#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1yru n GLY 8 N 0.00 0.83 3.58 0.00 0.00 -1.26 -4.86 105.19 103.48 1yru n GLY 8 Ca 0.00 -1.17 -0.42 0.00 0.00 0.00 0.00 46.02 44.43 1yru n GLY 8 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1yru s TYR 9 N 0.00 3.16 -2.42 1.61 4.12 -1.26 -4.73 117.35 117.83 1yru s TYR 9 Ca 0.00 0.41 0.21 0.00 0.02 0.00 0.00 57.07 57.71 1yru s TYR 9 Cb 0.00 -3.14 0.26 0.00 -1.52 0.00 0.00 41.96 37.55 1yru s TYR 9 CO 0.00 -0.62 1.23 0.00 0.02 0.00 0.00 175.55 176.19 1yru n ALA 10 N 6.06 2.44 -3.78 3.71 0.00 -1.26 -5.01 120.51 122.67 1yru n ALA 10 Ca -0.01 -0.80 0.07 0.00 0.00 0.00 0.00 53.44 52.70 1yru n ALA 10 Cb 0.49 -0.73 0.02 0.00 0.00 0.00 0.00 19.45 19.22 1yru n ALA 10 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 1yru n ASN 11 N 1.23 -1.57 0.02 0.00 2.04 -1.26 -5.05 115.26 110.67 1yru n ASN 11 Ca 0.14 -1.85 -0.11 0.00 -0.44 0.00 0.00 54.58 52.32 1yru n ASN 11 Cb 0.54 2.55 -0.06 0.00 -2.53 0.00 0.00 39.78 40.28 1yru n ASN 11 CO 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 177.26 176.82 1yru h ALA 12 N 2.00 0.07 -0.52 -2.53 0.00 -1.97 -2.93 119.26 113.37 1yru h ALA 12 Ca -0.24 -0.01 0.09 0.00 0.00 0.00 0.00 54.91 54.75 1yru h ALA 12 Cb 1.06 -0.02 -0.08 0.00 0.00 0.00 0.00 17.79 18.75 1yru h ALA 12 CO 0.33 -0.43 0.08 0.00 0.00 0.00 0.00 179.25 179.23 1yru h ALA 13 N 1.02 0.57 -0.33 0.00 0.00 -1.96 0.12 119.26 118.68 1yru h ALA 13 Ca 0.02 0.12 0.07 0.00 0.00 0.00 0.00 54.91 55.12 1yru h ALA 13 Cb -0.00 0.17 -0.08 0.00 0.00 0.00 0.00 17.79 17.88 1yru h ALA 13 CO -0.00 -0.33 -0.21 -0.44 0.00 0.00 0.00 179.25 178.27 1yru h ASP 14 N 0.21 -0.70 0.83 0.00 3.32 -1.87 0.43 116.42 118.65 1yru h ASP 14 Ca 0.27 0.15 0.00 0.00 0.02 0.00 0.00 57.03 57.46 1yru h ASP 14 Cb 0.38 0.36 0.00 0.00 0.22 0.00 0.00 39.33 40.28 1yru h ASP 14 CO -0.36 -0.24 0.00 0.54 -1.72 0.00 0.00 179.24 177.45 1yru n ARG 15 N -5.37 0.18 0.01 3.56 1.74 -0.34 -2.09 116.66 114.35 1yru n ARG 15 Ca 0.01 0.36 0.11 0.00 -0.77 0.00 0.00 57.85 57.56 1yru n ARG 15 Cb 0.28 -1.82 0.03 0.00 -1.02 0.00 0.00 32.46 29.94 1yru n ARG 15 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 1yru n GLU 16 N -2.15 0.17 0.27 5.56 1.02 0.28 -3.90 120.64 121.89 1yru n GLU 16 Ca 0.03 -0.01 0.16 0.00 -0.02 0.00 0.00 57.16 57.32 1yru n GLU 16 Cb 0.26 -1.55 0.62 0.00 -0.02 0.00 0.00 31.44 30.75 1yru n GLU 16 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 1yru h SER 17 N 0.00 0.00 0.00 1.62 4.64 -0.41 -3.46 113.55 115.95 1yru h SER 17 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1yru h SER 17 Cb 0.64 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.73 1yru h SER 17 CO 0.00 0.04 0.00 0.61 -0.87 0.00 0.00 176.83 176.61 1yru n GLY 18 N 0.10 0.79 3.74 -0.77 0.00 -1.25 -1.61 105.19 106.20 1yru n GLY 18 Ca 0.01 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.63 1yru n GLY 18 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1yru s ILE 19 N -3.34 4.86 0.29 -0.61 1.01 -1.26 -4.38 121.20 117.77 1yru s ILE 19 Ca 0.00 1.46 -0.30 0.00 0.00 0.00 0.00 60.65 61.81 1yru s ILE 19 Cb 0.00 -4.04 -0.12 0.00 0.01 0.00 0.00 42.46 38.32 1yru s ILE 19 CO 0.00 0.36 1.59 -2.65 0.00 0.00 0.00 174.94 174.23 1yru n PRO 20 N 3.00 2.68 -0.31 2.79 -0.02 -1.26 -4.78 135.00 137.09 1yru n PRO 20 Ca -0.04 0.95 0.04 0.00 -2.02 0.00 0.00 63.50 62.44 1yru n PRO 20 Cb 0.51 -2.73 0.11 0.00 -0.02 0.00 0.00 33.50 31.36 1yru n PRO 20 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1yru n ALA 21 N 2.10 0.16 0.15 3.55 0.00 -1.26 -2.32 120.51 122.88 1yru n ALA 21 Ca 0.08 0.94 0.00 0.00 0.00 0.00 0.00 53.44 54.46 1yru n ALA 21 Cb 0.37 -0.54 0.27 0.00 0.00 0.00 0.00 19.45 19.54 1yru n ALA 21 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1yru h ALA 22 N 1.64 1.19 -0.36 0.00 0.00 -1.94 -2.88 119.26 116.91 1yru h ALA 22 Ca 0.40 -0.42 -0.13 0.00 0.00 0.00 0.00 54.91 54.75 1yru h ALA 22 Cb 0.61 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.31 1yru h ALA 22 CO -0.89 0.59 -0.31 0.28 0.00 0.00 0.00 179.25 178.92 1yru h VAL 23 N 0.05 1.28 -0.09 0.00 2.07 -1.82 -3.18 116.25 114.55 1yru h VAL 23 Ca 0.00 -1.46 -0.12 0.00 0.82 0.00 0.00 66.70 65.95 1yru h VAL 23 Cb 0.83 1.33 -0.01 0.00 -1.52 0.00 0.00 31.29 31.91 1yru h VAL 23 CO 0.06 0.48 -0.46 0.25 0.02 0.00 0.00 177.57 177.93 1yru h LEU 24 N 0.67 0.24 -0.34 2.57 6.46 -1.32 -1.32 115.31 122.26 1yru h LEU 24 Ca 0.07 -0.11 -0.00 0.00 -0.12 0.00 0.00 57.88 57.72 1yru h LEU 24 Cb 0.85 -0.07 -0.02 0.00 -0.73 0.00 0.00 40.66 40.69 1yru h LEU 24 CO 0.07 0.67 0.19 0.44 -0.62 0.00 0.00 178.44 179.19 1yru h ASP 25 N 0.18 0.42 0.05 1.25 3.45 -1.51 0.16 116.42 120.42 1yru h ASP 25 Ca 0.01 -0.08 -0.05 0.00 0.43 0.00 0.00 57.03 57.35 1yru h ASP 25 Cb 0.88 -0.11 -0.01 0.00 -0.56 0.00 0.00 39.33 39.54 1yru h ASP 25 CO 0.07 0.37 -0.14 1.23 -1.57 0.00 0.00 179.24 179.20 1yru h GLY 26 N 0.43 0.22 0.97 2.75 0.00 -1.47 -0.72 103.07 105.25 1yru h GLY 26 Ca 0.12 -0.14 -0.04 0.00 0.00 0.00 0.00 47.33 47.28 1yru h GLY 26 CO -0.02 0.13 0.16 -2.22 0.00 0.00 0.00 176.54 174.59 1yru h ILE 27 N 0.20 1.22 -0.52 2.60 2.04 0.01 0.57 117.51 123.64 1yru h ILE 27 Ca 0.04 -0.73 -0.10 0.00 1.00 0.00 0.00 64.86 65.07 1yru h ILE 27 Cb 0.38 0.79 -0.02 0.00 -0.74 0.00 0.00 36.82 37.23 1yru h ILE 27 CO 0.02 0.27 -0.06 0.11 0.00 0.00 0.00 178.15 178.49 1yru h LYS 28 N 0.65 0.93 -0.26 2.37 1.57 -0.32 -2.11 116.57 119.40 1yru h LYS 28 Ca 0.16 -0.30 -0.14 0.00 -1.87 0.00 0.00 60.65 58.50 1yru h LYS 28 Cb 0.25 -0.08 -0.01 0.00 0.08 0.00 0.00 32.23 32.47 1yru h LYS 28 CO -0.01 0.96 -0.40 0.00 -0.57 0.00 0.00 179.45 179.43 1yru h ALA 29 N 1.08 0.81 -0.13 3.86 0.00 -0.08 -2.84 119.26 121.97 1yru h ALA 29 Ca 0.14 -0.44 -0.14 0.00 0.00 0.00 0.00 54.91 54.47 1yru h ALA 29 Cb 0.58 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.25 1yru h ALA 29 CO 0.04 0.65 -0.55 0.28 0.00 0.00 0.00 179.25 179.67 1yru h VAL 30 N 0.50 1.35 -0.49 0.00 2.07 0.37 -1.86 116.25 118.19 1yru h VAL 30 Ca 0.04 -1.83 -0.04 0.00 0.82 0.00 0.00 66.70 65.69 1yru h VAL 30 Cb 0.92 1.85 -0.02 0.00 -1.52 0.00 0.00 31.29 32.51 1yru h VAL 30 CO 0.08 0.55 0.12 0.00 0.02 0.00 0.00 177.57 178.34 1yru h ALA 31 N 1.13 1.30 0.14 1.67 0.00 -1.22 0.15 119.26 122.43 1yru h ALA 31 Ca 0.00 -0.18 -0.29 0.00 0.00 0.00 0.00 54.91 54.44 1yru h ALA 31 Cb 1.05 -0.20 0.02 0.00 0.00 0.00 0.00 17.79 18.66 1yru h ALA 31 CO 0.09 0.49 -1.26 0.87 0.00 0.00 0.00 179.25 179.45 1yru h LYS 32 N 0.71 0.47 -0.57 0.00 1.57 -1.30 -0.88 116.57 116.58 1yru h LYS 32 Ca 0.16 -0.69 -0.07 0.00 -1.87 0.00 0.00 60.65 58.17 1yru h LYS 32 Cb 0.26 0.24 -0.02 0.00 0.08 0.00 0.00 32.23 32.79 1yru h LYS 32 CO -0.00 1.31 0.07 0.93 -0.57 0.00 0.00 179.45 181.19 1yru h GLU 33 N 0.18 0.93 -0.21 3.15 5.08 -1.06 -2.37 114.58 120.29 1yru h GLU 33 Ca -0.17 -0.24 0.00 0.00 -1.00 0.00 0.00 59.36 57.95 1yru h GLU 33 Cb 1.95 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 31.08 1yru h GLU 33 CO 0.23 0.88 0.00 1.63 -1.00 0.00 0.00 179.01 180.75 1yru n LYS 34 N -4.22 2.21 -3.47 2.33 5.02 0.02 -5.01 118.16 115.03 1yru n LYS 34 Ca 0.04 -2.01 -0.14 0.00 -2.02 0.00 0.00 58.31 54.18 1yru n LYS 34 Cb 0.28 -1.44 0.00 0.00 -0.02 0.00 0.00 35.03 33.85 1yru n LYS 34 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 1yru n ASN 35 N 1.28 -6.16 -3.62 4.39 4.05 -0.43 -4.80 115.26 109.98 1yru n ASN 35 Ca 0.15 -0.57 -0.15 0.00 0.45 0.00 0.00 54.58 54.46 1yru n ASN 35 Cb 0.55 -3.28 -0.07 0.00 1.23 0.00 0.00 39.78 38.21 1yru n ASN 35 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 1yru s ALA 36 N -2.99 -1.60 -0.04 5.20 0.00 -0.62 -2.55 121.76 119.15 1yru s ALA 36 Ca 0.00 1.54 -0.27 0.00 0.00 0.00 0.00 51.96 53.23 1yru s ALA 36 Cb -0.00 -0.61 -0.03 0.00 0.00 0.00 0.00 23.12 22.48 1yru s ALA 36 CO 0.83 -0.33 0.87 0.99 0.00 0.00 0.00 175.76 178.12 1yru s THR 37 N -0.31 4.93 -0.17 0.00 2.01 -0.97 -3.78 115.64 117.36 1yru s THR 37 Ca -0.05 1.80 -0.02 0.00 0.31 0.00 0.00 61.69 63.74 1yru s THR 37 Cb -0.03 -4.20 -0.01 0.00 0.01 0.00 0.00 72.50 68.27 1yru s THR 37 CO 0.04 0.18 -0.10 -0.76 -0.69 0.00 0.00 174.62 173.29 1yru s LEU 38 N 1.04 2.76 -0.06 4.42 1.43 -0.14 -0.87 118.68 127.26 1yru s LEU 38 Ca 0.46 -0.37 0.05 0.00 -1.03 0.00 0.00 54.13 53.24 1yru s LEU 38 Cb -0.19 -1.66 -0.01 0.00 0.03 0.00 0.00 46.19 44.36 1yru s LEU 38 CO 0.23 0.08 -0.23 -0.04 0.23 0.00 0.00 176.35 176.62 1yru s MET 39 N 0.85 2.62 0.09 1.70 -1.94 -0.34 -0.92 119.30 121.35 1yru s MET 39 Ca -0.03 -0.87 0.05 0.00 -1.71 0.00 0.00 55.69 53.13 1yru s MET 39 Cb -0.15 -2.22 -0.03 0.00 2.01 0.00 0.00 34.83 34.44 1yru s MET 39 CO 0.01 0.39 -0.14 -0.06 -0.01 0.00 0.00 175.02 175.21 1yru s PHE 40 N -0.18 1.23 0.35 -0.03 0.40 0.04 0.24 117.98 120.03 1yru s PHE 40 Ca -0.03 -0.51 -0.23 0.00 -0.60 0.00 0.00 56.93 55.57 1yru s PHE 40 Cb -0.14 -0.68 -0.10 0.00 0.51 0.00 0.00 43.02 42.62 1yru s PHE 40 CO 0.04 0.07 0.90 1.03 0.70 0.00 0.00 175.22 177.96 1yru s ARG 41 N -2.07 4.37 0.33 0.44 0.52 -0.28 -0.56 118.95 121.71 1yru s ARG 41 Ca 0.01 1.15 -0.28 0.00 -0.52 0.00 0.00 55.73 56.09 1yru s ARG 41 Cb -0.08 -2.56 -0.12 0.00 0.52 0.00 0.00 34.95 32.71 1yru s ARG 41 CO 0.02 0.17 1.28 1.28 0.02 0.00 0.00 175.30 178.07 1yru n LEU 42 N 0.08 3.43 -4.74 2.53 4.77 -1.26 -4.58 117.00 117.22 1yru n LEU 42 Ca 0.03 1.20 -0.37 0.00 -0.03 0.00 0.00 56.01 56.84 1yru n LEU 42 Cb 0.52 -1.47 -0.06 0.00 -2.33 0.00 0.00 43.42 40.07 1yru n LEU 42 CO 0.41 -0.54 0.09 -0.69 -1.33 0.00 0.00 177.39 175.34 1yru s VAL 43 N -1.05 5.21 0.19 4.08 1.01 -0.63 -4.91 120.40 124.30 1yru s VAL 43 Ca 0.56 0.79 -0.33 0.00 0.00 0.00 0.00 61.98 63.00 1yru s VAL 43 Cb -0.58 -3.74 -0.14 0.00 0.00 0.00 0.00 36.38 31.93 1yru s VAL 43 CO 0.62 0.39 1.52 -3.20 0.00 0.00 0.00 175.10 174.43 1yru n ASN 44 N 3.36 3.00 0.26 3.32 2.85 -1.26 -4.33 115.26 122.46 1yru n ASN 44 Ca -0.10 1.10 0.18 0.00 -0.11 0.00 0.00 54.58 55.65 1yru n ASN 44 Cb 0.52 -1.43 0.92 0.00 1.24 0.00 0.00 39.78 41.03 1yru n ASN 44 CO 0.00 0.00 0.00 1.55 -2.11 0.00 0.00 177.26 176.70 1yru h PRO 45 N 5.33 0.00 0.00 1.20 0.13 -1.93 -1.11 132.00 135.62 1yru h PRO 45 Ca -0.45 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 1yru h PRO 45 Cb 1.26 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.39 1yru h PRO 45 CO 0.84 0.00 0.00 0.72 -0.23 0.00 0.00 178.00 179.33 1yru n HIS 46 N -2.73 0.00 -0.04 1.56 8.25 -1.26 -3.03 115.22 117.96 1yru n HIS 46 Ca -0.02 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.44 1yru n HIS 46 Cb 0.08 -0.18 -0.13 0.00 1.12 0.00 0.00 29.99 30.88 1yru n HIS 46 CO 0.00 0.00 0.00 0.43 0.64 0.00 0.00 176.34 177.41 1yru n SER 47 N -1.18 1.13 -0.35 0.41 7.64 -0.42 -4.56 113.62 116.29 1yru n SER 47 Ca 0.13 0.00 -0.09 0.00 1.01 0.00 0.00 58.87 59.92 1yru n SER 47 Cb 0.14 1.31 -0.08 0.00 -1.01 0.00 0.00 64.21 64.57 1yru n SER 47 CO 0.00 0.00 0.00 0.41 -3.01 0.00 0.00 175.04 172.44 1yru n THR 48 N -2.35 -0.56 0.20 0.44 -1.04 -1.17 0.12 114.28 109.93 1yru n THR 48 Ca -0.15 2.02 0.06 0.00 -2.04 0.00 0.00 64.05 63.94 1yru n THR 48 Cb 0.74 -2.50 0.53 0.00 -1.82 0.00 0.00 70.33 67.28 1yru n THR 48 CO 0.00 0.00 0.00 -1.28 -0.64 0.00 0.00 175.07 173.15 1yru h SER 49 N 0.00 0.07 0.24 8.00 0.87 -1.82 -1.43 113.55 119.48 1yru h SER 49 Ca 0.14 -0.01 -0.21 0.00 -1.23 0.00 0.00 61.79 60.48 1yru h SER 49 Cb 0.35 -0.02 0.00 0.00 -0.44 0.00 0.00 62.40 62.29 1yru h SER 49 CO -0.79 0.16 -0.85 -0.07 -0.53 0.00 0.00 176.83 174.74 1yru h LEU 50 N 0.08 0.58 -0.74 2.23 3.38 -0.59 -2.97 115.31 117.27 1yru h LEU 50 Ca 0.02 -0.42 -0.13 0.00 0.09 0.00 0.00 57.88 57.43 1yru h LEU 50 Cb 0.18 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.74 1yru h LEU 50 CO 0.01 1.20 -0.56 0.40 0.09 0.00 0.00 178.44 179.58 1yru h ILE 51 N 0.29 1.37 -0.02 1.22 2.04 -0.52 0.49 117.51 122.38 1yru h ILE 51 Ca -0.06 -1.88 -0.08 0.00 1.00 0.00 0.00 64.86 63.84 1yru h ILE 51 Cb 1.47 1.94 -0.01 0.00 -0.74 0.00 0.00 36.82 39.48 1yru h ILE 51 CO 0.15 0.55 -0.37 0.00 0.00 0.00 0.00 178.15 178.48 1yru h ALA 52 N 1.26 1.35 -0.76 1.87 0.00 -1.12 -2.93 119.26 118.93 1yru h ALA 52 Ca -0.00 -0.35 -0.35 0.00 0.00 0.00 0.00 54.91 54.21 1yru h ALA 52 Cb 1.03 -0.06 -0.21 0.00 0.00 0.00 0.00 17.79 18.55 1yru h ALA 52 CO 0.08 0.48 0.38 -0.85 0.00 0.00 0.00 179.25 179.34 1yru n GLU 53 N -4.09 2.52 -1.46 0.00 0.28 -1.17 -4.52 120.64 112.21 1yru n GLU 53 Ca -0.02 -3.06 -0.06 0.00 -0.16 0.00 0.00 57.16 53.86 1yru n GLU 53 Cb 0.41 -2.09 -0.02 0.00 1.43 0.00 0.00 31.44 31.17 1yru n GLU 53 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1yru n GLY 54 N -0.89 0.61 3.80 -1.84 0.00 -1.11 -4.99 105.19 100.77 1yru n GLY 54 Ca 0.48 -0.76 -0.34 0.00 0.00 0.00 0.00 46.02 45.41 1yru n GLY 54 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1yru s VAL 55 N -2.23 3.97 0.61 1.61 1.01 0.16 -4.51 120.40 121.01 1yru s VAL 55 Ca 0.00 1.24 -0.16 0.00 0.00 0.00 0.00 61.98 63.06 1yru s VAL 55 Cb 0.00 -3.50 -0.02 0.00 0.00 0.00 0.00 36.38 32.85 1yru s VAL 55 CO 0.00 -0.26 1.08 0.00 0.00 0.00 0.00 175.10 175.92 1yru s ALA 56 N -2.03 2.65 -0.15 5.51 0.00 -0.30 -4.59 121.76 122.85 1yru s ALA 56 Ca 0.65 0.45 -0.04 0.00 0.00 0.00 0.00 51.96 53.02 1yru s ALA 56 Cb -0.14 -3.26 -0.03 0.00 0.00 0.00 0.00 23.12 19.69 1yru s ALA 56 CO 0.18 -0.96 -0.03 0.99 0.00 0.00 0.00 175.76 175.95 1yru s THR 57 N -2.41 4.01 0.50 0.00 2.01 -1.26 0.17 115.64 118.66 1yru s THR 57 Ca 0.65 -0.32 -0.18 0.00 0.31 0.00 0.00 61.69 62.15 1yru s THR 57 Cb -0.18 -2.75 -0.08 0.00 0.01 0.00 0.00 72.50 69.50 1yru s THR 57 CO 0.38 0.50 1.00 -1.59 -0.69 0.00 0.00 174.62 174.22 1yru s LYS 58 N 0.25 3.90 0.39 4.92 -2.85 -0.81 -4.86 119.74 120.68 1yru s LYS 58 Ca -0.02 1.10 0.06 0.00 -1.00 0.00 0.00 55.97 56.11 1yru s LYS 58 Cb -0.14 -2.12 0.06 0.00 -2.06 0.00 0.00 37.83 33.57 1yru s LYS 58 CO 0.03 -0.32 0.48 0.41 0.10 0.00 0.00 175.35 176.05 1yru n GLY 59 N -1.04 2.18 0.00 0.59 0.00 -1.26 -4.48 105.19 101.18 1yru n GLY 59 Ca 0.07 -2.21 0.04 0.00 0.00 0.00 0.00 46.02 43.92 1yru n GLY 59 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1yru n LEU 60 N 0.00 0.00 0.01 0.99 4.77 -1.26 -2.66 117.00 118.85 1yru n LEU 60 Ca 0.08 0.48 -0.13 0.00 -0.03 0.00 0.00 56.01 56.41 1yru n LEU 60 Cb 0.41 -0.48 -0.09 0.00 -2.33 0.00 0.00 43.42 40.93 1yru n LEU 60 CO 0.26 -0.36 0.68 1.23 -1.33 0.00 0.00 177.39 177.87 1yru h GLY 61 N 1.27 -0.03 -6.06 -0.72 0.00 -1.94 -3.42 103.07 92.17 1yru h GLY 61 Ca 0.00 0.01 -0.56 0.00 0.00 0.00 0.00 47.33 46.78 1yru h GLY 61 CO 0.00 -0.01 1.17 0.14 0.00 0.00 0.00 176.54 177.84 1yru s VAL 62 N -4.68 3.57 -0.32 4.60 1.01 -1.09 -4.79 120.40 118.70 1yru s VAL 62 Ca -0.15 0.64 0.15 0.00 0.00 0.00 0.00 61.98 62.62 1yru s VAL 62 Cb 0.03 -3.58 0.44 0.00 0.00 0.00 0.00 36.38 33.27 1yru s VAL 62 CO 0.66 -0.24 1.35 1.41 0.00 0.00 0.00 175.10 178.28 1yru n HIS 63 N 8.65 0.73 -2.50 5.22 -0.00 -1.26 -4.91 115.22 121.15 1yru n HIS 63 Ca 0.20 -0.80 -0.38 0.00 -0.00 0.00 0.00 57.72 56.74 1yru n HIS 63 Cb 0.45 -0.23 -0.04 0.00 -0.00 0.00 0.00 29.99 30.17 1yru n HIS 63 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 1yru s ALA 64 N -2.40 3.17 0.12 -1.41 0.00 -1.26 -4.86 121.76 115.12 1yru s ALA 64 Ca 0.36 0.78 -0.30 0.00 0.00 0.00 0.00 51.96 52.80 1yru s ALA 64 Cb 0.28 -3.30 -0.06 0.00 0.00 0.00 0.00 23.12 20.04 1yru s ALA 64 CO 0.09 -0.24 1.03 0.15 0.00 0.00 0.00 175.76 176.80 1yru s LYS 65 N -2.21 4.63 0.90 0.00 -0.14 -1.26 -5.04 119.74 116.61 1yru s LYS 65 Ca 0.54 1.58 -0.15 0.00 -1.36 0.00 0.00 55.97 56.58 1yru s LYS 65 Cb -0.25 -3.34 0.21 0.00 -1.68 0.00 0.00 37.83 32.76 1yru s LYS 65 CO 0.32 0.11 1.23 -1.13 -0.76 0.00 0.00 175.35 175.11 1yru n SER 66 N 2.80 0.16 -4.37 2.83 3.41 -1.26 -4.31 113.62 112.88 1yru n SER 66 Ca 0.03 -1.48 -0.30 0.00 -0.26 0.00 0.00 58.87 56.86 1yru n SER 66 Cb 0.48 -0.93 -0.14 0.00 -0.26 0.00 0.00 64.21 63.36 1yru n SER 66 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 1yru s SER 67 N -5.50 3.26 -0.15 4.04 0.15 -0.49 -0.46 113.70 114.55 1yru s SER 67 Ca 0.70 -0.65 0.15 0.00 0.70 0.00 0.00 55.95 56.85 1yru s SER 67 Cb -0.02 -0.27 0.33 0.00 -1.71 0.00 0.00 66.02 64.35 1yru s SER 67 CO 0.49 0.23 1.17 -0.90 1.20 0.00 0.00 173.24 175.43 1yru n ASP 68 N 1.40 1.85 -3.58 5.45 3.85 -1.26 -0.23 116.55 124.03 1yru n ASP 68 Ca -0.17 -3.30 -0.12 0.00 -0.71 0.00 0.00 54.79 50.49 1yru n ASP 68 Cb 0.52 -0.45 -0.04 0.00 -1.35 0.00 0.00 41.12 39.80 1yru n ASP 68 CO 0.00 0.00 0.00 -1.66 -1.01 0.00 0.00 177.20 174.53 1yru s TRP 69 N -2.67 -0.34 0.15 2.11 1.48 -1.26 -4.91 118.94 113.49 1yru s TRP 69 Ca 0.33 0.16 0.00 0.00 -1.06 0.00 0.00 56.10 55.53 1yru s TRP 69 Cb 0.31 0.34 0.00 0.00 -1.16 0.00 0.00 33.47 32.96 1yru s TRP 69 CO -0.03 -0.71 0.00 0.41 -4.06 0.00 0.00 176.95 172.57 1yru n GLY 70 N -0.03 -2.07 0.15 3.67 0.00 -1.25 -2.75 105.19 102.91 1yru n GLY 70 Ca -0.17 -1.35 0.12 0.00 0.00 0.00 0.00 46.02 44.61 1yru n GLY 70 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1yru n LEU 71 N 0.00 0.64 -0.40 0.99 4.77 -1.26 -0.93 117.00 120.81 1yru n LEU 71 Ca 0.00 0.72 0.13 0.00 -0.03 0.00 0.00 56.01 56.84 1yru n LEU 71 Cb 0.29 -0.71 0.55 0.00 -2.33 0.00 0.00 43.42 41.22 1yru n LEU 71 CO 0.00 -0.77 0.88 0.00 -1.33 0.00 0.00 177.39 176.17 1yru n GLN 72 N -2.28 1.54 -1.64 3.23 0.00 -1.25 -4.92 117.38 112.06 1yru n GLN 72 Ca 0.00 -0.79 -0.51 0.00 0.00 0.00 0.00 57.00 55.71 1yru n GLN 72 Cb 0.13 -1.45 -0.05 0.00 0.00 0.00 0.00 30.24 28.87 1yru n GLN 72 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1yru n ALA 73 N -0.03 0.03 0.00 2.61 0.00 -0.11 -1.47 120.51 121.54 1yru n ALA 73 Ca 0.19 0.45 0.00 0.00 0.00 0.00 0.00 53.44 54.08 1yru n ALA 73 Cb 0.29 -2.22 0.00 0.00 0.00 0.00 0.00 19.45 17.52 1yru n ALA 73 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1yru n GLY 74 N 3.23 3.27 4.02 0.00 0.00 0.67 -4.92 105.19 111.46 1yru n GLY 74 Ca 0.20 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 46.02 1yru n GLY 74 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1yru s TYR 75 N -2.81 1.85 -0.39 1.61 1.51 -0.54 -4.25 117.35 114.32 1yru s TYR 75 Ca 0.00 -0.55 0.00 0.00 -1.01 0.00 0.00 57.07 55.52 1yru s TYR 75 Cb 0.00 -2.39 0.11 0.00 -0.11 0.00 0.00 41.96 39.57 1yru s TYR 75 CO 0.00 -1.04 0.15 0.42 -1.11 0.00 0.00 175.55 173.97 1yru s ILE 76 N -2.66 2.86 0.19 2.71 1.01 -1.25 -1.39 121.20 122.67 1yru s ILE 76 Ca 0.61 -2.26 -0.31 0.00 0.00 0.00 0.00 60.65 58.68 1yru s ILE 76 Cb -0.07 -3.01 -0.11 0.00 0.01 0.00 0.00 42.46 39.28 1yru s ILE 76 CO 0.38 -0.67 1.61 -2.16 0.00 0.00 0.00 174.94 174.11 1yru s PRO 77 N 0.94 4.18 0.24 2.79 0.04 -1.26 -2.21 135.00 139.72 1yru s PRO 77 Ca 0.10 2.45 -0.00 0.00 0.04 0.00 0.00 61.00 63.59 1yru s PRO 77 Cb -0.21 -3.12 0.27 0.00 0.04 0.00 0.00 34.50 31.48 1yru s PRO 77 CO -0.06 -0.64 1.62 0.28 0.04 0.00 0.00 177.00 178.24 1yru h VAL 78 N 3.88 1.30 -2.13 -0.36 2.07 -0.86 -3.37 116.25 116.77 1yru h VAL 78 Ca -0.43 -1.52 -0.55 0.00 0.82 0.00 0.00 66.70 65.02 1yru h VAL 78 Cb 1.20 1.53 -0.08 0.00 -1.52 0.00 0.00 31.29 32.42 1yru h VAL 78 CO 0.91 0.48 1.14 0.21 0.02 0.00 0.00 177.57 180.33 1yru s ASN 79 N -6.84 6.20 0.20 0.57 3.84 -1.26 -4.88 114.94 112.77 1yru s ASN 79 Ca -0.07 -0.61 0.08 0.00 0.21 0.00 0.00 52.86 52.47 1yru s ASN 79 Cb 0.13 -2.56 0.45 0.00 -0.55 0.00 0.00 41.25 38.72 1yru s ASN 79 CO 0.81 -1.79 1.11 -2.65 -2.79 0.00 0.00 177.10 171.79 1yru n PRO 80 N 9.29 0.06 0.16 0.43 -0.02 -1.26 -0.76 135.00 142.90 1yru n PRO 80 Ca 0.09 0.47 0.08 0.00 -2.02 0.00 0.00 63.50 62.12 1yru n PRO 80 Cb 0.49 -1.95 0.08 0.00 -0.02 0.00 0.00 33.50 32.10 1yru n PRO 80 CO 0.00 0.00 0.00 -0.91 1.98 0.00 0.00 175.50 176.57 1yru h ASN 81 N 0.00 0.00 0.00 2.55 2.35 -1.89 -3.10 115.58 115.49 1yru h ASN 81 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 1yru h ASN 81 Cb 0.53 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.90 1yru h ASN 81 CO 0.00 0.18 -0.00 0.18 -1.65 0.00 0.00 177.43 176.14 1yru n LEU 82 N -3.04 0.40 -4.97 1.61 4.77 0.06 -4.30 117.00 111.53 1yru n LEU 82 Ca 0.02 -0.13 -0.22 0.00 -0.03 0.00 0.00 56.01 55.65 1yru n LEU 82 Cb 0.61 -0.00 0.04 0.00 -2.33 0.00 0.00 43.42 41.74 1yru n LEU 82 CO 0.38 0.07 0.40 -0.94 -1.33 0.00 0.00 177.39 175.97 1yru s SER 83 N -2.01 5.20 0.46 -1.43 1.04 -1.17 -4.78 113.70 111.02 1yru s SER 83 Ca 0.45 0.06 0.22 0.00 0.48 0.00 0.00 55.95 57.17 1yru s SER 83 Cb 0.22 -0.91 1.22 0.00 0.10 0.00 0.00 66.02 66.65 1yru s SER 83 CO 0.36 -1.22 1.64 0.07 0.98 0.00 0.00 173.24 175.08 1yru h LYS 84 N -0.04 0.00 -1.04 4.02 2.10 -1.05 -0.91 116.57 119.66 1yru h LYS 84 Ca -0.42 0.00 -0.14 0.00 -2.00 0.00 0.00 60.65 58.09 1yru h LYS 84 Cb 1.30 0.00 -0.08 0.00 -0.90 0.00 0.00 32.23 32.55 1yru h LYS 84 CO 0.53 0.00 0.18 1.28 -2.00 0.00 0.00 179.45 179.44 1yru n LEU 85 N -2.44 4.09 0.00 7.07 4.77 -1.26 -4.70 117.00 124.53 1yru n LEU 85 Ca -0.01 -2.10 0.00 0.00 -0.03 0.00 0.00 56.01 53.87 1yru n LEU 85 Cb 0.27 -0.61 0.00 0.00 -2.33 0.00 0.00 43.42 40.75 1yru n LEU 85 CO 0.10 0.67 0.50 0.33 -1.33 0.00 0.00 177.39 177.66 1yru n PHE 86 N 0.10 0.00 0.04 -1.77 7.35 -0.35 -2.85 117.46 120.00 1yru n PHE 86 Ca 0.16 0.00 0.06 0.00 -0.76 0.00 0.00 57.45 56.91 1yru n PHE 86 Cb 0.80 -0.50 0.24 0.00 0.35 0.00 0.00 39.48 40.37 1yru n PHE 86 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1yru n GLY 87 N -1.00 1.98 3.65 7.13 0.00 -1.26 -4.88 105.19 110.82 1yru n GLY 87 Ca 0.00 -0.57 -0.29 0.00 0.00 0.00 0.00 46.02 45.16 1yru n GLY 87 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1yru s ARG 88 N -1.83 -0.28 0.34 1.61 1.81 -1.13 -5.06 118.95 114.40 1yru s ARG 88 Ca 0.34 0.21 0.04 0.00 -1.72 0.00 0.00 55.73 54.60 1yru s ARG 88 Cb 0.23 -1.68 -0.04 0.00 -0.45 0.00 0.00 34.95 33.01 1yru s ARG 88 CO 0.15 -3.14 0.15 0.00 -0.68 0.00 0.00 175.30 171.78 1yru s ALA 89 N -3.03 2.29 0.11 2.13 0.00 -1.26 -4.73 121.76 117.26 1yru s ALA 89 Ca 0.68 -1.64 -0.04 0.00 0.00 0.00 0.00 51.96 50.95 1yru s ALA 89 Cb -0.14 1.00 0.16 0.00 0.00 0.00 0.00 23.12 24.14 1yru s ALA 89 CO 0.57 -0.45 0.63 -2.30 0.00 0.00 0.00 175.76 174.21 1yru n PRO 90 N -0.70 -0.05 0.31 0.00 -0.02 -1.26 0.23 135.00 133.51 1yru n PRO 90 Ca -0.01 0.63 -0.16 0.00 -2.02 0.00 0.00 63.50 61.94 1yru n PRO 90 Cb 0.65 -0.93 -0.08 0.00 -0.02 0.00 0.00 33.50 33.11 1yru n PRO 90 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 1yru h GLU 91 N 0.00 -0.74 0.00 -0.52 4.22 -1.97 0.16 114.58 115.73 1yru h GLU 91 Ca 0.18 0.05 0.00 0.00 0.08 0.00 0.00 59.36 59.67 1yru h GLU 91 Cb 0.28 0.17 0.00 0.00 0.50 0.00 0.00 28.75 29.70 1yru h GLU 91 CO -0.41 -0.44 0.00 0.28 -2.18 0.00 0.00 179.01 176.26 1yru n VAL 92 N -5.36 0.00 -0.26 0.32 0.31 0.63 0.21 118.33 114.18 1yru n VAL 92 Ca -0.12 1.30 0.26 0.00 -0.01 0.00 0.00 64.34 65.76 1yru n VAL 92 Cb 0.34 -2.15 0.47 0.00 -0.91 0.00 0.00 33.84 31.59 1yru n VAL 92 CO 0.00 0.00 0.00 -0.38 -1.32 0.00 0.00 176.83 175.13 1yru n ILE 93 N -1.62 -0.34 0.05 2.52 -0.00 -0.89 -0.07 119.36 119.01 1yru n ILE 93 Ca 0.00 1.65 -0.12 0.00 -0.00 0.00 0.00 62.75 64.28 1yru n ILE 93 Cb 0.00 -2.67 -0.08 0.00 -0.00 0.00 0.00 39.64 36.89 1yru n ILE 93 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.55 176.55 1yru h ALA 94 N 1.62 -0.20 -0.74 -1.39 0.00 0.87 -2.68 119.26 116.72 1yru h ALA 94 Ca 0.68 -0.23 0.20 0.00 0.00 0.00 0.00 54.91 55.56 1yru h ALA 94 Cb 1.80 0.08 -0.04 0.00 0.00 0.00 0.00 17.79 19.63 1yru h ALA 94 CO -0.63 -0.32 0.52 0.00 0.00 0.00 0.00 179.25 178.82 1yru h ARG 95 N -0.79 0.10 -0.89 0.00 2.47 0.62 0.21 114.38 116.10 1yru h ARG 95 Ca -0.02 -0.01 0.14 0.00 -1.26 0.00 0.00 59.98 58.83 1yru h ARG 95 Cb 0.53 -0.02 -0.07 0.00 -1.65 0.00 0.00 29.97 28.76 1yru h ARG 95 CO 0.03 0.07 0.57 0.00 0.56 0.00 0.00 179.97 181.21 1yru h ALA 96 N 1.64 1.80 0.54 0.04 0.00 -0.24 -3.09 119.26 119.95 1yru h ALA 96 Ca 0.36 0.01 -0.03 0.00 0.00 