#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2pgc h ASN 3 N 0.00 0.00 -3.84 4.04 -1.07 -1.98 -3.46 115.58 109.27 2pgc h ASN 3 Ca 0.00 0.00 -0.50 0.00 0.07 0.00 0.00 56.30 55.87 2pgc h ASN 3 Cb 0.00 0.00 0.02 0.00 -2.07 0.00 0.00 38.32 36.27 2pgc h ASN 3 CO 0.00 0.00 0.48 -0.63 0.07 0.00 0.00 177.43 177.35 2pgc s ILE 4 N -3.24 3.42 0.41 6.14 1.09 -1.26 -4.57 121.20 123.20 2pgc s ILE 4 Ca 0.07 1.38 0.02 0.00 -1.10 0.00 0.00 60.65 61.02 2pgc s ILE 4 Cb 0.09 -3.86 0.02 0.00 -1.06 0.00 0.00 42.46 37.65 2pgc s ILE 4 CO 0.60 0.29 0.15 0.59 -0.10 0.00 0.00 174.94 176.47 2pgc n ASN 5 N 0.94 2.77 -4.11 3.58 3.02 -0.58 -4.81 115.26 116.07 2pgc n ASN 5 Ca -0.00 -2.62 -0.11 0.00 -0.03 0.00 0.00 54.58 51.82 2pgc n ASN 5 Cb 0.45 0.13 -0.10 0.00 -0.61 0.00 0.00 39.78 39.65 2pgc n ASN 5 CO 0.00 0.00 0.00 -0.31 -2.62 0.00 0.00 177.26 174.33 2pgc s TYR 6 N -2.30 0.73 -0.05 3.10 1.51 0.08 -0.92 117.35 119.50 2pgc s TYR 6 Ca 0.11 -0.78 -0.00 0.00 -1.01 0.00 0.00 57.07 55.39 2pgc s TYR 6 Cb -0.01 -0.44 0.03 0.00 -0.11 0.00 0.00 41.96 41.43 2pgc s TYR 6 CO 0.07 -0.16 -0.01 0.08 -1.11 0.00 0.00 175.55 174.42 2pgc s VAL 7 N -2.84 0.33 -0.15 0.71 1.01 0.54 -1.57 120.40 118.44 2pgc s VAL 7 Ca 0.03 0.06 -0.05 0.00 0.00 0.00 0.00 61.98 62.02 2pgc s VAL 7 Cb -0.00 -0.44 -0.03 0.00 0.00 0.00 0.00 36.38 35.90 2pgc s VAL 7 CO -0.04 0.21 0.02 -0.63 0.00 0.00 0.00 175.10 174.66 2pgc s ILE 8 N 1.41 4.43 -0.13 2.22 1.09 -0.53 0.15 121.20 129.83 2pgc s ILE 8 Ca -0.04 -0.18 0.02 0.00 -1.10 0.00 0.00 60.65 59.36 2pgc s ILE 8 Cb -0.13 -2.95 0.01 0.00 -1.06 0.00 0.00 42.46 38.33 2pgc s ILE 8 CO -0.03 0.51 -0.20 -0.76 -0.10 0.00 0.00 174.94 174.36 2pgc s LEU 9 N 0.02 2.01 -0.03 2.97 1.02 0.19 -1.28 118.68 123.57 2pgc s LEU 9 Ca 0.04 -0.56 0.07 0.00 0.02 0.00 0.00 54.13 53.69 2pgc s LEU 9 Cb -0.13 -1.36 -0.01 0.00 0.02 0.00 0.00 46.19 44.71 2pgc s LEU 9 CO 0.02 0.06 -0.23 -0.89 0.02 0.00 0.00 176.35 175.32 2pgc s THR 10 N 0.89 1.86 -0.08 5.49 2.01 0.52 -1.50 115.64 124.84 2pgc s THR 10 Ca -0.06 -0.99 0.04 0.00 0.31 0.00 0.00 61.69 60.99 2pgc s THR 10 Cb -0.15 -1.56 0.00 0.00 0.01 0.00 0.00 72.50 70.81 2pgc s THR 10 CO -0.03 0.52 -0.19 -0.69 -0.69 0.00 0.00 174.62 173.55 2pgc s VAL 11 N -0.38 1.66 0.02 3.82 1.01 0.72 -0.37 120.40 126.89 2pgc s VAL 11 Ca 0.04 -0.80 0.03 0.00 0.00 0.00 0.00 61.98 61.25 2pgc s VAL 11 Cb -0.11 -1.45 -0.02 0.00 0.00 0.00 0.00 36.38 34.80 2pgc s VAL 11 CO 0.01 0.47 -0.08 0.00 0.00 0.00 0.00 175.10 175.49 2pgc s ALA 12 N 0.39 0.68 0.07 5.51 0.00 -0.43 -1.29 121.76 126.68 2pgc s ALA 12 Ca -0.15 -0.57 -0.23 0.00 0.00 0.00 0.00 51.96 51.02 2pgc s ALA 12 Cb -0.16 -0.08 -0.06 0.00 0.00 0.00 0.00 23.12 22.82 2pgc s ALA 12 CO 0.06 0.09 0.69 -1.54 0.00 0.00 0.00 175.76 175.06 2pgc s SER 13 N -0.89 7.18 -0.02 0.00 1.04 -0.44 -0.95 113.70 119.63 2pgc s SER 13 Ca -0.02 1.40 0.00 0.00 0.48 0.00 0.00 55.95 57.81 2pgc s SER 13 Cb -0.06 -2.43 0.02 0.00 0.10 0.00 0.00 66.02 63.65 2pgc s SER 13 CO 0.00 0.15 0.02 -0.69 0.98 0.00 0.00 173.24 173.70 2pgc s VAL 14 N -0.63 -0.01 0.26 5.02 1.01 -1.26 -1.22 120.40 123.57 2pgc s VAL 14 Ca 0.34 0.15 -0.30 0.00 0.00 0.00 0.00 61.98 62.17 2pgc s VAL 14 Cb -0.20 -0.09 -0.14 0.00 0.00 0.00 0.00 36.38 35.95 2pgc s VAL 14 CO 0.22 0.08 1.26 0.47 0.00 0.00 0.00 175.10 177.13 2pgc n ASP 15 N 3.91 2.26 -0.30 3.32 8.00 -0.82 -4.86 116.55 128.06 2pgc n ASP 15 Ca -0.24 1.17 0.03 0.00 0.71 0.00 0.00 54.79 56.46 2pgc n ASP 15 Cb 0.52 -1.38 0.23 0.00 -0.02 0.00 0.00 41.12 40.47 2pgc n ASP 15 CO 0.00 0.00 0.00 0.15 -0.39 0.00 0.00 177.20 176.96 2pgc h PHE 16 N 3.24 1.05 -0.05 1.24 3.57 -1.96 -2.15 116.94 121.88 2pgc h PHE 16 Ca -0.44 0.03 -0.04 0.00 3.53 0.00 0.00 57.97 61.05 2pgc h PHE 16 Cb 1.30 -0.35 -0.01 0.00 2.79 0.00 0.00 35.95 39.69 2pgc h PHE 16 CO 0.53 0.57 -0.14 0.66 -2.23 0.00 0.00 178.31 177.70 2pgc h SER 17 N 1.05 0.06 0.73 0.41 4.64 -2.00 -2.62 113.55 115.83 2pgc h SER 17 Ca 0.37 -0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.68 2pgc h SER 17 Cb 0.13 -0.02 0.00 0.00 -0.31 0.00 0.00 62.40 62.20 2pgc h SER 17 CO -0.13 0.21 -0.10 0.00 -0.87 0.00 0.00 176.83 175.94 2pgc n TYR 18 N -4.34 0.00 -0.20 4.77 9.36 -0.81 -4.35 117.16 121.60 2pgc n TYR 18 Ca -0.02 0.00 0.01 0.00 3.32 0.00 0.00 57.90 61.21 2pgc n TYR 18 Cb 0.23 -0.37 0.11 0.00 -0.63 0.00 0.00 39.34 38.68 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 0.09 0.22 -0.27 2.98 3.08 -1.47 -2.48 114.38 116.54 2pgc h ARG 19 Ca 0.00 -0.01 -0.17 0.00 0.07 0.00 0.00 59.98 59.87 2pgc h ARG 19 Cb 0.44 -0.05 0.00 0.00 0.08 0.00 0.00 29.97 30.44 2pgc h ARG 19 CO 0.00 0.15 -0.49 1.49 -1.07 0.00 0.00 179.97 180.04 2pgc h GLU 20 N 0.23 0.80 -1.41 0.04 4.81 -1.82 -2.19 114.58 115.03 2pgc h GLU 20 Ca 0.31 -0.51 0.00 0.00 -0.13 0.00 0.00 59.36 59.04 2pgc h GLU 20 Cb 0.48 0.06 0.00 0.00 0.63 0.00 0.00 28.75 29.92 2pgc h GLU 20 CO -0.42 1.14 0.00 2.41 -0.73 0.00 0.00 179.01 181.40 2pgc n THR 21 N -4.09 0.06 0.00 0.32 -1.04 -0.93 -2.27 114.28 106.32 2pgc n THR 21 Ca -0.05 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.96 2pgc n THR 21 Cb 0.59 -0.40 0.00 0.00 -1.82 0.00 0.00 70.33 68.70 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 0.82 0.00 -0.05 2.41 0.00 -0.83 -0.70 120.51 122.16 2pgc n ALA 23 Ca 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 53.44 53.32 2pgc n ALA 23 Cb 0.03 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.42 2pgc n ALA 23 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 177.50 177.57 2pgc h ARG 24 N 0.00 0.28 -1.89 0.00 -0.00 -1.74 -2.38 114.38 108.65 2pgc h ARG 24 Ca 0.00 -0.10 0.00 0.00 -0.00 0.00 0.00 59.98 59.88 2pgc h ARG 24 Cb 0.00 -0.02 0.00 0.00 -0.00 0.00 0.00 29.97 29.95 2pgc h ARG 24 CO 0.00 0.54 0.00 1.28 -0.00 0.00 0.00 179.97 181.79 2pgc n LEU 25 N -4.72 0.42 0.00 0.08 4.77 0.12 -3.06 117.00 114.61 2pgc n LEU 25 Ca -0.05 -0.21 0.00 0.00 -0.03 0.00 0.00 56.01 55.72 2pgc n LEU 25 Cb 0.24 -0.07 0.00 0.00 -2.33 0.00 0.00 43.42 41.25 2pgc n LEU 25 CO 0.36 0.07 0.00 -1.54 -1.33 0.00 0.00 177.39 174.96 2pgc n SER 27 N 1.06 0.00 0.18 -1.43 3.41 -0.90 -1.66 113.62 114.28 2pgc n SER 27 Ca 0.00 0.00 -0.14 0.00 -0.26 0.00 0.00 58.87 58.47 2pgc n SER 27 Cb 0.06 0.00 -0.08 0.00 -0.26 0.00 0.00 64.21 63.93 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 -0.34 -0.32 4.04 0.87 -1.82 -2.03 113.55 113.94 2pgc h SER 28 Ca 0.00 -0.04 0.03 0.00 -1.23 0.00 0.00 61.79 60.54 2pgc h SER 28 Cb 0.00 