#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2pyg s TYR 3 N 0.00 -0.02 -0.30 1.24 1.51 -0.40 -4.96 117.35 114.41 2pyg s TYR 3 Ca 0.00 0.14 -0.17 0.00 -1.01 0.00 0.00 57.07 56.03 2pyg s TYR 3 Cb 0.00 -0.10 -0.02 0.00 -0.11 0.00 0.00 41.96 41.73 2pyg s TYR 3 CO 0.00 -0.06 0.45 1.21 -1.11 0.00 0.00 175.55 176.04 2pyg s ASN 4 N 0.57 6.31 0.51 2.29 3.84 -1.26 -0.43 114.94 126.77 2pyg s ASN 4 Ca -0.05 0.18 0.31 0.00 0.21 0.00 0.00 52.86 53.51 2pyg s ASN 4 Cb -0.07 -2.25 1.43 0.00 -0.55 0.00 0.00 41.25 39.82 2pyg s ASN 4 CO -0.02 -0.33 1.82 -0.37 -2.79 0.00 0.00 177.10 175.42 2pyg h VAL 5 N 5.49 0.48 0.00 -5.21 -1.51 -1.72 0.50 116.25 114.28 2pyg h VAL 5 Ca -0.29 -0.03 -0.01 0.00 -1.23 0.00 0.00 66.70 65.13 2pyg h VAL 5 Cb 1.14 0.37 -0.00 0.00 -2.13 0.00 0.00 31.29 30.67 2pyg h VAL 5 CO 0.71 0.02 -0.05 0.11 -1.23 0.00 0.00 177.57 177.12 2pyg h LYS 6 N 0.09 0.00 0.00 5.19 1.57 -1.84 0.23 116.57 121.82 2pyg h LYS 6 Ca 0.53 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.31 2pyg h LYS 6 Cb 1.93 0.00 0.00 0.00 0.08 0.00 0.00 32.23 34.24 2pyg h LYS 6 CO -0.07 0.05 0.00 -0.25 -0.57 0.00 0.00 179.45 178.61 2pyg n ASP 7 N -3.34 0.00 -0.65 0.86 8.00 0.18 -2.35 116.55 119.25 2pyg n ASP 7 Ca -0.01 0.41 0.06 0.00 0.71 0.00 0.00 54.79 55.96 2pyg n ASP 7 Cb 0.21 -0.46 0.17 0.00 -0.02 0.00 0.00 41.12 41.02 2pyg n ASP 7 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 2pyg n PHE 8 N -1.46 0.54 0.00 1.24 3.01 0.76 -4.96 117.46 116.59 2pyg n PHE 8 Ca 0.06 -0.59 0.00 0.00 1.01 0.00 0.00 57.45 57.93 2pyg n PHE 8 Cb 0.24 -0.10 0.00 0.00 -0.01 0.00 0.00 39.48 39.61 2pyg n PHE 8 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2pyg n GLY 9 N 0.20 0.64 3.71 1.37 0.00 -0.99 -4.50 105.19 105.61 2pyg n GLY 9 Ca 0.13 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.73 2pyg n GLY 9 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2pyg s ALA 10 N -2.00 3.52 -0.19 4.61 0.00 -0.93 -4.92 121.76 121.85 2pyg s ALA 10 Ca 0.00 0.97 -0.06 0.00 0.00 0.00 0.00 51.96 52.87 2pyg s ALA 10 Cb 0.00 -3.52 -0.21 0.00 0.00 0.00 0.00 23.12 19.39 2pyg s ALA 10 CO 0.00 -0.63 0.08 1.28 0.00 0.00 0.00 175.76 176.49 2pyg n LEU 11 N 4.29 2.63 -3.31 0.00 4.77 -1.26 -4.23 117.00 119.89 2pyg n LEU 11 Ca 0.11 0.12 -0.20 0.00 -0.03 0.00 0.00 56.01 56.01 2pyg n LEU 11 Cb 0.44 -1.01 0.08 0.00 -2.33 0.00 0.00 43.42 40.60 2pyg n LEU 11 CO 0.57 0.81 0.18 0.61 -1.33 0.00 0.00 177.39 178.23 2pyg n GLY 12 N 1.97 -0.38 1.35 -0.72 0.00 -1.26 -4.91 105.19 101.24 2pyg n GLY 12 Ca -0.39 0.14 0.09 0.00 0.00 0.00 0.00 46.02 45.85 2pyg n GLY 12 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2pyg n ASP 13 N -2.78 4.40 -1.09 1.61 5.68 -1.15 -3.49 116.55 119.73 2pyg n ASP 13 Ca -0.10 -2.50 -0.14 0.00 -0.50 0.00 0.00 54.79 51.55 2pyg n ASP 13 Cb 0.59 -0.53 -0.06 0.00 -1.14 0.00 0.00 41.12 39.99 2pyg n ASP 13 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2pyg n GLY 14 N 0.75 1.47 2.01 6.12 0.00 0.28 -4.69 105.19 111.12 2pyg n GLY 14 Ca 0.23 -0.29 0.00 0.00 0.00 0.00 0.00 46.02 45.96 2pyg n GLY 14 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2pyg n VAL 15 N -2.55 0.00 -2.07 1.61 0.31 -1.26 -4.91 118.33 109.46 2pyg n VAL 15 Ca -0.14 0.00 -0.38 0.00 -0.01 0.00 0.00 64.34 63.81 2pyg n VAL 15 Cb 0.49 -0.34 0.01 0.00 -0.91 0.00 0.00 33.84 33.08 2pyg n VAL 15 CO 0.00 0.00 0.00 -0.44 -1.32 0.00 0.00 176.83 175.07 2pyg s SER 16 N -4.06 5.92 -0.73 4.52 0.01 -1.26 -4.87 113.70 113.23 2pyg s SER 16 Ca 0.00 2.51 -0.24 0.00 1.31 0.00 0.00 55.95 59.53 2pyg s SER 16 Cb 0.00 -2.62 0.05 0.00 0.21 0.00 0.00 66.02 63.66 2pyg s SER 16 CO 0.00 -1.11 1.15 -0.62 0.41 0.00 0.00 173.24 173.07 2pyg s ASP 17 N -1.12 6.21 0.00 2.44 -1.08 -1.26 -3.54 116.67 118.32 2pyg s ASP 17 Ca 0.65 -0.83 0.12 0.00 -0.52 0.00 0.00 52.55 51.97 2pyg s ASP 17 Cb -0.34 -2.49 0.49 0.00 -1.46 0.00 0.00 42.92 39.12 2pyg s ASP 17 CO 0.41 -1.61 1.35 0.47 0.52 0.00 0.00 175.17 176.31 2pyg n ASP 18 N 8.49 0.99 -0.01 -0.34 8.00 0.26 -4.50 116.55 129.44 2pyg n ASP 18 Ca 0.03 -1.82 -0.10 0.00 0.71 0.00 0.00 54.79 53.61 2pyg n ASP 18 Cb 0.48 -0.10 -0.06 0.00 -0.02 0.00 0.00 41.12 41.41 2pyg n ASP 18 CO 0.00 0.00 0.00 -0.09 -0.39 0.00 0.00 177.20 176.72 2pyg h ARG 19 N 1.17 -0.36 -0.58 -1.24 2.43 -1.90 -0.09 114.38 113.82 2pyg h ARG 19 Ca 0.00 0.02 0.11 0.00 -0.81 0.00 0.00 59.98 59.31 2pyg h ARG 19 Cb 0.26 0.08 -0.09 0.00 -0.42 0.00 0.00 29.97 29.80 2pyg h ARG 19 CO 0.00 -0.24 0.06 0.00 -1.51 0.00 0.00 179.97 178.28 2pyg h ALA 20 N -0.68 0.62 0.31 2.80 0.00 -1.94 0.23 119.26 120.60 2pyg h ALA 20 Ca 0.02 0.15 0.00 0.00 0.00 0.00 0.00 54.91 55.09 2pyg h ALA 20 Cb 0.44 0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.45 2pyg h ALA 20 CO -0.29 -0.36 -0.33 0.77 0.00 0.00 0.00 179.25 179.05 2pyg h SER 21 N 0.18 -0.89 -0.75 0.00 0.02 -1.67 0.20 113.55 110.64 2pyg h SER 21 Ca 0.30 0.08 0.03 0.00 -0.84 0.00 0.00 61.79 61.36 2pyg h SER 21 Cb 0.47 0.30 -0.05 0.00 0.14 0.00 0.00 62.40 63.26 2pyg h SER 21 CO -0.44 -0.46 0.47 0.40 -1.14 0.00 0.00 176.83 175.66 2pyg h ILE 22 N -0.68 1.10 -0.35 3.27 2.04 -0.34 -1.18 117.51 121.38 2pyg h ILE 22 Ca -0.01 -0.31 -0.05 0.00 1.00 0.00 0.00 64.86 65.48 2pyg h ILE 22 Cb 0.62 0.11 -0.02 0.00 -0.74 0.00 0.00 36.82 36.79 2pyg h ILE 22 CO -0.07 0.17 0.01 -0.61 0.00 0.00 0.00 178.15 177.65 2pyg h GLN 23 N 0.92 0.54 -0.52 2.37 5.75 -0.18 -1.05 115.11 122.93 2pyg h GLN 23 Ca 0.30 -0.11 -0.05 0.00 -0.15 0.00 0.00 58.65 58.64 2pyg h GLN 23 Cb 0.03 -0.08 -0.02 0.00 1.07 0.00 0.00 27.48 28.47 2pyg h GLN 23 CO -0.11 0.55 0.13 0.00 -2.65 0.00 0.00 178.83 176.75 2pyg h ALA 24 N 1.50 0.69 -0.60 3.38 0.00 0.53 -0.04 119.26 124.71 2pyg h ALA 24 Ca 0.11 -0.21 -0.06 0.00 0.00 0.00 0.00 54.91 54.76 2pyg h ALA 24 Cb 0.32 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.88 2pyg h ALA 24 CO 0.01 0.37 0.15 0.00 0.00 0.00 0.00 179.25 179.78 2pyg h ALA 25 N 1.01 1.13 -0.44 0.00 0.00 -0.66 -0.73 119.26 119.56 2pyg h ALA 25 Ca 0.16 -0.22 -0.06 0.00 0.00 0.00 0.00 54.91 54.80 2pyg h ALA 25 Cb 0.32 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.86 2pyg h ALA 25 CO 0.00 0.59 0.05 0.82 0.00 0.00 0.00 179.25 180.71 2pyg h ILE 26 N 0.90 1.25 -0.30 0.00 2.04 -0.82 -1.81 117.51 118.77 2pyg h ILE 26 Ca 0.19 -0.94 -0.06 0.00 1.00 0.00 0.00 64.86 65.06 2pyg h ILE 26 Cb 0.32 1.00 -0.02 0.00 -0.74 0.00 0.00 36.82 37.38 2pyg h ILE 26 CO -0.00 0.32 -0.08 0.44 0.00 0.00 0.00 178.15 178.83 2pyg h ASP 27 N 0.59 0.47 -0.12 1.72 3.32 -0.63 -0.27 116.42 121.50 2pyg h ASP 27 Ca 0.13 -0.11 -0.02 0.00 0.02 0.00 0.00 57.03 57.05 2pyg h ASP 27 Cb 0.41 -0.12 -0.00 0.00 0.22 0.00 0.00 39.33 39.83 2pyg h ASP 27 CO 0.01 0.60 0.00 0.00 -1.72 0.00 0.00 179.24 178.13 2pyg h ALA 28 N 1.46 0.17 -0.47 3.45 0.00 -0.88 -1.05 119.26 121.94 2pyg h ALA 28 Ca 0.09 -0.18 0.03 0.00 0.00 0.00 0.00 54.91 54.85 2pyg h ALA 28 Cb 0.43 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 18.14 2pyg h ALA 28 CO 0.02 -0.15 0.25 0.00 0.00 0.00 0.00 179.25 179.38 2pyg h ALA 29 N 0.76 0.60 -0.06 0.00 0.00 -1.02 -0.33 119.26 119.20 2pyg h ALA 29 Ca 0.04 0.01 0.03 0.00 0.00 0.00 0.00 54.91 54.98 2pyg h ALA 29 Cb 0.35 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 18.01 2pyg h ALA 29 CO 0.01 -0.08 -0.15 -0.92 0.00 0.00 0.00 179.25 178.11 2pyg h TYR 30 N 0.50 -0.38 -0.60 0.00 3.20 -0.91 0.21 116.97 118.99 2pyg h TYR 30 Ca 0.20 0.02 0.05 0.00 3.14 0.00 0.00 58.73 62.14 2pyg h TYR 30 Cb 0.08 0.18 -0.04 0.00 1.54 0.00 0.00 36.73 38.49 2pyg h TYR 30 CO -0.09 -0.22 0.40 0.00 -1.64 0.00 0.00 178.16 176.62 2pyg h ALA 31 N 0.78 1.77 0.00 1.82 0.00 -0.74 0.13 119.26 123.03 2pyg h ALA 31 Ca 0.07 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.96 2pyg h ALA 31 Cb 0.31 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 17.94 2pyg h ALA 31 CO -0.18 0.14 0.00 0.00 0.00 0.00 0.00 179.25 179.20 2pyg n ALA 32 N -2.47 2.33 -0.93 0.00 0.00 -0.17 -4.80 120.51 114.46 2pyg n ALA 32 Ca 0.08 -0.03 0.00 0.00 0.00 0.00 0.00 53.44 53.50 2pyg n ALA 32 Cb 0.21 -1.07 0.00 0.00 0.00 0.00 0.00 19.45 18.59 2pyg n ALA 32 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2pyg n GLY 33 N 0.36 0.50 0.00 0.00 0.00 0.46 -4.89 105.19 101.61 2pyg n GLY 33 Ca 0.03 -0.33 0.00 0.00 0.00 0.00 0.00 46.02 45.73 2pyg n GLY 33 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2pyg n GLY 34 N -2.93 3.32 0.00 -0.02 0.00 0.63 -4.80 105.19 101.40 2pyg n GLY 34 Ca 0.00 -1.86 0.00 0.00 0.00 0.00 0.00 46.02 44.16 2pyg n GLY 34 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2pyg n GLY 35 N -1.00 -0.16 3.75 -0.02 0.00 0.17 -4.78 105.19 103.15 2pyg n GLY 35 Ca 0.00 -1.19 -0.35 0.00 0.00 0.00 0.00 46.02 44.47 2pyg n GLY 35 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2pyg s THR 36 N -2.00 5.41 -0.36 2.61 2.01 -1.26 -1.77 115.64 120.28 2pyg s THR 36 Ca 0.00 0.24 -0.12 0.00 0.31 0.00 0.00 61.69 62.11 2pyg s THR 36 Cb 0.00 -3.48 0.00 0.00 0.01 0.00 0.00 72.50 69.04 2pyg s THR 36 CO 0.00 0.46 0.23 -0.69 -0.69 0.00 0.00 174.62 173.93 2pyg s VAL 37 N 0.17 4.97 -0.12 3.82 1.01 0.16 -1.28 120.40 129.13 2pyg s VAL 37 Ca 0.10 -0.52 -0.07 0.00 0.00 0.00 0.00 61.98 61.49 2pyg s VAL 37 Cb -0.11 -3.66 -0.04 0.00 0.00 0.00 0.00 36.38 32.57 2pyg s VAL 37 CO -0.00 -0.12 0.15 -0.47 0.00 0.00 0.00 175.10 174.65 2pyg s TYR 38 N 1.65 3.60 -0.26 5.22 5.04 0.43 -0.48 117.35 132.55 2pyg s TYR 38 Ca 0.05 0.54 0.01 0.00 -2.44 0.00 0.00 57.07 55.23 2pyg s TYR 38 Cb -0.18 -1.95 0.07 0.00 0.35 0.00 0.00 41.96 40.25 2pyg s TYR 38 CO 0.09 0.73 -0.03 -0.51 -1.34 0.00 0.00 175.55 174.48 2pyg s LEU 39 N -1.00 2.94 1.02 6.97 1.02 0.07 -1.74 118.68 127.96 2pyg s LEU 39 Ca 0.15 -1.38 -0.12 0.00 0.02 0.00 0.00 54.13 52.80 2pyg s LEU 39 Cb -0.12 -1.25 0.16 0.00 0.02 0.00 0.00 46.19 45.00 2pyg s LEU 39 CO 0.04 -0.27 0.85 -2.65 0.02 0.00 0.00 176.35 174.35 2pyg n PRO 40 N 4.60 -1.12 -1.47 1.29 -0.02 -1.26 -3.34 135.00 133.68 2pyg n PRO 40 Ca -0.09 -0.28 -0.40 0.00 -2.02 0.00 0.00 63.50 60.71 2pyg n PRO 40 Cb 0.43 -2.15 0.02 0.00 -0.02 0.00 0.00 33.50 31.78 2pyg n PRO 40 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2pyg n ALA 41 N -4.37 -1.25 0.00 3.55 0.00 -1.26 -4.75 120.51 112.43 2pyg n ALA 41 Ca 0.07 0.09 0.00 0.00 0.00 0.00 0.00 53.44 53.60 2pyg n ALA 41 Cb 0.54 -1.81 0.00 0.00 0.00 0.00 0.00 19.45 18.18 2pyg n ALA 41 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2pyg n GLY 42 N 1.75 2.99 3.46 0.00 0.00 -0.21 -4.95 105.19 108.23 2pyg n GLY 42 Ca 0.11 -1.79 -0.38 0.00 0.00 0.00 0.00 46.02 43.96 2pyg n GLY 42 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2pyg s GLU 43 N -1.93 3.43 -0.33 1.61 2.12 -1.23 -0.83 118.70 121.54 2pyg s GLU 43 Ca 0.00 -0.65 -0.10 0.00 0.36 0.00 0.00 54.97 54.57 2pyg s GLU 43 Cb 0.00 -3.57 0.01 0.00 0.26 0.00 0.00 34.13 30.83 2pyg s GLU 43 CO 0.00 -0.37 0.17 0.71 -0.54 0.00 0.00 175.26 175.23 2pyg s TYR 44 N 1.63 3.20 0.36 5.30 1.51 0.21 -0.56 117.35 129.01 2pyg s TYR 44 Ca 0.05 -0.71 -0.23 0.00 -1.01 0.00 0.00 57.07 55.17 2pyg s TYR 44 Cb -0.17 -2.39 -0.10 0.00 -0.11 0.00 0.00 41.96 39.19 2pyg s TYR 44 CO 0.07 -0.53 0.92 1.03 -1.11 0.00 0.00 175.55 175.93 2pyg s ARG 45 N 1.59 4.38 0.03 -0.62 1.81 -1.23 -1.09 118.95 123.82 2pyg s ARG 45 Ca 0.04 1.17 -0.05 0.00 -1.72 0.00 0.00 55.73 55.17 2pyg s ARG 45 Cb -0.18 -2.53 -0.01 0.00 -0.45 0.00 0.00 34.95 31.78 2pyg s ARG 45 CO 0.06 0.15 0.08 0.14 -0.68 0.00 0.00 175.30 175.06 2pyg s VAL 46 N -1.87 0.12 0.39 3.52 -7.23 -0.64 -0.57 120.40 114.13 2pyg s VAL 46 Ca 0.55 -1.01 0.08 0.00 -1.81 0.00 0.00 61.98 59.78 2pyg s VAL 46 Cb -0.14 -0.73 -0.06 0.00 0.56 0.00 0.00 36.38 36.01 2pyg s VAL 46 CO 0.19 -0.56 0.10 -0.94 -0.31 0.00 0.00 175.10 173.58 2pyg s SER 47 N -1.91 4.24 0.34 4.85 1.04 -1.26 -1.27 113.70 119.74 2pyg s SER 47 Ca -0.08 -1.12 -0.29 0.00 0.48 0.00 0.00 55.95 54.94 2pyg s SER 47 Cb -0.03 -0.48 -0.11 0.00 0.10 0.00 0.00 66.02 65.50 2pyg s SER 47 CO -0.03 -0.45 1.52 0.00 0.98 0.00 0.00 173.24 175.26 2pyg s ALA 48 N -2.61 3.63 -0.01 5.32 0.00 -1.26 -4.63 121.76 122.21 2pyg s ALA 48 Ca 0.38 1.56 0.24 0.00 0.00 0.00 0.00 51.96 54.14 2pyg s ALA 48 Cb 0.04 -3.62 0.77 0.00 0.00 0.00 0.00 23.12 20.32 2pyg s ALA 48 CO 0.21 -1.01 1.76 0.00 0.00 0.00 0.00 175.76 176.71 2pyg h ALA 49 N 3.68 0.96 0.00 0.00 0.00 -0.76 -3.49 119.26 119.65 2pyg h ALA 49 Ca -0.49 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.24 2pyg h ALA 49 Cb 1.23 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.99 2pyg h ALA 49 CO 0.70 0.24 