0.00 0.00 54.91 55.26 1yru h ALA 96 Cb 1.27 -0.13 0.01 0.00 0.00 0.00 0.00 17.79 18.93 1yru h ALA 96 CO -0.04 -0.04 -0.26 -0.44 0.00 0.00 0.00 179.25 178.47 1yru h ASP 97 N 0.72 -0.62 -0.05 0.00 3.32 -0.34 -2.44 116.42 117.02 1yru h ASP 97 Ca 0.44 0.01 0.01 0.00 0.02 0.00 0.00 57.03 57.51 1yru h ASP 97 Cb 0.68 0.16 -0.01 0.00 0.22 0.00 0.00 39.33 40.38 1yru h ASP 97 CO -0.20 -0.42 -0.09 0.78 -1.72 0.00 0.00 179.24 177.59 1yru h ASN 98 N -0.76 -0.28 -0.10 6.45 2.35 -1.63 0.24 115.58 121.85 1yru h ASN 98 Ca -0.07 0.04 0.01 0.00 -0.55 0.00 0.00 56.30 55.72 1yru h ASN 98 Cb 0.58 0.11 -0.01 0.00 0.05 0.00 0.00 38.32 39.05 1yru h ASN 98 CO 0.12 -0.07 -0.06 0.47 -1.65 0.00 0.00 177.43 176.25 1yru n ASP 99 N -3.07 -0.10 0.11 5.81 10.43 -1.19 0.40 116.55 128.93 1yru n ASP 99 Ca -0.01 0.38 -0.15 0.00 2.57 0.00 0.00 54.79 57.59 1yru n ASP 99 Cb 0.05 -0.13 -0.08 0.00 1.84 0.00 0.00 41.12 42.80 1yru n ASP 99 CO 0.00 0.00 0.00 0.58 -1.07 0.00 0.00 177.20 176.71 1yru h VAL 100 N 0.00 0.08 -0.90 2.53 2.07 -0.89 -1.59 116.25 117.55 1yru h VAL 100 Ca 0.02 0.00 0.13 0.00 0.82 0.00 0.00 66.70 67.67 1yru h VAL 100 Cb 0.04 0.08 -0.07 0.00 -1.52 0.00 0.00 31.29 29.82 1yru h VAL 100 CO -0.09 0.00 0.58 0.78 0.02 0.00 0.00 177.57 178.86 1yru h ASN 101 N -0.69 0.72 -0.53 0.57 2.35 0.45 -2.07 115.58 116.37 1yru h ASN 101 Ca 0.01 0.04 0.10 0.00 -0.55 0.00 0.00 56.30 55.90 1yru h ASN 101 Cb 0.72 -0.10 -0.08 0.00 0.05 0.00 0.00 38.32 38.91 1yru h ASN 101 CO -0.28 0.38 0.09 -1.28 -1.65 0.00 0.00 177.43 174.69 1yru h SER 102 N 0.77 -0.03 -0.42 5.81 0.87 0.86 -3.04 113.55 118.36 1yru h SER 102 Ca 0.45 0.10 -0.11 0.00 -1.23 0.00 0.00 61.79 61.00 1yru h SER 102 Cb 0.63 0.15 -0.01 0.00 -0.44 0.00 0.00 62.40 62.72 1yru h SER 102 CO -0.21 0.01 -0.15 0.28 -0.53 0.00 0.00 176.83 176.22 1yru h SER 103 N 0.22 0.86 0.45 6.23 0.02 -0.79 -3.14 113.55 117.39 1yru h SER 103 Ca 0.27 -0.39 0.00 0.00 -0.84 0.00 0.00 61.79 60.83 1yru h SER 103 Cb 0.38 -0.24 0.00 0.00 0.14 0.00 0.00 62.40 62.69 1yru h SER 103 CO -0.36 1.05 0.00 0.18 -1.14 0.00 0.00 176.83 176.55 1yru n LEU 104 N -4.26 0.44 -0.08 5.07 4.32 -1.15 -2.00 117.00 119.33 1yru n LEU 104 Ca -0.01 0.63 -0.11 0.00 -0.02 0.00 0.00 56.01 56.51 1yru n LEU 104 Cb 0.40 -0.61 0.03 0.00 -1.62 0.00 0.00 43.42 41.63 1yru n LEU 104 CO 0.44 -0.57 0.58 0.00 -1.22 0.00 0.00 177.39 176.62 1yru h ALA 105 N 2.23 0.70 -2.92 -1.18 0.00 -1.50 -3.39 119.26 113.20 1yru h ALA 105 Ca 0.00 -0.44 -0.75 0.00 0.00 0.00 0.00 54.91 53.73 1yru h ALA 105 Cb 0.23 -0.12 -0.31 0.00 0.00 0.00 0.00 17.79 17.58 1yru h ALA 105 CO 0.00 0.66 -0.05 -1.01 0.00 0.00 0.00 179.25 178.86 1yru s HIS 106 N -4.38 3.72 0.00 0.00 3.76 -0.85 -4.84 115.29 112.70 1yru s HIS 106 Ca -0.10 -2.49 0.00 0.00 -0.15 0.00 0.00 55.06 52.32 1yru s HIS 106 Cb 0.12 -3.52 0.00 0.00 1.11 0.00 0.00 32.58 30.29 1yru s HIS 106 CO 0.86 -0.89 0.00 0.41 -0.85 0.00 0.00 174.74 174.27 1yru n GLY 107 N 3.38 0.04 3.77 -2.22 0.00 -1.26 -4.93 105.19 103.96 1yru n GLY 107 Ca 0.14 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.77 1yru n GLY 107 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1yru s HIS 108 N -0.96 3.78 0.31 1.61 4.02 -1.22 -3.08 115.29 119.75 1yru s HIS 108 Ca 0.00 1.41 0.07 0.00 1.02 0.00 0.00 55.06 57.57 1yru s HIS 108 Cb 0.00 -2.70 -0.03 0.00 -1.02 0.00 0.00 32.58 28.83 1yru s HIS 108 CO 0.00 0.41 0.23 0.95 1.02 0.00 0.00 174.74 177.36 1yru s THR 109 N -0.57 3.76 -0.19 1.30 -4.23 -1.18 -4.22 115.64 110.31 1yru s THR 109 Ca 0.34 -1.44 -0.03 0.00 -1.18 0.00 0.00 61.69 59.38 1yru s THR 109 Cb -0.20 -3.22 -0.01 0.00 1.34 0.00 0.00 72.50 70.40 1yru s THR 109 CO 0.22 -0.24 -0.05 0.00 -0.54 0.00 0.00 174.62 174.01 1yru s ALA 110 N -2.26 2.84 0.18 3.99 0.00 -1.26 -0.71 121.76 124.54 1yru s ALA 110 Ca 0.38 -1.04 0.09 0.00 0.00 0.00 0.00 51.96 51.38 1yru s ALA 110 Cb -0.06 -1.61 -0.04 0.00 0.00 0.00 0.00 23.12 21.41 1yru s ALA 110 CO 0.25 -0.18 -0.18 0.08 0.00 0.00 0.00 175.76 175.73 1yru s VAL 111 N 1.06 1.89 0.07 0.00 1.01 0.43 -4.87 120.40 119.99 1yru s VAL 111 Ca 0.01 -2.00 -0.31 0.00 0.00 0.00 0.00 61.98 59.68 1yru s VAL 111 Cb -0.15 -1.92 -0.08 0.00 0.00 0.00 0.00 36.38 34.23 1yru s VAL 111 CO -0.00 -0.34 1.55 -1.81 0.00 0.00 0.00 175.10 174.50 1yru s ASP 112 N -2.81 6.68 -0.18 3.32 1.11 -1.26 -0.81 116.67 122.72 1yru s ASP 112 Ca 0.18 2.40 -0.29 0.00 0.18 0.00 0.00 52.55 55.01 1yru s ASP 112 Cb -0.05 -2.57 -0.02 0.00 1.07 0.00 0.00 42.92 41.35 1yru s ASP 112 CO 0.07 -0.81 1.42 -0.22 1.18 0.00 0.00 175.17 176.81 1yru s LEU 113 N 2.23 4.09 -0.02 1.23 2.96 -0.89 -4.92 118.68 123.36 1yru s LEU 113 Ca 0.70 1.68 0.02 0.00 -0.22 0.00 0.00 54.13 56.32 1yru s LEU 113 Cb -0.38 -3.54 0.00 0.00 0.50 0.00 0.00 46.19 42.78 1yru s LEU 113 CO 0.30 -0.96 -0.08 0.42 -1.32 0.00 0.00 176.35 174.71 1yru s THR 114 N 4.15 0.73 0.12 3.68 -4.23 -1.26 -2.27 115.64 116.56 1yru s THR 114 Ca 0.62 -0.34 0.00 0.00 -1.18 0.00 0.00 61.69 60.80 1yru s THR 114 Cb -0.24 -0.65 -0.04 0.00 1.34 0.00 0.00 72.50 72.92 1yru s THR 114 CO 0.22 0.23 0.28 -0.76 -0.54 0.00 0.00 174.62 174.05 1yru s LEU 115 N 0.17 4.32 0.63 4.79 1.43 -0.95 -4.84 118.68 124.23 1yru s LEU 115 Ca -0.02 0.28 -0.11 0.00 -1.03 0.00 0.00 54.13 53.25 1yru s LEU 115 Cb -0.08 -3.00 -0.03 0.00 0.03 0.00 0.00 46.19 43.10 1yru s LEU 115 CO 0.00 0.08 1.03 -0.94 0.23 0.00 0.00 176.35 176.76 1yru s SER 116 N -2.89 6.14 0.52 2.29 1.04 -1.26 -2.01 113.70 117.54 1yru s SER 116 Ca 0.36 1.42 0.19 0.00 0.48 0.00 0.00 55.95 58.39 1yru s SER 116 Cb -0.12 -2.44 1.35 0.00 0.10 0.00 0.00 66.02 64.91 1yru s SER 116 CO 0.28 -0.93 2.15 0.11 0.98 0.00 0.00 173.24 175.83 1yru h LYS 117 N -0.36 0.00 -0.15 4.02 1.57 -1.95 -1.90 116.57 117.80 1yru h LYS 117 Ca -0.44 0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.31 1yru h LYS 117 Cb 1.19 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.50 1yru h LYS 117 CO 0.62 0.03 -0.04 0.93 -0.57 0.00 0.00 179.45 180.42 1yru h GLU 118 N 0.00 0.29 0.00 3.15 3.07 -1.95 0.13 114.58 119.27 1yru h GLU 118 Ca -0.00 -0.11 -0.05 0.00 -0.50 0.00 0.00 59.36 58.70 1yru h GLU 118 Cb 0.06 -0.02 -0.01 0.00 -0.84 0.00 0.00 28.75 27.95 1yru h GLU 118 CO 0.00 0.57 -0.23 -0.09 -1.40 0.00 0.00 179.01 177.86 1yru h ARG 119 N -0.00 0.00 0.07 2.33 2.43 -1.86 -0.09 114.38 117.25 1yru h ARG 119 Ca 0.04 0.00 -0.00 0.00 -0.81 0.00 0.00 59.98 59.21 1yru h ARG 119 Cb 0.46 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.01 1yru h ARG 119 CO 0.01 0.23 -0.03 1.25 -1.51 0.00 0.00 179.97 179.93 1yru h LEU 120 N 0.00 -0.08 -0.23 3.80 5.85 -0.75 0.24 115.31 124.13 1yru h LEU 120 Ca -0.00 -0.18 0.06 0.00 0.84 0.00 0.00 57.88 58.60 1yru h LEU 120 Cb 0.58 0.02 -0.07 0.00 0.37 0.00 0.00 40.66 41.56 1yru h LEU 120 CO 0.03 0.14 -0.32 0.44 -0.34 0.00 0.00 178.44 178.39 1yru h ASP 121 N -0.29 -1.01 -0.76 1.25 3.32 0.05 -1.62 116.42 117.36 1yru h ASP 121 Ca -0.01 0.16 0.12 0.00 0.02 0.00 0.00 57.03 57.32 1yru h ASP 121 Cb 0.25 0.45 -0.08 0.00 0.22 0.00 0.00 39.33 40.17 1yru h ASP 121 CO 0.02 -0.34 0.36 0.22 -1.72 0.00 0.00 179.24 177.78 1yru h TYR 122 N -0.33 0.63 -0.81 4.55 3.20 -0.74 -0.64 116.97 122.83 1yru h TYR 122 Ca 0.12 0.03 0.02 0.00 3.14 0.00 0.00 58.73 62.05 1yru h TYR 122 Cb 0.53 -0.17 -0.04 0.00 1.54 0.00 0.00 36.73 38.59 1yru h TYR 122 CO -0.45 0.17 0.53 -0.07 -1.64 0.00 0.00 178.16 176.70 1yru h LEU 123 N 0.56 0.90 0.00 2.82 3.38 0.46 0.02 115.31 123.45 1yru h LEU 123 Ca 0.39 -0.01 -0.07 0.00 0.09 0.00 0.00 57.88 58.28 1yru h LEU 123 Cb 0.50 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 41.03 1yru h LEU 123 CO -0.33 0.64 -0.33 0.03 0.09 0.00 0.00 178.44 178.54 1yru h ARG 124 N 1.06 0.00 0.01 1.13 3.08 -1.23 -1.03 114.38 117.40 1yru h ARG 124 Ca 0.31 0.00 -0.21 0.00 0.07 0.00 0.00 59.98 60.15 1yru h ARG 124 Cb -0.06 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 29.98 1yru h ARG 124 CO -0.09 0.33 -0.92 0.37 -1.07 0.00 0.00 179.97 178.59 1yru h GLN 125 N 0.00 0.27 -0.01 0.04 5.75 -0.41 -3.10 115.11 117.65 1yru h GLN 125 Ca -0.00 -0.30 0.00 0.00 -0.15 0.00 0.00 58.65 58.19 1yru h GLN 125 Cb 1.25 0.09 0.00 0.00 1.07 0.00 0.00 27.48 29.89 1yru h GLN 125 CO 0.04 1.02 -0.03 0.00 -2.65 0.00 0.00 178.83 177.22 1yru n ALA 126 N -2.49 2.65 -0.90 3.38 0.00 -0.07 -4.93 120.51 118.15 1yru n ALA 126 Ca -0.05 -0.36 0.00 0.00 0.00 0.00 0.00 53.44 53.03 1yru n ALA 126 Cb 0.83 -1.27 0.00 0.00 0.00 0.00 0.00 19.45 19.01 1yru n ALA 126 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1yru n GLY 127 N 1.15 0.59 0.28 0.00 0.00 -1.03 -4.83 105.19 101.36 1yru n GLY 127 Ca 0.19 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.37 1yru n GLY 127 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1yru h LEU 128 N 0.00 0.00 -7.07 0.99 3.38 -1.50 -3.30 115.31 107.81 1yru h LEU 128 Ca 0.00 0.00 -0.60 0.00 0.09 0.00 0.00 57.88 57.37 1yru h LEU 128 Cb 0.09 0.00 -0.40 0.00 0.09 0.00 0.00 40.66 40.44 1yru h LEU 128 CO 0.00 0.06 -0.74 -0.69 0.09 0.00 0.00 178.44 177.16 1yru s VAL 129 N -4.27 1.25 -1.53 1.22 1.01 -0.94 -3.89 120.40 113.24 1yru s VAL 129 Ca -0.03 -2.14 0.01 0.00 0.00 0.00 0.00 61.98 59.81 1yru s VAL 129 Cb 0.13 -1.90 0.02 0.00 0.00 0.00 0.00 36.38 34.63 1yru s VAL 129 CO 0.55 -0.81 0.77 0.35 0.00 0.00 0.00 175.10 175.96 1yru n THR 130 N 4.02 0.91 0.00 3.92 -2.24 -1.10 -4.31 114.28 115.49 1yru n THR 130 Ca 0.05 0.23 0.00 0.00 -2.27 0.00 0.00 64.05 62.06 1yru n THR 130 Cb 0.37 -1.21 0.00 0.00 -2.10 0.00 0.00 70.33 67.39 1yru n THR 130 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1yru n GLY 131 N -1.16 0.76 3.43 3.38 0.00 -1.24 -4.90 105.19 105.45 1yru n GLY 131 Ca 0.00 -1.35 -0.16 0.00 0.00 0.00 0.00 46.02 44.52 1yru n GLY 131 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 1yru s MET 132 N -1.89 0.90 0.00 1.61 0.23 -1.26 0.29 119.30 119.18 1yru s MET 132 Ca 0.00 0.17 0.00 0.00 -1.03 0.00 0.00 55.69 54.83 1yru s MET 132 Cb 0.00 0.42 0.00 0.00 -1.53 0.00 0.00 34.83 33.72 1yru s MET 132 CO 0.00 -0.26 0.00 0.00 -2.03 0.00 0.00 175.02 172.73 1yru n ALA 133 N 1.19 0.00 0.00 3.16 0.00 -1.06 -4.58 120.51 119.23 1yru n ALA 133 Ca -0.19 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.25 1yru n ALA 133 Cb 0.57 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.02 1yru n ALA 133 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1yru n ASP 134 N -2.52 0.00 0.00 0.00 -0.08 -1.26 -3.60 116.55 109.09 1yru n ASP 134 Ca 0.00 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.28 1yru n ASP 134 Cb 0.00 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.46 1yru n ASP 134 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1yru n GLY 135 N -0.70 0.00 2.39 0.27 0.00 -1.26 -4.95 105.19 100.93 1yru n GLY 135 Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.73 1yru n GLY 135 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1yru n VAL 136 N -0.03 3.42 -1.44 1.61 0.31 -1.24 -0.97 118.33 119.99 1yru n VAL 136 Ca 0.00 -2.01 -0.40 0.00 -0.01 0.00 0.00 64.34 61.92 1yru n VAL 136 Cb 0.00 -2.35 0.02 0.00 -0.91 0.00 0.00 33.84 30.59 1yru n VAL 136 CO 0.00 0.00 0.00 1.33 -1.32 0.00 0.00 176.83 176.84 1yru n VAL 137 N 3.67 1.71 -4.41 2.52 0.24 -1.26 -2.56 118.33 118.24 1yru n VAL 137 Ca 0.61 -0.50 -0.29 0.00 -2.04 0.00 0.00 64.34 62.12 1yru n VAL 137 Cb 0.26 -0.53 -0.06 0.00 -1.47 0.00 0.00 33.84 32.05 1yru n VAL 137 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1yru s ALA 138 N -1.59 3.98 0.00 2.33 0.00 0.85 -4.66 121.76 122.67 1yru s ALA 138 Ca 0.64 -1.16 0.00 0.00 0.00 0.00 0.00 51.96 51.44 1yru s ALA 138 Cb -0.55 -0.22 0.00 0.00 0.00 0.00 0.00 23.12 22.35 1yru s ALA 138 CO 0.58 -0.16 0.00 0.45 0.00 0.00 0.00 175.76 176.63 1yru n SER 139 N -1.35 0.00 -1.29 0.00 2.88 -1.26 -2.70 113.62 109.90 1yru n SER 139 Ca -0.10 0.00 0.10 0.00 -1.33 0.00 0.00 58.87 57.55 1yru n SER 139 Cb 0.66 0.00 0.30 0.00 -0.75 0.00 0.00 64.21 64.42 