0.09 -0.02 0.00 -0.44 0.00 0.00 62.40 62.03 2pgc h SER 28 CO 0.00 -0.18 0.22 0.22 -0.53 0.00 0.00 176.83 176.56 2pgc h TYR 29 N -0.49 0.32 -0.21 2.24 3.20 -1.63 -2.13 116.97 118.27 2pgc h TYR 29 Ca -0.04 0.01 -0.02 0.00 3.14 0.00 0.00 58.73 61.81 2pgc h TYR 29 Cb 0.37 -0.11 -0.01 0.00 1.54 0.00 0.00 36.73 38.52 2pgc h TYR 29 CO -0.03 0.19 0.05 0.77 -1.64 0.00 0.00 178.16 177.49 2pgc h SER 30 N 0.33 0.33 -0.46 -2.11 0.02 -1.80 -2.24 113.55 107.63 2pgc h SER 30 Ca 0.13 -0.24 0.09 0.00 -0.84 0.00 0.00 61.79 60.94 2pgc h SER 30 Cb 0.11 -0.09 -0.09 0.00 0.14 0.00 0.00 62.40 62.47 2pgc h SER 30 CO -0.03 0.48 -0.16 0.11 -1.14 0.00 0.00 176.83 176.10 2pgc h LYS 31 N 0.16 -0.05 -0.69 3.45 6.56 -0.72 0.70 116.57 125.98 2pgc h LYS 31 Ca 0.07 0.00 0.07 0.00 -1.06 0.00 0.00 60.65 59.73 2pgc h LYS 31 Cb 0.29 0.01 -0.06 0.00 -0.57 0.00 0.00 32.23 31.90 2pgc h LYS 31 CO 0.00 -0.03 0.37 0.22 -2.06 0.00 0.00 179.45 177.95 2pgc h ASP 32 N -0.05 0.53 -0.28 0.86 3.58 -1.33 0.19 116.42 119.90 2pgc h ASP 32 Ca 0.22 0.04 -0.09 0.00 0.42 0.00 0.00 57.03 57.62 2pgc h ASP 32 Cb 0.39 -0.06 -0.01 0.00 1.72 0.00 0.00 39.33 41.38 2pgc h ASP 32 CO -0.50 0.33 -0.19 -0.07 -2.88 0.00 0.00 179.24 175.93 2pgc h LEU 33 N 0.66 0.66 -0.30 2.28 3.38 -0.70 -0.70 115.31 120.60 2pgc h LEU 33 Ca 0.32 -0.43 -0.02 0.00 0.09 0.00 0.00 57.88 57.84 2pgc h LEU 33 Cb 0.26 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.81 2pgc h LEU 33 CO -0.21 0.95 0.11 0.40 0.09 0.00 0.00 178.44 179.78 2pgc h ILE 34 N 0.37 1.19 -0.00 1.22 2.04 -0.48 -0.59 117.51 121.26 2pgc h ILE 34 Ca 0.06 -0.58 -0.26 0.00 1.00 0.00 0.00 64.86 65.07 2pgc h ILE 34 Cb 0.73 1.01 0.02 0.00 -0.74 0.00 0.00 36.82 37.84 2pgc h ILE 34 CO 0.05 0.20 -1.03 0.44 0.00 0.00 0.00 178.15 177.81 2pgc h ASP 35 N 0.33 0.91 0.00 1.72 3.32 -0.99 -3.25 116.42 118.47 2pgc h ASP 35 Ca 0.10 -0.74 -0.07 0.00 0.02 0.00 0.00 57.03 56.35 2pgc h ASP 35 Cb 0.20 -0.28 -0.01 0.00 0.22 0.00 0.00 39.33 39.46 2pgc h ASP 35 CO -0.01 1.53 -1.55 0.59 -1.72 0.00 0.00 179.24 178.08 2pgc n ASN 36 N -3.87 2.59 -0.00 6.45 3.02 -0.27 -4.57 115.26 118.61 2pgc n ASN 36 Ca -0.11 0.00 0.10 0.00 -0.03 0.00 0.00 54.58 54.54 2pgc n ASN 36 Cb 0.88 1.20 -0.10 0.00 -0.61 0.00 0.00 39.78 41.15 2pgc n ASN 36 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2pgc n ALA 37 N -2.05 4.59 -1.00 5.41 0.00 -0.29 -4.94 120.51 122.22 2pgc n ALA 37 Ca -0.07 -0.58 -0.00 0.00 0.00 0.00 0.00 53.44 52.79 2pgc n ALA 37 Cb 0.48 -0.79 -0.00 0.00 0.00 0.00 0.00 19.45 19.14 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 1.49 0.43 3.76 0.00 0.00 -0.81 -4.63 105.19 105.42 2pgc n GLY 38 Ca 0.04 -0.74 -0.41 0.00 0.00 0.00 0.00 46.02 44.90 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 -2.00 3.67 -0.51 4.61 0.00 -0.88 -4.78 121.76 121.87 2pgc s ALA 39 Ca 0.00 1.53 -0.02 0.00 0.00 0.00 0.00 51.96 53.47 2pgc s ALA 39 Cb 0.00 -3.62 0.33 0.00 0.00 0.00 0.00 23.12 19.83 2pgc s ALA 39 CO 0.00 -0.96 2.06 1.63 0.00 0.00 0.00 175.76 178.50 2pgc n LYS 40 N 1.67 2.29 0.00 0.00 4.76 0.57 -4.43 118.16 123.02 2pgc n LYS 40 Ca 0.06 -2.50 0.00 0.00 -2.87 0.00 0.00 58.31 52.99 2pgc n LYS 40 Cb 0.38 -1.99 0.00 0.00 -1.84 0.00 0.00 35.03 31.59 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 -0.27 3.11 3.17 0.72 0.00 -1.26 -4.79 105.19 105.87 2pgc n GLY 41 Ca 0.48 -1.79 -0.10 0.00 0.00 0.00 0.00 46.02 44.60 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 -2.20 0.43 -0.00 2.61 -4.23 -1.26 -2.01 115.64 108.97 2pgc s THR 42 Ca 0.00 -1.92 0.01 0.00 -1.18 0.00 0.00 61.69 58.60 2pgc s THR 42 Cb 0.00 -1.89 -0.00 0.00 1.34 0.00 0.00 72.50 71.95 2pgc s THR 42 CO 0.00 -0.66 -0.02 -0.13 -0.54 0.00 0.00 174.62 173.27 2pgc s ARG 43 N -3.94 0.15 -0.05 3.99 0.52 0.05 -4.98 118.95 114.69 2pgc s ARG 43 Ca 0.18 -0.06 0.02 0.00 -0.52 0.00 0.00 55.73 55.35 2pgc s ARG 43 Cb 0.07 -0.15 0.02 0.00 0.52 0.00 0.00 34.95 35.40 2pgc s ARG 43 CO -0.01 0.03 -0.07 0.12 0.02 0.00 0.00 175.30 175.39 2pgc s PHE 44 N -0.00 0.95 0.26 -0.53 5.36 -1.26 -0.45 117.98 122.31 2pgc s PHE 44 Ca 0.00 -0.29 -0.20 0.00 -0.96 0.00 0.00 56.93 55.48 2pgc s PHE 44 Cb -0.01 -0.76 0.06 0.00 -0.34 0.00 0.00 43.02 41.97 2pgc s PHE 44 CO -0.00 -0.19 0.88 0.20 -1.46 0.00 0.00 175.22 174.64 2pgc s GLY 45 N 0.70 0.08 -0.04 13.12 0.00 -0.81 -1.11 107.32 119.26 2pgc s GLY 45 Ca -0.11 -0.36 -0.03 0.00 0.00 0.00 0.00 44.72 44.22 2pgc s GLY 45 CO 0.01 0.48 0.12 -1.35 0.00 0.00 0.00 173.10 172.36 2pgc s SER 46 N -3.09 6.01 -0.45 1.64 1.04 -0.57 -0.43 113.70 117.85 2pgc s SER 46 Ca 0.15 0.28 -0.29 0.00 0.48 0.00 0.00 55.95 56.57 2pgc s SER 46 Cb -0.04 -1.83 0.03 0.00 0.10 0.00 0.00 66.02 64.28 2pgc s SER 46 CO 0.07 0.31 1.16 -0.63 0.98 0.00 0.00 173.24 175.13 2pgc s ILE 47 N -1.17 4.20 -0.43 -1.02 1.01 0.12 -0.77 121.20 123.14 2pgc s ILE 47 Ca 0.22 1.25 0.23 0.00 0.00 0.00 0.00 60.65 62.34 2pgc s ILE 47 Cb -0.12 -4.54 0.32 0.00 0.01 0.00 0.00 42.46 38.13 2pgc s ILE 47 CO 0.12 -0.92 1.58 1.23 0.00 0.00 0.00 174.94 176.95 2pgc h GLY 48 N 11.21 0.00 -2.01 6.18 0.00 -1.14 0.12 103.07 117.43 2pgc h GLY 48 Ca -0.23 0.00 -0.42 0.00 0.00 0.00 0.00 47.33 46.68 2pgc h GLY 48 CO 1.11 0.00 -0.57 -0.51 0.00 0.00 0.00 176.54 176.58 2pgc s THR 49 N -3.22 0.44 0.00 4.70 -4.23 -1.25 -4.80 115.64 107.28 2pgc s THR 49 Ca 0.07 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.58 2pgc s THR 49 Cb 0.05 -2.54 0.00 0.00 1.34 0.00 0.00 72.50 71.36 2pgc s THR 49 CO 0.68 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 175.37 2pgc n GLY 50 N -0.60 -1.92 0.27 3.99 0.00 -1.26 -3.43 105.19 102.24 2pgc n GLY 50 Ca 0.00 -1.38 0.16 0.00 0.00 0.00 0.00 46.02 44.80 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 -0.52 1.61 3.32 -1.99 -2.43 116.42 116.40 2pgc h ASP 51 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 2pgc h ASP 51 Cb 0.