#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1cru s VAL 2 N 0.00 4.73 0.49 2.53 1.01 -1.26 -1.33 120.40 126.56 1cru s VAL 2 Ca 0.00 1.31 -0.24 0.00 0.00 0.00 0.00 61.98 63.05 1cru s VAL 2 Cb 0.00 -3.95 -0.07 0.00 0.00 0.00 0.00 36.38 32.36 1cru s VAL 2 CO 0.00 0.51 1.41 -2.65 0.00 0.00 0.00 175.10 174.37 1cru n PRO 3 N 1.98 2.05 -2.41 2.72 -0.02 -1.26 -4.98 135.00 133.07 1cru n PRO 3 Ca -0.09 0.74 -0.33 0.00 -2.02 0.00 0.00 63.50 61.81 1cru n PRO 3 Cb 0.50 -2.61 -0.03 0.00 -0.02 0.00 0.00 33.50 31.34 1cru n PRO 3 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1cru s LEU 4 N -2.93 3.67 0.55 2.45 1.43 -1.26 -5.07 118.68 117.53 1cru s LEU 4 Ca 0.65 1.66 -0.06 0.00 -1.03 0.00 0.00 54.13 55.36 1cru s LEU 4 Cb -0.44 -4.52 -0.01 0.00 0.03 0.00 0.00 46.19 41.25 1cru s LEU 4 CO 0.54 -0.67 0.87 0.42 0.23 0.00 0.00 176.35 177.74 1cru s THR 5 N -2.47 4.14 0.38 5.49 -4.23 -1.26 -4.92 115.64 112.77 1cru s THR 5 Ca 0.61 0.11 0.11 0.00 -1.18 0.00 0.00 61.69 61.34 1cru s THR 5 Cb -0.11 -3.61 0.33 0.00 1.34 0.00 0.00 72.50 70.44 1cru s THR 5 CO 0.28 -0.63 1.90 -0.65 -0.54 0.00 0.00 174.62 174.98 1cru h PRO 6 N -0.04 0.60 -0.28 3.99 0.11 -1.94 -0.25 132.00 134.18 1cru h PRO 6 Ca -0.46 -0.04 -0.11 0.00 0.11 0.00 0.00 66.00 65.50 1cru h PRO 6 Cb 1.24 -0.13 -0.01 0.00 0.11 0.00 0.00 31.00 32.20 1cru h PRO 6 CO 0.61 0.40 -0.30 1.03 -0.21 0.00 0.00 178.00 179.53 1cru h SER 7 N 0.62 0.59 -0.16 -2.05 0.87 -1.94 -0.66 113.55 110.81 1cru h SER 7 Ca 0.41 -0.22 -0.15 0.00 -1.23 0.00 0.00 61.79 60.59 1cru h SER 7 Cb 0.70 -0.16 -0.01 0.00 -0.44 0.00 0.00 62.40 62.49 1cru h SER 7 CO -0.17 0.85 -0.44 1.56 -0.53 0.00 0.00 176.83 178.11 1cru h GLN 8 N 0.49 0.72 -0.33 2.24 4.20 -1.45 -2.65 115.11 118.32 1cru h GLN 8 Ca 0.06 -0.39 -0.11 0.00 0.06 0.00 0.00 58.65 58.27 1cru h GLN 8 Cb 0.76 0.02 -0.01 0.00 0.30 0.00 0.00 27.48 28.56 1cru h GLN 8 CO 0.06 1.01 -0.22 0.74 -0.67 0.00 0.00 178.83 179.75 1cru h PHE 9 N 0.58 0.87 -0.28 2.96 -1.00 -1.15 -3.17 116.94 115.74 1cru h PHE 9 Ca 0.04 -0.23 0.02 0.00 2.81 0.00 0.00 57.97 60.60 1cru h PHE 9 Cb 0.99 -0.19 -0.01 0.00 3.61 0.00 0.00 35.95 40.34 1cru h PHE 9 CO 0.05 0.97 0.19 0.00 -1.61 0.00 0.00 178.31 177.91 1cru h ALA 10 N 0.76 1.87 0.00 2.45 0.00 -1.02 -2.22 119.26 121.10 1cru h ALA 10 Ca 0.07 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.94 1cru h ALA 10 Cb 0.78 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.47 1cru h ALA 10 CO 0.06 0.10 -0.12 -0.22 0.00 0.00 0.00 179.25 179.08 1cru h LYS 11 N 0.32 0.00 -3.44 0.00 1.63 -1.44 -3.39 116.57 110.24 1cru h LYS 11 Ca 0.11 0.00 -0.62 0.00 -0.85 0.00 0.00 60.65 59.29 1cru h LYS 11 Cb 0.05 0.00 0.01 0.00 -0.60 0.00 0.00 32.23 31.69 1cru h LYS 11 CO -0.02 0.12 3.32 0.00 -3.45 0.00 0.00 179.45 179.42 1cru n ALA 12 N -2.15 6.19 0.76 5.00 0.00 -0.84 -4.66 120.51 124.82 1cru n ALA 12 Ca 0.01 -3.29 0.12 0.00 0.00 0.00 0.00 53.44 50.28 1cru n ALA 12 Cb 0.43 -3.36 0.28 0.00 0.00 0.00 0.00 19.45 16.80 1cru n ALA 12 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1cru n LYS 13 N 4.58 0.16 -3.37 0.00 4.76 -1.26 -0.61 118.16 122.43 1cru n LYS 13 Ca 0.63 0.06 -0.19 0.00 -2.87 0.00 0.00 58.31 55.95 1cru n LYS 13 Cb 0.26 -1.62 0.05 0.00 -1.84 0.00 0.00 35.03 31.89 1cru n LYS 13 CO 0.00 0.00 0.00 0.43 -1.37 0.00 0.00 177.40 176.46 1cru n SER 14 N -1.86 -6.36 0.00 4.39 7.64 -1.26 -4.39 113.62 111.77 1cru n SER 14 Ca 0.05 -0.74 0.08 0.00 1.01 0.00 0.00 58.87 59.27 1cru n SER 14 Cb 0.39 -4.63 0.46 0.00 -1.01 0.00 0.00 64.21 59.43 1cru n SER 14 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 1cru n GLU 15 N -3.35 0.38 -0.17 1.43 4.71 -1.26 -2.42 120.64 119.97 1cru n GLU 15 Ca -0.07 0.07 0.09 0.00 -0.01 0.00 0.00 57.16 57.24 1cru n GLU 15 Cb 0.60 -1.50 0.27 0.00 -1.01 0.00 0.00 31.44 29.80 1cru n GLU 15 CO 0.00 0.00 0.00 0.27 0.09 0.00 0.00 177.13 177.49 1cru n ASN 16 N -1.15 2.34 -4.22 1.62 6.94 -1.26 -4.87 115.26 114.65 1cru n ASN 16 Ca 0.10 -1.89 -0.22 0.00 -0.02 0.00 0.00 54.58 52.54 1cru n ASN 16 Cb 0.10 -0.22 -0.13 0.00 -2.36 0.00 0.00 39.78 37.16 1cru n ASN 16 CO 0.00 0.00 0.00 -0.36 -1.03 0.00 0.00 177.26 175.87 1cru s PHE 17 N -1.55 1.57 -0.07 -2.53 0.40 -1.01 -1.16 117.98 113.61 1cru s PHE 17 Ca 0.33 -0.40 -0.15 0.00 -0.60 0.00 0.00 56.93 56.11 1cru s PHE 17 Cb 0.18 -0.90 -0.05 0.00 0.51 0.00 0.00 43.02 42.76 1cru s PHE 17 CO 0.25 0.11 0.38 -0.51 0.70 0.00 0.00 175.22 176.14 1cru s ASP 18 N -1.51 6.66 -0.16 1.36 1.01 0.43 -4.87 116.67 119.60 1cru s ASP 18 Ca 0.04 0.79 -0.06 0.00 0.71 0.00 0.00 52.55 54.03 1cru s ASP 18 Cb -0.09 -2.23 -0.04 0.00 1.01 0.00 0.00 42.92 41.57 1cru s ASP 18 CO 0.03 0.20 0.05 -0.75 0.21 0.00 0.00 175.17 174.90 1cru s LYS 19 N -0.32 3.75 -0.06 8.23 2.20 -1.26 -1.01 119.74 131.28 1cru s LYS 19 Ca 0.22 -0.36 -0.01 0.00 -0.36 0.00 0.00 55.97 55.46 1cru s LYS 19 Cb -0.15 -3.11 0.03 0.00 -1.51 0.00 0.00 37.83 33.09 1cru s LYS 19 CO 0.10 0.37 0.02 0.21 -0.36 0.00 0.00 175.35 175.69 1cru s LYS 20 N 0.07 0.37 -0.36 4.03 2.20 -0.08 -5.01 119.74 120.97 1cru s LYS 20 Ca 0.04 0.19 -0.25 0.00 -0.36 0.00 0.00 55.97 55.59 1cru s LYS 20 Cb -0.12 -0.78 0.01 0.00 -1.51 0.00 0.00 37.83 35.42 1cru s LYS 20 CO 0.01 -0.29 0.88 0.08 -0.36 0.00 0.00 175.35 175.67 1cru s VAL 21 N 1.93 4.64 -0.05 4.02 1.01 -1.26 -0.51 120.40 130.18 1cru s VAL 21 Ca 0.03 1.15 -0.17 0.00 0.00 0.00 0.00 61.98 63.00 1cru s VAL 21 Cb -0.12 -4.29 -0.31 0.00 0.00 0.00 0.00 36.38 31.66 1cru s VAL 21 CO -0.04 -0.47 0.77 0.40 0.00 0.00 0.00 175.10 175.76 1cru h ILE 22 N 5.77 1.21 -3.42 2.22 2.04 -1.32 -3.48 117.51 120.53 1cru h ILE 22 Ca -0.23 -2.53 -0.13 0.00 1.00 0.00 0.00 64.86 62.97 1cru h ILE 22 Cb 1.08 2.94 -0.20 0.00 -0.74 0.00 0.00 36.82 39.91 1cru h ILE 22 CO 0.96 0.76 -0.42 -0.76 0.00 0.00 0.00 178.15 178.69 1cru s LEU 23 N -7.62 1.35 0.18 1.44 1.43 -1.11 -4.90 118.68 109.45 1cru s LEU 23 Ca -0.15 -0.19 -0.01 0.00 -1.03 0.00 0.00 54.13 52.74 1cru s LEU 23 Cb 0.03 0.89 -0.04 0.00 0.03 0.00 0.00 46.19 47.10 1cru s LEU 23 CO 0.84 -0.44 0.13 -0.44 0.23 0.00 0.00 176.35 176.66 1cru s SER 24 N -1.58 0.18 -1.62 2.29 0.01 -1.26 -1.49 113.70 110.23 1cru s SER 24 Ca -0.12 -1.33 -0.03 0.00 1.31 0.00 0.00 55.95 55.79 1cru s SER 24 Cb -0.05 0.37 0.01 0.00 0.21 0.00 0.00 66.02 66.55 1cru s SER 24 CO 0.01 -0.82 0.30 -3.20 0.41 0.00 0.00 173.24 169.93 1cru n ASN 25 N -0.23 -5.81 -4.76 2.44 5.15 0.39 -4.89 115.26 107.54 1cru n ASN 25 Ca -0.00 -0.14 -0.32 0.00 -0.60 0.00 0.00 54.58 53.52 1cru n ASN 25 Cb 0.65 -4.77 0.09 0.00 -0.53 0.00 0.00 39.78 35.21 1cru n ASN 25 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 1cru s LEU 26 N -6.33 3.14 -0.89 1.20 1.43 0.03 -4.95 118.68 112.31 1cru s LEU 26 Ca 0.15 1.94 -0.15 0.00 -1.03 0.00 0.00 54.13 55.04 1cru s LEU 26 Cb -0.07 -4.54 0.20 0.00 0.03 0.00 0.00 46.19 41.81 1cru s LEU 26 CO 0.19 -2.02 0.91 0.21 0.23 0.00 0.00 176.35 175.87 1cru s ASN 27 N -3.01 6.78 -1.10 2.29 3.04 -1.26 -4.55 114.94 117.13 1cru s ASN 27 Ca 0.64 -2.60 -0.08 0.00 0.04 0.00 0.00 52.86 50.86 1cru s ASN 27 Cb -0.19 -2.27 -0.04 0.00 -1.54 0.00 0.00 41.25 37.20 1cru s ASN 27 CO 0.51 -0.69 0.88 0.29 -3.04 0.00 0.00 177.10 175.06 1cru n LYS 28 N 4.63 -2.60 -1.79 0.43 5.02 -1.26 -3.89 118.16 118.70 1cru n LYS 28 Ca 0.18 0.75 -0.41 0.00 -2.02 0.00 0.00 58.31 56.81 1cru n LYS 28 Cb 0.47 -5.40 -0.01 0.00 -0.02 0.00 0.00 35.03 30.07 1cru n LYS 28 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 1cru s PRO 29 N -4.96 4.12 0.06 1.97 0.04 -1.26 -0.75 135.00 134.23 1cru s PRO 29 Ca 0.39 2.57 0.00 0.00 0.04 0.00 0.00 61.00 64.00 1cru s PRO 29 Cb -0.08 -3.01 0.00 0.00 0.04 0.00 0.00 34.50 31.46 1cru s PRO 29 CO 0.77 -0.59 0.00 1.58 0.04 0.00 0.00 177.00 178.80 1cru n HIS 30 N 1.64 -0.33 -4.42 0.56 -0.00 -0.04 -4.78 115.22 107.85 1cru n HIS 30 Ca 0.06 0.06 -0.25 0.00 0.46 0.00 0.00 57.72 58.05 1cru n HIS 30 Cb 0.38 0.17 -0.13 0.00 -0.12 0.00 0.00 29.99 30.29 1cru n HIS 30 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 1cru s ALA 31 N -2.00 1.79 0.03 1.57 0.00 -1.26 -4.54 121.76 117.34 1cru s ALA 31 Ca 0.00 -1.17 0.01 0.00 0.00 0.00 0.00 51.96 50.80 1cru s ALA 31 Cb 0.00 -0.28 -0.02 0.00 0.00 0.00 0.00 23.12 22.81 1cru s ALA 31 CO 0.00 0.37 -0.05 -0.48 0.00 0.00 0.00 175.76 175.60 1cru s LEU 32 N -1.62 2.26 0.02 0.00 2.34 -1.26 -1.27 118.68 119.14 1cru s LEU 32 Ca 0.07 -0.54 -0.00 0.00 0.06 0.00 0.00 54.13 53.71 1cru s LEU 32 Cb -0.10 -0.01 -0.02 0.00 -0.56 0.00 0.00 46.19 45.51 1cru s LEU 32 CO 0.03 -0.27 -0.02 -0.76 -1.06 0.00 0.00 176.35 174.28 1cru s LEU 33 N -1.57 2.16 -0.39 1.48 1.43 0.20 -4.89 118.68 117.11 1cru s LEU 33 Ca -0.12 -0.40 -0.29 0.00 -1.03 0.00 0.00 54.13 52.29 1cru s LEU 33 Cb -0.09 0.11 0.02 0.00 0.03 0.00 0.00 46.19 46.26 1cru s LEU 33 CO -0.01 -0.25 1.13 0.86 0.23 0.00 0.00 176.35 178.32 1cru s TRP 34 N -1.21 2.94 0.70 0.29 -0.11 -1.26 -1.43 118.94 118.87 1cru s TRP 34 Ca -0.13 0.95 -0.13 0.00 1.22 0.00 0.00 56.10 58.01 1cru s TRP 34 Cb -0.08 -4.04 0.02 0.00 -1.50 0.00 0.00 33.47 27.87 1cru s TRP 34 CO -0.01 -1.11 1.10 0.20 -4.62 0.00 0.00 176.95 172.52 1cru s GLY 35 N 2.17 1.96 0.46 5.86 0.00 0.34 -4.92 107.32 113.18 1cru s GLY 35 Ca 0.48 0.43 0.31 0.00 0.00 0.00 0.00 44.72 45.94 1cru s GLY 35 CO 0.23 0.77 1.95 -2.55 0.00 0.00 0.00 173.10 173.50 1cru h PRO 36 N -0.42 0.00 -0.65 2.90 0.11 -1.94 -0.17 132.00 131.82 1cru h PRO 36 Ca -0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 1cru h PRO 36 Cb 1.24 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.35 1cru h PRO 36 CO 0.53 0.00 0.00 -0.40 -0.21 0.00 0.00 178.00 177.92 1cru n ASP 37 N -2.64 3.81 -1.44 -2.05 5.68 -1.26 -4.94 116.55 113.72 1cru n ASP 37 Ca -0.01 -2.00 -0.14 0.00 -0.50 0.00 0.00 54.79 52.14 1cru n ASP 37 Cb 0.12 -0.43 -0.02 0.00 -1.14 0.00 0.00 41.12 39.64 1cru n ASP 37 CO 0.00 0.00 0.00 0.59 -1.33 0.00 0.00 177.20 176.46 1cru n ASN 38 N 1.55 -4.44 -4.72 -1.12 3.02 -0.07 -5.02 115.26 104.46 1cru n ASN 38 Ca 0.23 0.10 -0.23 0.00 -0.03 0.00 0.00 54.58 54.65 1cru n ASN 38 Cb 0.61 -3.47 -0.07 0.00 -0.61 0.00 0.00 39.78 36.25 1cru n ASN 38 CO 0.00 0.00 0.00 -1.10 -2.62 0.00 0.00 177.26 173.54 1cru s GLN 39 N -4.22 2.34 -0.11 3.52 -1.52 -1.26 -4.85 119.66 113.55 1cru s GLN 39 Ca 0.00 -1.56 -0.21 0.00 -1.95 0.00 0.00 55.36 51.64 1cru s GLN 39 Cb 0.00 -2.15 -0.04 0.00 -0.22 0.00 0.00 33.01 30.60 1cru s GLN 39 CO 0.00 0.13 0.61 0.42 -0.25 0.00 0.00 175.29 176.20 1cru s ILE 40 N -2.43 5.09 -0.10 1.08 -1.09 -0.49 -0.51 121.20 122.75 1cru s ILE 40 Ca 0.37 1.23 0.00 0.00 -2.23 0.00 0.00 60.65 60.02 1cru s ILE 40 Cb -0.02 -3.95 -0.02 0.00 -1.58 0.00 0.00 42.46 36.89 1cru s ILE 40 CO 0.22 0.24 -0.10 0.26 -1.23 0.00 0.00 174.94 174.33 1cru s TRP 41 N 1.02 2.86 0.05 3.97 0.52 -0.51 0.08 118.94 126.92 1cru s TRP 41 Ca 0.32 -0.31 -0.06 0.00 0.02 0.00 0.00 56.10 56.07 1cru s TRP 41 Cb -0.16 -1.79 -0.01 0.00 -1.15 0.00 0.00 33.47 30.36 1cru s TRP 41 CO 0.14 0.04 0.10 -0.48 0.02 0.00 0.00 176.95 176.77 1cru s LEU 42 N -0.16 1.78 0.13 2.99 0.05 0.05 -0.63 118.68 122.90 1cru s LEU 42 Ca 0.01 -0.58 0.06 0.00 0.05 0.00 0.00 54.13 53.67 1cru s LEU 42 Cb -0.13 0.65 -0.04 0.00 -2.05 0.00 0.00 46.19 44.62 1cru s LEU 42 CO 0.03 -0.55 0.03 0.42 -0.55 0.00 0.00 176.35 175.73 1cru s THR 43 N -2.87 4.01 -0.32 5.48 -4.23 -0.40 -0.29 115.64 117.02 1cru s THR 43 Ca -0.03 -1.15 -0.06 0.00 -1.18 0.00 0.00 61.69 59.28 1cru s THR 43 Cb 0.00 -2.97 0.03 0.00 1.34 0.00 0.00 72.50 70.90 1cru s THR 43 CO -0.06 -0.00 0.08 -1.61 -0.54 0.00 0.00 174.62 172.49 1cru s GLU 44 N -2.67 2.74 0.25 3.99 2.02 -0.19 -0.86 118.70 123.99 1cru s GLU 44 Ca 0.27 -1.09 -0.06 0.00 0.02 0.00 0.00 54.97 54.12 1cru s GLU 44 Cb -0.11 -3.39 0.27 0.00 0.10 0.00 0.00 34.13 31.01 1cru s GLU 44 CO 0.19 -0.59 1.92 -0.09 0.02 0.00 0.00 175.26 176.72 1cru h ARG 45 N 8.19 1.29 -0.23 1.61 2.43 -1.05 -1.21 114.38 125.41 1cru h ARG 45 Ca -0.26 -0.09 -0.18 0.00 -0.81 0.00 0.00 59.98 58.64 1cru h ARG 45 Cb 1.09 -0.28 -0.00 0.00 -0.42 0.00 0.00 29.97 30.36 1cru h ARG 45 CO 0.60 0.87 -0.58 0.00 -1.51 0.00 0.00 179.97 179.34 1cru h ALA 46 N 1.37 0.54 0.00 2.80 0.00 -1.75 -0.42 119.26 121.80 1cru h ALA 46 Ca 0.35 -0.53 0.00 0.00 0.00 0.00 0.00 54.91 54.74 1cru h ALA 46 Cb -0.13 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.59 1cru h ALA 46 CO -0.07 0.69 -1.82 0.25 0.00 0.00 0.00 179.25 178.29 1cru n THR 47 N -3.97 0.05 -1.00 0.00 -2.24 -1.20 -4.68 114.28 101.24 1cru n THR 47 Ca -0.04 -0.46 -0.00 0.00 -2.27 0.00 0.00 64.05 61.28 1cru n THR 47 Cb 0.64 0.06 -0.00 0.00 -2.10 0.00 0.00 70.33 68.93 1cru n THR 47 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1cru n GLY 48 N 1.28 0.48 3.76 3.38 0.00 -0.46 -4.69 105.19 108.93 1cru n GLY 48 Ca -0.03 -0.15 -0.40 0.00 0.00 0.00 0.00 46.02 45.44 1cru n GLY 48 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1cru s LYS 49 N -0.29 4.77 -0.32 1.61 1.02 -1.23 -0.70 119.74 124.60 1cru s LYS 49 Ca 0.00 1.52 -0.04 0.00 0.02 0.00 0.00 55.97 57.48 1cru s LYS 49 Cb 0.00 -3.18 0.05 0.00 -0.52 0.00 0.00 37.83 34.17 1cru s LYS 49 CO 0.00 0.42 0.04 0.42 -0.92 0.00 0.00 175.35 175.31 1cru s ILE 50 N -1.25 3.30 0.03 2.17 1.01 0.35 -1.02 121.20 125.80 1cru s ILE 50 Ca 0.43 -1.28 -0.00 0.00 0.00 0.00 0.00 60.65 59.80 1cru s ILE 50 Cb -0.26 -2.89 -0.04 0.00 0.01 0.00 0.00 42.46 39.28 1cru s ILE 50 CO 0.32 -0.13 0.15 -0.76 0.00 0.00 0.00 174.94 174.52 1cru s LEU 51 N 1.31 4.17 -0.11 2.97 1.43 0.60 -0.93 118.68 128.11 1cru s LEU 51 Ca -0.04 0.21 0.03 0.00 -1.03 0.00 0.00 54.13 53.30 1cru s LEU 51 Cb -0.20 -2.64 0.01 0.00 0.03 0.00 0.00 46.19 43.39 1cru s LEU 51 CO 0.00 0.22 -0.20 -0.60 0.23 0.00 0.00 176.35 176.00 1cru s ARG 52 N -2.17 2.71 -0.05 1.70 3.52 0.05 -0.77 118.95 123.93 1cru s ARG 52 Ca 0.29 -0.75 0.07 0.00 -0.13 0.00 0.00 55.73 55.21 1cru s ARG 52 Cb -0.13 -2.16 -0.01 0.00 -1.56 0.00 0.00 34.95 31.09 1cru s ARG 52 CO 0.21 0.04 -0.25 0.08 -0.81 0.00 0.00 175.30 174.57 1cru s VAL 53 N 0.69 2.05 -0.08 7.11 1.01 0.11 -1.20 120.40 130.09 1cru s VAL 53 Ca -0.11 -1.07 -0.23 0.00 0.00 0.00 0.00 61.98 60.56 1cru s VAL 53 Cb -0.16 -1.72 -0.04 0.00 0.00 0.00 0.00 36.38 34.46 1cru s VAL 53 CO 0.02 0.57 0.70 0.21 0.00 0.00 0.00 175.10 176.60 1cru s ASN 54 N -0.26 6.96 0.20 3.32 3.84 0.22 -1.40 114.94 127.83 1cru s ASN 54 Ca -0.01 1.16 -0.10 0.00 0.21 0.00 0.00 52.86 54.12 1cru s ASN 54 Cb -0.13 -2.41 0.14 0.00 -0.55 0.00 0.00 41.25 38.30 1cru s ASN 54 CO 0.03 -0.13 1.83 -0.65 -2.79 0.00 0.00 177.10 175.39 1cru h PRO 55 N 6.81 0.99 -0.03 0.43 0.11 -1.90 1.00 132.00 139.42 1cru h PRO 55 Ca -0.40 -0.10 -0.14 0.00 0.11 0.00 0.00 66.00 65.47 1cru h PRO 55 Cb 1.19 -0.20 0.01 0.00 0.11 0.00 0.00 31.00 32.11 1cru h PRO 55 CO 0.76 0.72 -0.52 0.93 -0.21 0.00 0.00 178.00 179.68 1cru h GLU 56 N 0.99 0.40 0.00 1.05 4.39 -1.99 -3.38 114.58 116.03 1cru h GLU 56 Ca 0.26 -0.39 -0.20 0.00 0.34 0.00 0.00 59.36 59.37 1cru h GLU 56 Cb 0.00 0.10 -0.04 0.00 -0.10 0.00 0.00 28.75 28.72 1cru h GLU 56 CO -0.04 1.05 -1.75 -1.13 -1.16 0.00 0.00 179.01 175.98 1cru n SER 57 N -4.27 0.53 0.00 1.42 3.41 -1.22 -4.96 113.62 108.53 1cru n SER 57 Ca -0.10 0.24 0.00 0.00 -0.26 0.00 0.00 58.87 58.75 1cru n SER 57 Cb 0.62 0.61 0.00 0.00 -0.26 0.00 0.00 64.21 65.19 1cru n SER 57 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1cru