0.00 0.41 0.00 0.00 0.00 179.25 180.60 2pyg n GLY 50 N 0.45 -0.90 3.85 0.00 0.00 -1.26 -5.04 105.19 102.28 2pyg n GLY 50 Ca 0.01 0.51 -0.30 0.00 0.00 0.00 0.00 46.02 46.24 2pyg n GLY 50 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2pyg s GLU 51 N 0.00 2.45 0.25 1.61 0.41 -1.26 -4.90 118.70 117.26 2pyg s GLU 51 Ca 0.00 0.53 -0.03 0.00 -0.41 0.00 0.00 54.97 55.06 2pyg s GLU 51 Cb 0.00 -1.97 0.52 0.00 -1.78 0.00 0.00 34.13 30.90 2pyg s GLU 51 CO 0.00 -1.34 1.69 -1.35 -0.49 0.00 0.00 175.26 173.78 2pyg h PRO 52 N -0.88 0.32 0.00 0.39 0.11 -1.95 0.99 132.00 130.98 2pyg h PRO 52 Ca -0.46 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.63 2pyg h PRO 52 Cb 1.26 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.30 2pyg h PRO 52 CO 0.62 0.21 0.00 0.41 -0.21 0.00 0.00 178.00 179.03 2pyg n GLY 53 N -1.35 -0.74 0.02 -0.55 0.00 -1.26 -1.50 105.19 99.81 2pyg n GLY 53 Ca 0.16 -0.03 0.12 0.00 0.00 0.00 0.00 46.02 46.27 2pyg n GLY 53 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2pyg n ASP 54 N -1.48 0.58 0.00 1.61 8.00 0.34 -4.73 116.55 120.88 2pyg n ASP 54 Ca 0.02 -0.19 0.00 0.00 0.71 0.00 0.00 54.79 55.33 2pyg n ASP 54 Cb 0.09 0.35 0.00 0.00 -0.02 0.00 0.00 41.12 41.53 2pyg n ASP 54 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2pyg n GLY 55 N 1.44 1.80 0.67 0.44 0.00 -0.78 -4.43 105.19 104.33 2pyg n GLY 55 Ca 0.04 -0.44 -0.11 0.00 0.00 0.00 0.00 46.02 45.51 2pyg n GLY 55 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2pyg s LEU 57 N -6.65 1.89 -0.51 0.00 1.43 0.14 -4.43 118.68 110.55 2pyg s LEU 57 Ca -0.15 -0.45 -0.12 0.00 -1.03 0.00 0.00 54.13 52.38 2pyg s LEU 57 Cb 0.05 -1.17 0.13 0.00 0.03 0.00 0.00 46.19 45.23 2pyg s LEU 57 CO 0.19 0.10 0.42 -0.32 0.23 0.00 0.00 176.35 176.96 2pyg s MET 58 N 0.55 2.70 0.74 1.70 1.75 -1.26 -1.24 119.30 124.24 2pyg s MET 58 Ca -0.16 -1.77 -0.11 0.00 -1.25 0.00 0.00 55.69 52.40 2pyg s MET 58 Cb -0.17 -4.08 0.04 0.00 2.84 0.00 0.00 34.83 33.46 2pyg s MET 58 CO 0.05 -1.25 1.08 -0.51 -0.65 0.00 0.00 175.02 173.75 2pyg s LEU 59 N 1.40 3.08 0.24 4.11 1.43 0.13 -4.94 118.68 124.14 2pyg s LEU 59 Ca 0.05 1.76 -0.04 0.00 -1.03 0.00 0.00 54.13 54.87 2pyg s LEU 59 Cb -0.27 -4.51 -0.02 0.00 0.03 0.00 0.00 46.19 41.41 2pyg s LEU 59 CO 0.00 -1.83 0.28 -0.54 0.23 0.00 0.00 176.35 174.50 2pyg s LYS 60 N -4.92 1.42 0.11 1.70 1.02 -1.26 -4.42 119.74 113.39 2pyg s LYS 60 Ca 0.60 -1.56 -0.34 0.00 0.02 0.00 0.00 55.97 54.69 2pyg s LYS 60 Cb -0.16 0.35 -0.18 0.00 -0.52 0.00 0.00 37.83 37.32 2pyg s LYS 60 CO 0.55 -0.53 0.94 -0.25 -0.92 0.00 0.00 175.35 175.14 2pyg n ASP 61 N -0.52 0.03 0.00 2.83 8.00 -1.26 -1.44 116.55 124.19 2pyg n ASP 61 Ca 0.01 1.15 0.00 0.00 0.71 0.00 0.00 54.79 56.66 2pyg n ASP 61 Cb 0.64 -1.02 0.00 0.00 -0.02 0.00 0.00 41.12 40.72 2pyg n ASP 61 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2pyg n GLY 62 N 1.81 0.60 3.77 0.44 0.00 0.12 -4.45 105.19 107.48 2pyg n GLY 62 Ca 0.18 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.84 2pyg n GLY 62 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2pyg s VAL 63 N -2.45 5.34 0.02 1.61 1.01 -0.52 -0.66 120.40 124.75 2pyg s VAL 63 Ca 0.00 0.16 0.06 0.00 0.00 0.00 0.00 61.98 62.20 2pyg s VAL 63 Cb 0.00 -3.38 -0.02 0.00 0.00 0.00 0.00 36.38 32.98 2pyg s VAL 63 CO 0.00 0.52 -0.18 -0.31 0.00 0.00 0.00 175.10 175.13 2pyg s TYR 64 N -0.22 1.55 -0.05 5.22 1.51 -0.73 -2.88 117.35 121.75 2pyg s TYR 64 Ca 0.10 -0.34 -0.08 0.00 -1.01 0.00 0.00 57.07 55.74 2pyg s TYR 64 Cb -0.12 -0.95 -0.05 0.00 -0.11 0.00 0.00 41.96 40.74 2pyg s TYR 64 CO 0.01 0.04 0.23 -0.51 -1.11 0.00 0.00 175.55 174.21 2pyg s LEU 65 N -0.92 4.40 -0.05 -1.29 1.43 -0.43 0.35 118.68 122.17 2pyg s LEU 65 Ca 0.05 0.59 -0.02 0.00 -1.03 0.00 0.00 54.13 53.72 2pyg s LEU 65 Cb -0.08 -2.37 0.04 0.00 0.03 0.00 0.00 46.19 43.81 2pyg s LEU 65 CO 0.01 0.34 0.10 0.00 0.23 0.00 0.00 176.35 177.03 2pyg s ALA 66 N -1.13 -0.08 0.13 4.21 0.00 0.37 -0.85 121.76 124.40 2pyg s ALA 66 Ca 0.21 0.49 0.01 0.00 0.00 0.00 0.00 51.96 52.67 2pyg s ALA 66 Cb -0.13 -0.48 0.01 0.00 0.00 0.00 0.00 23.12 22.52 2pyg s ALA 66 CO 0.10 -0.25 0.11 0.41 0.00 0.00 0.00 175.76 176.13 2pyg n GLY 67 N 4.53 2.74 0.66 0.00 0.00 -0.69 -0.75 105.19 111.68 2pyg n GLY 67 Ca -0.20 -2.19 0.05 0.00 0.00 0.00 0.00 46.02 43.68 2pyg n GLY 67 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2pyg n ALA 68 N -2.77 2.54 0.00 4.61 0.00 -1.16 -4.78 120.51 118.96 2pyg n ALA 68 Ca -0.04 -0.60 0.00 0.00 0.00 0.00 0.00 53.44 52.80 2pyg n ALA 68 Cb 0.14 -0.99 0.00 0.00 0.00 0.00 0.00 19.45 18.60 2pyg n ALA 68 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2pyg n GLY 69 N 0.90 3.43 3.67 0.00 0.00 0.93 -4.76 105.19 109.37 2pyg n GLY 69 Ca 0.11 -1.79 -0.44 0.00 0.00 0.00 0.00 46.02 43.90 2pyg n GLY 69 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2pyg n MET 70 N -1.07 1.99 0.00 1.61 0.00 -1.25 -0.82 117.12 117.58 2pyg n MET 70 Ca 0.00 0.70 0.00 0.00 0.00 0.00 0.00 57.70 58.40 2pyg n MET 70 Cb 0.00 -2.30 0.00 0.00 0.00 0.00 0.00 33.22 30.92 2pyg n MET 70 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 2pyg n GLY 71 N 1.52 2.45 0.09 3.03 0.00 -1.26 -4.69 105.19 106.33 2pyg n GLY 71 Ca 0.09 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.93 2pyg n GLY 71 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2pyg h GLU 72 N 0.54 0.06 -5.08 1.61 4.39 -1.29 -3.44 114.58 111.36 2pyg h GLU 72 Ca 0.00 -0.10 -0.64 0.00 0.34 0.00 0.00 59.36 58.97 2pyg h GLU 72 Cb 0.00 0.04 -0.20 0.00 -0.10 0.00 0.00 28.75 28.49 2pyg h GLU 72 CO 0.00 1.05 -0.60 0.99 -1.16 0.00 0.00 179.01 179.29 2pyg s THR 73 N -2.31 4.53 -0.10 1.13 2.01 -0.66 -1.04 115.64 119.19 2pyg s THR 73 Ca -0.22 -0.11 -0.00 0.00 0.31 0.00 0.00 61.69 61.67 2pyg s THR 73 Cb 0.01 -3.08 0.02 0.00 0.01 0.00 0.00 72.50 69.46 2pyg s THR 73 CO 0.68 0.38 -0.06 -0.69 -0.69 0.00 0.00 174.62 174.24 2pyg s VAL 74 N 1.11 0.90 -0.31 3.82 1.01 -0.01 -0.73 120.40 126.19 2pyg s VAL 74 Ca 0.04 -0.22 -0.11 0.00 0.00 0.00 0.00 61.98 61.69 2pyg s VAL 74 Cb -0.14 -0.94 -0.03 0.00 0.00 0.00 0.00 36.38 35.27 2pyg s VAL 74 CO 0.03 0.34 0.19 -0.63 0.00 0.00 0.00 175.10 175.04 2pyg s ILE 75 N 1.65 5.05 -0.02 2.22 1.01 0.11 0.64 121.20 131.85 2pyg s ILE 75 Ca 0.03 -0.14 0.05 0.00 0.00 0.00 0.00 60.65 60.59 2pyg s ILE 75 Cb -0.13 -3.51 -0.01 0.00 0.01 0.00 0.00 42.46 38.82 2pyg s ILE 75 CO -0.07 0.12 -0.16 -0.75 0.00 0.00 0.00 174.94 174.08 2pyg s LYS 76 N 1.70 1.43 0.32 2.79 2.20 -0.25 -0.35 119.74 127.57 2pyg s LYS 76 Ca 0.06 -0.58 -0.29 0.00 -0.36 0.00 0.00 55.97 54.80 2pyg s LYS 76 Cb -0.17 -1.35 -0.10 0.00 -1.51 0.00 0.00 37.83 34.70 2pyg s LYS 76 CO 0.09 0.32 1.40 -1.17 -0.36 0.00 0.00 175.35 175.63 2pyg s LEU 77 N -0.26 4.39 0.50 5.43 2.96 -0.75 -1.61 118.68 129.34 2pyg s LEU 77 Ca 0.04 2.77 -0.23 0.00 -0.22 0.00 0.00 54.13 56.49 2pyg s LEU 77 Cb -0.08 -3.65 -0.06 0.00 0.50 0.00 0.00 46.19 42.91 2pyg s LEU 77 CO 0.00 -0.68 1.30 0.27 -1.32 0.00 0.00 176.35 175.92 2pyg s ILE 78 N -0.76 2.45 0.54 6.68 -4.36 -0.40 -4.74 121.20 120.62 2pyg s ILE 78 Ca 0.53 0.34 -0.22 0.00 -0.26 0.00 0.00 60.65 61.05 2pyg s ILE 78 Cb -0.42 -3.18 -0.05 0.00 1.25 0.00 0.00 42.46 40.06 2pyg s ILE 78 CO 0.52 0.00 1.32 -1.81 0.24 0.00 0.00 174.94 175.22 2pyg s ASP 79 N -1.04 5.37 0.00 4.36 1.01 -1.26 -2.60 116.67 122.51 2pyg s ASP 79 Ca 0.67 2.68 0.00 0.00 0.71 0.00 0.00 52.55 56.61 2pyg s ASP 79 Cb -0.37 -2.63 0.00 0.00 1.01 0.00 0.00 42.92 40.93 2pyg s ASP 79 CO 0.44 -1.50 0.00 0.61 0.21 0.00 0.00 175.17 174.94 2pyg n GLY 80 N 0.68 2.35 3.66 0.21 0.00 0.06 -5.01 105.19 107.14 2pyg n GLY 80 Ca 0.10 0.00 -0.46 0.00 0.00 0.00 0.00 46.02 45.66 2pyg n GLY 80 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2pyg n SER 81 N 0.00 2.67 -2.84 1.61 2.88 -1.07 -4.81 113.62 112.05 2pyg n SER 81 Ca 0.00 1.12 -0.12 0.00 -1.33 0.00 0.00 58.87 58.54 2pyg n SER 81 Cb 0.00 -1.39 0.02 0.00 -0.75 0.00 0.00 64.21 62.09 2pyg n SER 81 CO 0.00 0.00 0.00 -0.90 -1.23 0.00 0.00 175.04 172.91 2pyg n ASP 82 N 2.60 0.90 -3.84 -3.46 5.75 -1.25 -1.04 116.55 116.20 2pyg n ASP 82 Ca 0.14 -2.83 -0.09 0.00 -0.01 0.00 0.00 54.79 52.00 2pyg n ASP 82 Cb 0.29 -0.38 -0.07 0.00 -1.03 0.00 0.00 41.12 39.93 2pyg n ASP 82 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2pyg s GLN 83 N -2.57 0.86 0.06 0.11 -2.07 -1.11 -4.74 119.66 110.21 2pyg s GLN 83 Ca 0.31 -0.93 -0.31 0.00 -1.82 0.00 0.00 55.36 52.61 2pyg s GLN 83 Cb 0.41 0.35 -0.07 0.00 -1.09 0.00 0.00 33.01 32.61 2pyg s GLN 83 CO -0.01 -0.28 1.45 0.21 -1.32 0.00 0.00 175.29 175.34 2pyg s LYS 84 N -3.82 4.28 -0.30 9.60 2.20 -1.26 -4.46 119.74 125.98 2pyg s LYS 84 Ca 0.04 2.09 0.02 0.00 -0.36 0.00 0.00 55.97 57.76 2pyg s LYS 84 Cb 0.04 -3.43 0.09 0.00 -1.51 0.00 0.00 37.83 33.02 2pyg s LYS 84 CO -0.11 -0.55 0.03 0.42 -0.36 0.00 0.00 175.35 174.78 2pyg s ILE 85 N 1.88 1.61 -1.34 5.43 1.01 -0.22 -3.70 121.20 125.88 2pyg s ILE 85 Ca 0.66 -1.71 -0.14 0.00 0.00 0.00 0.00 60.65 59.45 2pyg s ILE 85 Cb -0.36 -2.10 0.09 0.00 0.01 0.00 0.00 42.46 40.11 2pyg s ILE 85 CO 0.29 -0.48 1.88 0.41 0.00 0.00 0.00 174.94 177.05 2pyg n THR 86 N 4.56 3.90 0.00 2.92 -1.04 -0.56 -1.58 114.28 122.48 2pyg n THR 86 Ca -0.03 -3.88 0.00 0.00 -2.04 0.00 0.00 64.05 58.10 2pyg n THR 86 Cb 0.43 -2.46 0.00 0.00 -1.82 0.00 0.00 70.33 66.48 2pyg n THR 86 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2pyg n GLY 87 N 4.31 0.54 0.32 3.41 0.00 -0.92 -4.48 105.19 108.38 2pyg n GLY 87 Ca 0.47 -0.81 0.13 0.00 0.00 0.00 0.00 46.02 45.80 2pyg n GLY 87 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 2pyg h MET 88 N 0.00 0.07 -4.39 1.61 0.00 0.39 -3.01 114.93 109.60 2pyg h MET 88 Ca 0.00 -0.00 -0.51 0.00 0.00 0.00 0.00 59.70 59.19 2pyg h MET 88 Cb 0.00 -0.02 -0.35 0.00 0.00 0.00 0.00 31.60 31.24 2pyg h MET 88 CO 0.00 0.05 -0.81 0.08 0.00 0.00 0.00 176.91 176.23 2pyg s VAL 89 N -5.10 1.05 0.39 -2.22 1.01 -1.02 0.26 120.40 114.77 2pyg s VAL 89 Ca -0.05 -0.38 -0.13 0.00 0.00 0.00 0.00 61.98 61.42 2pyg s VAL 89 Cb 0.18 -1.00 0.05 0.00 0.00 0.00 0.00 36.38 35.61 2pyg s VAL 89 CO 0.71 0.35 0.75 0.00 0.00 0.00 0.00 175.10 176.90 2pyg s ARG 90 N 1.06 2.24 0.27 2.72 1.70 -0.37 -2.33 118.95 124.24 2pyg s ARG 90 Ca -0.07 -1.55 0.10 0.00 -0.47 0.00 0.00 55.73 53.74 2pyg s ARG 90 Cb -0.15 0.60 -0.05 0.00 -0.57 0.00 0.00 34.95 34.79 2pyg s ARG 90 CO -0.01 -1.04 -0.07 -1.54 -1.08 0.00 0.00 175.30 171.57 2pyg s SER 91 N -3.12 4.23 0.14 -2.89 1.04 -1.12 0.21 113.70 112.18 2pyg s SER 91 Ca 0.19 -0.76 -0.31 0.00 0.48 0.00 0.00 55.95 55.55 2pyg s SER 91 Cb -0.04 -0.67 -0.08 0.00 0.10 0.00 0.00 66.02 65.33 2pyg s SER 91 CO 0.14 0.02 1.32 0.00 0.98 0.00 0.00 173.24 175.70 2pyg s ALA 92 N -2.35 3.53 0.61 5.32 0.00 -1.26 -4.69 121.76 122.92 2pyg s ALA 92 Ca 0.31 1.06 -0.19 0.00 0.00 0.00 0.00 51.96 53.13 2pyg s ALA 92 Cb -0.06 -3.50 -0.02 0.00 0.00 0.00 0.00 23.12 19.54 2pyg s ALA 92 CO 0.18 -0.54 1.32 -0.47 0.00 0.00 0.00 175.76 176.25 2pyg s TYR 93 N 0.71 2.15 -0.09 0.00 6.14 -1.26 -2.64 117.35 122.36 2pyg s TYR 93 Ca 0.60 1.44 0.00 0.00 0.64 0.00 0.00 57.07 59.75 2pyg s TYR 93 Cb -0.35 -3.74 0.00 0.00 0.42 0.00 0.00 41.96 38.29 2pyg s TYR 93 CO 0.33 -2.93 0.00 0.41 0.64 0.00 0.00 175.55 174.00 2pyg n GLY 94 N 0.83 0.21 3.10 8.97 0.00 -0.21 -4.97 105.19 113.12 2pyg n GLY 94 Ca 0.14 -0.02 -0.25 0.00 0.00 0.00 0.00 46.02 45.89 2pyg n GLY 94 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2pyg s GLU 95 N -1.58 1.63 -0.81 1.61 2.02 -1.08 -5.02 118.70 115.46 2pyg s GLU 95 Ca 0.00 -0.53 -0.23 0.00 0.02 0.00 0.00 54.97 54.23 2pyg s GLU 95 Cb 0.00 -1.42 0.07 0.00 0.10 0.00 0.00 34.13 32.88 2pyg s GLU 95 CO 0.00 0.20 1.17 -1.21 0.02 0.00 0.00 175.26 175.44 2pyg s GLU 96 N 0.13 3.34 0.13 1.61 2.02 -1.26 -4.62 118.70 120.04 2pyg s GLU 96 Ca -0.05 -0.97 -0.21 0.00 0.02 0.00 0.00 54.97 53.76 2pyg s GLU 96 Cb -0.11 -4.61 -0.07 0.00 0.10 0.00 0.00 34.13 29.43 2pyg s GLU 96 CO 0.02 -1.96 0.65 0.99 0.02 0.00 0.00 175.26 174.98 2pyg s THR 97 N 4.31 4.62 0.07 3.63 2.01 -1.26 -4.92 115.64 124.10 2pyg s THR 97 Ca 0.32 1.33 0.03 0.00 0.31 0.00 0.00 61.69 63.69 2pyg s THR 97 Cb -0.09 -3.95 -0.03 0.00 0.01 0.00 0.00 72.50 68.45 2pyg s THR 97 CO 0.02 0.47 -0.09 -0.44 -0.69 0.00 0.00 174.62 173.89 2pyg s SER 98 N -1.26 1.16 -0.76 3.53 0.01 -1.26 -1.37 113.70 113.75 2pyg s SER 98 Ca 0.34 -0.73 -0.01 0.00 1.31 0.00 0.00 55.95 56.87 2pyg s SER 98 Cb -0.20 0.03 0.00 0.00 0.21 0.00 0.00 66.02 66.07 2pyg s SER 98 CO 0.21 -0.26 0.67 -3.20 0.41 0.00 0.00 