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.55 2pgc h ASP 51 CO 0.00 0.03 0.00 1.41 -1.72 0.00 0.00 179.24 178.96 2pgc n HIS 52 N -3.14 1.78 -1.63 4.55 8.25 -1.26 -4.99 115.22 118.79 2pgc n HIS 52 Ca 0.01 -0.63 -0.50 0.00 -0.26 0.00 0.00 57.72 56.34 2pgc n HIS 52 Cb 0.33 -0.43 -0.05 0.00 1.12 0.00 0.00 29.99 30.96 2pgc n HIS 52 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2pgc n ALA 53 N 0.62 -0.00 0.00 -1.41 0.00 -0.92 -1.10 120.51 117.70 2pgc n ALA 53 Ca 0.24 0.47 0.00 0.00 0.00 0.00 0.00 53.44 54.16 2pgc n ALA 53 Cb 1.05 -2.20 0.00 0.00 0.00 0.00 0.00 19.45 18.30 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 3.03 1.30 3.80 0.00 0.00 0.03 -5.01 105.19 108.33 2pgc n GLY 54 Ca 0.19 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.89 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 -2.83 5.31 0.09 1.61 0.01 -0.26 -4.61 113.70 113.02 2pgc s SER 55 Ca 0.00 1.79 0.01 0.00 1.31 0.00 0.00 55.95 59.06 2pgc s SER 55 Cb 0.00 -2.52 -0.04 0.00 0.21 0.00 0.00 66.02 63.67 2pgc s SER 55 CO 0.00 -1.49 0.20 -0.76 0.41 0.00 0.00 173.24 171.60 2pgc s LEU 56 N -5.14 4.24 0.00 2.44 1.43 -0.13 -0.70 118.68 120.82 2pgc s LEU 56 Ca 0.62 0.18 0.04 0.00 -1.03 0.00 0.00 54.13 53.94 2pgc s LEU 56 Cb -0.16 -2.84 -0.01 0.00 0.03 0.00 0.00 46.19 43.20 2pgc s LEU 56 CO 0.47 0.14 -0.11 -0.51 0.23 0.00 0.00 176.35 176.56 2pgc s ILE 57 N -1.56 0.89 -0.08 -0.59 2.07 0.43 -1.32 121.20 121.05 2pgc s ILE 57 Ca 0.34 -0.58 0.03 0.00 -1.41 0.00 0.00 60.65 59.02 2pgc s ILE 57 Cb -0.12 -0.77 0.01 0.00 0.13 0.00 0.00 42.46 41.71 2pgc s ILE 57 CO 0.27 0.18 -0.18 0.12 -1.91 0.00 0.00 174.94 173.41 2pgc s PHE 58 N -0.40 2.01 -0.11 3.50 5.36 0.51 -1.92 117.98 126.92 2pgc s PHE 58 Ca 0.03 -0.78 0.03 0.00 -0.96 0.00 0.00 56.93 55.25 2pgc s PHE 58 Cb -0.05 -1.39 0.01 0.00 -0.34 0.00 0.00 43.02 41.25 2pgc s PHE 58 CO -0.00 -0.34 -0.22 0.42 -1.46 0.00 0.00 175.22 173.62 2pgc s ILE 59 N 0.48 1.96 -0.05 3.12 1.01 0.40 -0.36 121.20 127.78 2pgc s ILE 59 Ca -0.16 -0.95 0.07 0.00 0.00 0.00 0.00 60.65 59.61 2pgc s ILE 59 Cb -0.17 -1.72 -0.01 0.00 0.01 0.00 0.00 42.46 40.57 2pgc s ILE 59 CO 0.06 0.54 -0.25 -1.10 0.00 0.00 0.00 174.94 174.19 2pgc s GLN 60 N 0.57 2.40 -0.17 2.79 -0.21 -0.40 -0.77 119.66 123.86 2pgc s GLN 60 Ca -0.14 -0.91 -0.04 0.00 0.02 0.00 0.00 55.36 54.30 2pgc s GLN 60 Cb -0.17 -2.11 -0.02 0.00 1.00 0.00 0.00 33.01 31.71 2pgc s GLN 60 CO 0.04 0.44 -0.04 -0.06 -2.12 0.00 0.00 175.29 173.55 2pgc s PHE 61 N -0.31 2.99 0.04 0.91 0.08 -0.85 -1.45 117.98 119.39 2pgc s PHE 61 Ca 0.01 -0.45 0.05 0.00 0.12 0.00 0.00 56.93 56.65 2pgc s PHE 61 Cb -0.12 -1.99 -0.02 0.00 -0.57 0.00 0.00 43.02 40.31 2pgc s PHE 61 CO 0.02 -0.17 -0.14 0.71 -0.10 0.00 0.00 175.22 175.55 2pgc s TYR 62 N 0.65 1.19 0.12 0.36 2.02 -0.61 -0.31 117.35 120.78 2pgc s TYR 62 Ca -0.02 -0.36 0.13 0.00 -0.37 0.00 0.00 57.07 56.45 2pgc s TYR 62 Cb -0.14 -0.71 0.25 0.00 -0.40 0.00 0.00 41.96 40.96 2pgc s TYR 62 CO 0.02 0.03 1.53 -0.44 -1.57 0.00 0.00 175.55 175.13 2pgc h ASP 63 N 4.91 0.00 -5.06 2.29 5.19 -1.86 0.26 116.42 122.14 2pgc h ASP 63 Ca -0.38 0.00 -0.12 0.00 -0.62 0.00 0.00 57.03 55.91 2pgc h ASP 63 Cb 1.18 0.00 -0.18 0.00 0.18 0.00 0.00 39.33 40.51 2pgc h ASP 63 CO 0.44 0.62 -0.48 -1.81 -3.12 0.00 0.00 179.24 174.89 2pgc s ASP 64 N -6.62 0.11 0.57 6.45 1.01 -1.26 -4.47 116.67 112.45 2pgc s ASP 64 Ca 0.01 -0.43 0.34 0.00 0.71 0.00 0.00 52.55 53.18 2pgc s ASP 64 Cb 0.11 0.24 1.64 0.00 1.01 0.00 0.00 42.92 45.91 2pgc s ASP 64 CO 0.75 -0.50 2.10 -0.07 0.21 0.00 0.00 175.17 177.66 2pgc h LEU 65 N 3.71 0.00 -1.10 1.23 3.38 -1.98 -1.96 115.31 118.59 2pgc h LEU 65 Ca -0.32 0.00 0.04 0.00 0.09 0.00 0.00 57.88 57.69 2pgc h LEU 65 Cb 1.19 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 41.88 2pgc h LEU 65 CO 0.48 0.05 0.61 0.74 0.09 0.00 0.00 178.44 180.41 2pgc h THR 66 N 0.00 1.16 -0.45 0.22 2.02 -1.99 -0.75 112.91 113.12 2pgc h THR 66 Ca -0.00 -0.40 0.09 0.00 0.77 0.00 0.00 66.41 66.87 2pgc h THR 66 Cb 0.35 -0.11 -0.10 0.00 -1.74 0.00 0.00 68.15 66.55 2pgc h THR 66 CO 0.01 0.21 -0.31 1.23 0.37 0.00 0.00 175.52 177.03 2pgc h GLY 67 N 1.17 -0.15 1.56 2.16 0.00 -1.61 -0.03 103.07 106.17 2pgc h GLY 67 Ca 0.37 0.39 -0.07 0.00 0.00 0.00 0.00 47.33 48.02 2pgc h GLY 67 CO -0.11 -0.21 -0.10 -1.82 0.00 0.00 0.00 176.54 174.29 2pgc h TYR 68 N -0.21 0.58 -0.41 5.60 3.20 -1.30 -0.54 116.97 123.88 2pgc h TYR 68 Ca 0.19 -0.09 -0.06 0.00 3.14 0.00 0.00 58.73 61.91 2pgc h TYR 68 Cb 0.53 -0.16 -0.02 0.00 1.54 0.00 0.00 36.73 38.62 2pgc h TYR 68 CO -0.55 0.63 -0.01 0.37 -1.64 0.00 0.00 178.16 176.96 2pgc h GLN 69 N 0.50 0.66 -0.28 1.82 4.15 -0.46 0.20 115.11 121.70 2pgc h GLN 69 Ca 0.09 -0.17 -0.13 0.00 0.77 0.00 0.00 58.65 59.21 2pgc h GLN 69 Cb 0.48 -0.08 -0.01 0.00 0.21 0.00 0.00 27.48 28.08 2pgc h GLN 69 CO 0.03 0.69 -0.38 0.87 -1.93 0.00 0.00 178.83 178.11 2pgc h LYS 70 N 0.63 0.64 -0.44 1.69 1.57 -0.24 -2.62 116.57 117.80 2pgc h LYS 70 Ca 0.13 -0.32 0.04 0.00 -1.87 0.00 0.00 60.65 58.62 2pgc h LYS 70 Cb 0.41 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 32.69 2pgc h LYS 70 CO 0.02 0.92 0.21 0.00 -0.57 0.00 0.00 179.45 180.03 2pgc h ALA 71 N 1.05 0.54 -0.83 3.86 0.00 -0.36 -0.68 119.26 122.84 2pgc h ALA 71 Ca 0.05 0.02 0.06 0.00 0.00 0.00 0.00 54.91 55.04 2pgc h ALA 71 Cb 0.90 -0.06 -0.05 0.00 0.00 0.00 0.00 17.79 18.58 2pgc h ALA 71 CO 0.08 -0.14 0.54 -0.07 0.00 0.00 0.00 179.25 179.66 2pgc h LEU 72 N 0.43 0.82 -0.90 0.00 3.38 -0.79 -1.16 115.31 117.09 2pgc h LEU 72 Ca 0.19 0.00 -0.11 0.00 0.09 0.00 0.00 57.88 58.05 2pgc h LEU 72 Cb 0.10 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.66 2pgc h LEU 72 CO -0.14 0.54 -0.40 -0.33 0.09 0.00 0.00 178.44 178.20 2pgc h GLU 73 N 0.94 0.30 -0.57 1.13 5.08 -0.95 -2.95 114.58 117.55 2pgc h GLU 73 Ca 0.35 -0.14 -0.10 0.00 -1.00 0.00 0.00 59.36 58.47 2pgc h GLU 73 Cb 0.19 -0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.41 2pgc h GLU 73 CO -0.12 0.66 -0.03 0.82 -1.00 0.00 0.00 179.01 179.34 2pgc h ILE 74 N 0.25 1.27 0.12 3.13 1.08 -0.00 -3.28 117.51 120.08 2pgc h ILE 74 Ca 0.02 -1.17 0.02 0.00 -0.39 0.00 0.00 64.86 63.34 2pgc h ILE 74 Cb 0.82 0.87 -0.05 0.00 -3.07 0.00 0.00 36.82 35.40 2pgc h ILE 74 CO 0.06 0.42 -0.42 1.56 -0.69 0.00 0.00 178.15 179.09 2pgc h GLN 75 N 0.92 -0.63 -0.93 2.37 4.20 -1.13 -1.48 115.11 118.43 2pgc h GLN 75 Ca 0.16 0.04 0.25 0.00 0.06 0.00 0.00 58.65 59.16 2pgc h GLN 75 Cb 0.58 0.14 -0.05 0.00 0.30 0.00 0.00 27.48 28.46 2pgc h GLN 75 CO 0.03 -0.42 0.65 0.66 -0.67 0.00 0.00 178.83 179.09 2pgc h SER 76 N -0.65 0.14 1.06 1.46 4.64 -1.62 -0.13 113.55 118.45 2pgc h SER 76 Ca 0.02 0.02 0.00 0.00 -0.47 0.00 0.00 61.79 61.36 2pgc h SER 76 Cb 0.68 -0.01 0.00 0.00 -0.31 0.00 0.00 62.40 62.76 2pgc h SER 76 CO -0.24 0.05 -0.81 0.11 -0.87 0.00 0.00 176.83 175.06 2pgc h LYS 77 N 0.13 0.00 -6.12 4.77 1.57 -1.47 -3.48 116.57 111.98 2pgc h LYS 77 Ca 0.46 0.00 -0.57 0.00 -1.87 0.00 0.00 60.65 58.68 2pgc h LYS 77 Cb 1.60 0.00 -0.05 0.00 0.08 0.00 0.00 32.23 33.86 2pgc h LYS 77 CO -0.07 