n GLY 58 N 1.47 0.68 3.71 5.00 0.00 0.35 -4.97 105.19 111.43 1cru n GLY 58 Ca -0.15 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.44 1cru n GLY 58 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1cru n SER 59 N -0.04 3.30 -4.25 1.61 3.41 -1.25 -4.62 113.62 111.79 1cru n SER 59 Ca 0.00 1.16 -0.27 0.00 -0.26 0.00 0.00 58.87 59.50 1cru n SER 59 Cb 0.02 -1.52 -0.15 0.00 -0.26 0.00 0.00 64.21 62.30 1cru n SER 59 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1cru s VAL 60 N -0.29 1.70 -0.02 -3.33 1.01 -1.26 -0.61 120.40 117.60 1cru s VAL 60 Ca 0.63 -1.05 0.02 0.00 0.00 0.00 0.00 61.98 61.58 1cru s VAL 60 Cb -0.56 -1.44 0.00 0.00 0.00 0.00 0.00 36.38 34.38 1cru s VAL 60 CO 0.52 0.36 -0.07 -0.75 0.00 0.00 0.00 175.10 175.16 1cru s LYS 61 N -0.82 0.78 -0.79 2.72 2.20 -0.35 -4.98 119.74 118.50 1cru s LYS 61 Ca 0.08 -0.25 -0.24 0.00 -0.36 0.00 0.00 55.97 55.20 1cru s LYS 61 Cb -0.09 -0.75 0.05 0.00 -1.51 0.00 0.00 37.83 35.54 1cru s LYS 61 CO 0.00 0.09 1.21 0.99 -0.36 0.00 0.00 175.35 177.29 1cru s THR 62 N 0.18 4.01 0.23 3.43 2.01 -1.26 -0.77 115.64 123.48 1cru s THR 62 Ca -0.02 -0.20 -0.04 0.00 0.31 0.00 0.00 61.69 61.73 1cru s THR 62 Cb -0.07 -4.87 0.10 0.00 0.01 0.00 0.00 72.50 67.67 1cru s THR 62 CO 0.00 -1.73 1.72 0.58 -0.69 0.00 0.00 174.62 174.50 1cru h VAL 63 N 6.14 1.25 -2.07 3.82 2.07 -1.38 -3.47 116.25 122.62 1cru h VAL 63 Ca -0.15 -1.05 -0.01 0.00 0.82 0.00 0.00 66.70 66.31 1cru h VAL 63 Cb 1.05 0.82 -0.19 0.00 -1.52 0.00 0.00 31.29 31.45 1cru h VAL 63 CO 1.27 0.38 0.29 0.12 0.02 0.00 0.00 177.57 179.65 1cru s PHE 64 N -5.02 -0.55 -0.21 1.57 5.36 -1.17 -4.43 117.98 113.52 1cru s PHE 64 Ca -0.10 0.83 0.01 0.00 -0.96 0.00 0.00 56.93 56.71 1cru s PHE 64 Cb 0.14 0.45 0.05 0.00 -0.34 0.00 0.00 43.02 43.32 1cru s PHE 64 CO 0.83 -0.58 -0.08 -1.14 -1.46 0.00 0.00 175.22 172.79 1cru s GLN 65 N -1.69 1.83 -0.08 10.12 0.74 -1.26 -0.50 119.66 128.82 1cru s GLN 65 Ca -0.06 -0.90 -0.29 0.00 0.05 0.00 0.00 55.36 54.15 1cru s GLN 65 Cb -0.00 -2.48 -0.06 0.00 1.10 0.00 0.00 33.01 31.56 1cru s GLN 65 CO 0.03 -0.50 1.93 0.08 -0.55 0.00 0.00 175.29 176.28 1cru s VAL 66 N 1.40 3.20 0.55 1.34 1.01 0.12 -4.93 120.40 123.10 1cru s VAL 66 Ca -0.03 0.24 -0.20 0.00 0.00 0.00 0.00 61.98 61.98 1cru s VAL 66 Cb -0.17 -3.19 -0.05 0.00 0.00 0.00 0.00 36.38 32.97 1cru s VAL 66 CO -0.07 -0.06 1.21 -2.84 0.00 0.00 0.00 175.10 173.33 1cru s PRO 67 N 4.93 3.21 -1.84 2.72 0.02 -1.26 -3.74 135.00 139.03 1cru s PRO 67 Ca 0.87 1.84 0.00 0.00 0.02 0.00 0.00 61.00 63.73 1cru s PRO 67 Cb -0.36 -2.08 0.00 0.00 0.02 0.00 0.00 34.50 32.08 1cru s PRO 67 CO 0.36 -1.02 0.00 0.39 -0.33 0.00 0.00 177.00 176.40 1cru n GLU 68 N -1.25 -1.30 -1.89 5.54 1.02 -1.26 -4.96 120.64 116.55 1cru n GLU 68 Ca 0.12 1.08 -0.41 0.00 -0.02 0.00 0.00 57.16 57.92 1cru n GLU 68 Cb 0.49 -5.40 -0.02 0.00 -0.02 0.00 0.00 31.44 26.49 1cru n GLU 68 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 1cru s ILE 69 N -2.72 2.32 -0.19 -3.67 -1.09 -1.25 -4.61 121.20 110.00 1cru s ILE 69 Ca 0.00 0.28 -0.08 0.00 -2.23 0.00 0.00 60.65 58.62 1cru s ILE 69 Cb 0.00 -3.18 -0.04 0.00 -1.58 0.00 0.00 42.46 37.66 1cru s ILE 69 CO 0.00 0.05 0.07 -0.69 -1.23 0.00 0.00 174.94 173.13 1cru s VAL 70 N -0.16 4.81 -0.02 2.92 1.01 0.20 -4.98 120.40 124.17 1cru s VAL 70 Ca 0.60 -0.03 -0.01 0.00 0.00 0.00 0.00 61.98 62.55 1cru s VAL 70 Cb -0.45 -3.17 0.02 0.00 0.00 0.00 0.00 36.38 32.78 1cru s VAL 70 CO 0.48 0.45 0.04 0.21 0.00 0.00 0.00 175.10 176.28 1cru s ASN 71 N 0.42 0.00 -0.13 3.32 3.84 -1.26 -2.92 114.94 118.21 1cru s ASN 71 Ca 0.03 0.07 -0.05 0.00 0.21 0.00 0.00 52.86 53.12 1cru s ASN 71 Cb -0.12 0.02 -0.04 0.00 -0.55 0.00 0.00 41.25 40.56 1cru s ASN 71 CO 0.00 -0.07 0.05 -1.81 -2.79 0.00 0.00 177.10 172.48 1cru s ASP 72 N 0.55 5.61 0.46 -4.21 1.11 -1.26 -5.00 116.67 113.93 1cru s ASP 72 Ca -0.04 0.17 0.16 0.00 0.18 0.00 0.00 52.55 53.02 1cru s ASP 72 Cb -0.06 -1.81 1.12 0.00 1.07 0.00 0.00 42.92 43.24 1cru s ASP 72 CO -0.02 0.29 2.02 0.00 1.18 0.00 0.00 175.17 178.65 1cru h ALA 73 N 5.80 2.07 -0.58 5.23 0.00 -2.01 0.09 119.26 129.86 1cru h ALA 73 Ca -0.45 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.45 1cru h ALA 73 Cb 1.19 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.92 1cru h ALA 73 CO 0.62 -0.17 0.00 -0.40 0.00 0.00 0.00 179.25 179.30 1cru n ASP 74 N -4.47 4.72 -4.66 0.00 5.75 -1.26 -4.98 116.55 111.65 1cru n ASP 74 Ca 0.07 -2.54 -0.30 0.00 -0.01 0.00 0.00 54.79 52.01 1cru n ASP 74 Cb 0.33 -0.59 -0.10 0.00 -1.03 0.00 0.00 41.12 39.73 1cru n ASP 74 CO 0.00 0.00 0.00 -0.83 -0.11 0.00 0.00 177.20 176.26 1cru s GLY 75 N -0.81 2.69 -0.08 6.12 0.00 0.02 -5.00 107.32 110.25 1cru s GLY 75 Ca 0.48 -1.59 0.16 0.00 0.00 0.00 0.00 44.72 43.77 1cru s GLY 75 CO 0.20 -2.13 1.45 -1.06 0.00 0.00 0.00 173.10 171.57 1cru n GLN 76 N -1.07 3.20 -2.46 2.90 6.02 0.14 -4.79 117.38 121.32 1cru n GLN 76 Ca -0.10 -2.58 -0.23 0.00 -0.01 0.00 0.00 57.00 54.08 1cru n GLN 76 Cb 0.67 -1.65 0.07 0.00 1.02 0.00 0.00 30.24 30.35 1cru n GLN 76 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 1cru s ASN 77 N -1.19 4.80 0.00 1.08 2.20 -1.26 -4.73 114.94 115.84 1cru s ASN 77 Ca 0.39 0.05 0.00 0.00 -0.94 0.00 0.00 52.86 52.36 1cru s ASN 77 Cb 0.26 -0.69 0.00 0.00 -2.00 0.00 0.00 41.25 38.81 1cru s ASN 77 CO 0.18 -1.53 0.00 0.61 -2.94 0.00 0.00 177.10 173.42 1cru n GLY 78 N -2.70 0.41 3.68 0.45 0.00 -1.15 -4.63 105.19 101.25 1cru n GLY 78 Ca 0.10 -1.63 -0.41 0.00 0.00 0.00 0.00 46.02 44.08 1cru n GLY 78 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1cru s LEU 79 N 0.00 4.22 0.00 0.99 2.96 -0.17 -1.00 118.68 125.69 1cru s LEU 79 Ca 0.00 1.27 0.00 0.00 -0.22 0.00 0.00 54.13 55.18 1cru s LEU 79 Cb 0.00 -3.29 0.00 0.00 0.50 0.00 0.00 46.19 43.40 1cru s LEU 79 CO 0.00 -0.35 0.00 0.18 -1.32 0.00 0.00 176.35 174.86 1cru n LEU 80 N 4.86 0.00 -4.74 -0.68 4.77 0.23 -4.27 117.00 117.17 1cru n LEU 80 Ca 0.04 0.00 -0.39 0.00 -0.03 0.00 0.00 56.01 55.63 1cru n LEU 80 Cb 0.49 0.00 0.03 0.00 -2.33 0.00 0.00 43.42 41.61 1cru n LEU 80 CO 0.49 0.00 0.98 0.61 -1.33 0.00 0.00 177.39 178.14 1cru n GLY 81 N 3.96 0.78 3.42 -0.72 0.00 -0.85 -4.76 105.19 107.02 1cru n GLY 81 Ca 0.00 0.09 0.01 0.00 0.00 0.00 0.00 46.02 46.12 1cru n GLY 81 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1cru s PHE 82 N -1.25 -1.43 0.03 1.61 5.36 -1.24 -1.98 117.98 119.07 1cru s PHE 82 Ca 0.67 2.04 -0.15 0.00 -0.96 0.00 0.00 56.93 58.53 1cru s PHE 82 Cb -0.44 0.69 0.02 0.00 -0.34 0.00 0.00 43.02 42.95 1cru s PHE 82 CO 0.53 -0.75 0.33 0.00 -1.46 0.00 0.00 175.22 173.87 1cru s ALA 83 N 2.87 -0.79 0.16 11.12 0.00 0.05 -4.76 121.76 130.40 1cru s ALA 83 Ca 0.05 0.16 -0.00 0.00 0.00 0.00 0.00 51.96 52.17 1cru s ALA 83 Cb -0.13 0.27 -0.04 0.00 0.00 0.00 0.00 23.12 23.21 1cru s ALA 83 CO -0.20 -0.39 0.34 -0.06 0.00 0.00 0.00 175.76 175.45 1cru s PHE 84 N -2.25 3.49 0.28 0.00 0.40 -1.26 -0.29 117.98 118.35 1cru s PHE 84 Ca -0.07 0.31 -0.29 0.00 -0.60 0.00 0.00 56.93 56.27 1cru s PHE 84 Cb -0.02 -1.82 -0.10 0.00 0.51 0.00 0.00 43.02 41.59 1cru s PHE 84 CO -0.01 0.45 1.42 -1.58 0.70 0.00 0.00 175.22 176.19 1cru s HIS 85 N -1.76 2.97 0.47 0.36 5.65 -0.28 -4.86 115.29 117.83 1cru s HIS 85 Ca 0.37 1.13 0.15 0.00 0.25 0.00 0.00 55.06 56.96 1cru s HIS 85 Cb -0.11 -3.82 1.11 0.00 -1.18 0.00 0.00 32.58 28.58 1cru s HIS 85 CO 0.28 -2.54 2.04 -1.00 -0.65 0.00 0.00 174.74 172.87 1cru h PRO 86 N 4.41 0.27 -2.29 2.88 0.13 -1.92 -2.66 132.00 132.82 1cru h PRO 86 Ca -0.47 -0.02 -0.68 0.00 -0.87 0.00 0.00 66.00 63.96 1cru h PRO 86 Cb 1.22 -0.06 -0.36 0.00 0.13 0.00 0.00 31.00 31.93 1cru h PRO 86 CO 0.73 0.18 0.04 -3.47 -0.23 0.00 0.00 178.00 175.25 1cru n ASP 87 N -4.47 5.62 -0.29 1.44 2.03 -1.26 -4.88 116.55 114.73 1cru n ASP 87 Ca 0.05 -3.67 0.08 0.00 0.52 0.00 0.00 54.79 51.77 1cru n ASP 87 Cb 0.28 -0.82 0.30 0.00 -0.72 0.00 0.00 41.12 40.16 1cru n ASP 87 CO 0.00 0.00 0.00 0.15 -1.92 0.00 0.00 177.20 175.43 1cru h PHE 88 N 3.57 0.96 -0.98 -0.67 3.57 -1.59 0.04 116.94 121.85 1cru h PHE 88 Ca 0.29 0.03 0.22 0.00 3.53 0.00 0.00 57.97 62.04 1cru h PHE 88 Cb 0.44 -0.31 -0.08 0.00 2.79 0.00 0.00 35.95 38.79 1cru h PHE 88 CO 1.03 0.42 0.63 0.87 -2.23 0.00 0.00 178.31 179.03 1cru h LYS 89 N 0.87 0.47 0.00 1.11 6.56 -1.89 -2.23 116.57 121.46 1cru h LYS 89 Ca 0.43 -0.03 0.00 0.00 -1.06 0.00 0.00 60.65 59.99 1cru h LYS 89 Cb 0.47 -0.11 0.00 0.00 -0.57 0.00 0.00 32.23 32.02 1cru h LYS 89 CO -0.19 0.31 -0.64 0.09 -2.06 0.00 0.00 179.45 176.96 1cru n ASN 90 N -4.60 0.67 -3.37 0.86 3.02 -0.87 -4.76 115.26 106.21 1cru n ASN 90 Ca 0.22 -0.74 -0.26 0.00 -0.03 0.00 0.00 54.58 53.77 1cru n ASN 90 Cb 0.73 1.04 -0.10 0.00 -0.61 0.00 0.00 39.78 40.84 1cru n ASN 90 CO 0.00 0.00 0.00 0.20 -2.62 0.00 0.00 177.26 174.84 1cru s ASN 91 N -2.23 1.43 -1.31 6.41 0.01 -0.06 -5.04 114.94 114.16 1cru s ASN 91 Ca 0.04 -2.92 -0.10 0.00 -0.71 0.00 0.00 52.86 49.17 1cru s ASN 91 Cb 0.09 -0.33 -0.07 0.00 0.41 0.00 0.00 41.25 41.36 1cru s ASN 91 CO 0.50 -0.18 2.52 -0.81 -1.51 0.00 0.00 177.10 177.62 1cru n PRO 92 N 2.97 2.91 -4.58 -0.60 -0.04 -0.98 -3.92 135.00 130.76 1cru n PRO 92 Ca 0.28 -1.97 -0.32 0.00 -0.04 0.00 0.00 63.50 61.45 1cru n PRO 92 Cb 0.47 -2.74 -0.11 0.00 -0.04 0.00 0.00 33.50 31.08 1cru n PRO 92 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 1cru s TYR 93 N 2.90 2.79 -0.08 0.54 1.51 -1.26 -0.34 117.35 123.41 1cru s TYR 93 Ca 0.56 -0.10 0.05 0.00 -1.01 0.00 0.00 57.07 56.57 1cru s TYR 93 Cb 0.15 -1.59 -0.01 0.00 -0.11 0.00 0.00 41.96 40.40 1cru s TYR 93 CO -0.04 0.31 -0.24 0.42 -1.11 0.00 0.00 175.55 174.89 1cru s ILE 94 N -0.93 2.09 -0.13 2.71 1.01 -0.33 -1.13 121.20 124.50 1cru s ILE 94 Ca 0.15 -1.03 -0.00 0.00 0.00 0.00 0.00 60.65 59.77 1cru s ILE 94 Cb -0.11 -1.78 -0.02 0.00 0.01 0.00 0.00 42.46 40.57 1cru s ILE 94 CO 0.05 0.56 -0.12 -0.31 0.00 0.00 0.00 174.94 175.13 1cru s TYR 95 N 0.11 2.83 0.26 3.97 1.51 0.60 -0.15 117.35 126.49 1cru s TYR 95 Ca -0.12 -0.57 0.03 0.00 -1.01 0.00 0.00 57.07 55.40 1cru s TYR 95 Cb -0.16 -1.84 -0.05 0.00 -0.11 0.00 0.00 41.96 39.80 1cru s TYR 95 CO 0.07 -0.16 0.05 0.96 -1.11 0.00 0.00 175.55 175.35 1cru s ILE 96 N 0.27 0.90 0.06 2.71 -5.25 -0.11 -0.77 121.20 119.00 1cru s ILE 96 Ca -0.09 -2.01 0.04 0.00 -0.99 0.00 0.00 60.65 57.60 1cru s ILE 96 Cb -0.15 -2.55 -0.03 0.00 2.95 0.00 0.00 42.46 42.68 1cru s ILE 96 CO 0.05 -0.14 -0.11 -0.94 -1.79 0.00 0.00 174.94 172.01 1cru s SER 97 N -3.35 1.35 0.21 4.36 1.04 -0.84 -0.74 113.70 115.74 1cru s SER 97 Ca 0.34 -0.62 -0.22 0.00 0.48 0.00 0.00 55.95 55.92 1cru s SER 97 Cb 0.07 -0.01 0.05 0.00 0.10 0.00 0.00 66.02 66.23 1cru s SER 97 CO 0.12 -0.15 0.68 -0.83 0.98 0.00 0.00 173.24 174.04 1cru s GLY 98 N -1.77 -0.35 -0.18 7.32 0.00 -0.55 -0.60 107.32 111.19 1cru s GLY 98 Ca -0.04 0.10 -0.23 0.00 0.00 0.00 0.00 44.72 44.55 1cru s GLY 98 CO 0.01 0.04 0.74 -1.59 0.00 0.00 0.00 173.10 172.30 1cru s THR 99 N -3.80 4.94 0.09 0.90 2.01 -0.17 -1.42 115.64 118.20 1cru s THR 99 Ca 0.06 1.43 0.03 0.00 0.31 0.00 0.00 61.69 63.52 1cru s THR 99 Cb -0.03 -4.05 -0.04 0.00 0.01 0.00 0.00 72.50 68.39 1cru s THR 99 CO -0.03 0.07 -0.08 -0.36 -0.69 0.00 0.00 174.62 173.53 1cru s PHE 100 N 2.02 0.95 0.51 4.92 0.40 -0.38 -0.63 117.98 125.78 1cru s PHE 100 Ca 0.34 -0.75 -0.23 0.00 -0.60 0.00 0.00 56.93 55.69 1cru s PHE 100 Cb -0.16 -0.53 -0.06 0.00 0.51 0.00 0.00 43.02 42.77 1cru s PHE 100 CO 0.12 -0.07 1.37 0.21 0.70 0.00 0.00 175.22 177.55 1cru s LYS 101 N -3.15 3.37 -0.45 0.44 2.20 -1.26 -0.52 119.74 120.37 1cru s LYS 101 Ca 0.07 2.27 -0.06 0.00 -0.36 0.00 0.00 55.97 57.88 1cru s LYS 101 Cb 0.00 -2.41 0.12 0.00 -1.51 0.00 0.00 37.83 34.03 1cru s LYS 101 CO -0.02 -1.01 0.29 1.21 -0.36 0.00 0.00 175.35 175.46 1cru s ASN 102 N -0.83 5.51 0.57 1.43 3.84 -0.49 -4.58 114.94 120.39 1cru s ASN 102 Ca 0.67 -2.01 0.27 0.00 0.21 0.00 0.00 52.86 52.01 1cru s ASN 102 Cb -0.41 -1.93 1.53 0.00 -0.55 0.00 0.00 41.25 39.90 1cru s ASN 102 CO 0.50 -0.62 2.03 -0.65 -2.79 0.00 0.00 177.10 175.57 1cru h PRO 103 N 8.22 0.00 -0.01 0.43 0.11 -1.93 -0.56 132.00 138.26 1cru h PRO 103 Ca -0.17 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.94 1cru h PRO 103 Cb 1.06 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.17 1cru h PRO 103 CO 0.79 0.00 -0.11 1.63 -0.21 0.00 0.00 178.00 180.09 1cru n LYS 104 N -3.96 1.05 -1.72 1.05 5.02 -1.26 -4.94 118.16 113.40 1cru n LYS 104 Ca 0.05 -0.51 -0.43 0.00 -2.02 0.00 0.00 58.31 55.41 1cru n LYS 104 Cb 0.47 -1.49 -0.02 0.00 -0.02 0.00 0.00 35.03 33.97 1cru n LYS 104 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 1cru n SER 105 N -0.54 3.50 -1.17 4.39 2.88 -0.22 -4.88 113.62 117.58 1cru n SER 105 Ca 0.16 1.14 0.12 0.00 -1.33 0.00 0.00 58.87 58.96 1cru n SER 105 Cb 0.31 -1.54 0.23 0.00 -0.75 0.00 0.00 64.21 62.46 1cru n SER 105 CO 0.00 0.00 0.00 0.35 -1.23 0.00 0.00 175.04 174.16 1cru n THR 106 N 2.25 0.53 -4.07 2.46 -2.24 -1.26 -4.92 114.28 107.03 1cru n THR 106 Ca 0.10 -0.76 -0.19 0.00 -2.27 0.00 0.00 64.05 60.94 1cru n THR 106 Cb 0.35 0.94 -0.16 0.00 -2.10 0.00 0.00 70.33 69.36 1cru n THR 106 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1cru s ASP 107 N -1.46 0.71 0.26 3.42 -1.08 -1.26 -5.04 116.67 112.22 1cru s ASP 107 Ca 0.40 -0.08 0.04 0.00 -0.52 0.00 0.00 52.55 52.39 1cru s ASP 107 Cb 0.23 -0.35 0.33 0.00 -1.46 0.00 0.00 42.92 41.67 1cru s ASP 107 CO 0.32 -0.07 1.62 0.11 0.52 0.00 0.00 175.17 177.67 1cru h LYS 108 N 7.19 0.28 0.00 4.34 1.57 -1.99 -3.01 116.57 124.95 1cru h LYS 108 Ca -0.40 -0.16 -0.04 0.00 -1.87 0.00 0.00 60.65 58.18 1cru h LYS 108 Cb 1.14 0.01 -0.01 0.00 0.08 0.00 0.00 32.23 33.46 1cru h LYS 108 CO 0.47 0.72 -0.20 0.93 -0.57 0.00 0.00 179.45 180.81 1cru h GLU 109 N 0.23 0.00 -2.25 3.15 4.39 -2.02 -3.35 114.58 114.72 1cru h GLU 109 Ca 0.01 0.00 -0.58 0.00 0.34 0.00 0.00 59.36 59.13 1cru h GLU 109 Cb 0.96 0.00 -0.40 0.00 -0.10 0.00 0.00 28.75 29.21 1cru h GLU 109 CO 0.08 0.20 -0.88 1.28 -1.16 0.00 0.00 179.01 178.52 1cru n LEU 110 N -3.38 1.33 0.03 1.33 4.77 -1.14 -4.97 117.00 114.97 1cru n LEU 110 Ca 0.00 -4.89 0.14 0.00 -0.03 0.00 0.00 56.01 51.23 1cru n LEU 110 Cb 0.41 0.11 0.56 0.00 -2.33 0.00 0.00 43.42 42.17 1cru n LEU 110 CO 0.32 1.99 0.94 -0.81 -1.33 0.00 0.00 177.39 178.50 1cru n PRO 111 N 1.60 0.07 -3.65 3.23 -0.04 -1.20 -4.63 135.00 130.38 1cru n PRO 111 Ca 0.25 0.06 -0.23 0.00 -0.04 0.00 0.00 63.50 63.54 1cru n PRO 111 Cb 0.47 -1.58 -0.02 0.00 -0.04 0.00 0.00 33.50 32.33 1cru n PRO 111 CO 0.00 0.00 0.00 -0.80 -0.04 0.00 0.00 175.50 174.66 1cru s ASN 112 N -3.39 4.89 0.18 3.54 0.01 -1.26 -1.39 114.94 117.52 1cru s ASN 112 Ca 0.13 -0.92 0.02 0.00 -0.71 0.00 0.00 52.86 51.38 1cru s ASN 112 Cb 0.17 -0.20 -0.05 0.00 0.41 0.00 0.00 41.25 41.59 1cru s ASN 112 CO 0.54 -0.84 -0.01 0.00 -1.51 0.00 0.00 177.10 175.28 1cru s GLN 113 N -4.21 1.14 -0.09 -0.60 -2.07 0.32 -4.20 119.66 109.95 1cru s GLN 113 Ca 0.45 -1.54 -0.02 0.00 -1.82 0.00 0.00 55.36 52.42 1cru s GLN 113 Cb -0.03 -0.37 -0.03 0.00 -1.09 0.00 0.00 33.01 31.49 1cru s GLN 113 CO 0.26 -0.10 -0.00 0.99 -1.32 0.00 0.00 175.29 175.12 1cru s THR 114 N -3.58 4.27 -0.05 3.63 2.01 0.09 -1.25 115.64 120.76 1cru s THR 114 Ca 0.24 -0.26 0.04 0.00 0.31 0.00 0.00 61.69 62.01 1cru s THR 114 