1yru n SER 139 CO 0.00 0.00 0.00 -0.46 -1.23 0.00 0.00 175.04 173.35 1yru n ASN 140 N 0.00 3.96 -4.76 -3.46 0.23 -1.26 -4.82 115.26 105.16 1yru n ASN 140 Ca 0.00 -2.10 -0.37 0.00 -0.53 0.00 0.00 54.58 51.58 1yru n ASN 140 Cb 0.00 -0.47 0.02 0.00 -2.08 0.00 0.00 39.78 37.25 1yru n ASN 140 CO 0.00 0.00 0.00 -2.28 -0.93 0.00 0.00 177.26 174.05 1yru s HIS 141 N -1.19 2.49 0.56 -2.53 2.46 -1.26 -4.84 115.29 110.98 1yru s HIS 141 Ca 0.46 1.47 0.30 0.00 0.47 0.00 0.00 55.06 57.75 1yru s HIS 141 Cb 0.25 -3.58 1.46 0.00 -0.13 0.00 0.00 32.58 30.59 1yru s HIS 141 CO 0.29 -2.27 1.90 0.00 -2.47 0.00 0.00 174.74 172.18 1yru h ALA 142 N 1.45 2.51 -0.01 1.58 0.00 -2.04 -1.68 119.26 121.06 1yru h ALA 142 Ca -0.50 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.37 1yru h ALA 142 Cb 1.28 0.05 -0.00 0.00 0.00 0.00 0.00 17.79 19.12 1yru h ALA 142 CO 0.57 -0.89 -0.06 0.78 0.00 0.00 0.00 179.25 179.66 1yru h GLY 143 N 0.00 0.02 2.00 0.00 0.00 -1.97 -2.85 103.07 100.27 1yru h GLY 143 Ca 0.31 -0.01 0.00 0.00 0.00 0.00 0.00 47.33 47.63 1yru h GLY 143 CO -0.00 0.01 0.00 -1.72 0.00 0.00 0.00 176.54 174.82 1yru n TYR 144 N -4.46 0.59 0.44 5.60 4.02 -0.63 -0.19 117.16 122.53 1yru n TYR 144 Ca -0.03 0.22 0.12 0.00 -0.01 0.00 0.00 57.90 58.20 1yru n TYR 144 Cb 0.15 -0.85 0.25 0.00 -0.02 0.00 0.00 39.34 38.86 1yru n TYR 144 CO 0.00 0.00 0.00 0.93 -1.01 0.00 0.00 176.86 176.78 1yru h GLU 145 N 0.00 0.00 0.00 -0.72 4.39 -1.69 -3.32 114.58 113.24 1yru h GLU 145 Ca 0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 1yru h GLU 145 Cb 0.40 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.05 1yru h GLU 145 CO 0.00 0.00 -0.93 0.94 -1.16 0.00 0.00 179.01 177.86 1yru n GLN 146 N -2.53 2.13 -4.20 2.33 7.27 -0.77 -4.85 117.38 116.77 1yru n GLN 146 Ca 0.04 -0.04 -0.14 0.00 0.07 0.00 0.00 57.00 56.93 1yru n GLN 146 Cb 0.47 -1.07 -0.10 0.00 2.41 0.00 0.00 30.24 31.95 1yru n GLN 146 CO 0.00 0.00 0.00 -0.06 0.07 0.00 0.00 177.06 177.07 1yru s PHE 147 N -2.25 1.11 0.05 3.69 0.40 0.73 -3.03 117.98 118.68 1yru s PHE 147 Ca -0.00 -0.71 0.09 0.00 -0.60 0.00 0.00 56.93 55.70 1yru s PHE 147 Cb 0.06 -0.59 -0.03 0.00 0.51 0.00 0.00 43.02 42.97 1yru s PHE 147 CO 0.38 0.01 -0.24 -1.21 0.70 0.00 0.00 175.22 174.85 1yru s GLU 148 N -3.19 1.62 0.12 0.44 2.02 0.30 -4.41 118.70 115.61 1yru s GLU 148 Ca 0.10 -1.05 0.02 0.00 0.02 0.00 0.00 54.97 54.05 1yru s GLU 148 Cb -0.00 -1.79 -0.04 0.00 0.10 0.00 0.00 34.13 32.40 1yru s GLU 148 CO -0.00 0.46 -0.05 -0.06 0.02 0.00 0.00 175.26 175.63 1yru s PHE 149 N -0.81 1.00 -0.09 1.61 0.40 -1.26 -1.38 117.98 117.44 1yru s PHE 149 Ca 0.10 -0.94 -0.32 0.00 -0.60 0.00 0.00 56.93 55.17 1yru s PHE 149 Cb -0.10 -0.57 0.12 0.00 0.51 0.00 0.00 43.02 42.99 1yru s PHE 149 CO 0.02 -0.16 1.05 -0.98 0.70 0.00 0.00 175.22 175.85 1yru s ARG 150 N -3.85 0.57 0.24 0.44 1.70 -1.04 -3.98 118.95 113.03 1yru s ARG 150 Ca 0.16 -0.22 0.10 0.00 -0.47 0.00 0.00 55.73 55.30 1yru s ARG 150 Cb 0.05 0.26 -0.05 0.00 -0.57 0.00 0.00 34.95 34.64 1yru s ARG 150 CO -0.02 -0.25 -0.18 0.54 -1.08 0.00 0.00 175.30 174.31 1yru s VAL 151 N -2.77 2.19 -0.03 4.99 0.11 -0.14 -1.31 120.40 123.43 1yru s VAL 151 Ca 0.07 -2.30 -0.01 0.00 -2.93 0.00 0.00 61.98 56.82 1yru s VAL 151 Cb -0.01 -2.18 0.03 0.00 -1.53 0.00 0.00 36.38 32.69 1yru s VAL 151 CO -0.07 -0.45 0.04 -0.54 -3.33 0.00 0.00 175.10 170.75 1yru s LYS 152 N -3.47 0.06 0.95 1.54 1.02 0.58 -4.77 119.74 115.66 1yru s LYS 152 Ca 0.26 0.24 -0.12 0.00 0.02 0.00 0.00 55.97 56.37 1yru s LYS 152 Cb -0.04 -0.46 0.16 0.00 -0.52 0.00 0.00 37.83 36.98 1yru s LYS 152 CO 0.11 -0.24 1.10 -2.00 -0.92 0.00 0.00 175.35 173.40 1yru s GLU 153 N 1.60 0.79 0.36 1.68 2.12 -1.26 0.05 118.70 124.04 1yru s GLU 153 Ca -0.02 0.56 0.07 0.00 0.36 0.00 0.00 54.97 55.93 1yru s GLU 153 Cb -0.13 -1.78 -0.03 0.00 0.26 0.00 0.00 34.13 32.46 1yru s GLU 153 CO -0.03 -2.50 0.25 0.95 -0.54 0.00 0.00 175.26 173.39 1yru s THR 154 N -3.01 0.14 -2.21 -1.70 -4.23 -1.05 -4.74 115.64 98.84 1yru s THR 154 Ca 0.64 -2.00 0.27 0.00 -1.18 0.00 0.00 61.69 59.43 1yru s THR 154 Cb -0.18 -2.44 0.67 0.00 1.34 0.00 0.00 72.50 71.89 1yru s THR 154 CO 0.57 0.00 1.89 -1.54 -0.54 0.00 0.00 174.62 175.00 1yru n SER 155 N -1.57 0.76 0.01 3.99 3.41 -1.26 -3.41 113.62 115.55 1yru n SER 155 Ca 0.04 -1.33 -0.03 0.00 -0.26 0.00 0.00 58.87 57.28 1yru n SER 155 Cb 0.63 -0.01 -0.11 0.00 -0.26 0.00 0.00 64.21 64.46 1yru n SER 155 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 1yru n ASP 156 N -0.37 0.81 0.00 4.04 2.03 -1.26 -4.97 116.55 116.83 1yru n ASP 156 Ca 0.20 0.37 0.00 0.00 0.52 0.00 0.00 54.79 55.87 1yru n ASP 156 Cb 0.22 0.16 0.00 0.00 -0.72 0.00 0.00 41.12 40.78 1yru n ASP 156 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1yru n GLY 157 N 1.46 2.22 3.86 0.27 0.00 -1.22 -5.11 105.19 106.67 1yru n GLY 157 Ca -0.13 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.59 1yru n GLY 157 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1yru s ARG 158 N -0.12 0.49 -0.09 1.61 0.52 -1.26 -4.24 118.95 115.87 1yru s ARG 158 Ca 0.00 -0.26 -0.00 0.00 -0.52 0.00 0.00 55.73 54.95 1yru s ARG 158 Cb 0.00 -1.81 0.02 0.00 0.52 0.00 0.00 34.95 33.68 1yru s ARG 158 CO 0.00 -2.54 -0.05 0.71 0.02 0.00 0.00 175.30 173.44 1yru s TYR 159 N -3.67 1.13 0.16 -0.53 1.51 -0.85 -2.51 117.35 112.58 1yru s TYR 159 Ca 0.72 -0.47 -0.30 0.00 -1.01 0.00 0.00 57.07 56.01 1yru s TYR 159 Cb -0.06 -1.01 -0.07 0.00 -0.11 0.00 0.00 41.96 40.71 1yru s TYR 159 CO 0.53 -0.39 1.00 0.00 -1.11 0.00 0.00 175.55 175.58 1yru s ALA 160 N 1.60 3.31 -0.32 3.71 0.00 0.11 -2.24 121.76 127.92 1yru s ALA 160 Ca 0.01 0.67 -0.12 0.00 0.00 0.00 0.00 51.96 52.52 1yru s ALA 160 Cb -0.13 -3.29 -0.03 0.00 0.00 0.00 0.00 23.12 19.67 1yru s ALA 160 CO -0.05 -0.04 0.22 0.08 0.00 0.00 0.00 175.76 175.97 1yru s VAL 161 N -0.35 5.26 0.26 0.00 1.01 -0.96 -0.31 120.40 125.33 1yru s VAL 161 Ca 0.46 -0.10 0.10 0.00 0.00 0.00 0.00 61.98 62.45 1yru s VAL 161 Cb -0.26 -3.64 -0.05 0.00 0.00 0.00 0.00 36.38 32.43 1yru s VAL 161 CO 0.32 0.08 -0.09 -1.10 0.00 0.00 0.00 175.10 174.31 1yru s GLN 162 N 1.73 2.03 0.12 2.72 -0.21 -0.43 0.12 119.66 125.75 1yru s GLN 162 Ca 0.06 -1.54 -0.13 0.00 0.02 0.00 0.00 55.36 53.77 1yru s GLN 162 Cb -0.17 -2.01 0.02 0.00 1.00 0.00 0.00 33.01 31.85 1yru s GLN 162 CO 0.10 0.36 0.32 1.52 -2.12 0.00 0.00 175.29 175.48 1yru s TYR 163 N -2.33 -0.01 0.18 0.91 -0.85 0.85 -2.50 117.35 113.60 1yru s TYR 163 Ca 0.30 -0.36 -0.15 0.00 -0.52 0.00 0.00 57.07 56.34 1yru s TYR 163 Cb -0.06 0.12 0.02 0.00 0.38 0.00 0.00 41.96 42.42 1yru s TYR 163 CO 0.18 -0.67 0.46 0.50 -1.52 0.00 0.00 175.55 174.50 1yru s ARG 164 N -3.85 1.30 -0.13 -3.49 3.52 -0.48 -1.70 118.95 114.13 1yru s ARG 164 Ca 0.06 -0.92 -0.16 0.00 -0.13 0.00 0.00 55.73 54.58 1yru s ARG 164 Cb 0.03 0.48 -0.05 0.00 -1.56 0.00 0.00 34.95 33.86 1yru s ARG 164 CO -0.10 -0.53 0.39 0.50 -0.81 0.00 0.00 175.30 174.75 1yru s ARG 165 N -3.89 4.26 -0.47 5.12 3.52 -1.26 0.11 118.95 126.35 1yru s ARG 165 Ca 0.10 0.28 -0.45 0.00 -0.13 0.00 0.00 55.73 55.53 1yru s ARG 165 Cb 0.00 -3.41 -0.19 0.00 -1.56 0.00 0.00 34.95 29.79 1yru s ARG 165 CO -0.03 0.24 1.78 1.17 -0.81 0.00 0.00 175.30 177.65 1yru n LYS 166 N 3.46 0.18 0.00 5.12 0.00 -1.17 0.85 118.16 126.61 1yru n LYS 166 Ca -0.10 0.06 0.00 0.00 0.00 0.00 0.00 58.31 58.27 1yru n LYS 166 Cb 0.52 -1.61 0.00 0.00 0.00 0.00 0.00 35.03 33.94 1yru n LYS 166 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1yru n GLY 167 N 5.01 1.47 0.00 3.14 0.00 -1.26 -5.00 105.19 108.54 1yru n GLY 167 Ca 0.37 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.39 1yru n GLY 167 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1yru n GLY 168 N -0.84 -1.76 1.18 -0.02 0.00 0.25 -5.03 105.19 98.96 1yru n GLY 168 Ca 0.00 -0.58 0.00 0.00 0.00 0.00 0.00 46.02 45.44 1yru n GLY 168 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1yru n ASP 169 N 0.00 0.00 -4.91 1.61 4.64 -1.26 -4.92 116.55 111.71 1yru n ASP 169 Ca 0.00 0.00 -0.31 0.00 -1.38 0.00 0.00 54.79 53.10 1yru n ASP 169 Cb 0.00 0.00 -0.04 0.00 -1.04 0.00 0.00 41.12 40.04 1yru n ASP 169 CO 0.00 0.00 0.00 -0.62 -0.82 0.00 0.00 177.20 175.76 1yru s ASP 170 N -4.30 6.40 0.17 1.67 -1.08 -1.26 -4.96 116.67 113.32 1yru s ASP 170 Ca 0.00 0.38 -0.30 0.00 -0.52 0.00 0.00 52.55 52.11 1yru s ASP 170 Cb 0.00 -2.00 -0.07 0.00 -1.46 0.00 0.00 42.92 39.38 1yru s ASP 170 CO 0.00 0.11 1.06 -0.36 0.52 0.00 0.00 175.17 176.51 1yru s PHE 171 N -1.59 3.66 0.06 -5.34 0.08 -1.26 -4.71 117.98 108.89 1yru s PHE 171 Ca 0.37 1.66 0.05 0.00 0.12 0.00 0.00 56.93 59.14 1yru s PHE 171 Cb -0.12 -3.21 -0.03 0.00 -0.57 0.00 0.00 43.02 39.08 1yru s PHE 171 CO 0.27 -0.38 -0.15 -1.83 -0.10 0.00 0.00 175.22 173.04 1yru s GLU 172 N -0.41 0.89 0.86 0.44 -1.05 -0.69 -4.86 118.70 113.88 1yru s GLU 172 Ca 0.48 -0.91 -0.13 0.00 -0.15 0.00 0.00 54.97 54.27 1yru s GLU 172 Cb -0.28 -0.92 0.06 0.00 -0.44 0.00 0.00 34.13 32.56 1yru s GLU 172 CO 0.34 0.21 0.85 0.00 0.95 0.00 0.00 175.26 177.61 1yru n ALA 173 N 1.47 -1.19 -2.23 -0.84 0.00 -1.26 -0.10 120.51 116.36 1yru n ALA 173 Ca -0.20 -0.45 -0.38 0.00 0.00 0.00 0.00 53.44 52.42 1yru n ALA 173 Cb 0.54 -2.04 -0.06 0.00 0.00 0.00 0.00 19.45 17.89 1yru n ALA 173 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1yru s VAL 174 N -2.28 4.70 -0.16 0.00 1.01 0.12 -4.65 120.40 119.14 1yru s VAL 174 Ca 0.66 1.20 -0.07 0.00 0.00 0.00 0.00 61.98 63.78 1yru s VAL 174 Cb -0.26 -3.89 -0.04 0.00 0.00 0.00 0.00 36.38 32.19 1yru s VAL 174 CO 0.58 0.44 0.07 -0.54 0.00 0.00 0.00 175.10 175.65 1yru s LYS 175 N -1.40 3.74 -0.02 2.72 1.02 -1.26 -2.09 119.74 122.44 1yru s LYS 175 Ca 0.33 -0.31 0.03 0.00 0.02 0.00 0.00 55.97 56.04 1yru s LYS 175 Cb -0.19 -3.15 -0.00 0.00 -0.52 0.00 0.00 37.83 33.97 1yru s LYS 175 CO 0.20 0.43 -0.11 0.54 -0.92 0.00 0.00 175.35 175.49 1yru s VAL 176 N -0.06 0.87 0.52 3.17 0.11 0.01 -0.10 120.40 124.93 1yru s VAL 176 Ca 0.07 -0.44 -0.22 0.00 -2.93 0.00 0.00 61.98 58.46 1yru s VAL 176 Cb -0.12 -0.75 -0.05 0.00 -1.53 0.00 0.00 36.38 33.93 1yru s VAL 176 CO 0.01 0.26 1.29 -0.63 -3.33 0.00 0.00 175.10 172.70 1yru s ILE 177 N -0.03 2.42 0.00 7.04 1.01 -0.94 0.16 121.20 130.87 1yru s ILE 177 Ca 0.00 0.31 0.00 0.00 0.00 0.00 0.00 60.65 60.96 1yru s ILE 177 Cb -0.07 -3.15 0.00 0.00 0.01 0.00 0.00 42.46 39.25 1yru s ILE 177 CO 0.00 -0.01 0.00 0.61 0.00 0.00 0.00 174.94 175.54 1yru n GLY 178 N 0.63 2.39 3.48 6.18 0.00 0.12 -2.08 105.19 115.90 1yru n GLY 178 Ca 0.10 -1.12 -0.30 0.00 0.00 0.00 0.00 46.02 44.69 1yru n GLY 178 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1yru n ASN 179 N -1.32 -1.35 -0.02 1.61 3.02 0.51 -3.09 115.26 114.62 1yru n ASN 179 Ca 0.00 0.07 -0.13 0.00 -0.03 0.00 0.00 54.58 54.49 1yru n ASN 179 Cb 0.00 -1.26 -0.01 0.00 -0.61 0.00 0.00 39.78 37.91 1yru n ASN 179 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1yru h ALA 180 N -2.22 0.52 0.00 5.41 0.00 -1.87 -1.00 119.26 120.10 1yru h ALA 180 Ca -0.53 -0.55 0.00 0.00 0.00 0.00 0.00 54.91 53.83 1yru h ALA 180 Cb 1.31 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 19.04 1yru h ALA 180 CO 0.43 0.70 0.00 0.00 0.00 0.00 0.00 179.25 180.38 1yru n ALA 181 N -2.55 2.06 0.00 0.00 0.00 -1.26 -4.85 120.51 113.90 1yru n ALA 181 Ca -0.05 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.39 1yru n ALA 181 Cb 0.66 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 19.11 1yru n ALA 181 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1yru n GLY 182 N 0.15 2.66 3.73 0.00 0.00 -0.38 -5.02 105.19 106.32 1yru n GLY 182 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 1yru n GLY 182 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1yru s ILE 183 N -2.56 3.67 0.71 -0.61 1.01 -1.26 -4.51 121.20 117.65 1yru s ILE 183 Ca 0.00 1.34 -0.12 0.00 0.00 0.00 0.00 60.65 61.88 1yru s ILE 183 Cb 0.00 -3.86 0.02 0.00 