173.24 171.07 2pyg n ASN 99 N 0.88 -6.94 -3.55 2.44 5.15 -0.28 -2.30 115.26 110.67 2pyg n ASN 99 Ca -0.19 -0.32 -0.10 0.00 -0.60 0.00 0.00 54.58 53.38 2pyg n ASN 99 Cb 0.57 -4.24 -0.02 0.00 -0.53 0.00 0.00 39.78 35.56 2pyg n ASN 99 CO 0.00 0.00 0.00 0.72 1.40 0.00 0.00 177.26 179.38 2pyg s PHE 100 N -2.98 0.31 -4.90 1.20 -0.71 -1.04 0.15 117.98 110.00 2pyg s PHE 100 Ca 0.01 -0.75 0.00 0.00 -1.04 0.00 0.00 56.93 55.14 2pyg s PHE 100 Cb -0.00 0.42 0.00 0.00 -1.21 0.00 0.00 43.02 42.23 2pyg s PHE 100 CO 0.79 -1.23 0.00 0.41 -1.34 0.00 0.00 175.22 173.86 2pyg n GLY 101 N -0.47 -0.62 3.40 1.99 0.00 -1.14 -1.86 105.19 106.49 2pyg n GLY 101 Ca -0.03 -1.13 -0.13 0.00 0.00 0.00 0.00 46.02 44.74 2pyg n GLY 101 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 2pyg s MET 102 N -1.96 1.17 0.15 1.61 0.23 -1.01 -1.31 119.30 118.18 2pyg s MET 102 Ca 0.00 -0.42 -0.19 0.00 -1.03 0.00 0.00 55.69 54.06 2pyg s MET 102 Cb 0.00 0.53 0.04 0.00 -1.53 0.00 0.00 34.83 33.88 2pyg s MET 102 CO 0.00 -0.47 0.49 -0.98 -2.03 0.00 0.00 175.02 172.03 2pyg s ARG 103 N -3.29 1.21 -1.24 3.16 1.70 -0.03 -1.88 118.95 118.58 2pyg s ARG 103 Ca -0.01 -0.67 -0.19 0.00 -0.47 0.00 0.00 55.73 54.38 2pyg s ARG 103 Cb -0.00 0.52 0.01 0.00 -0.57 0.00 0.00 34.95 34.91 2pyg s ARG 103 CO -0.09 -0.51 0.64 -0.25 -1.08 0.00 0.00 175.30 174.02 2pyg n ASP 104 N -0.30 -3.60 -3.08 -2.89 8.00 -0.41 -1.70 116.55 112.57 2pyg n ASP 104 Ca -0.15 -1.11 -0.07 0.00 0.71 0.00 0.00 54.79 54.17 2pyg n ASP 104 Cb 0.64 -2.73 0.02 0.00 -0.02 0.00 0.00 41.12 39.02 2pyg n ASP 104 CO 0.00 0.00 0.00 -1.48 -0.39 0.00 0.00 177.20 175.33 2pyg s LEU 105 N -6.91 -0.01 -0.03 0.64 0.05 -1.20 -0.05 118.68 111.17 2pyg s LEU 105 Ca 0.36 -1.01 0.03 0.00 0.05 0.00 0.00 54.13 53.55 2pyg s LEU 105 Cb -0.15 2.68 0.00 0.00 -2.05 0.00 0.00 46.19 46.67 2pyg s LEU 105 CO 0.91 -1.52 -0.10 -0.89 -0.55 0.00 0.00 176.35 174.20 2pyg s THR 106 N -2.39 0.83 -0.21 5.48 2.01 0.09 -1.65 115.64 119.79 2pyg s THR 106 Ca 0.16 -0.39 -0.05 0.00 0.31 0.00 0.00 61.69 61.72 2pyg s THR 106 Cb -0.05 -0.73 -0.02 0.00 0.01 0.00 0.00 72.50 71.71 2pyg s THR 106 CO 0.10 0.25 0.01 -0.76 -0.69 0.00 0.00 174.62 173.53 2pyg s LEU 107 N 0.15 3.25 -0.23 4.42 1.43 0.49 0.05 118.68 128.23 2pyg s LEU 107 Ca -0.03 -0.22 -0.00 0.00 -1.03 0.00 0.00 54.13 52.85 2pyg s LEU 107 Cb -0.08 -1.83 0.03 0.00 0.03 0.00 0.00 46.19 44.33 2pyg s LEU 107 CO 0.00 0.04 -0.10 -0.62 0.23 0.00 0.00 176.35 175.91 2pyg s ASP 108 N 1.13 4.07 0.00 2.29 -1.08 0.52 -1.36 116.67 122.24 2pyg s ASP 108 Ca 0.03 -0.90 0.25 0.00 -0.52 0.00 0.00 52.55 51.41 2pyg s ASP 108 Cb -0.14 -1.61 1.11 0.00 -1.46 0.00 0.00 42.92 40.82 2pyg s ASP 108 CO 0.01 -0.11 1.80 0.61 0.52 0.00 0.00 175.17 178.01 2pyg n GLY 109 N 4.62 -1.28 4.20 2.66 0.00 0.03 -1.80 105.19 113.62 2pyg n GLY 109 Ca -0.17 -0.09 -0.30 0.00 0.00 0.00 0.00 46.02 45.45 2pyg n GLY 109 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2pyg n ASN 110 N -1.44 -0.11 0.27 1.61 5.15 -1.10 -4.65 115.26 115.00 2pyg n ASN 110 Ca 0.08 -1.16 0.16 0.00 -0.60 0.00 0.00 54.58 53.06 2pyg n ASN 110 Cb 0.26 -2.21 0.72 0.00 -0.53 0.00 0.00 39.78 38.02 2pyg n ASN 110 CO 0.00 0.00 0.00 0.08 1.40 0.00 0.00 177.26 178.74 2pyg h ARG 111 N -1.70 0.00 0.00 1.20 0.11 -1.64 -2.39 114.38 109.96 2pyg h ARG 111 Ca -0.64 0.00 -0.05 0.00 0.10 0.00 0.00 59.98 59.39 2pyg h ARG 111 Cb 1.39 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 32.46 2pyg h ARG 111 CO 0.70 0.06 -0.22 -0.44 0.10 0.00 0.00 179.97 180.17 2pyg h ASP 112 N 0.00 0.00 -0.07 0.08 3.32 -1.87 -3.18 116.42 114.70 2pyg h ASP 112 Ca -0.00 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 57.05 2pyg h ASP 112 Cb 0.46 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.01 2pyg h ASP 112 CO 0.01 0.22 -0.01 0.59 -1.72 0.00 0.00 179.24 178.33 2pyg n ASN 113 N -3.84 2.72 -4.03 6.45 3.02 -0.92 -5.04 115.26 113.62 2pyg n ASN 113 Ca -0.02 -3.10 -0.11 0.00 -0.03 0.00 0.00 54.58 51.32 2pyg n ASN 113 Cb 0.32 -0.46 -0.07 0.00 -0.61 0.00 0.00 39.78 38.95 2pyg n ASN 113 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 2pyg s THR 114 N -2.88 0.00 0.19 3.41 -4.23 -1.08 -0.76 115.64 110.29 2pyg s THR 114 Ca 0.35 -1.69 0.02 0.00 -1.18 0.00 0.00 61.69 59.19 2pyg s THR 114 Cb 0.30 -2.37 -0.05 0.00 1.34 0.00 0.00 72.50 71.72 2pyg s THR 114 CO 0.04 0.00 -0.00 -0.94 -0.54 0.00 0.00 174.62 173.18 2pyg s SER 115 N -3.10 1.42 0.00 3.99 1.04 -0.21 -4.82 113.70 112.02 2pyg s SER 115 Ca 0.31 -1.19 0.00 0.00 0.48 0.00 0.00 55.95 55.55 2pyg s SER 115 Cb 0.03 0.08 0.00 0.00 0.10 0.00 0.00 66.02 66.23 2pyg s SER 115 CO 0.11 -0.55 0.00 0.61 0.98 0.00 0.00 173.24 174.40 2pyg n GLY 116 N -0.30 1.67 3.64 7.32 0.00 -1.26 -2.73 105.19 113.53 2pyg n GLY 116 Ca -0.06 -1.67 -0.43 0.00 0.00 0.00 0.00 46.02 43.86 2pyg n GLY 116 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2pyg s LYS 117 N -4.14 3.93 -0.13 1.61 2.20 -1.26 -4.76 119.74 117.18 2pyg s LYS 117 Ca 0.00 1.60 0.02 0.00 -0.36 0.00 0.00 55.97 57.23 2pyg s LYS 117 Cb 0.00 -3.95 0.01 0.00 -1.51 0.00 0.00 37.83 32.38 2pyg s LYS 117 CO 0.00 -1.12 -0.20 0.08 -0.36 0.00 0.00 175.35 173.75 2pyg s VAL 118 N 4.61 1.91 -0.10 4.02 1.01 -1.26 -1.06 120.40 129.52 2pyg s VAL 118 Ca 0.65 -0.89 -0.02 0.00 0.00 0.00 0.00 61.98 61.73 2pyg s VAL 118 Cb -0.23 -1.70 -0.03 0.00 0.00 0.00 0.00 36.38 34.42 2pyg s VAL 118 CO 0.25 0.52 -0.03 -1.81 0.00 0.00 0.00 175.10 174.03 2pyg s ASP 119 N 0.89 4.93 0.03 3.32 1.01 -0.61 -0.57 116.67 125.66 2pyg s ASP 119 Ca -0.06 0.01 -0.21 0.00 0.71 0.00 0.00 52.55 53.00 2pyg s ASP 119 Cb -0.15 -1.47 -0.12 0.00 1.01 0.00 0.00 42.92 42.19 2pyg s ASP 119 CO -0.02 0.31 1.26 1.23 0.21 0.00 0.00 175.17 178.16 2pyg h GLY 120 N 5.65 -0.81 -4.69 0.21 0.00 -0.90 -0.38 103.07 102.15 2pyg h GLY 120 Ca -0.44 0.30 -0.67 0.00 0.00 0.00 0.00 47.33 46.52 2pyg h GLY 120 CO 0.56 -0.29 -0.88 0.86 0.00 0.00 0.00 176.54 176.79 2pyg s TRP 121 N -4.59 2.16 -0.07 5.60 -0.11 -0.47 -1.21 118.94 120.25 2pyg s TRP 121 Ca -0.11 -0.41 -0.09 0.00 1.22 0.00 0.00 56.10 56.70 2pyg s TRP 121 Cb 0.01 -1.39 0.02 0.00 -1.50 0.00 0.00 33.47 30.61 2pyg s TRP 121 CO 0.34 -0.04 0.24 0.12 -4.62 0.00 0.00 176.95 172.99 2pyg s PHE 122 N -0.55 -0.21 -0.03 5.86 2.19 -0.98 0.46 117.98 124.70 2pyg s PHE 122 Ca 0.09 0.49 -0.29 0.00 0.33 0.00 0.00 56.93 57.55 2pyg s PHE 122 Cb -0.09 0.07 0.09 0.00 -1.31 0.00 0.00 43.02 41.78 2pyg s PHE 122 CO -0.01 -0.19 0.80 0.54 1.83 0.00 0.00 175.22 178.19 2pyg s ASN 123 N -0.31 -0.50 0.00 6.13 4.22 -1.24 -2.81 114.94 120.43 2pyg s ASN 123 Ca -0.04 0.34 0.00 0.00 -2.14 0.00 0.00 52.86 51.02 2pyg s ASN 123 Cb -0.03 0.45 0.00 0.00 1.28 0.00 0.00 41.25 42.95 2pyg s ASN 123 CO 0.01 -0.60 0.00 0.61 -2.04 0.00 0.00 177.10 175.08 2pyg n GLY 124 N 0.37 -1.96 0.00 0.45 0.00 -1.26 0.94 105.19 103.73 2pyg n GLY 124 Ca -0.14 -1.32 0.00 0.00 0.00 0.00 0.00 46.02 44.56 2pyg n GLY 124 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 2pyg n TYR 125 N 4.08 0.00 -3.70 1.61 9.36 -0.48 -4.61 117.16 123.43 2pyg n TYR 125 Ca 0.00 0.00 -0.14 0.00 3.32 0.00 0.00 57.90 61.08 2pyg n TYR 125 Cb 0.00 0.00 -0.14 0.00 -0.63 0.00 0.00 39.34 38.57 2pyg n TYR 125 CO 0.00 0.00 0.00 0.42 0.22 0.00 0.00 176.86 177.50 2pyg s ILE 126 N 0.00 -0.22 0.08 2.97 1.01 -1.20 -1.05 121.20 122.79 2pyg s ILE 126 Ca 0.00 0.23 -0.32 0.00 0.00 0.00 0.00 60.65 60.56 2pyg s ILE 126 Cb 0.00 -0.38 -0.11 0.00 0.01 0.00 0.00 42.46 41.97 2pyg s ILE 126 CO 0.00 0.10 1.81 -2.65 0.00 0.00 0.00 174.94 174.20 2pyg n PRO 127 N 4.83 2.54 -0.90 2.79 -0.02 -1.26 0.26 135.00 143.24 2pyg n PRO 127 Ca -0.15 0.92 0.00 0.00 -2.02 0.00 0.00 63.50 62.26 2pyg n PRO 127 Cb 0.51 -2.79 0.00 0.00 -0.02 0.00 0.00 33.50 31.20 2pyg n PRO 127 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2pyg n GLY 128 N 4.14 0.70 3.95 -1.23 0.00 -1.26 -5.00 105.19 106.49 2pyg n GLY 128 Ca 0.19 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.98 2pyg n GLY 128 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2pyg s GLY 129 N -2.00 1.41 -0.72 -0.02 0.00 0.14 -5.05 107.32 101.08 2pyg s GLY 129 Ca 0.00 -1.07 -0.22 0.00 0.00 0.00 0.00 44.72 43.43 2pyg s GLY 129 CO 0.00 -1.06 1.04 -0.35 0.00 0.00 0.00 173.10 172.74 2pyg s ASP 130 N -3.73 6.26 0.00 1.64 2.15 -1.26 -4.71 116.67 117.00 2pyg s ASP 130 Ca 0.36 -1.12 0.00 0.00 0.43 0.00 0.00 52.55 52.22 2pyg s ASP 130 Cb -0.10 -2.44 0.00 0.00 -0.30 0.00 0.00 42.92 40.09 2pyg s ASP 130 CO 0.30 -1.43 0.00 0.61 -0.17 0.00 0.00 175.17 174.49 2pyg n GLY 131 N 5.43 2.14 3.48 2.66 0.00 -1.26 -5.03 105.19 112.62 2pyg n GLY 131 Ca 0.03 -1.08 -0.11 0.00 0.00 0.00 0.00 46.02 44.87 2pyg n GLY 131 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2pyg s ALA 132 N -2.00 -1.75 0.42 4.61 0.00 -1.26 -3.99 121.76 117.78 2pyg s ALA 132 Ca 0.00 0.91 -0.15 0.00 0.00 0.00 0.00 51.96 52.72 2pyg s ALA 132 Cb 0.00 0.45 -0.08 0.00 0.00 0.00 0.00 23.12 23.49 2pyg s ALA 132 CO 0.00 -0.66 0.85 -0.51 0.00 0.00 0.00 175.76 175.44 2pyg s ASP 133 N -2.36 6.71 0.01 0.00 1.11 0.14 -4.30 116.67 117.98 2pyg s ASP 133 Ca 0.02 1.40 -0.02 0.00 0.18 0.00 0.00 52.55 54.14 2pyg s ASP 133 Cb -0.01 -2.43 -0.01 0.00 1.07 0.00 0.00 42.92 41.54 2pyg s ASP 133 CO -0.08 -0.38 0.01 -0.13 1.18 0.00 0.00 175.17 175.77 2pyg s ARG 134 N -3.52 0.29 -0.78 8.23 0.52 -0.47 -0.62 118.95 122.60 2pyg s ARG 134 Ca 0.56 -0.46 -0.02 0.00 -0.52 0.00 0.00 55.73 55.29 2pyg s ARG 134 Cb -0.10 0.11 -0.03 0.00 0.52 0.00 0.00 34.95 35.45 2pyg s ARG 134 CO 0.23 -0.05 0.71 -3.47 0.02 0.00 0.00 175.30 172.74 2pyg n ASP 135 N 1.82 -6.66 -4.34 0.23 -0.08 -0.79 -1.12 116.55 105.61 2pyg n ASP 135 Ca -0.22 -0.32 -0.32 0.00 -1.51 0.00 0.00 54.79 52.42 2pyg n ASP 135 Cb 0.56 -4.75 -0.15 0.00 2.34 0.00 0.00 41.12 39.12 2pyg n ASP 135 CO 0.00 0.00 0.00 -0.69 0.12 0.00 0.00 177.20 176.63 2pyg s VAL 136 N -3.16 2.70 -0.10 5.18 1.01 -0.99 -2.18 120.40 122.86 2pyg s VAL 136 Ca 0.19 -0.81 0.00 0.00 0.00 0.00 0.00 61.98 61.36 2pyg s VAL 136 Cb -0.02 -2.08 0.02 0.00 0.00 0.00 0.00 36.38 34.30 2pyg s VAL 136 CO 0.66 0.55 -0.07 -0.89 0.00 0.00 0.00 175.10 175.34 2pyg s THR 137 N 0.11 0.94 -0.13 3.92 2.01 -0.78 0.18 115.64 121.90 2pyg s THR 137 Ca -0.08 -0.27 0.02 0.00 0.31 0.00 0.00 61.69 61.67 2pyg s THR 137 Cb -0.15 -0.96 0.01 0.00 0.01 0.00 0.00 72.50 71.42 2pyg s THR 137 CO 0.05 0.34 -0.19 -0.63 -0.69 0.00 0.00 174.62 173.51 2pyg s ILE 138 N 1.49 1.85 -0.03 1.82 1.01 0.72 -2.40 121.20 125.67 2pyg s ILE 138 Ca 0.00 -0.85 0.02 0.00 0.00 0.00 0.00 60.65 59.82 2pyg s ILE 138 Cb -0.13 -1.66 0.01 0.00 0.01 0.00 0.00 42.46 40.69 2pyg s ILE 138 CO -0.05 0.51 -0.06 -1.61 0.00 0.00 0.00 174.94 173.73 2pyg s GLU 139 N 0.97 0.83 -1.21 2.79 2.02 -0.79 -1.28 118.70 122.03 2pyg s GLU 139 Ca -0.05 -0.17 -0.16 0.00 0.02 0.00 0.00 54.97 54.61 2pyg s GLU 139 Cb -0.15 -0.80 -0.00 0.00 0.10 0.00 0.00 34.13 33.27 2pyg s GLU 139 CO -0.04 -0.01 0.71 0.54 0.02 0.00 0.00 175.26 176.48 2pyg n ARG 140 N 3.71 -1.76 -5.05 1.61 1.74 -0.69 -1.97 116.66 114.25 2pyg n ARG 140 Ca -0.22 0.43 -0.29 0.00 -0.77 0.00 0.00 57.85 57.00 2pyg n ARG 140 Cb 0.53 -4.16 -0.15 0.00 -1.02 0.00 0.00 32.46 27.65 2pyg n ARG 140 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 2pyg s VAL 141 N -3.58 1.84 -0.14 1.55 1.01 -1.26 -1.29 120.40 118.54 2pyg s VAL 141 Ca 0.36 -1.07 -0.01 0.00 0.00 0.00 0.00 61.98 61.26 2pyg s VAL 141 Cb -0.13 -1.55 -0.02 0.00 0.00 0.00 0.00 36.38 34.69 2pyg s VAL 141 CO 0.87 0.46 -0.12 -0.70 0.00 0.00 0.00 175.10 175.61 2pyg s GLU 142 N -0.72 3.40 -0.12 2.72 2.12 -0.66 -1.16 118.70 124.29 2pyg s GLU 142 Ca 0.09 -0.67 0.03 0.00 0.36 0.00 0.00 54.97 54.78 2pyg s GLU 142 Cb -0.09 -2.67 0.01 0.00 0.26 0.00 0.00 34.13 31.64 2pyg s GLU 142 CO -0.00 0.20 -0.22 0.08 -0.54 0.00 0.00 175.26 174.78 2pyg s VAL 143 N 0.40 2.00 0.12 3.70 1.01 0.31 -0.38 120.40 127.55 2pyg s VAL 143 Ca -0.10 -0.96 -0.12 0.00 0.00 0.00 0.00 61.98 60.80 2pyg s VAL 143 Cb -0.16 -1.75 0.01 0.00 0.00 0.00 0.00 36.38 34.48 2pyg s VAL 143 CO 0.05 0.54 0.30 0.00 0.00 0.00 0.00 175.10 175.99 2pyg s ARG 144 N 0.64 0.99 -1.82 2.72 1.70 -0.46 -1.61 118.95 121.10 2pyg s ARG 144 Ca -0.12 -0.88 0.00 0.00 -0.47 0.00 0.00 55.73 54.27 2pyg s ARG 144 Cb -0.16 0.41 0.00 0.00 -0.57 0.00 0.00 34.95 34.62 2pyg s ARG 144 CO 0.02 -0.36 0.00 0.39 -1.08 0.00 0.00 175.30 174.28 2pyg n GLU 145 N -0.16 -1.63 -2.84 3.89 -0.58 -0.95 -0.79 120.64 117.58 2pyg n GLU 145 Ca -0.14 1.02 -0.40 0.00 -0.42 0.00 0.00 57.16 57.22 2pyg n GLU 145 Cb 0.63 -5.56 -0.05 