Cb 0.06 -2.80 0.00 0.00 0.01 0.00 0.00 72.50 69.77 1cru s THR 114 CO 0.04 0.59 -0.16 -0.63 -0.69 0.00 0.00 174.62 173.77 1cru s ILE 115 N -0.76 1.39 -0.26 1.82 1.01 -0.51 -2.19 121.20 121.71 1cru s ILE 115 Ca 0.12 -0.68 -0.14 0.00 0.00 0.00 0.00 60.65 59.95 1cru s ILE 115 Cb -0.11 -1.21 -0.04 0.00 0.01 0.00 0.00 42.46 41.10 1cru s ILE 115 CO 0.02 0.41 0.32 -0.63 0.00 0.00 0.00 174.94 175.06 1cru s ILE 116 N 0.18 5.22 0.06 2.92 1.01 0.23 -1.48 121.20 129.34 1cru s ILE 116 Ca -0.07 0.48 0.04 0.00 0.00 0.00 0.00 60.65 61.10 1cru s ILE 116 Cb -0.13 -3.65 -0.03 0.00 0.01 0.00 0.00 42.46 38.67 1cru s ILE 116 CO 0.03 0.20 -0.11 -0.60 0.00 0.00 0.00 174.94 174.46 1cru s ARG 117 N 1.82 0.69 -0.03 2.79 3.52 0.09 0.09 118.95 127.92 1cru s ARG 117 Ca 0.13 -0.87 0.01 0.00 -0.13 0.00 0.00 55.73 54.87 1cru s ARG 117 Cb -0.15 -0.59 -0.03 0.00 -1.56 0.00 0.00 34.95 32.61 1cru s ARG 117 CO 0.09 0.12 -0.01 0.50 -0.81 0.00 0.00 175.30 175.19 1cru s ARG 118 N -1.68 2.80 0.19 5.12 3.52 0.18 -0.94 118.95 128.15 1cru s ARG 118 Ca -0.05 -0.57 0.10 0.00 -0.13 0.00 0.00 55.73 55.08 1cru s ARG 118 Cb -0.10 -2.67 -0.04 0.00 -1.56 0.00 0.00 34.95 30.58 1cru s ARG 118 CO 0.01 0.64 -0.20 0.71 -0.81 0.00 0.00 175.30 175.66 1cru s TYR 119 N -1.00 2.05 -0.18 5.12 1.51 0.79 -1.06 117.35 124.59 1cru s TYR 119 Ca 0.17 -0.42 -0.06 0.00 -1.01 0.00 0.00 57.07 55.76 1cru s TYR 119 Cb -0.11 -1.00 -0.03 0.00 -0.11 0.00 0.00 41.96 40.71 1cru s TYR 119 CO 0.07 0.45 0.01 0.99 -1.11 0.00 0.00 175.55 175.96 1cru s THR 120 N -2.04 4.27 -0.07 -0.71 2.01 0.58 -1.19 115.64 118.50 1cru s THR 120 Ca 0.20 -0.22 -0.25 0.00 0.31 0.00 0.00 61.69 61.74 1cru s THR 120 Cb -0.06 -2.91 -0.03 0.00 0.01 0.00 0.00 72.50 69.51 1cru s THR 120 CO 0.09 0.46 0.75 -0.47 -0.69 0.00 0.00 174.62 174.77 1cru s TYR 121 N 0.52 3.57 -0.41 4.92 5.04 0.54 -0.54 117.35 130.98 1cru s TYR 121 Ca -0.00 1.31 -0.09 0.00 -2.44 0.00 0.00 57.07 55.85 1cru s TYR 121 Cb -0.14 -2.87 0.07 0.00 0.35 0.00 0.00 41.96 39.37 1cru s TYR 121 CO 0.02 0.03 0.24 1.21 -1.34 0.00 0.00 175.55 175.71 1cru s ASN 122 N 0.88 5.61 0.47 4.32 3.84 0.02 -4.88 114.94 125.20 1cru s ASN 122 Ca 0.39 -1.45 0.21 0.00 0.21 0.00 0.00 52.86 52.23 1cru s ASN 122 Cb -0.18 -1.98 1.17 0.00 -0.55 0.00 0.00 41.25 39.72 1cru s ASN 122 CO 0.19 -0.51 1.99 0.50 -2.79 0.00 0.00 177.10 176.48 1cru h LYS 123 N 8.39 0.00 -0.15 0.43 3.64 -1.96 0.19 116.57 127.11 1cru h LYS 123 Ca -0.23 0.00 -0.03 0.00 -1.27 0.00 0.00 60.65 59.12 1cru h LYS 123 Cb 1.08 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 32.90 1cru h LYS 123 CO 0.74 0.19 -0.03 1.03 -2.27 0.00 0.00 179.45 179.11 1cru h SER 124 N 0.00 0.29 -0.03 4.20 0.87 -1.96 -3.25 113.55 113.67 1cru h SER 124 Ca -0.00 -0.36 0.00 0.00 -1.23 0.00 0.00 61.79 60.20 1cru h SER 124 Cb 0.42 -0.08 0.00 0.00 -0.44 0.00 0.00 62.40 62.30 1cru h SER 124 CO 0.02 0.58 -0.07 0.35 -0.53 0.00 0.00 176.83 177.19 1cru n THR 125 N -4.70 0.00 -3.71 2.23 -2.24 -1.18 -5.00 114.28 99.68 1cru n THR 125 Ca -0.05 -0.47 -0.29 0.00 -2.27 0.00 0.00 64.05 60.97 1cru n THR 125 Cb 0.25 1.47 0.03 0.00 -2.10 0.00 0.00 70.33 69.98 1cru n THR 125 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 1cru n ASP 126 N 1.16 -4.17 -3.26 3.42 2.03 0.65 -4.99 116.55 111.39 1cru n ASP 126 Ca 0.13 -0.99 -0.11 0.00 0.52 0.00 0.00 54.79 54.35 1cru n ASP 126 Cb 0.58 -3.46 -0.02 0.00 -0.72 0.00 0.00 41.12 37.50 1cru n ASP 126 CO 0.00 0.00 0.00 0.28 -1.92 0.00 0.00 177.20 175.56 1cru s THR 127 N -3.56 0.00 -0.06 5.18 -1.32 -1.07 -4.89 115.64 109.92 1cru s THR 127 Ca 0.35 -1.30 -0.02 0.00 -1.21 0.00 0.00 61.69 59.52 1cru s THR 127 Cb -0.12 -2.63 -0.04 0.00 -1.51 0.00 0.00 72.50 68.20 1cru s THR 127 CO 0.86 0.00 0.04 -0.76 -2.21 0.00 0.00 174.62 172.54 1cru s LEU 128 N -3.12 3.74 0.00 9.08 1.02 -1.26 -0.80 118.68 127.34 1cru s LEU 128 Ca 0.22 0.17 -0.07 0.00 0.02 0.00 0.00 54.13 54.46 1cru s LEU 128 Cb -0.03 -1.97 0.03 0.00 0.02 0.00 0.00 46.19 44.24 1cru s LEU 128 CO 0.14 0.35 0.57 -1.84 0.02 0.00 0.00 176.35 175.59 1cru n GLU 129 N 1.82 0.82 -3.68 1.70 0.28 0.30 -4.93 120.64 116.94 1cru n GLU 129 Ca -0.17 -2.25 -0.29 0.00 -0.16 0.00 0.00 57.16 54.29 1cru n GLU 129 Cb 0.53 2.44 0.04 0.00 1.43 0.00 0.00 31.44 35.89 1cru n GLU 129 CO 0.00 0.00 0.00 1.63 -0.16 0.00 0.00 177.13 178.60 1cru n LYS 130 N -0.50 -1.77 -1.77 3.44 5.02 -1.26 -0.31 118.16 121.02 1cru n LYS 130 Ca -0.04 0.49 -0.41 0.00 -2.02 0.00 0.00 58.31 56.34 1cru n LYS 130 Cb 0.53 -4.34 0.01 0.00 -0.02 0.00 0.00 35.03 31.20 1cru n LYS 130 CO 0.00 0.00 0.00 -0.35 -0.52 0.00 0.00 177.40 176.53 1cru n PRO 131 N -4.16 2.51 -3.73 1.97 -0.04 -1.26 -4.36 135.00 125.93 1cru n PRO 131 Ca -0.13 0.88 -0.21 0.00 -0.04 0.00 0.00 63.50 64.00 1cru n PRO 131 Cb 0.61 -2.66 -0.18 0.00 -0.04 0.00 0.00 33.50 31.23 1cru n PRO 131 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1cru s VAL 132 N -1.15 0.14 0.08 0.52 1.01 -0.22 -4.98 120.40 115.79 1cru s VAL 132 Ca 0.57 0.27 -0.31 0.00 0.00 0.00 0.00 61.98 62.51 1cru s VAL 132 Cb -0.46 -0.34 -0.06 0.00 0.00 0.00 0.00 36.38 35.52 1cru s VAL 132 CO 0.61 0.22 1.22 -1.81 0.00 0.00 0.00 175.10 175.34 1cru s ASP 133 N 2.04 7.05 -0.24 3.32 1.01 -1.26 -0.65 116.67 127.94 1cru s ASP 133 Ca 0.05 2.08 -0.07 0.00 0.71 0.00 0.00 52.55 55.32 1cru s ASP 133 Cb -0.12 -2.58 -0.17 0.00 1.01 0.00 0.00 42.92 41.05 1cru s ASP 133 CO -0.04 -0.48 -0.13 0.18 0.21 0.00 0.00 175.17 174.91 1cru n LEU 134 N 3.77 2.49 -3.59 1.23 4.77 0.11 -4.92 117.00 120.86 1cru n LEU 134 Ca 0.09 0.12 -0.13 0.00 -0.03 0.00 0.00 56.01 56.06 1cru n LEU 134 Cb 0.46 -0.92 -0.12 0.00 -2.33 0.00 0.00 43.42 40.51 1cru n LEU 134 CO 0.56 0.74 -0.11 -0.22 -1.33 0.00 0.00 177.39 177.03 1cru s LEU 135 N -7.06 -0.37 0.47 2.23 2.96 -0.94 -4.21 118.68 111.75 1cru s LEU 135 Ca -0.34 0.47 0.05 0.00 -0.22 0.00 0.00 54.13 54.09 1cru s LEU 135 Cb 0.10 0.81 -0.04 0.00 0.50 0.00 0.00 46.19 47.56 1cru s LEU 135 CO 0.59 -0.26 0.08 0.00 -1.32 0.00 0.00 176.35 175.44 1cru s ALA 136 N 2.45 3.76 -0.57 5.97 0.00 -1.26 -0.60 121.76 131.51 1cru s ALA 136 Ca 0.03 -1.38 0.00 0.00 0.00 0.00 0.00 51.96 50.61 1cru s ALA 136 Cb -0.13 -0.07 0.00 0.00 0.00 0.00 0.00 23.12 22.91 1cru s ALA 136 CO -0.11 -0.12 0.00 0.41 0.00 0.00 0.00 175.76 175.94 1cru n GLY 137 N -1.22 0.77 3.84 0.00 0.00 -1.23 -4.99 105.19 102.36 1cru n GLY 137 Ca -0.10 -0.81 -0.32 0.00 0.00 0.00 0.00 46.02 44.80 1cru n GLY 137 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1cru s LEU 138 N -1.26 3.54 0.61 0.99 1.43 -0.93 -4.39 118.68 118.68 1cru s LEU 138 Ca 0.00 1.58 -0.18 0.00 -1.03 0.00 0.00 54.13 54.49 1cru s LEU 138 Cb 0.00 -4.51 -0.04 0.00 0.03 0.00 0.00 46.19 41.67 1cru s LEU 138 CO 0.00 -0.71 0.97 -2.65 0.23 0.00 0.00 176.35 174.19 1cru n PRO 139 N -1.83 0.87 -3.78 1.29 -0.02 -1.26 -0.73 135.00 129.54 1cru n PRO 139 Ca 0.07 0.34 -0.13 0.00 -2.02 0.00 0.00 63.50 61.76 1cru n PRO 139 Cb 0.54 -2.18 -0.11 0.00 -0.02 0.00 0.00 33.50 31.73 1cru n PRO 139 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1cru s SER 140 N -1.28 -0.27 0.35 2.55 0.15 -1.26 -3.78 113.70 110.15 1cru s SER 140 Ca 0.77 0.47 -0.12 0.00 0.70 0.00 0.00 55.95 57.77 1cru s SER 140 Cb -0.41 0.54 0.05 0.00 -1.71 0.00 0.00 66.02 64.49 1cru s SER 140 CO 0.46 -0.17 0.68 -1.54 1.20 0.00 0.00 173.24 173.88 1cru n SER 141 N 2.60 -1.97 -0.02 5.45 3.41 -1.26 -4.74 113.62 117.08 1cru n SER 141 Ca -0.15 -2.42 0.14 0.00 -0.26 0.00 0.00 58.87 56.18 1cru n SER 141 Cb 0.58 3.30 0.54 0.00 -0.26 0.00 0.00 64.21 68.37 1cru n SER 141 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1cru n LYS 142 N -0.47 0.19 -4.23 4.33 5.02 -1.26 -4.42 118.16 117.31 1cru n LYS 142 Ca -0.07 -0.05 -0.20 0.00 -2.02 0.00 0.00 58.31 55.97 1cru n LYS 142 Cb 0.52 -1.50 -0.12 0.00 -0.02 0.00 0.00 35.03 33.92 1cru n LYS 142 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1cru s ASP 143 N -2.85 2.05 -1.15 4.39 1.11 -1.26 0.28 116.67 119.24 1cru s ASP 143 Ca 0.18 -0.72 -0.28 0.00 0.18 0.00 0.00 52.55 51.91 1cru s ASP 143 Cb 0.19 -0.08 0.03 0.00 1.07 0.00 0.00 42.92 44.13 1cru s ASP 143 CO 0.55 -0.07 0.70 1.41 1.18 0.00 0.00 175.17 178.94 1cru n HIS 144 N 0.88 -1.60 0.01 4.23 8.25 -1.26 -3.30 115.22 122.43 1cru n HIS 144 Ca -0.18 0.25 -0.09 0.00 -0.26 0.00 0.00 57.72 57.44 1cru n HIS 144 Cb 0.55 -2.94 -0.13 0.00 1.12 0.00 0.00 29.99 28.58 1cru n HIS 144 CO 0.00 0.00 0.00 1.96 0.64 0.00 0.00 176.34 178.94 1cru h GLN 145 N -2.18 0.03 0.00 -0.41 1.08 -1.89 -2.24 115.11 109.50 1cru h GLN 145 Ca -0.69 -0.04 0.00 0.00 -1.45 0.00 0.00 58.65 56.47 1cru h GLN 145 Cb 1.39 0.02 0.00 0.00 -0.05 0.00 0.00 27.48 28.84 1cru h GLN 145 CO 0.49 0.70 0.00 0.43 -0.95 0.00 0.00 178.83 179.50 1cru n SER 146 N -3.17 0.00 0.00 1.46 7.64 -1.26 -2.14 113.62 116.14 1cru n SER 146 Ca -0.13 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.75 1cru n SER 146 Cb 1.02 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 64.22 1cru n SER 146 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1cru n GLY 147 N 0.00 0.48 3.72 0.23 0.00 0.36 -4.86 105.19 105.11 1cru n GLY 147 Ca 0.00 -0.90 -0.42 0.00 0.00 0.00 0.00 46.02 44.70 1cru n GLY 147 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1cru s ARG 148 N -2.71 4.57 -0.14 1.61 6.06 -1.25 -2.00 118.95 125.09 1cru s ARG 148 Ca 0.00 1.49 0.00 0.00 -2.50 0.00 0.00 55.73 54.73 1cru s ARG 148 Cb 0.00 -3.42 0.02 0.00 0.06 0.00 0.00 34.95 31.62 1cru s ARG 148 CO 0.00 -0.02 -0.12 -1.17 -2.50 0.00 0.00 175.30 171.49 1cru s LEU 149 N 0.75 1.59 0.10 -0.88 0.20 -1.26 -1.05 118.68 118.13 1cru s LEU 149 Ca 0.52 -0.47 0.03 0.00 0.69 0.00 0.00 54.13 54.89 1cru s LEU 149 Cb -0.23 -1.08 -0.04 0.00 -0.43 0.00 0.00 46.19 44.41 1cru s LEU 149 CO 0.29 -0.08 -0.08 0.68 -0.29 0.00 0.00 176.35 176.86 1cru s VAL 150 N 1.55 0.80 -0.21 1.68 -7.23 -0.14 -4.39 120.40 112.46 1cru s VAL 150 Ca 0.04 -1.79 -0.05 0.00 -1.81 0.00 0.00 61.98 58.38 1cru s VAL 150 Cb -0.13 -1.51 -0.02 0.00 0.56 0.00 0.00 36.38 35.29 1cru s VAL 150 CO -0.10 -0.72 -0.02 -0.63 -0.31 0.00 0.00 175.10 173.32 1cru s ILE 151 N -3.04 3.67 0.80 -0.62 1.01 -1.26 0.03 121.20 121.79 1cru s ILE 151 Ca 0.09 -0.40 -0.12 0.00 0.00 0.00 0.00 60.65 60.22 1cru s ILE 151 Cb 0.01 -2.67 0.07 0.00 0.01 0.00 0.00 42.46 39.89 1cru s ILE 151 CO -0.02 0.42 1.17 -0.83 0.00 0.00 0.00 174.94 175.67 1cru s GLY 152 N 1.30 1.60 0.65 6.18 0.00 -0.12 -4.91 107.32 112.00 1cru s GLY 152 Ca 0.04 -0.63 0.42 0.00 0.00 0.00 0.00 44.72 44.54 1cru s GLY 152 CO -0.00 -0.16 2.35 -0.56 0.00 0.00 0.00 173.10 174.73 1cru h PRO 153 N -1.02 0.00 -0.12 2.90 0.13 -1.94 0.14 132.00 132.09 1cru h PRO 153 Ca -0.46 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 1cru h PRO 153 Cb 1.32 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.45 1cru h PRO 153 CO 0.66 0.00 0.00 -0.40 -0.23 0.00 0.00 178.00 178.03 1cru n ASP 154 N -3.25 1.03 -1.65 1.44 5.68 -1.26 -4.91 116.55 113.63 1cru n ASP 154 Ca -0.03 -1.66 -0.16 0.00 -0.50 0.00 0.00 54.79 52.44 1cru n ASP 154 Cb 0.07 -0.08 -0.02 0.00 -1.14 0.00 0.00 41.12 39.96 1cru n ASP 154 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1cru n GLN 155 N -0.08 -1.21 -4.13 0.11 1.13 0.48 -5.01 117.38 108.67 1cru n GLN 155 Ca 0.14 0.82 -0.25 0.00 -1.94 0.00 0.00 57.00 55.78 1cru n GLN 155 Cb 0.22 -5.14 -0.06 0.00 0.11 0.00 0.00 30.24 25.37 1cru n GLN 155 CO 0.00 0.00 0.00 0.15 -1.44 0.00 0.00 177.06 175.77 1cru s LYS 156 N -4.45 2.80 -0.08 -1.09 -0.14 -1.26 -4.41 119.74 111.11 1cru s LYS 156 Ca 0.00 -1.01 -0.23 0.00 -1.36 0.00 0.00 55.97 53.38 1cru s LYS 156 Cb 0.00 -2.54 -0.04 0.00 -1.68 0.00 0.00 37.83 33.57 1cru s LYS 156 CO 0.00 0.44 0.67 0.42 -0.76 0.00 0.00 175.35 176.12 1cru s ILE 157 N -1.92 5.06 -0.15 2.17 1.01 0.07 -0.95 121.20 126.48 1cru s ILE 157 Ca 0.31 1.37 -0.03 0.00 0.00 0.00 0.00 60.65 62.31 1cru s ILE 157 Cb -0.09 -4.01 -0.02 0.00 0.01 0.00 0.00 42.46 38.35 1cru s ILE 157 CO 0.23 0.25 -0.06 -0.31 0.00 0.00 0.00 174.94 175.04 1cru s TYR 158 N 0.88 2.96 -0.05 3.97 1.51 0.10 -0.43 117.35 126.29 1cru s TYR 158 Ca 0.36 -0.45 0.01 0.00 -1.01 0.00 0.00 57.07 55.98 1cru s TYR 158 Cb -0.17 -1.94 0.02 0.00 -0.11 0.00 0.00 41.96 39.76 1cru s TYR 158 CO 0.16 -0.13 -0.04 -0.47 -1.11 0.00 0.00 175.55 173.97 1cru s TYR 159 N 0.45 0.71 -0.09 2.71 5.04 -0.09 -0.96 117.35 125.12 1cru s TYR 159 Ca -0.05 -0.19 -0.18 0.00 -2.44 0.00 0.00 57.07 54.20 1cru s TYR 159 Cb -0.15 -0.66 -0.05 0.00 0.35 0.00 0.00 41.96 41.46 1cru s TYR 159 CO 0.03 -0.20 0.48 0.95 -1.34 0.00 0.00 175.55 175.47 1cru s THR 160 N 1.01 5.14 -0.16 4.34 -4.23 -0.21 -0.09 115.64 121.44 1cru s THR 160 Ca -0.10 0.96 -0.01 0.00 -1.18 0.00 0.00 61.69 61.37 1cru s THR 160 Cb -0.14 -3.81 0.04 0.00 1.34 0.00 0.00 72.50 69.93 1cru s THR 160 CO -0.01 0.37 -0.05 -0.51 -0.54 0.00 0.00 174.62 173.89 1cru s ILE 161 N 0.31 1.08 1.07 2.99 2.07 -0.36 -0.49 121.20 127.87 1cru s ILE 161 Ca 0.26 -0.61 -0.15 0.00 -1.41 0.00 0.00 60.65 58.74 1cru s ILE 161 Cb -0.16 -1.26 0.22 0.00 0.13 0.00 0.00 42.46 41.40 1cru s ILE 161 CO 0.11 0.12 1.12 -0.83 -1.91 0.00 0.00 174.94 173.55 1cru s GLY 162 N 1.65 1.58 0.00 1.50 0.00 -0.91 -0.63 107.32 110.51 1cru s GLY 162 Ca 0.01 -0.67 0.11 0.00 0.00 0.00 0.00 44.72 44.16 1cru s GLY 162 CO -0.08 0.05 1.26 2.09 0.00 0.00 0.00 173.10 176.43 1cru n ASP 163 N -4.35 0.00 0.00 1.64 5.75 -0.02 -1.08 116.55 118.49 1cru n ASP 163 Ca 0.09 -1.31 0.00 0.00 -0.01 0.00 0.00 54.79 53.56 1cru n ASP 163 Cb 0.59 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.68 1cru n ASP 163 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1cru n GLN 164 N -0.70 -0.50 -0.55 0.11 1.13 -0.85 -2.80 117.38 113.22 1cru n GLN 164 Ca 0.08 0.13 0.00 0.00 -1.94 0.00 0.00 57.00 55.26 1cru n GLN 164 Cb 0.04 -3.62 0.00 0.00 0.11 0.00 0.00 30.24 26.76 1cru n GLN 164 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1cru n GLY 165 N -1.61 0.76 3.76 1.08 0.00 -1.21 -4.30 105.19 103.66 1cru n GLY 165 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 1cru n GLY 165 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1cru n ARG 166 N -2.15 2.42 -1.30 1.61 1.74 -1.12 -2.41 116.66 115.45 1cru n ARG 166 Ca 0.00 0.85 -0.04 0.00 -0.77 0.00 0.00 57.85 57.89 1cru n ARG 166 Cb 0.00 -2.60 -0.02 0.00 -1.02 0.00 0.00 32.46 28.83 1cru n ARG 166 CO 0.00 0.00 0.00 -1.71 -1.52 0.00 0.00 177.63 174.40 1cru n ASN 167 N 0.26 -3.23 -3.60 0.55 5.15 -0.80 -4.79 115.26 108.81 1cru n ASN 167 Ca 0.03 0.08 -0.15 0.00 -0.60 0.00 0.00 54.58 53.94 1cru n ASN 167 Cb 0.39 -1.39 -0.06 0.00 -0.53 0.00 0.00 39.78 38.19 1cru n ASN 167 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1cru s GLN 168 N -2.70 0.96 3.69 1.20 -2.07 -1.01 -4.80 119.66 114.93 1cru s GLN 168 Ca 0.00 -0.03 0.00 0.00 -1.82 0.00 0.00 55.36 53.51 1cru s GLN 168 Cb 0.00 0.44 0.00 0.00 -1.09 0.00 0.00 33.01 32.36 1cru s GLN 168 CO 0.00 -0.31 0.00 1.28 -1.32 0.00 0.00 175.29 174.94 1cru n LEU 169 N 0.80 0.00 0.15 2.60 4.77 -1.26 -1.26 117.00 122.81 1cru n LEU 169 Ca -0.19 0.00 0.11 0.00 -0.03 0.00 0.00 56.01 55.90 1cru n LEU 169 Cb 0.58 0.00 0.54 0.00 -2.33 0.00 0.00 43.42 42.21 1cru n LEU 169 CO 0.22 0.00 0.84 0.00 -1.33 0.00 0.00 177.39 177.12 1cru n ALA 170 N 9.60 1.32 -1.38 -1.18 0.00 -1.26 -1.88 120.51 125.74 1cru n ALA 170 Ca 0.00 0.15 0.06 0.00 0.00 0.00 0.00 53.44 