0.01 0.00 0.00 42.46 38.64 1yru s ILE 183 CO 0.00 0.19 1.08 -2.84 0.00 0.00 0.00 174.94 173.36 1yru s PRO 184 N 0.11 2.67 0.10 2.79 0.02 -1.26 0.19 135.00 139.62 1yru s PRO 184 Ca 0.55 1.12 0.05 0.00 0.02 0.00 0.00 61.00 62.73 1yru s PRO 184 Cb -0.32 -1.95 -0.04 0.00 0.02 0.00 0.00 34.50 32.21 1yru s PRO 184 CO 0.35 -1.32 0.02 -0.51 -0.33 0.00 0.00 177.00 175.20 1yru s LEU 185 N -5.53 3.51 0.19 -5.54 1.43 -0.89 -1.15 118.68 110.71 1yru s LEU 185 Ca 0.61 -0.18 0.02 0.00 -1.03 0.00 0.00 54.13 53.55 1yru s LEU 185 Cb -0.16 -2.22 -0.05 0.00 0.03 0.00 0.00 46.19 43.79 1yru s LEU 185 CO 0.52 0.16 0.02 0.28 0.23 0.00 0.00 176.35 177.56 1yru s THR 186 N -1.39 0.68 0.59 5.49 -1.32 0.44 -3.74 115.64 116.39 1yru s THR 186 Ca 0.27 -1.99 -0.18 0.00 -1.21 0.00 0.00 61.69 58.58 1yru s THR 186 Cb -0.11 -2.24 -0.08 0.00 -1.51 0.00 0.00 72.50 68.56 1yru s THR 186 CO 0.19 -0.37 0.57 0.00 -2.21 0.00 0.00 174.62 172.81 1yru n ALA 187 N -0.30 -1.03 -2.92 11.08 0.00 -1.26 -1.93 120.51 124.15 1yru n ALA 187 Ca -0.05 -0.04 -0.25 0.00 0.00 0.00 0.00 53.44 53.10 1yru n ALA 187 Cb 0.64 -1.86 -0.03 0.00 0.00 0.00 0.00 19.45 18.19 1yru n ALA 187 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 177.50 177.66 1yru s ASP 188 N -1.21 6.19 -0.34 0.00 -4.77 -1.26 -4.63 116.67 110.65 1yru s ASP 188 Ca 0.69 0.09 -0.29 0.00 -3.30 0.00 0.00 52.55 49.75 1yru s ASP 188 Cb -0.43 -1.81 -0.01 0.00 -1.09 0.00 0.00 42.92 39.58 1yru s ASP 188 CO 0.54 0.03 1.54 -0.63 0.70 0.00 0.00 175.17 177.34 1yru s ILE 189 N -1.81 3.78 -0.12 2.11 1.01 -0.16 -4.98 121.20 121.04 1yru s ILE 189 Ca 0.34 0.83 -0.24 0.00 0.00 0.00 0.00 60.65 61.58 1yru s ILE 189 Cb -0.10 -3.95 -0.03 0.00 0.01 0.00 0.00 42.46 38.39 1yru s ILE 189 CO 0.28 -0.54 0.74 -1.81 0.00 0.00 0.00 174.94 173.61 1yru s ASP 190 N 4.39 6.94 -0.10 3.58 1.01 -1.26 -4.52 116.67 126.70 1yru s ASP 190 Ca 0.67 1.14 -0.23 0.00 0.71 0.00 0.00 52.55 54.84 1yru s ASP 190 Cb -0.19 -2.42 -0.03 0.00 1.01 0.00 0.00 42.92 41.29 1yru s ASP 190 CO 0.31 -0.24 0.70 -0.04 0.21 0.00 0.00 175.17 176.11 1yru s MET 191 N 1.45 4.38 -0.00 8.23 -1.94 -1.26 -1.12 119.30 129.03 1yru s MET 191 Ca 0.37 0.84 -0.21 0.00 -1.71 0.00 0.00 55.69 54.98 1yru s MET 191 Cb -0.17 -3.48 -0.23 0.00 2.01 0.00 0.00 34.83 32.96 1yru s MET 191 CO 0.15 -0.03 1.09 0.35 -0.01 0.00 0.00 175.02 176.58 1yru h PHE 192 N 6.94 0.54 -1.69 -0.03 3.57 0.27 -0.78 116.94 125.75 1yru h PHE 192 Ca -0.38 -0.29 0.19 0.00 3.53 0.00 0.00 57.97 61.02 1yru h PHE 192 Cb 1.18 -0.06 -0.19 0.00 2.79 0.00 0.00 35.95 39.67 1yru h PHE 192 CO 0.67 1.10 0.70 0.00 -2.23 0.00 0.00 178.31 178.54 1yru s ALA 193 N -3.23 -1.99 -0.16 2.41 0.00 -1.02 -2.49 121.76 115.28 1yru s ALA 193 Ca -0.14 1.45 0.01 0.00 0.00 0.00 0.00 51.96 53.28 1yru s ALA 193 Cb 0.03 -0.13 0.02 0.00 0.00 0.00 0.00 23.12 23.04 1yru s ALA 193 CO 0.81 -0.56 -0.16 0.42 0.00 0.00 0.00 175.76 176.26 1yru s ILE 194 N -2.36 1.77 -0.72 0.00 1.01 -1.26 -1.20 121.20 118.44 1yru s ILE 194 Ca 0.07 -0.77 -0.04 0.00 0.00 0.00 0.00 60.65 59.91 1yru s ILE 194 Cb -0.01 -1.64 0.18 0.00 0.01 0.00 0.00 42.46 41.00 1yru s ILE 194 CO -0.05 0.48 0.57 -0.04 0.00 0.00 0.00 174.94 175.90 1yru s MET 195 N 1.40 2.88 0.51 2.79 -1.94 -0.05 -4.91 119.30 119.98 1yru s MET 195 Ca 0.05 -2.73 -0.19 0.00 -1.71 0.00 0.00 55.69 51.10 1yru s MET 195 Cb -0.13 -3.87 -0.08 0.00 2.01 0.00 0.00 34.83 32.76 1yru s MET 195 CO -0.12 -1.21 1.04 -1.25 -0.01 0.00 0.00 175.02 173.48 1yru s PRO 196 N -0.39 3.71 0.17 2.03 0.04 -1.25 -2.28 135.00 137.03 1yru s PRO 196 Ca 0.20 1.34 -0.30 0.00 0.04 0.00 0.00 61.00 62.28 1yru s PRO 196 Cb -0.16 -2.08 -0.08 0.00 0.04 0.00 0.00 34.50 32.22 1yru s PRO 196 CO -0.06 -0.51 1.13 -1.58 0.04 0.00 0.00 177.00 176.02 1yru s HIS 197 N -2.06 3.54 0.43 0.56 2.46 -1.06 -0.55 115.29 118.61 1yru s HIS 197 Ca 0.67 1.54 0.19 0.00 0.47 0.00 0.00 55.06 57.93 1yru s HIS 197 Cb -0.16 -3.32 1.12 0.00 -0.13 0.00 0.00 32.58 30.09 1yru s HIS 197 CO 0.23 -0.79 1.86 1.25 -2.47 0.00 0.00 174.74 174.82 1yru h LEU 198 N 5.22 0.37 0.00 8.88 5.85 -0.96 0.59 115.31 135.26 1yru h LEU 198 Ca -0.44 0.04 0.00 0.00 0.84 0.00 0.00 57.88 58.32 1yru h LEU 198 Cb 1.21 -0.03 0.00 0.00 0.37 0.00 0.00 40.66 42.22 1yru h LEU 198 CO 0.73 0.14 0.00 -1.54 -0.34 0.00 0.00 178.44 177.44 1yru n SER 199 N -4.49 0.00 0.00 1.25 3.41 -1.26 -1.16 113.62 111.36 1yru n SER 199 Ca 0.19 -0.02 0.13 0.00 -0.26 0.00 0.00 58.87 58.92 1yru n SER 199 Cb 0.73 -0.10 0.70 0.00 -0.26 0.00 0.00 64.21 65.28 1yru n SER 199 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1yru n ASN 200 N -1.10 0.00 -0.63 4.04 3.02 0.20 -3.33 115.26 117.46 1yru n ASN 200 Ca 0.03 -0.20 0.07 0.00 -0.03 0.00 0.00 54.58 54.45 1yru n ASN 200 Cb 0.02 -0.25 0.18 0.00 -0.61 0.00 0.00 39.78 39.13 1yru n ASN 200 CO 0.00 0.00 0.00 0.49 -2.62 0.00 0.00 177.26 175.13 1yru n PHE 201 N -1.25 0.58 0.32 3.10 3.01 -0.31 -4.69 117.46 118.22 1yru n PHE 201 Ca 0.14 -0.72 -0.17 0.00 1.01 0.00 0.00 57.45 57.71 1yru n PHE 201 Cb 0.20 -0.17 -0.09 0.00 -0.01 0.00 0.00 39.48 39.42 1yru n PHE 201 CO 0.00 0.00 0.00 -0.09 1.01 0.00 0.00 176.76 177.68 1yru h ARG 202 N 1.51 -0.88 -0.32 -1.08 2.43 -1.73 -1.25 114.38 113.06 1yru h ARG 202 Ca 0.00 0.06 0.04 0.00 -0.81 0.00 0.00 59.98 59.27 1yru h ARG 202 Cb 1.05 0.20 -0.04 0.00 -0.42 0.00 0.00 29.97 30.76 1yru h ARG 202 CO 0.10 -0.59 0.10 -0.44 -1.51 0.00 0.00 179.97 177.63 1yru h ASP 203 N -0.91 0.09 -0.32 -3.80 3.32 -1.87 -0.29 116.42 112.64 1yru h ASP 203 Ca -0.06 0.04 0.07 0.00 0.02 0.00 0.00 57.03 57.09 1yru h ASP 203 Cb 0.76 0.03 -0.07 0.00 0.22 0.00 0.00 39.33 40.28 1yru h ASP 203 CO 0.03 0.09 -0.11 -1.28 -1.72 0.00 0.00 179.24 176.25 1yru h SER 204 N 0.23 -0.38 -0.43 6.45 0.87 -1.85 0.72 113.55 119.16 1yru h SER 204 Ca 0.14 0.11 -0.07 0.00 -1.23 0.00 0.00 61.79 60.74 1yru h SER 204 Cb 0.13 0.23 -0.02 0.00 -0.44 0.00 0.00 62.40 62.31 1yru h SER 204 CO -0.16 -0.14 -0.01 0.00 -0.53 0.00 0.00 176.83 175.99 1yru h ALA 205 N 1.26 0.58 -0.75 6.23 0.00 -0.43 -2.81 119.26 123.34 1yru h ALA 205 Ca 0.16 -0.27 0.11 0.00 0.00 0.00 0.00 54.91 54.91 1yru h ALA 205 Cb 0.28 -0.16 -0.08 0.00 0.00 0.00 0.00 17.79 17.84 1yru h ALA 205 CO -0.36 0.38 0.37 0.00 0.00 0.00 0.00 179.25 179.64 1yru h ARG 206 N 0.60 0.58 0.00 0.00 3.08 0.00 -1.27 114.38 117.37 1yru h ARG 206 Ca 0.12 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 60.14 1yru h ARG 206 Cb 0.51 -0.13 0.00 0.00 0.08 0.00 0.00 29.97 30.43 1yru h ARG 206 CO 0.02 0.38 0.00 -1.13 -1.07 0.00 0.00 179.97 178.18 1yru n SER 207 N -4.88 0.53 0.04 7.04 3.41 0.14 0.67 113.62 120.57 1yru n SER 207 Ca 0.13 0.58 -0.14 0.00 -0.26 0.00 0.00 58.87 59.18 1yru n SER 207 Cb 0.32 -0.71 -0.14 0.00 -0.26 0.00 0.00 64.21 63.43 1yru n SER 207 CO 0.00 0.00 0.00 -1.28 -0.16 0.00 0.00 175.04 173.60 1yru h SER 208 N 0.00 0.24 0.00 4.04 0.87 -1.10 -3.43 113.55 114.18 1yru h SER 208 Ca 0.00 -0.36 -0.15 0.00 -1.23 0.00 0.00 61.79 60.05 1yru h SER 208 Cb 0.54 -0.08 -0.02 0.00 -0.44 0.00 0.00 62.40 62.40 1yru h SER 208 CO 0.00 1.30 -1.52 0.52 -0.53 0.00 0.00 176.83 176.60 1yru n VAL 209 N -3.34 0.51 -0.23 2.23 0.31 -0.58 -5.02 118.33 112.21 1yru n VAL 209 Ca -0.15 -0.14 0.00 0.00 -0.01 0.00 0.00 64.34 64.04 1yru n VAL 209 Cb 1.03 -1.53 0.00 0.00 -0.91 0.00 0.00 33.84 32.43 1yru n VAL 209 CO 0.00 0.00 0.00 0.41 -1.32 0.00 0.00 176.83 175.92 1yru n THR 210 N -3.34 0.00 -2.13 2.52 -1.04 0.21 -4.92 114.28 105.58 1yru n THR 210 Ca -0.18 0.00 -0.25 0.00 -2.04 0.00 0.00 64.05 61.58 1yru n THR 210 Cb 0.63 -0.36 0.02 0.00 -1.82 0.00 0.00 70.33 68.80 1yru n THR 210 CO 0.00 0.00 0.00 -1.20 -0.64 0.00 0.00 175.07 173.23 1yru n SER 211 N 0.00 4.91 0.00 8.00 7.64 -1.24 -4.64 113.62 128.29 1yru n SER 211 Ca 0.00 -3.74 0.00 0.00 1.01 0.00 0.00 58.87 56.14 1yru n SER 211 Cb 0.00 -0.38 0.00 0.00 -1.01 0.00 0.00 64.21 62.82 1yru n SER 211 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1yru n GLY 212 N -0.65 0.83 3.72 0.23 0.00 -0.83 -4.89 105.19 103.60 1yru n GLY 212 Ca 0.43 -0.03 -0.23 0.00 0.00 0.00 0.00 46.02 46.19 1yru n GLY 212 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1yru s ASP 213 N -2.03 4.78 0.88 1.61 1.01 -1.26 -4.81 116.67 116.85 1yru s ASP 213 Ca 0.00 -0.63 -0.11 0.00 0.71 0.00 0.00 52.55 52.52 1yru s ASP 213 Cb 0.00 -0.89 0.13 0.00 1.01 0.00 0.00 42.92 43.17 1yru s ASP 213 CO 0.00 -0.14 1.15 -0.94 0.21 0.00 0.00 175.17 175.45 1yru s SER 214 N -3.78 3.21 0.13 0.27 1.04 -1.26 -4.69 113.70 108.61 1yru s SER 214 Ca 0.35 2.17 -0.14 0.00 0.48 0.00 0.00 55.95 58.81 1yru s SER 214 Cb -0.05 -2.57 -0.01 0.00 0.10 0.00 0.00 66.02 63.49 1yru s SER 214 CO 0.22 -2.91 1.59 0.58 0.98 0.00 0.00 173.24 173.70 1yru h VAL 215 N -1.63 1.25 -0.07 5.02 2.07 -1.99 -1.58 116.25 119.33 1yru h VAL 215 Ca -0.44 -0.97 0.02 0.00 0.82 0.00 0.00 66.70 66.13 1yru h VAL 215 Cb 1.27 1.06 -0.02 0.00 -1.52 0.00 0.00 31.29 32.09 1yru h VAL 215 CO 0.43 0.33 -0.03 0.74 0.02 0.00 0.00 177.57 179.07 1yru h THR 216 N 0.56 0.91 0.00 2.57 2.02 -2.00 -1.48 112.91 115.49 1yru h THR 216 Ca 0.12 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.28 1yru h THR 216 Cb 0.44 0.91 -0.00 0.00 -1.74 0.00 0.00 68.15 67.76 1yru h THR 216 CO 0.02 0.00 -0.09 0.44 0.37 0.00 0.00 175.52 176.26 1yru h ASP 217 N -0.02 0.00 0.02 4.18 3.32 -1.88 -1.34 116.42 120.70 1yru h ASP 217 Ca 0.04 0.00 -0.10 0.00 0.02 0.00 0.00 57.03 56.98 1yru h ASP 217 Cb 0.07 0.00 0.01 0.00 0.22 0.00 0.00 39.33 39.63 1yru h ASP 217 CO -0.08 0.09 -0.41 0.22 -1.72 0.00 0.00 179.24 177.34 1yru h TYR 218 N 0.00 0.37 -0.64 4.55 3.20 -0.66 -1.73 116.97 122.06 1yru h TYR 218 Ca -0.00 -0.22 -0.08 0.00 3.14 0.00 0.00 58.73 61.57 1yru h TYR 218 Cb 0.19 -0.04 -0.03 0.00 1.54 0.00 0.00 36.73 38.39 1yru h TYR 218 CO 0.00 1.06 0.10 -0.07 -1.64 0.00 0.00 178.16 177.61 1yru h LEU 219 N -0.42 1.01 -0.43 2.82 3.38 -1.23 -1.93 115.31 118.51 1yru h LEU 219 Ca -0.06 -0.24 0.02 0.00 0.09 0.00 0.00 57.88 57.69 1yru h LEU 219 Cb 1.19 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 41.64 1yru h LEU 219 CO 0.08 1.01 0.26 0.00 0.09 0.00 0.00 178.44 179.88 1yru h ALA 220 N 1.11 0.55 0.00 1.53 0.00 -1.24 0.45 119.26 121.66 1yru h ALA 220 Ca 0.20 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.10 1yru h ALA 220 Cb 0.43 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.09 1yru h ALA 220 CO 0.01 -0.06 0.00 -0.09 0.00 0.00 0.00 179.25 179.11 1yru h ARG 221 N 0.52 0.00 0.00 0.00 2.43 -1.13 -3.34 114.38 112.87 1yru h ARG 221 Ca 0.17 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.34 1yru h ARG 221 Cb 0.00 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.55 1yru h ARG 221 CO -0.08 0.00 0.00 0.25 -1.51 0.00 0.00 179.97 178.63 1yru n THR 222 N -2.46 0.00 0.00 0.20 -2.24 -0.74 -5.04 114.28 104.00 1yru n THR 222 Ca 0.01 -0.17 0.00 0.00 -2.27 0.00 0.00 64.05 61.62 1yru n THR 222 Cb 0.21 1.52 0.00 0.00 -2.10 0.00 0.00 70.33 69.96 1yru n THR 222 CO 0.00 0.00 0.00 -1.14 -0.57 0.00 0.00 175.07 173.36 1yru n ARG 223 N -0.07 1.17 0.00 -0.78 3.00 0.10 -5.06 116.66 115.02 1yru n ARG 223 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.85 1yru n ARG 223 Cb 0.13 0.00 0.00 0.00 0.00 0.00 0.00 32.46 32.59 1yru n ARG 223 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.63 178.17 1yru n ARG 224 N 0.00 0.00 -1.68 -0.14 1.74 -1.26 -5.03 116.66 110.29 1yru n ARG 224 Ca 0.00 0.00 -0.47 0.00 -0.77 0.00 0.00 57.85 56.61 1yru n ARG 224 Cb 0.00 0.00 -0.04 0.00 -1.02 0.00 0.00 32.46 31.40 1yru n ARG 224 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1yru n ALA 225 N -0.25 1.03 -4.12 7.54 0.00 -1.26 -5.14 120.51 118.29 1yru n ALA 225 Ca 0.00 0.27 -0.33 0.00 0.00 0.00 0.00 53.44 53.38 1yru n ALA 225 Cb 0.00 -2.53 -0.02 0.00 0.00 0.00 0.00 19.45 16.90 1yru n ALA 225 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 1yru n LEU 233 N 6.78 -1.92 -4.59 0.00 0.00 -1.26 -5.27 117.00 110.74 