#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2pgc n SER 2 N nan 0.00 0.08 1.61 3.41 -1.26 -4.72 113.62 nan 2pgc n SER 2 Ca nan 0.00 0.13 0.00 -0.26 0.00 0.00 58.87 nan 2pgc n SER 2 Cb nan 0.00 0.46 0.00 -0.26 0.00 0.00 64.21 nan 2pgc n SER 2 CO nan 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 nan 2pgc n ASN 3 N 0.00 0.58 -4.75 4.04 5.03 -1.26 -4.83 115.26 114.06 2pgc n ASN 3 Ca 0.00 0.56 -0.40 0.00 0.87 0.00 0.00 54.58 55.61 2pgc n ASN 3 Cb 0.00 -0.71 -0.05 0.00 -1.02 0.00 0.00 39.78 37.99 2pgc n ASN 3 CO 0.00 0.00 0.00 -0.63 -1.83 0.00 0.00 177.26 174.80 2pgc s ILE 4 N -3.09 3.83 0.54 2.41 1.09 -1.26 -4.55 121.20 120.17 2pgc s ILE 4 Ca 0.11 1.83 0.02 0.00 -1.10 0.00 0.00 60.65 61.51 2pgc s ILE 4 Cb 0.14 -4.16 0.02 0.00 -1.06 0.00 0.00 42.46 37.40 2pgc s ILE 4 CO 0.55 0.42 0.16 0.20 -0.10 0.00 0.00 174.94 176.17 2pgc s ASN 5 N -1.08 4.33 0.03 3.58 0.01 -0.61 -4.80 114.94 116.40 2pgc s ASN 5 Ca 0.43 -1.55 0.02 0.00 -0.71 0.00 0.00 52.86 51.05 2pgc s ASN 5 Cb -0.28 0.61 -0.02 0.00 0.41 0.00 0.00 41.25 41.97 2pgc s ASN 5 CO 0.35 -1.01 -0.07 -0.31 -1.51 0.00 0.00 177.10 174.56 2pgc s TYR 6 N -2.87 0.61 -0.07 2.20 1.51 0.79 -0.38 117.35 119.14 2pgc s TYR 6 Ca 0.13 -0.40 0.02 0.00 -1.01 0.00 0.00 57.07 55.81 2pgc s TYR 6 Cb -0.01 -0.37 0.01 0.00 -0.11 0.00 0.00 41.96 41.49 2pgc s TYR 6 CO 0.08 -0.07 -0.12 0.08 -1.11 0.00 0.00 175.55 174.42 2pgc s VAL 7 N -1.07 1.13 -0.16 0.71 1.01 0.11 -1.06 120.40 121.08 2pgc s VAL 7 Ca -0.07 -0.46 -0.06 0.00 0.00 0.00 0.00 61.98 61.39 2pgc s VAL 7 Cb -0.08 -1.05 -0.04 0.00 0.00 0.00 0.00 36.38 35.21 2pgc s VAL 7 CO 0.00 0.36 0.03 -0.63 0.00 0.00 0.00 175.10 174.86 2pgc s ILE 8 N 0.83 4.50 -0.13 2.22 1.09 -0.32 -0.03 121.20 129.35 2pgc s ILE 8 Ca -0.11 -0.14 0.02 0.00 -1.10 0.00 0.00 60.65 59.31 2pgc s ILE 8 Cb -0.15 -3.00 0.01 0.00 -1.06 0.00 0.00 42.46 38.26 2pgc s ILE 8 CO 0.02 0.49 -0.20 -0.76 -0.10 0.00 0.00 174.94 174.39 2pgc s LEU 9 N 0.21 2.00 -0.04 2.97 1.02 0.12 -1.08 118.68 123.88 2pgc s LEU 9 Ca 0.02 -0.56 0.06 0.00 0.02 0.00 0.00 54.13 53.67 2pgc s LEU 9 Cb -0.13 -1.35 -0.01 0.00 0.02 0.00 0.00 46.19 44.72 2pgc s LEU 9 CO 0.01 0.05 -0.22 -0.89 0.02 0.00 0.00 176.35 175.33 2pgc s THR 10 N 0.91 1.75 -0.07 5.49 2.01 -0.27 -1.17 115.64 124.29 2pgc s THR 10 Ca -0.06 -0.92 0.03 0.00 0.31 0.00 0.00 61.69 61.05 2pgc s THR 10 Cb -0.15 -1.48 0.01 0.00 0.01 0.00 0.00 72.50 70.89 2pgc s THR 10 CO -0.03 0.50 -0.15 -0.69 -0.69 0.00 0.00 174.62 173.56 2pgc s VAL 11 N -0.21 1.35 0.01 3.82 1.01 0.13 -0.71 120.40 125.81 2pgc s VAL 11 Ca 0.00 -0.61 0.02 0.00 0.00 0.00 0.00 61.98 61.39 2pgc s VAL 11 Cb -0.11 -1.21 -0.01 0.00 0.00 0.00 0.00 36.38 35.04 2pgc s VAL 11 CO 0.02 0.40 -0.06 0.00 0.00 0.00 0.00 175.10 175.46 2pgc s ALA 12 N 0.57 0.50 0.03 5.51 0.00 -0.36 -1.38 121.76 126.63 2pgc s ALA 12 Ca -0.15 -0.45 -0.20 0.00 0.00 0.00 0.00 51.96 51.16 2pgc s ALA 12 Cb -0.16 -0.05 -0.06 0.00 0.00 0.00 0.00 23.12 22.85 2pgc s ALA 12 CO 0.05 0.06 0.59 -1.54 0.00 0.00 0.00 175.76 174.92 2pgc s SER 13 N -0.71 7.02 -0.01 0.00 1.04 -0.32 -0.98 113.70 119.75 2pgc s SER 13 Ca -0.03 1.21 0.00 0.00 0.48 0.00 0.00 55.95 57.62 2pgc s SER 13 Cb -0.05 -2.37 0.01 0.00 0.10 0.00 0.00 66.02 63.71 2pgc s SER 13 CO 0.00 0.18 -0.01 -0.69 0.98 0.00 0.00 173.24 173.70 2pgc s VAL 14 N -0.59 0.13 0.38 5.02 1.01 -1.26 -0.67 120.40 124.42 2pgc s VAL 14 Ca 0.30 -0.01 -0.28 0.00 0.00 0.00 0.00 61.98 61.99 2pgc s VAL 14 Cb -0.19 -0.16 -0.11 0.00 0.00 0.00 0.00 36.38 35.92 2pgc s VAL 14 CO 0.18 0.07 1.48 0.47 0.00 0.00 0.00 175.10 177.31 2pgc n ASP 15 N 3.42 3.77 -0.32 3.32 9.92 -0.84 -4.87 116.55 130.95 2pgc n ASP 15 Ca -0.18 1.23 0.05 0.00 -0.53 0.00 0.00 54.79 55.36 2pgc n ASP 15 Cb 0.56 -1.62 0.24 0.00 -0.64 0.00 0.00 41.12 39.67 2pgc n ASP 15 CO 0.00 0.00 0.00 0.15 0.13 0.00 0.00 177.20 177.48 2pgc h PHE 16 N 2.95 1.07 0.00 1.24 3.57 -1.97 -1.95 116.94 121.85 2pgc h PHE 16 Ca -0.51 0.03 -0.05 0.00 3.53 0.00 0.00 57.97 60.97 2pgc h PHE 16 Cb 1.24 -0.35 -0.01 0.00 2.79 0.00 0.00 35.95 39.63 2pgc h PHE 16 CO 0.53 0.52 -0.24 0.66 -2.23 0.00 0.00 178.31 177.55 2pgc h SER 17 N 1.02 0.00 0.28 0.41 4.64 -2.00 -2.79 113.55 115.11 2pgc h SER 17 Ca 0.42 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.74 2pgc h SER 17 Cb 0.28 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.37 2pgc h SER 17 CO -0.17 0.24 -0.15 0.00 -0.87 0.00 0.00 176.83 175.87 2pgc n TYR 18 N -4.21 0.00 -0.26 4.77 9.36 -0.74 -4.38 117.16 121.70 2pgc n TYR 18 Ca -0.02 0.00 -0.03 0.00 3.32 0.00 0.00 57.90 61.16 2pgc n TYR 18 Cb 0.30 -0.14 0.08 0.00 -0.63 0.00 0.00 39.34 38.94 2pgc n TYR 18 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 2pgc h ARG 19 N 0.92 0.88 -0.08 2.98 3.08 -1.47 -2.94 114.38 117.74 2pgc h ARG 19 Ca 0.00 -0.05 -0.08 0.00 0.07 0.00 0.00 59.98 59.91 2pgc h ARG 19 Cb 0.41 -0.20 0.00 0.00 0.08 0.00 0.00 29.97 30.27 2pgc h ARG 19 CO 0.00 0.58 -0.28 0.93 -1.07 0.00 0.00 179.97 180.13 2pgc h GLU 20 N 0.90 0.33 -0.49 0.04 5.08 -1.81 -2.48 114.58 116.14 2pgc h GLU 20 Ca 0.29 -0.25 0.00 0.00 -1.00 0.00 0.00 59.36 58.40 2pgc h GLU 20 Cb -0.00 0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.29 2pgc h GLU 20 CO -0.10 0.88 0.00 2.41 -1.00 0.00 0.00 179.01 181.19 2pgc n THR 21 N -4.46 0.00 0.00 1.13 -1.04 -1.11 -2.24 114.28 106.56 2pgc n THR 21 Ca -0.08 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.93 2pgc n THR 21 Cb 0.47 -0.09 0.00 0.00 -1.82 0.00 0.00 70.33 68.89 2pgc n THR 21 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2pgc n ALA 23 N 0.46 0.00 -0.06 2.41 0.00 -0.94 -1.08 120.51 121.31 2pgc n ALA 23 Ca 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 53.44 53.30 2pgc n ALA 23 Cb 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.38 2pgc n ALA 23 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2pgc h ARG 24 N 0.00 0.53 -0.85 0.00 3.08 -1.75 -2.07 114.38 113.32 2pgc h ARG 24 Ca 0.00 -0.33 0.00 0.00 0.07 0.00 0.00 59.98 59.72 2pgc h ARG 24 Cb 0.00 0.04 0.00 0.00 0.08 0.00 0.00 29.97 30.09 2pgc h ARG 24 CO 0.00 0.93 0.00 1.28 -1.07 0.00 0.00 179.97 181.11 2pgc n LEU 25 N -4.35 0.00 0.00 3.04 4.77 -0.24 -3.10 117.00 117.12 2pgc n LEU 25 Ca -0.06 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.92 2pgc n LEU 25 Cb 0.48 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.57 2pgc n LEU 25 CO 0.43 0.00 0.00 -1.54 -1.33 0.00 0.00 177.39 174.95 2pgc n SER 27 N 0.65 0.00 0.04 -1.43 3.41 -0.78 -1.44 113.62 114.07 2pgc n SER 27 Ca 0.00 0.00 -0.13 0.00 -0.26 0.00 0.00 58.87 58.48 2pgc n SER 27 Cb 0.00 0.00 -0.09 0.00 -0.26 0.00 0.00 64.21 63.86 2pgc n SER 27 CO 0.00 0.00 0.00 -1.28 -0.16 0.00 0.00 