0.00 -0.57 0.00 0.00 31.44 25.89 2pyg n GLU 145 CO 0.00 0.00 0.00 -1.64 -0.48 0.00 0.00 177.13 175.01 2pyg s MET 146 N -4.46 4.68 0.45 3.49 -1.94 -1.25 -1.68 119.30 118.58 2pyg s MET 146 Ca 0.00 1.33 0.24 0.00 -1.71 0.00 0.00 55.69 55.55 2pyg s MET 146 Cb 0.00 -3.32 0.98 0.00 2.01 0.00 0.00 34.83 34.50 2pyg s MET 146 CO 0.00 0.41 1.85 0.66 -0.01 0.00 0.00 175.02 177.93 2pyg h SER 147 N 4.85 0.00 0.00 3.03 4.64 -1.84 1.05 113.55 125.28 2pyg h SER 147 Ca -0.45 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.87 2pyg h SER 147 Cb 1.21 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.30 2pyg h SER 147 CO 0.69 0.21 0.00 0.61 -0.87 0.00 0.00 176.83 177.47 2pyg n GLY 148 N 0.07 1.01 3.88 -0.77 0.00 0.26 -3.44 105.19 106.20 2pyg n GLY 148 Ca -0.00 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.72 2pyg n GLY 148 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2pyg s TYR 149 N 3.63 3.55 0.00 1.61 2.02 -1.25 0.00 117.35 126.91 2pyg s TYR 149 Ca 0.00 1.11 0.00 0.00 -0.37 0.00 0.00 57.07 57.81 2pyg s TYR 149 Cb 0.00 -2.54 0.00 0.00 -0.40 0.00 0.00 41.96 39.02 2pyg s TYR 149 CO 0.00 -0.40 0.00 0.41 -1.57 0.00 0.00 175.55 173.99 2pyg n GLY 150 N -2.15 1.33 3.61 0.71 0.00 -0.16 -1.66 105.19 106.87 2pyg n GLY 150 Ca 0.04 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.68 2pyg n GLY 150 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2pyg s PHE 151 N 0.00 3.24 -0.50 1.61 0.40 -0.05 -1.37 117.98 121.31 2pyg s PHE 151 Ca 0.00 0.20 0.07 0.00 -0.60 0.00 0.00 56.93 56.60 2pyg s PHE 151 Cb 0.00 -2.40 0.37 0.00 0.51 0.00 0.00 43.02 41.50 2pyg s PHE 151 CO 0.00 -0.13 0.97 -3.47 0.70 0.00 0.00 175.22 173.29 2pyg n ASP 152 N 4.96 3.89 -4.74 1.36 2.03 0.17 -0.52 116.55 123.70 2pyg n ASP 152 Ca -0.13 -3.55 -0.42 0.00 0.52 0.00 0.00 54.79 51.21 2pyg n ASP 152 Cb 0.52 -0.54 -0.02 0.00 -0.72 0.00 0.00 41.12 40.36 2pyg n ASP 152 CO 0.00 0.00 0.00 -0.81 -1.92 0.00 0.00 177.20 174.47 2pyg n PRO 153 N -0.23 2.68 -4.55 -0.67 -0.04 -1.24 -3.73 135.00 127.22 2pyg n PRO 153 Ca 0.31 0.95 -0.26 0.00 -0.04 0.00 0.00 63.50 64.46 2pyg n PRO 153 Cb 0.53 -2.73 -0.09 0.00 -0.04 0.00 0.00 33.50 31.17 2pyg n PRO 153 CO 0.00 0.00 0.00 -1.58 -0.04 0.00 0.00 175.50 173.88 2pyg s HIS 154 N 0.00 1.90 -0.01 0.54 2.46 0.27 -2.35 115.29 118.09 2pyg s HIS 154 Ca 0.64 -1.09 -0.30 0.00 0.47 0.00 0.00 55.06 54.79 2pyg s HIS 154 Cb -0.50 -1.32 -0.08 0.00 -0.13 0.00 0.00 32.58 30.55 2pyg s HIS 154 CO 0.48 -0.07 2.00 -2.00 -2.47 0.00 0.00 174.74 172.69 2pyg s GLU 155 N -3.79 3.96 0.11 2.88 2.12 -0.55 -2.75 118.70 120.67 2pyg s GLU 155 Ca 0.25 2.48 0.08 0.00 0.36 0.00 0.00 54.97 58.15 2pyg s GLU 155 Cb 0.05 -4.19 -0.04 0.00 0.26 0.00 0.00 34.13 30.20 2pyg s GLU 155 CO 0.13 -1.16 -0.17 -0.65 -0.54 0.00 0.00 175.26 172.87 2pyg s GLN 156 N 4.79 1.86 -0.06 4.30 -0.21 -1.26 -1.38 119.66 127.70 2pyg s GLN 156 Ca 0.90 -1.14 -0.01 0.00 0.02 0.00 0.00 55.36 55.13 2pyg s GLN 156 Cb -0.40 -2.15 0.03 0.00 1.00 0.00 0.00 33.01 31.49 2pyg s GLN 156 CO 0.40 0.49 0.01 0.99 -2.12 0.00 0.00 175.29 175.06 2pyg s THR 157 N -1.13 0.31 -0.12 -0.19 2.01 -1.06 -0.68 115.64 114.77 2pyg s THR 157 Ca 0.18 0.15 -0.03 0.00 0.31 0.00 0.00 61.69 62.30 2pyg s THR 157 Cb -0.11 -0.47 -0.03 0.00 0.01 0.00 0.00 72.50 71.90 2pyg s THR 157 CO 0.10 0.24 -0.01 -0.63 -0.69 0.00 0.00 174.62 173.64 2pyg s ILE 158 N 1.89 4.22 -1.13 1.82 -1.09 0.21 -0.56 121.20 126.56 2pyg s ILE 158 Ca 0.03 -0.26 -0.06 0.00 -2.23 0.00 0.00 60.65 58.13 2pyg s ILE 158 Cb -0.12 -2.81 -0.03 0.00 -1.58 0.00 0.00 42.46 37.91 2pyg s ILE 158 CO -0.04 0.55 0.89 -3.20 -1.23 0.00 0.00 174.94 171.90 2pyg n ASN 159 N 2.75 -4.61 -4.90 3.58 5.15 0.08 -1.89 115.26 115.42 2pyg n ASN 159 Ca -0.18 -0.75 -0.33 0.00 -0.60 0.00 0.00 54.58 52.72 2pyg n ASN 159 Cb 0.53 -4.76 -0.05 0.00 -0.53 0.00 0.00 39.78 34.97 2pyg n ASN 159 CO 0.00 0.00 0.00 -0.22 1.40 0.00 0.00 177.26 178.44 2pyg s LEU 160 N -5.96 4.35 -0.06 1.20 2.96 -1.26 -2.36 118.68 117.57 2pyg s LEU 160 Ca 0.29 0.45 -0.00 0.00 -0.22 0.00 0.00 54.13 54.65 2pyg s LEU 160 Cb -0.05 -2.81 0.02 0.00 0.50 0.00 0.00 46.19 43.85 2pyg s LEU 160 CO 0.77 0.21 -0.03 -0.89 -1.32 0.00 0.00 176.35 175.09 2pyg s THR 161 N -1.40 0.48 -0.15 3.68 2.01 0.13 -0.83 115.64 119.56 2pyg s THR 161 Ca 0.31 -0.02 -0.00 0.00 0.31 0.00 0.00 61.69 62.29 2pyg s THR 161 Cb -0.13 -0.56 0.03 0.00 0.01 0.00 0.00 72.50 71.85 2pyg s THR 161 CO 0.20 0.24 -0.10 -0.63 -0.69 0.00 0.00 174.62 173.65 2pyg s ILE 162 N 1.39 1.30 0.06 1.82 1.01 -0.60 -0.20 121.20 125.99 2pyg s ILE 162 Ca -0.04 -0.56 0.00 0.00 0.00 0.00 0.00 60.65 60.06 2pyg s ILE 162 Cb -0.13 -1.32 -0.04 0.00 0.01 0.00 0.00 42.46 40.98 2pyg s ILE 162 CO -0.03 0.33 -0.04 0.00 0.00 0.00 0.00 174.94 175.20 2pyg s ARG 163 N 1.58 0.65 -1.41 2.79 1.70 -0.41 -1.10 118.95 122.75 2pyg s ARG 163 Ca 0.03 -1.18 -0.16 0.00 -0.47 0.00 0.00 55.73 53.96 2pyg s ARG 163 Cb -0.14 0.05 0.15 0.00 -0.57 0.00 0.00 34.95 34.45 2pyg s ARG 163 CO -0.09 -0.07 0.52 -0.25 -1.08 0.00 0.00 175.30 174.33 2pyg n ASP 164 N 0.26 -2.38 -4.80 -2.89 8.00 -0.38 -1.71 116.55 112.65 2pyg n ASP 164 Ca -0.15 -0.73 -0.23 0.00 0.71 0.00 0.00 54.79 54.39 2pyg n ASP 164 Cb 0.60 -2.03 -0.05 0.00 -0.02 0.00 0.00 41.12 39.62 2pyg n ASP 164 CO 0.00 0.00 0.00 -0.44 -0.39 0.00 0.00 177.20 176.37 2pyg s SER 165 N -2.93 4.72 -0.01 -2.24 0.01 -1.24 -3.12 113.70 108.88 2pyg s SER 165 Ca 0.59 -0.92 -0.00 0.00 1.31 0.00 0.00 55.95 56.93 2pyg s SER 165 Cb -0.33 -0.52 0.01 0.00 0.21 0.00 0.00 66.02 65.39 2pyg s SER 165 CO 0.72 -0.60 0.02 -0.69 0.41 0.00 0.00 173.24 173.11 2pyg s VAL 166 N -2.54 -0.03 -0.09 3.43 1.01 -0.31 -0.90 120.40 120.97 2pyg s VAL 166 Ca 0.44 0.09 -0.00 0.00 0.00 0.00 0.00 61.98 62.52 2pyg s VAL 166 Cb 0.01 -0.05 0.02 0.00 0.00 0.00 0.00 36.38 36.36 2pyg s VAL 166 CO 0.25 0.04 -0.07 0.00 0.00 0.00 0.00 175.10 175.32 2pyg s ALA 167 N 0.47 1.16 0.06 5.51 0.00 0.06 -0.53 121.76 128.48 2pyg s ALA 167 Ca -0.04 -0.42 -0.12 0.00 0.00 0.00 0.00 51.96 51.38 2pyg s ALA 167 Cb -0.06 -0.80 0.01 0.00 0.00 0.00 0.00 23.12 22.28 2pyg s ALA 167 CO -0.01 -0.32 0.27 -3.38 0.00 0.00 0.00 175.76 172.32 2pyg s HIS 168 N 1.54 -0.04 -1.45 0.00 -3.43 -0.64 -2.19 115.29 109.09 2pyg s HIS 168 Ca 0.01 -0.18 -0.09 0.00 -0.80 0.00 0.00 55.06 54.00 2pyg s HIS 168 Cb -0.13 0.06 0.03 0.00 -1.43 0.00 0.00 32.58 31.11 2pyg s HIS 168 CO -0.05 -0.51 0.94 -0.25 -2.00 0.00 0.00 174.74 172.86 2pyg n ASP 169 N 0.42 -5.72 -4.91 7.38 8.00 -1.07 -3.14 116.55 117.50 2pyg n ASP 169 Ca -0.18 -0.53 -0.23 0.00 0.71 0.00 0.00 54.79 54.56 2pyg n ASP 169 Cb 0.60 -4.56 -0.03 0.00 -0.02 0.00 0.00 41.12 37.11 2pyg n ASP 169 CO 0.00 0.00 0.00 0.20 -0.39 0.00 0.00 177.20 177.01 2pyg s ASN 170 N -3.12 6.01 0.32 -2.24 0.01 -1.26 -2.23 114.94 112.43 2pyg s ASN 170 Ca 0.53 -0.02 0.04 0.00 -0.71 0.00 0.00 52.86 52.69 2pyg s ASN 170 Cb -0.25 -1.70 0.53 0.00 0.41 0.00 0.00 41.25 40.25 2pyg s ASN 170 CO 0.65 -0.02 1.81 1.23 -1.51 0.00 0.00 177.10 179.27 2pyg h GLY 171 N 1.59 0.54 0.00 0.66 0.00 0.18 -1.30 103.07 104.74 2pyg h GLY 171 Ca -0.50 -0.36 0.00 0.00 0.00 0.00 0.00 47.33 46.47 2pyg h GLY 171 CO 0.63 0.34 0.00 1.04 0.00 0.00 0.00 176.54 178.54 2pyg n LEU 172 N -4.22 0.00 -4.82 3.11 4.77 0.10 -4.20 117.00 111.74 2pyg n LEU 172 Ca 0.01 0.00 -0.34 0.00 -0.03 0.00 0.00 56.01 55.65 2pyg n LEU 172 Cb 0.31 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.34 2pyg n LEU 172 CO 0.40 0.00 -0.22 -1.81 -1.33 0.00 0.00 177.39 174.43 2pyg s ASP 173 N 0.78 5.94 0.03 -1.43 1.01 -1.26 -0.88 116.67 120.87 2pyg s ASP 173 Ca 0.00 0.24 -0.27 0.00 0.71 0.00 0.00 52.55 53.23 2pyg s ASP 173 Cb 0.00 -1.78 -0.17 0.00 1.01 0.00 0.00 42.92 41.98 2pyg s ASP 173 CO 0.00 0.29 1.39 1.23 0.21 0.00 0.00 175.17 178.29 2pyg h GLY 174 N 4.17 -0.55 -5.43 0.21 0.00 -0.97 -0.40 103.07 100.09 2pyg h GLY 174 Ca -0.50 0.21 -0.52 0.00 0.00 0.00 0.00 47.33 46.52 2pyg h GLY 174 CO 0.63 -0.20 -0.82 -1.36 0.00 0.00 0.00 176.54 174.79 2pyg s PHE 175 N -5.21 1.47 -0.01 5.60 0.40 0.02 -0.87 117.98 119.38 2pyg s PHE 175 Ca -0.15 -0.43 0.08 0.00 -0.60 0.00 0.00 56.93 55.83 2pyg s PHE 175 Cb 0.03 -1.02 -0.02 0.00 0.51 0.00 0.00 43.02 42.52 2pyg s PHE 175 CO 0.57 -0.17 -0.25 0.08 0.70 0.00 0.00 175.22 176.15 2pyg s VAL 176 N 0.18 2.14 -0.57 -0.44 1.01 0.32 -0.53 120.40 122.50 2pyg s VAL 176 Ca -0.05 -1.16 0.04 0.00 0.00 0.00 0.00 61.98 60.81 2pyg s VAL 176 Cb -0.11 -1.76 0.15 0.00 0.00 0.00 0.00 36.38 34.65 2pyg s VAL 176 CO 0.02 0.53 0.36 0.00 0.00 0.00 0.00 175.10 176.00 2pyg s ALA 177 N -0.67 3.19 -0.53 5.51 0.00 -0.45 -3.68 121.76 125.14 2pyg s ALA 177 Ca 0.11 -3.33 -0.19 0.00 0.00 0.00 0.00 51.96 48.54 2pyg s ALA 177 Cb -0.10 -2.08 0.07 0.00 0.00 0.00 0.00 23.12 21.01 2pyg s ALA 177 CO -0.00 -2.06 0.65 0.34 0.00 0.00 0.00 175.76 174.69 2pyg s ASP 178 N -0.64 6.21 -1.14 0.00 -1.08 -0.99 -1.05 116.67 117.98 2pyg s ASP 178 Ca 0.21 -1.06 -0.19 0.00 -0.52 0.00 0.00 52.55 51.00 2pyg s ASP 178 Cb -0.15 -2.29 -0.01 0.00 -1.46 0.00 0.00 42.92 39.00 2pyg s ASP 178 CO -0.08 -0.95 0.80 0.00 0.52 0.00 0.00 175.17 175.45 2pyg n TYR 179 N 6.22 -1.95 -3.78 -5.34 4.19 -0.64 -1.48 117.16 114.38 2pyg n TYR 179 Ca -0.07 0.50 -0.33 0.00 3.31 0.00 0.00 57.90 61.31 2pyg n TYR 179 Cb 0.45 -3.52 -0.05 0.00 0.49 0.00 0.00 39.34 36.71 2pyg n TYR 179 CO 0.00 0.00 0.00 -0.51 0.91 0.00 0.00 176.86 177.26 2pyg s LEU 180 N -6.40 4.34 0.01 2.98 1.43 -1.26 -2.57 118.68 117.20 2pyg s LEU 180 Ca 0.46 0.48 0.02 0.00 -1.03 0.00 0.00 54.13 54.06 2pyg s LEU 180 Cb -0.15 -2.94 -0.01 0.00 0.03 0.00 0.00 46.19 43.12 2pyg s LEU 180 CO 0.85 0.17 -0.07 -0.69 0.23 0.00 0.00 176.35 176.84 2pyg s VAL 181 N -1.46 0.57 -1.28 -1.59 1.01 0.27 -1.92 120.40 116.00 2pyg s VAL 181 Ca 0.34 -0.47 -0.25 0.00 0.00 0.00 0.00 61.98 61.59 2pyg s VAL 181 Cb -0.13 -0.51 0.03 0.00 0.00 0.00 0.00 36.38 35.77 2pyg s VAL 181 CO 0.22 0.05 0.56 0.47 0.00 0.00 0.00 175.10 176.39 2pyg n ASP 182 N 2.59 -3.13 -4.26 3.32 8.00 -0.37 -0.75 116.55 121.97 2pyg n ASP 182 Ca -0.15 -1.25 -0.22 0.00 0.71 0.00 0.00 54.79 53.87 2pyg n ASP 182 Cb 0.57 -1.91 -0.09 0.00 -0.02 0.00 0.00 41.12 39.67 2pyg n ASP 182 CO 0.00 0.00 0.00 -0.44 -0.39 0.00 0.00 177.20 176.37 2pyg s SER 183 N -3.73 2.32 -0.03 -2.24 0.01 -1.16 -1.79 113.70 107.09 2pyg s SER 183 Ca 0.38 -1.52 -0.02 0.00 1.31 0.00 0.00 55.95 56.10 2pyg s SER 183 Cb -0.20 0.23 0.01 0.00 0.21 0.00 0.00 66.02 66.27 2pyg s SER 183 CO 0.96 -0.78 0.07 -0.69 0.41 0.00 0.00 173.24 173.22 2pyg s VAL 184 N -3.35 -0.01 -0.18 3.43 1.01 -0.01 -2.05 120.40 119.24 2pyg s VAL 184 Ca 0.31 0.02 0.00 0.00 0.00 0.00 0.00 61.98 62.32 2pyg s VAL 184 Cb 0.06 -0.12 0.01 0.00 0.00 0.00 0.00 36.38 36.34 2pyg s VAL 184 CO 0.15 0.01 -0.17 -0.36 0.00 0.00 0.00 175.10 174.72 2pyg s PHE 185 N 0.16 2.80 -0.02 5.22 0.40 -0.19 -1.55 117.98 124.80 2pyg s PHE 185 Ca -0.01 -1.50 0.00 0.00 -0.60 0.00 0.00 56.93 54.82 2pyg s PHE 185 Cb -0.02 -1.94 0.02 0.00 0.51 0.00 0.00 43.02 41.59 2pyg s PHE 185 CO -0.00 -0.75 0.02 -2.00 0.70 0.00 0.00 175.22 173.18 2pyg s GLU 186 N 1.28 0.04 -1.42 0.44 2.12 -0.26 -0.46 118.70 120.44 2pyg s GLU 186 Ca 0.04 0.12 -0.07 0.00 0.36 0.00 0.00 54.97 55.42 2pyg s GLU 186 Cb -0.13 -0.24 0.04 0.00 0.26 0.00 0.00 34.13 34.06 2pyg s GLU 186 CO -0.10 -0.12 0.87 0.09 -0.54 0.00 0.00 175.26 175.46 2pyg n ASN 187 N 3.90 -3.29 -4.85 -1.70 3.02 -0.32 -1.25 115.26 110.77 2pyg n ASN 187 Ca -0.24 -0.78 -0.22 0.00 -0.03 0.00 0.00 54.58 53.31 2pyg n ASN 187 Cb 0.53 -4.04 -0.04 0.00 -0.61 0.00 0.00 39.78 35.62 2pyg n ASN 187 CO 0.00 0.00 0.00 0.20 -2.62 0.00 0.00 177.26 174.84 2pyg s ASN 188 N -3.78 5.68 -0.04 6.41 0.01 -1.26 -2.33 114.94 119.63 2pyg s ASN 188 Ca 0.37 -0.18 0.02 0.00 -0.71 0.00 0.00 52.86 52.36 2pyg s ASN 188 Cb -0.18 -1.50 0.01 0.00 0.41 0.00 0.00 41.25 39.99 2pyg s ASN 188 CO 0.82 -0.03 -0.10 -0.69 -1.51 0.00 0.00 177.10 175.58 2pyg s VAL 189 N -2.07 0.93 -0.10 1.60 1.01 -0.08 -0.55 120.40 121.14 2pyg s VAL 189 Ca 0.33 -0.41 -0.01 0.00 0.00 0.00 0.00 61.98 61.89 2pyg s VAL 189 Cb -0.08 -0.84 0.03 0.00 0.00 0.00 0.00 36.38 35.48 2pyg s VAL 189 CO 0.26 0.29 -0.03 0.00 0.00 0.00 0.00 175.10 175.62 2pyg s ALA 190 N 0.39 1.01 0.07 5.51 0.00 0.20 -0.76 121.76 128.19 2pyg s ALA 190 Ca -0.07 -0.35 -0.12 0.00 0.00 0.00 0.00 51.96 51.42 2pyg s ALA 190 Cb -0.12 -0.84 0.01 0.00 0.00 0.00 0.00 23.12 22.17 2pyg s ALA 190 CO 0.02 -0.46 0.26 1.52 0.00 0.00 0.00 175.76 177.10 2pyg s TYR 191 N 1.84 -0.01 -1.98 0.00 -0.85 -0.93 -1.50 117.35 113.93 