1yru n LEU 233 Ca 0.22 -0.99 -0.42 0.00 0.00 0.00 0.00 56.01 54.83 1yru n LEU 233 Cb 0.32 -2.17 -0.06 0.00 0.00 0.00 0.00 43.42 41.51 1yru n LEU 233 CO 0.72 0.35 0.49 -0.62 0.00 0.00 0.00 177.39 178.33 1yru s ASP 234 N -3.57 6.52 -0.00 1.96 2.15 -1.26 -4.74 116.67 117.73 1yru s ASP 234 Ca 0.55 0.35 -0.21 0.00 0.43 0.00 0.00 52.55 53.67 1yru s ASP 234 Cb -0.29 -2.37 -0.21 0.00 -0.30 0.00 0.00 42.92 39.75 1yru s ASP 234 CO 0.91 -0.63 1.14 0.03 -0.17 0.00 0.00 175.17 176.45 1yru h ARG 235 N 8.37 0.33 -0.21 4.34 3.08 -2.05 -1.70 114.38 126.54 1yru h ARG 235 Ca -0.25 -0.29 -0.00 0.00 0.07 0.00 0.00 59.98 59.51 1yru h ARG 235 Cb 1.10 0.07 -0.01 0.00 0.08 0.00 0.00 29.97 31.21 1yru h ARG 235 CO 0.87 0.95 0.12 0.93 -1.07 0.00 0.00 179.97 181.77 1yru h GLU 236 N -0.20 0.28 -0.75 0.04 5.08 -2.00 -2.05 114.58 114.98 1yru h GLU 236 Ca -0.03 -0.03 -0.01 0.00 -1.00 0.00 0.00 59.36 58.30 1yru h GLU 236 Cb 1.04 -0.06 -0.04 0.00 0.50 0.00 0.00 28.75 30.19 1yru h GLU 236 CO 0.07 0.24 0.45 -0.09 -1.00 0.00 0.00 179.01 178.68 1yru h ARG 237 N 0.25 1.03 -0.36 2.33 2.43 -1.92 -2.14 114.38 115.98 1yru h ARG 237 Ca 0.07 -0.10 -0.07 0.00 -0.81 0.00 0.00 59.98 59.08 1yru h ARG 237 Cb 0.03 -0.21 -0.02 0.00 -0.42 0.00 0.00 29.97 29.35 1yru h ARG 237 CO -0.01 0.73 -0.05 0.82 -1.51 0.00 0.00 179.97 179.95 1yru h ILE 238 N 1.03 1.22 0.56 1.20 2.04 -1.12 -1.83 117.51 120.62 1yru h ILE 238 Ca 0.27 -0.95 -0.02 0.00 1.00 0.00 0.00 64.86 65.16 1yru h ILE 238 Cb -0.02 1.00 -0.01 0.00 -0.74 0.00 0.00 36.82 37.05 1yru h ILE 238 CO -0.05 0.32 -0.39 -0.78 0.00 0.00 0.00 178.15 177.25 1yru h ASP 239 N 0.56 -1.02 -0.53 1.72 3.58 -0.90 -1.91 116.42 117.93 1yru h ASP 239 Ca 0.11 0.07 0.10 0.00 0.42 0.00 0.00 57.03 57.73 1yru h ASP 239 Cb 0.43 0.31 -0.08 0.00 1.72 0.00 0.00 39.33 41.71 1yru h ASP 239 CO 0.02 -0.59 0.05 -0.07 -2.88 0.00 0.00 179.24 175.77 1yru h LEU 240 N -0.92 -0.13 -0.83 2.28 -0.00 -1.15 0.29 115.31 114.85 1yru h LEU 240 Ca -0.06 0.12 0.07 0.00 -0.00 0.00 0.00 57.88 58.00 1yru h LEU 240 Cb 0.77 0.19 -0.06 0.00 -0.00 0.00 0.00 40.66 41.55 1yru h LEU 240 CO 0.03 -0.04 0.50 -0.07 -0.00 0.00 0.00 178.44 178.86 1yru h LEU 241 N 0.17 0.76 -1.28 1.67 3.38 -1.17 0.22 115.31 119.05 1yru h LEU 241 Ca 0.27 0.03 -0.07 0.00 0.09 0.00 0.00 57.88 58.20 1yru h LEU 241 Cb 0.41 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.02 1yru h LEU 241 CO -0.41 0.47 -0.35 -0.50 0.09 0.00 0.00 178.44 177.74 1yru h TRP 242 N 0.88 0.00 -0.32 1.13 4.06 -0.31 -1.45 115.95 119.94 1yru h TRP 242 Ca 0.38 0.00 -0.17 0.00 2.06 0.00 0.00 58.89 61.16 1yru h TRP 242 Cb 0.24 0.00 -0.00 0.00 -1.00 0.00 0.00 29.16 28.40 1yru h TRP 242 CO -0.05 0.35 -0.47 0.87 -3.56 0.00 0.00 178.44 175.59 1yru h LYS 243 N 0.00 0.87 -0.21 0.49 1.57 0.12 -0.95 116.57 118.47 1yru h LYS 243 Ca -0.00 -0.51 -0.17 0.00 -1.87 0.00 0.00 60.65 58.11 1yru h LYS 243 Cb 0.66 0.04 -0.00 0.00 0.08 0.00 0.00 32.23 33.00 1yru h LYS 243 CO 0.05 1.15 -0.54 -0.84 -0.57 0.00 0.00 179.45 178.69 1yru h ILE 244 N 0.69 1.31 -0.87 1.86 3.07 0.18 -1.81 117.51 121.95 1yru h ILE 244 Ca 0.04 -1.78 0.09 0.00 1.55 0.00 0.00 64.86 64.76 1yru h ILE 244 Cb 1.06 1.73 -0.07 0.00 -0.27 0.00 0.00 36.82 39.27 1yru h ILE 244 CO 0.11 0.56 0.52 0.00 -1.05 0.00 0.00 178.15 178.29 1yru h ALA 245 N 0.91 1.23 0.16 0.16 0.00 -1.20 0.34 119.26 120.86 1yru h ALA 245 Ca 0.01 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 1yru h ALA 245 Cb 1.10 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.71 1yru h ALA 245 CO 0.11 0.19 -0.08 -0.09 0.00 0.00 0.00 179.25 179.38 1yru h ARG 246 N 0.89 -0.21 -0.60 0.00 2.43 -0.93 -2.05 114.38 113.91 1yru h ARG 246 Ca 0.40 0.01 0.04 0.00 -0.81 0.00 0.00 59.98 59.63 1yru h ARG 246 Cb 0.30 0.05 -0.05 0.00 -0.42 0.00 0.00 29.97 29.86 1yru h ARG 246 CO -0.22 0.06 0.35 0.00 -1.51 0.00 0.00 179.97 178.64 1yru h ALA 247 N 0.30 0.79 -0.54 2.80 0.00 -0.90 -0.97 119.26 120.75 1yru h ALA 247 Ca -0.02 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 1yru h ALA 247 Cb 0.37 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.00 1yru h ALA 247 CO 0.04 0.04 0.28 0.78 0.00 0.00 0.00 179.25 180.39 1yru h GLY 248 N 0.66 0.81 1.01 0.00 0.00 -0.28 -1.91 103.07 103.37 1yru h GLY 248 Ca 0.26 -0.38 -0.03 0.00 0.00 0.00 0.00 47.33 47.18 1yru h GLY 248 CO -0.14 0.37 0.32 0.00 0.00 0.00 0.00 176.54 177.09 1yru h ALA 249 N 1.11 0.89 0.00 3.60 0.00 -0.95 -1.63 119.26 122.29 1yru h ALA 249 Ca 0.19 -0.15 -0.05 0.00 0.00 0.00 0.00 54.91 54.90 1yru h ALA 249 Cb 0.08 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 1yru h ALA 249 CO -0.03 0.46 -0.22 0.00 0.00 0.00 0.00 179.25 179.46 1yru h ARG 250 N 0.96 0.00 0.04 0.00 3.08 -0.84 -1.91 114.38 115.71 1yru h ARG 250 Ca 0.23 0.00 -0.32 0.00 0.07 0.00 0.00 59.98 59.96 1yru h ARG 250 Cb 0.13 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 30.14 1yru h ARG 250 CO -0.03 0.22 -1.85 -1.13 -1.07 0.00 0.00 179.97 176.12 1yru n SER 251 N -4.00 1.25 -0.29 7.04 3.41 -0.75 -1.94 113.62 118.34 1yru n SER 251 Ca -0.02 0.32 0.02 0.00 -0.26 0.00 0.00 58.87 58.93 1yru n SER 251 Cb 0.30 -0.27 0.16 0.00 -0.26 0.00 0.00 64.21 64.13 1yru n SER 251 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1yru h ALA 252 N 0.69 1.16 -0.45 7.33 0.00 -1.07 0.12 119.26 127.04 1yru h ALA 252 Ca -0.35 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.59 1yru h ALA 252 Cb 2.03 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 19.67 1yru h ALA 252 CO 0.08 0.12 0.00 1.55 0.00 0.00 0.00 179.25 181.00 1yru n VAL 253 N -4.73 0.59 -4.18 0.00 3.14 -0.74 -4.95 118.33 107.45 1yru n VAL 253 Ca 0.13 -0.73 -0.34 0.00 -2.96 0.00 0.00 64.34 60.44 1yru n VAL 253 Cb 0.25 0.71 -0.03 0.00 -1.06 0.00 0.00 33.84 33.71 1yru n VAL 253 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1yru n GLY 254 N 1.47 -0.36 0.27 7.55 0.00 0.41 -4.90 105.19 109.63 1yru n GLY 254 Ca 0.20 0.14 0.05 0.00 0.00 0.00 0.00 46.02 46.41 1yru n GLY 254 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1yru h THR 255 N -1.57 0.50 0.01 2.61 2.02 -1.67 -0.41 112.91 114.40 1yru h THR 255 Ca -0.61 -0.08 -0.00 0.00 0.77 0.00 0.00 66.41 66.49 1yru h THR 255 Cb 1.38 0.24 0.00 0.00 -1.74 0.00 0.00 68.15 68.03 1yru h THR 255 CO 0.74 0.04 -0.01 -0.33 0.37 0.00 0.00 175.52 176.34 1yru h GLU 256 N 0.24 -0.01 -0.78 6.66 5.08 -1.91 -3.31 114.58 120.56 1yru h GLU 256 Ca 0.41 0.00 0.18 0.00 -1.00 0.00 0.00 59.36 58.94 1yru h GLU 256 Cb 0.69 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.90 1yru h GLU 256 CO -0.52 0.78 0.53 0.00 -1.00 0.00 0.00 179.01 178.80 1yru h ALA 257 N 0.05 2.29 0.00 3.43 0.00 -1.81 -0.94 119.26 122.28 1yru h ALA 257 Ca -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1yru h ALA 257 Cb 0.80 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.57 1yru h ALA 257 CO 0.00 -0.52 0.00 0.54 0.00 0.00 0.00 179.25 179.28 1yru n ARG 258 N -4.45 0.91 0.02 0.00 1.74 -0.19 -2.64 116.66 112.05 1yru n ARG 258 Ca 0.15 0.00 0.12 0.00 -0.77 0.00 0.00 57.85 57.35 1yru n ARG 258 Cb 0.64 -1.20 0.15 0.00 -1.02 0.00 0.00 32.46 31.03 1yru n ARG 258 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 1yru n ARG 259 N -0.70 0.15 -3.28 5.56 1.74 -0.36 -4.97 116.66 114.80 1yru n ARG 259 Ca 0.09 0.02 -0.14 0.00 -0.77 0.00 0.00 57.85 57.05 1yru n ARG 259 Cb 0.04 -1.57 -0.04 0.00 -1.02 0.00 0.00 32.46 29.87 1yru n ARG 259 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1yru n GLN 260 N -1.78 0.91 -4.32 5.56 10.64 -1.08 -5.15 117.38 122.15 1yru n GLN 260 Ca 0.04 -1.82 -0.32 0.00 -1.83 0.00 0.00 57.00 53.06 1yru n GLN 260 Cb 0.39 0.86 -0.09 0.00 -0.86 0.00 0.00 30.24 30.54 1yru n GLN 260 CO 0.00 0.00 0.00 -0.06 -1.83 0.00 0.00 177.06 175.17 1yru s PHE 261 N -2.24 3.02 0.28 2.61 2.99 -1.26 -4.44 117.98 118.93 1yru s PHE 261 Ca 0.08 0.04 0.07 0.00 0.00 0.00 0.00 56.93 57.12 1yru s PHE 261 Cb 0.00 -1.65 -0.03 0.00 0.00 0.00 0.00 43.02 41.35 1yru s PHE 261 CO 0.06 0.44 0.22 1.03 -0.00 0.00 0.00 175.22 176.96 1yru s ARG 262 N -1.56 2.85 0.08 0.44 1.81 -0.57 -4.98 118.95 117.03 1yru s ARG 262 Ca 0.19 -1.13 0.02 0.00 -1.72 0.00 0.00 55.73 53.09 1yru s ARG 262 Cb -0.11 -2.53 -0.04 0.00 -0.45 0.00 0.00 34.95 31.82 1yru s ARG 262 CO 0.10 0.31 -0.07 0.71 -0.68 0.00 0.00 175.30 175.67 1yru s TYR 263 N -2.19 0.83 -0.37 -0.53 1.51 -1.26 -1.49 117.35 113.85 1yru s TYR 263 Ca 0.35 -0.81 0.02 0.00 -1.01 0.00 0.00 57.07 55.61 1yru s TYR 263 Cb -0.07 -0.49 0.11 0.00 -0.11 0.00 0.00 41.96 41.40 1yru s TYR 263 CO 0.25 -0.14 0.14 0.34 -1.11 0.00 0.00 175.55 175.03 1yru s ASP 264 N -2.67 4.16 1.48 2.29 3.68 0.64 -4.89 116.67 121.36 1yru s ASP 264 Ca 0.06 -2.16 0.00 0.00 2.13 0.00 0.00 52.55 52.58 1yru s ASP 264 Cb 0.01 -1.19 0.00 0.00 -1.45 0.00 0.00 42.92 40.30 1yru s ASP 264 CO -0.04 -0.35 0.00 0.61 0.13 0.00 0.00 175.17 175.52 1yru n GLY 265 N 4.19 1.87 1.83 2.66 0.00 -1.26 -2.14 105.19 112.35 1yru n GLY 265 Ca 0.03 -0.41 0.07 0.00 0.00 0.00 0.00 46.02 45.70 1yru n GLY 265 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1yru n ASP 266 N 6.05 5.61 -4.49 1.61 5.68 -1.26 -4.91 116.55 124.84 1yru n ASP 266 Ca 0.00 -2.96 -0.34 0.00 -0.50 0.00 0.00 54.79 51.00 1yru n ASP 266 Cb 0.00 -0.68 -0.12 0.00 -1.14 0.00 0.00 41.12 39.17 1yru n ASP 266 CO 0.00 0.00 0.00 -0.32 -1.33 0.00 0.00 177.20 175.55 1yru s MET 267 N -2.79 3.42 -0.24 0.11 1.75 -0.91 -5.07 119.30 115.57 1yru s MET 267 Ca 0.54 -0.56 -0.29 0.00 -1.25 0.00 0.00 55.69 54.13 1yru s MET 267 Cb 0.41 -2.78 -0.01 0.00 2.84 0.00 0.00 34.83 35.29 1yru s MET 267 CO 0.15 0.32 1.30 1.21 -0.65 0.00 0.00 175.02 177.36 1yru s ASN 268 N 0.12 6.77 0.00 1.11 3.84 -1.26 -0.26 114.94 125.26 1yru s ASN 268 Ca -0.03 1.42 0.26 0.00 0.21 0.00 0.00 52.86 54.73 1yru s ASN 268 Cb -0.14 -2.54 0.72 0.00 -0.55 0.00 0.00 41.25 38.74 1yru s ASN 268 CO 0.03 -0.96 1.55 -0.38 -2.79 0.00 0.00 177.10 174.55 1yru n ILE 269 N 5.88 0.00 -2.75 -5.21 2.08 -0.56 -4.47 119.36 114.33 1yru n ILE 269 Ca 0.15 -0.22 0.00 0.00 0.56 0.00 0.00 62.75 63.24 1yru n ILE 269 Cb 0.46 0.63 0.00 0.00 -0.75 0.00 0.00 39.64 39.97 1yru n ILE 269 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 1yru n GLY 270 N 1.29 -1.80 3.69 7.39 0.00 -1.25 -1.87 105.19 112.64 1yru n GLY 270 Ca 0.14 -1.58 -0.41 0.00 0.00 0.00 0.00 46.02 44.18 1yru n GLY 270 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1yru s VAL 271 N 0.00 4.95 -0.13 1.61 1.01 -1.26 -1.51 120.40 125.06 1yru s VAL 271 Ca 0.00 1.58 -0.19 0.00 0.00 0.00 0.00 61.98 63.37 1yru s VAL 271 Cb 0.00 -4.11 0.05 0.00 0.00 0.00 0.00 36.38 32.32 1yru s VAL 271 CO 0.00 0.12 0.48 -0.51 0.00 0.00 0.00 175.10 175.19 1yru s ILE 272 N 1.55 0.01 0.60 2.22 2.07 -1.26 -4.53 121.20 121.86 1yru s ILE 272 Ca 0.39 -0.10 -0.09 0.00 -1.41 0.00 0.00 60.65 59.43 1yru s ILE 272 Cb -0.17 -0.72 -0.03 0.00 0.13 0.00 0.00 42.46 41.67 1yru s ILE 272 CO 0.16 -0.05 0.98 0.42 -1.91 0.00 0.00 174.94 174.53 1yru s THR 273 N -0.27 4.53 0.28 4.00 -4.23 -1.26 -4.54 115.64 114.15 1yru s THR 273 Ca -0.04 0.62 0.02 0.00 -1.18 0.00 0.00 61.69 61.11 1yru s THR 273 Cb -0.03 -3.79 0.27 0.00 1.34 0.00 0.00 72.50 70.29 1yru s THR 273 CO 0.03 -0.97 1.72 0.44 -0.54 0.00 0.00 174.62 175.30 1yru h ASP 274 N -0.24 0.41 -0.18 3.99 3.32 -1.93 -1.42 116.42 120.38 1yru h ASP 274 Ca -0.45 0.13 -0.06 0.00 0.02 0.00 0.00 57.03 56.67 1yru h ASP 274 Cb 1.21 0.09 -0.00 0.00 0.22 0.00 0.00 39.33 40.84 1yru h ASP 274 CO 0.62 0.08 -0.12 0.15 -1.72 0.00 0.00 179.24 178.25 1yru h PHE 275 N 0.49 0.46 -0.87 4.55 3.57 -1.92 -1.18 116.94 122.04 1yru h PHE 275 Ca 0.52 -0.13 0.16 0.00 3.53 0.00 0.00 57.97 62.06 1yru h PHE 275 Cb 0.91 -0.10 -0.07 0.00 2.79 0.00 0.00 35.95 39.48 1yru h PHE 275 CO -0.12 0.73 0.56 0.93 -2.23 0.00 0.00 178.31 178.19 1yru h GLU 276 N 0.06 0.56 0.05 1.11 5.08 -1.64 0.42 114.58 120.23 1yru h GLU 276 Ca 0.03 -0.03 -0.29 0.00 -1.00 0.00 0.00 59.36 58.07 1yru h GLU 