7y h ASP 145 N 0.89 0.84 0.08 0.19 3.32 -0.53 0.05 116.42 121.28 3g7y h ASP 145 Ca 0.35 -0.31 0.02 0.00 0.02 0.00 0.00 57.03 57.12 3g7y h ASP 145 Cb 0.17 -0.23 -0.04 0.00 0.22 0.00 0.00 39.33 39.45 3g7y h ASP 145 CO -0.17 1.03 -0.32 0.15 -1.72 0.00 0.00 179.24 178.21 3g7y h PHE 146 N 0.72 -0.88 -0.36 4.55 3.57 -0.74 -1.28 116.94 122.51 3g7y h PHE 146 Ca 0.10 0.02 -0.11 0.00 3.53 0.00 0.00 57.97 61.51 3g7y h PHE 146 Cb 0.74 0.38 -0.01 0.00 2.79 0.00 0.00 35.95 39.85 3g7y h PHE 146 CO 0.04 -0.42 -0.25 -0.07 -2.23 0.00 0.00 178.31 175.38 3g7y h LEU 147 N -0.53 0.73 -1.36 0.59 3.38 -1.17 -2.60 115.31 114.35 3g7y h LEU 147 Ca 0.04 -0.27 -0.03 0.00 0.09 0.00 0.00 57.88 57.71 3g7y h LEU 147 Cb 0.57 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 41.10 3g7y h LEU 147 CO -0.21 0.95 0.09 0.00 0.09 0.00 0.00 178.44 179.36 3g7y h ALA 148 N 1.10 1.49 -0.17 1.53 0.00 -0.78 0.60 119.26 123.04 3g7y h ALA 148 Ca 0.08 -0.14 -0.22 0.00 0.00 0.00 0.00 54.91 54.63 3g7y h ALA 148 Cb 0.74 -0.15 0.01 0.00 0.00 0.00 0.00 17.79 18.39 3g7y h ALA 148 CO 0.06 0.38 -0.75 0.87 0.00 0.00 0.00 179.25 179.81 3g7y h LYS 149 N 0.51 0.80 -0.13 0.00 1.57 -1.07 0.15 116.57 118.39 3g7y h LYS 149 Ca 0.12 -0.63 -0.12 0.00 -1.87 0.00 0.00 60.65 58.15 3g7y h LYS 149 Cb 0.19 0.12 0.00 0.00 0.08 0.00 0.00 32.23 32.63 3g7y h LYS 149 CO -0.00 1.24 -0.38 0.82 -0.57 0.00 0.00 179.45 180.55 3g7y h ILE 150 N 0.55 1.37 -0.00 1.86 2.04 -1.02 -3.20 117.51 119.12 3g7y h ILE 150 Ca -0.04 -1.68 0.00 0.00 1.00 0.00 0.00 64.86 64.13 3g7y h ILE 150 Cb 1.37 2.09 0.00 0.00 -0.74 0.00 0.00 36.82 39.55 3g7y h ILE 150 CO 0.15 0.50 -0.02 0.18 0.00 0.00 0.00 178.15 178.97 3g7y n LEU 151 N -4.32 0.02 -3.38 1.44 4.77 0.20 -4.93 117.00 110.81 3g7y n LEU 151 Ca -0.07 0.41 -0.17 0.00 -0.03 0.00 0.00 56.01 56.14 3g7y n LEU 151 Cb 0.53 -0.42 0.09 0.00 -2.33 0.00 0.00 43.42 41.29 3g7y n LEU 151 CO 0.44 0.01 0.12 -3.20 -1.33 0.00 0.00 177.39 173.43 3g7y n ASN 152 N -1.42 -2.45 -4.49 -1.43 5.15 0.26 -5.00 115.26 105.88 3g7y n ASN 152 Ca 0.09 -0.60 -0.23 0.00 -0.60 0.00 0.00 54.58 53.25 3g7y n ASN 152 Cb 0.31 -4.99 -0.11 0.00 -0.53 0.00 0.00 39.78 34.46 3g7y n ASN 152 CO 0.00 0.00 0.00 0.27 1.40 0.00 0.00 177.26 