175.04 173.60 2pgc h SER 28 N 0.00 -0.07 -0.59 4.04 0.87 -1.83 -1.97 113.55 114.00 2pgc h SER 28 Ca 0.00 -0.25 0.05 0.00 -1.23 0.00 0.00 61.79 60.36 2pgc h SER 28 Cb 0.00 0.02 -0.03 0.00 -0.44 0.00 0.00 62.40 61.94 2pgc h SER 28 CO 0.00 0.21 0.39 0.22 -0.53 0.00 0.00 176.83 177.12 2pgc h TYR 29 N -0.36 0.60 -0.15 2.24 3.20 -1.55 -2.24 116.97 118.71 2pgc h TYR 29 Ca -0.01 0.02 -0.01 0.00 3.14 0.00 0.00 58.73 61.86 2pgc h TYR 29 Cb 0.32 -0.20 -0.01 0.00 1.54 0.00 0.00 36.73 38.38 2pgc h TYR 29 CO 0.02 0.34 0.04 0.77 -1.64 0.00 0.00 178.16 177.69 2pgc h SER 30 N 0.61 0.23 -0.60 -2.11 0.02 -1.79 -2.25 113.55 107.65 2pgc h SER 30 Ca 0.25 -0.21 0.12 0.00 -0.84 0.00 0.00 61.79 61.10 2pgc h SER 30 Cb 0.20 -0.06 -0.09 0.00 0.14 0.00 0.00 62.40 62.59 2pgc h SER 30 CO -0.07 0.38 0.07 0.11 -1.14 0.00 0.00 176.83 176.18 2pgc h LYS 31 N 0.06 0.19 -0.41 3.45 6.56 -0.79 0.16 116.57 125.79 2pgc h LYS 31 Ca 0.05 -0.01 0.07 0.00 -1.06 0.00 0.00 60.65 59.69 2pgc h LYS 31 Cb 0.24 -0.04 -0.06 0.00 -0.57 0.00 0.00 32.23 31.80 2pgc h LYS 31 CO -0.00 0.12 0.07 0.22 -2.06 0.00 0.00 179.45 177.80 2pgc h ASP 32 N 0.19 -0.01 -0.41 0.86 1.82 -1.27 0.55 116.42 118.15 2pgc h ASP 32 Ca 0.32 0.07 -0.12 0.00 -0.39 0.00 0.00 57.03 56.91 2pgc h ASP 32 Cb 0.49 0.10 -0.01 0.00 0.68 0.00 0.00 39.33 40.60 2pgc h ASP 32 CO -0.45 0.03 -0.20 -0.07 -1.61 0.00 0.00 179.24 176.93 2pgc h LEU 33 N 0.20 0.89 -0.35 2.28 3.38 -0.61 -0.19 115.31 120.90 2pgc h LEU 33 Ca 0.20 -0.41 -0.02 0.00 0.09 0.00 0.00 57.88 57.74 2pgc h LEU 33 Cb 0.25 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.74 2pgc h LEU 33 CO -0.27 1.10 0.14 0.40 0.09 0.00 0.00 178.44 179.90 2pgc h ILE 34 N 0.67 1.19 0.08 1.22 2.04 -0.35 -0.62 117.51 121.75 2pgc h ILE 34 Ca 0.09 -0.57 -0.27 0.00 1.00 0.00 0.00 64.86 65.11 2pgc h ILE 34 Cb 0.77 0.91 0.02 0.00 -0.74 0.00 0.00 36.82 37.77 2pgc h ILE 34 CO 0.06 0.20 -1.15 0.44 0.00 0.00 0.00 178.15 177.70 2pgc h ASP 35 N 0.42 0.69 0.00 1.72 3.32 -0.90 -3.30 116.42 118.36 2pgc h ASP 35 Ca 0.12 -0.63 -0.20 0.00 0.02 0.00 0.00 57.03 56.34 2pgc h ASP 35 Cb 0.18 -0.22 -0.04 0.00 0.22 0.00 0.00 39.33 39.48 2pgc h ASP 35 CO -0.01 1.45 -1.77 0.59 -1.72 0.00 0.00 179.24 177.78 2pgc n ASN 36 N -3.73 2.19 -0.01 6.45 4.13 -0.09 -4.58 115.26 119.62 2pgc n ASN 36 Ca -0.10 0.00 0.11 0.00 1.68 0.00 0.00 54.58 56.27 2pgc n ASN 36 Cb 0.94 0.83 0.07 0.00 -1.54 0.00 0.00 39.78 40.08 2pgc n ASN 36 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2pgc n ALA 37 N -2.39 4.13 -1.20 5.41 0.00 -0.30 -4.94 120.51 121.22 2pgc n ALA 37 Ca -0.18 -0.47 -0.04 0.00 0.00 0.00 0.00 53.44 52.75 2pgc n ALA 37 Cb 0.84 -0.95 -0.02 0.00 0.00 0.00 0.00 19.45 19.32 2pgc n ALA 37 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2pgc n GLY 38 N 1.50 0.64 3.74 0.00 0.00 -0.92 -4.64 105.19 105.51 2pgc n GLY 38 Ca 0.05 -0.88 -0.42 0.00 0.00 0.00 0.00 46.02 44.77 2pgc n GLY 38 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2pgc s ALA 39 N -2.15 3.77 -0.44 4.61 0.00 -0.86 -4.77 121.76 121.92 2pgc s ALA 39 Ca 0.00 1.50 -0.02 0.00 0.00 0.00 0.00 51.96 53.44 2pgc s ALA 39 Cb 0.00 -3.64 0.27 0.00 0.00 0.00 0.00 23.12 19.75 2pgc s ALA 39 CO 0.00 -0.89 2.09 1.63 0.00 0.00 0.00 175.76 178.59 2pgc n LYS 40 N 2.90 2.13 0.00 0.00 4.76 0.25 -4.43 118.16 123.77 2pgc n LYS 40 Ca 0.10 -2.17 0.00 0.00 -2.87 0.00 0.00 58.31 53.37 2pgc n LYS 40 Cb 0.38 -1.87 0.00 0.00 -1.84 0.00 0.00 35.03 31.70 2pgc n LYS 40 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2pgc n GLY 41 N 0.01 3.10 3.15 0.72 0.00 -1.26 -4.78 105.19 106.13 2pgc n GLY 41 Ca 0.42 -1.89 -0.09 0.00 0.00 0.00 0.00 46.02 44.46 2pgc n GLY 41 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2pgc s THR 42 N -2.64 0.15 0.00 2.61 -4.23 -1.26 -2.38 115.64 107.89 2pgc s THR 42 Ca 0.00 -1.76 0.01 0.00 -1.18 0.00 0.00 61.69 58.76 2pgc s THR 42 Cb 0.00 -1.76 -0.01 0.00 1.34 0.00 0.00 72.50 72.08 2pgc s THR 42 CO 0.00 -0.68 -0.03 -0.13 -0.54 0.00 0.00 174.62 173.25 2pgc s ARG 43 N -3.97 0.22 -0.03 3.99 1.81 -0.18 -4.97 118.95 115.82 2pgc s ARG 43 Ca 0.15 -0.19 0.01 0.00 -1.72 0.00 0.00 55.73 53.98 2pgc s ARG 43 Cb 0.07 -0.16 0.02 0.00 -0.45 0.00 0.00 34.95 34.44 2pgc s ARG 43 CO -0.04 0.04 -0.01 0.12 -0.68 0.00 0.00 175.30 174.72 2pgc s PHE 44 N -0.30 0.39 0.31 -0.53 5.36 -1.26 0.09 117.98 122.04 2pgc s PHE 44 Ca -0.02 -0.04 -0.18 0.00 -0.96 0.00 0.00 56.93 55.73 2pgc s PHE 44 Cb -0.02 -0.42 0.06 0.00 -0.34 0.00 0.00 43.02 42.30 2pgc s PHE 44 CO -0.00 -0.12 0.88 0.20 -1.46 0.00 0.00 175.22 174.72 2pgc s GLY 45 N 0.81 0.27 -0.13 13.12 0.00 -0.63 -1.24 107.32 119.53 2pgc s GLY 45 Ca -0.09 -0.60 -0.05 0.00 0.00 0.00 0.00 44.72 43.99 2pgc s GLY 45 CO -0.01 0.64 0.04 -1.35 0.00 0.00 0.00 173.10 172.42 2pgc s SER 46 N -3.18 5.50 -0.16 1.64 1.04 -0.22 -0.74 113.70 117.58 2pgc s SER 46 Ca 0.18 0.15 -0.29 0.00 0.48 0.00 0.00 55.95 56.47 2pgc s SER 46 Cb -0.04 -1.75 -0.02 0.00 0.10 0.00 0.00 66.02 64.31 2pgc s SER 46 CO 0.09 0.30 1.31 -0.63 0.98 0.00 0.00 173.24 175.29 2pgc s ILE 47 N -0.42 4.20 -0.32 -1.02 1.01 0.55 -0.92 121.20 124.28 2pgc s ILE 47 Ca 0.09 1.45 0.23 0.00 0.00 0.00 0.00 60.65 62.41 2pgc s ILE 47 Cb -0.12 -3.95 0.10 0.00 0.01 0.00 0.00 42.46 38.50 2pgc s ILE 47 CO 0.02 -0.15 1.22 1.23 0.00 0.00 0.00 174.94 177.26 2pgc h GLY 48 N 9.86 0.00 -2.26 6.18 0.00 -0.96 0.33 103.07 116.21 2pgc h GLY 48 Ca -0.28 0.00 -0.35 0.00 0.00 0.00 0.00 47.33 46.70 2pgc h GLY 48 CO 0.97 0.00 -0.59 -0.51 0.00 0.00 0.00 176.54 176.41 2pgc s THR 49 N -3.31 0.30 0.00 4.70 -4.23 -1.25 -4.78 115.64 107.07 2pgc s THR 49 Ca 0.02 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.53 2pgc s THR 49 Cb 0.09 -2.55 0.00 0.00 1.34 0.00 0.00 72.50 71.38 2pgc s THR 49 CO 0.75 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 175.44 2pgc n GLY 50 N -0.47 -2.09 0.16 3.99 0.00 -1.26 -3.34 105.19 102.18 2pgc n GLY 50 Ca 0.01 -1.42 0.13 0.00 0.00 0.00 0.00 46.02 44.74 2pgc n GLY 50 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2pgc h ASP 51 N -0.00 0.00 -0.53 1.61 5.19 -1.99 -2.70 116.42 118.00 2pgc h ASP 51 Ca 0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 2pgc h ASP 51 Cb 0.00 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.51 2pgc h ASP 51 CO 0.00 0.00 0.00 1.41 -3.12 0.00 0.00 179.24 177.53 2pgc n HIS 52 N -2.52 1.57 -1.65 4.55 -0.00 -1.26 -4.98 115.22 110.92 2pgc n HIS 52 Ca 0.03 -0.57 -0.47 0.00 -0.00 0.00 0.00 57.72 56.71 2pgc n HIS 52 Cb 0.36 -0.35 -0.04 0.00 -0.00 0.00 0.00 29.99 29.96 2pgc n HIS 52 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 2pgc n ALA 53 N 0.73 0.77 0.00 -1.41 0.00 -1.02 -1.17 120.51 118.40 2pgc n ALA 53 Ca 0.23 0.46 