2pyg s TYR 191 Ca 0.05 -0.27 0.00 0.00 -0.52 0.00 0.00 57.07 56.33 2pyg s TYR 191 Cb -0.13 0.05 0.00 0.00 0.38 0.00 0.00 41.96 42.26 2pyg s TYR 191 CO -0.07 -0.54 0.00 0.00 -1.52 0.00 0.00 175.55 173.42 2pyg n ALA 192 N 0.24 -0.37 -2.22 9.51 0.00 -0.93 -2.81 120.51 123.93 2pyg n ALA 192 Ca -0.17 0.28 -0.37 0.00 0.00 0.00 0.00 53.44 53.18 2pyg n ALA 192 Cb 0.61 -2.00 -0.06 0.00 0.00 0.00 0.00 19.45 18.00 2pyg n ALA 192 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 2pyg s ASN 193 N -2.62 7.00 0.49 0.00 0.01 -1.26 -2.61 114.94 115.94 2pyg s ASN 193 Ca 0.00 1.29 0.16 0.00 -0.71 0.00 0.00 52.86 53.59 2pyg s ASN 193 Cb 0.00 -2.37 1.18 0.00 0.41 0.00 0.00 41.25 40.47 2pyg s ASN 193 CO 0.00 0.12 2.08 0.44 -1.51 0.00 0.00 177.10 178.23 2pyg h ASP 194 N 3.77 0.14 0.00 -1.22 3.32 -1.29 0.20 116.42 121.34 2pyg h ASP 194 Ca -0.48 -0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.56 2pyg h ASP 194 Cb 1.20 -0.03 0.00 0.00 0.22 0.00 0.00 39.33 40.72 2pyg h ASP 194 CO 0.65 0.10 0.00 -1.14 -1.72 0.00 0.00 179.24 177.13 2pyg n ARG 195 N -4.49 0.00 -2.85 3.56 0.63 -0.06 -3.40 116.66 110.05 2pyg n ARG 195 Ca 0.02 0.00 -0.31 0.00 -0.92 0.00 0.00 57.85 56.64 2pyg n ARG 195 Cb 0.22 0.00 -0.04 0.00 0.45 0.00 0.00 32.46 33.09 2pyg n ARG 195 CO 0.00 0.00 0.00 -1.01 -2.51 0.00 0.00 177.63 174.11 2pyg s HIS 196 N 2.85 3.44 -0.08 -0.14 3.76 -1.24 -0.90 115.29 122.97 2pyg s HIS 196 Ca 0.00 1.16 -0.25 0.00 -0.15 0.00 0.00 55.06 55.83 2pyg s HIS 196 Cb 0.00 -2.53 -0.20 0.00 1.11 0.00 0.00 32.58 30.96 2pyg s HIS 196 CO 0.00 -0.10 0.89 0.78 -0.85 0.00 0.00 174.74 175.46 2pyg h GLY 197 N 1.46 -0.05 -5.73 -2.22 0.00 -0.85 -0.69 103.07 94.98 2pyg h GLY 197 Ca -0.47 0.02 -0.47 0.00 0.00 0.00 0.00 47.33 46.41 2pyg h GLY 197 CO 0.64 -0.02 -0.80 -1.36 0.00 0.00 0.00 176.54 175.00 2pyg s PHE 198 N -3.04 1.16 -0.29 5.60 0.40 0.45 -0.80 117.98 121.45 2pyg s PHE 198 Ca -0.16 -0.35 -0.01 0.00 -0.60 0.00 0.00 56.93 55.81 2pyg s PHE 198 Cb -0.01 -0.85 0.09 0.00 0.51 0.00 0.00 43.02 42.76 2pyg s PHE 198 CO 0.60 -0.18 0.08 1.21 0.70 0.00 0.00 175.22 177.63 2pyg s ASN 199 N 0.45 3.86 -0.25 1.36 2.47 0.31 -0.42 114.94 122.72 2pyg s ASN 199 Ca -0.08 -1.49 -0.16 0.00 0.42 0.00 0.00 52.86 51.54 2pyg s ASN 199 Cb -0.12 -0.84 -0.03 0.00 -1.45 0.00 0.00 41.25 38.80 2pyg s ASN 199 CO 0.02 -0.39 0.44 -0.69 -3.72 0.00 0.00 177.10 172.76 2pyg s VAL 200 N 1.64 5.13 0.32 -5.21 1.01 0.78 -1.34 120.40 122.73 2pyg s VAL 200 Ca 0.07 0.73 -0.09 0.00 0.00 0.00 0.00 61.98 62.70 2pyg s VAL 200 Cb -0.17 -3.76 0.01 0.00 0.00 0.00 0.00 36.38 32.46 2pyg s VAL 200 CO -0.22 0.15 0.54 0.54 0.00 0.00 0.00 175.10 176.11 2pyg s VAL 201 N 2.01 0.00 -0.90 2.92 0.11 -0.22 -0.69 120.40 123.64 2pyg s VAL 201 Ca 0.18 -1.41 -0.06 0.00 -2.93 0.00 0.00 61.98 57.76 2pyg s VAL 201 Cb -0.16 -2.52 -0.01 0.00 -1.53 0.00 0.00 36.38 32.16 2pyg s VAL 201 CO 0.09 0.00 0.73 0.41 -3.33 0.00 0.00 175.10 173.00 2pyg n THR 202 N -0.49 -7.36 -0.96 5.04 -1.04 -1.19 -1.62 114.28 106.66 2pyg n THR 202 Ca -0.02 -0.51 0.00 0.00 -2.04 0.00 0.00 64.05 61.48 2pyg n THR 202 Cb 0.61 -5.29 0.00 0.00 -1.82 0.00 0.00 70.33 63.83 2pyg n THR 202 CO 0.00 0.00 0.00 -1.20 -0.64 0.00 0.00 175.07 173.23 2pyg n SER 203 N -2.37 -4.58 -4.64 8.00 7.64 -1.15 -2.09 113.62 114.43 2pyg n SER 203 Ca -0.11 0.00 -0.44 0.00 1.01 0.00 0.00 58.87 59.33 2pyg n SER 203 Cb 0.58 -2.55 -0.02 0.00 -1.01 0.00 0.00 64.21 61.22 2pyg n SER 203 CO 0.00 0.00 0.00 0.41 -3.01 0.00 0.00 175.04 172.44 2pyg n THR 204 N -2.26 1.59 -3.56 0.44 -1.04 -1.21 -4.62 114.28 103.63 2pyg n THR 204 Ca 0.00 -0.40 -0.12 0.00 -2.04 0.00 0.00 64.05 61.49 2pyg n THR 204 Cb 0.32 -1.28 -0.04 0.00 -1.82 0.00 0.00 70.33 67.51 2pyg n THR 204 CO 0.00 0.00 0.00 -1.38 -0.64 0.00 0.00 175.07 173.05 2pyg s HIS 205 N -0.70 -0.37 -1.13 -1.42 -3.43 -0.81 -1.62 115.29 105.82 2pyg s HIS 205 Ca 0.62 0.24 -0.09 0.00 -0.80 0.00 0.00 55.06 55.03 2pyg s HIS 205 Cb -0.67 0.36 -0.04 0.00 -1.43 0.00 0.00 32.58 30.81 2pyg s HIS 205 CO 0.57 -0.70 0.86 -0.25 -2.00 0.00 0.00 174.74 173.21 2pyg n ASP 206 N 0.03 -5.00 -4.16 7.38 8.00 0.05 -2.91 116.55 119.93 2pyg n ASP 206 Ca -0.17 -0.81 -0.26 0.00 0.71 0.00 0.00 54.79 54.26 2pyg n ASP 206 Cb 0.62 -4.50 -0.16 0.00 -0.02 0.00 0.00 41.12 37.06 2pyg n ASP 206 CO 0.00 0.00 0.00 0.12 -0.39 0.00 0.00 177.20 176.93 2pyg s PHE 207 N -3.45 1.68 -0.10 1.24 5.36 -0.98 -1.23 117.98 120.49 2pyg s PHE 207 Ca 0.35 -0.39 0.04 0.00 -0.96 0.00 0.00 56.93 55.97 2pyg s PHE 207 Cb -0.08 -1.10 0.00 0.00 -0.34 0.00 0.00 43.02 41.50 2pyg s PHE 207 CO 0.78 -0.09 -0.22 0.08 -1.46 0.00 0.00 175.22 174.32 2pyg s VAL 208 N -0.23 1.91 -0.34 3.12 1.01 -0.87 -1.50 120.40 123.51 2pyg s VAL 208 Ca 0.02 -0.93 0.02 0.00 0.00 0.00 0.00 61.98 61.10 2pyg s VAL 208 Cb -0.09 -1.67 0.09 0.00 0.00 0.00 0.00 36.38 34.72 2pyg s VAL 208 CO 0.01 0.53 0.05 -0.04 0.00 0.00 0.00 175.10 175.64 2pyg s MET 209 N 0.43 1.73 -0.21 2.72 -1.94 0.83 -1.03 119.30 121.82 2pyg s MET 209 Ca -0.17 -1.76 -0.06 0.00 -1.71 0.00 0.00 55.69 51.99 2pyg s MET 209 Cb -0.17 -3.22 -0.03 0.00 2.01 0.00 0.00 34.83 33.42 2pyg s MET 209 CO 0.07 -0.89 0.02 0.99 -0.01 0.00 0.00 175.02 175.21 2pyg s THR 210 N 0.99 4.10 -1.41 2.05 2.01 0.39 -0.62 115.64 123.15 2pyg s THR 210 Ca 0.07 -0.26 -0.08 0.00 0.31 0.00 0.00 61.69 61.73 2pyg s THR 210 Cb -0.20 -2.87 0.05 0.00 0.01 0.00 0.00 72.50 69.48 2pyg s THR 210 CO -0.07 0.41 0.60 -3.20 -0.69 0.00 0.00 174.62 171.67 2pyg n ASN 211 N 4.39 -4.83 -4.86 3.53 5.15 0.66 -1.17 115.26 118.12 2pyg n ASN 211 Ca -0.17 -0.38 -0.31 0.00 -0.60 0.00 0.00 54.58 53.12 2pyg n ASN 211 Cb 0.52 -3.93 -0.03 0.00 -0.53 0.00 0.00 39.78 35.80 2pyg n ASN 211 CO 0.00 0.00 0.00 0.20 1.40 0.00 0.00 177.26 178.86 2pyg s ASN 212 N -2.78 6.55 -0.03 1.20 0.01 -1.26 -3.73 114.94 114.90 2pyg s ASN 212 Ca 0.39 1.27 0.04 0.00 -0.71 0.00 0.00 52.86 53.85 2pyg s ASN 212 Cb -0.19 -2.38 -0.01 0.00 0.41 0.00 0.00 41.25 39.08 2pyg s ASN 212 CO 0.48 -0.46 -0.15 -0.69 -1.51 0.00 0.00 177.10 174.76 2pyg s VAL 213 N -2.46 1.27 -0.06 1.60 1.01 0.28 -2.05 120.40 120.00 2pyg s VAL 213 Ca 0.54 -0.65 -0.02 0.00 0.00 0.00 0.00 61.98 61.84 2pyg s VAL 213 Cb -0.10 -1.08 0.04 0.00 0.00 0.00 0.00 36.38 35.24 2pyg s VAL 213 CO 0.32 0.37 0.11 0.00 0.00 0.00 0.00 175.10 175.89 2pyg s ALA 214 N -0.11 0.03 0.08 5.51 0.00 -0.32 -0.63 121.76 126.33 2pyg s ALA 214 Ca 0.00 0.38 -0.10 0.00 0.00 0.00 0.00 51.96 52.25 2pyg s ALA 214 Cb -0.09 -0.67 0.00 0.00 0.00 0.00 0.00 23.12 22.37 2pyg s ALA 214 CO 0.01 -0.48 0.22 1.52 0.00 0.00 0.00 175.76 177.03 2pyg s TYR 215 N 2.09 0.09 -1.84 0.00 -0.85 -0.56 -1.63 117.35 114.64 2pyg s TYR 215 Ca 0.02 -0.45 0.00 0.00 -0.52 0.00 0.00 57.07 56.12 2pyg s TYR 215 Cb -0.12 -0.02 0.00 0.00 0.38 0.00 0.00 41.96 42.20 2pyg s TYR 215 CO -0.04 -0.54 0.00 0.41 -1.52 0.00 0.00 175.55 173.86 2pyg n GLY 216 N 0.09 0.32 3.88 5.49 0.00 -0.42 -3.05 105.19 111.51 2pyg n GLY 216 Ca -0.16 -0.05 -0.31 0.00 0.00 0.00 0.00 46.02 45.50 2pyg n GLY 216 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2pyg s ASN 217 N -2.32 6.57 0.48 1.61 0.01 -1.26 -2.20 114.94 117.83 2pyg s ASN 217 Ca 0.00 0.81 0.32 0.00 -0.71 0.00 0.00 52.86 53.28 2pyg s ASN 217 Cb 0.00 -2.18 1.61 0.00 0.41 0.00 0.00 41.25 41.09 2pyg s ASN 217 CO 0.00 -0.05 1.98 1.23 -1.51 0.00 0.00 177.10 178.75 2pyg h GLY 218 N 2.54 0.00 0.00 0.66 0.00 0.05 0.08 103.07 106.40 2pyg h GLY 218 Ca -0.47 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.86 2pyg h GLY 218 CO 0.70 0.00 0.00 1.44 0.00 0.00 0.00 176.54 178.68 2pyg n SER 219 N -2.71 0.00 -4.88 0.19 7.64 -0.08 -4.52 113.62 109.26 2pyg n SER 219 Ca -0.01 0.00 -0.31 0.00 1.01 0.00 0.00 58.87 59.56 2pyg n SER 219 Cb 0.14 0.00 -0.05 0.00 -1.01 0.00 0.00 64.21 63.30 2pyg n SER 219 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 2pyg s SER 220 N 1.00 6.58 -0.00 6.43 0.01 -1.26 -0.93 113.70 125.52 2pyg s SER 220 Ca 0.00 0.93 -0.25 0.00 1.31 0.00 0.00 55.95 57.94 2pyg s SER 220 Cb 0.00 -2.23 -0.18 0.00 0.21 0.00 0.00 66.02 63.82 2pyg s SER 220 CO 0.00 -0.16 1.26 1.23 0.41 0.00 0.00 173.24 175.97 2pyg h GLY 221 N 2.11 -0.21 -6.45 3.44 0.00 -1.02 -1.70 103.07 99.24 2pyg h GLY 221 Ca -0.47 0.08 -0.32 0.00 0.00 0.00 0.00 47.33 46.61 2pyg h GLY 221 CO 0.67 -0.08 -0.74 -2.27 0.00 0.00 0.00 176.54 174.13 2pyg s LEU 222 N -9.41 1.13 -0.00 3.11 2.96 -0.05 -0.41 118.68 116.00 2pyg s LEU 222 Ca -0.15 0.01 0.04 0.00 -0.22 0.00 0.00 54.13 53.81 2pyg s LEU 222 Cb 0.02 -0.14 -0.01 0.00 0.50 0.00 0.00 46.19 46.56 2pyg s LEU 222 CO 0.60 -0.11 -0.13 0.54 -1.32 0.00 0.00 176.35 175.93 2pyg s VAL 223 N 1.03 1.01 -0.19 1.68 0.11 0.44 -0.75 120.40 123.74 2pyg s VAL 223 Ca -0.10 -0.59 0.01 0.00 -2.93 0.00 0.00 61.98 58.38 2pyg s VAL 223 Cb -0.13 -0.85 0.03 0.00 -1.53 0.00 0.00 36.38 33.89 2pyg s VAL 223 CO -0.02 0.25 -0.18 -0.69 -3.33 0.00 0.00 175.10 171.13 2pyg s VAL 224 N -0.36 2.03 0.04 2.04 1.01 0.07 -0.16 120.40 125.08 2pyg s VAL 224 Ca 0.05 -1.01 -0.14 0.00 0.00 0.00 0.00 61.98 60.88 2pyg s VAL 224 Cb -0.05 -1.88 0.02 0.00 0.00 0.00 0.00 36.38 34.46 2pyg s VAL 224 CO -0.00 0.45 0.30 0.00 0.00 0.00 0.00 175.10 175.85 2pyg s GLN 225 N 1.28 0.79 0.14 2.72 -2.07 0.14 -0.35 119.66 122.31 2pyg s GLN 225 Ca 0.03 -0.49 -0.17 0.00 -1.82 0.00 0.00 55.36 52.92 2pyg s GLN 225 Cb -0.14 0.34 -0.01 0.00 -1.09 0.00 0.00 33.01 32.12 2pyg s GLN 225 CO -0.12 -0.25 1.76 -0.09 -1.32 0.00 0.00 175.29 175.27 2pyg h ARG 226 N 3.29 0.50 0.00 9.60 2.43 -1.39 -3.31 114.38 125.49 2pyg h ARG 226 Ca -0.32 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 58.80 2pyg h ARG 226 Cb 1.20 -0.10 0.00 0.00 -0.42 0.00 0.00 29.97 30.64 2pyg h ARG 226 CO 0.46 0.39 0.00 0.41 -1.51 0.00 0.00 179.97 179.72 2pyg n GLY 227 N -1.05 -2.48 0.19 2.80 0.00 -1.26 -3.14 105.19 100.25 2pyg n GLY 227 Ca -0.00 -2.19 0.03 0.00 0.00 0.00 0.00 46.02 43.85 2pyg n GLY 227 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2pyg h LEU 228 N 0.00 0.00 -9.97 0.99 3.38 -2.02 -3.45 115.31 104.23 2pyg h LEU 228 Ca 0.00 0.00 -0.54 0.00 0.09 0.00 0.00 57.88 57.43 2pyg h LEU 228 Cb 0.00 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.72 2pyg h LEU 228 CO 0.00 0.34 -0.11 -1.61 0.09 0.00 0.00 178.44 177.16 2pyg s GLU 229 N -4.24 3.81 -1.27 1.13 2.02 -1.26 -4.73 118.70 114.16 2pyg s GLU 229 Ca -0.03 0.30 -0.18 0.00 0.02 0.00 0.00 54.97 55.07 2pyg s GLU 229 Cb 0.14 -2.65 0.02 0.00 0.10 0.00 0.00 34.13 31.74 2pyg s GLU 229 CO 0.72 0.32 1.89 -3.47 0.02 0.00 0.00 175.26 174.73 2pyg n ASP 230 N -0.11 4.21 -4.57 -0.19 2.03 -1.26 -4.90 116.55 111.76 2pyg n ASP 230 Ca 0.00 -2.85 -0.26 0.00 0.52 0.00 0.00 54.79 52.21 2pyg n ASP 230 Cb 0.52 -1.68 -0.10 0.00 -0.72 0.00 0.00 41.12 39.14 2pyg n ASP 230 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 2pyg s LEU 231 N 4.82 2.79 0.11 -2.67 1.43 -1.26 -5.01 118.68 118.88 2pyg s LEU 231 Ca 0.55 -1.18 -0.36 0.00 -1.03 0.00 0.00 54.13 52.12 2pyg s LEU 231 Cb 0.06 -1.05 -0.16 0.00 0.03 0.00 0.00 46.19 45.07 2pyg s LEU 231 CO 0.06 -0.23 1.45 0.00 0.23 0.00 0.00 176.35 177.86 2pyg n ALA 232 N -0.84 -0.02 -1.66 4.21 0.00 -1.26 -4.90 120.51 116.05 2pyg n ALA 232 Ca -0.05 0.48 -0.35 0.00 0.00 0.00 0.00 53.44 53.53 2pyg n ALA 232 Cb 0.64 -2.19 0.03 0.00 0.00 0.00 0.00 19.45 17.92 2pyg n ALA 232 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2pyg s LEU 233 N 0.76 3.59 0.49 0.00 1.43 -1.26 -2.95 118.68 120.75 2pyg s LEU 233 Ca 0.83 2.19 -0.22 0.00 -1.03 0.00 0.00 54.13 55.90 2pyg s LEU 233 Cb -0.85 -4.58 -0.07 0.00 0.03 0.00 0.00 46.19 40.73 2pyg s LEU 233 CO 0.44 -1.50 1.16 -2.84 0.23 0.00 0.00 176.35 173.83 2pyg s PRO 234 N -3.57 3.58 0.21 1.29 0.02 -1.26 -4.58 135.00 130.69 2pyg s PRO 234 Ca 0.72 1.72 -0.23 0.00 0.02 0.00 0.00 61.00 63.24 2pyg s PRO 234 Cb -0.25 -2.25 0.05 0.00 0.02 0.00 0.00 34.50 32.07 2pyg s PRO 234 CO 0.34 -0.68 0.73 -1.54 -0.33 0.00 0.00 177.00 175.51 2pyg s SER 235 N -1.51 -0.35 -0.87 2.53 1.04 -0.64 -2.98 113.70 110.92 2pyg s SER 235 Ca 0.67 -0.35 -0.04 0.00 0.48 0.00 0.00 55.95 56.71 2pyg s SER 235 Cb -0.27 0.63 -0.02 0.00 0.10 0.00 0.00 66.02 66.46 2pyg s SER 235 CO 0.32 -1.12 0.76 0.59 0.98 0.00 0.00 173.24 174.77 2pyg n ASN 236 N -0.42 -7.02 -4.07 7.02 3.02 0.03 -2.83 115.26 110.99 2pyg n ASN 236 Ca -0.09 -0.41 -0.24 0.00 -0.03 0.00 0.00 54.58 53.81 2pyg n ASN 236 Cb 0.61 -4.82 -0.16 0.00 -0.61 0.00 0.00 39.78 34.80 2pyg n ASN 236 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 2pyg s ILE 237 N -3.15 1.19 -0.25 2.41 1.01 -0.95 -0.77 121.20 120.68 2pyg s ILE 237 Ca 0.17 -0.56 -0.03 0.00 0.00 0.00 0.00 60.65 60.23 2pyg s ILE 237 Cb -0.03 -1.04 0.01 0.00 0.01 0.00 0.00 42.46 41.41 2pyg s ILE 237 CO 0.77 0.35 -0.03 -0.22 0.00 0.00 0.00 174.94 175.81 2pyg s LEU 238 N 0.27 3.23 -0.46 2.97 2.96 -0.56 -1.43 118.68 125.66 2pyg s LEU 238 Ca -0.07 -0.71 -0.12 0.00 -0.22 0.00 0.00 54.13 53.00 2pyg s LEU 238 Cb -0.12 -1.72 0.09 0.00 0.50 0.00 0.00 46.19 44.93 2pyg s LEU 238 CO 0.02 -0.11 0.35 -0.63 -1.32 0.00 0.00 176.35 174.66 2pyg s ILE 239 N 1.40 4.71 -0.33 6.68 1.01 0.73 -0.12 121.20 135.28 2pyg s ILE 239 Ca 0.02 -1.35 -0.02 0.00 0.00 0.00 0.00 60.65 59.31 2pyg s ILE 239 Cb -0.16 -3.91 0.07 0.00 0.01 0.00 0.00 42.46 38.47 2pyg s ILE 239 CO -0.03 -0.62 0.05 -0.62 0.00 0.00 0.00 174.94 173.72 2pyg s ASP 240 N 2.57 4.97 0.05 3.58 2.15 0.21 -1.01 116.67 129.19 2pyg s ASP 240 Ca 0.04 -1.53 0.00 0.00 0.43 0.00 0.00 52.55 51.49 2pyg s ASP 240 Cb -0.25 -1.73 0.00 0.00 -0.30 0.00 0.00 42.92 40.64 2pyg s ASP 240 CO 0.03 -0.34 0.00 0.61 -0.17 0.00 0.00 175.17 175.31 2pyg n GLY 241 N 4.59 -1.58 5.66 2.66 0.00 0.77 -0.25 105.19 117.04 2pyg n GLY 241 Ca -0.09 -1.32 0.00 0.00 0.00 0.00 0.00 46.02 44.61 2pyg n GLY 241 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2pyg n GLY 242 N 0.00 -1.99 3.17 -0.02 0.00 -1.26 -4.27 105.19 100.82 2pyg n GLY 242 Ca 0.00 -1.54 -0.13 0.00 0.00 0.00 0.00 46.02 44.35 2pyg n GLY 242 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2pyg s ALA 243 N -1.19 -0.64 -0.28 4.61 0.00 -0.87 -1.72 121.76 121.66 2pyg s ALA 243 Ca 0.00 0.54 -0.03 0.00 0.00 0.00 0.00 51.96 52.48 2pyg s ALA 243 Cb 0.00 -0.26 0.09 0.00 0.00 0.00 0.00 23.12 22.96 2pyg s ALA 243 CO 0.00 -0.17 0.11 0.71 0.00 0.00 0.00 175.76 176.41 2pyg s TYR 244 N -0.38 0.92 0.07 0.00 2.02 -0.59 -1.17 117.35 118.21 2pyg s TYR 244 Ca -0.05 -1.17 -0.08 0.00 -0.37 0.00 0.00 57.07 55.40 2pyg s TYR 244 Cb -0.03 -1.21 -0.01 0.00 -0.40 0.00 0.00 41.96 40.31 2pyg s TYR 244 CO 0.01 -0.81 0.16 1.52 -1.57 0.00 0.00 175.55 174.86 2pyg s TYR 245 N 1.89 0.18 -1.46 2.71 1.13 -0.65 -3.03 117.35 118.12 2pyg s TYR 245 Ca 0.08 -0.57 -0.10 0.00 -1.41 0.00 0.00 57.07 55.07 2pyg s TYR 245 Cb -0.17 -0.10 0.05 0.00 -1.10 0.00 0.00 41.96 40.64 2pyg s TYR 245 CO -0.28 -0.49 0.89 -0.25 -2.51 0.00 0.00 175.55 172.91 2pyg n ASP 246 N 0.19 -5.40 -4.95 -0.18 8.00 -0.47 -3.07 116.55 110.67 2pyg n ASP 246 Ca -0.16 -0.55 -0.25 0.00 0.71 0.00 0.00 54.79 54.54 2pyg n ASP 246 Cb 0.61 -4.31 -0.03 0.00 -0.02 0.00 0.00 41.12 37.37 2pyg n ASP 246 CO 0.00 0.00 0.00 0.20 -0.39 0.00 0.00 177.20 177.01 2pyg s ASN 247 N -3.09 6.34 0.23 -2.24 0.01 -1.26 -1.30 114.94 113.64 2pyg s ASN 247 Ca 0.53 0.19 -0.07 0.00 -0.71 0.00 0.00 52.86 52.80 2pyg s ASN 247 Cb -0.25 -1.92 0.29 0.00 0.41 0.00 0.00 41.25 39.78 2pyg s ASN 247 CO 0.65 -0.00 1.86 0.00 -1.51 0.00 0.00 177.10 178.10 2pyg h ALA 248 N 1.84 1.12 -3.00 0.60 0.00 -0.70 0.85 119.26 119.97 2pyg h ALA 248 Ca -0.49 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.40 2pyg h ALA 248 Cb 1.20 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 18.74 2pyg h ALA 248 CO 0.66 0.31 0.00 0.54 0.00 0.00 0.00 179.25 180.76 2pyg n ARG 249 N -4.60 0.00 -2.43 0.00 1.74 -0.11 -3.20 116.66 108.05 2pyg n ARG 249 Ca 0.11 0.00 -0.32 0.00 -0.77 0.00 0.00 57.85 56.87 2pyg n ARG 249 Cb 0.13 0.00 -0.03 0.00 -1.02 0.00 0.00 32.46 31.54 2pyg n ARG 249 CO 0.00 0.00 0.00 -1.21 -1.52 0.00 0.00 177.63 174.90 2pyg s GLU 250 N 3.21 3.88 -0.06 5.56 8.01 -1.26 -0.77 118.70 137.26 2pyg s GLU 250 Ca 0.00 0.84 -0.26 0.00 0.01 0.00 0.00 54.97 55.55 2pyg s GLU 250 Cb 0.00 -2.18 -0.23 0.00 -4.31 0.00 0.00 34.13 27.41 2pyg s GLU 250 CO 0.00 -0.26 1.06 0.78 0.01 0.00 0.00 175.26 176.86 2pyg h GLY 251 N 0.85 0.06 -6.72 -1.39 0.00 -1.12 -1.75 103.07 93.00 2pyg h GLY 251 Ca -0.47 -0.08 -0.42 0.00 0.00 0.00 0.00 47.33 46.35 2pyg h GLY 251 CO 0.62 0.08 -0.77 0.14 0.00 0.00 0.00 176.54 176.61 2pyg s VAL 252 N -3.38 0.44 -0.13 4.60 1.01 -0.51 -0.87 120.40 121.56 2pyg s VAL 252 Ca -0.17 0.03 0.02 0.00 0.00 0.00 0.00 61.98 61.86 2pyg s VAL 252 Cb 0.00 -0.54 0.00 0.00 0.00 0.00 0.00 36.38 35.84 2pyg s VAL 252 CO 0.70 0.24 -0.21 -0.22 0.00 0.00 0.00 175.10 175.62 2pyg s LEU 253 N 1.56 2.22 -0.28 3.92 2.96 0.07 -1.04 118.68 128.09 2pyg s LEU 253 Ca -0.01 -0.55 0.03 0.00 -0.22 0.00 0.00 54.13 53.38 2pyg s LEU 253 Cb -0.13 -1.47 0.07 0.00 0.50 0.00 0.00 46.19 45.16 2pyg s LEU 253 CO -0.03 0.11 -0.07 -0.76 -1.32 0.00 0.00 176.35 174.27 2pyg s LEU 254 N 0.67 3.77 -0.11 -0.68 1.43 0.06 -0.75 118.68 123.08 2pyg s LEU 254 Ca -0.10 -1.58 0.01 0.00 -1.03 0.00 0.00 54.13 51.43 2pyg s LEU 254 Cb -0.16 -1.57 0.02 0.00 0.03 0.00 0.00 46.19 44.50 2pyg s LEU 254 CO 0.02 -0.24 -0.14 -0.75 0.23 0.00 0.00 176.35 175.47 2pyg s LYS 255 N 1.05 2.09 -1.06 1.70 2.20 0.53 -0.02 119.74 126.23 2pyg s LYS 255 Ca -0.04 -0.51 -0.17 0.00 -0.36 0.00 0.00 55.97 54.89 2pyg s LYS 255 Cb -0.20 -1.81 -0.01 0.00 -1.51 0.00 0.00 37.83 34.31 2pyg s LYS 255 CO -0.06 -0.08 0.76 -1.33 -0.36 0.00 0.00 175.35 174.28 2pyg n MET 256 N 4.25 -1.23 -4.04 4.03 2.81 -0.30 -2.28 117.12 120.37 2pyg n MET 256 Ca -0.19 0.59 -0.14 0.00 -1.81 0.00 0.00 57.70 56.15 2pyg n MET 256 Cb 0.51 -4.02 -0.03 0.00 -0.71 0.00 0.00 33.22 28.97 2pyg n MET 256 CO 0.00 0.00 0.00 -0.08 1.51 0.00 0.00 175.97 177.40 2pyg s THR 257 N -3.36 0.00 0.24 2.03 -1.32 -1.16 -3.11 115.64 108.97 2pyg s THR 257 Ca 0.37 -1.50 -0.19 0.00 -1.21 0.00 0.00 61.69 59.17 2pyg s THR 257 Cb -0.14 -2.67 0.02 0.00 -1.51 0.00 0.00 72.50 68.21 2pyg s THR 257 CO 0.86 0.00 0.61 -0.94 -2.21 0.00 0.00 174.62 172.93 2pyg s SER 258 N -3.21 -0.26 -1.15 8.08 1.04 -1.16 -2.27 113.70 114.78 2pyg s SER 258 Ca 0.28 -0.58 -0.22 0.00 0.48 0.00 0.00 55.95 55.91 2pyg s SER 258 Cb -0.01 0.65 -0.00 0.00 0.10 0.00 0.00 66.02 66.75 2pyg s SER 258 CO 0.19 -1.19 0.78 0.47 0.98 0.00 0.00 173.24 174.47 2pyg n ASP 259 N -0.40 -5.10 -4.37 7.02 9.92 -0.33 -3.19 116.55 120.10 2pyg n ASP 259 Ca -0.07 -1.05 -0.32 0.00 -0.53 0.00 0.00 54.79 52.83 2pyg n ASP 259 Cb 0.61 -3.20 -0.15 0.00 -0.64 0.00 0.00 41.12 37.74 2pyg n ASP 259 CO 0.00 0.00 0.00 -0.63 0.13 0.00 0.00 177.20 176.70 2pyg s ILE 260 N -3.48 2.45 -0.15 0.53 -1.09 -1.20 -0.79 121.20 117.47 2pyg s ILE 260 Ca 0.47 -0.95 0.01 0.00 -2.23 0.00 0.00 60.65 57.95 2pyg s ILE 260 Cb -0.18 -1.90 0.02 0.00 -1.58 0.00 0.00 42.46 38.82 2pyg s ILE 260 CO 0.87 0.58 -0.18 -0.89 -1.23 0.00 0.00 174.94 174.10 2pyg s THR 261 N -0.58 1.83 -0.25 2.92 2.01 -0.51 -0.17 115.64 120.89 2pyg s THR 261 Ca 0.08 -0.81 -0.03 0.00 0.31 0.00 0.00 61.69 61.24 2pyg s THR 261 Cb -0.11 -1.66 0.01 0.00 0.01 0.00 0.00 72.50 70.75 2pyg s THR 261 CO 0.00 0.50 -0.03 -0.22 -0.69 0.00 0.00 174.62 174.19 2pyg s LEU 262 N 1.22 3.27 0.03 4.42 2.96 0.91 -0.19 118.68 131.30 2pyg s LEU 262 Ca 0.01 -0.73 -0.03 0.00 -0.22 0.00 0.00 54.13 53.16 2pyg s LEU 262 Cb -0.14 -1.73 -0.02 0.00 0.50 0.00 0.00 46.19 44.81 2pyg s LEU 262 CO -0.09 -0.12 0.03 0.00 -1.32 0.00 0.00 176.35 174.86 2pyg s GLN 263 N 1.40 0.50 -1.47 1.98 -2.07 -0.18 -0.52 119.66 119.31 2pyg s GLN 263 Ca 0.02 -0.78 -0.12 0.00 -1.82 0.00 0.00 55.36 52.66 2pyg s GLN 263 Cb -0.16 0.19 0.08 0.00 -1.09 0.00 0.00 33.01 32.03 2pyg s GLN 263 CO -0.03 -0.11 0.75 0.09 -1.32 0.00 0.00 175.29 174.67 2pyg n ASN 264 N 0.92 -4.47 -4.59 12.60 3.02 -0.70 -0.16 115.26 121.88 2pyg n ASN 264 Ca -0.20 -0.60 -0.26 0.00 -0.03 0.00 0.00 54.58 53.49 2pyg n ASN 264 Cb 0.58 -3.62 -0.09 0.00 -0.61 0.00 0.00 39.78 36.04 2pyg n ASN 264 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2pyg s ALA 265 N -3.15 3.01 -0.24 5.41 0.00 -1.26 -3.59 121.76 121.94 2pyg s ALA 265 Ca 0.54 -1.53 -0.07 0.00 0.00 0.00 0.00 51.96 50.90 2pyg s ALA 265 Cb -0.27 -0.74 -0.03 0.00 0.00 0.00 0.00 23.12 22.08 2pyg s ALA 265 CO 0.66 0.41 0.06 0.34 0.00 0.00 0.00 175.76 177.23 2pyg s ASP 266 N -3.08 5.10 -0.21 0.00 -1.08 -0.70 -0.80 116.67 115.90 2pyg s ASP 266 Ca 0.27 -0.19 -0.00 0.00 -0.52 0.00 0.00 52.55 52.11 2pyg s ASP 266 Cb -0.08 -1.91 0.05 0.00 -1.46 0.00 0.00 42.92 39.53 2pyg s ASP 266 CO 0.17 -0.00 -0.04 -0.63 0.52 0.00 0.00 175.17 175.18 2pyg s ILE 267 N 1.43 1.29 0.22 4.11 1.01 0.41 -1.54 121.20 128.13 2pyg s ILE 267 Ca 0.05 -0.97 -0.11 0.00 0.00 0.00 0.00 60.65 59.62 2pyg s ILE 267 Cb -0.15 -1.56 -0.01 0.00 0.01 0.00 0.00 42.46 40.76 2pyg s ILE 267 CO 0.03 -0.04 0.41 -1.38 0.00 0.00 0.00 174.94 173.96 2pyg s HIS 268 N 1.52 0.39 -0.28 3.97 -3.43 -1.17 -0.76 115.29 115.54 2pyg s HIS 268 Ca -0.03 -0.74 0.00 0.00 -0.80 0.00 0.00 55.06 53.49 2pyg s HIS 268 Cb -0.18 0.09 0.00 0.00 -1.43 0.00 0.00 32.58 31.06 2pyg s HIS 268 CO -0.07 -0.89 0.00 0.41 -2.00 0.00 0.00 174.74 172.19 2pyg n GLY 269 N -0.33 0.30 3.81 -1.38 0.00 0.39 -1.37 105.19 106.61 2pyg n GLY 269 Ca -0.03 -0.01 -0.33 0.00 0.00 0.00 0.00 46.02 45.64 2pyg n GLY 269 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2pyg s ASN 270 N -2.11 6.57 0.16 1.61 0.01 -1.26 -3.42 114.94 116.50 2pyg s ASN 270 Ca 0.00 1.76 -0.16 0.00 -0.71 0.00 0.00 52.86 53.76 2pyg s ASN 270 Cb 0.00 -2.54 0.03 0.00 0.41 0.00 0.00 41.25 39.15 2pyg s ASN 270 CO 0.00 -0.62 1.80 1.23 -1.51 0.00 0.00 177.10 178.01 2pyg h GLY 271 N 1.49 0.57 0.00 0.66 0.00 -0.30 -0.80 103.07 104.69 2pyg h GLY 271 Ca -0.49 -0.19 0.00 0.00 0.00 0.00 0.00 47.33 46.65 2pyg h GLY 271 CO 0.60 0.18 0.00 1.44 0.00 0.00 0.00 176.54 178.76 2pyg n SER 272 N -4.84 0.00 -4.76 0.19 7.64 0.05 -0.99 113.62 110.92 2pyg n SER 272 Ca 0.01 0.00 -0.34 0.00 1.01 0.00 0.00 58.87 59.55 2pyg n SER 272 Cb 0.05 0.00 0.05 0.00 -1.01 0.00 0.00 64.21 63.30 2pyg n SER 272 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 2pyg s SER 273 N -0.81 5.04 0.01 6.43 0.01 -1.26 0.01 113.70 123.13 2pyg s SER 273 Ca 0.00 2.13 -0.25 0.00 1.31 0.00 0.00 55.95 59.14 2pyg s SER 273 Cb 0.00 -2.57 -0.19 0.00 0.21 0.00 0.00 66.02 63.48 2pyg s SER 273 CO 0.00 -1.68 1.39 1.23 0.41 0.00 0.00 173.24 174.59 2pyg h GLY 274 N 0.23 -0.02 -5.75 3.44 0.00 -1.00 -2.75 103.07 97.21 2pyg h GLY 274 Ca -0.48 0.01 -0.48 0.00 0.00 0.00 0.00 47.33 46.38 2pyg h GLY 274 CO 0.54 -0.01 -0.80 0.14 0.00 0.00 0.00 176.54 176.40 2pyg s VAL 275 N -4.79 1.00 -0.10 4.60 1.01 -0.79 -1.42 120.40 119.91 2pyg s VAL 275 Ca -0.15 -0.43 0.00 0.00 0.00 0.00 0.00 61.98 61.40 2pyg s VAL 275 Cb 0.03 -0.91 0.02 0.00 0.00 0.00 0.00 36.38 35.53 2pyg s VAL 275 CO 0.66 0.31 -0.08 -0.60 0.00 0.00 0.00 175.10 175.39 2pyg s ARG 276 N 0.49 1.54 -0.33 2.72 3.52 -0.20 -1.00 118.95 125.68 2pyg s ARG 276 Ca -0.10 -0.28 -0.10 0.00 -0.13 0.00 0.00 55.73 55.12 2pyg s ARG 276 Cb -0.13 -1.53 0.01 0.00 -1.56 0.00 0.00 34.95 31.74 2pyg s ARG 276 CO 0.02 -0.20 0.17 0.08 -0.81 0.00 0.00 175.30 174.56 2pyg s VAL 277 N 1.47 4.54 -0.44 7.11 1.01 0.45 -0.76 120.40 133.78 2pyg s VAL 277 Ca 0.00 -0.62 0.03 0.00 0.00 0.00 0.00 61.98 61.40 2pyg s VAL 277 Cb -0.13 -3.41 0.12 0.00 0.00 0.00 0.00 36.38 32.96 2pyg s VAL 277 CO -0.05 -0.05 0.19 -0.47 0.00 0.00 0.00 175.10 174.71 2pyg s TYR 278 N 1.58 2.97 -0.60 5.22 6.14 0.97 -1.00 117.35 132.62 2pyg s TYR 278 Ca 0.03 -2.87 -0.02 0.00 0.64 0.00 0.00 57.07 54.85 2pyg s TYR 278 Cb -0.18 -2.57 -0.03 0.00 0.42 0.00 0.00 41.96 39.60 2pyg s TYR 278 CO 0.06 -0.81 0.54 0.41 0.64 0.00 0.00 175.55 176.39 2pyg n GLY 279 N 3.63 -0.61 3.11 8.97 0.00 0.21 -1.67 105.19 118.83 2pyg n GLY 279 Ca 0.05 0.26 -0.10 0.00 0.00 0.00 0.00 46.02 46.23 2pyg n GLY 279 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2pyg s ALA 280 N -3.16 -0.12 0.11 4.61 0.00 -1.26 -1.14 121.76 120.80 2pyg s ALA 280 Ca 0.19 -0.46 0.08 0.00 0.00 0.00 0.00 51.96 51.77 2pyg s ALA 280 Cb -0.02 0.22 -0.04 0.00 0.00 0.00 0.00 23.12 23.28 2pyg s ALA 280 CO 0.48 -0.29 -0.20 -0.65 0.00 0.00 0.00 175.76 175.11 2pyg s GLN 281 N -2.29 1.11 -1.34 0.00 -0.21 -0.96 -2.82 119.66 113.15 2pyg s GLN 281 Ca -0.08 -1.18 -0.06 0.00 0.02 0.00 0.00 55.36 54.07 2pyg s GLN 281 Cb -0.03 -1.31 0.02 0.00 1.00 0.00 0.00 33.01 32.69 2pyg s GLN 281 CO -0.03 0.30 0.99 -0.25 -2.12 0.00 0.00 175.29 174.18 2pyg n ASP 282 N 0.97 -3.75 -4.81 5.90 8.00 -0.23 -1.18 116.55 121.45 2pyg n ASP 282 Ca -0.19 -0.67 -0.38 0.00 0.71 0.00 0.00 54.79 54.26 2pyg n ASP 282 Cb 0.54 -4.62 -0.06 0.00 -0.02 0.00 0.00 41.12 36.96 2pyg n ASP 282 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 2pyg s VAL 283 N -3.40 5.03 -0.17 2.53 1.01 -1.20 -3.09 120.40 121.11 2pyg s VAL 283 Ca 0.32 0.89 0.01 0.00 0.00 0.00 0.00 61.98 63.20 2pyg s VAL 283 Cb -0.15 -3.75 0.01 0.00 0.00 