53.65 1cru n ALA 170 Cb 0.00 -1.35 0.19 0.00 0.00 0.00 0.00 19.45 18.29 1cru n ALA 170 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1cru n TYR 171 N -2.25 0.22 -0.26 0.00 4.02 -0.39 -4.84 117.16 113.68 1cru n TYR 171 Ca 0.00 -1.32 0.07 0.00 -0.01 0.00 0.00 57.90 56.64 1cru n TYR 171 Cb 0.12 -0.26 0.19 0.00 -0.02 0.00 0.00 39.34 39.38 1cru n TYR 171 CO 0.00 0.00 0.00 1.25 -1.01 0.00 0.00 176.86 177.10 1cru h LEU 172 N 0.75 0.02 -1.30 7.72 5.85 -0.72 -1.96 115.31 125.66 1cru h LEU 172 Ca 0.03 0.15 0.00 0.00 0.84 0.00 0.00 57.88 58.91 1cru h LEU 172 Cb 1.13 0.20 0.00 0.00 0.37 0.00 0.00 40.66 42.36 1cru h LEU 172 CO 0.07 -0.05 0.00 0.49 -0.34 0.00 0.00 178.44 178.61 1cru n PHE 173 N -5.16 0.24 -2.98 1.25 3.01 -1.26 -3.49 117.46 109.07 1cru n PHE 173 Ca 0.15 -0.12 -0.39 0.00 1.01 0.00 0.00 57.45 58.10 1cru n PHE 173 Cb 0.49 0.00 -0.06 0.00 -0.01 0.00 0.00 39.48 39.90 1cru n PHE 173 CO 0.00 0.00 0.00 -0.51 1.01 0.00 0.00 176.76 177.26 1cru s LEU 174 N -1.58 4.58 -0.09 4.37 1.43 -0.83 -4.00 118.68 122.56 1cru s LEU 174 Ca 0.33 1.62 -0.30 0.00 -1.03 0.00 0.00 54.13 54.76 1cru s LEU 174 Cb 0.18 -3.29 -0.04 0.00 0.03 0.00 0.00 46.19 43.08 1cru s LEU 174 CO 0.27 0.18 1.44 -2.16 0.23 0.00 0.00 176.35 176.32 1cru s PRO 175 N -1.00 4.22 0.25 1.29 0.04 -1.26 -3.26 135.00 135.28 1cru s PRO 175 Ca 0.36 1.93 -0.30 0.00 0.04 0.00 0.00 61.00 63.03 1cru s PRO 175 Cb -0.23 -3.82 -0.10 0.00 0.04 0.00 0.00 34.50 30.39 1cru s PRO 175 CO 0.26 -0.74 1.49 1.21 0.04 0.00 0.00 177.00 179.26 1cru s ASN 176 N 2.50 6.58 0.00 6.66 3.84 -1.26 -4.93 114.94 128.33 1cru s ASN 176 Ca 0.64 2.73 0.16 0.00 0.21 0.00 0.00 52.86 56.60 1cru s ASN 176 Cb -0.28 -2.62 0.44 0.00 -0.55 0.00 0.00 41.25 38.24 1cru s ASN 176 CO 0.23 -0.77 1.37 0.00 -2.79 0.00 0.00 177.10 175.14 1cru n GLN 177 N 2.48 2.76 -0.09 0.43 1.13 -1.26 -4.64 117.38 118.19 1cru n GLN 177 Ca 0.08 -2.29 0.10 0.00 -1.94 0.00 0.00 57.00 52.95 1cru n GLN 177 Cb 0.39 -1.40 0.46 0.00 0.11 0.00 0.00 30.24 29.81 1cru n GLN 177 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1cru h ALA 178 N 3.02 1.92 -0.00 -1.58 0.00 -1.83 -0.31 119.26 120.48 1cru h ALA 178 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1cru h ALA 178 Cb 0.84 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.52 1cru h ALA 178 CO 0.00 -0.04 -0.21 1.04 0.00 0.00 0.00 179.25 180.05 1cru n GLN 179 N -4.48 0.43 -3.37 0.00 1.13 -1.26 -1.68 117.38 108.15 1cru n GLN 179 Ca 0.09 -0.17 -0.33 0.00 -1.94 0.00 0.00 57.00 54.64 1cru n GLN 179 Cb 0.31 -1.50 -0.06 0.00 0.11 0.00 0.00 30.24 29.11 1cru n GLN 179 CO 0.00 0.00 0.00 -1.01 -1.44 0.00 0.00 177.06 174.61 1cru s HIS 180 N -2.69 3.49 0.09 1.08 3.76 -0.13 -4.96 115.29 115.92 1cru s HIS 180 Ca 0.21 0.97 0.03 0.00 -0.15 0.00 0.00 55.06 56.12 1cru s HIS 180 Cb 0.19 -2.32 -0.04 0.00 1.11 0.00 0.00 32.58 31.52 1cru s HIS 180 CO 0.54 0.31 -0.08 0.95 -0.85 0.00 0.00 174.74 175.61 1cru s THR 181 N -1.70 0.77 0.45 1.30 -4.23 -1.26 -4.82 115.64 106.15 1cru s THR 181 Ca 0.44 -1.64 -0.22 0.00 -1.18 0.00 0.00 61.69 59.09 1cru s THR 181 Cb -0.12 -1.33 -0.08 0.00 1.34 0.00 0.00 72.50 72.31 1cru s THR 181 CO 0.20 -0.64 1.10 -2.16 -0.54 0.00 0.00 174.62 172.58 1cru s PRO 182 N -2.93 3.88 0.69 3.99 0.04 -1.26 -4.97 135.00 134.43 1cru s PRO 182 Ca 0.05 1.58 -0.11 0.00 0.04 0.00 0.00 61.00 62.57 1cru s PRO 182 Cb -0.01 -2.36 0.01 0.00 0.04 0.00 0.00 34.50 32.18 1cru s PRO 182 CO -0.02 -0.41 1.07 0.95 0.04 0.00 0.00 177.00 178.63 1cru s THR 183 N -1.69 3.52 0.45 1.26 -4.23 -1.26 -4.82 115.64 108.87 1cru s THR 183 Ca 0.63 0.41 0.15 0.00 -1.18 0.00 0.00 61.69 61.70 1cru s THR 183 Cb -0.23 -3.48 0.19 0.00 1.34 0.00 0.00 72.50 70.32 1cru s THR 183 CO 0.28 -0.61 2.00 -0.61 -0.54 0.00 0.00 174.62 175.15 1cru h GLN 184 N -0.58 0.00 -0.21 3.99 5.75 -1.94 -2.00 115.11 120.12 1cru h GLN 184 Ca -0.45 0.00 -0.04 0.00 -0.15 0.00 0.00 58.65 58.01 1cru h GLN 184 Cb 1.25 0.00 -0.01 0.00 1.07 0.00 0.00 27.48 29.80 1cru h GLN 184 CO 0.63 0.17 -0.01 1.96 -2.65 0.00 0.00 178.83 178.94 1cru h GLN 185 N 0.00 0.38 -0.60 1.69 7.50 -1.99 0.89 115.11 122.98 1cru h GLN 185 Ca -0.00 -0.13 -0.02 0.00 0.50 0.00 0.00 58.65 59.00 1cru h GLN 185 Cb 0.31 -0.03 -0.03 0.00 0.05 0.00 0.00 27.48 27.78 1cru h GLN 185 CO 0.02 0.58 0.29 0.93 -1.50 0.00 0.00 178.83 179.16 1cru h GLU 186 N 0.13 0.86 -0.49 1.46 5.08 -1.80 -1.93 114.58 117.89 1cru h GLU 186 Ca 0.06 -0.12 -0.01 0.00 -1.00 0.00 0.00 59.36 58.29 1cru h GLU 186 Cb 0.42 -0.16 -0.02 0.00 0.50 0.00 0.00 28.75 29.49 1cru h GLU 186 CO 0.01 0.69 0.28 1.25 -1.00 0.00 0.00 179.01 180.24 1cru h LEU 187 N 0.81 0.60 -1.59 1.33 5.85 -1.14 0.11 115.31 121.29 1cru h LEU 187 Ca 0.21 -0.08 0.01 0.00 0.84 0.00 0.00 57.88 58.86 1cru h LEU 187 Cb 0.11 -0.15 -0.02 0.00 0.37 0.00 0.00 40.66 40.96 1cru h LEU 187 CO -0.03 0.50 0.29 0.78 -0.34 0.00 0.00 178.44 179.65 1cru h ASN 188 N 0.65 0.47 -0.18 1.25 -0.26 -0.57 -0.60 115.58 116.34 1cru h ASN 188 Ca 0.17 -0.01 0.00 0.00 -0.56 0.00 0.00 56.30 55.90 1cru h ASN 188 Cb 0.02 -0.12 0.00 0.00 -1.06 0.00 0.00 38.32 37.17 1cru h ASN 188 CO -0.03 0.34 0.00 0.61 -1.06 0.00 0.00 177.43 177.29 1cru n GLY 189 N -1.48 0.29 3.30 2.83 0.00 -0.75 -4.91 105.19 104.47 1cru n GLY 189 Ca 0.04 -0.40 -0.24 0.00 0.00 0.00 0.00 46.02 45.42 1cru n GLY 189 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1cru n LYS 190 N 0.31 -5.35 -3.03 1.61 5.02 -0.23 -4.93 118.16 111.56 1cru n LYS 190 Ca 0.15 0.79 -0.44 0.00 -2.02 0.00 0.00 58.31 56.79 1cru n LYS 190 Cb 0.32 -5.67 -0.05 0.00 -0.02 0.00 0.00 35.03 29.61 1cru n LYS 190 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 1cru s ASP 191 N -2.90 6.22 -0.44 4.39 3.68 0.30 -4.92 116.67 122.99 1cru s ASP 191 Ca 0.42 -0.99 0.04 0.00 2.13 0.00 0.00 52.55 54.15 1cru s ASP 191 Cb -0.20 -2.34 0.62 0.00 -1.45 0.00 0.00 42.92 39.55 1cru s ASP 191 CO 0.52 -1.13 1.85 -1.22 0.13 0.00 0.00 175.17 175.32 1cru n TYR 192 N 6.76 2.77 0.25 -5.34 0.53 -1.26 -4.44 117.16 116.44 1cru n TYR 192 Ca -0.06 -1.92 0.09 0.00 -1.02 0.00 0.00 57.90 55.00 1cru n TYR 192 Cb 0.45 -0.91 0.65 0.00 -1.03 0.00 0.00 39.34 38.50 1cru n TYR 192 CO 0.00 0.00 0.00 1.12 -1.02 0.00 0.00 176.86 176.96 1cru h HIS 193 N 1.09 0.00 0.00 -0.72 2.07 -1.91 0.12 115.15 115.80 1cru h HIS 193 Ca 0.57 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 58.09 1cru h HIS 193 Cb 2.50 0.00 0.00 0.00 2.57 0.00 0.00 27.41 32.48 1cru h HIS 193 CO 1.49 0.11 0.00 0.25 -3.07 0.00 0.00 177.93 176.71 1cru n THR 194 N -4.11 0.00 -1.72 6.12 -2.24 -1.26 -4.24 114.28 106.83 1cru n THR 194 Ca -0.02 0.00 -0.41 0.00 -2.27 0.00 0.00 64.05 61.35 1cru n THR 194 Cb 0.19 -0.51 -0.01 0.00 -2.10 0.00 0.00 70.33 67.90 1cru n THR 194 CO 0.00 0.00 0.00 -1.22 -0.57 0.00 0.00 175.07 173.28 1cru n TYR 195 N -1.14 2.91 -4.30 4.78 0.53 0.03 -4.72 117.16 115.25 1cru n TYR 195 Ca 0.19 -2.97 -0.21 0.00 -1.02 0.00 0.00 57.90 53.90 1cru n TYR 195 Cb 0.17 -2.33 -0.16 0.00 -1.03 0.00 0.00 39.34 35.99 1cru n TYR 195 CO 0.00 0.00 0.00 -1.64 -1.02 0.00 0.00 176.86 174.20 1cru s MET 196 N 1.73 1.01 -0.69 -0.72 -1.94 -1.26 -4.53 119.30 112.90 1cru s MET 196 Ca 0.55 -0.21 -0.01 0.00 -1.71 0.00 0.00 55.69 54.30 1cru s MET 196 Cb 0.15 -0.94 0.00 0.00 2.01 0.00 0.00 34.83 36.06 1cru s MET 196 CO -0.06 -0.01 0.58 0.41 -0.01 0.00 0.00 175.02 175.93 1cru n GLY 197 N 3.78 0.03 3.17 -0.03 0.00 0.20 -3.59 105.19 108.76 1cru n GLY 197 Ca -0.23 -0.16 -0.11 0.00 0.00 0.00 0.00 46.02 45.52 1cru n GLY 197 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1cru s LYS 198 N -5.02 0.87 -0.25 1.61 -0.14 -0.18 -1.48 119.74 115.14 1cru s LYS 198 Ca 0.09 -1.37 -0.07 0.00 -1.36 0.00 0.00 55.97 53.27 1cru s LYS 198 Cb -0.04 -0.14 -0.02 0.00 -1.68 0.00 0.00 37.83 35.95 1cru s LYS 198 CO 0.40 -0.07 0.05 0.08 -0.76 0.00 0.00 175.35 175.06 1cru s VAL 199 N -3.69 4.13 0.16 3.17 1.01 -0.65 -1.22 120.40 123.31 1cru s VAL 199 Ca 0.14 -0.26 -0.04 0.00 0.00 0.00 0.00 61.98 61.82 1cru s VAL 199 Cb 0.06 -2.94 -0.05 0.00 0.00 0.00 0.00 36.38 33.45 1cru s VAL 199 CO -0.03 0.33 0.39 -0.76 0.00 0.00 0.00 175.10 175.03 1cru s LEU 200 N 1.59 4.25 -0.14 3.92 1.43 0.88 -0.39 118.68 130.21 1cru s LEU 200 Ca 0.06 0.56 -0.01 0.00 -1.03 0.00 0.00 54.13 53.72 1cru s LEU 200 Cb -0.15 -3.30 0.03 0.00 0.03 0.00 0.00 46.19 42.80 1cru s LEU 200 CO 0.02 0.02 -0.06 -0.60 0.23 0.00 0.00 176.35 175.97 1cru s ARG 201 N -2.81 1.45 0.14 1.70 3.52 0.64 -0.91 118.95 122.67 1cru s ARG 201 Ca 0.41 -0.37 0.07 0.00 -0.13 0.00 0.00 55.73 55.71 1cru s ARG 201 Cb -0.12 -1.78 -0.04 0.00 -1.56 0.00 0.00 34.95 31.46 1cru s ARG 201 CO 0.26 -0.35 -0.16 -0.48 -0.81 0.00 0.00 175.30 173.76 1cru s LEU 202 N 1.68 2.42 0.87 -0.88 2.34 0.43 -4.53 118.68 121.01 1cru s LEU 202 Ca 0.03 -0.84 -0.11 0.00 0.06 0.00 0.00 54.13 53.27 1cru s LEU 202 Cb -0.14 -0.66 0.11 0.00 -0.56 0.00 0.00 46.19 44.94 1cru s LEU 202 CO -0.08 -0.10 1.10 0.20 -1.06 0.00 0.00 176.35 176.40 1cru s ASN 203 N -2.57 3.62 0.32 1.48 0.01 -0.31 -0.75 114.94 116.74 1cru s ASN 203 Ca 0.12 1.76 0.24 0.00 -0.71 0.00 0.00 52.86 54.27 1cru s ASN 203 Cb -0.05 -2.39 1.15 0.00 0.41 0.00 0.00 41.25 40.36 1cru s ASN 203 CO 0.04 -2.59 1.73 -0.07 -1.51 0.00 0.00 177.10 174.71 1cru h LEU 204 N -1.51 0.00 -2.20 0.60 3.38 -1.89 -0.40 115.31 113.29 1cru h LEU 204 Ca -0.47 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.50 1cru h LEU 204 Cb 1.26 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.01 1cru h LEU 204 CO 0.51 0.00 0.00 -0.90 0.09 0.00 0.00 178.44 178.14 1cru n ASP 205 N -2.33 3.28 0.00 -0.43 5.68 -1.26 -4.95 116.55 116.54 1cru n ASP 205 Ca 0.00 -1.97 0.00 0.00 -0.50 0.00 0.00 54.79 52.33 1cru n ASP 205 Cb 0.14 -0.25 0.00 0.00 -1.14 0.00 0.00 41.12 39.87 1cru n ASP 205 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1cru n GLY 206 N 1.48 1.00 3.77 6.12 0.00 -0.16 -4.76 105.19 112.63 1cru n GLY 206 Ca 0.19 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.92 1cru n GLY 206 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1cru s SER 207 N -2.55 3.75 -0.24 1.61 1.04 -1.26 -4.66 113.70 111.40 1cru s SER 207 Ca 0.00 1.21 -0.29 0.00 0.48 0.00 0.00 55.95 57.35 1cru s SER 207 Cb 0.00 -1.87 0.01 0.00 0.10 0.00 0.00 66.02 64.26 1cru s SER 207 CO 0.00 -2.43 1.04 -0.63 0.98 0.00 0.00 173.24 172.20 1cru s ILE 208 N -3.14 4.67 0.16 -1.02 1.01 -1.26 -1.16 121.20 120.47 1cru s ILE 208 Ca 0.63 1.99 -0.31 0.00 0.00 0.00 0.00 60.65 62.96 1cru s ILE 208 Cb -0.16 -4.31 -0.11 0.00 0.01 0.00 0.00 42.46 37.89 1cru s ILE 208 CO 0.55 -0.20 1.78 -2.84 0.00 0.00 0.00 174.94 174.23 1cru s PRO 209 N 3.22 4.13 0.62 2.79 0.02 -1.26 -4.86 135.00 139.66 1cru s PRO 209 Ca 0.44 2.60 0.39 0.00 0.02 0.00 0.00 61.00 64.45 1cru s PRO 209 Cb -0.15 -3.35 2.02 0.00 0.02 0.00 0.00 34.50 33.04 1cru s PRO 209 CO 0.07 -0.80 2.24 0.87 -0.33 0.00 0.00 177.00 179.05 1cru h LYS 210 N 7.76 0.00 -0.64 5.54 1.57 -1.97 -1.76 116.57 127.06 1cru h LYS 210 Ca -0.45 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.33 1cru h LYS 210 Cb 1.21 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.52 1cru h LYS 210 CO 0.95 0.02 0.00 -0.40 -0.57 0.00 0.00 179.45 179.45 1cru n ASP 211 N -3.22 4.24 -4.75 0.86 5.75 -1.26 -4.95 116.55 113.21 1cru n ASP 211 Ca -0.02 -2.38 -0.32 0.00 -0.01 0.00 0.00 54.79 52.06 1cru n ASP 211 Cb 0.15 -0.54 0.08 0.00 -1.03 0.00 0.00 41.12 39.78 1cru n ASP 211 CO 0.00 0.00 0.00 0.20 -0.11 0.00 0.00 177.20 177.29 1cru s ASN 212 N -0.85 4.50 0.65 -1.12 -0.87 -0.67 -4.98 114.94 111.61 1cru s ASN 212 Ca 0.45 2.01 -0.16 0.00 -1.57 0.00 0.00 52.86 53.59 1cru s ASN 212 Cb 0.29 -2.55 -0.00 0.00 -0.02 0.00 0.00 41.25 38.97 1cru s ASN 212 CO 0.22 -2.04 1.17 -2.16 -2.57 0.00 0.00 177.10 171.71 1cru s PRO 213 N -4.42 2.68 -0.14 -0.60 0.04 -1.26 -4.92 135.00 126.37 1cru s PRO 213 Ca 0.66 1.64 -0.12 0.00 0.04 0.00 0.00 61.00 63.22 1cru s PRO 213 Cb -0.21 -1.91 -0.05 0.00 0.04 0.00 0.00 34.50 32.37 1cru s PRO 213 CO 0.49 -1.39 0.26 0.45 0.04 0.00 0.00 177.00 176.84 1cru s SER 214 N -2.07 6.43 -0.19 6.66 0.15 -1.26 -4.34 113.70 119.07 1cru s SER 214 Ca 0.73 0.51 0.01 0.00 0.70 0.00 0.00 55.95 57.89 1cru s SER 214 Cb -0.26 -2.16 0.04 0.00 -1.71 0.00 0.00 66.02 61.93 1cru s SER 214 CO 0.39 0.19 -0.11 -0.36 1.20 0.00 0.00 173.24 174.55 1cru s PHE 215 N 0.05 2.39 -1.42 3.44 0.40 0.19 -4.76 117.98 118.27 1cru s PHE 215 Ca 0.16 -1.55 -0.10 0.00 -0.60 0.00 0.00 56.93 54.84 1cru s PHE 215 Cb -0.13 -1.64 0.04 0.00 0.51 0.00 0.00 43.02 41.80 1cru s PHE 215 CO 0.04 -0.73 1.10 0.09 0.70 0.00 0.00 175.22 176.41 1cru n ASN 216 N 4.69 -5.59 -0.14 1.36 5.03 -1.26 -1.16 115.26 118.20 1cru n ASN 216 Ca -0.15 -0.64 -0.02 0.00 0.87 0.00 0.00 54.58 54.64 1cru n ASN 216 Cb 0.47 -4.58 -0.01 0.00 -1.02 0.00 0.00 39.78 34.64 1cru n ASN 216 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1cru n GLY 217 N -1.86 0.51 3.10 7.41 0.00 -1.26 -4.99 105.19 108.10 1cru n GLY 217 Ca 0.01 -0.25 -0.27 0.00 0.00 0.00 0.00 46.02 45.50 1cru n GLY 217 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1cru s VAL 218 N -1.88 1.50 -0.36 1.61 1.01 -0.31 -5.01 120.40 116.97 1cru s VAL 218 Ca 0.00 -0.70 -0.14 0.00 0.00 0.00 0.00 61.98 61.15 1cru s VAL 218 Cb 0.00 -1.33 -0.01 0.00 0.00 0.00 0.00 36.38 35.05 1cru s VAL 218 CO 0.00 0.44 0.26 -0.69 0.00 0.00 0.00 175.10 175.11 1cru s VAL 219 N 0.50 5.27 0.00 2.92 1.01 -1.26 -0.63 120.40 128.20 1cru s VAL 219 Ca -0.15 -0.32 0.00 0.00 0.00 0.00 0.00 61.98 61.51 1cru s VAL 219 Cb -0.16 -3.78 0.00 0.00 0.00 0.00 0.00 36.38 32.44 1cru s VAL 219 CO 0.06 -0.10 0.00 -1.54 0.00 0.00 0.00 175.10 173.52 1cru n SER 220 N 5.14 1.72 0.00 3.32 3.41 -1.26 -5.01 113.62 120.94 1cru n SER 220 Ca -0.12 -0.27 0.11 0.00 -0.26 0.00 0.00 58.87 58.33 1cru n SER 220 Cb 0.49 0.00 0.50 0.00 -0.26 0.00 0.00 64.21 64.94 1cru n SER 220 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 1cru n HIS 221 N 0.00 0.00 -2.18 7.33 8.25 -1.26 -4.76 115.22 122.59 1cru n HIS 221 Ca 0.00 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 57.04 1cru n HIS 221 Cb 0.00 -0.45 -0.03 0.00 1.12 0.00 0.00 29.99 30.63 1cru n HIS 221 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 1cru s ILE 222 N -2.91 3.20 -0.20 1.59 1.01 -1.26 -0.26 121.20 122.38 1cru s ILE 222 Ca 0.13 0.93 -0.06 0.00 0.00 0.00 0.00 60.65 61.66 1cru s ILE 222 Cb 0.15 -3.60 -0.10 0.00 0.01 0.00 0.00 42.46 38.92 1cru s ILE 222 CO 0.40 0.11 -0.22 0.00 0.00 0.00 0.00 174.94 175.22 1cru n TYR 223 N 3.17 0.00 -4.12 3.97 9.36 0.48 -4.37 117.16 125.65 1cru n TYR 223 Ca 0.08 0.00 -0.09 0.00 3.32 0.00 0.00 57.90 61.21 1cru n TYR 223 Cb 0.42 -0.72 -0.10 0.00 -0.63 0.00 0.00 39.34 38.31 1cru n TYR 223 CO 0.00 0.00 0.00 0.95 0.22 0.00 0.00 176.86 178.03 1cru s THR 224 N -2.37 0.47 0.38 2.97 -4.23 -0.88 -1.01 115.64 110.97 1cru s THR 224 Ca -0.27 -1.74 0.04 0.00 -1.18 0.00 0.00 61.69 58.54 1cru s THR 224 Cb 0.09 -1.43 -0.03 0.00 1.34 0.00 0.00 72.50 72.47 1cru s THR 224 CO 0.38 -0.85 0.16 -1.48 -0.54 0.00 0.00 174.62 172.30 1cru s LEU 225 N -2.76 1.91 -0.27 4.79 2.34 -0.94 -1.64 118.68 122.11 1cru s LEU 225 Ca 0.06 -1.69 -0.01 0.00 0.06 0.00 0.00 54.13 52.55 1cru s LEU 225 Cb 0.04 0.06 0.00 0.00 -0.56 0.00 0.00 46.19 45.73 1cru s LEU 225 CO -0.06 -0.96 0.23 0.61 -1.06 0.00 0.00 176.35 175.11 1cru n GLY 226 N -0.83 0.52 3.51 -3.48 