0.00 0.46 0.45 -0.57 0.00 0.00 179.45 179.72 2pgc s SER 78 N -5.16 7.11 0.09 0.86 0.15 -0.06 -4.94 113.70 111.75 2pgc s SER 78 Ca 0.02 1.37 -0.17 0.00 0.70 0.00 0.00 55.95 57.86 2pgc s SER 78 Cb 0.10 -2.51 -0.08 0.00 -1.71 0.00 0.00 66.02 61.83 2pgc s SER 78 CO 0.76 -0.41 1.49 0.28 1.20 0.00 0.00 173.24 176.57 2pgc h SER 79 N 7.17 0.53 -0.53 5.45 0.02 -1.92 -1.80 113.55 122.47 2pgc h SER 79 Ca -0.31 -0.36 0.11 0.00 -0.84 0.00 0.00 61.79 60.39 2pgc h SER 79 Cb 1.14 -0.14 -0.10 0.00 0.14 0.00 0.00 62.40 63.44 2pgc h SER 79 CO 0.84 0.76 -0.15 0.58 -1.14 0.00 0.00 176.83 177.72 2pgc h VAL 80 N 0.29 0.43 -0.42 2.27 2.07 -1.95 0.96 116.25 119.89 2pgc h VAL 80 Ca 0.07 0.00 -0.04 0.00 0.82 0.00 0.00 66.70 67.55 2pgc h VAL 80 Cb 0.53 0.43 -0.02 0.00 -1.52 0.00 0.00 31.29 30.71 2pgc h VAL 80 CO 0.03 0.00 0.11 0.15 0.02 0.00 0.00 177.57 177.88 2pgc h PHE 81 N -0.02 0.70 -0.45 1.57 3.57 -1.86 -2.63 116.94 117.82 2pgc h PHE 81 Ca 0.25 -0.08 0.07 0.00 3.53 0.00 0.00 57.97 61.75 2pgc h PHE 81 Cb 0.41 -0.20 -0.06 0.00 2.79 0.00 0.00 35.95 38.89 2pgc h PHE 81 CO -0.46 0.66 0.09 -0.22 -2.23 0.00 0.00 178.31 176.14 2pgc h LYS 82 N 0.55 0.22 -0.75 1.11 3.64 -0.53 -2.78 116.57 118.03 2pgc h LYS 82 Ca 0.13 -0.01 0.02 0.00 -1.27 0.00 0.00 60.65 59.52 2pgc h LYS 82 Cb 0.30 -0.05 -0.04 0.00 -0.41 0.00 0.00 32.23 32.03 2pgc h LYS 82 CO -0.00 0.14 0.48 1.49 -2.27 0.00 0.00 179.45 179.30 2pgc h GLU 83 N 0.22 0.94 -0.09 1.90 4.81 -0.66 0.28 114.58 121.99 2pgc h GLU 83 Ca 0.22 -0.06 0.00 0.00 -0.13 0.00 0.00 59.36 59.39 2pgc h GLU 83 Cb 0.28 -0.21 0.00 0.00 0.63 0.00 0.00 28.75 29.45 2pgc h GLU 83 CO -0.29 0.62 0.00 -0.89 -0.73 0.00 0.00 179.01 177.72 2pgc n ILE 84 N -4.60 0.00 0.00 2.32 5.41 -1.01 -1.29 119.36 120.20 2pgc n ILE 84 Ca 0.08 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.83 2pgc n ILE 84 Cb 0.06 -0.11 0.00 0.00 -0.71 0.00 0.00 39.64 38.87 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 0.30 0.00 0.20 4.38 9.92 0.10 -4.04 116.55 127.41 2pgc n ASP 86 Ca 0.00 0.00 0.05 0.00 -0.53 0.00 0.00 54.79 54.31 2pgc n ASP 86 Cb 0.02 0.00 0.43 0.00 -0.64 0.00 0.00 41.12 40.94 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 0.00 -0.21 -2.24 4.64 -1.43 -3.46 113.55 110.85 2pgc h SER 87 Ca 0.00 0.00 -0.09 0.00 -0.47 0.00 0.00 61.79 61.23 2pgc h SER 87 Cb 0.00 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.05 2pgc h SER 87 CO 0.00 0.31 -0.08 0.61 -0.87 0.00 0.00 176.83 176.80 2pgc n GLY 88 N -0.45 0.61 0.13 -0.77 0.00 -1.26 -4.86 105.19 98.59 2pgc n GLY 88 Ca -0.02 -0.16 0.07 0.00 0.00 0.00 0.00 46.02 45.92 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 -1.33 1.99 -4.64 1.61 5.02 -1.26 -4.94 118.16 114.61 2pgc n LYS 89 Ca -0.04 -0.29 -0.25 0.00 -2.02 0.00 0.00 58.31 55.71 2pgc n LYS 89 Cb 0.34 -1.22 -0.16 0.00 -0.02 0.00 0.00 35.03 33.97 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 -2.19 1.31 -0.29 7.82 0.00 -1.26 -1.95 121.76 125.19 2pgc s ALA 90 Ca 0.08 -0.47 -0.00 0.00 0.00 0.00 0.00 51.96 51.56 2pgc s ALA 90 Cb 0.12 -0.55 0.09 0.00 0.00 0.00 0.00 23.12 22.78 2pgc s ALA 90 CO 0.53 0.15 0.06 1.21 0.00 0.00 0.00 175.76 177.71 2pgc s ASN 91 N 0.51 3.93 -0.08 0.00 3.04 -0.36 -4.99 114.94 116.98 2pgc s ASN 91 Ca -0.12 -1.51 -0.30 0.00 0.04 0.00 0.00 52.86 50.97 2pgc s ASN 91 Cb -0.15 -0.95 -0.04 0.00 -1.54 0.00 0.00 41.25 38.57 2pgc s ASN 91 CO 0.03 -0.37 1.55 -0.63 -3.04 0.00 0.00 177.10 174.64 2pgc s ILE 92 N 1.54 3.77 0.00 -5.21 1.01 -1.26 -1.32 121.20 119.73 2pgc s ILE 92 Ca 0.06 0.93 0.00 0.00 0.00 0.00 0.00 60.65 61.64 2pgc s ILE 92 Cb -0.18 -3.60 0.00 0.00 0.01 0.00 0.00 42.46 38.69 2pgc s ILE 92 CO -0.18 -0.08 0.24 0.00 0.00 0.00 0.00 174.94 174.91 2pgc n TYR 93 N 7.00 0.00 -3.68 3.97 4.11 -0.41 -4.98 117.16 123.17 2pgc n TYR 93 Ca 0.16 0.00 -0.10 0.00 -0.00 0.00 0.00 57.90 57.96 2pgc n TYR 93 Cb 0.43 0.00 -0.09 0.00 -0.00 0.00 0.00 39.34 39.68 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 -0.94 -0.37 -0.08 -3.48 2.96 -1.13 -5.02 118.68 110.61 2pgc s LEU 94 Ca 0.00 1.14 -0.04 0.00 -0.22 0.00 0.00 54.13 55.01 2pgc s LEU 94 Cb 0.00 1.80 0.04 0.00 0.50 0.00 0.00 46.19 48.53 2pgc s LEU 94 CO 0.00 -0.21 0.18 -0.60 -1.32 0.00 0.00 176.35 174.41 2pgc s ARG 95 N 1.23 0.14 0.08 1.98 3.52 -1.26 -0.20 118.95 124.44 2pgc s ARG 95 Ca -0.08 0.42 -0.03 0.00 -0.13 0.00 0.00 55.73 55.92 2pgc s ARG 95 Cb -0.06 -0.15 -0.03 0.00 -1.56 0.00 0.00 34.95 33.15 2pgc s ARG 95 CO -0.12 -0.16 0.06 -0.80 -0.81 0.00 0.00 175.30 173.47 2pgc s ASN 96 N 1.16 0.34 -0.05 -2.12 0.01 -0.56 -4.88 114.94 108.84 2pgc s ASN 96 Ca -0.09 -0.96 0.04 0.00 -0.71 0.00 0.00 52.86 51.14 2pgc s ASN 96 Cb -0.11 0.27 -0.02 0.00 0.41 0.00 0.00 41.25 41.79 2pgc s ASN 96 CO -0.07 -0.67 -0.15 -0.63 -1.51 0.00 0.00 177.10 174.06 2pgc s ILE 97 N -3.94 2.96 0.07 0.60 1.01 -1.26 -0.64 121.20 120.00 2pgc s ILE 97 Ca 0.11 -0.76 0.07 0.00 0.00 0.00 0.00 60.65 60.07 2pgc s ILE 97 Cb 0.07 -2.15 -0.03 0.00 0.01 0.00 0.00 42.46 40.36 2pgc s ILE 97 CO -0.07 0.59 -0.18 -0.55 0.00 0.00 0.00 174.94 174.72 2pgc s SER 98 N -0.66 2.20 0.71 3.58 0.15 0.12 -0.40 113.70 119.40 2pgc s SER 98 Ca 0.10 -0.60 -0.11 0.00 0.70 0.00 0.00 55.95 56.04 2pgc s SER 98 Cb -0.11 -0.13 0.02 0.00 -1.71 0.00 0.00 66.02 64.09 2pgc s SER 98 CO 0.01 0.05 1.07 0.42 1.20 0.00 0.00 173.24 175.99 2pgc s THR 99 N -1.05 3.73 -0.21 6.45 -4.23 -0.47 -0.34 115.64 119.53 2pgc s THR 99 Ca 0.04 0.60 -0.02 0.00 -1.18 0.00 0.00 61.69 61.14 2pgc s THR 99 Cb -0.09 -3.22 0.06 0.00 1.34 0.00 0.00 72.50 70.58 2pgc s THR 99 CO 0.03 -0.70 0.01 -0.55 -0.54 0.00 0.00 174.62 172.87 2pgc s SER 100 N -3.49 3.22 0.07 3.99 0.15 -0.10 -3.96 113.70 113.58 2pgc s SER 100 Ca 0.60 -0.95 -0.04 0.00 0.70 0.00 0.00 55.95 56.26 2pgc s SER 100 Cb -0.16 -0.77 -0.05 0.00 -1.71 0.00 0.00 66.02 63.34 2pgc s SER 100 CO 0.53 -0.29 0.30 -0.76 1.20 0.00 0.00 173.24 174.21 2pgc s LEU 101 N 1.72 4.33 0.06 3.45 1.43 0.35 -1.52 118.68 128.49 2pgc s LEU 101 Ca -0.02 0.51 -0.34 0.00 -1.03 0.00 0.00 54.13 53.25 2pgc s LEU 101 Cb -0.18 -2.98 -0.13 0.00 0.03 0.00 0.00 46.19 42.93 2pgc s LEU 101 CO -0.08 0.16 1.71 -2.65 0.23 0.00 0.00 176.35 175.71 2pgc n PRO 102 N 0.54 2.17 -4.34 1.29 -0.02 -1.26 -4.54 135.00 128.85 2pgc n PRO 102 Ca -0.06 0.79 -0.25 0.00 -2.02 0.00 0.00 63.50 61.96 2pgc n PRO 102 Cb 0.52 -2.59 -0.13 0.00 -0.02 0.00 0.00 33.50 31.28 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 2.23 1.76 -1.37 3.45 -4.23 -1.26 -5.05 115.64 111.18 2pgc s THR 103 Ca 0.85 -1.52 -0.12 0.00 -1.18 0.00 0.00 61.69 59.71 2pgc s THR 103 Cb -0.68 -1.59 0.11 0.00 1.34 0.00 0.00 72.50 71.68 2pgc s THR 103 CO 0.43 -0.01 2.04 0.29 -0.54 0.00 0.00 174.62 176.83 2pgc n LYS 104 N 1.16 3.25 -3.94 3.99 5.02 -1.26 -4.90 118.16 121.47 2pgc n LYS 104 Ca -0.19 -3.09 -0.16 0.00 -2.02 0.00 0.00 58.31 52.86 2pgc n LYS 104 Cb 0.53 -3.11 -0.15 0.00 -0.02 0.00 0.00 35.03 32.28 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 1.80 0.25 -0.67 2.13 2.19 -1.26 -4.82 117.98 117.59 2pgc s PHE 105 Ca 0.43 -0.00 -0.27 0.00 0.33 0.00 0.00 56.93 57.42 2pgc s PHE 105 Cb 0.11 -0.30 0.03 0.00 -1.31 0.00 0.00 43.02 41.56 2pgc s PHE 105 CO -0.04 -0.08 1.22 -2.00 1.83 0.00 0.00 175.22 176.16 2pgc s GLU 106 N 0.63 3.31 0.25 10.12 2.12 -1.26 -4.99 118.70 128.88 2pgc s GLU 106 Ca -0.06 -0.09 -0.30 0.00 0.36 0.00 0.00 54.97 54.88 2pgc s GLU 106 Cb -0.09 -4.12 -0.09 0.00 0.26 0.00 0.00 34.13 30.09 2pgc s GLU 106 CO -0.01 -1.95 1.13 -0.65 -0.54 0.00 0.00 175.26 173.24 2pgc s GLN 107 N 5.33 4.59 0.14 4.30 -1.52 -1.26 -4.85 119.66 126.39 2pgc s GLN 107 Ca 0.37 1.83 0.03 0.00 -1.95 0.00 0.00 55.36 55.64 2pgc s GLN 107 Cb -0.08 -3.21 -0.04 0.00 -0.22 0.00 0.00 33.01 29.46 2pgc s GLN 107 CO 0.19 0.11 0.24 0.45 -0.25 0.00 0.00 175.29 176.03 2pgc s SER 108 N -0.55 6.13 0.00 5.90 0.15 -0.29 -5.02 113.70 120.02 2pgc s SER 108 Ca 0.47 0.10 0.27 0.00 0.70 0.00 0.00 55.95 57.49 2pgc s SER 108 Cb -0.32 -1.79 0.77 0.00 -1.71 0.00 0.00 66.02 62.97 2pgc s SER 108 CO 0.40 0.07 1.58 -1.22 1.20 0.00 0.00 173.24 175.27 2pgc n TYR 109 N -0.41 0.00 -1.80 3.44 4.01 -1.26 -4.78 117.16 116.36 2pgc n TYR 109 Ca -0.07 0.00 -0.42 0.00 -0.16 0.00 0.00 57.90 57.25 2pgc n TYR 109 Cb 0.54 -0.03 -0.03 0.00 -0.31 0.00 0.00 39.34 39.51 2pgc n TYR 109 CO 0.00 0.00 0.00 -2.00 -0.46 0.00 0.00 176.86 174.40 2pgc s GLU 110 N -2.17 4.16 -0.28 -0.72 2.12 -1.26 -4.93 118.70 115.62 2pgc s GLU 110 Ca 0.31 2.47 -0.34 0.00 0.36 0.00 0.00 54.97 57.78 2pgc s GLU 110 Cb 0.20 -3.83 -0.10 0.00 0.26 0.00 0.00 34.13 30.66 2pgc s GLU 110 CO 0.40 -0.85 2.13 0.72 -0.54 0.00 0.00 175.26 177.12 2pgc n HIS 111 N 6.46 1.81 -1.80 5.30 8.25 -1.26 -4.95 115.22 129.03 2pgc n HIS 111 Ca 0.18 0.15 -0.33 0.00 -0.26 0.00 0.00 57.72 57.47 2pgc n HIS 111 Cb 0.40 -2.59 0.04 0.00 1.12 0.00 0.00 29.99 28.96 2pgc n HIS 111 CO 0.00 0.00 0.00 -1.25 0.64 0.00 0.00 176.34 175.73 2pgc s PRO 112 N 5.82 2.94 -0.17 -0.41 0.04 -1.26 -4.95 135.00 137.01 2pgc s PRO 112 Ca 1.05 1.27 0.09 0.00 0.04 0.00 0.00 61.00 63.45 2pgc s PRO 112 Cb -0.73 -1.98 -0.23 0.00 0.04 0.00 0.00 34.50 31.61 2pgc s PRO 112 CO 0.47 -1.12 0.18 1.17 0.04 0.00 0.00 177.00 177.73 2pgc n LYS 113 N -2.44 0.68 -4.10 4.56 4.81 -0.56 -4.75 118.16 116.36 2pgc n LYS 113 Ca 0.09 0.14 -0.14 0.00 -0.87 0.00 0.00 58.31 57.53 2pgc n LYS 113 Cb 0.52 -1.61 -0.11 0.00 0.02 0.00 0.00 35.03 33.85 2pgc n LYS 113 CO 0.00 0.00 0.00 0.71 1.17 0.00 0.00 177.40 179.28 2pgc s TYR 114 N -2.53 0.84 -0.04 5.64 2.02 -0.58 -1.07 117.35 121.63 2pgc s TYR 114 Ca -0.17 -0.52 0.06 0.00 -0.37 0.00 0.00 57.07 56.08 2pgc s TYR 114 Cb 0.07 -0.49 -0.01 0.00 -0.40 0.00 0.00 41.96 41.13 2pgc s TYR 114 CO 0.76 -0.05 -0.22 0.42 -1.57 0.00 0.00 175.55 174.89 2pgc s ILE 115 N -1.51 1.81 -0.21 2.71 1.01 -0.26 -0.29 121.20 124.46 2pgc s ILE 115 Ca -0.06 -0.95 -0.05 0.00 0.00 0.00 0.00 60.65 59.58 2pgc s ILE 115 Cb -0.09 -1.52 -0.02 0.00 0.01 0.00 0.00 42.46 40.83 2pgc s ILE 115 CO 0.01 0.51 0.01 -0.69 0.00 0.00 0.00 174.94 174.78 2pgc s VAL 116 N -0.30 4.00 -0.17 2.92 1.01 -0.45 0.25 120.40 127.66 2pgc s VAL 116 Ca 0.02 -0.29 -0.08 0.00 0.00 0.00 0.00 61.98 61.63 2pgc s VAL 116 Cb -0.11 -2.82 -0.04 0.00 0.00 0.00 0.00 36.38 33.41 2pgc s VAL 116 CO 0.01 0.41 0.09 -0.76 0.00 0.00 0.00 175.10 174.85 2pgc s LEU 117 N 1.15 4.02 -0.03 3.92 1.43 -0.59 -1.51 118.68 127.08 2pgc s LEU 117 Ca 0.03 0.20 0.04 0.00 -1.03 0.00 0.00 54.13 53.37 2pgc s LEU 117 Cb -0.14 -2.01 -0.01 0.00 0.03 0.00 0.00 46.19 44.06 2pgc s LEU 117 CO 0.02 0.23 -0.16 -0.89 0.23 0.00 0.00 176.35 175.78 2pgc s THR 118 N 0.04 1.27 -0.04 5.49 2.01 0.26 -1.35 115.64 123.32 2pgc s THR 118 Ca 0.07 -0.65 0.03 0.00 0.31 0.00 0.00 61.69 61.45 2pgc s THR 118 Cb -0.12 -1.08 0.00 0.00 0.01 0.00 0.00 72.50 71.31 2pgc s THR 118 CO 0.00 0.37 -0.14 -0.60 -0.69 0.00 0.00 174.62 173.56 2pgc s ARG 119 N -0.12 1.58 0.06 4.92 3.52 -1.26 0.10 118.95 127.76 2pgc s ARG 119 Ca 0.01 -0.49 0.00 0.00 -0.13 0.00 0.00 55.73 55.12 2pgc s ARG 119 Cb -0.09 -1.37 -0.04 0.00 -1.56 0.00 0.00 34.95 31.90 2pgc s ARG 119 CO 0.01 0.16 -0.05 0.00 -0.81 0.00 0.00 175.30 174.61 2pgc s ALA 120 N 0.22 0.63 -0.17 6.12 0.00 -0.03 -0.79 121.76 127.75 2pgc s ALA 120 Ca -0.06 -1.14 -0.06 0.00 0.00 0.00 0.00 51.96 50.70 2pgc s ALA 120 Cb -0.12 0.19 -0.03 0.00 0.00 0.00 0.00 23.12 23.16 2pgc s ALA 120 CO 0.02 -0.26 0.02 -2.00 0.00 0.00 0.00 175.76 173.54 2pgc s GLU 121 N -3.35 3.84 -0.02 0.00 2.12 -0.26 -0.56 118.70 120.46 2pgc s GLU 121 Ca 0.04 -0.42 -0.29 0.00 0.36 0.00 0.00 54.97 54.67 2pgc s GLU 121 Cb 0.03 -3.08 0.09 0.00 0.26 0.00 0.00 34.13 31.43 2pgc s GLU 121 CO -0.06 0.27 0.80 0.00 -0.54 0.00 0.00 175.26 175.72 2pgc s ALA 122 N 0.35 -1.79 0.50 6.30 0.00 -1.26 -1.71 121.76 124.15 2pgc s ALA 122 Ca -0.00 1.13 0.00 0.00 0.00 0.00 0.00 51.96 53.09 2pgc s ALA 122 Cb -0.13 0.12 0.00 0.00 0.00 0.00 0.00 23.12 23.11 2pgc s ALA 122 CO 0.01 -0.52 0.00 0.00 0.00 0.00 0.00 175.76 175.25 2pgc n ALA 123 N 0.29 0.00 0.00 0.00 0.00 -1.26 -4.93 120.51 114.60 2pgc n ALA 123 Ca -0.14 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.30 2pgc n ALA 123 Cb 0.60 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.05 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 -1.29 0.00 3.41 -1.26 -3.91 113.62 110.57 2pgc n SER 125 Ca 0.00 0.00 0.08 0.00 -0.26 0.00 0.00 58.87 58.69 2pgc n SER 125 Cb 0.00 0.00 0.28 0.00 -0.26 0.00 0.00 64.21 64.23 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 3.78 -0.33 4.04 8.00 -1.26 -4.62 116.55 126.16 2pgc n ASP 126 Ca 0.00 -2.30 0.08 0.00 0.71 0.00 0.00 54.79 53.28 2pgc n ASP 126 Cb 0.00 -0.50 0.28 0.00 -0.02 0.00 0.00 41.12 40.88 2pgc n ASP 126 CO 0.00 0.00 0.00 0.11 -0.39 0.00 0.00 177.20 176.92 2pgc h LYS 127 N 3.29 0.89 0.18 -1.24 1.57 -1.96 -1.17 116.57 118.13 2pgc h LYS 127 Ca 0.00 -0.05 -0.24 0.00 -1.87 0.00 0.00 60.65 58.49 2pgc h LYS 127 Cb 1.15 -0.20 0.03 0.00 0.08 0.00 