0.00 0.00 0.00 0.00 0.00 53.44 54.13 2pgc n ALA 53 Cb 0.94 -2.27 0.00 0.00 0.00 0.00 0.00 19.45 18.12 2pgc n ALA 53 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2pgc n GLY 54 N 3.04 3.08 3.78 0.00 0.00 0.10 -5.00 105.19 110.19 2pgc n GLY 54 Ca 0.17 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.86 2pgc n GLY 54 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2pgc s SER 55 N -1.16 5.04 0.08 1.61 0.01 -0.32 -4.69 113.70 114.28 2pgc s SER 55 Ca 0.00 1.91 0.02 0.00 1.31 0.00 0.00 55.95 59.18 2pgc s SER 55 Cb 0.00 -2.54 -0.04 0.00 0.21 0.00 0.00 66.02 63.65 2pgc s SER 55 CO 0.00 -1.67 0.16 -0.76 0.41 0.00 0.00 173.24 171.38 2pgc s LEU 56 N -5.15 4.10 -0.01 2.44 1.43 -0.15 -0.33 118.68 121.01 2pgc s LEU 56 Ca 0.64 0.12 0.03 0.00 -1.03 0.00 0.00 54.13 53.90 2pgc s LEU 56 Cb -0.19 -2.73 -0.01 0.00 0.03 0.00 0.00 46.19 43.30 2pgc s LEU 56 CO 0.46 0.15 -0.11 -0.51 0.23 0.00 0.00 176.35 176.57 2pgc s ILE 57 N -1.50 0.85 -0.08 -0.59 2.07 0.09 -1.22 121.20 120.81 2pgc s ILE 57 Ca 0.32 -0.47 0.03 0.00 -1.41 0.00 0.00 60.65 59.13 2pgc s ILE 57 Cb -0.12 -0.71 0.01 0.00 0.13 0.00 0.00 42.46 41.76 2pgc s ILE 57 CO 0.25 0.23 -0.18 0.12 -1.91 0.00 0.00 174.94 173.46 2pgc s PHE 58 N -0.26 2.01 -0.09 3.50 5.36 0.12 -1.61 117.98 127.01 2pgc s PHE 58 Ca 0.04 -0.80 0.04 0.00 -0.96 0.00 0.00 56.93 55.25 2pgc s PHE 58 Cb -0.04 -1.39 0.00 0.00 -0.34 0.00 0.00 43.02 41.25 2pgc s PHE 58 CO -0.00 -0.35 -0.22 0.42 -1.46 0.00 0.00 175.22 173.61 2pgc s ILE 59 N 0.52 1.88 -0.04 3.12 1.01 0.11 -1.11 121.20 126.69 2pgc s ILE 59 Ca -0.16 -0.92 0.07 0.00 0.00 0.00 0.00 60.65 59.63 2pgc s ILE 59 Cb -0.17 -1.63 -0.01 0.00 0.01 0.00 0.00 42.46 40.66 2pgc s ILE 59 CO 0.06 0.52 -0.24 -1.10 0.00 0.00 0.00 174.94 174.18 2pgc s GLN 60 N 0.36 2.24 -0.16 2.79 -0.21 -0.24 -1.01 119.66 123.43 2pgc s GLN 60 Ca -0.17 -0.86 -0.02 0.00 0.02 0.00 0.00 55.36 54.32 2pgc s GLN 60 Cb -0.17 -2.00 -0.02 0.00 1.00 0.00 0.00 33.01 31.82 2pgc s GLN 60 CO 0.08 0.43 -0.08 -0.06 -2.12 0.00 0.00 175.29 173.54 2pgc s PHE 61 N -0.31 2.92 0.02 0.91 0.08 -1.00 -1.17 117.98 119.42 2pgc s PHE 61 Ca 0.02 -0.61 0.03 0.00 0.12 0.00 0.00 56.93 56.48 2pgc s PHE 61 Cb -0.12 -1.95 -0.01 0.00 -0.57 0.00 0.00 43.02 40.37 2pgc s PHE 61 CO 0.02 -0.25 -0.09 0.71 -0.10 0.00 0.00 175.22 175.51 2pgc s TYR 62 N 0.66 0.82 0.19 0.36 2.02 -0.22 -0.58 117.35 120.60 2pgc s TYR 62 Ca -0.04 -0.28 0.12 0.00 -0.37 0.00 0.00 57.07 56.50 2pgc s TYR 62 Cb -0.15 -0.50 0.30 0.00 -0.40 0.00 0.00 41.96 41.20 2pgc s TYR 62 CO 0.02 -0.02 1.56 -0.44 -1.57 0.00 0.00 175.55 175.11 2pgc h ASP 63 N 5.31 0.00 -5.11 2.29 5.19 -1.86 0.22 116.42 122.47 2pgc h ASP 63 Ca -0.33 0.00 -0.13 0.00 -0.62 0.00 0.00 57.03 55.95 2pgc h ASP 63 Cb 1.19 0.00 -0.17 0.00 0.18 0.00 0.00 39.33 40.52 2pgc h ASP 63 CO 0.46 0.63 -0.57 -1.81 -3.12 0.00 0.00 179.24 174.83 2pgc s ASP 64 N -6.71 0.25 0.54 6.45 1.01 -1.26 -4.50 116.67 112.45 2pgc s ASP 64 Ca -0.00 -0.63 0.32 0.00 0.71 0.00 0.00 52.55 52.95 2pgc s ASP 64 Cb 0.11 0.21 1.46 0.00 1.01 0.00 0.00 42.92 45.72 2pgc s ASP 64 CO 0.76 -0.51 2.03 -0.07 0.21 0.00 0.00 175.17 177.58 2pgc h LEU 65 N 3.63 0.00 -0.86 1.23 3.38 -1.98 -2.18 115.31 118.54 2pgc h LEU 65 Ca -0.33 0.00 0.07 0.00 0.09 0.00 0.00 57.88 57.71 2pgc h LEU 65 Cb 1.18 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 41.86 2pgc h LEU 65 CO 0.53 0.06 0.53 0.74 0.09 0.00 0.00 178.44 180.39 2pgc h THR 66 N 0.00 1.01 -0.54 0.22 2.02 -1.99 -1.13 112.91 112.50 2pgc h THR 66 Ca -0.00 -0.32 0.10 0.00 0.77 0.00 0.00 66.41 66.96 2pgc h THR 66 Cb 0.45 -0.01 -0.08 0.00 -1.74 0.00 0.00 68.15 66.77 2pgc h THR 66 CO 0.01 0.17 0.09 1.23 0.37 0.00 0.00 175.52 177.39 2pgc h GLY 67 N 0.94 0.66 1.47 2.16 0.00 -1.65 -1.10 103.07 105.55 2pgc h GLY 67 Ca 0.38 -0.01 -0.09 0.00 0.00 0.00 0.00 47.33 47.61 2pgc h GLY 67 CO -0.19 -0.10 -0.17 -1.82 0.00 0.00 0.00 176.54 174.25 2pgc h TYR 68 N 0.22 0.69 -0.64 5.60 3.20 -1.37 -1.10 116.97 123.57 2pgc h TYR 68 Ca 0.28 -0.13 -0.04 0.00 3.14 0.00 0.00 58.73 61.98 2pgc h TYR 68 Cb 0.40 -0.17 -0.03 0.00 1.54 0.00 0.00 36.73 38.47 2pgc h TYR 68 CO -0.25 0.76 0.24 0.37 -1.64 0.00 0.00 178.16 177.64 2pgc h GLN 69 N 0.56 0.95 -0.58 1.82 4.15 -0.49 0.18 115.11 121.70 2pgc h GLN 69 Ca 0.09 -0.16 -0.09 0.00 0.77 0.00 0.00 58.65 59.26 2pgc h GLN 69 Cb 0.61 -0.16 -0.02 0.00 0.21 0.00 0.00 27.48 28.12 2pgc h GLN 69 CO 0.04 0.78 -0.00 0.87 -1.93 0.00 0.00 178.83 178.59 2pgc h LYS 70 N 0.93 1.02 -0.70 1.69 1.57 -0.82 -2.52 116.57 117.74 2pgc h LYS 70 Ca 0.22 -0.33 0.06 0.00 -1.87 0.00 0.00 60.65 58.73 2pgc h LYS 70 Cb 0.20 -0.09 -0.06 0.00 0.08 0.00 0.00 32.23 32.36 2pgc h LYS 70 CO -0.02 1.01 0.39 0.00 -0.57 0.00 0.00 179.45 180.26 2pgc h ALA 71 N 0.97 0.95 -0.66 3.86 0.00 -0.47 -0.06 119.26 123.85 2pgc h ALA 71 Ca 0.16 0.02 -0.00 0.00 0.00 0.00 0.00 54.91 55.09 2pgc h ALA 71 Cb 0.55 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.19 2pgc h ALA 71 CO 0.03 0.06 0.40 -0.07 0.00 0.00 0.00 179.25 179.67 2pgc h LEU 72 N 0.71 0.79 -0.76 0.00 3.38 -0.77 -1.70 115.31 116.95 2pgc h LEU 72 Ca 0.32 -0.04 -0.13 0.00 0.09 0.00 0.00 57.88 58.11 2pgc h LEU 72 Cb 0.21 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.75 2pgc h LEU 72 CO -0.19 0.61 -0.54 -0.33 0.09 0.00 0.00 178.44 178.07 2pgc h GLU 73 N 0.91 0.22 -0.54 1.13 5.08 -0.82 -3.00 114.58 117.56 2pgc h GLU 73 Ca 0.24 -0.13 -0.07 0.00 -1.00 0.00 0.00 59.36 58.40 2pgc h GLU 73 Cb -0.04 0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.20 2pgc h GLU 73 CO -0.05 0.70 0.05 0.82 -1.00 0.00 0.00 179.01 179.54 2pgc h ILE 74 N 0.17 1.24 0.28 3.13 1.08 -0.43 -3.24 117.51 119.75 2pgc h ILE 74 Ca 0.00 -0.97 0.00 0.00 -0.39 0.00 0.00 64.86 63.51 2pgc h ILE 74 Cb 1.01 0.77 -0.02 0.00 -3.07 0.00 0.00 36.82 35.51 2pgc h ILE 74 CO 0.08 0.35 -0.30 1.56 -0.69 0.00 0.00 178.15 179.15 2pgc h GLN 75 N 0.82 -0.60 -0.95 2.37 4.20 -1.19 -1.62 115.11 118.14 2pgc h GLN 75 Ca 0.17 0.04 0.24 0.00 0.06 0.00 0.00 58.65 59.15 2pgc h GLN 75 Cb 0.41 0.14 -0.07 0.00 0.30 0.00 0.00 27.48 28.26 2pgc h GLN 75 CO 0.01 -0.40 0.64 0.66 -0.67 0.00 0.00 178.83 179.07 2pgc h SER 76 N -0.62 0.32 0.40 1.46 4.64 -1.57 -0.72 113.55 117.46 2pgc h SER 76 Ca -0.01 0.04 0.00 0.00 -0.47 0.00 0.00 61.79 61.35 2pgc h SER 76 Cb 0.58 -0.01 0.00 0.00 -0.31 0.00 0.00 62.40 62.65 2pgc h SER 76 CO -0.07 0.11 -0.79 0.29 -0.87 0.00 0.00 176.83 175.50 2pgc n LYS 77 N -4.48 0.12 -2.73 4.77 4.01 -1.06 -4.96 118.16 113.82 2pgc n LYS 77 Ca 0.21 0.00 -0.42 0.00 -0.51 0.00 0.00 58.31 57.59 2pgc n LYS 77 Cb 0.82 -1.54 -0.03 0.00 -0.51 0.00 0.00 35.03 33.77 2pgc n LYS 77 CO 0.00 0.00 0.00 0.45 -1.11 0.00 0.00 177.40 176.74 