0.00 -0.68 -0.46 105.19 103.77 1cru n GLY 226 Ca -0.03 -0.44 -0.28 0.00 0.00 0.00 0.00 46.02 45.28 1cru n GLY 226 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1cru s HIS 227 N -3.07 2.53 0.00 1.61 3.76 -0.55 -1.37 115.29 118.20 1cru s HIS 227 Ca 0.08 -0.26 0.00 0.00 -0.15 0.00 0.00 55.06 54.73 1cru s HIS 227 Cb -0.03 -1.28 0.00 0.00 1.11 0.00 0.00 32.58 32.38 1cru s HIS 227 CO 0.15 0.47 0.00 -2.13 -0.85 0.00 0.00 174.74 172.38 1cru n ARG 228 N 0.35 0.00 -3.46 1.40 0.63 -1.26 -4.23 116.66 110.09 1cru n ARG 228 Ca -0.13 0.00 -0.27 0.00 -0.92 0.00 0.00 57.85 56.53 1cru n ARG 228 Cb 0.55 -0.02 -0.10 0.00 0.45 0.00 0.00 32.46 33.33 1cru n ARG 228 CO 0.00 0.00 0.00 -1.71 -2.51 0.00 0.00 177.63 173.41 1cru n ASN 229 N -1.54 0.15 -4.54 6.15 5.15 -1.22 -0.84 115.26 118.57 1cru n ASN 229 Ca 0.00 -2.53 -0.42 0.00 -0.60 0.00 0.00 54.58 51.03 1cru n ASN 229 Cb 0.00 -0.59 -0.03 0.00 -0.53 0.00 0.00 39.78 38.63 1cru n ASN 229 CO 0.00 0.00 0.00 -2.16 1.40 0.00 0.00 177.26 176.50 1cru s PRO 230 N -0.28 3.48 0.00 1.20 0.04 -1.26 -1.44 135.00 136.74 1cru s PRO 230 Ca 0.32 -1.00 0.27 0.00 0.04 0.00 0.00 61.00 60.62 1cru s PRO 230 Cb 0.03 -4.98 0.83 0.00 0.04 0.00 0.00 34.50 30.43 1cru s PRO 230 CO -0.19 -2.11 1.62 1.04 0.04 0.00 0.00 177.00 177.40 1cru n GLN 231 N 8.60 0.56 -5.13 4.56 6.02 -1.16 -4.56 117.38 126.27 1cru n GLN 231 Ca 0.23 -0.29 -0.32 0.00 -0.01 0.00 0.00 57.00 56.61 1cru n GLN 231 Cb 0.50 -1.49 -0.15 0.00 1.02 0.00 0.00 30.24 30.11 1cru n GLN 231 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.06 176.25 1cru s GLY 232 N -2.64 1.38 -0.22 1.08 0.00 -0.99 -4.20 107.32 101.73 1cru s GLY 232 Ca 0.22 -1.02 -0.09 0.00 0.00 0.00 0.00 44.72 43.83 1cru s GLY 232 CO 0.55 -0.63 0.49 -2.27 0.00 0.00 0.00 173.10 171.24 1cru s LEU 233 N -0.24 -0.69 -0.21 0.66 2.96 -1.26 -1.71 118.68 118.18 1cru s LEU 233 Ca -0.01 1.15 -0.16 0.00 -0.22 0.00 0.00 54.13 54.90 1cru s LEU 233 Cb -0.13 1.65 0.06 0.00 0.50 0.00 0.00 46.19 48.27 1cru s LEU 233 CO 0.03 -0.22 0.54 0.00 -1.32 0.00 0.00 176.35 175.38 1cru s ALA 234 N 2.40 -1.39 0.31 5.97 0.00 -0.09 -4.85 121.76 124.11 1cru s ALA 234 Ca -0.05 1.74 -0.22 0.00 0.00 0.00 0.00 51.96 53.43 1cru s ALA 234 Cb -0.11 -1.03 -0.10 0.00 0.00 0.00 0.00 23.12 21.89 1cru s ALA 234 CO -0.15 -0.29 0.86 -0.06 0.00 0.00 0.00 175.76 176.12 1cru s PHE 235 N 0.89 3.57 0.50 0.00 0.40 -1.26 -0.63 117.98 121.45 1cru s PHE 235 Ca -0.05 1.57 -0.00 0.00 -0.60 0.00 0.00 56.93 57.85 1cru s PHE 235 Cb -0.05 -2.78 0.01 0.00 0.51 0.00 0.00 43.02 40.71 1cru s PHE 235 CO -0.08 0.17 0.73 0.95 0.70 0.00 0.00 175.22 177.70 1cru s THR 236 N -1.74 3.52 0.62 0.64 -4.23 0.20 -4.77 115.64 109.88 1cru s THR 236 Ca 0.51 -0.50 0.38 0.00 -1.18 0.00 0.00 61.69 60.90 1cru s THR 236 Cb -0.15 -3.32 0.41 0.00 1.34 0.00 0.00 72.50 70.77 1cru s THR 236 CO 0.20 -0.24 2.31 -0.65 -0.54 0.00 0.00 174.62 175.71 1cru h PRO 237 N 0.23 0.00 -0.54 3.99 0.11 -1.98 -1.14 132.00 132.66 1cru h PRO 237 Ca -0.45 0.00 -0.04 0.00 0.11 0.00 0.00 66.00 65.62 1cru h PRO 237 Cb 1.27 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.35 1cru h PRO 237 CO 0.56 0.00 0.05 0.27 -0.21 0.00 0.00 178.00 178.67 1cru n ASN 238 N -3.40 5.17 0.00 -2.05 6.94 -1.26 -4.94 115.26 115.71 1cru n ASN 238 Ca -0.03 -3.03 0.00 0.00 -0.02 0.00 0.00 54.58 51.50 1cru n ASN 238 Cb 0.08 -0.67 0.00 0.00 -2.36 0.00 0.00 39.78 36.83 1cru n ASN 238 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1cru n GLY 239 N 0.22 0.69 3.89 4.83 0.00 -0.43 -5.05 105.19 109.33 1cru n GLY 239 Ca 0.29 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 46.02 1cru n GLY 239 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1cru s LYS 240 N -0.18 3.42 -0.26 1.61 1.02 -1.26 -4.81 119.74 119.28 1cru s LYS 240 Ca 0.00 0.44 0.02 0.00 0.02 0.00 0.00 55.97 56.45 1cru s LYS 240 Cb 0.00 -2.20 0.05 0.00 -0.52 0.00 0.00 37.83 35.17 1cru s LYS 240 CO 0.00 -0.51 -0.10 -1.17 -0.92 0.00 0.00 175.35 172.65 1cru s LEU 241 N -5.03 3.37 0.16 3.17 2.96 -1.26 -0.63 118.68 121.43 1cru s LEU 241 Ca 0.53 -1.27 0.02 0.00 -0.22 0.00 0.00 54.13 53.19 1cru s LEU 241 Cb -0.11 -1.58 -0.04 0.00 0.50 0.00 0.00 46.19 44.97 1cru s LEU 241 CO 0.50 -0.18 0.31 -0.76 -1.32 0.00 0.00 176.35 174.90 1cru s LEU 242 N 1.16 4.32 -0.05 -0.68 1.43 0.19 -0.49 118.68 124.57 1cru s LEU 242 Ca -0.06 0.21 -0.15 0.00 -1.03 0.00 0.00 54.13 53.10 1cru s LEU 242 Cb -0.19 -2.96 0.03 0.00 0.03 0.00 0.00 46.19 43.10 1cru s LEU 242 CO -0.05 0.03 0.33 -1.58 0.23 0.00 0.00 176.35 175.31 1cru s GLN 243 N -3.29 0.61 0.10 1.70 -0.44 -0.31 -0.92 119.66 117.11 1cru s GLN 243 Ca 0.35 -0.00 0.10 0.00 -2.50 0.00 0.00 55.36 53.31 1cru s GLN 243 Cb -0.11 0.28 -0.04 0.00 -1.64 0.00 0.00 33.01 31.50 1cru s GLN 243 CO 0.29 -0.15 -0.25 -1.54 0.50 0.00 0.00 175.29 174.13 1cru s SER 244 N -0.93 3.36 -0.11 6.67 1.04 -0.69 -0.79 113.70 122.24 1cru s SER 244 Ca -0.10 -0.66 -0.09 0.00 0.48 0.00 0.00 55.95 55.58 1cru s SER 244 Cb -0.04 -0.30 0.03 0.00 0.10 0.00 0.00 66.02 65.82 1cru s SER 244 CO 0.03 0.21 0.29 -0.70 0.98 0.00 0.00 173.24 174.05 1cru s GLU 245 N -1.79 0.31 -0.04 4.02 2.12 -0.08 -2.33 118.70 120.90 1cru s GLU 245 Ca 0.14 0.46 -0.28 0.00 0.36 0.00 0.00 54.97 55.65 1cru s GLU 245 Cb -0.10 0.08 -0.03 0.00 0.26 0.00 0.00 34.13 34.34 1cru s GLU 245 CO 0.05 -0.08 0.91 -0.65 -0.54 0.00 0.00 175.26 174.96 1cru s GLN 246 N 0.53 4.49 0.56 4.30 -0.21 -0.52 -0.58 119.66 128.24 1cru s GLN 246 Ca -0.03 1.27 0.05 0.00 0.02 0.00 0.00 55.36 56.67 1cru s GLN 246 Cb -0.05 -3.48 0.10 0.00 1.00 0.00 0.00 33.01 30.59 1cru s GLN 246 CO -0.03 -0.09 0.77 0.41 -2.12 0.00 0.00 175.29 174.23 1cru n GLY 247 N 3.02 1.42 0.00 3.09 0.00 -1.26 -3.40 105.19 108.06 1cru n GLY 247 Ca 0.05 -2.13 0.00 0.00 0.00 0.00 0.00 46.02 43.93 1cru n GLY 247 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1cru n PRO 248 N -2.32 0.00 0.00 1.61 -0.04 -1.26 -4.68 135.00 128.31 1cru n PRO 248 Ca 0.14 0.00 0.14 0.00 -0.04 0.00 0.00 63.50 63.74 1cru n PRO 248 Cb 0.52 0.00 0.53 0.00 -0.04 0.00 0.00 33.50 34.51 1cru n PRO 248 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1cru n ASN 249 N 0.00 1.16 -3.32 3.54 4.13 -1.26 -4.93 115.26 114.59 1cru n ASN 249 Ca 0.00 -1.22 -0.10 0.00 1.68 0.00 0.00 54.58 54.94 1cru n ASN 249 Cb 0.00 0.03 -0.01 0.00 -1.54 0.00 0.00 39.78 38.25 1cru n ASN 249 CO 0.00 0.00 0.00 -0.94 0.28 0.00 0.00 177.26 176.60 1cru s SER 250 N -2.17 0.25 -1.29 6.41 1.04 -1.26 -3.13 113.70 113.55 1cru s SER 250 Ca 0.35 -1.15 -0.04 0.00 0.48 0.00 0.00 55.95 55.58 1cru s SER 250 Cb 0.21 0.73 0.01 0.00 0.10 0.00 0.00 66.02 67.07 1cru s SER 250 CO 0.40 -1.44 1.07 0.47 0.98 0.00 0.00 173.24 174.72 1cru n ASP 251 N -1.12 -3.96 -4.72 7.02 8.00 0.56 -4.38 116.55 117.96 1cru n ASP 251 Ca -0.04 -0.60 -0.34 0.00 0.71 0.00 0.00 54.79 54.52 1cru n ASP 251 Cb 0.61 -5.00 0.10 0.00 -0.02 0.00 0.00 41.12 36.81 1cru n ASP 251 CO 0.00 0.00 0.00 -1.81 -0.39 0.00 0.00 177.20 175.00 1cru s ASP 252 N -3.88 4.07 0.08 -2.24 1.01 -1.12 -4.02 116.67 110.58 1cru s ASP 252 Ca 0.28 2.33 0.04 0.00 0.71 0.00 0.00 52.55 55.91 1cru s ASP 252 Cb -0.12 -2.59 -0.03 0.00 1.01 0.00 0.00 42.92 41.19 1cru s ASP 252 CO 0.74 -2.34 -0.11 -1.61 0.21 0.00 0.00 175.17 172.06 1cru s GLU 253 N -4.00 0.80 -0.24 8.23 2.02 0.25 -0.84 118.70 124.92 1cru s GLU 253 Ca 0.73 -1.06 -0.04 0.00 0.02 0.00 0.00 54.97 54.62 1cru s GLU 253 Cb -0.28 -0.58 0.00 0.00 0.10 0.00 0.00 34.13 33.37 1cru s GLU 253 CO 0.47 0.10 -0.02 0.42 0.02 0.00 0.00 175.26 176.25 1cru s ILE 254 N -2.03 3.38 0.18 -1.63 -1.09 -0.27 -0.90 121.20 118.84 1cru s ILE 254 Ca 0.02 -0.66 0.10 0.00 -2.23 0.00 0.00 60.65 57.88 1cru s ILE 254 Cb -0.05 -2.63 -0.04 0.00 -1.58 0.00 0.00 42.46 38.16 1cru s ILE 254 CO 0.01 0.29 -0.18 0.20 -1.23 0.00 0.00 174.94 174.03 1cru s ASN 255 N 1.45 3.79 -0.31 3.58 0.01 0.03 -0.37 114.94 123.11 1cru s ASN 255 Ca 0.04 -0.72 -0.11 0.00 -0.71 0.00 0.00 52.86 51.36 1cru s ASN 255 Cb -0.15 -0.46 -0.02 0.00 0.41 0.00 0.00 41.25 41.03 1cru s ASN 255 CO -0.02 0.12 0.18 -0.22 -1.51 0.00 0.00 177.10 175.65 1cru s LEU 256 N -2.64 4.21 -0.30 0.60 2.96 -1.26 -1.16 118.68 121.08 1cru s LEU 256 Ca 0.22 -0.43 -0.23 0.00 -0.22 0.00 0.00 54.13 53.47 1cru s LEU 256 Cb -0.09 -2.05 -0.00 0.00 0.50 0.00 0.00 46.19 44.55 1cru s LEU 256 CO 0.12 -0.19 0.78 -0.63 -1.32 0.00 0.00 176.35 175.11 1cru s ILE 257 N 1.66 4.81 -0.02 6.68 -1.09 0.36 -5.03 121.20 128.58 1cru s ILE 257 Ca 0.05 1.21 0.08 0.00 -2.23 0.00 0.00 60.65 59.76 1cru s ILE 257 Cb -0.17 -4.13 -0.02 0.00 -1.58 0.00 0.00 42.46 36.56 1cru s ILE 257 CO 0.08 -0.22 -0.25 0.68 -1.23 0.00 0.00 174.94 174.00 1cru s VAL 258 N 2.92 2.00 -0.16 2.92 -7.23 -1.26 -4.43 120.40 115.15 1cru s VAL 258 Ca 0.32 -1.08 -0.39 0.00 -1.81 0.00 0.00 61.98 59.02 1cru s VAL 258 Cb -0.14 -1.66 -0.16 0.00 0.56 0.00 0.00 36.38 34.97 1cru s VAL 258 CO 0.12 0.57 1.58 1.17 -0.31 0.00 0.00 175.10 178.22 1cru n LYS 259 N 2.47 1.06 -0.93 4.82 4.81 -1.26 -1.12 118.16 128.00 1cru n LYS 259 Ca -0.16 0.39 0.00 0.00 -0.87 0.00 0.00 58.31 57.67 1cru n LYS 259 Cb 0.51 -2.04 0.00 0.00 0.02 0.00 0.00 35.03 33.52 1cru n LYS 259 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1cru n GLY 260 N 3.54 0.93 3.76 3.14 0.00 -0.18 -5.02 105.19 111.37 1cru n GLY 260 Ca 0.24 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.91 1cru n GLY 260 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1cru s GLY 261 N -1.94 2.61 -0.25 -0.02 0.00 -0.28 -4.86 107.32 102.58 1cru s GLY 261 Ca 0.00 0.88 -0.03 0.00 0.00 0.00 0.00 44.72 45.57 1cru s GLY 261 CO 0.00 1.26 -0.03 0.21 0.00 0.00 0.00 173.10 174.54 1cru s ASN 262 N -1.80 4.44 -0.01 1.64 3.84 -0.30 -2.22 114.94 120.52 1cru s ASN 262 Ca 0.74 -0.73 0.11 0.00 0.21 0.00 0.00 52.86 53.20 1cru s ASN 262 Cb -0.27 -1.72 0.34 0.00 -0.55 0.00 0.00 41.25 39.06 1cru s ASN 262 CO 0.33 -0.11 1.27 -1.22 -2.79 0.00 0.00 177.10 174.58 1cru n TYR 263 N 4.73 0.54 0.00 0.43 4.02 0.39 -0.83 117.16 126.44 1cru n TYR 263 Ca -0.17 -0.26 0.00 0.00 -0.01 0.00 0.00 57.90 57.46 1cru n TYR 263 Cb 0.48 -0.02 0.00 0.00 -0.02 0.00 0.00 39.34 39.78 1cru n TYR 263 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1cru n GLY 264 N 1.06 2.83 3.77 2.72 0.00 -1.16 -4.80 105.19 109.61 1cru n GLY 264 Ca 0.13 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.75 1cru n GLY 264 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 1cru s TRP 265 N -1.10 2.99 -2.47 1.61 -0.11 -0.47 -0.85 118.94 118.53 1cru s TRP 265 Ca 0.00 1.42 0.23 0.00 1.22 0.00 0.00 56.10 58.96 1cru s TRP 265 Cb 0.00 -3.67 0.49 0.00 -1.50 0.00 0.00 33.47 28.78 1cru s TRP 265 CO 0.00 -1.90 1.43 -0.35 -4.62 0.00 0.00 176.95 171.51 1cru n PRO 266 N 0.62 2.32 0.19 5.86 -0.04 -1.26 -4.10 135.00 138.59 1cru n PRO 266 Ca 0.01 -1.99 0.04 0.00 -0.04 0.00 0.00 63.50 61.52 1cru n PRO 266 Cb 0.42 -1.48 0.37 0.00 -0.04 0.00 0.00 33.50 32.77 1cru n PRO 266 CO 0.00 0.00 0.00 -0.91 -0.04 0.00 0.00 175.50 174.55 1cru h ASN 267 N 3.97 0.00 -3.41 3.54 2.35 -1.57 -3.43 115.58 117.03 1cru h ASN 267 Ca 0.00 0.00 -0.39 0.00 -0.55 0.00 0.00 56.30 55.36 1cru h ASN 267 Cb 0.87 0.00 -0.35 0.00 0.05 0.00 0.00 38.32 38.89 1cru h ASN 267 CO 0.00 0.38 -0.76 -0.69 -1.65 0.00 0.00 177.43 174.70 1cru s VAL 268 N -3.92 0.35 -0.31 2.81 1.01 -0.03 -4.19 120.40 116.12 1cru s VAL 268 Ca -0.02 0.03 -0.08 0.00 0.00 0.00 0.00 61.98 61.91 1cru s VAL 268 Cb 0.13 -0.44 0.00 0.00 0.00 0.00 0.00 36.38 36.07 1cru s VAL 268 CO 0.70 0.21 0.12 0.00 0.00 0.00 0.00 175.10 176.12 1cru s ALA 269 N 1.26 3.17 0.00 5.51 0.00 -1.26 -3.29 121.76 127.14 1cru s ALA 269 Ca -0.06 -1.45 0.00 0.00 0.00 0.00 0.00 51.96 50.45 1cru s ALA 269 Cb -0.13 -2.28 0.00 0.00 0.00 0.00 0.00 23.12 20.71 1cru s ALA 269 CO -0.02 -0.95 0.00 0.41 0.00 0.00 0.00 175.76 175.20 1cru n GLY 270 N 4.92 1.09 3.81 0.00 0.00 -1.26 -4.75 105.19 109.00 1cru n GLY 270 Ca -0.14 -0.68 -0.31 0.00 0.00 0.00 0.00 46.02 44.89 1cru n GLY 270 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1cru s TYR 271 N 0.00 2.98 -1.25 1.61 1.51 -1.26 -4.52 117.35 116.42 1cru s TYR 271 Ca 0.00 1.46 -0.16 0.00 -1.01 0.00 0.00 57.07 57.36 1cru s TYR 271 Cb 0.00 -2.93 0.13 0.00 -0.11 0.00 0.00 41.96 39.05 1cru s TYR 271 CO 0.00 -1.35 1.58 0.21 -1.11 0.00 0.00 175.55 174.87 1cru s LYS 272 N -4.94 4.05 0.00 -0.62 2.20 -1.26 -4.59 119.74 114.58 1cru s LYS 272 Ca 0.59 -2.33 0.00 0.00 -0.36 0.00 0.00 55.97 53.87 1cru s LYS 272 Cb -0.15 -5.28 0.00 0.00 -1.51 0.00 0.00 37.83 30.89 1cru s LYS 272 CO 0.54 -1.99 0.26 -0.40 -0.36 0.00 0.00 175.35 173.39 1cru n ASP 273 N 6.88 0.51 -3.41 1.43 5.68 -1.26 -4.90 116.55 121.48 1cru n ASP 273 Ca 0.42 -0.83 -0.24 0.00 -0.50 0.00 0.00 54.79 53.64 1cru n ASP 273 Cb 0.44 0.17 -0.00 0.00 -1.14 0.00 0.00 41.12 40.59 1cru n ASP 273 CO 0.00 0.00 0.00 0.47 -1.33 0.00 0.00 177.20 176.34 1cru n ASP 274 N -0.17 -3.84 -3.95 -1.12 8.00 -1.26 -4.95 116.55 109.25 1cru n ASP 274 Ca 0.00 -0.43 -0.31 0.00 0.71 0.00 0.00 54.79 54.76 1cru n ASP 274 Cb 0.06 -3.17 -0.15 0.00 -0.02 0.00 0.00 41.12 37.84 1cru n ASP 274 CO 0.00 0.00 0.00 -0.55 -0.39 0.00 0.00 177.20 176.26 1cru s SER 275 N -2.77 4.07 0.00 -2.24 0.15 -1.26 -4.76 113.70 106.88 1cru s SER 275 Ca 0.42 -1.37 0.00 0.00 0.70 0.00 0.00 55.95 55.70 1cru s SER 275 Cb -0.22 -1.26 0.00 0.00 -1.71 0.00 0.00 66.02 62.83 1cru s SER 275 CO 0.52 -0.26 0.00 0.61 1.20 0.00 0.00 173.24 175.31 1cru n GLY 276 N 4.60 1.38 3.26 9.45 0.00 -1.16 -4.52 105.19 118.20 1cru n GLY 276 Ca -0.09 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.79 1cru n GLY 276 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1cru s TYR 277 N -3.33 -0.26 0.03 1.61 5.04 -1.26 -4.77 117.35 114.41 1cru s TYR 277 Ca 0.00 0.51 -0.07 0.00 -2.44 0.00 0.00 57.07 55.06 1cru s TYR 277 Cb 0.00 0.12 -0.00 0.00 0.35 0.00 0.00 41.96 42.43 1cru s TYR 277 CO 0.00 -0.35 0.14 0.00 -1.34 0.00 0.00 175.55 174.01 1cru s ALA 278 N -0.90 -0.21 -0.54 3.97 0.00 -0.93 -4.69 121.76 118.46 1cru s ALA 278 Ca -0.10 -0.40 -0.22 0.00 0.00 0.00 0.00 51.96 51.24 1cru s ALA 278 Cb -0.04 0.25 0.05 0.00 0.00 0.00 0.00 23.12 23.37 1cru s ALA 278 CO 0.03 -0.32 0.83 -0.47 0.00 0.00 0.00 175.76 175.83 1cru s TYR 279 N -2.46 2.88 -0.41 0.00 5.04 -0.51 -4.08 117.35 117.81 1cru s TYR 279 Ca -0.06 -0.21 -0.16 0.00 -2.44 0.00 0.00 57.07 54.20 1cru s TYR 279 Cb -0.02 -3.89 0.02 0.00 0.35 0.00 0.00 41.96 38.42 1cru s TYR 279 CO -0.04 -1.25 0.34 0.00 -1.34 0.00 0.00 175.55 173.27 1cru s ALA 280 N 3.49 3.46 -0.76 3.97 0.00 -1.26 -0.71 121.76 129.94 1cru s ALA 280 Ca 0.25 -1.61 -0.19 0.00 0.00 0.00 0.00 51.96 50.41 1cru s ALA 280 Cb -0.15 -2.93 0.12 0.00 0.00 0.00 0.00 23.12 20.16 1cru s ALA 280 CO 0.16 -1.46 0.92 1.21 0.00 0.00 0.00 175.76 176.60 1cru s ASN 281 N 1.73 6.42 0.44 0.00 3.84 -0.57 -4.91 114.94 121.89 1cru s ASN 281 Ca 0.08 -1.74 0.18 0.00 0.21 0.00 0.00 52.86 51.59 1cru s ASN 281 Cb -0.18 -2.35 1.02 0.00 -0.55 0.00 0.00 41.25 39.18 1cru s ASN 281 CO 0.11 -1.09 1.94 1.88 -2.79 0.00 0.00 177.10 177.15 1cru h TYR 282 N 8.95 0.00 0.00 0.43 -1.99 -1.88 -1.39 116.97 121.10 1cru h TYR 282 Ca -0.07 0.00 -0.00 0.00 2.00 0.00 0.00 58.73 60.66 1cru h TYR 282 Cb 1.05 0.00 -0.00 0.00 2.00 0.00 0.00 36.73 39.78 1cru h TYR 282 CO 1.01 0.24 -0.02 0.66 -0.00 0.00 0.00 178.16 180.06 1cru h SER 283 N 0.00 