0.00 32.23 33.28 2pgc h LYS 127 CO 0.16 0.59 -1.03 -0.44 -0.57 0.00 0.00 179.45 178.16 2pgc h ASP 128 N 0.92 0.60 -0.71 0.86 3.32 -1.95 -1.87 116.42 117.59 2pgc h ASP 128 Ca 0.47 -0.94 0.09 0.00 0.02 0.00 0.00 57.03 56.67 2pgc h ASP 128 Cb 0.51 -0.20 -0.07 0.00 0.22 0.00 0.00 39.33 39.79 2pgc h ASP 128 CO -0.23 1.50 0.35 0.11 -1.72 0.00 0.00 179.24 179.24 2pgc h LYS 129 N -0.20 0.57 0.19 3.56 1.57 -1.85 -0.34 116.57 120.08 2pgc h LYS 129 Ca -0.18 -0.03 0.01 0.00 -1.87 0.00 0.00 60.65 58.57 2pgc h LYS 129 Cb 1.82 -0.13 -0.02 0.00 0.08 0.00 0.00 32.23 33.97 2pgc h LYS 129 CO 0.19 0.38 -0.23 0.35 -0.57 0.00 0.00 179.45 179.57 2pgc h PHE 130 N 0.59 -0.62 -0.57 -1.35 3.04 -1.18 -1.80 116.94 115.06 2pgc h PHE 130 Ca 0.35 0.01 0.01 0.00 3.98 0.00 0.00 57.97 62.32 2pgc h PHE 130 Cb 0.38 0.25 -0.03 0.00 2.56 0.00 0.00 35.95 39.11 2pgc h PHE 130 CO -0.11 -0.34 0.38 1.25 -2.02 0.00 0.00 178.31 177.47 2pgc h LEU 131 N -0.47 0.64 -0.52 0.59 5.85 -0.92 -2.04 115.31 118.43 2pgc h LEU 131 Ca 0.01 -0.01 -0.15 0.00 0.84 0.00 0.00 57.88 58.57 2pgc h LEU 131 Cb 0.46 -0.16 -0.01 0.00 0.37 0.00 0.00 40.66 41.33 2pgc h LEU 131 CO -0.09 0.46 -0.38 0.78 -0.34 0.00 0.00 178.44 178.88 2pgc h ASN 132 N 0.75 0.84 -0.13 1.25 2.35 -0.73 -1.17 115.58 118.74 2pgc h ASN 132 Ca 0.21 -0.37 0.02 0.00 -0.55 0.00 0.00 56.30 55.61 2pgc h ASN 132 Cb -0.06 -0.24 -0.02 0.00 0.05 0.00 0.00 38.32 38.06 2pgc h ASN 132 CO -0.05 1.12 -0.01 0.00 -1.65 0.00 0.00 177.43 176.85 2pgc h ILE 134 N 0.03 1.03 -0.19 0.00 1.08 -1.18 -1.33 117.51 116.95 2pgc h ILE 134 Ca 0.06 -0.33 -0.15 0.00 -0.39 0.00 0.00 64.86 64.05 2pgc h ILE 134 Cb 0.08 -0.03 -0.01 0.00 -3.07 0.00 0.00 36.82 33.79 2pgc h ILE 134 CO -0.11 0.18 -0.51 0.78 -0.69 0.00 0.00 178.15 177.80 2pgc h ASN 135 N 0.97 0.58 0.34 1.72 2.35 -0.90 -2.51 115.58 118.13 2pgc h ASN 135 Ca 0.39 -0.30 -0.09 0.00 -0.55 0.00 0.00 56.30 55.75 2pgc h ASN 135 Cb 0.20 -0.17 -0.01 0.00 0.05 0.00 0.00 38.32 38.40 2pgc h ASN 135 CO -0.18 0.99 -0.40 0.44 -1.65 0.00 0.00 177.43 176.62 2pgc h ASP 136 N 0.42 0.09 -0.28 5.81 3.32 -0.05 -2.90 116.42 122.83 2pgc h ASP 136 Ca 0.02 -0.03 0.00 0.00 0.02 0.00 0.00 57.03 57.03 2pgc h ASP 136 Cb 1.04 -0.02 0.00 0.00 0.22 0.00 0.00 39.33 40.56 2pgc h ASP 136 CO 0.10 0.48 0.00 0.35 -1.72 0.00 0.00 179.24 178.45 2pgc n THR 137 N -4.05 0.35 0.14 0.35 -2.24 -0.57 -4.46 114.28 103.80 2pgc n THR 137 Ca -0.02 -0.59 0.15 0.00 -2.27 0.00 0.00 64.05 61.33 2pgc n THR 137 Cb 0.45 0.85 0.71 0.00 -2.10 0.00 0.00 70.33 70.24 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 4.40 2.15 -0.20 6.98 0.00 -1.23 -0.78 119.26 130.58 2pgc h ALA 138 Ca 0.00 -0.01 -0.16 0.00 0.00 0.00 0.00 54.91 54.74 2pgc h ALA 138 Cb 0.83 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.64 2pgc h ALA 138 CO 0.00 -0.34 -0.52 0.66 0.00 0.00 0.00 179.25 179.05 2pgc h SER 139 N 0.00 0.64 -0.90 0.00 4.64 -1.82 -2.54 113.55 113.57 2pgc h SER 139 Ca 0.12 -0.33 0.18 0.00 -0.47 0.00 0.00 61.79 61.29 2pgc h SER 139 Cb 0.54 -0.18 -0.11 0.00 -0.31 0.00 0.00 62.40 62.34 2pgc h SER 139 CO -0.00 1.05 0.46 0.00 -0.87 0.00 0.00 176.83 177.47 2pgc h PHE 141 N 0.58 -0.19 -0.26 0.00 0.04 -1.56 -3.11 116.94 112.44 2pgc h PHE 141 Ca 0.52 -0.00 0.00 0.00 2.80 0.00 0.00 57.97 61.29 2pgc h PHE 141 Cb 0.86 0.06 -0.01 0.00 2.20 0.00 0.00 35.95 39.05 2pgc h PHE 141 CO -0.09 0.22 0.16 -0.22 -0.60 0.00 0.00 178.31 177.79 2pgc h LYS 142 N -0.93 0.35 -0.24 1.51 1.63 -1.14 -0.19 116.57 117.56 2pgc h LYS 142 Ca -0.02 -0.03 -0.01 0.00 -0.85 0.00 0.00 60.65 59.74 2pgc h LYS 142 Cb 0.49 -0.08 -0.01 0.00 -0.60 0.00 0.00 32.23 32.03 2pgc h LYS 142 CO 0.03 0.25 0.11 -0.44 -3.45 0.00 0.00 179.45 175.96 2pgc h ASP 143 N 0.34 0.28 -0.61 4.20 3.32 -0.85 -2.56 116.42 120.54 2pgc h ASP 143 Ca 0.09 -0.02 0.00 0.00 0.02 0.00 0.00 57.03 57.13 2pgc h ASP 143 Cb -0.01 -0.07 0.00 0.00 0.22 0.00 0.00 39.33 39.47 2pgc h ASP 143 CO -0.02 0.25 0.00 0.59 -1.72 0.00 0.00 179.24 178.34 2pgc n ASN 144 N -4.45 3.46 0.00 6.45 5.03 -0.85 -4.93 115.26 119.98 2pgc n ASN 144 Ca 0.00 -1.99 0.00 0.00 0.87 0.00 0.00 54.58 53.46 2pgc n ASN 144 Cb 0.11 -0.41 0.00 0.00 -1.02 0.00 0.00 39.78 38.46 2pgc n ASN 144 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2pgc n GLY 145 N 1.53 0.81 3.77 7.41 0.00 -0.91 -4.53 105.19 113.27 2pgc n GLY 145 Ca 0.22 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.83 2pgc n GLY 145 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2pgc s ALA 146 N -2.00 3.57 -0.25 4.61 0.00 -0.14 -4.40 121.76 123.14 2pgc s ALA 146 Ca 0.00 1.40 -0.16 0.00 0.00 0.00 0.00 51.96 53.20 2pgc s ALA 146 Cb 0.00 -3.55 -0.15 0.00 0.00 0.00 0.00 23.12 19.42 2pgc s ALA 146 CO 0.00 -0.82 -0.16 1.28 0.00 0.00 0.00 175.76 176.06 2pgc n LEU 147 N 1.15 1.97 -4.07 0.00 4.77 0.32 -4.51 117.00 116.63 2pgc n LEU 147 Ca 0.02 0.35 -0.13 0.00 -0.03 0.00 0.00 56.01 56.22 2pgc n LEU 147 Cb 0.40 -0.88 -0.11 0.00 -2.33 0.00 0.00 43.42 40.50 2pgc n LEU 147 CO 0.61 0.50 -0.40 0.42 -1.33 0.00 0.00 177.39 177.19 2pgc s THR 148 N -2.46 0.55 -0.06 -5.08 -4.23 -1.24 -1.14 115.64 101.97 2pgc s THR 148 Ca -0.35 -1.12 -0.03 0.00 -1.18 0.00 0.00 61.69 59.01 2pgc s THR 148 Cb 0.12 -0.66 0.04 0.00 1.34 0.00 0.00 72.50 73.34 2pgc s THR 148 CO 0.53 -0.40 0.12 -0.22 -0.54 0.00 0.00 174.62 174.10 2pgc s LEU 149 N -1.64 0.23 -0.00 4.79 0.20 -1.26 -1.01 118.68 119.99 2pgc s LEU 149 Ca -0.09 0.22 0.05 0.00 0.69 0.00 0.00 54.13 55.01 2pgc s LEU 149 Cb -0.09 0.13 -0.02 0.00 -0.43 0.00 0.00 46.19 45.78 2pgc s LEU 149 CO 0.00 -0.22 -0.17 -0.13 -0.29 0.00 0.00 176.35 175.54 2pgc s ARG 150 N 1.95 1.35 -0.08 1.98 1.81 -0.34 -4.94 118.95 120.68 2pgc s ARG 150 Ca 0.00 -0.66 -0.07 0.00 -1.72 0.00 0.00 55.73 53.28 2pgc s ARG 150 Cb -0.12 -1.33 0.02 0.00 -0.45 0.00 0.00 34.95 33.07 2pgc s ARG 150 CO -0.05 0.36 0.22 0.12 -0.68 0.00 0.00 175.30 175.27 2pgc s PHE 151 N -0.48 -0.24 0.00 -0.53 5.36 -1.26 -0.46 117.98 120.36 2pgc s PHE 151 Ca 0.06 0.58 0.00 0.00 -0.96 0.00 0.00 56.93 56.62 2pgc s PHE 151 Cb -0.07 0.08 0.00 0.00 -0.34 0.00 0.00 43.02 42.69 2pgc s PHE 151 CO -0.00 -0.12 0.00 0.41 -1.46 0.00 0.00 175.22 174.05 2pgc n GLY 152 N 3.00 0.88 3.18 13.12 0.00 -0.60 -0.50 105.19 124.27 2pgc n GLY 152 Ca -0.13 -0.51 -0.24 0.00 0.00 0.00 0.00 46.02 45.14 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 2.07 0.03 1.61 -0.87 -1.25 -0.40 114.94 118.13 2pgc s ASN 153 Ca 0.00 -0.39 -0.30 0.00 -1.57 0.00 0.00 52.86 50.60 