2pgc s SER 78 N -3.39 7.20 0.09 4.39 0.15 -0.28 -4.95 113.70 116.91 2pgc s SER 78 Ca 0.08 1.47 -0.16 0.00 0.70 0.00 0.00 55.95 58.04 2pgc s SER 78 Cb 0.16 -2.54 -0.09 0.00 -1.71 0.00 0.00 66.02 61.85 2pgc s SER 78 CO 0.77 -0.42 1.43 0.28 1.20 0.00 0.00 173.24 176.50 2pgc h SER 79 N 7.11 0.67 -0.54 5.45 0.02 -1.91 -1.96 113.55 122.38 2pgc h SER 79 Ca -0.31 -0.45 0.09 0.00 -0.84 0.00 0.00 61.79 60.28 2pgc h SER 79 Cb 1.15 -0.19 -0.07 0.00 0.14 0.00 0.00 62.40 63.43 2pgc h SER 79 CO 0.84 0.97 0.15 0.58 -1.14 0.00 0.00 176.83 178.23 2pgc h VAL 80 N 0.36 0.73 -0.48 2.27 2.07 -1.96 0.17 116.25 119.41 2pgc h VAL 80 Ca 0.05 -0.10 -0.07 0.00 0.82 0.00 0.00 66.70 67.40 2pgc h VAL 80 Cb 0.76 0.41 -0.02 0.00 -1.52 0.00 0.00 31.29 30.92 2pgc h VAL 80 CO 0.06 0.05 0.02 0.15 0.02 0.00 0.00 177.57 177.87 2pgc h PHE 81 N 0.29 0.91 -0.55 1.57 3.57 -1.87 -2.66 116.94 118.20 2pgc h PHE 81 Ca 0.28 -0.15 0.03 0.00 3.53 0.00 0.00 57.97 61.65 2pgc h PHE 81 Cb 0.36 -0.24 -0.04 0.00 2.79 0.00 0.00 35.95 38.83 2pgc h PHE 81 CO -0.21 0.86 0.33 -0.22 -2.23 0.00 0.00 178.31 176.84 2pgc h LYS 82 N 0.70 0.62 -0.48 1.11 3.64 -0.81 -2.91 116.57 118.45 2pgc h LYS 82 Ca 0.14 -0.04 0.04 0.00 -1.27 0.00 0.00 60.65 59.52 2pgc h LYS 82 Cb 0.49 -0.14 -0.04 0.00 -0.41 0.00 0.00 32.23 32.13 2pgc h LYS 82 CO 0.02 0.41 0.25 1.49 -2.27 0.00 0.00 179.45 179.35 2pgc h GLU 83 N 0.64 0.47 -0.01 1.90 4.81 -0.83 0.19 114.58 121.76 2pgc h GLU 83 Ca 0.23 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.43 2pgc h GLU 83 Cb 0.04 -0.11 0.00 0.00 0.63 0.00 0.00 28.75 29.31 2pgc h GLU 83 CO -0.11 0.31 0.00 -0.89 -0.73 0.00 0.00 179.01 177.60 2pgc n ILE 84 N -4.88 0.00 0.00 2.32 5.41 -1.02 -1.11 119.36 120.08 2pgc n ILE 84 Ca 0.03 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.78 2pgc n ILE 84 Cb 0.12 -0.11 0.00 0.00 -0.71 0.00 0.00 39.64 38.94 2pgc n ILE 84 CO 0.00 0.00 0.00 0.47 0.00 0.00 0.00 176.55 177.02 2pgc n ASP 86 N 0.29 0.00 0.15 4.38 9.92 0.67 -4.06 116.55 127.90 2pgc n ASP 86 Ca 0.00 0.00 0.03 0.00 -0.53 0.00 0.00 54.79 54.29 2pgc n ASP 86 Cb 0.00 0.00 0.42 0.00 -0.64 0.00 0.00 41.12 40.90 2pgc n ASP 86 CO 0.00 0.00 0.00 0.77 0.13 0.00 0.00 177.20 178.10 2pgc h SER 87 N 0.00 0.16 -0.04 -2.24 4.64 -1.36 -3.46 113.55 111.25 2pgc h SER 87 Ca 0.00 -0.03 -0.02 0.00 -0.47 0.00 0.00 61.79 61.27 2pgc h SER 87 Cb 0.00 -0.04 -0.01 0.00 -0.31 0.00 0.00 62.40 62.04 2pgc h SER 87 CO 0.00 0.33 -0.02 0.61 -0.87 0.00 0.00 176.83 176.88 2pgc n GLY 88 N -0.90 0.34 0.30 -0.77 0.00 -1.26 -4.87 105.19 98.02 2pgc n GLY 88 Ca -0.01 -0.05 0.08 0.00 0.00 0.00 0.00 46.02 46.04 2pgc n GLY 88 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2pgc n LYS 89 N -1.23 1.65 -4.56 1.61 5.02 -1.26 -4.92 118.16 114.46 2pgc n LYS 89 Ca -0.01 -0.65 -0.25 0.00 -2.02 0.00 0.00 58.31 55.39 2pgc n LYS 89 Cb 0.25 -1.29 -0.17 0.00 -0.02 0.00 0.00 35.03 33.80 2pgc n LYS 89 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2pgc s ALA 90 N -2.09 1.25 -0.27 7.82 0.00 -1.26 -2.00 121.76 125.22 2pgc s ALA 90 Ca 0.12 -0.41 0.01 0.00 0.00 0.00 0.00 51.96 51.68 2pgc s ALA 90 Cb 0.13 -0.57 0.08 0.00 0.00 0.00 0.00 23.12 22.76 2pgc s ALA 90 CO 0.48 0.10 -0.01 1.21 0.00 0.00 0.00 175.76 177.54 2pgc s ASN 91 N 0.69 4.11 -0.13 0.00 3.04 0.16 -4.99 114.94 117.82 2pgc s ASN 91 Ca -0.14 -1.48 -0.29 0.00 0.04 0.00 0.00 52.86 50.98 2pgc s ASN 91 Cb -0.16 -1.24 -0.02 0.00 -1.54 0.00 0.00 41.25 38.29 2pgc s ASN 91 CO 0.03 -0.30 1.32 -0.63 -3.04 0.00 0.00 177.10 174.49 2pgc s ILE 92 N 1.32 4.15 0.00 -5.21 1.01 -1.26 -1.17 121.20 120.03 2pgc s ILE 92 Ca 0.00 1.41 0.00 0.00 0.00 0.00 0.00 60.65 62.06 2pgc s ILE 92 Cb -0.19 -3.91 0.00 0.00 0.01 0.00 0.00 42.46 38.38 2pgc s ILE 92 CO -0.10 -0.11 0.41 0.00 0.00 0.00 0.00 174.94 175.14 2pgc n TYR 93 N 6.48 0.00 -3.69 3.97 4.11 -0.48 -4.98 117.16 122.57 2pgc n TYR 93 Ca 0.14 0.00 -0.11 0.00 -0.00 0.00 0.00 57.90 57.93 2pgc n TYR 93 Cb 0.45 0.00 -0.10 0.00 -0.00 0.00 0.00 39.34 39.69 2pgc n TYR 93 CO 0.00 0.00 0.00 -1.17 -0.00 0.00 0.00 176.86 175.69 2pgc s LEU 94 N -0.10 -0.11 -0.11 -3.48 2.96 -1.10 -5.02 118.68 111.74 2pgc s LEU 94 Ca 0.00 1.01 -0.05 0.00 -0.22 0.00 0.00 54.13 54.87 2pgc s LEU 94 Cb 0.00 1.63 0.05 0.00 0.50 0.00 0.00 46.19 48.36 2pgc s LEU 94 CO 0.00 -0.19 0.24 -0.60 -1.32 0.00 0.00 176.35 174.48 2pgc s ARG 95 N 0.94 0.19 0.06 1.98 3.52 -1.26 -0.70 118.95 123.68 2pgc s ARG 95 Ca -0.05 0.55 -0.01 0.00 -0.13 0.00 0.00 55.73 56.08 2pgc s ARG 95 Cb -0.06 -0.12 -0.04 0.00 -1.56 0.00 0.00 34.95 33.18 2pgc s ARG 95 CO -0.08 -0.18 -0.01 -0.80 -0.81 0.00 0.00 175.30 173.42 2pgc s ASN 96 N 1.40 0.46 -0.06 -2.12 0.01 -0.32 -4.88 114.94 109.43 2pgc s ASN 96 Ca -0.08 -1.01 0.03 0.00 -0.71 0.00 0.00 52.86 51.10 2pgc s ASN 96 Cb -0.11 0.21 -0.02 0.00 0.41 0.00 0.00 41.25 41.75 2pgc s ASN 96 CO -0.08 -0.62 -0.16 -0.63 -1.51 0.00 0.00 177.10 174.10 2pgc s ILE 97 N -3.93 2.92 0.09 0.60 1.01 -1.26 -0.70 121.20 119.93 2pgc s ILE 97 Ca 0.08 -0.76 0.08 0.00 0.00 0.00 0.00 60.65 60.06 2pgc s ILE 97 Cb 0.08 -2.15 -0.03 0.00 0.01 0.00 0.00 42.46 40.37 2pgc s ILE 97 CO -0.09 0.58 -0.22 -0.55 0.00 0.00 0.00 174.94 174.66 2pgc s SER 98 N -0.46 2.63 0.67 3.58 0.15 0.95 -0.47 113.70 120.74 2pgc s SER 98 Ca 0.06 -0.66 -0.11 0.00 0.70 0.00 0.00 55.95 55.94 2pgc s SER 98 Cb -0.12 -0.17 -0.01 0.00 -1.71 0.00 0.00 66.02 64.02 2pgc s SER 98 CO 0.02 0.10 1.05 0.42 1.20 0.00 0.00 173.24 176.03 2pgc s THR 99 N -1.07 4.21 -0.20 6.45 -4.23 -0.36 -0.71 115.64 119.72 2pgc s THR 99 Ca 0.08 0.74 -0.01 0.00 -1.18 0.00 0.00 61.69 61.32 2pgc s THR 99 Cb -0.10 -3.53 0.05 0.00 1.34 0.00 0.00 72.50 70.27 2pgc s THR 99 CO 0.04 -0.92 -0.03 -0.55 -0.54 0.00 0.00 174.62 172.62 2pgc s SER 100 N -3.84 3.30 0.12 3.99 0.15 0.49 -3.88 113.70 114.03 2pgc s SER 100 Ca 0.57 -0.93 -0.03 0.00 0.70 0.00 0.00 55.95 56.27 2pgc s SER 100 Cb -0.13 -0.96 -0.05 0.00 -1.71 0.00 0.00 66.02 63.17 2pgc s SER 100 CO 0.54 -0.24 0.33 -0.76 1.20 0.00 0.00 173.24 174.31 2pgc s LEU 101 N 1.58 4.29 0.13 3.45 1.43 0.72 -1.57 118.68 128.71 2pgc s LEU 101 Ca -0.03 0.49 -0.33 0.00 -1.03 0.00 0.00 54.13 53.23 2pgc s LEU 101 Cb -0.17 -3.21 -0.13 0.00 0.03 0.00 0.00 46.19 42.71 2pgc s LEU 101 CO -0.07 0.08 1.66 -2.65 0.23 0.00 0.00 176.35 175.60 2pgc n PRO 102 N 0.12 2.30 -4.27 1.29 -0.02 -1.26 -4.52 135.00 128.64 2pgc n PRO 102 Ca -0.03 0.83 -0.20 0.00 -2.02 0.00 0.00 63.50 62.08 2pgc n PRO 102 Cb 0.52 -2.63 -0.11 0.00 -0.02 0.00 0.00 33.50 31.25 2pgc n PRO 102 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 2pgc s THR 103 N 1.53 1.52 -1.34 3.45 -4.23 -1.26 -5.06 115.64 110.25 2pgc s THR 103 Ca 0.80 -1.70 -0.11 0.00 -1.18 0.00 0.00 