276 Cb 0.63 -0.13 -0.03 0.00 0.50 0.00 0.00 28.75 29.73 1yru h GLU 276 CO 0.03 0.37 -1.59 1.25 -1.00 0.00 0.00 179.01 178.07 1yru h LEU 277 N 0.57 0.17 -0.51 1.33 5.85 -1.40 -1.07 115.31 120.25 1yru h LEU 277 Ca 0.44 -0.29 0.10 0.00 0.84 0.00 0.00 57.88 58.97 1yru h LEU 277 Cb 0.85 -0.06 -0.09 0.00 0.37 0.00 0.00 40.66 41.73 1yru h LEU 277 CO -0.19 1.25 -0.06 -0.33 -0.34 0.00 0.00 178.44 178.77 1yru h GLU 278 N 0.03 0.05 -0.84 1.25 5.08 -0.35 0.10 114.58 119.91 1yru h GLU 278 Ca -0.25 -0.00 0.06 0.00 -1.00 0.00 0.00 59.36 58.16 1yru h GLU 278 Cb 1.98 -0.01 -0.06 0.00 0.50 0.00 0.00 28.75 31.16 1yru h GLU 278 CO 0.11 0.04 0.52 0.28 -1.00 0.00 0.00 179.01 178.96 1yru h VAL 279 N 0.06 1.05 -0.66 3.13 2.07 -0.81 -0.90 116.25 120.18 1yru h VAL 279 Ca 0.26 -0.33 0.04 0.00 0.82 0.00 0.00 66.70 67.49 1yru h VAL 279 Cb 0.39 0.01 -0.05 0.00 -1.52 0.00 0.00 31.29 30.13 1yru h VAL 279 CO -0.48 0.17 0.40 -0.09 0.02 0.00 0.00 177.57 177.59 1yru h ARG 280 N 0.95 0.75 -0.48 1.57 2.43 0.28 -1.38 114.38 118.51 1yru h ARG 280 Ca 0.36 -0.04 -0.13 0.00 -0.81 0.00 0.00 59.98 59.35 1yru h ARG 280 Cb 0.15 -0.17 -0.01 0.00 -0.42 0.00 0.00 29.97 29.52 1yru h ARG 280 CO -0.17 0.49 -0.23 -0.91 -1.51 0.00 0.00 179.97 177.65 1yru h ASN 281 N 0.77 1.01 -0.55 -3.80 2.35 -0.38 0.87 115.58 115.86 1yru h ASN 281 Ca 0.28 -0.39 -0.06 0.00 -0.55 0.00 0.00 56.30 55.58 1yru h ASN 281 Cb 0.07 -0.28 -0.03 0.00 0.05 0.00 0.00 38.32 38.13 1yru h ASN 281 CO -0.13 1.19 0.14 0.00 -1.65 0.00 0.00 177.43 176.98 1yru h ALA 282 N 0.88 1.14 -0.13 -0.83 0.00 -0.83 -0.25 119.26 119.25 1yru h ALA 282 Ca 0.11 -0.22 -0.05 0.00 0.00 0.00 0.00 54.91 54.75 1yru h ALA 282 Cb 0.80 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 18.36 1yru h ALA 282 CO 0.07 0.58 -0.11 -0.07 0.00 0.00 0.00 179.25 179.71 1yru h LEU 283 N 0.88 0.32 -2.13 0.00 3.38 -1.03 -2.52 115.31 114.21 1yru h LEU 283 Ca 0.19 -0.47 -0.01 0.00 0.09 0.00 0.00 57.88 57.68 1yru h LEU 283 Cb 0.32 -0.09 -0.00 0.00 0.09 0.00 0.00 40.66 40.98 1yru h LEU 283 CO -0.00 0.72 -0.04 0.78 0.09 0.00 0.00 178.44 179.99 1yru h ASN 284 N -0.08 0.00 0.51 -0.43 2.35 -0.65 -0.85 115.58 116.43 1yru h ASN 284 Ca 0.02 0.00 -0.02 0.00 -0.55 0.00 0.00 56.30 55.75 1yru h ASN 284 Cb 0.63 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.00 1yru h ASN 284 CO 0.03 0.04 -0.24 0.03 -1.65 0.00 0.00 177.43 175.64 1yru h ARG 285 N 0.00 -0.66 -1.01 0.81 2.47 -0.86 -2.39 114.38 112.74 1yru h ARG 285 Ca -0.00 0.04 0.27 0.00 -1.26 0.00 0.00 59.98 59.03 1yru h ARG 285 Cb 0.09 0.15 -0.07 0.00 -1.65 0.00 0.00 29.97 28.49 1yru h ARG 285 CO 0.01 -0.44 0.69 0.00 0.56 0.00 0.00 179.97 180.79 1yru h ARG 286 N -0.80 0.21 -0.79 0.04 2.47 -0.98 0.85 114.38 115.38 1yru h ARG 286 Ca -0.07 -0.01 -0.05 0.00 -1.26 0.00 0.00 59.98 58.59 1yru h ARG 286 Cb 0.52 -0.05 -0.03 0.00 -1.65 0.00 0.00 29.97 28.76 1yru h ARG 286 CO 0.11 0.14 0.30 0.00 0.56 0.00 0.00 179.97 181.08 1yru h ALA 287 N 1.56 1.04 -0.11 0.04 0.00 -1.07 -1.59 119.26 119.12 1yru h ALA 287 Ca 0.53 -0.20 -0.19 0.00 0.00 0.00 0.00 54.91 55.04 1yru h ALA 287 Cb 1.66 -0.31 -0.00 0.00 0.00 0.00 0.00 17.79 19.14 1yru h ALA 287 CO -0.14 0.67 -0.71 0.45 0.00 0.00 0.00 179.25 179.52 1yru h HIS 288 N 1.15 0.68 0.00 0.00 3.86 0.12 -0.24 115.15 120.71 1yru h HIS 288 Ca 0.26 -0.29 -0.01 0.00 -1.16 0.00 0.00 60.37 59.17 1yru h HIS 288 Cb 0.24 -0.11 -0.00 0.00 1.06 0.00 0.00 27.41 28.60 1yru h HIS 288 CO 0.02 1.06 -0.05 0.00 0.86 0.00 0.00 177.93 179.82 1yru h ALA 289 N 0.87 1.35 -3.15 2.45 0.00 -0.07 -3.40 119.26 117.31 1yru h ALA 289 Ca -0.03 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.84 1yru h ALA 289 Cb 1.29 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.07 1yru h ALA 289 CO 0.13 0.06 0.00 0.28 0.00 0.00 0.00 179.25 179.72 1yru n VAL 290 N -3.65 0.00 0.71 0.00 0.31 -0.99 -4.96 118.33 109.75 1yru n VAL 290 Ca -0.02 0.00 0.04 0.00 -0.01 0.00 0.00 64.34 64.34 1yru n VAL 290 Cb 0.15 -1.08 0.14 0.00 -0.91 0.00 0.00 33.84 32.14 1yru n VAL 290 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1yru n GLY 291 N 5.00 1.11 3.95 2.92 0.00 -1.26 -4.93 105.19 111.98 1yru n GLY 291 Ca 0.00 -0.34 -0.23 0.00 0.00 0.00 0.00 46.02 45.45 1yru n GLY 291 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1yru s ALA 292 N -1.65 3.69 0.79 4.61 0.00 -0.12 -3.74 121.76 125.35 1yru s ALA 292 Ca 0.21 -1.04 -0.01 0.00 0.00 0.00 0.00 51.96 51.12 1yru s ALA 292 Cb 0.13 -2.21 0.01 0.00 0.00 0.00 0.00 23.12 21.04 1yru s ALA 292 CO 0.10 -0.52 0.06 1.04 0.00 0.00 0.00 175.76 176.44 1yru n GLN 293 N -2.22 0.17 -1.75 0.00 1.13 -1.26 -3.44 117.38 110.00 1yru n GLN 293 Ca 0.03 -0.11 -0.41 0.00 -1.94 0.00 0.00 57.00 54.58 1yru n GLN 293 Cb 0.58 -0.05 0.01 0.00 0.11 0.00 0.00 30.24 30.89 1yru n GLN 293 CO 0.00 0.00 0.00 -0.25 -1.44 0.00 0.00 177.06 175.37 1yru n ASP 294 N -3.02 3.30 0.00 1.08 8.00 -1.26 -4.63 116.55 120.02 1yru n ASP 294 Ca 0.01 1.16 0.00 0.00 0.71 0.00 0.00 54.79 56.67 1yru n ASP 294 Cb 0.03 -1.58 0.00 0.00 -0.02 0.00 0.00 41.12 39.54 1yru n ASP 294 CO 0.00 0.00 0.00 1.33 -0.39 0.00 0.00 177.20 178.14 1yru n VAL 295 N 0.03 0.00 -3.80 2.53 0.24 -1.26 -4.29 118.33 111.78 1yru n VAL 295 Ca 0.04 -0.06 -0.37 0.00 -2.04 0.00 0.00 64.34 61.92 1yru n VAL 295 Cb 0.40 0.52 -0.13 0.00 -1.47 0.00 0.00 33.84 33.16 1yru n VAL 295 CO 0.00 0.00 0.00 -0.69 -2.14 0.00 0.00 176.83 174.00 1yru s VAL 296 N -1.67 3.44 -2.22 3.34 1.01 -1.26 -0.99 120.40 122.05 1yru s VAL 296 Ca 0.00 -1.38 0.22 0.00 0.00 0.00 0.00 61.98 60.82 1yru s VAL 296 Cb 0.00 -3.03 0.04 0.00 0.00 0.00 0.00 36.38 33.39 1yru s VAL 296 CO 0.00 -0.25 1.10 0.00 0.00 0.00 0.00 175.10 175.96 1yru n GLN 297 N 4.72 1.54 -3.84 2.72 1.13 -1.26 -4.95 117.38 117.43 1yru n GLN 297 Ca -0.11 -1.23 -0.07 0.00 -1.94 0.00 0.00 57.00 53.65 1yru n GLN 297 Cb 0.44 -1.45 -0.01 0.00 0.11 0.00 0.00 30.24 29.33 1yru n GLN 297 CO 0.00 0.00 0.00 -3.38 -1.44 0.00 0.00 177.06 172.24 1yru s HIS 298 N -2.27 -0.12 0.61 1.08 -3.43 -1.26 -4.63 115.29 105.27 1yru s HIS 298 Ca 0.20 -0.35 -0.10 0.00 -0.80 0.00 0.00 55.06 54.01 1yru s HIS 298 Cb 0.18 0.72 0.16 0.00 -1.43 0.00 0.00 32.58 32.21 1yru s HIS 298 CO 0.48 -1.24 0.44 0.41 -2.00 0.00 0.00 174.74 172.82 1yru n GLY 299 N -0.48 -3.25 3.82 -1.38 0.00 -0.78 -4.79 105.19 98.33 1yru n GLY 299 Ca -0.05 -1.36 -0.32 0.00 0.00 0.00 0.00 46.02 44.30 1yru n GLY 299 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1yru s THR 300 N -1.68 4.02 0.58 2.61 2.01 -1.26 -4.60 115.64 117.32 1yru s THR 300 Ca 0.31 0.77 0.39 0.00 0.31 0.00 0.00 61.69 63.47 1yru s THR 300 Cb -0.04 -3.43 0.41 0.00 0.01 0.00 0.00 72.50 69.44 1yru s THR 300 CO 0.25 -0.74 2.29 -0.08 -0.69 0.00 0.00 174.62 175.65 1yru h GLU 301 N -0.20 0.00 0.00 4.92 4.57 -0.82 -1.17 114.58 121.88 1yru h GLU 301 Ca -0.45 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 57.73 1yru h GLU 301 Cb 1.21 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.80 1yru h GLU 301 CO 0.57 0.01 0.00 1.04 -1.18 0.00 0.00 179.01 179.46 1yru n GLN 302 N -3.33 0.10 -0.86 1.92 1.13 -1.16 -2.25 117.38 112.93 1yru n GLN 302 Ca -0.03 0.23 0.05 0.00 -1.94 0.00 0.00 57.00 55.32 1yru n GLN 302 Cb 0.11 -1.50 0.11 0.00 0.11 0.00 0.00 30.24 29.07 1yru n GLN 302 CO 0.00 0.00 0.00 0.09 -1.44 0.00 0.00 177.06 175.71 1yru n ASN 303 N -1.37 1.36 -4.67 1.08 3.02 -0.44 -3.76 115.26 110.48 1yru n ASN 303 Ca 0.04 -2.95 -0.40 0.00 -0.03 0.00 0.00 54.58 51.24 1yru n ASN 303 Cb 0.10 -0.40 -0.05 0.00 -0.61 0.00 0.00 39.78 38.81 1yru n ASN 303 CO 0.00 0.00 0.00 0.21 -2.62 0.00 0.00 177.26 174.85 1yru s ASN 304 N -2.54 6.76 0.17 6.41 3.04 -0.95 -4.72 114.94 123.10 1yru s ASN 304 Ca 0.32 0.92 0.23 0.00 0.04 0.00 0.00 52.86 54.38 1yru s ASN 304 Cb 0.33 -2.37 0.90 0.00 -1.54 0.00 0.00 41.25 38.58 1yru s ASN 304 CO -0.09 -0.25 1.71 -0.81 -3.04 0.00 0.00 177.10 174.62 1yru n PRO 305 N 4.82 0.15 -3.90 0.43 -0.04 -1.26 -3.73 135.00 131.48 1yru n PRO 305 Ca -0.01 0.28 -0.29 0.00 -0.04 0.00 0.00 63.50 63.45 1yru n PRO 305 Cb 0.50 -1.74 -0.12 0.00 -0.04 0.00 0.00 33.50 32.09 1yru n PRO 305 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 1yru s PHE 306 N -3.16 3.39 0.16 0.54 0.40 -1.26 -5.09 117.98 112.96 1yru s PHE 306 Ca 0.08 -3.26 -0.30 0.00 -0.60 0.00 0.00 56.93 52.84 1yru s PHE 306 Cb 0.11 -2.68 -0.08 0.00 0.51 0.00 0.00 43.02 40.89 1yru s PHE 306 CO 0.44 -0.60 1.26 -1.25 0.70 0.00 0.00 175.22 175.77 1yru s PRO 307 N -1.11 4.43 0.33 0.24 0.04 -1.24 -5.04 135.00 132.65 1yru s PRO 307 Ca 0.23 1.94 -0.19 0.00 0.04 0.00 0.00 61.00 63.02 1yru s PRO 307 Cb -0.10 -3.24 -0.10 0.00 0.04 0.00 0.00 34.50 31.10 1yru s PRO 307 CO -0.12 -0.21 0.82 -1.21 0.04 0.00 0.00 177.00 176.31 1yru s GLU 308 N 0.18 4.19 -0.57 4.56 0.41 -1.26 -4.97 118.70 121.23 1yru s GLU 308 Ca 0.56 0.92 0.00 0.00 -0.41 0.00 0.00 54.97 56.05 1yru s GLU 308 Cb -0.34 -2.50 0.45 0.00 -1.78 0.00 0.00 34.13 29.97 1yru s GLU 308 CO 0.35 0.17 1.83 0.00 -0.49 0.00 0.00 175.26 177.11 1yru n ALA 309 N -0.11 6.01 -1.73 5.21 0.00 -1.26 -5.00 120.51 123.63 1yru n ALA 309 Ca 0.03 -3.56 -0.42 0.00 0.00 0.00 0.00 53.44 49.49 1yru n ALA 309 Cb 0.53 -1.41 -0.01 0.00 0.00 0.00 0.00 19.45 18.56 1yru n ALA 309 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 1yru n ASP 310 N -0.87 3.20 -2.33 0.00 3.85 -1.26 -4.90 116.55 114.24 1yru n ASP 310 Ca 0.58 1.21 -0.18 0.00 -0.71 0.00 0.00 54.79 55.69 1yru n ASP 310 Cb 0.74 -1.54 0.02 0.00 -1.35 0.00 0.00 41.12 39.00 1yru n ASP 310 CO 0.00 0.00 0.00 -1.84 -1.01 0.00 0.00 177.20 174.35 1yru n GLU 311 N 0.75 2.97 -3.47 0.11 0.28 -1.26 -4.82 120.64 115.21 1yru n GLU 311 Ca 0.04 -4.01 0.01 0.00 -0.16 0.00 0.00 57.16 53.04 1yru n GLU 311 Cb 0.37 -2.04 -0.05 0.00 1.43 0.00 0.00 31.44 31.15 1yru n GLU 311 CO 0.00 0.00 0.00 0.21 -0.16 0.00 0.00 177.13 177.18 1yru s LYS 312 N -3.60 0.30 -0.03 3.44 2.20 -1.26 -4.48 119.74 116.31 1yru s LYS 312 Ca 0.43 0.69 0.08 0.00 -0.36 0.00 0.00 55.97 56.81 1yru s LYS 312 Cb 0.39 0.33 -0.02 0.00 -1.51 0.00 0.00 37.83 37.02 1yru s LYS 312 CO -0.02 -0.09 -0.25 0.42 -0.36 0.00 0.00 175.35 175.05 1yru s ILE 313 N 2.12 2.12 -0.19 5.43 1.09 -0.43 -4.51 121.20 126.83 1yru s ILE 313 Ca -0.04 -1.08 -0.21 0.00 -1.10 0.00 0.00 60.65 58.21 1yru s ILE 313 Cb -0.05 -1.74 -0.02 0.00 -1.06 0.00 0.00 42.46 39.59 1yru s ILE 313 CO -0.17 0.58 0.66 0.12 -0.10 0.00 0.00 174.94 176.03 1yru s PHE 314 N -0.57 3.38 -0.08 3.97 5.36 0.27 -1.28 117.98 129.04 1yru s PHE 314 Ca 0.09 0.97 0.04 0.00 -0.96 0.00 0.00 56.93 57.07 1yru s PHE 314 Cb -0.10 -2.83 -0.01 0.00 -0.34 0.00 0.00 43.02 39.74 1yru s PHE 314 CO -0.00 -0.18 -0.20 0.08 -1.46 0.00 0.00 175.22 173.46 1yru s VAL 315 N 1.92 2.47 -0.22 3.12 1.01 0.22 -0.78 120.40 128.15 1yru s VAL 315 Ca 0.30 -0.90 0.00 0.00 0.00 0.00 0.00 61.98 61.38 1yru s VAL 315 Cb -0.16 -1.96 0.05 0.00 0.00 0.00 0.00 36.38 34.32 1yru s VAL 315 CO 0.11 0.56 -0.05 -0.69 0.00 0.00 0.00 175.10 175.02 1yru s VAL 316 N -0.01 1.40 0.71 2.92 1.01 -0.10 -0.17 120.40 126.16 1yru s VAL 316 Ca -0.06 -1.05 -0.12 0.00 0.00 0.00 0.00 61.98 60.74 1yru s VAL 316 Cb -0.15 -1.65 0.02 0.00 0.00 0.00 0.00 36.38 34.61 1yru s VAL 316 CO 0.05 -0.04 1.08 -0.44 0.00 0.00 0.00 175.10 175.75 1yru s SER 317 N 1.47 5.02 0.61 3.32 0.01 -0.73 -0.97 113.70 122.44 1yru s SER 317 Ca -0.04 1.80 0.41 0.00 1.31 0.00 0.00 55.95 59.43 1yru s SER 317 Cb -0.18 -2.52 2.21 0.00 0.21 0.00 0.00 66.02 65.74 1yru s SER 317 CO -0.07 -1.69 2.25 0.00 0.41 0.00 0.00 173.24 174.14 1yru h ALA 318 N -0.58 1.01 0.00 1.44 0.00 -1.82 0.64 119.26 119.95 1yru h ALA 318 Ca -0.45 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.46 1yru h ALA 318 Cb 1.23 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.02 1yru h ALA 318 CO 0.54 -0.01 -0.27 0.25 0.00 0.00 0.00 179.25 179.76 1yru n THR 319 N -2.94 0.18 0.00 0.00 -2.24 -1.26 -4.09 114.28 103.93 1yru n THR 319 Ca -0.03 -0.11 0.00 