0.00 -0.64 3.88 4.64 -1.73 -0.46 113.55 119.23 1cru h SER 283 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1cru h SER 283 Cb 0.50 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.59 1cru h SER 283 CO 0.03 0.02 0.00 0.00 -0.87 0.00 0.00 176.83 176.01 1cru n ALA 284 N -2.14 2.56 -1.33 5.18 0.00 -0.53 -4.95 120.51 119.30 1cru n ALA 284 Ca -0.02 -1.39 -0.31 0.00 0.00 0.00 0.00 53.44 51.72 1cru n ALA 284 Cb 0.14 -0.87 0.08 0.00 0.00 0.00 0.00 19.45 18.80 1cru n ALA 284 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1cru s ALA 285 N -1.28 2.34 0.45 0.00 0.00 -0.18 -4.60 121.76 118.48 1cru s ALA 285 Ca 0.46 0.26 0.14 0.00 0.00 0.00 0.00 51.96 52.81 1cru s ALA 285 Cb 0.26 -3.26 1.01 0.00 0.00 0.00 0.00 23.12 21.13 1cru s ALA 285 CO 0.28 -1.64 2.00 0.00 0.00 0.00 0.00 175.76 176.40 1cru h ALA 286 N -0.98 1.72 -2.61 0.00 0.00 -1.29 -3.46 119.26 112.63 1cru h ALA 286 Ca -0.44 -0.15 0.13 0.00 0.00 0.00 0.00 54.91 54.45 1cru h ALA 286 Cb 1.23 -0.03 -0.07 0.00 0.00 0.00 0.00 17.79 18.91 1cru h ALA 286 CO 0.52 0.21 0.38 0.54 0.00 0.00 0.00 179.25 180.91 1cru s ASN 287 N -6.99 -0.23 0.00 0.00 2.20 -1.26 -5.05 114.94 103.60 1cru s ASN 287 Ca -0.04 -0.45 0.11 0.00 -0.94 0.00 0.00 52.86 51.53 1cru s ASN 287 Cb 0.16 0.58 0.33 0.00 -2.00 0.00 0.00 41.25 40.32 1cru s ASN 287 CO 0.70 -1.06 1.27 0.29 -2.94 0.00 0.00 177.10 175.35 1cru n LYS 288 N -0.45 1.71 0.01 3.55 5.02 -1.26 -3.59 118.16 123.15 1cru n LYS 288 Ca -0.06 -1.10 0.12 0.00 -2.02 0.00 0.00 58.31 55.25 1cru n LYS 288 Cb 0.60 -1.26 0.20 0.00 -0.02 0.00 0.00 35.03 34.55 1cru n LYS 288 CO 0.00 0.00 0.00 -1.13 -0.52 0.00 0.00 177.40 175.75 1cru n SER 289 N 0.39 0.56 -4.76 4.39 3.41 -1.26 -4.92 113.62 111.42 1cru n SER 289 Ca 0.11 -0.29 -0.41 0.00 -0.26 0.00 0.00 58.87 58.02 1cru n SER 289 Cb 0.27 0.34 -0.02 0.00 -0.26 0.00 0.00 64.21 64.54 1cru n SER 289 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 1cru s ILE 290 N -3.02 2.67 0.22 -1.33 1.01 -1.24 -5.01 121.20 114.50 1cru s ILE 290 Ca 0.10 0.64 -0.05 0.00 0.00 0.00 0.00 60.65 61.34 1cru s ILE 290 Cb 0.17 -3.41 -0.06 0.00 0.01 0.00 0.00 42.46 39.17 1cru s ILE 290 CO 0.72 0.14 0.48 -0.54 0.00 0.00 0.00 174.94 175.74 1cru s LYS 291 N -1.50 3.65 -0.41 2.79 1.02 -1.26 -5.06 119.74 118.97 1cru s LYS 291 Ca 0.51 -0.00 -0.21 0.00 0.02 0.00 0.00 55.97 56.29 1cru s LYS 291 Cb -0.41 -2.73 0.02 0.00 -0.52 0.00 0.00 37.83 34.19 1cru s LYS 291 CO 0.51 0.34 0.68 0.34 -0.92 0.00 0.00 175.35 176.30 1cru s ASP 292 N -2.74 6.38 0.19 2.83 -1.08 -1.26 -4.39 116.67 116.60 1cru s ASP 292 Ca 0.43 -0.12 0.19 0.00 -0.52 0.00 0.00 52.55 52.53 1cru s ASP 292 Cb -0.11 -2.34 0.86 0.00 -1.46 0.00 0.00 42.92 39.86 1cru s ASP 292 CO 0.26 -0.75 1.58 0.18 0.52 0.00 0.00 175.17 176.96 1cru n LEU 293 N 6.31 0.45 -3.19 -1.34 4.77 -1.26 -4.88 117.00 117.86 1cru n LEU 293 Ca -0.00 0.64 -0.22 0.00 -0.03 0.00 0.00 56.01 56.39 1cru n LEU 293 Cb 0.48 -0.61 0.06 0.00 -2.33 0.00 0.00 43.42 41.02 1cru n LEU 293 CO 0.53 -0.57 0.15 0.00 -1.33 0.00 0.00 177.39 176.17 1cru n ALA 294 N -1.69 -1.11 -1.28 -1.18 0.00 -1.26 -4.90 120.51 109.09 1cru n ALA 294 Ca 0.01 0.34 -0.04 0.00 0.00 0.00 0.00 53.44 53.76 1cru n ALA 294 Cb 0.16 -4.68 0.22 0.00 0.00 0.00 0.00 19.45 15.15 1cru n ALA 294 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1cru n GLN 295 N -4.40 2.31 -2.14 0.00 1.13 -1.26 -4.93 117.38 108.09 1cru n GLN 295 Ca -0.03 -3.07 -0.19 0.00 -1.94 0.00 0.00 57.00 51.77 1cru n GLN 295 Cb 0.58 -1.91 -0.03 0.00 0.11 0.00 0.00 30.24 28.99 1cru n GLN 295 CO 0.00 0.00 0.00 -1.71 -1.44 0.00 0.00 177.06 173.91 1cru n ASN 296 N -0.90 -5.37 0.00 1.08 5.15 -1.26 -1.65 115.26 112.31 1cru n ASN 296 Ca 0.35 0.11 0.00 0.00 -0.60 0.00 0.00 54.58 54.44 1cru n ASN 296 Cb 1.12 -4.45 0.00 0.00 -0.53 0.00 0.00 39.78 35.92 1cru n ASN 296 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1cru n GLY 297 N -0.93 2.00 0.21 8.20 0.00 -1.26 -2.19 105.19 111.22 1cru n GLY 297 Ca -0.21 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.68 1cru n GLY 297 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1cru h VAL 298 N 0.00 1.32 -3.32 1.61 2.07 -1.58 -3.39 116.25 112.96 1cru h VAL 298 Ca 0.00 -1.95 -0.49 0.00 0.82 0.00 0.00 66.70 65.09 1cru h VAL 298 Cb 0.00 1.92 -0.35 0.00 -1.52 0.00 0.00 31.29 31.33 1cru h VAL 298 CO 0.00 0.61 -0.80 -0.75 0.02 0.00 0.00 177.57 176.65 1cru s LYS 299 N -3.82 1.33 0.16 1.57 2.20 -1.25 -5.05 119.74 114.87 1cru s LYS 299 Ca -0.08 -0.23 0.04 0.00 -0.36 0.00 0.00 55.97 55.34 1cru s LYS 299 Cb 0.10 -1.31 -0.05 0.00 -1.51 0.00 0.00 37.83 35.07 1cru s LYS 299 CO 0.87 -0.15 -0.08 0.14 -0.36 0.00 0.00 175.35 175.77 1cru s VAL 300 N 1.27 1.07 0.67 4.02 -7.23 -1.26 -4.37 120.40 114.57 1cru s VAL 300 Ca -0.04 -2.04 -0.13 0.00 -1.81 0.00 0.00 61.98 57.96 1cru s VAL 300 Cb -0.14 -1.93 -0.00 0.00 0.56 0.00 0.00 36.38 34.88 1cru s VAL 300 CO -0.03 -0.68 1.07 0.00 -0.31 0.00 0.00 175.10 175.16 1cru s ALA 301 N -3.39 2.59 0.48 1.32 0.00 -1.26 -4.99 121.76 116.50 1cru s ALA 301 Ca 0.18 0.32 -0.24 0.00 0.00 0.00 0.00 51.96 52.22 1cru s ALA 301 Cb 0.03 -3.24 -0.07 0.00 0.00 0.00 0.00 23.12 19.85 1cru s ALA 301 CO 0.01 -1.18 1.32 0.00 0.00 0.00 0.00 175.76 175.91 1cru s ALA 302 N -2.67 3.04 0.00 0.00 0.00 -1.26 -3.60 121.76 117.26 1cru s ALA 302 Ca 0.62 1.26 0.00 0.00 0.00 0.00 0.00 51.96 53.84 1cru s ALA 302 Cb -0.16 -3.52 0.00 0.00 0.00 0.00 0.00 23.12 19.44 1cru s ALA 302 CO 0.46 -1.07 0.00 0.41 0.00 0.00 0.00 175.76 175.56 1cru n GLY 303 N 0.63 0.40 3.36 0.00 0.00 -1.26 -4.95 105.19 103.37 1cru n GLY 303 Ca 0.07 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.75 1cru n GLY 303 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1cru s VAL 304 N -2.00 3.40 0.19 1.61 0.11 -1.24 -0.80 120.40 121.67 1cru s VAL 304 Ca 0.00 -0.51 -0.30 0.00 -2.93 0.00 0.00 61.98 58.24 1cru s VAL 304 Cb 0.00 -2.51 -0.09 0.00 -1.53 0.00 0.00 36.38 32.26 1cru s VAL 304 CO 0.00 0.46 1.35 -2.16 -3.33 0.00 0.00 175.10 171.42 1cru s PRO 305 N 0.96 4.35 -0.08 1.54 0.04 -1.26 -4.86 135.00 135.68 1cru s PRO 305 Ca -0.01 2.10 0.05 0.00 0.04 0.00 0.00 61.00 63.18 1cru s PRO 305 Cb -0.15 -3.19 -0.01 0.00 0.04 0.00 0.00 34.50 31.19 1cru s PRO 305 CO 0.00 -0.33 -0.24 0.08 0.04 0.00 0.00 177.00 176.56 1cru s VAL 306 N 0.33 2.11 -0.15 -0.36 1.01 -1.26 -1.51 120.40 120.57 1cru s VAL 306 Ca 0.59 -1.02 0.01 0.00 0.00 0.00 0.00 61.98 61.56 1cru s VAL 306 Cb -0.37 -1.78 0.00 0.00 0.00 0.00 0.00 36.38 34.22 1cru s VAL 306 CO 0.37 0.56 -0.18 -0.89 0.00 0.00 0.00 175.10 174.97 1cru s THR 307 N 0.08 2.45 0.70 3.92 2.01 0.11 -4.97 115.64 119.94 1cru s THR 307 Ca -0.11 -0.85 -0.13 0.00 0.31 0.00 0.00 61.69 60.91 1cru s THR 307 Cb -0.16 -2.01 0.02 0.00 0.01 0.00 0.00 72.50 70.36 1cru s THR 307 CO 0.06 0.53 1.11 -0.54 -0.69 0.00 0.00 174.62 175.09 1cru s LYS 308 N 0.80 2.59 0.33 4.92 1.02 -1.26 -1.42 119.74 126.71 1cru s LYS 308 Ca -0.06 1.33 0.03 0.00 0.02 0.00 0.00 55.97 57.29 1cru s LYS 308 Cb -0.15 -1.93 0.62 0.00 -0.52 0.00 0.00 37.83 35.84 1cru s LYS 308 CO -0.01 -1.41 1.93 0.93 -0.92 0.00 0.00 175.35 175.88 1cru h GLU 309 N -0.38 0.89 0.00 1.68 5.08 -1.84 -1.09 114.58 118.93 1cru h GLU 309 Ca -0.46 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 57.85 1cru h GLU 309 Cb 1.24 -0.20 0.00 0.00 0.50 0.00 0.00 28.75 30.29 1cru h GLU 309 CO 0.53 0.59 0.00 -1.13 -1.00 0.00 0.00 179.01 178.00 1cru n SER 310 N -4.48 0.00 0.02 1.42 3.41 -1.26 -2.68 113.62 110.05 1cru n SER 310 Ca 0.12 0.32 0.11 0.00 -0.26 0.00 0.00 58.87 59.16 1cru n SER 310 Cb 0.21 -0.43 0.06 0.00 -0.26 0.00 0.00 64.21 63.80 1cru n SER 310 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1cru n GLU 311 N -1.43 0.19 -1.93 4.33 1.02 -0.42 -4.94 120.64 117.47 1cru n GLU 311 Ca 0.07 0.00 -0.41 0.00 -0.02 0.00 0.00 57.16 56.80 1cru n GLU 311 Cb 0.23 -1.57 -0.01 0.00 -0.02 0.00 0.00 31.44 30.06 1cru n GLU 311 CO 0.00 0.00 0.00 -0.46 1.18 0.00 0.00 177.13 177.85 1cru s TRP 312 N -3.13 2.83 -0.22 -0.32 -0.00 -1.09 -4.94 118.94 112.07 1cru s TRP 312 Ca 0.06 1.15 0.15 0.00 -0.00 0.00 0.00 56.10 57.46 1cru s TRP 312 Cb 0.15 -3.89 0.62 0.00 -0.00 0.00 0.00 33.47 30.35 1cru s TRP 312 CO 0.78 -2.69 1.54 0.25 -0.00 0.00 0.00 176.95 176.83 1cru n THR 313 N 1.18 2.49 -1.15 5.86 -2.24 -1.26 -5.02 114.28 114.14 1cru n THR 313 Ca 0.03 -1.81 -0.29 0.00 -2.27 0.00 0.00 64.05 59.71 1cru n THR 313 Cb 0.40 -0.28 0.19 0.00 -2.10 0.00 0.00 70.33 68.54 1cru n THR 313 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1cru s GLY 314 N -1.62 1.56 0.20 3.38 0.00 -1.26 -5.07 107.32 104.51 1cru s GLY 314 Ca 0.47 -0.42 0.08 0.00 0.00 0.00 0.00 44.72 44.84 1cru s GLY 314 CO 0.10 0.22 -0.14 1.25 0.00 0.00 0.00 173.10 174.53 1cru s LYS 315 N -4.98 1.33 -1.51 2.90 2.20 -1.26 -4.78 119.74 113.64 1cru s LYS 315 Ca 0.66 -1.59 -0.06 0.00 -0.36 0.00 0.00 55.97 54.62 1cru s LYS 315 Cb -0.18 -1.11 0.01 0.00 -1.51 0.00 0.00 37.83 35.04 1cru s LYS 315 CO 0.58 0.18 0.72 0.09 -0.36 0.00 0.00 175.35 176.56 1cru n ASN 316 N -0.38 -6.02 -4.69 1.43 3.02 -1.26 -4.56 115.26 102.79 1cru n ASN 316 Ca -0.08 -0.35 -0.42 0.00 -0.03 0.00 0.00 54.58 53.69 1cru n ASN 316 Cb 0.60 -4.84 -0.03 0.00 -0.61 0.00 0.00 39.78 34.90 1cru n ASN 316 CO 0.00 0.00 0.00 0.12 -2.62 0.00 0.00 177.26 174.76 1cru s PHE 317 N -3.20 2.86 -0.24 3.10 5.36 -1.26 -1.15 117.98 123.46 1cru s PHE 317 Ca 0.37 0.75 -0.02 0.00 -0.96 0.00 0.00 56.93 57.07 1cru s PHE 317 Cb -0.17 -3.73 0.02 0.00 -0.34 0.00 0.00 43.02 38.80 1cru s PHE 317 CO 0.46 -2.72 -0.06 0.08 -1.46 0.00 0.00 175.22 171.52 1cru s VAL 318 N 2.14 2.97 0.63 3.12 1.01 -0.01 -4.91 120.40 125.34 1cru s VAL 318 Ca 0.66 -0.88 -0.12 0.00 0.00 0.00 0.00 61.98 61.64 1cru s VAL 318 Cb -0.34 -2.46 -0.03 0.00 0.00 0.00 0.00 36.38 33.55 1cru s VAL 318 CO 0.28 0.27 1.04 -2.16 0.00 0.00 0.00 175.10 174.53 1cru s PRO 319 N 1.37 3.39 0.69 2.72 0.04 -1.26 -4.59 135.00 137.35 1cru s PRO 319 Ca 0.02 0.90 -0.14 0.00 0.04 0.00 0.00 61.00 61.82 1cru s PRO 319 Cb -0.16 -2.05 0.02 0.00 0.04 0.00 0.00 34.50 32.35 1cru s PRO 319 CO -0.05 -0.74 1.12 -1.25 0.04 0.00 0.00 177.00 176.12 1cru s PRO 320 N -4.84 2.59 0.24 0.56 0.04 -1.26 -4.80 135.00 127.53 1cru s PRO 320 Ca 0.58 1.39 0.05 0.00 0.04 0.00 0.00 61.00 63.06 1cru s PRO 320 Cb -0.12 -1.92 0.25 0.00 0.04 0.00 0.00 34.50 32.74 1cru s PRO 320 CO 0.49 -1.42 1.55 -0.07 0.04 0.00 0.00 177.00 177.60 1cru h LEU 321 N -0.27 0.22 -7.12 -3.56 3.38 -1.07 -3.46 115.31 103.44 1cru h LEU 321 Ca -0.46 -0.13 -0.07 0.00 0.09 0.00 0.00 57.88 57.31 1cru h LEU 321 Cb 1.25 -0.06 -0.22 0.00 0.09 0.00 0.00 40.66 41.71 1cru h LEU 321 CO 0.53 0.79 -0.03 -0.75 0.09 0.00 0.00 178.44 179.07 1cru s LYS 322 N -3.68 0.68 -0.06 1.13 2.20 -1.15 -4.78 119.74 114.07 1cru s LYS 322 Ca -0.03 0.87 0.02 0.00 -0.36 0.00 0.00 55.97 56.47 1cru s LYS 322 Cb 0.12 0.30 -0.03 0.00 -1.51 0.00 0.00 37.83 36.71 1cru s LYS 322 CO 0.79 -0.09 -0.10 0.95 -0.36 0.00 0.00 175.35 176.53 1cru s THR 323 N 0.52 3.38 -0.55 3.43 -4.23 -1.26 -1.12 115.64 115.82 1cru s THR 323 Ca -0.02 -0.60 0.05 0.00 -1.18 0.00 0.00 61.69 59.95 1cru s THR 323 Cb -0.05 -2.36 0.18 0.00 1.34 0.00 0.00 72.50 71.62 1cru s THR 323 CO -0.02 0.59 0.46 0.18 -0.54 0.00 0.00 174.62 175.29 1cru n LEU 324 N 2.36 1.38 -4.20 4.79 4.77 -0.02 -1.42 117.00 124.66 1cru n LEU 324 Ca -0.18 -4.84 -0.14 0.00 -0.03 0.00 0.00 56.01 50.82 1cru n LEU 324 Cb 0.53 -0.08 -0.09 0.00 -2.33 0.00 0.00 43.42 41.45 1cru n LEU 324 CO 0.27 1.86 -0.13 -0.31 -1.33 0.00 0.00 177.39 177.74 1cru s TYR 325 N -0.91 1.25 -0.10 -1.77 1.51 -0.29 -2.80 117.35 114.24 1cru s TYR 325 Ca 0.31 -1.39 -0.01 0.00 -1.01 0.00 0.00 57.07 54.96 1cru s TYR 325 Cb 0.03 -0.49 -0.03 0.00 -0.11 0.00 0.00 41.96 41.36 1cru s TYR 325 CO -0.16 -0.78 -0.04 0.99 -1.11 0.00 0.00 175.55 174.44 1cru s THR 326 N -3.85 3.90 0.31 -0.71 2.01 -0.44 -0.32 115.64 116.54 1cru s THR 326 Ca 0.37 -0.39 0.03 0.00 0.31 0.00 0.00 61.69 62.01 1cru s THR 326 Cb 0.04 -2.64 -0.05 0.00 0.01 0.00 0.00 72.50 69.86 1cru s THR 326 CO 0.17 0.57 0.09 0.68 -0.69 0.00 0.00 174.62 175.43 1cru s VAL 327 N -0.45 0.82 0.49 3.82 -7.23 -1.26 -4.60 120.40 111.99 1cru s VAL 327 Ca 0.07 -2.00 0.00 0.00 -1.81 0.00 0.00 61.98 58.24 1cru s VAL 327 Cb -0.12 -2.66 0.01 0.00 0.56 0.00 0.00 36.38 34.17 1cru s VAL 327 CO 0.02 0.00 0.71 -1.10 -0.31 0.00 0.00 175.10 174.42 1cru s GLN 328 N -3.91 2.90 0.60 4.82 -0.21 -1.26 -2.97 119.66 119.62 1cru s GLN 328 Ca 0.35 -0.56 0.31 0.00 0.02 0.00 0.00 55.36 55.48 1cru s GLN 328 Cb 0.07 -2.53 1.86 0.00 1.00 0.00 0.00 33.01 33.42 1cru s GLN 328 CO 0.15 -0.42 2.26 -0.44 -2.12 0.00 0.00 175.29 174.72 1cru h ASP 329 N 0.28 0.00 0.73 5.90 3.32 -1.88 -1.63 116.42 123.14 1cru h ASP 329 Ca -0.45 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.60 1cru h ASP 329 Cb 1.27 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.82 1cru h ASP 329 CO 0.56 0.00 0.00 0.35 -1.72 0.00 0.00 179.24 178.43 1cru n THR 330 N -3.79 0.42 -1.74 0.35 -2.24 -1.26 -4.89 114.28 101.13 1cru n THR 330 Ca -0.03 0.10 -0.42 0.00 -2.27 0.00 0.00 64.05 61.44 1cru n THR 330 Cb 0.09 -0.72 -0.01 0.00 -2.10 0.00 0.00 70.33 67.59 1cru n THR 330 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1cru n TYR 331 N -1.47 2.69 -3.20 4.78 9.36 -0.61 -4.94 117.16 123.77 1cru n TYR 331 Ca 0.06 0.42 -0.44 0.00 3.32 0.00 0.00 57.90 61.26 1cru n TYR 331 Cb 0.25 -2.51 -0.07 0.00 -0.63 0.00 0.00 39.34 36.39 1cru n TYR 331 CO 0.00 0.00 0.00 1.21 0.22 0.00 0.00 176.86 178.29 1cru s ASN 332 N 0.04 6.21 0.00 2.98 2.47 -1.26 -4.90 114.94 120.48 1cru s ASN 332 Ca 0.58 -0.95 0.28 0.00 0.42 0.00 0.00 52.86 53.19 1cru s ASN 332 Cb -0.52 -2.27 1.51 0.00 -1.45 0.00 0.00 41.25 38.51 1cru s ASN 332 CO 0.58 -0.84 1.99 -1.22 -3.72 0.00 0.00 177.10 173.89 1cru n TYR 333 N 6.01 0.00 -2.69 0.43 4.02 -1.26 -3.62 117.16 120.05 1cru n TYR 333 Ca -0.07 0.00 -0.34 0.00 -0.01 0.00 0.00 57.90 57.48 1cru n TYR 333 Cb 0.45 -0.19 -0.00 0.00 -0.02 0.00 0.00 39.34 39.57 1cru n TYR 333 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 176.86 175.94 1cru n ASN 334 N -1.19 5.98 -4.64 7.72 3.02 -1.26 -4.80 115.26 120.09 1cru n ASN 334 Ca 0.16 -3.71 -0.43 0.00 -0.03 0.00 0.00 54.58 50.58 1cru n ASN 334 Cb 0.18 -0.85 -0.03 0.00 -0.61 0.00 0.00 39.78 38.48 1cru n ASN 334 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1cru s ASP 335 N -2.38 6.49 0.14 6.41 -1.08 -1.24 -4.90 116.67 120.12 1cru s ASP 335 Ca 0.45 1.85 0.16 0.00 -0.52 0.00 0.00 52.55 54.49 1cru s ASP 335 Cb 0.27 -2.53 0.73 0.00 -1.46 0.00 0.00 42.92 39.92 1cru s ASP 335 CO -0.16 -1.13 1.50 -2.65 0.52 0.00 0.00 175.17 173.24 1cru n PRO 336 N 7.43 0.09 0.12 4.34 -0.02 -1.26 -2.79 135.00 142.91 1cru n PRO 336 Ca 0.18 0.42 0.12 0.00 -2.02 0.00 0.00 63.50 62.20 1cru n PRO 336 Cb 0.44 -1.71 0.47 0.00 -0.02 0.00 0.00 33.50 32.69 1cru n PRO 336 CO 0.00 0.00 0.00 2.41 1.98 0.00 0.00 175.50 179.89 1cru n THR 337 N -1.88 0.81 -0.24 3.45 -1.04 -1.26 -1.96 114.28 112.16 1cru n THR 337 Ca 0.01 0.18 0.09 0.00 -2.04 0.00 0.00 64.05 62.30 1cru n THR 337 Cb 0.13 -1.09 0.25 0.00 -1.82 0.00 0.00 70.33 67.80 1cru n THR 337 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1cru n GLY 339 N 1.19 2.87 0.00 0.00 0.00 -0.83 -0.56 105.19 107.86 1cru n GLY 339 Ca 0.19 -0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.22 