0.00 0.00 36.38 32.50 2pyg s VAL 283 CO 0.77 0.53 -0.19 -1.10 0.00 0.00 0.00 175.10 175.11 2pyg s GLN 284 N -0.77 3.06 -0.53 2.72 -0.21 0.77 -0.70 119.66 124.01 2pyg s GLN 284 Ca 0.24 -0.81 -0.02 0.00 0.02 0.00 0.00 55.36 54.80 2pyg s GLN 284 Cb -0.17 -2.58 0.14 0.00 1.00 0.00 0.00 33.01 31.41 2pyg s GLN 284 CO 0.13 -0.12 0.32 0.42 -2.12 0.00 0.00 175.29 173.92 2pyg s ILE 285 N 1.10 3.34 -0.10 1.08 1.01 0.12 -0.06 121.20 127.70 2pyg s ILE 285 Ca 0.00 -2.69 0.01 0.00 0.00 0.00 0.00 60.65 57.97 2pyg s ILE 285 Cb -0.14 -3.24 -0.02 0.00 0.01 0.00 0.00 42.46 39.06 2pyg s ILE 285 CO -0.07 -0.79 -0.12 -0.76 0.00 0.00 0.00 174.94 173.20 2pyg s LEU 286 N 0.34 2.83 -1.32 2.97 1.43 0.32 -2.02 118.68 123.24 2pyg s LEU 286 Ca 0.14 -0.23 -0.18 0.00 -1.03 0.00 0.00 54.13 52.83 2pyg s LEU 286 Cb -0.22 -1.62 0.02 0.00 0.03 0.00 0.00 46.19 44.40 2pyg s LEU 286 CO -0.03 0.25 0.49 0.47 0.23 0.00 0.00 176.35 177.75 2pyg n ASP 287 N 2.98 -2.44 -4.72 2.29 8.00 -0.65 -2.17 116.55 119.83 2pyg n ASP 287 Ca -0.18 -1.20 -0.23 0.00 0.71 0.00 0.00 54.79 53.90 2pyg n ASP 287 Cb 0.53 -2.20 -0.06 0.00 -0.02 0.00 0.00 41.12 39.36 2pyg n ASP 287 CO 0.00 0.00 0.00 0.20 -0.39 0.00 0.00 177.20 177.01 2pyg s ASN 288 N -3.88 4.89 -0.57 -2.24 0.01 -1.26 -1.71 114.94 110.18 2pyg s ASN 288 Ca 0.29 -0.55 -0.05 0.00 -0.71 0.00 0.00 52.86 51.84 2pyg s ASN 288 Cb -0.14 -0.99 0.15 0.00 0.41 0.00 0.00 41.25 40.67 2pyg s ASN 288 CO 0.95 -0.08 0.40 -1.58 -1.51 0.00 0.00 177.10 175.27 2pyg s GLN 289 N -3.77 2.51 -0.39 -0.60 2.00 0.02 -1.34 119.66 118.09 2pyg s GLN 289 Ca 0.33 -2.22 -0.09 0.00 -2.00 0.00 0.00 55.36 51.39 2pyg s GLN 289 Cb -0.06 -3.80 0.06 0.00 0.80 0.00 0.00 33.01 30.01 2pyg s GLN 289 CO 0.22 -1.16 0.21 0.42 -0.50 0.00 0.00 175.29 174.47 2pyg s ILE 290 N 0.49 4.15 0.04 -2.34 1.01 -0.34 -0.44 121.20 123.77 2pyg s ILE 290 Ca 0.13 -1.25 -0.15 0.00 0.00 0.00 0.00 60.65 59.38 2pyg s ILE 290 Cb -0.21 -3.46 0.03 0.00 0.01 0.00 0.00 42.46 38.83 2pyg s ILE 290 CO -0.04 -0.38 0.34 -1.38 0.00 0.00 0.00 174.94 173.49 2pyg s HIS 291 N 1.43 -0.17 -1.40 3.97 -3.43 0.06 -2.19 115.29 113.57 2pyg s HIS 291 Ca 0.02 0.09 -0.06 0.00 -0.80 0.00 0.00 55.06 54.31 2pyg s HIS 291 Cb -0.21 0.14 0.04 0.00 -1.43 0.00 0.00 32.58 31.11 2pyg s HIS 291 CO 0.03 -0.51 0.86 -0.25 -2.00 0.00 0.00 174.74 172.87 2pyg n ASP 292 N 0.65 -3.04 0.00 7.38 8.00 0.05 -3.42 116.55 126.17 2pyg n ASP 292 Ca -0.19 -0.78 0.00 0.00 0.71 0.00 0.00 54.79 54.53 2pyg n ASP 292 Cb 0.59 -4.10 0.00 0.00 -0.02 0.00 0.00 41.12 37.59 2pyg n ASP 292 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 2pyg n ASN 293 N -2.97 0.07 -3.84 -2.24 3.02 -1.26 -0.47 115.26 107.58 2pyg n ASN 293 Ca -0.14 0.00 -0.28 0.00 -0.03 0.00 0.00 54.58 54.13 2pyg n ASN 293 Cb 0.61 0.00 0.03 0.00 -0.61 0.00 0.00 39.78 39.81 2pyg n ASN 293 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2pyg n ALA 294 N -3.00 -1.45 0.24 5.41 0.00 0.10 -4.12 120.51 117.69 2pyg n ALA 294 Ca 0.00 0.13 0.14 0.00 0.00 0.00 0.00 53.44 53.71 2pyg n ALA 294 Cb 0.00 -4.02 0.48 0.00 0.00 0.00 0.00 19.45 15.91 2pyg n ALA 294 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.50 179.46 2pyg h GLN 295 N -2.10 0.00 0.00 0.00 1.08 -0.57 -3.32 115.11 110.20 2pyg h GLN 295 Ca -0.59 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 56.61 2pyg h GLN 295 Cb 1.37 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.80 2pyg h GLN 295 CO 0.64 0.08 0.00 0.00 -0.95 0.00 0.00 178.83 178.59 2pyg n ALA 296 N -2.13 2.16 -3.34 3.87 0.00 -0.16 -4.96 120.51 115.95 2pyg n ALA 296 Ca 0.01 -0.41 -0.13 0.00 0.00 0.00 0.00 53.44 52.91 2pyg n ALA 296 Cb 0.41 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.82 2pyg n ALA 296 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2pyg s ALA 297 N -0.05 -1.44 -1.01 0.00 0.00 -1.16 -5.00 121.76 113.11 2pyg s ALA 297 Ca 0.00 0.58 -0.23 0.00 0.00 0.00 0.00 51.96 52.31 2pyg s ALA 297 Cb 0.00 0.54 0.05 0.00 0.00 0.00 0.00 23.12 23.71 2pyg s ALA 297 CO 0.00 -0.60 1.45 0.00 0.00 0.00 0.00 175.76 176.61 2pyg s ALA 298 N -2.89 2.70 0.16 0.00 0.00 -1.26 -4.62 121.76 115.85 2pyg s ALA 298 Ca -0.03 -2.22 -0.01 0.00 0.00 0.00 0.00 51.96 49.71 2pyg s ALA 298 Cb -0.00 -4.52 -0.04 0.00 0.00 0.00 0.00 23.12 18.56 2pyg s ALA 298 CO -0.05 -3.62 0.09 0.14 0.00 0.00 0.00 175.76 172.32 2pyg s VAL 299 N 5.06 0.07 0.63 0.00 -7.23 -1.25 -4.83 120.40 112.85 2pyg s VAL 299 Ca 0.46 -1.95 -0.09 0.00 -1.81 0.00 0.00 61.98 58.59 2pyg s VAL 299 Cb -0.00 -2.24 -0.01 0.00 0.56 0.00 0.00 36.38 34.69 2pyg s VAL 299 CO -0.09 -0.26 0.99 -2.16 -0.31 0.00 0.00 175.10 173.26 2pyg s PRO 300 N -4.09 3.13 0.25 4.82 0.04 -1.26 -1.14 135.00 136.75 2pyg s PRO 300 Ca 0.31 0.37 -0.01 0.00 0.04 0.00 0.00 61.00 61.71 2pyg s PRO 300 Cb 0.07 -2.15 0.32 0.00 0.04 0.00 0.00 34.50 32.78 2pyg s PRO 300 CO 0.06 -0.73 1.69 0.93 0.04 0.00 0.00 177.00 178.99 2pyg h GLU 301 N -0.33 0.62 -3.71 4.56 4.39 -1.28 -3.37 114.58 115.46 2pyg h GLU 301 Ca -0.45 -0.23 -0.47 0.00 0.34 0.00 0.00 59.36 58.55 2pyg h GLU 301 Cb 1.23 -0.04 -0.38 0.00 -0.10 0.00 0.00 28.75 29.46 2pyg h GLU 301 CO 0.62 0.79 -0.77 0.08 -1.16 0.00 0.00 179.01 178.58 2pyg s VAL 302 N -4.58 0.48 -0.13 3.13 1.01 -0.66 -0.58 120.40 119.06 2pyg s VAL 302 Ca -0.08 -0.11 -0.02 0.00 0.00 0.00 0.00 61.98 61.77 2pyg s VAL 302 Cb 0.14 -0.72 -0.02 0.00 0.00 0.00 0.00 36.38 35.77 2pyg s VAL 302 CO 0.81 0.14 -0.07 -0.22 0.00 0.00 0.00 175.10 175.75 2pyg s LEU 303 N 1.92 3.05 -0.15 3.92 2.96 -0.17 -1.30 118.68 128.90 2pyg s LEU 303 Ca 0.03 -0.18 0.02 0.00 -0.22 0.00 0.00 54.13 53.78 2pyg s LEU 303 Cb -0.14 -1.71 0.02 0.00 0.50 0.00 0.00 46.19 44.86 2pyg s LEU 303 CO -0.06 0.19 -0.19 -0.76 -1.32 0.00 0.00 176.35 174.21 2pyg s LEU 304 N 0.20 1.99 0.19 -0.68 1.43 0.11 -0.41 118.68 121.52 2pyg s LEU 304 Ca -0.04 -0.57 -0.14 0.00 -1.03 0.00 0.00 54.13 52.34 2pyg s LEU 304 Cb -0.14 -1.36 0.01 0.00 0.03 0.00 0.00 46.19 44.73 2pyg s LEU 304 CO 0.04 0.03 0.44 0.00 0.23 0.00 0.00 176.35 177.09 2pyg s GLN 305 N 1.06 1.34 0.29 1.70 -2.07 -0.17 -0.87 119.66 120.94 2pyg s GLN 305 Ca -0.02 -1.02 0.01 0.00 -1.82 0.00 0.00 55.36 52.51 2pyg s GLN 305 Cb -0.14 0.47 -0.04 0.00 -1.09 0.00 0.00 33.01 32.21 2pyg s GLN 305 CO -0.06 -0.54 0.47 -1.12 -1.32 0.00 0.00 175.29 172.72 2pyg s SER 306 N -2.92 6.33 -0.23 12.60 0.01 -1.26 -0.62 113.70 127.60 2pyg s SER 306 Ca 0.13 0.37 -0.05 0.00 1.31 0.00 0.00 55.95 57.71 2pyg s SER 306 Cb 0.00 -1.99 -0.01 0.00 0.21 0.00 0.00 66.02 64.23 2pyg s SER 306 CO -0.00 -0.18 -0.01 0.12 0.41 0.00 0.00 173.24 173.58 2pyg s PHE 307 N -2.13 3.00 -0.49 2.43 5.36 0.26 -4.44 117.98 121.97 2pyg s PHE 307 Ca 0.38 -0.82 -0.22 0.00 -0.96 0.00 0.00 56.93 55.31 2pyg s PHE 307 Cb -0.10 -2.14 0.04 0.00 -0.34 0.00 0.00 43.02 40.47 2pyg s PHE 307 CO 0.33 -0.50 0.79 0.34 -1.46 0.00 0.00 175.22 174.71 2pyg s ASP 308 N 1.51 6.35 -0.12 6.13 -1.08 -1.26 0.02 116.67 128.21 2pyg s ASP 308 Ca 0.06 -0.35 0.18 0.00 -0.52 0.00 0.00 52.55 51.92 2pyg s ASP 308 Cb -0.15 -2.38 0.28 0.00 -1.46 0.00 0.00 42.92 39.21 2pyg s ASP 308 CO -0.01 -0.99 1.14 -0.67 0.52 0.00 0.00 175.17 175.16 2pyg n ASP 309 N 6.78 2.25 0.21 -0.34 2.03 -0.01 -4.72 116.55 122.75 2pyg n ASP 309 Ca 0.00 -3.04 0.12 0.00 0.52 0.00 0.00 54.79 52.39 2pyg n ASP 309 Cb 0.47 -0.42 0.69 0.00 -0.72 0.00 0.00 41.12 41.14 2pyg n ASP 309 CO 0.00 0.00 0.00 0.71 -1.92 0.00 0.00 177.20 175.99 2pyg h THR 310 N 0.28 0.87 -0.60 5.18 1.35 -1.58 0.28 112.91 118.70 2pyg h THR 310 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.86 2pyg h THR 310 Cb 1.01 0.94 0.00 0.00 -1.73 0.00 0.00 68.15 68.37 2pyg h THR 310 CO 0.00 0.00 0.00 0.00 -0.25 0.00 0.00 175.52 175.27 2pyg n ALA 311 N -2.53 2.68 -2.46 6.62 0.00 -1.26 -4.09 120.51 119.47 2pyg n ALA 311 Ca -0.00 -1.47 0.00 0.00 0.00 0.00 0.00 53.44 51.97 2pyg n ALA 311 Cb 0.21 -0.86 0.00 0.00 0.00 0.00 0.00 19.45 18.80 2pyg n ALA 311 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2pyg n GLY 312 N 1.09 3.79 0.37 0.00 0.00 0.91 -4.95 105.19 106.39 2pyg n GLY 312 Ca 0.23 -2.05 0.10 0.00 0.00 0.00 0.00 46.02 44.29 2pyg n GLY 312 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2pyg h ALA 313 N -0.21 1.76 0.00 4.61 0.00 -1.85 -2.92 119.26 120.66 2pyg h ALA 313 Ca 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 54.91 54.83 2pyg h ALA 313 Cb 0.00 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.62 2pyg h ALA 313 CO 0.00 0.04 -1.33 -1.13 0.00 0.00 0.00 179.25 176.84 2pyg n SER 314 N -4.53 0.73 -1.76 0.00 3.41 -1.26 -4.74 113.62 105.48 2pyg n SER 314 Ca 0.15 0.30 -0.18 0.00 -0.26 0.00 0.00 58.87 58.88 2pyg n SER 314 Cb 0.37 0.52 -0.03 0.00 -0.26 0.00 0.00 64.21 64.81 2pyg n SER 314 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2pyg n GLY 315 N 1.30 0.42 3.54 5.00 0.00 -0.73 -4.97 105.19 109.74 2pyg n GLY 315 Ca -0.06 -0.16 -0.30 0.00 0.00 0.00 0.00 46.02 45.50 2pyg n GLY 315 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2pyg s THR 316 N -2.79 3.22 -0.43 2.61 2.01 -1.10 -4.52 115.64 114.64 2pyg s THR 316 Ca 0.00 -1.20 -0.12 0.00 0.31 0.00 0.00 61.69 60.67 2pyg s THR 316 Cb 0.00 -2.45 0.06 0.00 0.01 0.00 0.00 72.50 70.12 2pyg s THR 316 CO 0.00 0.20 0.30 -0.47 -0.69 0.00 0.00 174.62 173.97 2pyg s TYR 317 N -1.11 3.28 -0.71 4.92 5.04 -1.26 -0.83 117.35 126.68 2pyg s TYR 317 Ca 0.19 -1.16 -0.27 0.00 -2.44 0.00 0.00 57.07 53.39 2pyg s TYR 317 Cb -0.11 -2.93 0.03 0.00 0.35 0.00 0.00 41.96 39.30 2pyg s TYR 317 CO 0.10 -0.78 1.29 0.71 -1.34 0.00 0.00 175.55 175.53 2pyg s TYR 318 N 1.54 2.30 0.03 4.97 1.51 0.10 -4.95 117.35 122.85 2pyg s TYR 318 Ca 0.03 0.05 -0.29 0.00 -1.01 0.00 0.00 57.07 55.86 2pyg s TYR 318 Cb -0.23 -4.59 -0.04 0.00 -0.11 0.00 0.00 41.96 36.99 2pyg s TYR 318 CO 0.05 -2.02 0.92 0.99 -1.11 0.00 0.00 175.55 174.38 2pyg s THR 319 N 5.76 4.77 -0.19 -0.71 2.01 -1.26 -0.57 115.64 125.45 2pyg s THR 319 Ca 0.38 1.95 -0.26 0.00 0.31 0.00 0.00 61.69 64.07 2pyg s THR 319 Cb -0.08 -4.27 -0.01 0.00 0.01 0.00 0.00 72.50 68.15 2pyg s THR 319 CO 0.17 0.24 0.89 -0.89 -0.69 0.00 0.00 174.62 174.34 2pyg s THR 320 N 0.58 4.82 0.02 -0.82 2.01 -1.26 -4.44 115.64 116.56 2pyg s THR 320 Ca 0.48 1.75 0.00 0.00 0.31 0.00 0.00 61.69 64.23 2pyg s THR 320 Cb -0.21 -4.19 -0.02 0.00 0.01 0.00 0.00 72.50 68.09 2pyg s THR 320 CO 0.27 -0.04 -0.03 -0.76 -0.69 0.00 0.00 174.62 173.37 2pyg s LEU 321 N 2.48 2.22 -1.19 4.42 1.43 -1.13 -1.22 118.68 125.69 2pyg s LEU 321 Ca 0.40 -0.47 -0.00 0.00 -1.03 0.00 0.00 54.13 53.03 2pyg s LEU 321 Cb -0.16 0.06 0.00 0.00 0.03 0.00 0.00 46.19 46.12 2pyg s LEU 321 CO 0.11 -0.27 1.00 0.59 0.23 0.00 0.00 176.35 178.01 2pyg n ASN 322 N 1.69 -2.21 -4.61 2.29 3.02 -0.95 -1.07 115.26 113.42 2pyg n ASN 322 Ca -0.23 -0.61 -0.41 0.00 -0.03 0.00 0.00 54.58 53.30 2pyg n ASN 322 Cb 0.55 -5.07 -0.07 0.00 -0.61 0.00 0.00 39.78 34.58 2pyg n ASN 322 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 2pyg s THR 323 N -3.35 4.99 -0.27 3.41 2.01 -1.15 -3.23 115.64 118.05 2pyg s THR 323 Ca 0.02 0.92 -0.10 0.00 0.31 0.00 0.00 61.69 62.84 2pyg s THR 323 Cb -0.01 -3.93 -0.04 0.00 0.01 0.00 0.00 72.50 68.53 2pyg s THR 323 CO 0.72 -0.03 0.15 -0.60 -0.69 0.00 0.00 174.62 174.17 2pyg s ARG 324 N 2.48 3.87 -0.30 4.92 3.52 0.12 -0.43 118.95 133.13 2pyg s ARG 324 Ca 0.24 -0.37 0.03 0.00 -0.13 0.00 0.00 55.73 55.50 2pyg s ARG 324 Cb -0.15 -3.54 0.08 0.00 -1.56 0.00 0.00 34.95 29.78 2pyg s ARG 324 CO 0.10 -0.16 -0.01 0.42 -0.81 0.00 0.00 175.30 174.85 2pyg s ILE 325 N 1.65 2.10 -0.01 4.11 1.01 0.20 0.15 121.20 130.41 2pyg s ILE 325 Ca 0.07 -1.97 0.00 0.00 0.00 0.00 0.00 60.65 58.75 2pyg s ILE 325 Cb -0.16 -2.42 0.00 0.00 0.01 0.00 0.00 42.46 39.90 2pyg s ILE 325 CO 0.08 -0.38 -0.01 -0.70 0.00 0.00 0.00 174.94 173.93 2pyg s GLU 326 N 1.05 0.11 -0.08 2.79 2.12 -0.85 -0.11 118.70 123.73 2pyg s GLU 326 Ca 0.03 -0.01 0.00 0.00 0.36 0.00 0.00 54.97 55.35 2pyg s GLU 326 Cb -0.19 -0.16 0.00 0.00 0.26 0.00 0.00 34.13 34.04 2pyg s GLU 326 CO -0.08 -0.01 0.00 0.41 -0.54 0.00 0.00 175.26 175.04 2pyg n GLY 327 N 3.26 0.44 3.86 -1.50 0.00 -0.53 -1.64 105.19 109.09 2pyg n GLY 327 Ca -0.15 -0.13 -0.31 0.00 0.00 0.00 0.00 46.02 45.42 2pyg n GLY 327 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2pyg s ASN 328 N -2.14 6.65 -0.23 1.61 0.01 -1.25 -3.93 114.94 115.64 2pyg s ASN 328 Ca 0.00 1.29 -0.03 0.00 -0.71 0.00 0.00 52.86 53.42 2pyg s ASN 328 Cb 0.00 -2.39 0.01 0.00 0.41 0.00 0.00 41.25 39.28 2pyg s ASN 328 CO 0.00 -0.37 -0.05 -0.89 -1.51 0.00 0.00 177.10 174.28 2pyg