61.69 59.51 2pgc s THR 103 Cb -0.64 -1.58 0.12 0.00 1.34 0.00 0.00 72.50 71.75 2pgc s THR 103 CO 0.39 -0.29 2.01 0.29 -0.54 0.00 0.00 174.62 176.47 2pgc n LYS 104 N 0.65 3.36 -3.87 3.99 5.02 -1.26 -4.90 118.16 121.15 2pgc n LYS 104 Ca -0.16 -3.20 -0.14 0.00 -2.02 0.00 0.00 58.31 52.79 2pgc n LYS 104 Cb 0.56 -3.05 -0.15 0.00 -0.02 0.00 0.00 35.03 32.37 2pgc n LYS 104 CO 0.00 0.00 0.00 0.12 -0.52 0.00 0.00 177.40 177.00 2pgc s PHE 105 N 1.35 0.10 -0.69 2.13 2.19 -1.26 -4.84 117.98 116.97 2pgc s PHE 105 Ca 0.42 0.04 -0.27 0.00 0.33 0.00 0.00 56.93 57.45 2pgc s PHE 105 Cb 0.11 -0.18 0.03 0.00 -1.31 0.00 0.00 43.02 41.67 2pgc s PHE 105 CO -0.03 -0.05 1.31 -1.83 1.83 0.00 0.00 175.22 176.45 2pgc s GLU 106 N 0.52 3.22 0.28 10.12 4.04 -1.26 -4.99 118.70 130.63 2pgc s GLU 106 Ca -0.05 -0.05 -0.29 0.00 0.04 0.00 0.00 54.97 54.62 2pgc s GLU 106 Cb -0.07 -4.16 -0.10 0.00 0.02 0.00 0.00 34.13 29.83 2pgc s GLU 106 CO -0.01 -2.09 1.21 -0.65 -1.84 0.00 0.00 175.26 171.88 2pgc s GLN 107 N 5.67 4.49 0.16 -4.83 -1.52 -1.26 -4.86 119.66 117.50 2pgc s GLN 107 Ca 0.40 1.99 0.05 0.00 -1.95 0.00 0.00 55.36 55.85 2pgc s GLN 107 Cb -0.08 -3.15 -0.04 0.00 -0.22 0.00 0.00 33.01 29.52 2pgc s GLN 107 CO 0.18 -0.03 0.16 0.45 -0.25 0.00 0.00 175.29 175.80 2pgc s SER 108 N -0.46 5.65 0.00 5.90 0.15 -0.41 -5.03 113.70 119.50 2pgc s SER 108 Ca 0.49 -0.08 0.25 0.00 0.70 0.00 0.00 55.95 57.31 2pgc s SER 108 Cb -0.35 -1.52 0.54 0.00 -1.71 0.00 0.00 66.02 62.98 2pgc s SER 108 CO 0.44 0.07 1.43 -1.22 1.20 0.00 0.00 173.24 175.17 2pgc n TYR 109 N -0.34 0.00 -1.79 3.44 4.02 -1.26 -4.75 117.16 116.48 2pgc n TYR 109 Ca -0.08 0.00 -0.42 0.00 -0.01 0.00 0.00 57.90 57.39 2pgc n TYR 109 Cb 0.54 -0.11 -0.03 0.00 -0.02 0.00 0.00 39.34 39.72 2pgc n TYR 109 CO 0.00 0.00 0.00 -2.00 -1.01 0.00 0.00 176.86 173.85 2pgc s GLU 110 N -2.59 4.16 0.08 -0.72 2.12 -1.26 -4.93 118.70 115.55 2pgc s GLU 110 Ca 0.21 2.50 -0.31 0.00 0.36 0.00 0.00 54.97 57.73 2pgc s GLU 110 Cb 0.19 -3.62 -0.09 0.00 0.26 0.00 0.00 34.13 30.86 2pgc s GLU 110 CO 0.57 -0.81 1.80 -1.01 -0.54 0.00 0.00 175.26 175.27 2pgc s HIS 111 N 2.79 2.02 0.63 5.30 3.76 -1.26 -4.94 115.29 123.60 2pgc s HIS 111 Ca 0.79 -0.01 -0.14 0.00 -0.15 0.00 0.00 55.06 55.55 2pgc s HIS 111 Cb -0.44 -4.12 -0.02 0.00 1.11 0.00 0.00 32.58 29.12 2pgc s HIS 111 CO 0.35 -4.69 1.06 -1.25 -0.85 0.00 0.00 174.74 169.36 2pgc s PRO 112 N 3.17 3.15 -0.11 8.40 0.04 -1.26 -4.94 135.00 143.45 2pgc s PRO 112 Ca 0.80 1.11 0.15 0.00 0.04 0.00 0.00 61.00 63.11 2pgc s PRO 112 Cb -0.43 -2.01 -0.24 0.00 0.04 0.00 0.00 34.50 31.86 2pgc s PRO 112 CO 0.36 -0.94 0.38 1.63 0.04 0.00 0.00 177.00 178.48 2pgc n LYS 113 N -2.47 0.66 -4.18 4.56 4.01 -0.32 -4.78 118.16 115.65 2pgc n LYS 113 Ca 0.08 0.14 -0.17 0.00 -0.51 0.00 0.00 58.31 57.86 2pgc n LYS 113 Cb 0.53 -1.66 -0.12 0.00 -0.51 0.00 0.00 35.03 33.27 2pgc n LYS 113 CO 0.00 0.00 0.00 0.71 -1.11 0.00 0.00 177.40 177.00 2pgc s TYR 114 N -2.57 1.00 -0.05 2.13 2.02 -0.82 -1.03 117.35 118.04 2pgc s TYR 114 Ca -0.07 -0.42 0.05 0.00 -0.37 0.00 0.00 57.07 56.26 2pgc s TYR 114 Cb 0.07 -0.58 -0.01 0.00 -0.40 0.00 0.00 41.96 41.04 2pgc s TYR 114 CO 0.83 0.00 -0.21 0.42 -1.57 0.00 0.00 175.55 175.02 2pgc s ILE 115 N -1.13 1.76 -0.23 2.71 1.01 -0.41 -0.34 121.20 124.57 2pgc s ILE 115 Ca -0.03 -0.91 -0.07 0.00 0.00 0.00 0.00 60.65 59.63 2pgc s ILE 115 Cb -0.09 -1.49 -0.03 0.00 0.01 0.00 0.00 42.46 40.86 2pgc s ILE 115 CO 0.01 0.50 0.07 -0.69 0.00 0.00 0.00 174.94 174.82 2pgc s VAL 116 N -0.13 4.42 -0.16 2.92 1.01 -0.32 0.24 120.40 128.37 2pgc s VAL 116 Ca -0.02 -0.14 -0.07 0.00 0.00 0.00 0.00 61.98 61.74 2pgc s VAL 116 Cb -0.12 -3.04 -0.04 0.00 0.00 0.00 0.00 36.38 33.17 2pgc s VAL 116 CO 0.02 0.37 0.09 -0.76 0.00 0.00 0.00 175.10 174.82 2pgc s LEU 117 N 1.26 3.99 -0.02 3.92 1.43 -0.41 -1.64 118.68 127.22 2pgc s LEU 117 Ca 0.05 0.20 0.05 0.00 -1.03 0.00 0.00 54.13 53.40 2pgc s LEU 117 Cb -0.15 -2.00 -0.01 0.00 0.03 0.00 0.00 46.19 44.07 2pgc s LEU 117 CO 0.03 0.25 -0.17 -0.89 0.23 0.00 0.00 176.35 175.80 2pgc s THR 118 N -0.07 1.34 -0.03 5.49 2.01 0.21 -1.20 115.64 123.39 2pgc s THR 118 Ca 0.08 -0.72 0.04 0.00 0.31 0.00 0.00 61.69 61.40 2pgc s THR 118 Cb -0.12 -1.12 -0.00 0.00 0.01 0.00 0.00 72.50 71.27 2pgc s THR 118 CO 0.01 0.38 -0.13 -0.60 -0.69 0.00 0.00 174.62 173.59 2pgc s ARG 119 N -0.33 1.27 0.04 4.92 3.52 -1.26 0.05 118.95 127.16 2pgc s ARG 119 Ca 0.05 -0.46 -0.01 0.00 -0.13 0.00 0.00 55.73 55.18 2pgc s ARG 119 Cb -0.07 -1.16 -0.03 0.00 -1.56 0.00 0.00 34.95 32.13 2pgc s ARG 119 CO -0.00 0.21 -0.02 0.00 -0.81 0.00 0.00 175.30 174.68 2pgc s ALA 120 N -0.02 0.27 -0.17 6.12 0.00 -0.14 -1.03 121.76 126.79 2pgc s ALA 120 Ca -0.01 -0.86 -0.06 0.00 0.00 0.00 0.00 51.96 51.03 2pgc s ALA 120 Cb -0.08 0.22 -0.04 0.00 0.00 0.00 0.00 23.12 23.21 2pgc s ALA 120 CO 0.01 -0.27 0.04 -2.00 0.00 0.00 0.00 175.76 173.54 2pgc s GLU 121 N -2.69 3.85 0.03 0.00 2.12 0.13 -0.36 118.70 121.78 2pgc s GLU 121 Ca -0.04 -0.37 -0.28 0.00 0.36 0.00 0.00 54.97 54.64 2pgc s GLU 121 Cb -0.01 -3.14 0.08 0.00 0.26 0.00 0.00 34.13 31.32 2pgc s GLU 121 CO -0.05 0.32 0.69 0.00 -0.54 0.00 0.00 175.26 175.67 2pgc s ALA 122 N 0.23 -1.72 0.35 6.30 0.00 -1.26 -1.45 121.76 124.21 2pgc s ALA 122 Ca 0.03 0.98 0.00 0.00 0.00 0.00 0.00 51.96 52.97 2pgc s ALA 122 Cb -0.13 0.34 0.00 0.00 0.00 0.00 0.00 23.12 23.33 2pgc s ALA 122 CO 0.01 -0.55 0.00 0.00 0.00 0.00 0.00 175.76 175.22 2pgc n ALA 123 N 0.28 0.00 0.00 0.00 0.00 -1.26 -4.93 120.51 114.60 2pgc n ALA 123 Ca -0.17 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.27 2pgc n ALA 123 Cb 0.61 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.06 2pgc n ALA 123 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 2pgc n SER 125 N 0.00 0.00 -0.89 0.00 3.41 -1.26 -3.90 113.62 110.98 2pgc n SER 125 Ca 0.00 0.00 0.07 0.00 -0.26 0.00 0.00 58.87 58.68 2pgc n SER 125 Cb 0.00 0.00 0.21 0.00 -0.26 0.00 0.00 64.21 64.16 2pgc n SER 125 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 2pgc n ASP 126 N 0.00 2.58 -0.25 4.04 8.00 -1.26 -4.57 116.55 125.09 2pgc n ASP 126 Ca 0.00 -2.05 0.08 0.00 0.71 0.00 0.00 54.79 53.53 2pgc n ASP 126 Cb 0.00 -0.33 0.33 0.00 -0.02 0.00 0.00 41.12 41.10 2pgc n ASP 126 CO 0.00 0.00 0.00 0.07 -0.39 0.00 0.00 177.20 176.88 2pgc h LYS 127 N 2.67 0.78 0.18 -1.24 2.10 -1.97 -1.01 116.57 118.08 2pgc h LYS 127 Ca 0.00 -0.05 -0.28 0.00 -2.00 0.00 0.00 60.65 58.32 2pgc h LYS 127 Cb 0.68 -0.17 0.03 0.00 -0.90 0.00 0.00 32.23 31.87 2pgc h LYS 127 CO 0.02 0.51 -1.21 -0.44 -2.00 0.00 0.00 179.45 176.34 2pgc h ASP 128 N 0.80 0.75 -0.75 7.07 3.32 -1.95 -1.88 116.42 123.78 2pgc h ASP 128 Ca 0.39 -0.89 0.11 0.00 0.02 0.00 0.00 57.03 56.66 2pgc h ASP 128 Cb 0.43 -0.24 -0.08 0.00 0.22 0.00 0.00 39.33 39.66 2pgc h ASP 128 CO -0.16 1.59 0.36 0.11 -1.72 0.00 0.00 179.24 179.42 2pgc h LYS 129 N 0.04 0.55 0.29 3.56 1.57 -1.80 -0.53 116.57 120.26 2pgc h LYS 129 Ca -0.20 -0.03 -0.01 0.00 -1.87 0.00 0.00 60.65 58.54 2pgc h LYS 129 Cb 1.93 -0.13 -0.01 0.00 0.08 0.00 0.00 32.23 34.11 2pgc h LYS 129 CO 0.23 0.37 -0.20 0.35 -0.57 0.00 0.00 179.45 179.63 2pgc h PHE 130 N 0.57 -0.53 -0.56 -1.35 3.04 -1.12 -1.79 116.94 115.20 2pgc h PHE 130 Ca 0.38 -0.00 -0.01 0.00 3.98 0.00 0.00 57.97 62.33 2pgc h PHE 130 Cb 0.48 0.19 -0.03 0.00 2.56 0.00 0.00 35.95 39.15 2pgc h PHE 130 CO -0.12 -0.31 0.32 1.25 -2.02 0.00 0.00 178.31 177.44 2pgc h LEU 131 N -0.49 0.67 -0.32 0.59 5.85 -0.92 -1.86 115.31 118.85 2pgc h LEU 131 Ca -0.02 -0.04 -0.01 0.00 0.84 0.00 0.00 57.88 58.64 2pgc h LEU 131 Cb 0.42 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 41.26 2pgc h LEU 131 CO 0.01 0.53 0.14 0.78 -0.34 0.00 0.00 178.44 179.56 2pgc h ASN 132 N 0.77 0.43 -0.32 1.25 2.35 -0.80 -0.93 115.58 118.33 2pgc h ASN 132 Ca 0.20 -0.14 0.02 0.00 -0.55 0.00 0.00 56.30 55.83 2pgc h ASN 132 Cb -0.01 -0.11 -0.03 0.00 0.05 0.00 0.00 38.32 38.23 2pgc h ASN 132 CO -0.04 0.45 0.16 0.00 -1.65 0.00 0.00 177.43 176.35 2pgc h ILE 134 N 0.33 1.02 -0.13 0.00 1.08 -1.18 -1.09 117.51 117.54 2pgc h ILE 134 Ca 0.13 -0.28 -0.14 0.00 -0.39 0.00 0.00 64.86 64.18 2pgc h ILE 134 Cb 0.05 0.12 -0.01 0.00 -3.07 0.00 0.00 36.82 33.90 2pgc h ILE 134 CO -0.09 0.15 -0.53 0.78 -0.69 0.00 0.00 178.15 177.77 2pgc h ASN 135 N 0.83 0.40 0.67 1.72 2.35 -0.69 -2.62 115.58 118.23 2pgc h ASN 135 Ca 0.33 -0.21 -0.06 0.00 -0.55 0.00 0.00 56.30 55.81 2pgc h ASN 135 Cb 0.16 -0.11 -0.01 0.00 0.05 0.00 0.00 38.32 38.40 2pgc h ASN 135 CO -0.17 0.86 -0.30 0.44 -1.65 0.00 0.00 177.43 176.61 2pgc h ASP 136 N 0.28 0.00 -0.35 5.81 3.32 0.27 -2.92 116.42 122.83 2pgc h ASP 136 Ca 0.01 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.06 2pgc h ASP 136 Cb 1.03 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.58 2pgc h ASP 136 CO 0.09 0.30 0.00 0.35 -1.72 0.00 0.00 179.24 178.26 2pgc n THR 137 N -3.64 0.44 -0.25 0.35 -2.24 -0.48 -4.58 114.28 103.88 2pgc n THR 137 Ca -0.01 -0.72 0.19 0.00 -2.27 0.00 0.00 64.05 61.24 2pgc n THR 137 Cb 0.42 1.06 0.50 0.00 -2.10 0.00 0.00 70.33 70.21 2pgc n THR 137 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2pgc h ALA 138 N 4.55 2.18 -0.16 6.98 0.00 -1.26 -0.15 119.26 131.41 2pgc h ALA 138 Ca 0.00 0.02 -0.12 0.00 0.00 0.00 0.00 54.91 54.81 2pgc h ALA 138 Cb 1.00 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.75 2pgc h ALA 138 CO 0.00 -0.48 -0.42 0.66 0.00 0.00 0.00 179.25 179.01 2pgc h SER 139 N 0.42 0.38 -0.84 0.00 4.64 -1.83 -2.18 113.55 114.15 2pgc h SER 139 Ca 0.48 -0.17 0.16 0.00 -0.47 0.00 0.00 61.79 61.80 2pgc h SER 139 Cb 1.18 -0.11 -0.10 0.00 -0.31 0.00 0.00 62.40 63.06 2pgc h SER 139 CO -0.19 0.76 0.40 0.00 -0.87 0.00 0.00 176.83 176.93 2pgc h PHE 141 N 0.53 -0.18 -0.39 0.00 0.04 -1.51 -3.15 116.94 112.29 2pgc h PHE 141 Ca 0.47 -0.00 -0.00 0.00 2.80 0.00 0.00 57.97 61.24 2pgc h PHE 141 Cb 0.74 0.06 -0.02 0.00 2.20 0.00 0.00 35.95 38.93 2pgc h PHE 141 CO -0.12 0.21 0.24 -0.22 -0.60 0.00 0.00 178.31 177.82 2pgc h LYS 142 N -0.95 0.52 -0.92 1.51 1.63 -1.24 -0.28 116.57 116.84 2pgc h LYS 142 Ca -0.02 -0.04 0.11 0.00 -0.85 0.00 0.00 60.65 59.85 2pgc h LYS 142 Cb 0.47 -0.11 -0.08 0.00 -0.60 0.00 0.00 32.23 31.90 2pgc h LYS 142 CO 0.03 0.37 0.55 -0.44 -3.45 0.00 0.00 179.45 176.52 2pgc h ASP 143 N 0.51 0.80 -0.47 4.20 3.32 -0.89 -2.62 116.42 121.26 2pgc h ASP 143 Ca 0.14 0.05 0.00 0.00 0.02 0.00 0.00 57.03 57.24 2pgc h ASP 143 Cb -0.02 -0.10 0.00 0.00 0.22 0.00 0.00 39.33 39.43 2pgc h ASP 143 CO -0.03 0.43 0.00 0.59 -1.72 0.00 0.00 179.24 178.51 2pgc n ASN 144 N -4.69 2.90 0.00 6.45 3.02 -0.89 -4.92 115.26 117.13 2pgc n ASN 144 Ca 0.17 -1.96 0.00 0.00 -0.03 0.00 0.00 54.58 52.76 2pgc n ASN 144 Cb 0.33 -0.31 0.00 0.00 -0.61 0.00 0.00 39.78 39.19 2pgc n ASN 144 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2pgc n GLY 145 N 1.38 0.90 3.78 7.41 0.00 -0.93 -4.58 105.19 113.15 2pgc n GLY 145 Ca 0.19 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.79 2pgc n GLY 145 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2pgc n ALA 146 N -0.55 2.40 -0.13 4.61 0.00 -0.17 -4.39 120.51 122.29 2pgc n ALA 146 Ca 0.00 0.34 -0.27 0.00 0.00 0.00 0.00 53.44 53.51 2pgc n ALA 146 Cb 0.00 -2.42 -0.10 0.00 0.00 0.00 0.00 19.45 16.93 2pgc n ALA 146 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2pgc n LEU 147 N 0.43 1.93 -4.18 0.00 4.77 0.61 -4.54 117.00 116.01 2pgc n LEU 147 Ca 0.01 0.36 -0.16 0.00 -0.03 0.00 0.00 56.01 56.20 2pgc n LEU 147 Cb 0.39 -0.85 -0.11 0.00 -2.33 0.00 0.00 43.42 40.52 2pgc n LEU 147 CO 0.64 0.44 -0.43 0.42 -1.33 0.00 0.00 177.39 177.13 2pgc s THR 148 N -2.49 1.03 -0.06 -5.08 -4.23 -1.23 -1.29 115.64 102.29 2pgc s THR 148 Ca -0.36 -1.52 -0.03 0.00 -1.18 0.00 0.00 61.69 58.61 2pgc s THR 148 Cb 0.12 -1.25 0.04 0.00 1.34 0.00 0.00 72.50 72.75 2pgc s THR 148 CO 0.51 -0.42 0.12 -0.22 -0.54 0.00 0.00 174.62 174.07 2pgc s LEU 149 N -2.19 0.36 0.04 4.79 0.20 -1.26 -1.07 118.68 119.56 2pgc s LEU 149 Ca 0.03 0.25 0.05 0.00 0.69 0.00 0.00 54.13 55.14 2pgc s LEU 149 Cb -0.06 0.20 -0.02 0.00 -0.43 0.00 0.00 46.19 45.88 2pgc s LEU 149 CO 0.01 -0.20 -0.14 -0.13 -0.29 0.00 0.00 176.35 175.61 2pgc s ARG 150 N 1.75 0.89 -0.13 1.98 0.52 -0.02 -4.95 118.95 119.00 2pgc s ARG 150 Ca -0.02 -0.78 -0.11 0.00 -0.52 0.00 0.00 55.73 54.30 2pgc s ARG 150 Cb -0.12 -0.89 0.04 0.00 0.52 0.00 0.00 34.95 34.50 2pgc s ARG 150 CO -0.05 0.21 0.34 0.12 0.02 0.00 0.00 175.30 175.94 2pgc s PHE 151 N -0.93 -0.39 0.00 -0.53 5.36 -1.26 -0.55 117.98 119.68 2pgc s PHE 151 Ca 0.00 0.93 0.00 0.00 -0.96 0.00 0.00 56.93 56.91 2pgc s PHE 151 Cb -0.08 0.13 0.00 0.00 -0.34 0.00 0.00 43.02 42.73 2pgc s PHE 151 CO 0.01 -0.20 0.00 0.41 -1.46 0.00 0.00 175.22 173.99 2pgc n GLY 152 N 3.09 0.73 3.27 13.12 0.00 -0.69 -0.20 105.19 124.51 2pgc n GLY 152 Ca -0.15 -0.56 -0.28 0.00 0.00 0.00 0.00 46.02 45.03 2pgc n GLY 152 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2pgc s ASN 153 N 2.00 2.66 0.02 1.61 -0.87 -1.25 -0.03 114.94 119.08 2pgc s ASN 153 Ca 0.00 -0.48 -0.30 0.00 -1.57 0.00 0.00 52.86 50.51 2pgc s ASN 153 Cb 0.00 -0.26 -0.07 0.00 -0.02 0.00 0.00 41.25 40.90 2pgc s ASN 153 CO 0.00 0.23 1.64 -0.76 -2.57 0.00 0.00 177.10 175.64 2pgc s LEU 154 N -0.89 4.35 0.22 0.60 1.43 -0.42 -1.23 118.68 122.74 2pgc s LEU 154 Ca 0.09 2.37 0.17 0.00 -1.03 0.00 0.00 54.13 55.73 2pgc s LEU 154 Cb -0.09 -3.55 0.02 0.00 0.03 0.00 0.00 46.19 42.60 2pgc s LEU 154 CO 0.01 -0.89 1.24 -0.07 0.23 0.00 0.00 176.35 176.87 2pgc h LEU 155 N 9.13 0.00 -8.90 1.79 3.38 -1.13 0.20 115.31 119.78 2pgc h LEU 155 Ca -0.41 0.00 -0.38 0.00 0.09 0.00 0.00 57.88 57.17 2pgc h LEU 155 Cb 1.19 0.00 -0.14 0.00 0.09 0.00 0.00 40.66 41.80 2pgc h LEU 155 CO 0.93 0.45 -0.66 0.42 0.09 0.00 0.00 178.44 179.68 2pgc s THR 156 N -3.00 1.05 0.00 0.22 -4.23 -1.19 -4.84 115.64 103.64 2pgc s THR 156 Ca 0.02 -2.03 0.00 0.00 -1.18 0.00 0.00 61.69 58.49 2pgc s THR 156 Cb 0.08 -2.36 0.00 0.00 1.34 0.00 0.00 72.50 71.56 2pgc s THR 156 CO 0.76 -0.32 0.00 0.61 -0.54 0.00 0.00 174.62 175.14 2pgc n GLY 157 N -0.43 -3.82 0.00 3.99 0.00 -1.26 -3.84 105.19 99.84 2pgc n GLY 157 Ca -0.05 -2.03 0.10 0.00 0.00 0.00 0.00 46.02 44.04 2pgc n GLY 157 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2pgc n SER 158 N -0.11 0.00 -1.27 1.61 7.64 -1.26 -2.08 113.62 118.15 2pgc n SER 158 Ca 0.00 0.50 -0.04 0.00 1.01 0.00 0.00 58.87 60.34 2pgc n SER 158 Cb 0.00 -0.50 0.21 0.00 -1.01 0.00 0.00 64.21 62.91 2pgc n SER 158 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 2pgc n ASN 159 N -1.50 3.03 -4.62 6.43 4.13 -1.26 -5.04 115.26 116.42 2pgc n ASN 159 Ca 0.05 -3.57 -0.47 0.00 1.68 0.00 0.00 54.58 52.27 2pgc n ASN 159 Cb 0.24 -0.65 -0.03 0.00 -1.54 0.00 0.00 39.78 37.80 2pgc n ASN 159 CO 0.00 0.00 0.00 0.55 0.28 0.00 0.00 177.26 178.09 2pgc n VAL 160 N -0.96 0.90 0.00 2.41 3.14 -0.88 -1.22 118.33 121.72 2pgc n VAL 160 Ca 0.34 -0.23 0.00 0.00 -2.96 0.00 0.00 64.34 61.50 2pgc n VAL 160 Cb 1.10 -1.12 0.00 0.00 -1.06 0.00 0.00 33.84 32.76 2pgc n VAL 160 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 2pgc n GLY 161 N 2.09 2.98 3.65 7.55 0.00 0.06 -4.99 105.19 116.54 2pgc n GLY 161 Ca 0.14 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.76 2pgc n GLY 161 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2pgc n ASN 162 N 0.12 1.55 -4.81 1.61 5.03 -0.36 -4.62 115.26 113.78 2pgc n ASN 162 Ca 0.00 0.94 -0.34 0.00 0.87 0.00 0.00 54.58 56.05 2pgc n ASN 162 Cb 0.00 -1.44 -0.06 0.00 -1.02 0.00 0.00 39.78 37.26 2pgc n ASN 162 CO 0.00 0.00 0.00 -0.31 -1.83 0.00 0.00 177.26 175.12 2pgc s TYR 163 N -1.37 3.36 -0.03 3.10 1.51 0.51 -1.30 117.35 123.13 2pgc s TYR 163 Ca 0.70 1.64 0.01 0.00 -1.01 0.00 0.00 57.07 58.41 2pgc s TYR 163 Cb -0.46 -2.90 0.02 0.00 -0.11 0.00 0.00 41.96 38.51 2pgc s TYR 163 CO 0.51 -0.14 -0.04 -1.17 -1.11 0.00 0.00 175.55 173.61 2pgc s LEU 164 N -2.95 1.41 -0.07 -1.29 2.96 0.96 -0.97 118.68 118.73 2pgc s LEU 164 Ca 0.60 -0.10 0.05 0.00 -0.22 0.00 0.00 54.13 54.45 2pgc s LEU 164 Cb -0.12 -0.37 -0.00 0.00 0.50 0.00 0.00 46.19 46.20 2pgc s LEU 164 CO 0.17 -0.04 -0.22 -0.22 -1.32 0.00 0.00 176.35 174.72 2pgc s LEU 165 N 0.75 2.00 -0.11 -0.68 2.96 0.11 -1.70 118.68 122.01 2pgc s LEU 165 Ca -0.09 -0.48 0.02 0.00 -0.22 0.00 0.00 54.13 53.36 2pgc s LEU 165 Cb -0.12 -1.25 0.01 0.00 0.50 0.00 0.00 46.19 45.33 2pgc s LEU 165 CO -0.00 0.17 -0.17 -0.83 -1.32 0.00 0.00 176.35 174.19 2pgc s GLY 166 N 0.17 1.11 -0.06 7.98 0.00 0.28 -0.62 107.32 116.18 2pgc s GLY 166 Ca -0.11 -0.80 0.02 0.00 0.00 0.00 0.00 44.72 43.83 2pgc s GLY 166 CO 0.06 0.09 -0.09 0.14 0.00 0.00 0.00 173.10 173.29 2pgc s VAL 167 N 0.82 0.92 0.05 1.40 1.01 -0.65 -0.84 120.40 123.11 2pgc s VAL 167 Ca -0.09 -0.34 -0.11 0.00 0.00 0.00 0.00 61.98 61.43 2pgc s VAL 167 Cb -0.16 -0.88 -0.06 0.00 0.00 0.00 0.00 36.38 35.29 2pgc s VAL 167 CO 0.01 0.31 0.40 -0.83 0.00 0.00 0.00 175.10 174.98 2pgc s GLY 168 N 0.85 2.38 0.04 4.51 0.00 -0.24 -1.18 107.32 113.70 2pgc s GLY 168 Ca -0.12 -0.33 0.01 0.00 0.00 0.00 0.00 44.72 44.28 2pgc s GLY 168 CO 0.01 -0.06 -0.05 -0.19 0.00 0.00 0.00 173.10 172.82 2pgc s TYR 169 N -1.28 0.53 -0.38 1.90 2.02 0.54 -0.29 117.35 120.40 2pgc s TYR 169 Ca 0.29 -0.68 0.23 0.00 -0.37 0.00 0.00 57.07 56.54 2pgc s TYR 169 Cb -0.15 -0.34 0.18 0.00 -0.40 0.00 0.00 41.96 41.25 2pgc s TYR 169 CO 0.16 -0.19 1.26 -1.00 -1.57 0.00 0.00 175.55 174.22 2pgc h PRO 170 N 4.06 0.00 0.00 -1.71 0.13 -1.85 -0.66 132.00 131.97 2pgc h PRO 170 Ca -0.34 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.79 2pgc h PRO 170 Cb 1.19 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.32 2pgc h PRO 170 CO 0.49 0.00 0.00 -1.13 -0.23 0.00 0.00 178.00 177.13 2pgc n SER 171 N -2.66 0.58 0.00 1.44 3.41 -1.26 -4.48 113.62 110.65 2pgc n SER 171 Ca 0.02 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.63 2pgc n SER 171 Cb 0.52 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.47 2pgc n SER 171 CO 0.00 0.00 0.00 1.21 -0.16 0.00 0.00 175.04 176.09 2pgc n GLU 173 N 0.00 0.00 -0.17 4.33 2.13 -1.26 -2.99 120.64 122.68 2pgc n GLU 173 Ca 0.00 0.00 -0.02 0.00 0.66 0.00 0.00 57.16 57.80 2pgc n GLU 173 Cb 0.00 0.00 0.20 0.00 0.27 0.00 0.00 31.44 31.91 2pgc n GLU 173 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 2pgc h ALA 174 N 0.00 1.28 -0.03 4.31 0.00 -1.97 -0.66 119.26 122.20 2pgc h ALA 174 Ca 0.00 -0.15 -0.00 0.00 0.00 0.00 0.00 54.91 54.75 2pgc h ALA 174 Cb 0.00 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 17.54 2pgc h ALA 174 CO 0.00 0.54 0.01 0.82 0.00 0.00 0.00 179.25 180.62 2pgc h ILE 175 N 0.90 1.14 -0.32 0.00 2.04 -1.83 -0.23 117.51 119.19 2pgc h ILE 175 Ca 0.21 -0.40 0.06 0.00 1.00 0.00 0.00 64.86 65.74 2pgc h ILE 175 Cb 0.16 1.36 -0.06 0.00 -0.74 0.00 0.00 36.82 37.54 2pgc h ILE 175 CO -0.02 0.11 -0.04 -0.08 0.00 0.00 0.00 178.15 178.12 2pgc h GLU 176 N -0.12 0.04 -0.46 2.37 4.81 -1.75 -0.53 114.58 118.94 2pgc h GLU 176 Ca 0.01 -0.00 -0.10 0.00 -0.13 0.00 0.00 59.36 59.13 2pgc h GLU 176 Cb 0.17 -0.01 -0.02 0.00 0.63 0.00 0.00 28.75 29.52 2pgc h GLU 176 CO -0.00 0.03 -0.12 0.87 -0.73 0.00 0.00 179.01 179.05 2pgc h LYS 177 N 0.05 0.85 -0.14 1.92 1.79 -1.04 -0.24 116.57 119.76 2pgc h LYS 177 Ca 0.16 -0.30 0.00 0.00 -2.18 0.00 0.00 60.65 58.33 2pgc h LYS 177 Cb 0.23 -0.06 -0.01 0.00 -1.58 0.00 0.00 32.23 30.81 2pgc h LYS 177 CO -0.30 0.93 0.09 1.15 -1.08 0.00 0.00 179.45 180.24 2pgc h THR 178 N 0.77 1.03 0.00 -0.16 2.02 -0.56 -2.57 112.91 113.44 2pgc h THR 178 Ca 0.12 -0.06 -0.12 0.00 0.77 0.00 0.00 66.41 67.12 2pgc h THR 178 Cb 0.64 0.83 -0.02 0.00 -1.74 0.00 0.00 68.15 67.86 2pgc h THR 178 CO 0.04 0.03 -0.57 1.88 0.37 0.00 0.00 175.52 177.28 2pgc h TYR 179 N 0.18 0.00 -0.40 3.16 0.05 -0.86 0.60 116.97 119.69 2pgc h TYR 179 Ca 0.05 0.00 0.05 0.00 0.05 0.00 0.00 58.73 58.88 2pgc h TYR 179 Cb -0.02 0.00 -0.05 0.00 1.01 0.00 0.00 36.73 37.68 2pgc h TYR 179 CO -0.07 0.57 0.13 -0.44 -1.05 0.00 0.00 178.16 177.30 2pgc h ASP 180 N 0.00 0.13 -0.05 3.88 3.32 -0.87 -2.31 116.42 120.53 2pgc h ASP 180 Ca -0.01 0.05 -0.11 0.00 0.02 0.00 0.00 57.03 56.99 2pgc h ASP 180 Cb 1.11 0.04 0.01 0.00 0.22 0.00 0.00 39.33 40.70 2pgc h ASP 180 CO 0.07 0.11 -0.38 -0.08 -1.72 0.00 0.00 179.24 177.24 2pgc h GLU 181 N 0.29 0.34 -0.36 3.56 4.81 -1.11 -3.34 114.58 118.78 2pgc h GLU 181 Ca 0.19 -0.31 0.02 0.00 -0.13 0.00 0.00 59.36 59.13 2pgc h GLU 181 Cb 0.18 0.07 -0.02 0.00 0.63 0.00 0.00 28.75 29.61 2pgc h GLU 181 CO -0.20 0.96 0.20 1.25 -0.73 0.00 0.00 179.01 180.50 2pgc h LEU 182 N -0.18 0.32 -2.05 1.64 5.85 -0.82 -2.32 115.31 117.75 2pgc h LEU 182 Ca -0.03 0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.68 2pgc h LEU 182 Cb 1.06 -0.06 -0.00 0.00 0.37 0.00 0.00 40.66 42.03 2pgc h LEU 182 CO 0.08 0.23 -0.07 -0.07 -0.34 0.00 0.00 178.44 178.27 2pgc h LEU 183 N 0.41 0.00 -4.13 2.25 3.38 -1.56 -2.46 115.31 113.21 2pgc h LEU 183 Ca 0.14 0.00 -0.65 0.00 0.09 0.00 0.00 57.88 57.46 2pgc h LEU 183 Cb 0.02 0.00 -0.34 0.00 0.09 0.00 0.00 40.66 40.43 2pgc h LEU 183 CO -0.07 0.07 0.32 0.00 0.09 0.00 0.00 178.44 178.84 2pgc n ALA 184 N -2.19 5.91 -2.59 1.53 0.00 -0.88 -4.79 120.51 117.50 2pgc n ALA 184 Ca -0.01 -3.73 -0.29 0.00 0.00 0.00 0.00 53.44 49.40 2pgc n ALA 184 Cb 0.22 -1.32 -0.16 0.00 0.00 0.00 0.00 19.45 18.19 2pgc n ALA 184 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 2pgc s HIS 185 N -3.78 2.12 0.14 0.00 5.04 -0.93 -5.01 115.29 112.87 2pgc s HIS 185 Ca 0.58 -0.52 -0.17 0.00 -1.54 0.00 0.00 55.06 53.41 2pgc s HIS 185 Cb 0.46 -1.38 -0.01 0.00 0.04 0.00 0.00 32.58 31.68 2pgc s HIS 185 CO -0.07 -0.12 1.80 0.66 -2.34 0.00 0.00 174.74 174.67 2pgc h SER 186 N 5.86 0.38 -0.54 9.88 4.64 -1.93 -1.86 113.55 129.98 2pgc h SER 186 Ca -0.36 -0.01 0.05 0.00 -0.47 0.00 0.00 61.79 61.00 2pgc h SER 186 Cb 1.15 -0.10 -0.03 0.00 -0.31 0.00 0.00 62.40 63.12 2pgc h SER 186 CO 0.47 0.28 0.36 0.28 -0.87 0.00 0.00 176.83 177.35 2pgc h SER 187 N 0.45 0.46 0.07 4.97 0.02 -1.94 0.16 113.55 117.74 2pgc h SER 187 Ca 0.12 -0.00 -0.00 0.00 -0.84 0.00 0.00 61.79 61.07 2pgc h SER 187 Cb -0.05 -0.10 0.00 0.00 0.14 0.00 0.00 62.40 62.39 2pgc h SER 187 CO -0.03 0.31 -0.03 0.22 -1.14 0.00 0.00 176.83 176.16 2pgc h TYR 188 N 0.53 -0.09 -0.47 3.45 3.20 -1.62 -0.91 116.97 121.06 2pgc h TYR 188 Ca 0.23 -0.00 0.04 0.00 3.14 0.00 0.00 58.73 62.14 2pgc h TYR 188 Cb 0.24 0.03 -0.03 0.00 1.54 0.00 0.00 36.73 38.51 2pgc h TYR 188 CO -0.00 0.23 0.31 0.87 -1.64 0.00 0.00 178.16 177.93 2pgc h LYS 189 N -0.40 0.45 -0.40 1.82 1.57 -0.78 -1.13 116.57 117.71 2pgc h LYS 189 Ca -0.01 -0.03 -0.12 0.00 -1.87 0.00 0.00 60.65 58.62 2pgc h LYS 189 Cb 0.35 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 32.55 2pgc h LYS 189 CO 0.02 0.30 -0.23 1.49 -0.57 0.00 0.00 179.45 180.45 2pgc h GLU 190 N 0.47 0.86 -1.99 3.15 4.81 -0.92 -3.25 114.58 117.71 2pgc h GLU 190 Ca 0.19 -0.39 0.00 0.00 -0.13 0.00 0.00 59.36 59.03 2pgc h GLU 190 Cb 0.19 -0.02 0.00 0.00 0.63 0.00 0.00 28.75 29.55 2pgc h GLU 190 CO -0.05 1.04 0.00 -0.11 -0.73 0.00 0.00 179.01 179.16 2pgc n LEU 191 N -4.20 0.00 0.00 1.64 7.94 -0.36 -3.93 117.00 118.10 2pgc n LEU 191 Ca -0.02 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.88 2pgc n LEU 191 Cb 0.45 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.40 2pgc n LEU 191 CO 0.46 0.00 0.00 0.35 -1.11 0.00 0.00 177.39 177.09 2pgc n THR 193 N 1.77 0.00 -0.57 1.96 -2.24 -1.23 -1.33 114.28 112.64 2pgc n THR 193 Ca 0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 2pgc n THR 193 Cb 0.00 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.23 2pgc n THR 193 CO 0.00 0.00 0.00 2.22 -0.57 0.00 0.00 175.07 176.72 2pgc n PHE 194 N 0.00 0.00 -4.02 4.78 1.16 -1.25 -5.05 117.46 113.07 2pgc n PHE 194 Ca 0.00 -0.12 -0.16 0.00 -1.87 0.00 0.00 57.45 55.31 2pgc n PHE 194 Cb 0.00 -0.01 -0.15 0.00 -1.61 0.00 0.00 39.48 37.71 2pgc n PHE 194 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 2pgc s ALA 195 N -0.24 0.31 -0.25 1.98 0.00 -0.44 -4.51 121.76 118.61 2pgc s ALA 195 Ca 0.00 -0.03 -0.03 0.00 0.00 0.00 0.00 51.96 51.90 2pgc s ALA 195 Cb 0.00 -0.17 0.02 0.00 0.00 0.00 0.00 23.12 22.96 2pgc s ALA 195 CO 0.00 0.02 -0.03 0.21 0.00 0.00 0.00 175.76 175.96 2pgc s LYS 196 N 0.35 2.98 0.07 0.00 2.20 -0.53 -4.94 119.74 119.87 2pgc s LYS 196 Ca -0.03 -0.89 -0.31 0.00 -0.36 0.00 0.00 55.97 54.38 2pgc s LYS 196 Cb -0.06 -3.07 -0.08 0.00 -1.51 0.00 0.00 37.83 33.11 2pgc s LYS 196 CO -0.01 -0.38 1.50 0.08 -0.36 0.00 0.00 175.35 176.19 2pgc s VAL 197 N 1.39 3.26 -0.21 4.02 1.01 -1.26 -0.69 120.40 127.92 2pgc s VAL 197 Ca 0.02 0.78 0.13 0.00 0.00 0.00 0.00 61.98 62.91 2pgc s VAL 197 Cb -0.16 -3.50 0.42 0.00 0.00 0.00 0.00 36.38 33.13 2pgc s VAL 197 CO -0.03 0.02 1.27 -0.46 0.00 0.00 0.00 175.10 175.91 2pgc n ASN 198 N 4.91 2.19 -3.65 3.32 0.23 -0.20 -4.94 115.26 117.13 2pgc n ASN 198 Ca 0.14 -3.62 -0.02 0.00 -0.53 0.00 0.00 54.58 50.54 2pgc n ASN 198 Cb 0.42 -0.53 -0.07 0.00 -2.08 0.00 0.00 39.78 37.52 2pgc n ASN 198 CO 0.00 0.00 0.00 -0.60 -0.93 0.00 0.00 177.26 175.73 2pgc s ARG 200 N -3.13 0.29 0.02 -3.83 3.52 -1.26 -4.99 118.95 109.58 2pgc s ARG 200 Ca 0.38 0.46 -0.14 0.00 -0.13 0.00 0.00 55.73 56.31 2pgc s ARG 200 Cb 0.36 0.08 0.02 0.00 -1.56 0.00 0.00 34.95 33.85 2pgc s ARG 200 CO -0.02 -0.05 0.30 -0.80 -0.81 0.00 0.00 175.30 173.92 2pgc s ASN 201 N 0.96 -0.14 -0.15 -2.12 0.01 -0.34 -4.83 114.94 108.33 2pgc s ASN 201 Ca -0.05 -0.09 -0.05 0.00 -0.71 0.00 0.00 52.86 51.95 2pgc s ASN 201 Cb -0.04 0.34 -0.04 0.00 0.41 0.00 0.00 41.25 41.92 2pgc s ASN 201 CO -0.12 -0.55 0.04 -0.63 -1.51 0.00 0.00 177.10 174.33 2pgc s ILE 202 N -2.07 4.62 -0.13 0.60 1.01 -1.26 -1.29 121.20 122.68 2pgc s ILE 202 Ca -0.08 -0.11 -0.03 0.00 0.00 0.00 0.00 60.65 60.43 2pgc s ILE 202 Cb -0.03 -3.03 -0.03 0.00 0.01 0.00 0.00 42.46 39.38 2pgc s ILE 202 CO -0.00 0.52 -0.03 -0.63 0.00 0.00 0.00 174.94 174.80 2pgc s ILE 203 N -0.10 3.98 -0.27 2.92 1.01 0.14 -0.28 121.20 128.60 2pgc s ILE 203 Ca 0.06 -0.34 -0.15 0.00 0.00 0.00 0.00 60.65 60.22 2pgc s ILE 203 Cb -0.12 -2.71 -0.04 0.00 0.01 0.00 0.00 42.46 39.60 2pgc s ILE 203 CO 0.01 0.53 0.36 -0.75 0.00 0.00 0.00 174.94 175.09 2pgc s LYS 204 N -0.09 4.02 0.10 2.79 2.20 -0.10 -1.29 119.74 127.36 2pgc s LYS 204 Ca 0.02 0.01 -0.31 0.00 -0.36 0.00 0.00 55.97 55.34 2pgc s LYS 204 Cb -0.13 -3.65 -0.08 0.00 -1.51 0.00 0.00 37.83 32.46 2pgc s LYS 204 CO 0.02 -0.26 1.48 0.42 -0.36 0.00 0.00 175.35 176.66 2pgc s ILE 205 N 2.01 3.17 -2.89 5.43 -1.09 -0.20 -1.05 121.20 126.59 2pgc s ILE 205 Ca 0.14 0.76 0.23 0.00 -2.23 0.00 0.00 60.65 59.56 2pgc s ILE 205 Cb -0.16 -3.49 0.18 0.00 -1.58 0.00 0.00 42.46 37.41 2pgc s ILE 205 CO 0.10 0.04 1.23 0.18 -1.23 0.00 0.00 174.94 175.26