0.00 -2.27 0.00 0.00 64.05 61.65 1yru n THR 319 Cb 0.08 -0.23 0.00 0.00 -2.10 0.00 0.00 70.33 68.08 1yru n THR 319 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1yru n GLY 320 N 1.43 3.43 3.76 3.38 0.00 0.22 -5.02 105.19 112.38 1yru n GLY 320 Ca 0.06 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.69 1yru n GLY 320 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1yru s GLU 321 N -0.85 3.35 0.10 1.61 2.02 -1.26 -4.72 118.70 118.94 1yru s GLU 321 Ca 0.00 2.20 0.08 0.00 0.02 0.00 0.00 54.97 57.27 1yru s GLU 321 Cb 0.00 -2.36 -0.03 0.00 0.10 0.00 0.00 34.13 31.83 1yru s GLU 321 CO 0.00 -1.01 -0.22 -1.54 0.02 0.00 0.00 175.26 172.51 1yru s SER 322 N -0.93 2.62 0.17 -0.19 1.04 -1.26 -1.77 113.70 113.39 1yru s SER 322 Ca 0.68 -0.67 -0.23 0.00 0.48 0.00 0.00 55.95 56.21 1yru s SER 322 Cb -0.39 -0.16 0.06 0.00 0.10 0.00 0.00 66.02 65.63 1yru s SER 322 CO 0.47 0.09 0.67 0.00 0.98 0.00 0.00 173.24 175.45 1yru s GLN 323 N -1.80 1.36 -0.12 4.02 -2.07 0.76 -4.87 119.66 116.94 1yru s GLN 323 Ca 0.07 -0.59 -0.09 0.00 -1.82 0.00 0.00 55.36 52.93 1yru s GLN 323 Cb -0.10 0.57 -0.04 0.00 -1.09 0.00 0.00 33.01 32.35 1yru s GLN 323 CO 0.04 -0.61 0.19 -1.64 -1.32 0.00 0.00 175.29 171.95 1yru s MET 324 N -3.72 3.68 -0.01 9.60 -1.94 -1.26 0.72 119.30 126.37 1yru s MET 324 Ca 0.04 -0.05 0.03 0.00 -1.71 0.00 0.00 55.69 54.01 1yru s MET 324 Cb -0.02 -3.25 -0.01 0.00 2.01 0.00 0.00 34.83 33.56 1yru s MET 324 CO -0.07 0.66 -0.11 -0.51 -0.01 0.00 0.00 175.02 174.97 1yru s LEU 325 N -0.72 1.99 0.60 -0.03 1.43 -0.40 -4.97 118.68 116.58 1yru s LEU 325 Ca 0.15 -0.20 -0.12 0.00 -1.03 0.00 0.00 54.13 52.93 1yru s LEU 325 Cb -0.13 -0.58 -0.05 0.00 0.03 0.00 0.00 46.19 45.46 1yru s LEU 325 CO 0.04 0.13 1.01 0.42 0.23 0.00 0.00 176.35 178.19 1yru s THR 326 N -0.20 4.69 0.09 5.49 -4.23 -1.26 -1.32 115.64 118.91 1yru s THR 326 Ca 0.03 0.91 0.22 0.00 -1.18 0.00 0.00 61.69 61.66 1yru s THR 326 Cb -0.05 -3.85 0.22 0.00 1.34 0.00 0.00 72.50 70.16 1yru s THR 326 CO -0.00 -1.07 1.62 -0.09 -0.54 0.00 0.00 174.62 174.54 1yru h ARG 327 N -0.11 0.00 0.09 3.99 2.43 -1.94 -1.42 114.38 117.42 1yru h ARG 327 Ca -0.45 0.00 -0.23 0.00 -0.81 0.00 0.00 59.98 58.50 1yru h ARG 327 Cb 1.19 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 30.73 1yru h ARG 327 CO 0.62 0.00 -1.17 0.78 -1.51 0.00 0.00 179.97 178.69 1yru h GLY 328 N 0.00 0.21 2.00 2.80 0.00 -1.98 -3.23 103.07 102.87 1yru h GLY 328 Ca 0.00 -0.53 0.00 0.00 0.00 0.00 0.00 47.33 46.80 1yru h GLY 328 CO 0.00 0.46 0.00 -1.06 0.00 0.00 0.00 176.54 175.94 1yru n GLN 329 N -4.10 0.07 -0.02 4.80 6.02 -0.89 -2.77 117.38 120.49 1yru n GLN 329 Ca -0.23 0.27 -0.15 0.00 -0.01 0.00 0.00 57.00 56.88 1yru n GLN 329 Cb 0.81 -1.62 -0.03 0.00 1.02 0.00 0.00 30.24 30.41 1yru n GLN 329 CO 0.00 0.00 0.00 1.25 -1.01 0.00 0.00 177.06 177.30 1yru h LEU 330 N 0.00 0.85 -0.25 1.08 5.85 -1.30 -1.49 115.31 120.05 1yru h LEU 330 Ca 0.00 -0.52 -0.05 0.00 0.84 0.00 0.00 57.88 58.16 1yru h LEU 330 Cb 0.34 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 41.11 1yru h LEU 330 CO 0.00 1.30 -0.02 0.11 -0.34 0.00 0.00 178.44 179.48 1yru h LYS 331 N 0.53 0.46 -0.62 1.25 1.57 -1.55 -1.70 116.57 116.50 1yru h LYS 331 Ca -0.02 -0.16 0.05 0.00 -1.87 0.00 0.00 60.65 58.65 1yru h LYS 331 Cb 1.29 -0.03 -0.05 0.00 0.08 0.00 0.00 32.23 33.51 1yru h LYS 331 CO 0.14 0.65 0.34 0.93 -0.57 0.00 0.00 179.45 180.94 1yru h GLU 332 N 0.22 0.62 0.54 3.15 5.08 -1.54 -1.82 114.58 120.83 1yru h GLU 332 Ca 0.07 -0.04 -0.03 0.00 -1.00 0.00 0.00 59.36 58.36 1yru h GLU 332 Cb 0.46 -0.14 0.01 0.00 0.50 0.00 0.00 28.75 29.58 1yru h GLU 332 CO 0.02 0.41 -0.26 -0.92 -1.00 0.00 0.00 179.01 177.26 1yru h TYR 333 N 0.64 -0.67 -0.64 4.33 3.20 -1.08 -1.27 116.97 121.48 1yru h TYR 333 Ca 0.28 -0.02 0.13 0.00 3.14 0.00 0.00 58.73 62.26 1yru h TYR 333 Cb 0.16 0.22 -0.11 0.00 1.54 0.00 0.00 36.73 38.54 1yru h TYR 333 CO -0.08 -0.41 -0.01 0.82 -1.64 0.00 0.00 178.16 176.83 1yru h ILE 334 N -0.75 0.46 -0.90 1.81 2.04 -1.02 0.58 117.51 119.74 1yru h ILE 334 Ca -0.07 -0.04 0.02 0.00 1.00 0.00 0.00 64.86 65.77 1yru h ILE 334 Cb 0.57 0.35 -0.05 0.00 -0.74 0.00 0.00 36.82 36.94 1yru h ILE 334 CO 0.12 0.02 0.59 1.23 0.00 0.00 0.00 178.15 180.11 1yru h GLY 335 N 0.10 1.28 1.00 5.37 0.00 -1.17 0.94 103.07 110.60 1yru h GLY 335 Ca 0.33 -0.46 -0.03 0.00 0.00 0.00 0.00 47.33 47.18 1yru h GLY 335 CO -0.56 0.42 -0.27 1.46 0.00 0.00 0.00 176.54 177.59 1yru h GLN 336 N 1.18 -0.73 -0.23 4.80 4.20 0.10 -2.45 115.11 121.97 1yru h GLN 336 Ca 0.34 0.05 -0.03 0.00 0.06 0.00 0.00 58.65 59.08 1yru h GLN 336 Cb -0.07 0.17 -0.01 0.00 0.30 0.00 0.00 27.48 27.86 1yru h GLN 336 CO -0.09 -0.48 0.02 1.96 -0.67 0.00 0.00 178.83 179.57 1yru h GLN 337 N -0.77 0.33 -0.39 1.46 1.08 -0.59 -1.53 115.11 114.69 1yru h GLN 337 Ca -0.08 -0.05 -0.07 0.00 -1.45 0.00 0.00 58.65 57.00 1yru h GLN 337 Cb 0.59 -0.06 -0.02 0.00 -0.05 0.00 0.00 27.48 27.94 1yru h GLN 337 CO 0.13 0.34 -0.04 0.00 -0.95 0.00 0.00 178.83 178.30 1yru h ARG 338 N 0.33 0.65 0.00 1.46 3.08 0.11 -0.96 114.38 119.05 1yru h ARG 338 Ca 0.08 -0.17 -0.02 0.00 0.07 0.00 0.00 59.98 59.94 1yru h ARG 338 Cb 0.18 -0.08 -0.00 0.00 0.08 0.00 0.00 29.97 30.16 1yru h ARG 338 CO 0.00 0.70 -0.08 0.78 -1.07 0.00 0.00 179.97 180.30 1yru h GLY 339 N 0.94 0.00 -1.45 0.04 0.00 -0.80 -0.81 103.07 100.98 1yru h GLY 339 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.45 1yru h GLY 339 CO 0.02 0.00 0.00 1.18 0.00 0.00 0.00 176.54 177.74 1yru n GLU 340 N -3.71 2.04 0.00 4.80 1.02 -0.44 -4.94 120.64 119.41 1yru n GLU 340 Ca -0.02 -1.57 0.00 0.00 -0.02 0.00 0.00 57.16 55.54 1yru n GLU 340 Cb 0.19 -1.43 0.00 0.00 -0.02 0.00 0.00 31.44 30.18 1yru n GLU 340 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1yru n GLY 341 N 1.27 0.65 3.75 0.62 0.00 -0.31 -4.95 105.19 106.22 1yru n GLY 341 Ca 0.17 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.79 1yru n GLY 341 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1yru s TYR 342 N -2.00 3.80 0.10 1.61 1.51 -0.76 -0.23 117.35 121.39 1yru s TYR 342 Ca 0.00 1.60 -0.10 0.00 -1.01 0.00 0.00 57.07 57.56 1yru s TYR 342 Cb 0.00 -2.86 -0.06 0.00 -0.11 0.00 0.00 41.96 38.93 1yru s TYR 342 CO 0.00 0.33 0.42 0.08 -1.11 0.00 0.00 175.55 175.27 1yru s VAL 343 N -0.35 5.07 -0.04 0.71 1.01 0.28 -3.94 120.40 123.14 1yru s VAL 343 Ca 0.40 0.45 -0.06 0.00 0.00 0.00 0.00 61.98 62.77 1yru s VAL 343 Cb -0.22 -3.65 0.01 0.00 0.00 0.00 0.00 36.38 32.52 1yru s VAL 343 CO 0.26 0.24 0.16 0.12 0.00 0.00 0.00 175.10 175.88 1yru s PHE 344 N -1.45 -0.12 0.03 5.22 5.36 -1.26 -3.90 117.98 121.86 1yru s PHE 344 Ca 0.35 0.27 0.02 0.00 -0.96 0.00 0.00 56.93 56.61 1yru s PHE 344 Cb -0.14 0.03 -0.02 0.00 -0.34 0.00 0.00 43.02 42.55 1yru s PHE 344 CO 0.19 -0.15 -0.07 1.52 -1.46 0.00 0.00 175.22 175.25 1yru s TYR 345 N -0.37 0.57 0.32 10.12 -0.85 -1.26 -5.10 117.35 120.78 1yru s TYR 345 Ca -0.05 -0.42 0.08 0.00 -0.52 0.00 0.00 57.07 56.17 1yru s TYR 345 Cb -0.03 -0.35 -0.03 0.00 0.38 0.00 0.00 41.96 41.92 1yru s TYR 345 CO 0.01 -0.08 0.21 -1.83 -1.52 0.00 0.00 175.55 172.33 1yru s GLU 346 N -1.27 2.61 0.06 -3.49 -1.05 -1.26 -4.95 118.70 109.35 1yru s GLU 346 Ca -0.08 -1.35 -0.35 0.00 -0.15 0.00 0.00 54.97 53.03 1yru s GLU 346 Cb -0.08 -2.37 -0.15 0.00 -0.44 0.00 0.00 34.13 31.09 1yru s GLU 346 CO 0.00 0.17 1.56 -1.71 0.95 0.00 0.00 175.26 176.23 1yru n ASN 347 N -1.23 2.62 0.25 0.83 2.85 -1.25 -4.85 115.26 114.48 1yru n ASN 347 Ca -0.03 1.08 0.17 0.00 -0.11 0.00 0.00 54.58 55.68 1yru n ASN 347 Cb 0.60 -1.32 0.86 0.00 1.24 0.00 0.00 39.78 41.16 1yru n ASN 347 CO 0.00 0.00 0.00 0.03 -2.11 0.00 0.00 177.26 175.18 1yru h ARG 348 N 6.06 0.00 -0.59 1.20 3.08 -1.94 -1.73 114.38 120.46 1yru h ARG 348 Ca -0.46 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.59 1yru h ARG 348 Cb 1.29 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.34 1yru h ARG 348 CO 0.87 0.00 0.00 0.00 -1.07 0.00 0.00 179.97 179.77 1yru n ALA 349 N -1.94 2.54 0.04 0.04 0.00 -1.26 -4.29 120.51 115.64 1yru n ALA 349 Ca -0.02 -1.06 -0.19 0.00 0.00 0.00 0.00 53.44 52.17 1yru n ALA 349 Cb 0.10 -0.97 -0.13 0.00 0.00 0.00 0.00 19.45 18.45 1yru n ALA 349 CO 0.00 0.00 0.00 1.88 0.00 0.00 0.00 177.50 179.38 1yru h TYR 350 N 3.35 0.64 0.00 0.00 0.99 -1.65 -3.31 116.97 117.00 1yru h TYR 350 Ca 0.00 -0.41 0.00 0.00 2.00 0.00 0.00 58.73 60.32 1yru h TYR 350 Cb 0.87 -0.05 0.00 0.00 1.00 0.00 0.00 36.73 38.55 1yru h TYR 350 CO 0.44 1.28 0.00 0.41 -0.00 0.00 0.00 178.16 180.28 1yru n GLY 351 N 1.40 -2.80 0.20 3.88 0.00 -1.26 0.06 105.19 106.67 1yru n GLY 351 Ca -0.13 0.22 0.05 0.00 0.00 0.00 0.00 46.02 46.16 1yru n GLY 351 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1yru h VAL 352 N 0.00 0.00 -0.02 1.61 2.07 -1.83 1.63 116.25 119.72 1yru h VAL 352 Ca 0.00 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.52 1yru h VAL 352 Cb 0.00 0.20 0.00 0.00 -1.52 0.00 0.00 31.29 29.97 1yru h VAL 352 CO 0.00 0.00 -0.24 0.00 0.02 0.00 0.00 177.57 177.35 1yru n ALA 353 N -1.48 2.99 -1.07 1.67 0.00 -0.65 -4.98 120.51 117.00 1yru n ALA 353 Ca -0.01 -0.59 -0.00 0.00 0.00 0.00 0.00 53.44 52.84 1yru n ALA 353 Cb 0.55 -0.61 -0.00 0.00 0.00 0.00 0.00 19.45 19.39 1yru n ALA 353 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1yru n GLY 354 N 1.15 0.41 1.07 0.00 0.00 0.56 -4.94 105.19 103.43 1yru n GLY 354 Ca 0.08 -1.07 -0.03 0.00 0.00 0.00 0.00 46.02 45.01 1yru n GLY 354 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1yru n LYS 355 N -2.88 2.15 -2.21 1.61 4.76 0.11 -4.99 118.16 116.71 1yru n LYS 355 Ca -0.00 -3.53 -0.40 0.00 -2.87 0.00 0.00 58.31 51.51 1yru n LYS 355 Cb 0.04 -1.77 -0.02 0.00 -1.84 0.00 0.00 35.03 31.44 1yru n LYS 355 CO 0.00 0.00 0.00 0.45 -1.37 0.00 0.00 177.40 176.48 1yru s SER 356 N -3.32 6.69 0.00 4.39 0.15 -1.24 -4.79 113.70 115.58 1yru s SER 356 Ca 0.42 2.52 0.26 0.00 0.70 0.00 0.00 55.95 59.85 1yru s SER 356 Cb 0.38 -2.63 1.12 0.00 -1.71 0.00 0.00 66.02 63.18 1yru s SER 356 CO -0.04 -0.57 1.77 0.18 1.20 0.00 0.00 173.24 175.78 1yru n LEU 357 N 0.52 1.18 -4.72 3.45 4.77 -1.26 -4.88 117.00 116.07 1yru n LEU 357 Ca 0.02 -0.43 -0.35 0.00 -0.03 0.00 0.00 56.01 55.22 1yru n LEU 357 Cb 0.44 -0.03 -0.09 0.00 -2.33 0.00 0.00 43.42 41.42 1yru n LEU 357 CO 0.55 0.21 -0.28 -0.36 -1.33 0.00 0.00 177.39 176.18 1yru s PHE 358 N -1.95 3.22 -0.68 -1.77 0.40 -1.26 -4.88 117.98 111.06 1yru s PHE 358 Ca 0.38 0.23 0.02 0.00 -0.60 0.00 0.00 56.93 56.95 1yru s PHE 358 Cb 0.20 -1.79 0.37 0.00 0.51 0.00 0.00 43.02 42.31 1yru s PHE 358 CO 0.31 0.51 1.43 -0.25 0.70 0.00 0.00 175.22 177.93 1yru n ASP 359 N 1.90 5.83 -1.79 1.36 9.92 -1.26 -5.02 116.55 127.49 1yru n ASP 359 Ca -0.18 -3.74 -0.04 0.00 -0.53 0.00 0.00 54.79 50.30 1yru n ASP 359 Cb 0.54 -0.76 -0.01 0.00 -0.64 0.00 0.00 41.12 40.24 1yru n ASP 359 CO 0.00 0.00 0.00 -0.90 0.13 0.00 0.00 177.20 176.43 1yru n ASP 360 N -0.36 0.73 -0.03 -2.24 3.85 -1.26 -5.06 116.55 112.18 1yru n ASP 360 Ca 0.42 -1.40 -0.01 0.00 -0.71 0.00 0.00 54.79 53.10 1yru n ASP 360 Cb 0.42 0.22 -0.01 0.00 -1.35 0.00 0.00 41.12 40.40 1yru n ASP 360 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 1yru n GLY 361 N 1.33 -2.94 2.25 6.12 0.00 -1.26 -4.79 105.19 105.90 1yru n GLY 361 Ca -0.00 0.60 0.00 0.00 0.00 0.00 0.00 46.02 46.62 1yru n GLY 361 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1yru n LEU 362 N -3.11 0.20 0.00 0.99 0.00 -1.26 -4.96 117.00 108.86 1yru n LEU 362 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56.01 56.01 1yru n LEU 362 Cb 0.02 -0.87 0.00 0.00 0.00 0.00 0.00 43.42 42.57 1yru n LEU 362 CO -0.01 -0.20 0.00 0.61 0.00 0.00 0.00 177.39 177.79 1yru n GLY 363 N -2.19 5.21 0.09 -3.96 0.00 -1.26 -5.18 105.19 97.91 1yru n GLY 363 Ca 0.00 -1.56 0.01 0.00 0.00 0.00 0.00 46.02 44.48 1yru n GLY 363 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32