s THR 329 N -2.28 3.13 -0.08 1.60 2.01 -0.45 -0.79 115.64 118.78 2pyg s THR 329 Ca 0.54 -0.74 0.02 0.00 0.31 0.00 0.00 61.69 61.83 2pyg s THR 329 Cb -0.10 -2.49 0.01 0.00 0.01 0.00 0.00 72.50 69.93 2pyg s THR 329 CO 0.26 0.32 -0.13 -0.63 -0.69 0.00 0.00 174.62 173.75 2pyg s ILE 330 N 1.41 1.27 -0.03 1.82 1.01 0.17 -1.19 121.20 125.66 2pyg s ILE 330 Ca 0.04 -0.54 -0.01 0.00 0.00 0.00 0.00 60.65 60.13 2pyg s ILE 330 Cb -0.15 -1.16 0.02 0.00 0.01 0.00 0.00 42.46 41.18 2pyg s ILE 330 CO -0.04 0.39 0.07 -0.94 0.00 0.00 0.00 174.94 174.42 2pyg s SER 331 N 0.79 -0.02 0.65 3.58 1.04 -0.93 -0.53 113.70 118.27 2pyg s SER 331 Ca -0.12 0.14 -0.02 0.00 0.48 0.00 0.00 55.95 56.44 2pyg s SER 331 Cb -0.16 0.06 0.09 0.00 0.10 0.00 0.00 66.02 66.12 2pyg s SER 331 CO 0.02 -0.10 0.60 0.61 0.98 0.00 0.00 173.24 175.35 2pyg n GLY 332 N 3.84 0.39 0.00 7.32 0.00 -0.98 -0.77 105.19 114.99 2pyg n GLY 332 Ca -0.23 -1.95 0.00 0.00 0.00 0.00 0.00 46.02 43.84 2pyg n GLY 332 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2pyg n SER 333 N -3.03 0.24 0.28 1.61 3.41 -1.26 -4.20 113.62 110.67 2pyg n SER 333 Ca 0.10 -0.99 0.15 0.00 -0.26 0.00 0.00 58.87 57.87 2pyg n SER 333 Cb 0.34 0.00 0.80 0.00 -0.26 0.00 0.00 64.21 65.09 2pyg n SER 333 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2pyg h ALA 334 N 0.54 1.16 0.00 7.33 0.00 -1.88 -2.91 119.26 123.50 2pyg h ALA 334 Ca 0.00 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.84 2pyg h ALA 334 Cb 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.78 2pyg h ALA 334 CO 0.00 0.10 -1.48 0.09 0.00 0.00 0.00 179.25 177.95 2pyg n ASN 335 N -3.41 0.41 -4.52 0.00 3.02 -1.26 -4.92 115.26 104.58 2pyg n ASN 335 Ca -0.01 -0.10 -0.47 0.00 -0.03 0.00 0.00 54.58 53.96 2pyg n ASN 335 Cb 0.23 1.33 -0.05 0.00 -0.61 0.00 0.00 39.78 40.68 2pyg n ASN 335 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 2pyg n SER 336 N -2.18 2.65 0.09 6.41 7.64 -1.10 -3.79 113.62 123.34 2pyg n SER 336 Ca -0.01 0.33 -0.12 0.00 1.01 0.00 0.00 58.87 60.08 2pyg n SER 336 Cb 0.51 -1.39 -0.08 0.00 -1.01 0.00 0.00 64.21 62.24 2pyg n SER 336 CO 0.00 0.00 0.00 0.71 -3.01 0.00 0.00 175.04 172.74 2pyg h THR 337 N 7.08 0.85 -3.20 0.44 1.35 -1.45 -2.93 112.91 115.04 2pyg h THR 337 Ca -0.34 -0.88 -0.41 0.00 -0.55 0.00 0.00 66.41 64.23 2pyg h THR 337 Cb 1.29 1.32 -0.14 0.00 -1.73 0.00 0.00 68.15 68.88 2pyg h THR 337 CO 0.99 0.18 -0.64 -0.31 -0.25 0.00 0.00 175.52 175.49 2pyg s TYR 338 N -4.10 1.69 -0.12 4.73 1.51 -1.26 -2.03 117.35 117.77 2pyg s TYR 338 Ca -0.14 -0.94 -0.20 0.00 -1.01 0.00 0.00 57.07 54.79 2pyg s TYR 338 Cb 0.01 -1.01 -0.17 0.00 -0.11 0.00 0.00 41.96 40.68 2pyg s TYR 338 CO 0.53 -0.03 0.56 0.78 -1.11 0.00 0.00 175.55 176.28 2pyg h GLY 339 N 2.36 -0.02 -6.04 0.71 0.00 -0.54 -1.26 103.07 98.29 2pyg h GLY 339 Ca -0.39 0.01 -0.39 0.00 0.00 0.00 0.00 47.33 46.55 2pyg h GLY 339 CO 0.66 -0.01 -0.77 -0.42 0.00 0.00 0.00 176.54 176.00 2pyg s ILE 340 N -2.15 0.52 -0.02 2.60 1.01 -0.68 -1.66 121.20 120.81 2pyg s ILE 340 Ca -0.13 -0.15 0.00 0.00 0.00 0.00 0.00 60.65 60.38 2pyg s ILE 340 Cb -0.02 -0.52 0.02 0.00 0.01 0.00 0.00 42.46 41.95 2pyg s ILE 340 CO 0.47 0.21 -0.00 -1.58 0.00 0.00 0.00 174.94 174.03 2pyg s GLN 341 N 0.69 0.27 -0.11 2.79 0.74 -0.42 -1.59 119.66 122.03 2pyg s GLN 341 Ca -0.09 0.05 -0.06 0.00 0.05 0.00 0.00 55.36 55.31 2pyg s GLN 341 Cb -0.12 -0.42 -0.04 0.00 1.10 0.00 0.00 33.01 33.53 2pyg s GLN 341 CO 0.00 -0.10 0.10 -1.21 -0.55 0.00 0.00 175.29 173.53 2pyg s GLU 342 N 0.82 3.32 0.42 1.67 2.02 -0.34 0.06 118.70 126.67 2pyg s GLU 342 Ca -0.08 -0.21 -0.16 0.00 0.02 0.00 0.00 54.97 54.54 2pyg s GLU 342 Cb -0.11 -3.08 -0.09 0.00 0.10 0.00 0.00 34.13 30.95 2pyg s GLU 342 CO -0.01 0.76 0.87 1.03 0.02 0.00 0.00 175.26 177.93 2pyg s ARG 343 N -1.01 4.00 -1.41 1.61 1.81 -0.04 -4.69 118.95 119.22 2pyg s ARG 343 Ca 0.15 0.83 -0.08 0.00 -1.72 0.00 0.00 55.73 54.91 2pyg s ARG 343 Cb -0.12 -2.27 0.06 0.00 -0.45 0.00 0.00 34.95 32.18 2pyg s ARG 343 CO 0.04 -0.06 2.46 -1.71 -0.68 0.00 0.00 175.30 175.35 2pyg n ASN 344 N -0.99 7.54 -0.23 0.23 5.15 -1.26 -4.33 115.26 121.38 2pyg n ASN 344 Ca 0.05 -2.96 0.08 0.00 -0.60 0.00 0.00 54.58 51.15 2pyg n ASN 344 Cb 0.54 -1.45 0.12 0.00 -0.53 0.00 0.00 39.78 38.46 2pyg n ASN 344 CO 0.00 0.00 0.00 -0.90 1.40 0.00 0.00 177.26 177.76 2pyg n ASP 345 N 2.83 1.89 0.00 1.20 5.68 -1.26 -4.95 116.55 121.95 2pyg n ASP 345 Ca 0.63 -2.99 0.00 0.00 -0.50 0.00 0.00 54.79 51.93 2pyg n ASP 345 Cb 0.27 -0.40 0.00 0.00 -1.14 0.00 0.00 41.12 39.85 2pyg n ASP 345 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2pyg n GLY 346 N -1.14 1.23 3.67 6.12 0.00 -1.26 -4.76 105.19 109.04 2pyg n GLY 346 Ca 0.14 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.71 2pyg n GLY 346 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2pyg n THR 347 N -1.88 0.83 -4.00 2.61 -1.04 -1.26 -4.75 114.28 104.80 2pyg n THR 347 Ca 0.00 -0.21 -0.09 0.00 -2.04 0.00 0.00 64.05 61.71 2pyg n THR 347 Cb 0.00 -1.46 -0.05 0.00 -1.82 0.00 0.00 70.33 67.00 2pyg n THR 347 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 2pyg s ASP 348 N 0.35 -0.09 -1.36 8.00 2.15 -0.36 -3.76 116.67 121.60 2pyg s ASP 348 Ca 0.70 -0.93 -0.08 0.00 0.43 0.00 0.00 52.55 52.67 2pyg s ASP 348 Cb -0.66 0.59 0.02 0.00 -0.30 0.00 0.00 42.92 42.56 2pyg s ASP 348 CO 0.48 -1.15 1.14 -1.22 -0.17 0.00 0.00 175.17 174.26 2pyg n TYR 349 N -0.39 -2.74 -3.13 -5.34 4.01 -1.26 -2.89 117.16 105.42 2pyg n TYR 349 Ca -0.02 1.00 -0.39 0.00 -0.16 0.00 0.00 57.90 58.33 2pyg n TYR 349 Cb 0.62 -4.94 -0.06 0.00 -0.31 0.00 0.00 39.34 34.65 2pyg n TYR 349 CO 0.00 0.00 0.00 -1.12 -0.46 0.00 0.00 176.86 175.28 2pyg s SER 350 N -3.46 7.20 -0.30 7.72 0.01 -1.26 -2.24 113.70 121.38 2pyg s SER 350 Ca 0.52 1.43 0.03 0.00 1.31 0.00 0.00 55.95 59.24 2pyg s SER 350 Cb -0.23 -2.42 0.08 0.00 0.21 0.00 0.00 66.02 63.65 2pyg s SER 350 CO 0.74 0.22 -0.03 -0.44 0.41 0.00 0.00 173.24 174.15 2pyg s SER 351 N -1.01 4.59 -0.30 2.44 0.01 0.43 -0.68 113.70 119.17 2pyg s SER 351 Ca 0.32 -1.77 -0.14 0.00 1.31 0.00 0.00 55.95 55.68 2pyg s SER 351 Cb -0.21 -1.57 -0.03 0.00 0.21 0.00 0.00 66.02 64.42 2pyg s SER 351 CO 0.22 -0.29 0.31 -0.76 0.41 0.00 0.00 173.24 173.13 2pyg s LEU 352 N 1.01 4.22 -0.07 2.44 1.43 -0.47 -0.63 118.68 126.61 2pyg s LEU 352 Ca 0.01 -0.04 0.01 0.00 -1.03 0.00 0.00 54.13 53.08 2pyg s LEU 352 Cb -0.19 -2.29 0.02 0.00 0.03 0.00 0.00 46.19 43.76 2pyg s LEU 352 CO -0.07 -0.21 -0.06 -0.63 0.23 0.00 0.00 176.35 175.61 2pyg s ILE 353 N 1.94 0.76 -1.05 -0.59 1.01 0.84 -1.51 121.20 122.60 2pyg s ILE 353 Ca 0.11 -0.21 -0.18 0.00 0.00 0.00 0.00 60.65 60.37 2pyg s ILE 353 Cb -0.16 -0.77 0.01 0.00 0.01 0.00 0.00 42.46 41.54 2pyg s ILE 353 CO 0.11 0.29 0.71 0.47 0.00 0.00 0.00 174.94 176.52 2pyg n ASP 354 N 4.34 -5.13 -4.35 3.58 8.00 -1.06 -1.54 116.55 120.39 2pyg n ASP 354 Ca -0.19 -1.00 -0.33 0.00 0.71 0.00 0.00 54.79 53.98 2pyg n ASP 354 Cb 0.51 -2.70 -0.14 0.00 -0.02 0.00 0.00 41.12 38.76 2pyg n ASP 354 CO 0.00 0.00 0.00 0.20 -0.39 0.00 0.00 177.20 177.01 2pyg s ASN 355 N -3.33 3.97 -0.43 -2.24 0.01 -1.26 -1.45 114.94 110.20 2pyg s ASN 355 Ca 0.33 -0.35 -0.22 0.00 -0.71 0.00 0.00 52.86 51.91 2pyg s ASN 355 Cb -0.15 -1.61 0.02 0.00 0.41 0.00 0.00 41.25 39.93 2pyg s ASN 355 CO 0.89 0.15 0.73 -1.81 -1.51 0.00 0.00 177.10 175.55 2pyg s ASP 356 N 0.43 6.39 -0.02 -1.22 1.01 0.03 -4.97 116.67 118.33 2pyg s ASP 356 Ca -0.10 -0.13 0.05 0.00 0.71 0.00 0.00 52.55 53.08 2pyg s ASP 356 Cb -0.16 -2.36 -0.03 0.00 1.01 0.00 0.00 42.92 41.38 2pyg s ASP 356 CO 0.05 -0.84 -0.16 -0.63 0.21 0.00 0.00 175.17 173.80 2pyg s ILE 357 N 3.10 2.95 -0.05 0.77 1.01 -1.26 0.46 121.20 128.19 2pyg s ILE 357 Ca 0.27 -0.89 -0.29 0.00 0.00 0.00 0.00 60.65 59.74 2pyg s ILE 357 Cb -0.13 -2.18 0.11 0.00 0.01 0.00 0.00 42.46 40.27 2pyg s ILE 357 CO 0.21 0.50 0.91 0.00 0.00 0.00 0.00 174.94 176.56 2pyg s ALA 358 N -0.80 -1.85 -0.92 9.38 0.00 0.31 -4.97 121.76 122.90 2pyg s ALA 358 Ca 0.13 1.17 -0.01 0.00 0.00 0.00 0.00 51.96 53.25 2pyg s ALA 358 Cb -0.11 0.15 0.00 0.00 0.00 0.00 0.00 23.12 23.16 2pyg s ALA 358 CO 0.02 -0.59 0.09 0.41 0.00 0.00 0.00 175.76 175.69 2pyg n GLY 359 N 0.01 -0.06 3.31 0.00 0.00 -1.26 -2.33 105.19 104.87 2pyg n GLY 359 Ca -0.09 -0.38 -0.18 0.00 0.00 0.00 0.00 46.02 45.37 2pyg n GLY 359 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2pyg s VAL 360 N -2.65 1.57 0.51 1.61 -7.23 -1.26 -2.85 120.40 110.11 2pyg s VAL 360 Ca 0.05 -2.12 0.15 0.00 -1.81 0.00 0.00 61.98 58.25 2pyg s VAL 360 Cb -0.02 -1.94 0.27 0.00 0.56 0.00 0.00 36.38 35.25 2pyg s VAL 360 CO 0.06 -0.60 2.13 1.56 -0.31 0.00 0.00 175.10 177.94 2pyg h GLN 361 N 2.74 0.05 -2.06 4.82 4.20 -1.37 -3.41 115.11 120.08 2pyg h GLN 361 Ca -0.38 -0.00 0.04 0.00 0.06 0.00 0.00 58.65 58.36 2pyg h GLN 361 Cb 1.21 -0.01 -0.21 0.00 0.30 0.00 0.00 27.48 28.77 2pyg h GLN 361 CO 0.61 0.04 -0.10 -1.14 -0.67 0.00 0.00 178.83 177.57 2pyg s GLN 362 N -5.09 0.60 0.15 1.46 0.74 -0.86 -5.02 119.66 111.64 2pyg s GLN 362 Ca -0.05 1.32 -0.25 0.00 0.05 0.00 0.00 55.36 56.43 2pyg s GLN 362 Cb 0.17 0.53 0.02 0.00 1.10 0.00 0.00 33.01 34.83 2pyg s GLN 362 CO 0.68 -0.18 1.60 -1.35 -0.55 0.00 0.00 175.29 175.48 2pyg h PRO 363 N 7.60 -0.31 -3.67 1.67 0.11 -1.87 -2.23 132.00 133.30 2pyg h PRO 363 Ca -0.23 0.02 -0.14 0.00 0.11 0.00 0.00 66.00 65.76 2pyg h PRO 363 Cb 1.15 0.07 -0.19 0.00 0.11 0.00 0.00 31.00 32.14 2pyg h PRO 363 CO 0.13 -0.21 -0.51 0.42 -0.21 0.00 0.00 178.00 177.62 2pyg s ILE 364 N -5.98 0.11 -0.26 4.15 1.01 -1.26 -1.30 121.20 117.67 2pyg s ILE 364 Ca -0.15 -0.89 -0.01 0.00 0.00 0.00 0.00 60.65 59.60 2pyg s ILE 364 Cb 0.12 -0.65 0.14 0.00 0.01 0.00 0.00 42.46 42.08 2pyg s ILE 364 CO 0.67 -0.49 0.38 -1.58 0.00 0.00 0.00 174.94 173.92 2pyg s GLN 365 N -2.00 0.36 0.20 2.79 2.00 -0.62 -4.98 119.66 117.41 2pyg s GLN 365 Ca -0.10 0.38 0.08 0.00 -2.00 0.00 0.00 55.36 53.71 2pyg s GLN 365 Cb -0.05 -0.45 -0.04 0.00 0.80 0.00 0.00 33.01 33.28 2pyg s GLN 365 CO -0.02 -0.78 0.01 -0.51 -0.50 0.00 0.00 175.29 173.50 2pyg s LEU 366 N 2.53 3.31 0.00 3.68 1.43 -1.26 -1.20 118.68 127.17 2pyg s LEU 366 Ca 0.12 -0.44 0.00 0.00 -1.03 0.00 0.00 54.13 52.77 2pyg s LEU 366 Cb -0.14 -1.93 0.00 0.00 0.03 0.00 0.00 46.19 44.15 2pyg s LEU 366 CO -0.21 0.06 0.00 -1.22 0.23 0.00 0.00 176.35 175.22 2pyg n TYR 367 N -0.33 0.00 -1.67 0.29 4.01 -1.26 -4.97 117.16 113.22 2pyg n TYR 367 Ca -0.09 0.00 -0.50 0.00 -0.16 0.00 0.00 57.90 57.15 2pyg n TYR 367 Cb 0.56 0.00 -0.05 0.00 -0.31 0.00 0.00 39.34 39.54 2pyg n TYR 367 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2pyg n GLY 368 N 1.12 1.14 0.34 2.72 0.00 -1.25 -4.83 105.19 104.43 2pyg n GLY 368 Ca 0.00 0.79 0.19 0.00 0.00 0.00 0.00 46.02 47.00 2pyg n GLY 368 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2pyg h PRO 369 N 7.34 0.00 -0.35 1.61 0.13 -1.97 0.73 132.00 139.50 2pyg h PRO 369 Ca -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 2pyg h PRO 369 Cb 1.28 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.41 2pyg h PRO 369 CO 0.91 0.00 0.00 0.72 -0.23 0.00 0.00 178.00 179.40 2pyg n HIS 370 N -3.25 0.48 -2.93 1.56 8.25 -1.26 -4.99 115.22 113.08 2pyg n HIS 370 Ca -0.02 -0.51 -0.39 0.00 -0.26 0.00 0.00 57.72 56.55 2pyg n HIS 370 Cb 0.22 -0.03 -0.06 0.00 1.12 0.00 0.00 29.99 31.24 2pyg n HIS 370 CO 0.00 0.00 0.00 -1.12 0.64 0.00 0.00 176.34 175.86 2pyg s SER 371 N -1.02 7.41 0.17 0.41 0.01 0.25 -4.24 113.70 116.69 2pyg s SER 371 Ca 0.24 1.70 0.08 0.00 1.31 0.00 0.00 55.95 59.28 2pyg s SER 371 Cb 0.13 -2.52 -0.04 0.00 0.21 0.00 0.00 66.02 63.79 2pyg s SER 371 CO 0.16 0.17 -0.16 0.42 0.41 0.00 0.00 173.24 174.24 2pyg s THR 372 N -1.22 1.66 0.01 1.44 -4.23 0.14 -4.91 115.64 108.53 2pyg s THR 372 Ca 0.38 -1.98 0.00 0.00 -1.18 0.00 0.00 61.69 58.92 2pyg s THR 372 Cb -0.23 -1.85 -0.01 0.00 1.34 0.00 0.00 72.50 71.76 2pyg s THR 372 CO 0.27 -0.45 -0.02 0.54 -0.54 0.00 0.00 174.62 174.41 2pyg s VAL 373 N -2.44 0.15 -0.00 2.29 0.11 -1.26 -1.37 120.40 117.87 2pyg s VAL 373 Ca 0.17 -0.40 -0.22 0.00 -2.93 0.00 0.00 61.98 58.60 2pyg s VAL 373 Cb -0.03 -0.19 0.04 0.00 -1.53 0.00 0.00 36.38 34.67 2pyg s VAL 373 CO 0.06 -0.16 0.47 -0.94 -3.33 0.00 0.00 175.10 171.20 2pyg s SER 374 N -0.58 -0.39 0.00 3.54 1.04 -0.57 -4.98 113.70 111.76 2pyg s SER 374 Ca -0.05 0.27 0.00 0.00 0.48 0.00 0.00 55.95 56.65 2pyg s SER 374 Cb -0.04 0.43 0.00 0.00 0.10 0.00 0.00 66.02 66.51 2pyg s SER 374 CO -0.00 -0.58 0.00 0.61 0.98 0.00 0.00 173.24 174.24