2pgc s ASN 153 Cb 0.00 -0.20 -0.08 0.00 -0.02 0.00 0.00 41.25 40.96 2pgc s ASN 153 CO 0.00 0.17 1.68 -0.76 -2.57 0.00 0.00 177.10 175.62 2pgc s LEU 154 N -0.74 4.36 0.15 0.60 1.43 -0.31 -1.36 118.68 122.81 2pgc s LEU 154 Ca 0.06 2.43 0.12 0.00 -1.03 0.00 0.00 54.13 55.71 2pgc s LEU 154 Cb -0.07 -3.55 -0.11 0.00 0.03 0.00 0.00 46.19 42.49 2pgc s LEU 154 CO 0.00 -0.91 1.21 -0.07 0.23 0.00 0.00 176.35 176.81 2pgc h LEU 155 N 9.24 0.00 -9.07 1.79 3.38 -1.07 -0.85 115.31 118.73 2pgc h LEU 155 Ca -0.42 0.00 -0.45 0.00 0.09 0.00 0.00 57.88 57.10 2pgc h LEU 155 Cb 1.20 0.00 -0.14 0.00 0.09 0.00 0.00 40.66 41.81 2pgc h LEU 155 CO 0.94 0.77 -0.65 0.42 0.09 0.00 0.00 178.44 180.00 2pgc s THR 156 N -2.81 1.34 0.00 0.22 -4.23 -1.19 -4.83 115.64 104.14 2pgc s THR 156 Ca 0.01 -2.07 0.00 0.00 -1.18 0.00 0.00 61.69 58.45 2pgc s THR 156 Cb 0.09 -2.48 0.00 0.00 1.34 0.00 0.00 72.50 71.44 2pgc s THR 156 CO 0.79 -0.25 0.00 0.61 -0.54 0.00 0.00 174.62 175.23 2pgc n GLY 157 N -0.55 -3.22 0.00 3.99 0.00 -1.26 -4.01 105.19 100.14 2pgc n GLY 157 Ca -0.05 -2.12 0.14 0.00 0.00 0.00 0.00 46.02 44.00 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 0.00 0.00 -1.17 1.61 7.64 -1.26 -2.54 113.62 117.90 2pgc n SER 158 Ca 0.00 0.11 -0.04 0.00 1.01 0.00 0.00 58.87 59.95 2pgc n SER 158 Cb 0.00 -0.37 0.20 0.00 -1.01 0.00 0.00 64.21 63.03 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 -1.37 2.44 -4.69 6.43 4.13 -1.26 -5.06 115.26 115.88 2pgc n ASN 159 Ca 0.11 -3.80 -0.44 0.00 1.68 0.00 0.00 54.58 52.13 2pgc n ASN 159 Cb 0.28 -0.64 -0.03 0.00 -1.54 0.00 0.00 39.78 37.86 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 -1.13 0.76 0.00 2.41 3.14 -1.05 -1.37 118.33 121.09 2pgc n VAL 160 Ca 0.33 -0.19 0.00 0.00 -2.96 0.00 0.00 64.34 61.52 2pgc n VAL 160 Cb 1.04 -1.61 0.00 0.00 -1.06 0.00 0.00 33.84 32.21 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 2.45 2.96 3.68 7.55 0.00 -0.32 -5.00 105.19 116.51 2pgc n GLY 161 Ca 0.12 -0.02 -0.40 0.00 0.00 0.00 0.00 46.02 45.72 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 0.09 2.14 -4.78 1.61 5.03 -0.47 -4.62 115.26 114.27 2pgc n ASN 162 Ca 0.00 1.04 -0.37 0.00 0.87 0.00 0.00 54.58 56.12 2pgc n ASN 162 Cb 0.00 -1.47 -0.05 0.00 -1.02 0.00 0.00 39.78 37.23 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 -1.26 3.57 -0.05 3.10 1.51 0.27 -1.16 117.35 123.33 2pgc s TYR 163 Ca 0.65 1.74 0.02 0.00 -1.01 0.00 0.00 57.07 58.46 2pgc s TYR 163 Cb -0.49 -3.03 0.02 0.00 -0.11 0.00 0.00 41.96 38.35 2pgc s TYR 163 CO 0.55 -0.12 -0.08 -1.17 -1.11 0.00 0.00 175.55 173.63 2pgc s LEU 164 N -2.11 1.53 -0.07 -1.29 2.96 0.47 -0.85 118.68 119.31 2pgc s LEU 164 Ca 0.51 -0.20 0.05 0.00 -0.22 0.00 0.00 54.13 54.27 2pgc s LEU 164 Cb -0.22 -0.59 -0.01 0.00 0.50 0.00 0.00 46.19 45.87 2pgc s LEU 164 CO 0.27 -0.00 -0.23 -0.22 -1.32 0.00 0.00 176.35 174.86 2pgc s LEU 165 N 0.69 2.21 -0.09 -0.68 2.96 0.12 -1.56 118.68 122.32 2pgc s LEU 165 Ca -0.11 -0.47 0.02 0.00 -0.22 0.00 0.00 54.13 53.35 2pgc s LEU 165 Cb -0.14 -1.42 0.01 0.00 0.50 0.00 0.00 46.19 45.14 2pgc s LEU 165 CO 0.02 0.23 -0.15 -0.83 -1.32 0.00 0.00 176.35 174.30 2pgc s GLY 166 N -0.07 0.99 -0.07 7.98 0.00 0.39 -0.57 107.32 115.96 2pgc s GLY 166 Ca -0.06 -0.65 0.01 0.00 0.00 0.00 0.00 44.72 44.02 2pgc s GLY 166 CO 0.04 0.14 -0.06 0.14 0.00 0.00 0.00 173.10 173.37 2pgc s VAL 167 N 0.83 0.74 0.15 1.40 1.01 -0.57 -1.20 120.40 122.77 2pgc s VAL 167 Ca -0.10 -0.19 -0.12 0.00 0.00 0.00 0.00 61.98 61.56 2pgc s VAL 167 Cb -0.15 -0.76 -0.07 0.00 0.00 0.00 0.00 36.38 35.39 2pgc s VAL 167 CO 0.01 0.29 0.51 -0.83 0.00 0.00 0.00 175.10 175.09 2pgc s GLY 168 N 1.21 2.39 0.01 4.51 0.00 -0.18 -1.34 107.32 113.92 2pgc s GLY 168 Ca -0.06 -0.22 -0.04 0.00 0.00 0.00 0.00 44.72 44.39 2pgc s GLY 168 CO -0.02 0.01 0.07 -0.19 0.00 0.00 0.00 173.10 172.97 2pgc s TYR 169 N -1.53 0.13 -0.53 1.90 2.02 0.61 -0.52 117.35 119.43 2pgc s TYR 169 Ca 0.39 -0.30 0.24 0.00 -0.37 0.00 0.00 57.07 57.02 2pgc s TYR 169 Cb -0.14 -0.11 0.26 0.00 -0.40 0.00 0.00 41.96 41.58 2pgc s TYR 169 CO 0.19 -0.25 1.27 -1.00 -1.57 0.00 0.00 175.55 174.19 2pgc h PRO 170 N 4.39 0.00 0.00 -1.71 0.13 -1.84 -1.19 132.00 131.78 2pgc h PRO 170 Ca -0.31 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.82 2pgc h PRO 170 Cb 1.20 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.33 2pgc h PRO 170 CO 0.41 0.00 0.00 -1.13 -0.23 0.00 0.00 178.00 177.05 2pgc n SER 171 N -2.31 0.00 0.00 1.44 3.41 -1.26 -4.55 113.62 110.35 2pgc n SER 171 Ca 0.03 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.64 2pgc n SER 171 Cb 0.47 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.42 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 -0.20 4.33 2.13 -1.26 -3.05 120.64 122.59 2pgc n GLU 173 Ca 0.00 0.00 -0.05 0.00 0.66 0.00 0.00 57.16 57.77 2pgc n GLU 173 Cb 0.00 0.00 0.11 0.00 0.27 0.00 0.00 31.44 31.82 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 1.07 0.29 4.31 0.00 -1.96 0.12 119.26 123.09 2pgc h ALA 174 Ca 0.00 -0.23 -0.01 0.00 0.00 0.00 0.00 54.91 54.67 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 0.62 -0.14 0.82 0.00 0.00 0.00 179.25 180.55 2pgc h ILE 175 N 0.97 0.72 -0.47 0.00 2.04 -1.83 0.91 117.51 119.85 2pgc h ILE 175 Ca 0.21 -0.02 0.03 0.00 1.00 0.00 0.00 64.86 66.07 2pgc h ILE 175 Cb 0.33 0.73 -0.03 0.00 -0.74 0.00 0.00 36.82 37.11 2pgc h ILE 175 CO -0.00 0.00 0.27 -0.08 0.00 0.00 0.00 178.15 178.34 2pgc h GLU 176 N -0.40 0.52 -0.56 2.37 4.81 -1.80 -0.55 114.58 118.98 2pgc h GLU 176 Ca -0.04 -0.03 -0.09 0.00 -0.13 0.00 0.00 59.36 59.07 2pgc h GLU 176 Cb 0.30 -0.12 -0.02 0.00 0.63 0.00 0.00 28.75 29.54 2pgc h GLU 176 CO 0.06 0.35 0.00 0.87 -0.73 0.00 0.00 179.01 179.56 2pgc h LYS 177 N 0.54 0.95 -0.52 1.92 1.79 -0.70 -0.46 116.57 120.09 2pgc h LYS 177 Ca 0.19 -0.28 0.00 0.00 -2.18 0.00 0.00 60.65 58.38 2pgc h LYS 177 Cb 0.04 -0.10 -0.03 0.00 -1.58 0.00 0.00 32.23 30.56 2pgc h LYS 177 CO -0.10 0.94 0.34 1.15 -1.08 0.00 0.00 179.45 180.70 2pgc h THR 178 N 0.88 1.14 -0.03 -0.16 2.02 -0.19 -2.70 112.91 113.87 2pgc h THR 178 Ca 0.16 -0.27 -0.18 0.00 0.77 0.00 0.00 66.41 66.90 2pgc h THR 178 Cb 0.51 0.38 -0.01 0.00 -1.74 0.00 0.00 68.15 67.30 2pgc h THR 178 CO 0.03 0.14 -0.77 1.88 0.37 0.00 0.00 175.52 177.17 2pgc h TYR 179 N 0.71 0.30 -0.56 3.16 0.05 -0.94 0.34 116.97 120.03 2pgc h TYR 179 Ca 0.19 -0.14 0.10 0.00 0.05 0.00 0.00 58.73 58.92 2pgc h TYR 179 Cb -0.07 -0.04 -0.08 0.00 