1cru n GLY 339 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1cru n GLU 340 N 14.00 0.45 -2.72 1.61 -0.58 -1.26 -2.92 120.64 129.21 1cru n GLU 340 Ca 0.00 0.00 -0.14 0.00 -0.42 0.00 0.00 57.16 56.60 1cru n GLU 340 Cb 0.00 -1.12 0.01 0.00 -0.57 0.00 0.00 31.44 29.76 1cru n GLU 340 CO 0.00 0.00 0.00 -1.33 -0.48 0.00 0.00 177.13 175.32 1cru n MET 341 N -0.62 1.62 -0.30 3.49 2.81 0.28 -4.97 117.12 119.43 1cru n MET 341 Ca 0.03 -3.57 0.25 0.00 -1.81 0.00 0.00 57.70 52.60 1cru n MET 341 Cb 0.01 -1.54 0.47 0.00 -0.71 0.00 0.00 33.22 31.45 1cru n MET 341 CO 0.00 0.00 0.00 2.41 1.51 0.00 0.00 175.97 179.89 1cru n THR 342 N -0.09 -0.39 0.27 2.03 -1.04 -1.15 -2.32 114.28 111.59 1cru n THR 342 Ca 0.18 1.93 0.13 0.00 -2.04 0.00 0.00 64.05 64.25 1cru n THR 342 Cb 0.75 -3.04 0.82 0.00 -1.82 0.00 0.00 70.33 67.03 1cru n THR 342 CO 0.00 0.00 0.00 0.10 -0.64 0.00 0.00 175.07 174.53 1cru h TYR 343 N 0.00 0.00 0.00 -1.42 -0.00 -1.90 -2.01 116.97 111.64 1cru h TYR 343 Ca 0.72 0.00 0.00 0.00 0.00 0.00 0.00 58.73 59.45 1cru h TYR 343 Cb 1.82 0.00 0.00 0.00 0.00 0.00 0.00 36.73 38.55 1cru h TYR 343 CO -0.14 0.00 0.00 0.44 -0.00 0.00 0.00 178.16 178.46 1cru n ILE 344 N -4.07 0.12 1.11 -0.90 -6.64 -0.98 -1.89 119.36 106.11 1cru n ILE 344 Ca -0.02 0.03 0.12 0.00 -1.77 0.00 0.00 62.75 61.11 1cru n ILE 344 Cb 0.12 -0.58 0.25 0.00 -1.44 0.00 0.00 39.64 37.99 1cru n ILE 344 CO 0.00 0.00 0.00 0.00 -1.77 0.00 0.00 176.55 174.78 1cru n TRP 346 N -0.94 1.48 -1.16 0.00 8.01 -0.79 -4.84 117.44 119.20 1cru n TRP 346 Ca 0.09 0.42 -0.34 0.00 -1.31 0.00 0.00 57.50 56.35 1cru n TRP 346 Cb 0.36 -2.20 -0.02 0.00 -2.01 0.00 0.00 31.31 27.44 1cru n TRP 346 CO 0.00 0.00 0.00 -0.35 -1.01 0.00 0.00 177.69 176.33 1cru n PRO 347 N -2.00 3.00 -4.24 -0.99 -0.04 -1.18 -4.79 135.00 124.75 1cru n PRO 347 Ca 0.15 -1.98 -0.13 0.00 -0.04 0.00 0.00 63.50 61.49 1cru n PRO 347 Cb 0.49 -2.74 -0.10 0.00 -0.04 0.00 0.00 33.50 31.10 1cru n PRO 347 CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 1cru s THR 348 N 2.81 0.22 0.00 0.52 -4.23 -1.26 -1.14 115.64 112.56 1cru s THR 348 Ca 0.57 -1.99 0.00 0.00 -1.18 0.00 0.00 61.69 59.09 1cru s THR 348 Cb 0.15 -2.49 0.00 0.00 1.34 0.00 0.00 72.50 71.50 1cru s THR 348 CO -0.05 -0.06 0.00 1.33 -0.54 0.00 0.00 174.62 175.31 1cru n VAL 349 N -0.32 0.00 -3.37 2.29 0.24 -1.23 -4.88 118.33 111.06 1cru n VAL 349 Ca 0.00 -0.39 -0.16 0.00 -2.04 0.00 0.00 64.34 61.76 1cru n VAL 349 Cb 0.66 1.00 0.03 0.00 -1.47 0.00 0.00 33.84 34.06 1cru n VAL 349 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1cru n ALA 350 N -0.77 -2.55 -1.97 2.33 0.00 -1.26 -3.35 120.51 112.94 1cru n ALA 350 Ca 0.00 -0.06 -0.42 0.00 0.00 0.00 0.00 53.44 52.96 1cru n ALA 350 Cb 0.00 -3.31 -0.03 0.00 0.00 0.00 0.00 19.45 16.11 1cru n ALA 350 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1cru s PRO 351 N -4.45 4.26 0.00 0.00 0.04 -1.26 -1.41 135.00 132.19 1cru s PRO 351 Ca 0.26 2.26 0.13 0.00 0.04 0.00 0.00 61.00 63.69 1cru s PRO 351 Cb -0.06 -3.16 -0.06 0.00 0.04 0.00 0.00 34.50 31.26 1cru s PRO 351 CO 0.80 -0.49 0.65 -1.13 0.04 0.00 0.00 177.00 176.87 1cru n SER 352 N 3.37 1.07 -1.91 6.66 3.41 -0.56 -4.58 113.62 121.08 1cru n SER 352 Ca 0.11 -1.03 -0.02 0.00 -0.26 0.00 0.00 58.87 57.67 1cru n SER 352 Cb 0.40 0.69 0.01 0.00 -0.26 0.00 0.00 64.21 65.05 1cru n SER 352 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 1cru n SER 353 N -0.64 -0.75 -3.64 4.04 2.88 -1.26 -4.52 113.62 109.73 1cru n SER 353 Ca 0.04 -1.42 -0.04 0.00 -1.33 0.00 0.00 58.87 56.12 1cru n SER 353 Cb 0.24 1.22 -0.06 0.00 -0.75 0.00 0.00 64.21 64.86 1cru n SER 353 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1cru s ALA 354 N -1.43 -1.96 -0.06 -1.46 0.00 -1.26 -4.31 121.76 111.29 1cru s ALA 354 Ca 0.09 2.39 0.01 0.00 0.00 0.00 0.00 51.96 54.45 1cru s ALA 354 Cb -0.01 -1.59 0.02 0.00 0.00 0.00 0.00 23.12 21.53 1cru s ALA 354 CO 0.03 -0.64 -0.08 -0.47 0.00 0.00 0.00 175.76 174.60 1cru s TYR 355 N 2.24 1.10 -0.38 0.00 5.04 0.29 -4.27 117.35 121.36 1cru s TYR 355 Ca -0.08 -0.38 -0.24 0.00 -2.44 0.00 0.00 57.07 53.93 1cru s TYR 355 Cb -0.08 -0.88 0.01 0.00 0.35 0.00 0.00 41.96 41.37 1cru s TYR 355 CO -0.19 -0.25 0.84 0.08 -1.34 0.00 0.00 175.55 174.69 1cru s VAL 356 N 0.86 4.66 -0.11 3.14 1.01 -1.26 -0.06 120.40 128.64 1cru s VAL 356 Ca -0.12 0.95 -0.29 0.00 0.00 0.00 0.00 61.98 62.52 1cru s VAL 356 Cb -0.15 -4.27 -0.03 0.00 0.00 0.00 0.00 36.38 31.93 1cru s VAL 356 CO 0.01 -0.51 1.37 -0.47 0.00 0.00 0.00 175.10 175.50 1cru s TYR 357 N 3.28 2.65 -2.19 5.22 5.04 -0.83 -4.93 117.35 125.60 1cru s TYR 357 Ca 0.34 0.80 0.19 0.00 -2.44 0.00 0.00 57.07 55.96 1cru s TYR 357 Cb -0.12 -3.62 0.26 0.00 0.35 0.00 0.00 41.96 38.83 1cru s TYR 357 CO 0.19 -2.29 1.21 1.63 -1.34 0.00 0.00 175.55 174.95 1cru n LYS 358 N 6.53 2.01 0.00 4.97 5.02 -1.26 -4.43 118.16 130.99 1cru n LYS 358 Ca 0.14 -1.89 0.00 0.00 -2.02 0.00 0.00 58.31 54.54 1cru n LYS 358 Cb 0.44 -1.40 0.00 0.00 -0.02 0.00 0.00 35.03 34.05 1cru n LYS 358 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1cru n GLY 359 N 1.14 1.92 0.00 0.72 0.00 -1.26 -5.04 105.19 102.67 1cru n GLY 359 Ca 0.14 -0.56 0.00 0.00 0.00 0.00 0.00 46.02 45.60 1cru n GLY 359 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1cru n GLY 360 N 0.00 0.79 0.29 -0.02 0.00 -1.25 -3.58 105.19 101.41 1cru n GLY 360 Ca 0.00 -2.02 0.18 0.00 0.00 0.00 0.00 46.02 44.18 1cru n GLY 360 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 1cru h LYS 361 N 6.73 0.00 -0.60 1.61 2.10 -1.75 -1.90 116.57 122.76 1cru h LYS 361 Ca 0.00 0.00 -0.44 0.00 -2.00 0.00 0.00 60.65 58.21 1cru h LYS 361 Cb 0.00 0.00 -0.35 0.00 -0.90 0.00 0.00 32.23 30.98 1cru h LYS 361 CO 0.00 0.02 -0.77 1.63 -2.00 0.00 0.00 179.45 178.33 1cru n LYS 362 N -3.15 3.18 -1.58 0.07 5.02 0.71 -5.06 118.16 117.35 1cru n LYS 362 Ca -0.01 -3.98 -0.42 0.00 -2.02 0.00 0.00 58.31 51.88 1cru n LYS 362 Cb 0.23 -2.13 0.01 0.00 -0.02 0.00 0.00 35.03 33.12 1cru n LYS 362 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1cru n ALA 363 N -0.77 -0.21 -2.54 7.82 0.00 -0.72 -3.32 120.51 120.77 1cru n ALA 363 Ca 0.38 0.23 -0.42 0.00 0.00 0.00 0.00 53.44 53.63 1cru n ALA 363 Cb 0.92 -2.01 -0.03 0.00 0.00 0.00 0.00 19.45 18.33 1cru n ALA 363 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1cru s ILE 364 N -1.29 4.44 0.05 0.00 1.01 -1.26 -4.94 121.20 119.22 1cru s ILE 364 Ca 0.63 1.74 -0.37 0.00 0.00 0.00 0.00 60.65 62.65 1cru s ILE 364 Cb -0.58 -4.12 -0.17 0.00 0.01 0.00 0.00 42.46 37.60 1cru s ILE 364 CO 0.57 0.03 1.34 0.41 0.00 0.00 0.00 174.94 177.29 1cru n THR 365 N 4.44 0.02 -0.50 2.92 -1.04 -1.26 -1.80 114.28 117.06 1cru n THR 365 Ca 0.10 -0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.10 1cru n THR 365 Cb 0.47 -0.77 0.00 0.00 -1.82 0.00 0.00 70.33 68.21 1cru n THR 365 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1cru n GLY 366 N 2.53 1.89 0.86 3.41 0.00 -1.26 -4.90 105.19 107.71 1cru n GLY 366 Ca 0.19 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.27 1cru n GLY 366 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1cru n TRP 367 N -2.00 0.67 -1.73 1.61 7.02 -0.74 -4.93 117.44 117.33 1cru n TRP 367 Ca 0.00 -0.30 -0.42 0.00 -1.02 0.00 0.00 57.50 55.76 1cru n TRP 367 Cb 0.00 -0.07 -0.01 0.00 -2.42 0.00 0.00 31.31 28.81 1cru n TRP 367 CO 0.00 0.00 0.00 0.39 -2.02 0.00 0.00 177.69 176.06 1cru n GLU 368 N 0.62 2.48 -3.48 -0.99 4.71 -1.26 -2.78 120.64 119.94 1cru n GLU 368 Ca 0.14 0.88 -0.24 0.00 -0.01 0.00 0.00 57.16 57.92 1cru n GLU 368 Cb 0.43 -2.59 0.06 0.00 -1.01 0.00 0.00 31.44 28.33 1cru n GLU 368 CO 0.00 0.00 0.00 0.09 0.09 0.00 0.00 177.13 177.31 1cru n ASN 369 N 1.42 -6.04 -4.88 1.62 5.03 -1.26 -4.70 115.26 106.45 1cru n ASN 369 Ca 0.06 -0.50 -0.27 0.00 0.87 0.00 0.00 54.58 54.74 1cru n ASN 369 Cb 0.36 -4.79 -0.04 0.00 -1.02 0.00 0.00 39.78 34.29 1cru n ASN 369 CO 0.00 0.00 0.00 0.42 -1.83 0.00 0.00 177.26 175.85 1cru s THR 370 N -3.27 4.98 -0.15 3.41 -4.23 -1.12 -0.94 115.64 114.32 1cru s THR 370 Ca 0.52 -0.80 0.00 0.00 -1.18 0.00 0.00 61.69 60.23 1cru s THR 370 Cb -0.24 -3.53 -0.00 0.00 1.34 0.00 0.00 72.50 70.07 1cru s THR 370 CO 0.64 -0.06 -0.15 -0.22 -0.54 0.00 0.00 174.62 174.30 1cru s LEU 371 N -3.05 2.51 -0.24 4.79 2.96 0.67 -1.97 118.68 124.36 1cru s LEU 371 Ca 0.33 -0.45 -0.11 0.00 -0.22 0.00 0.00 54.13 53.68 1cru s LEU 371 Cb -0.11 -1.57 -0.05 0.00 0.50 0.00 0.00 46.19 44.96 1cru s LEU 371 CO 0.26 0.09 0.16 -0.76 -1.32 0.00 0.00 176.35 174.78 1cru s LEU 372 N 0.77 4.12 -0.31 -0.68 1.43 0.92 -0.64 118.68 124.29 1cru s LEU 372 Ca -0.06 0.11 0.01 0.00 -1.03 0.00 0.00 54.13 53.16 1cru s LEU 372 Cb -0.15 -2.11 0.10 0.00 0.03 0.00 0.00 46.19 44.06 1cru s LEU 372 CO 0.01 0.07 0.07 -0.69 0.23 0.00 0.00 176.35 176.03 1cru s VAL 373 N 1.04 1.35 0.45 -1.59 1.01 0.13 -0.55 120.40 122.24 1cru s VAL 373 Ca 0.08 -1.65 -0.24 0.00 0.00 0.00 0.00 61.98 60.16 1cru s VAL 373 Cb -0.13 -1.97 -0.08 0.00 0.00 0.00 0.00 36.38 34.20 1cru s VAL 373 CO 0.04 -0.59 1.26 -2.16 0.00 0.00 0.00 175.10 173.66 1cru s PRO 374 N 1.39 3.76 -0.15 2.72 0.04 -1.26 -0.52 135.00 140.97 1cru s PRO 374 Ca 0.09 2.04 -0.02 0.00 0.04 0.00 0.00 61.00 63.15 1cru s PRO 374 Cb -0.18 -2.56 -0.02 0.00 0.04 0.00 0.00 34.50 31.79 1cru s PRO 374 CO -0.18 -0.63 -0.09 0.45 0.04 0.00 0.00 177.00 176.59 1cru s SER 375 N -0.98 4.25 -0.07 6.66 0.15 0.04 -1.49 113.70 122.25 1cru s SER 375 Ca 0.61 -0.29 -0.17 0.00 0.70 0.00 0.00 55.95 56.80 1cru s SER 375 Cb -0.35 -1.67 -0.13 0.00 -1.71 0.00 0.00 66.02 62.16 1cru s SER 375 CO 0.44 0.13 0.66 -0.07 1.20 0.00 0.00 173.24 175.60 1cru h LEU 376 N 6.95 -0.18 -0.62 3.45 3.38 -1.24 -2.72 115.31 124.33 1cru h LEU 376 Ca -0.30 -0.29 -0.07 0.00 0.09 0.00 0.00 57.88 57.31 1cru h LEU 376 Cb 1.20 0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.99 1cru h LEU 376 CO 0.58 0.39 -0.32 0.07 0.09 0.00 0.00 178.44 179.25 1cru h LYS 377 N -0.95 0.00 0.00 1.13 2.10 -1.78 -3.26 116.57 113.81 1cru h LYS 377 Ca -0.02 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.63 1cru h LYS 377 Cb 0.46 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.79 1cru h LYS 377 CO 0.04 0.32 -0.94 0.54 -2.00 0.00 0.00 179.45 177.40 1cru n ARG 378 N -3.32 0.04 -3.45 0.07 5.12 -1.26 -0.91 116.66 112.94 1cru n ARG 378 Ca 0.01 -0.01 -0.21 0.00 -1.93 0.00 0.00 57.85 55.72 1cru n ARG 378 Cb 0.55 -1.51 0.07 0.00 -1.16 0.00 0.00 32.46 30.42 1cru n ARG 378 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1cru n GLY 379 N 1.48 -0.35 3.21 -0.13 0.00 -1.23 -4.74 105.19 103.44 1cru n GLY 379 Ca 0.04 0.13 -0.12 0.00 0.00 0.00 0.00 46.02 46.07 1cru n GLY 379 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1cru s VAL 380 N -3.28 0.44 -0.18 1.61 -7.23 -1.25 -1.26 120.40 109.25 1cru s VAL 380 Ca 0.49 -1.95 -0.00 0.00 -1.81 0.00 0.00 61.98 58.71 1cru s VAL 380 Cb -0.22 -2.11 0.01 0.00 0.56 0.00 0.00 36.38 34.62 1cru s VAL 380 CO 0.63 -0.45 -0.15 -0.63 -0.31 0.00 0.00 175.10 174.19 1cru s ILE 381 N -3.82 2.53 0.22 -0.62 1.01 0.20 -0.78 121.20 119.94 1cru s ILE 381 Ca 0.25 -0.79 -0.19 0.00 0.00 0.00 0.00 60.65 59.91 1cru s ILE 381 Cb 0.07 -2.08 -0.08 0.00 0.01 0.00 0.00 42.46 40.37 1cru s ILE 381 CO 0.03 0.51 0.71 -0.36 0.00 0.00 0.00 174.94 175.83 1cru s PHE 382 N 1.16 3.63 -0.22 3.97 0.40 0.32 -0.43 117.98 126.81 1cru s PHE 382 Ca 0.01 1.35 -0.04 0.00 -0.60 0.00 0.00 56.93 57.65 1cru s PHE 382 Cb -0.14 -2.59 -0.01 0.00 0.51 0.00 0.00 43.02 40.78 1cru s PHE 382 CO -0.06 0.33 -0.02 0.50 0.70 0.00 0.00 175.22 176.66 1cru s ARG 383 N -2.04 3.45 -0.18 0.44 3.52 0.45 -0.69 118.95 123.90 1cru s ARG 383 Ca 0.43 -0.59 0.01 0.00 -0.13 0.00 0.00 55.73 55.45 1cru s ARG 383 Cb -0.16 -3.05 0.02 0.00 -1.56 0.00 0.00 34.95 30.20 1cru s ARG 383 CO 0.21 -0.15 -0.19 0.42 -0.81 0.00 0.00 175.30 174.78 1cru s ILE 384 N 1.37 2.15 0.26 4.11 1.01 0.19 -1.14 121.20 129.16 1cru s ILE 384 Ca 0.04 -0.93 -0.24 0.00 0.00 0.00 0.00 60.65 59.53 1cru s ILE 384 Cb -0.14 -1.91 -0.09 0.00 0.01 0.00 0.00 42.46 40.32 1cru s ILE 384 CO -0.01 0.52 0.85 -0.75 0.00 0.00 0.00 174.94 175.55 1cru s LYS 385 N 1.30 4.50 0.31 2.79 2.47 -1.26 -0.24 119.74 129.60 1cru s LYS 385 Ca 0.05 1.17 0.08 0.00 -1.56 0.00 0.00 55.97 55.71 1cru s LYS 385 Cb -0.13 -2.92 -0.06 0.00 -1.46 0.00 0.00 37.83 33.25 1cru s LYS 385 CO -0.12 0.37 -0.08 -0.51 0.16 0.00 0.00 175.35 175.17 1cru s LEU 386 N -1.84 2.60 1.06 5.43 1.02 -0.12 -0.32 118.68 126.51 1cru s LEU 386 Ca 0.45 -1.19 -0.15 0.00 0.02 0.00 0.00 54.13 53.26 1cru s LEU 386 Cb -0.19 -0.81 0.22 0.00 0.02 0.00 0.00 46.19 45.43 1cru s LEU 386 CO 0.24 -0.27 1.12 1.51 0.02 0.00 0.00 176.35 178.96 1cru s ASP 387 N -3.52 2.13 0.66 2.29 1.47 -0.80 -4.77 116.67 114.13 1cru s ASP 387 Ca 0.31 0.89 0.43 0.00 1.18 0.00 0.00 52.55 55.37 1cru s ASP 387 Cb 0.03 -1.36 2.33 0.00 -0.34 0.00 0.00 42.92 43.58 1cru s ASP 387 CO 0.14 -3.41 2.34 -0.65 0.68 0.00 0.00 175.17 174.28 1cru h PRO 388 N -2.09 0.00 -0.21 2.11 0.11 -1.93 0.13 132.00 130.12 1cru h PRO 388 Ca -0.50 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.61 1cru h PRO 388 Cb 1.31 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.42 1cru h PRO 388 CO 0.49 0.00 0.00 0.25 -0.21 0.00 0.00 178.00 178.53 1cru n THR 389 N -3.11 0.26 -3.74 -1.15 -2.24 -1.26 -4.96 114.28 98.07 1cru n THR 389 Ca -0.03 -0.58 -0.26 0.00 -2.27 0.00 0.00 64.05 60.92 1cru n THR 389 Cb 0.09 1.06 0.05 0.00 -2.10 0.00 0.00 70.33 69.43 1cru n THR 389 CO 0.00 0.00 0.00 -1.22 -0.57 0.00 0.00 175.07 173.28 1cru n TYR 390 N 1.22 -2.43 -0.04 4.78 4.02 0.03 -4.89 117.16 119.85 1cru n TYR 390 Ca 0.17 0.94 0.03 0.00 -0.01 0.00 0.00 57.90 59.03 1cru n TYR 390 Cb 0.56 -4.49 -0.15 0.00 -0.02 0.00 0.00 39.34 35.23 1cru n TYR 390 CO 0.00 0.00 0.00 0.43 -1.01 0.00 0.00 176.86 176.28 1cru n SER 391 N -2.96 0.52 -3.70 7.72 7.64 -1.26 -4.98 113.62 116.61 1cru n SER 391 Ca -0.05 0.00 -0.12 0.00 1.01 0.00 0.00 58.87 59.71 1cru n SER 391 Cb 0.57 1.54 -0.07 0.00 -1.01 0.00 0.00 64.21 65.25 1cru n SER 391 CO 0.00 0.00 0.00 0.28 -3.01 0.00 0.00 175.04 172.31 1cru s THR 392 N -3.02 0.07 0.59 0.44 -1.32 -1.26 -5.04 115.64 106.10 1cru s THR 392 Ca -0.08 -0.57 -0.13 0.00 -1.21 0.00 0.00 61.69 59.70 1cru s THR 392 Cb 0.10 -0.97 -0.05 0.00 -1.51 0.00 0.00 72.50 70.06 1cru s THR 392 CO 0.79 -0.31 1.02 0.42 -2.21 0.00 0.00 174.62 174.32 1cru s THR 393 N -2.66 4.57 -0.12 5.08 -4.23 -1.26 -1.90 115.64 115.13 1cru s THR 393 Ca -0.04 0.98 0.01 0.00 -1.18 0.00 0.00 61.69 61.46 1cru s THR 393 Cb -0.00 -3.77 -0.01 0.00 1.34 0.00 0.00 72.50 70.05 1cru s THR 393 CO -0.04 -0.95 -0.16 -0.31 -0.54 0.00 0.00 174.62 172.62 1cru s TYR 394 N -2.96 2.74 0.00 3.99 2.02 0.57 -4.79 117.35 118.92 1cru s TYR 394 Ca 0.57 -0.71 0.00 0.00 -0.37 0.00 0.00 57.07 56.56 1cru s TYR 394 Cb -0.11 -1.80 0.00 0.00 -0.40 0.00 0.00 41.96 39.65 1cru s TYR 394 CO 0.46 -0.24 0.00 -0.25 -1.57 0.00 0.00 175.55 173.95 1cru n ASP 395 N 3.45 0.00 -4.83 2.29 8.00 -1.26 -4.20 116.55 120.00 1cru n ASP 395 Ca -0.18 0.00 -0.31 0.00 0.71 0.00 0.00 54.79 55.01 1cru n ASP 395 Cb 0.53 0.00 -0.05 0.00 -0.02 0.00 0.00 41.12 41.58 1cru n ASP 395 CO 0.00 0.00 0.00 -1.81 -0.39 0.00 0.00 177.20 175.00 1cru s ASP 396 N -4.00 4.34 -0.30 -2.24 1.01 -1.26 -4.98 116.67 109.23 1cru s ASP 