178.93 3g7y s ILE 153 N -3.35 1.56 -0.19 -1.44 -4.36 0.22 -5.03 121.20 108.62 3g7y s ILE 153 Ca 0.06 -2.05 0.00 0.00 -0.26 0.00 0.00 60.65 58.40 3g7y s ILE 153 Cb -0.02 -2.73 0.02 0.00 1.25 0.00 0.00 42.46 40.97 3g7y s ILE 153 CO 0.71 -0.10 -0.17 -0.44 0.24 0.00 0.00 174.94 175.18 3g7y s SER 154 N -3.53 3.37 0.18 4.36 0.01 -1.26 -4.58 113.70 112.25 3g7y s SER 154 Ca 0.34 -0.66 0.07 0.00 1.31 0.00 0.00 55.95 57.01 3g7y s SER 154 Cb 0.07 -1.52 -0.04 0.00 0.21 0.00 0.00 66.02 64.74 3g7y s SER 154 CO 0.15 -0.01 -0.14 0.27 0.41 0.00 0.00 173.24 173.91 3g7y s ILE 155 N 1.31 1.63 -0.23 1.44 -4.36 -1.26 -4.95 121.20 114.78 3g7y s ILE 155 Ca 0.04 -2.08 0.02 0.00 -0.26 0.00 0.00 60.65 58.37 3g7y s ILE 155 Cb -0.14 -1.92 0.04 0.00 1.25 0.00 0.00 42.46 41.70 3g7y s ILE 155 CO -0.11 -0.54 -0.13 -0.89 0.24 0.00 0.00 174.94 173.50 3g7y s THR 156 N -2.75 2.23 -0.04 8.37 2.01 -1.26 -5.05 115.64 119.15 3g7y s THR 156 Ca 0.19 -1.31 -0.19 0.00 0.31 0.00 0.00 61.69 60.69 3g7y s THR 156 Cb -0.02 -2.16 -0.05 0.00 0.01 0.00 0.00 72.50 70.28 3g7y s THR 156 CO 0.06 0.20 0.52 -0.69 -0.69 0.00 0.00 174.62 174.02 3g7y s VAL 157 N 1.20 5.01 0.02 3.82 1.01 -1.26 -5.02 120.40 125.18 3g7y s VAL 157 Ca -0.03 1.08 -0.30 0.00 0.00 0.00 0.00 61.98 62.73 3g7y s VAL 157 Cb -0.17 -3.86 -0.09 0.00 0.00 0.00 0.00 36.38 32.27 3g7y s VAL 157 CO -0.08 0.42 1.99 -2.84 0.00 0.00 0.00 175.10 174.60 3g7y s PRO 158 N -0.12 4.06 0.00 2.72 0.02 -1.26 -4.75 135.00 135.66 3g7y s PRO 158 Ca 0.28 2.57 0.00 0.00 0.02 0.00 0.00 61.00 63.87 3g7y s PRO 158 Cb -0.17 -4.18 0.00 0.00 0.02 0.00 0.00 34.50 30.17 3g7y s PRO 158 CO 0.14 -1.05 0.15 0.00 -0.33 0.00 0.00 177.00 175.91 3g7y n GLN 159 N 7.65 0.00 0.00 5.54 -0.00 -1.26 -5.01 117.38 124.30 3g7y n GLN 159 Ca 0.21 -0.15 0.00 0.00 -0.00 0.00 0.00 57.00 57.06 3g7y n GLN 159 Cb 0.41 -0.19 0.00 0.00 -0.00 0.00 0.00 30.24 30.46 3g7y n GLN 159 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 3g7y n ALA 160 N 0.00 0.00 1.30 2.61 0.00 -1.26 -5.19 120.51 117.97 3g7y n ALA 160 Ca 0.00 0.00 0.13 0.00 0.00 0.00 0.00 53.44 53.57 3g7y n ALA 160 Cb 0.45 0.00 0.36 0.00 0.00 0.00 0.00 19.45 20.25 3g7y n ALA 160 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84