1.01 0.00 0.00 36.73 37.56 2pgc h TYR 179 CO -0.04 0.90 0.14 -0.44 -1.05 0.00 0.00 178.16 177.68 2pgc h ASP 180 N 0.14 0.06 -0.03 3.88 3.32 -0.91 -1.64 116.42 121.24 2pgc h ASP 180 Ca -0.03 0.09 -0.12 0.00 0.02 0.00 0.00 57.03 56.99 2pgc h ASP 180 Cb 1.35 0.11 0.01 0.00 0.22 0.00 0.00 39.33 41.02 2pgc h ASP 180 CO 0.12 0.05 -0.45 -0.08 -1.72 0.00 0.00 179.24 177.15 2pgc h GLU 181 N 0.29 0.37 0.20 3.56 4.81 -1.35 -3.34 114.58 119.12 2pgc h GLU 181 Ca 0.29 -0.35 -0.00 0.00 -0.13 0.00 0.00 59.36 59.17 2pgc h GLU 181 Cb 0.39 0.09 -0.01 0.00 0.63 0.00 0.00 28.75 29.85 2pgc h GLU 181 CO -0.35 1.01 -0.15 1.25 -0.73 0.00 0.00 179.01 180.05 2pgc h LEU 182 N -0.15 -0.39 -2.51 1.64 5.85 -0.70 -2.55 115.31 116.50 2pgc h LEU 182 Ca -0.05 0.03 0.02 0.00 0.84 0.00 0.00 57.88 58.72 2pgc h LEU 182 Cb 1.15 0.13 -0.00 0.00 0.37 0.00 0.00 40.66 42.30 2pgc h LEU 182 CO 0.09 -0.24 0.11 -0.07 -0.34 0.00 0.00 178.44 177.99 2pgc h LEU 183 N -0.36 0.00 -4.43 2.25 3.38 -1.45 -1.00 115.31 113.70 2pgc h LEU 183 Ca -0.01 0.00 -0.65 0.00 0.09 0.00 0.00 57.88 57.31 2pgc h LEU 183 Cb 0.32 0.00 -0.36 0.00 0.09 0.00 0.00 40.66 40.71 2pgc h LEU 183 CO -0.01 0.00 -0.00 0.00 0.09 0.00 0.00 178.44 178.52 2pgc n ALA 184 N -2.19 5.66 -2.49 1.53 0.00 -0.96 -4.82 120.51 117.24 2pgc n ALA 184 Ca -0.01 -4.04 -0.26 0.00 0.00 0.00 0.00 53.44 49.13 2pgc n ALA 184 Cb 0.19 -1.09 -0.15 0.00 0.00 0.00 0.00 19.45 18.39 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 -3.75 1.66 0.13 0.00 5.04 -0.38 -4.99 115.29 112.99 2pgc s HIS 185 Ca 0.52 -0.32 -0.19 0.00 -1.54 0.00 0.00 55.06 53.53 2pgc s HIS 185 Cb 0.43 -1.07 -0.04 0.00 0.04 0.00 0.00 32.58 31.94 2pgc s HIS 185 CO -0.18 -0.03 1.76 0.66 -2.34 0.00 0.00 174.74 174.60 2pgc h SER 186 N 5.71 0.14 -0.98 9.88 4.64 -1.94 -1.78 113.55 129.22 2pgc h SER 186 Ca -0.37 0.01 0.11 0.00 -0.47 0.00 0.00 61.79 61.07 2pgc h SER 186 Cb 1.15 -0.01 -0.08 0.00 -0.31 0.00 0.00 62.40 63.15 2pgc h SER 186 CO 0.48 0.11 0.62 0.28 -0.87 0.00 0.00 176.83 177.46 2pgc h SER 187 N 0.22 0.90 0.07 4.97 0.02 -1.95 0.05 113.55 117.84 2pgc h SER 187 Ca 0.09 0.04 -0.00 0.00 -0.84 0.00 0.00 61.79 61.08 2pgc h SER 187 Cb 0.03 -0.14 0.00 0.00 0.14 0.00 0.00 62.40 62.43 2pgc h SER 187 CO -0.07 0.50 -0.04 0.22 -1.14 0.00 0.00 176.83 176.30 2pgc h TYR 188 N 0.97 -0.09 -1.00 3.45 3.20 -1.66 -0.75 116.97 121.09 2pgc h TYR 188 Ca 0.47 -0.00 0.12 0.00 3.14 0.00 0.00 58.73 62.46 2pgc h TYR 188 Cb 0.45 0.03 -0.08 0.00 1.54 0.00 0.00 36.73 38.67 2pgc h TYR 188 CO -0.00 0.09 0.63 0.87 -1.64 0.00 0.00 178.16 178.11 2pgc h LYS 189 N -0.26 0.97 -0.43 1.82 1.79 -0.61 -1.73 116.57 118.13 2pgc h LYS 189 Ca -0.01 -0.06 -0.14 0.00 -2.18 0.00 0.00 60.65 58.26 2pgc h LYS 189 Cb 0.22 -0.22 -0.01 0.00 -1.58 0.00 0.00 32.23 30.64 2pgc h LYS 189 CO 0.02 0.64 -0.28 1.49 -1.08 0.00 0.00 179.45 180.24 2pgc h GLU 190 N 1.00 0.92 -1.93 3.15 4.81 -0.86 -3.24 114.58 118.43 2pgc h GLU 190 Ca 0.50 -0.42 0.00 0.00 -0.13 0.00 0.00 59.36 59.31 2pgc h GLU 190 Cb 0.49 -0.02 0.00 0.00 0.63 0.00 0.00 28.75 29.85 2pgc h GLU 190 CO -0.27 1.08 0.00 -0.11 -0.73 0.00 0.00 179.01 178.98 2pgc n LEU 191 N -4.09 0.00 0.00 1.64 7.94 -0.30 -3.89 117.00 118.30 2pgc n LEU 191 Ca -0.01 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.89 2pgc n LEU 191 Cb 0.49 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.44 2pgc n LEU 191 CO 0.47 0.00 0.00 0.35 -1.11 0.00 0.00 177.39 177.10 2pgc n THR 193 N 1.44 0.00 -0.66 1.96 -2.24 -1.22 -1.01 114.28 112.54 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 -4.25 4.78 1.16 -1.25 -5.06 117.46 112.84 2pgc n PHE 194 Ca 0.00 -0.12 -0.18 0.00 -1.87 0.00 0.00 57.45 55.27 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 0.64 -0.31 1.98 0.00 -0.18 -4.52 121.76 119.12 2pgc s ALA 195 Ca 0.00 -0.22 -0.05 0.00 0.00 0.00 0.00 51.96 51.69 2pgc s ALA 195 Cb 0.00 -0.25 0.04 0.00 0.00 0.00 0.00 23.12 22.91 2pgc s ALA 195 CO 0.00 0.10 0.06 0.21 0.00 0.00 0.00 175.76 176.13 2pgc s LYS 196 N 0.20 2.66 0.03 0.00 2.47 -0.69 -4.94 119.74 119.46 2pgc s LYS 196 Ca -0.02 -1.14 -0.30 0.00 -1.56 0.00 0.00 55.97 52.94 2pgc s LYS 196 Cb -0.07 -3.33 -0.07 0.00 -1.46 0.00 0.00 37.83 32.90 2pgc s LYS 196 CO -0.00 -0.60 1.59 0.08 0.16 0.00 0.00 175.35 176.58 2pgc s VAL 197 N 1.37 3.31 -0.21 4.02 1.01 -1.26 -1.11 120.40 127.54 2pgc s VAL 197 Ca -0.02 0.68 0.15 0.00 0.00 0.00 0.00 61.98 62.79 2pgc s VAL 197 Cb -0.19 -3.44 0.52 0.00 0.00 0.00 0.00 36.38 33.27 2pgc s VAL 197 CO 0.01 -0.01 1.43 -0.46 0.00 0.00 0.00 175.10 176.07 2pgc n ASN 198 N 5.86 3.51 -3.58 3.32 0.23 0.03 -4.96 115.26 119.68 2pgc n ASN 198 Ca 0.15 -3.20 -0.00 0.00 -0.53 0.00 0.00 54.58 51.00 2pgc n ASN 198 Cb 0.42 -0.57 -0.06 0.00 -2.08 0.00 0.00 39.78 37.49 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 -2.94 0.29 0.06 -3.83 3.52 -1.26 -5.00 118.95 109.80 2pgc s ARG 200 Ca 0.43 0.54 -0.10 0.00 -0.13 0.00 0.00 55.73 56.47 2pgc s ARG 200 Cb 0.36 0.13 0.01 0.00 -1.56 0.00 0.00 34.95 33.89 2pgc s ARG 200 CO 0.07 -0.07 0.22 -0.80 -0.81 0.00 0.00 175.30 173.91 2pgc s ASN 201 N 1.54 0.03 -0.11 -2.12 0.01 -0.46 -4.87 114.94 108.96 2pgc s ASN 201 Ca -0.07 -0.45 -0.01 0.00 -0.71 0.00 0.00 52.86 51.62 2pgc s ASN 201 Cb -0.04 0.33 -0.03 0.00 0.41 0.00 0.00 41.25 41.93 2pgc s ASN 201 CO -0.15 -0.65 -0.07 -0.63 -1.51 0.00 0.00 177.10 174.10 2pgc s ILE 202 N -3.13 3.63 -0.12 0.60 1.01 -1.26 -1.54 121.20 120.38 2pgc s ILE 202 Ca -0.01 -0.47 -0.01 0.00 0.00 0.00 0.00 60.65 60.16 2pgc s ILE 202 Cb 0.01 -2.54 -0.02 0.00 0.01 0.00 0.00 42.46 39.93 2pgc s ILE 202 CO -0.07 0.54 -0.08 -0.63 0.00 0.00 0.00 174.94 174.70 2pgc s ILE 203 N -0.12 3.55 -0.34 2.92 1.01 0.14 -0.53 121.20 127.83 2pgc s ILE 203 Ca 0.01 -0.50 -0.16 0.00 0.00 0.00 0.00 60.65 60.00 2pgc s ILE 203 Cb -0.13 -2.50 -0.01 0.00 0.01 0.00 0.00 42.46 39.83 2pgc s ILE 203 CO 0.03 0.53 0.40 -1.59 0.00 0.00 0.00 174.94 174.32 2pgc s LYS 204 N 0.00 3.60 0.13 2.79 0.00 0.05 -1.10 119.74 125.22 2pgc s LYS 204 Ca -0.01 -0.32 -0.31 0.00 0.00 0.00 0.00 55.97 55.32 2pgc s LYS 204 Cb -0.14 -3.80 -0.09 0.00 0.00 0.00 0.00 37.83 33.80 2pgc s LYS 204 CO 0.03 -0.55 1.59 0.42 0.00 0.00 0.00 175.35 176.84 2pgc s ILE 205 N 2.12 2.79 -2.64 3.79 -1.09 -0.24 -1.51 121.20 124.43 2pgc s ILE 205 Ca 0.14 0.48 0.21 0.00 -2.23 0.00 0.00 60.65 59.25 2pgc s ILE 205 Cb -0.16 -3.31 0.17 0.00 -1.58 0.00 0.00 42.46 37.58 2pgc s ILE 205 CO 0.12 0.02 1.17 0.18 -1.23 0.00 0.00 174.94 175.20