396 Ca 0.00 -1.51 -0.27 0.00 0.71 0.00 0.00 52.55 51.48 1cru s ASP 396 Cb 0.00 0.54 0.01 0.00 1.01 0.00 0.00 42.92 44.48 1cru s ASP 396 CO 0.00 -0.98 0.98 0.00 0.21 0.00 0.00 175.17 175.38 1cru s ALA 397 N -2.85 3.53 -0.29 5.23 0.00 -1.26 -4.58 121.76 121.54 1cru s ALA 397 Ca 0.15 -0.14 -0.18 0.00 0.00 0.00 0.00 51.96 51.79 1cru s ALA 397 Cb -0.00 -3.54 -0.02 0.00 0.00 0.00 0.00 23.12 19.56 1cru s ALA 397 CO 0.09 -1.34 0.52 0.08 0.00 0.00 0.00 175.76 175.12 1cru s VAL 398 N 3.37 5.04 0.38 0.00 1.01 -0.29 -4.87 120.40 125.05 1cru s VAL 398 Ca 0.41 0.70 -0.25 0.00 0.00 0.00 0.00 61.98 62.84 1cru s VAL 398 Cb -0.13 -3.88 -0.09 0.00 0.00 0.00 0.00 36.38 32.28 1cru s VAL 398 CO 0.13 -0.02 1.10 -2.16 0.00 0.00 0.00 175.10 174.15 1cru s PRO 399 N 2.36 4.18 0.10 2.72 0.04 -1.26 -0.41 135.00 142.72 1cru s PRO 399 Ca 0.20 1.68 -0.01 0.00 0.04 0.00 0.00 61.00 62.91 1cru s PRO 399 Cb -0.15 -2.68 -0.04 0.00 0.04 0.00 0.00 34.50 31.67 1cru s PRO 399 CO 0.11 -0.17 0.03 -1.64 0.04 0.00 0.00 177.00 175.37 1cru s MET 400 N -2.28 0.81 -1.49 4.56 -1.94 0.42 -4.78 119.30 114.59 1cru s MET 400 Ca 0.56 -1.34 -0.13 0.00 -1.71 0.00 0.00 55.69 53.07 1cru s MET 400 Cb -0.27 0.24 0.07 0.00 2.01 0.00 0.00 34.83 36.88 1cru s MET 400 CO 0.34 -0.21 1.03 1.19 -0.01 0.00 0.00 175.02 177.36 1cru n PHE 401 N -0.02 -2.44 -1.68 -0.03 3.01 -1.02 -0.63 117.46 114.66 1cru n PHE 401 Ca -0.09 0.93 -0.45 0.00 1.01 0.00 0.00 57.45 58.85 1cru n PHE 401 Cb 0.63 -4.23 -0.04 0.00 -0.01 0.00 0.00 39.48 35.83 1cru n PHE 401 CO 0.00 0.00 0.00 1.17 1.01 0.00 0.00 176.76 178.94 1cru n LYS 402 N -4.76 2.29 -3.78 -1.08 3.00 0.22 -4.57 118.16 109.49 1cru n LYS 402 Ca 0.03 0.83 -0.05 0.00 -0.00 0.00 0.00 58.31 59.12 1cru n LYS 402 Cb 0.53 -2.63 -0.02 0.00 0.00 0.00 0.00 35.03 32.92 1cru n LYS 402 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.40 175.86 1cru s SER 403 N 1.48 -0.23 -1.35 3.14 1.04 -0.39 -4.79 113.70 112.60 1cru s SER 403 Ca 0.80 -0.46 -0.10 0.00 0.48 0.00 0.00 55.95 56.68 1cru s SER 403 Cb -0.64 0.58 0.12 0.00 0.10 0.00 0.00 66.02 66.18 1cru s SER 403 CO 0.39 -1.07 2.09 0.59 0.98 0.00 0.00 173.24 176.21 1cru n ASN 404 N -0.46 5.30 -4.02 7.02 3.02 -1.26 -4.41 115.26 120.45 1cru n ASN 404 Ca -0.06 -3.02 -0.08 0.00 -0.03 0.00 0.00 54.58 51.40 1cru n ASN 404 Cb 0.60 -1.52 -0.10 0.00 -0.61 0.00 0.00 39.78 38.15 1cru n ASN 404 CO 0.00 0.00 0.00 0.20 -2.62 0.00 0.00 177.26 174.84 1cru s ASN 405 N 1.46 0.34 -0.49 6.41 0.01 -1.26 -0.84 114.94 120.58 1cru s ASN 405 Ca 0.45 -0.71 -0.13 0.00 -0.71 0.00 0.00 52.86 51.75 1cru s ASN 405 Cb 0.12 0.15 0.10 0.00 0.41 0.00 0.00 41.25 42.03 1cru s ASN 405 CO -0.03 -0.44 0.40 -0.13 -1.51 0.00 0.00 177.10 175.39 1cru s ARG 406 N -2.56 2.82 -0.03 -0.60 0.52 -1.26 -3.52 118.95 114.32 1cru s ARG 406 Ca -0.06 -1.58 -0.30 0.00 -0.52 0.00 0.00 55.73 53.28 1cru s ARG 406 Cb -0.02 -4.10 -0.03 0.00 0.52 0.00 0.00 34.95 31.32 1cru s ARG 406 CO -0.05 -1.16 1.13 0.71 0.02 0.00 0.00 175.30 175.95 1cru s TYR 407 N 1.54 3.37 -0.16 -0.53 1.51 -1.03 -1.01 117.35 121.04 1cru s TYR 407 Ca 0.04 1.38 0.08 0.00 -1.01 0.00 0.00 57.07 57.56 1cru s TYR 407 Cb -0.27 -3.33 -0.15 0.00 -0.11 0.00 0.00 41.96 38.10 1cru s TYR 407 CO 0.03 -0.91 -0.04 -2.13 -1.11 0.00 0.00 175.55 171.40 1cru n ARG 408 N 4.72 1.17 -3.50 -0.62 3.00 -0.00 -3.61 116.66 117.82 1cru n ARG 408 Ca 0.09 0.04 -0.10 0.00 -0.00 0.00 0.00 57.85 57.88 1cru n ARG 408 Cb 0.47 -1.37 -0.02 0.00 0.00 0.00 0.00 32.46 31.55 1cru n ARG 408 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.63 177.97 1cru s ASP 409 N -5.18 -0.45 -0.13 6.15 2.15 -1.21 -4.33 116.67 113.66 1cru s ASP 409 Ca -0.14 -0.06 -0.19 0.00 0.43 0.00 0.00 52.55 52.58 1cru s ASP 409 Cb 0.05 0.52 0.05 0.00 -0.30 0.00 0.00 42.92 43.24 1cru s ASP 409 CO 0.52 -0.86 0.50 0.54 -0.17 0.00 0.00 175.17 175.71 1cru s VAL 410 N -3.49 0.01 0.23 1.11 0.11 -1.26 -1.71 120.40 115.40 1cru s VAL 410 Ca 0.04 -0.09 -0.04 0.00 -2.93 0.00 0.00 61.98 58.96 1cru s VAL 410 Cb -0.01 -0.74 -0.03 0.00 -1.53 0.00 0.00 36.38 34.07 1cru s VAL 410 CO -0.09 -0.05 0.25 0.27 -3.33 0.00 0.00 175.10 172.15 1cru s ILE 411 N -0.28 0.00 0.22 7.04 -4.36 -0.34 -4.77 121.20 118.70 1cru s ILE 411 Ca -0.04 -1.82 0.09 0.00 -0.26 0.00 0.00 60.65 58.62 1cru s ILE 411 Cb -0.03 -2.43 -0.05 0.00 1.25 0.00 0.00 42.46 41.20 1cru s ILE 411 CO 0.03 0.00 -0.17 0.00 0.24 0.00 0.00 174.94 175.04 1cru s ALA 412 N -4.01 2.24 0.78 2.27 0.00 -1.26 -0.70 121.76 121.09 1cru s ALA 412 Ca 0.34 -1.68 -0.11 0.00 0.00 0.00 0.00 51.96 50.51 1cru s ALA 412 Cb 0.04 -0.17 0.06 0.00 0.00 0.00 0.00 23.12 23.06 1cru s ALA 412 CO 0.13 0.18 1.09 -1.54 0.00 0.00 0.00 175.76 175.62 1cru s SER 413 N -3.19 4.61 0.32 0.00 1.04 0.11 -4.91 113.70 111.69 1cru s SER 413 Ca 0.23 1.37 0.04 0.00 0.48 0.00 0.00 55.95 58.07 1cru s SER 413 Cb -0.03 -2.12 0.67 0.00 0.10 0.00 0.00 66.02 64.63 1cru s SER 413 CO 0.09 -1.90 1.88 -0.65 0.98 0.00 0.00 173.24 173.64 1cru h PRO 414 N -1.04 0.84 0.00 4.02 0.11 -1.91 0.12 132.00 134.14 1cru h PRO 414 Ca -0.46 -0.05 -0.05 0.00 0.11 0.00 0.00 66.00 65.54 1cru h PRO 414 Cb 1.26 -0.19 -0.01 0.00 0.11 0.00 0.00 31.00 32.17 1cru h PRO 414 CO 0.59 0.56 -0.24 -0.44 -0.21 0.00 0.00 178.00 178.25 1cru h ASP 415 N 0.87 0.00 0.00 -2.05 3.32 -1.92 -3.39 116.42 113.25 1cru h ASP 415 Ca 0.43 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.48 1cru h ASP 415 Cb 0.47 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.02 1cru h ASP 415 CO -0.19 0.24 0.00 0.61 -1.72 0.00 0.00 179.24 178.18 1cru n GLY 416 N 0.21 0.73 0.59 2.75 0.00 0.03 -0.21 105.19 109.29 1cru n GLY 416 Ca 0.00 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.14 1cru n GLY 416 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1cru n ASN 417 N 0.00 2.12 -4.10 1.61 6.94 -1.21 -4.02 115.26 116.59 1cru n ASN 417 Ca 0.00 -1.57 -0.26 0.00 -0.02 0.00 0.00 54.58 52.74 1cru n ASN 417 Cb 0.00 0.24 -0.16 0.00 -2.36 0.00 0.00 39.78 37.50 1cru n ASN 417 CO 0.00 0.00 0.00 -0.69 -1.03 0.00 0.00 177.26 175.54 1cru s VAL 418 N -2.29 1.35 -0.04 3.53 1.01 -1.26 -0.84 120.40 121.85 1cru s VAL 418 Ca 0.24 -0.65 0.01 0.00 0.00 0.00 0.00 61.98 61.58 1cru s VAL 418 Cb 0.19 -1.18 -0.03 0.00 0.00 0.00 0.00 36.38 35.36 1cru s VAL 418 CO 0.46 0.39 -0.02 -0.76 0.00 0.00 0.00 175.10 175.17 1cru s LEU 419 N 0.24 3.41 -0.11 3.92 1.43 0.44 -0.71 118.68 127.30 1cru s LEU 419 Ca -0.08 0.01 0.02 0.00 -1.03 0.00 0.00 54.13 53.06 1cru s LEU 419 Cb -0.13 -1.86 -0.01 0.00 0.03 0.00 0.00 46.19 44.22 1cru s LEU 419 CO 0.03 0.33 -0.18 -0.31 0.23 0.00 0.00 176.35 176.44 1cru s TYR 420 N -0.96 2.67 0.04 0.29 1.51 0.13 -0.59 117.35 120.44 1cru s TYR 420 Ca 0.16 -0.76 0.04 0.00 -1.01 0.00 0.00 57.07 55.50 1cru s TYR 420 Cb -0.11 -1.75 -0.02 0.00 -0.11 0.00 0.00 41.96 39.96 1cru s TYR 420 CO 0.06 -0.26 -0.12 0.08 -1.11 0.00 0.00 175.55 174.20 1cru s VAL 421 N 0.21 0.95 0.01 0.71 1.01 0.33 -1.20 120.40 122.42 1cru s VAL 421 Ca -0.11 -0.94 0.01 0.00 0.00 0.00 0.00 61.98 60.94 1cru s VAL 421 Cb -0.16 -0.88 -0.04 0.00 0.00 0.00 0.00 36.38 35.30 1cru s VAL 421 CO 0.06 -0.05 0.03 -0.76 0.00 0.00 0.00 175.10 174.38 1cru s LEU 422 N -1.13 3.65 0.10 3.92 1.43 -0.69 -0.51 118.68 125.45 1cru s LEU 422 Ca -0.00 0.02 0.08 0.00 -1.03 0.00 0.00 54.13 53.19 1cru s LEU 422 Cb -0.08 -2.16 -0.03 0.00 0.03 0.00 0.00 46.19 43.95 1cru s LEU 422 CO 0.01 0.26 -0.19 0.42 0.23 0.00 0.00 176.35 177.07 1cru s THR 423 N -1.17 1.59 0.72 5.49 -4.23 -0.56 -0.82 115.64 116.65 1cru s THR 423 Ca 0.22 -1.53 -0.14 0.00 -1.18 0.00 0.00 61.69 59.06 1cru s THR 423 Cb -0.12 -1.49 0.03 0.00 1.34 0.00 0.00 72.50 72.27 1cru s THR 423 CO 0.13 -0.12 1.13 -1.81 -0.54 0.00 0.00 174.62 173.41 1cru s ASP 424 N -1.96 4.59 0.15 3.99 1.01 -0.18 -3.02 116.67 121.25 1cru s ASP 424 Ca 0.06 2.08 0.05 0.00 0.71 0.00 0.00 52.55 55.44 1cru s ASP 424 Cb -0.09 -2.56 -0.07 0.00 1.01 0.00 0.00 42.92 41.21 1cru s ASP 424 CO 0.04 -1.98 1.35 0.74 0.21 0.00 0.00 175.17 175.52 1cru h THR 425 N -0.40 1.58 -3.44 -1.27 2.02 -1.87 -0.32 112.91 109.21 1cru h THR 425 Ca -0.46 -2.94 -0.05 0.00 0.77 0.00 0.00 66.41 63.74 1cru h THR 425 Cb 1.26 2.63 -0.12 0.00 -1.74 0.00 0.00 68.15 70.18 1cru h THR 425 CO 0.51 0.85 -0.07 0.00 0.37 0.00 0.00 175.52 177.17 1cru s ALA 426 N -3.00 -0.77 0.00 6.16 0.00 -1.26 -4.35 121.76 118.54 1cru s ALA 426 Ca -0.01 -0.26 0.00 0.00 0.00 0.00 0.00 51.96 51.69 1cru s ALA 426 Cb 0.10 0.78 0.00 0.00 0.00 0.00 0.00 23.12 24.00 1cru s ALA 426 CO 0.82 -0.71 0.00 0.41 0.00 0.00 0.00 175.76 176.28 1cru n GLY 427 N -0.27 0.99 3.91 0.00 0.00 -1.26 -5.05 105.19 103.51 1cru n GLY 427 Ca -0.12 -1.98 -0.31 0.00 0.00 0.00 0.00 46.02 43.61 1cru n GLY 427 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1cru s ASN 428 N -0.89 6.44 -0.00 1.61 0.01 -1.26 -4.38 114.94 116.47 1cru s ASN 428 Ca 0.00 0.48 -0.12 0.00 -0.71 0.00 0.00 52.86 52.52 1cru s ASN 428 Cb 0.00 -2.05 0.01 0.00 0.41 0.00 0.00 41.25 39.63 1cru s ASN 428 CO 0.00 0.07 0.24 0.54 -1.51 0.00 0.00 177.10 176.44 1cru s VAL 429 N -1.65 0.07 0.01 1.60 0.11 -0.15 -4.63 120.40 115.76 1cru s VAL 429 Ca 0.39 -0.60 -0.29 0.00 -2.93 0.00 0.00 61.98 58.55 1cru s VAL 429 Cb -0.12 -0.59 -0.04 0.00 -1.53 0.00 0.00 36.38 34.10 1cru s VAL 429 CO 0.26 -0.33 0.92 -1.58 -3.33 0.00 0.00 175.10 171.04 1cru s GLN 430 N -1.51 4.56 0.78 1.54 0.74 -0.09 -1.22 119.66 124.45 1cru s GLN 430 Ca -0.13 1.32 -0.09 0.00 0.05 0.00 0.00 55.36 56.51 1cru s GLN 430 Cb -0.06 -3.44 0.09 0.00 1.10 0.00 0.00 33.01 30.71 1cru s GLN 430 CO 0.02 0.03 1.11 0.15 -0.55 0.00 0.00 175.29 176.05 1cru s LYS 431 N 0.75 1.83 0.39 1.67 1.02 0.53 -4.74 119.74 121.19 1cru s LYS 431 Ca 0.48 -0.25 0.14 0.00 0.02 0.00 0.00 55.97 56.36 1cru s LYS 431 Cb -0.21 -2.07 0.97 0.00 -0.52 0.00 0.00 37.83 36.00 1cru s LYS 431 CO 0.26 -1.55 1.85 -0.44 -0.92 0.00 0.00 175.35 174.56 1cru h ASP 432 N -0.89 0.52 -0.07 2.83 3.32 -1.90 -0.18 116.42 120.05 1cru h ASP 432 Ca -0.44 0.05 0.00 0.00 0.02 0.00 0.00 57.03 56.66 1cru h ASP 432 Cb 1.30 -0.05 0.00 0.00 0.22 0.00 0.00 39.33 40.80 1cru h ASP 432 CO 0.57 0.22 0.00 -0.90 -1.72 0.00 0.00 179.24 177.41 1cru n ASP 433 N -4.56 0.81 0.00 6.45 3.85 -1.26 -4.47 116.55 117.37 1cru n ASP 433 Ca 0.19 -1.52 0.00 0.00 -0.71 0.00 0.00 54.79 52.76 1cru n ASP 433 Cb 0.62 -0.04 0.00 0.00 -1.35 0.00 0.00 41.12 40.34 1cru n ASP 433 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 1cru n GLY 434 N 0.98 2.47 3.91 6.12 0.00 -0.08 -4.99 105.19 113.60 1cru n GLY 434 Ca 0.16 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.89 1cru n GLY 434 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1cru s SER 435 N -1.62 4.01 -0.06 1.61 1.04 -1.26 -4.65 113.70 112.77 1cru s SER 435 Ca 0.00 0.58 -0.06 0.00 0.48 0.00 0.00 55.95 56.95 1cru s SER 435 Cb 0.00 -0.91 -0.04 0.00 0.10 0.00 0.00 66.02 65.17 1cru s SER 435 CO 0.00 -2.20 0.19 -0.69 0.98 0.00 0.00 173.24 171.52 1cru s VAL 436 N -3.68 5.43 0.04 5.02 1.01 -1.26 -0.35 120.40 126.61 1cru s VAL 436 Ca 0.66 0.11 0.02 0.00 0.00 0.00 0.00 61.98 62.77 1cru s VAL 436 Cb -0.08 -3.48 -0.02 0.00 0.00 0.00 0.00 36.38 32.79 1cru s VAL 436 CO 0.50 0.49 -0.06 0.28 0.00 0.00 0.00 175.10 176.31 1cru s THR 437 N -1.17 0.41 -0.38 3.92 -1.32 -0.36 -4.91 115.64 111.83 1cru s THR 437 Ca 0.21 -1.03 0.08 0.00 -1.21 0.00 0.00 61.69 59.74 1cru s THR 437 Cb -0.13 -0.50 0.19 0.00 -1.51 0.00 0.00 72.50 70.55 1cru s THR 437 CO 0.11 -0.42 1.15 -0.46 -2.21 0.00 0.00 174.62 172.79 1cru n ASN 438 N 1.50 2.56 -4.46 8.08 0.23 -1.26 -0.98 115.26 120.94 1cru n ASN 438 Ca -0.23 -2.21 -0.44 0.00 -0.53 0.00 0.00 54.58 51.17 1cru n ASN 438 Cb 0.55 -0.18 -0.05 0.00 -2.08 0.00 0.00 39.78 38.01 1cru n ASN 438 CO 0.00 0.00 0.00 -0.89 -0.93 0.00 0.00 177.26 175.44 1cru s THR 439 N -1.37 4.70 -0.06 5.53 2.01 -1.26 -4.64 115.64 120.55 1cru s THR 439 Ca 0.16 -0.36 -0.16 0.00 0.31 0.00 0.00 61.69 61.64 1cru s THR 439 Cb 0.11 -4.42 -0.05 0.00 0.01 0.00 0.00 72.50 68.15 1cru s THR 439 CO 0.07 -0.98 0.43 -0.76 -0.69 0.00 0.00 174.62 172.69 1cru s LEU 440 N 3.09 4.37 0.18 4.42 1.43 -1.26 -4.91 118.68 126.00 1cru s LEU 440 Ca 0.19 0.87 -0.12 0.00 -1.03 0.00 0.00 54.13 54.04 1cru s LEU 440 Cb -0.18 -2.62 0.10 0.00 0.03 0.00 0.00 46.19 43.52 1cru s LEU 440 CO 0.13 0.17 1.78 -0.08 0.23 0.00 0.00 176.35 178.58 1cru h GLU 441 N 5.70 0.89 -2.61 1.70 4.81 -1.39 -3.35 114.58 120.33 1cru h GLU 441 Ca -0.46 -0.12 -0.60 0.00 -0.13 0.00 0.00 59.36 58.05 1cru h GLU 441 Cb 1.20 -0.17 -0.40 0.00 0.63 0.00 0.00 28.75 30.01 1cru h GLU 441 CO 0.69 0.69 -0.80 0.09 -0.73 0.00 0.00 179.01 178.95 1cru n ASN 442 N -4.53 1.22 -4.70 1.04 4.13 -1.26 -5.10 115.26 106.06 1cru n ASN 442 Ca 0.04 -2.80 -0.42 0.00 1.68 0.00 0.00 54.58 53.09 1cru n ASN 442 Cb 0.10 -0.65 -0.03 0.00 -1.54 0.00 0.00 39.78 37.67 1cru n ASN 442 CO 0.00 0.00 0.00 -2.84 0.28 0.00 0.00 177.26 174.70 1cru s PRO 443 N -0.80 4.21 -1.21 3.52 0.02 -1.26 -3.57 135.00 135.92 1cru s PRO 443 Ca 0.30 2.32 -0.11 0.00 0.02 0.00 0.00 61.00 63.53 1cru s PRO 443 Cb 0.02 -3.38 -0.01 0.00 0.02 0.00 0.00 34.50 31.15 1cru s PRO 443 CO -0.17 -0.66 0.73 0.41 -0.33 0.00 0.00 177.00 176.98 1cru n GLY 444 N 3.85 -0.73 3.63 0.52 0.00 -0.13 -0.46 105.19 111.88 1cru n GLY 444 Ca 0.15 0.34 -0.23 0.00 0.00 0.00 0.00 46.02 46.28 1cru n GLY 444 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1cru s SER 445 N -3.81 4.49 -0.31 1.61 0.01 -1.17 -0.79 113.70 113.74 1cru s SER 445 Ca 0.29 -0.65 -0.05 0.00 1.31 0.00 0.00 55.95 56.84 1cru s SER 445 Cb -0.09 -0.82 0.03 0.00 0.21 0.00 0.00 66.02 65.35 1cru s SER 445 CO 0.84 0.01 0.06 -0.22 0.41 0.00 0.00 173.24 174.34 1cru s LEU 446 N -3.61 3.97 -0.03 2.44 2.96 -0.56 -1.50 118.68 122.35 1cru s LEU 446 Ca 0.31 -0.99 0.06 0.00 -0.22 0.00 0.00 54.13 53.29 1cru s LEU 446 Cb -0.07 -1.83 -0.02 0.00 0.50 0.00 0.00 46.19 44.78 1cru s LEU 446 CO 0.19 -0.25 -0.21 -0.63 -1.32 0.00 0.00 176.35 174.14 1cru s ILE 447 N 1.40 2.52 -0.16 6.68 1.01 0.33 -0.78 121.20 132.20 1cru s ILE 447 Ca -0.01 -0.93 -0.04 0.00 0.00 0.00 0.00 60.65 59.68 1cru s ILE 447 Cb -0.18 -1.93 -0.03 0.00 0.01 0.00 0.00 42.46 40.33 1cru s ILE 447 CO 0.01 0.58 -0.04 -0.75 0.00 0.00 0.00 174.94 174.75 1cru s LYS 448 N -0.65 3.65 -0.23 2.79 2.20 0.33 -0.51 119.74 127.32 1cru s LYS 448 Ca 0.10 -0.53 -0.00 0.00 -0.36 0.00 0.00 55.97 55.18 1cru s LYS 448 Cb -0.10 -2.92 0.03 0.00 -1.51 0.00 0.00 37.83 33.32 1cru s LYS 448 CO -0.00 0.21 -0.11 -0.06 -0.36 0.00 0.00 175.35 175.03 1cru s PHE 449 N 0.44 3.01 -0.21 4.03 0.40 0.25 -0.90 117.98 125.00 1cru s PHE 449 Ca -0.04 -1.66 -0.06 0.00 -0.60 0.00 0.00 56.93 54.57 1cru s PHE 449 Cb -0.14 -2.00 -0.03 0.00 0.51 0.00 0.00 43.02 41.36 1cru s PHE 449 CO 0.03 -0.76 0.02 0.99 0.70 0.00 0.00 175.22 176.20 1cru s THR 450 N 1.29 4.12 0.24 0.64 2.01 -0.18 -0.42 115.64 123.35 1cru s THR 450 Ca 0.00 -0.25 -0.31 0.00 0.31 0.00 0.00 61.69 61.44 1cru s THR 450 Cb -0.16 -2.88 -0.11 0.00 0.01 0.00 0.00 72.50 69.36 1cru s THR 450 CO -0.07 0.41 1.64 -0.47 -0.69 0.00 0.00 174.62 175.44 1cru s TYR 451 N 1.10 2.86 -2.00 4.92 5.04 -0.02 -0.43 117.35 128.82 1cru s TYR 451 Ca 0.03 0.59 0.20 0.00 -2.44 0.00 0.00 57.07 55.46 1cru s TYR 451 Cb -0.14 -4.07 1.22 0.00 0.35 0.00 0.00 41.96 39.31 1cru s TYR 451 CO 0.02 -3.84 1.60 1.63 -1.34 0.00 0.00 175.55 173.62