#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wdy h ALA 22 N 0.00 1.21 -0.38 0.00 0.00 -2.01 -2.37 119.26 115.71 1wdy h ALA 22 Ca 0.00 -0.11 -0.13 0.00 0.00 0.00 0.00 54.91 54.66 1wdy h ALA 22 Cb 0.00 -0.37 -0.01 0.00 0.00 0.00 0.00 17.79 17.41 1wdy h ALA 22 CO 0.00 0.66 -0.30 0.28 0.00 0.00 0.00 179.25 179.89 1wdy h VAL 23 N 1.27 1.28 -0.18 0.00 2.07 -2.03 -2.48 116.25 116.19 1wdy h VAL 23 Ca 0.33 -1.45 -0.14 0.00 0.82 0.00 0.00 66.70 66.25 1wdy h VAL 23 Cb -0.02 1.30 -0.01 0.00 -1.52 0.00 0.00 31.29 31.04 1wdy h VAL 23 CO -0.06 0.48 -0.49 -0.08 0.02 0.00 0.00 177.57 177.44 1wdy h GLU 24 N 0.70 0.48 -0.08 1.57 4.81 -1.95 -1.88 114.58 118.23 1wdy h GLU 24 Ca 0.08 -0.28 -0.08 0.00 -0.13 0.00 0.00 59.36 58.95 1wdy h GLU 24 Cb 0.84 0.02 -0.01 0.00 0.63 0.00 0.00 28.75 30.23 1wdy h GLU 24 CO 0.07 0.87 -0.34 -0.44 -0.73 0.00 0.00 179.01 178.44 1wdy h ASP 25 N 0.38 0.16 -0.11 1.04 3.32 -1.38 -0.07 116.42 119.75 1wdy h ASP 25 Ca 0.02 -0.05 -0.18 0.00 0.02 0.00 0.00 57.03 56.83 1wdy h ASP 25 Cb 1.00 -0.04 -0.00 0.00 0.22 0.00 0.00 39.33 40.51 1wdy h ASP 25 CO 0.09 0.49 -0.58 0.78 -1.72 0.00 0.00 179.24 178.30 1wdy h ASN 26 N 0.14 0.80 0.07 6.45 2.35 -1.16 0.35 115.58 124.58 1wdy h ASN 26 Ca 0.02 -0.44 -0.12 0.00 -0.55 0.00 0.00 56.30 55.21 1wdy h ASN 26 Cb 0.67 -0.23 -0.01 0.00 0.05 0.00 0.00 38.32 38.80 1wdy h ASN 26 CO 0.05 1.20 -0.39 0.45 -1.65 0.00 0.00 177.43 177.09 1wdy h HIS 27 N 0.53 0.49 -0.12 1.19 3.86 -1.15 -2.61 115.15 117.34 1wdy h HIS 27 Ca 0.00 -0.13 -0.11 0.00 -1.16 0.00 0.00 60.37 58.97 1wdy h HIS 27 Cb 1.16 -0.11 -0.01 0.00 1.06 0.00 0.00 27.41 29.51 1wdy h HIS 27 CO 0.06 0.75 -0.42 -0.07 0.86 0.00 0.00 177.93 179.10 1wdy h LEU 28 N 0.35 0.28 -0.18 2.43 3.38 -0.76 -1.92 115.31 118.89 1wdy h LEU 28 Ca 0.03 -0.12 -0.01 0.00 0.09 0.00 0.00 57.88 57.87 1wdy h LEU 28 Cb 0.84 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 41.50 1wdy h LEU 28 CO 0.07 0.68 0.07 0.25 0.09 0.00 0.00 178.44 179.59 1wdy h LEU 29 N 0.22 0.25 -0.58 1.67 5.85 -0.67 -0.04 115.31 122.01 1wdy h LEU 29 Ca 0.02 -0.17 0.02 0.00 0.84 0.00 0.00 57.88 58.59 1wdy h LEU 29 Cb 0.84 -0.06 -0.04 0.00 0.37 0.00 0.00 40.66 41.77 1wdy h LEU 29 CO 0.07 0.35 0.36 0.40 -0.34 0.00 0.00 178.44 179.27 1wdy h ILE 30 N 0.13 1.08 -0.45 4.05 2.04 -1.31 -1.83 117.51 121.22 1wdy h ILE 30 Ca 0.06 -0.24 -0.09 0.00 1.00 0.00 0.00 64.86 65.59 1wdy h ILE 30 Cb 0.18 0.31 -0.02 0.00 -0.74 0.00 0.00 36.82 36.55 1wdy h ILE 30 CO -0.00 0.13 -0.07 0.50 0.00 0.00 0.00 178.15 178.71 1wdy h LYS 31 N 0.71 0.79 -0.78 2.37 1.63 -1.11 -1.70 116.57 118.48 1wdy h LYS 31 Ca 0.23 -0.24 -0.03 0.00 -0.85 0.00 0.00 60.65 59.75 1wdy h LYS 31 Cb 0.00 -0.08 -0.04 0.00 -0.60 0.00 0.00 32.23 31.52 1wdy h LYS 31 CO -0.09 0.84 0.35 0.00 -3.45 0.00 0.00 179.45 177.10 1wdy h ALA 32 N 1.20 1.00 -0.08 5.00 0.00 -0.63 0.12 119.26 125.87 1wdy h ALA 32 Ca 0.13 -0.17 -0.00 0.00 0.00 0.00 0.00 54.91 54.87 1wdy h ALA 32 Cb 0.54 -0.31 -0.00 0.00 0.00 0.00 0.00 17.79 18.02 1wdy h ALA 32 CO 0.03 0.59 0.04 0.28 0.00 0.00 0.00 179.25 180.19 1wdy h VAL 33 N 1.11 1.09 -0.40 0.00 2.07 -1.06 -0.80 116.25 118.26 1wdy h VAL 33 Ca 0.26 -0.25 0.00 0.00 0.82 0.00 0.00 66.70 67.54 1wdy h VAL 33 Cb 0.15 1.11 -0.02 0.00 -1.52 0.00 0.00 31.29 31.01 1wdy h VAL 33 CO -0.03 0.08 0.26 1.56 0.02 0.00 0.00 177.57 179.46 1wdy h GLN 34 N 0.03 0.52 -0.13 1.57 4.20 -0.69 -0.90 115.11 119.71 1wdy h GLN 34 Ca 0.03 -0.03 0.00 0.00 0.06 0.00 0.00 58.65 58.71 1wdy h GLN 34 Cb 0.08 -0.12 0.00 0.00 0.30 0.00 0.00 27.48 27.75 1wdy h GLN 34 CO -0.00 0.35 0.00 0.09 -0.67 0.00 0.00 178.83 178.59 1wdy n ASN 35 N -4.47 1.66 -3.71 1.46 3.02 0.35 -4.94 115.26 108.62 1wdy n ASN 35 Ca 0.03 -1.66 -0.26 0.00 -0.03 0.00 0.00 54.58 52.66 1wdy n ASN 35 Cb 0.06 -0.08 0.06 0.00 -0.61 0.00 0.00 39.78 39.21 1wdy n ASN 35 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1wdy n GLU 36 N 0.31 -7.12 -3.26 3.52 1.02 -0.34 -4.92 120.64 109.84 1wdy n GLU 36 Ca 0.17 0.75 -0.46 0.00 -0.02 0.00 0.00 57.16 57.60 1wdy n GLU 36 Cb 0.34 -5.75 -0.01 0.00 -0.02 0.00 0.00 31.44 26.00 1wdy n GLU 36 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 1wdy s ASP 37 N -3.32 6.99 0.13 1.62 -1.08 -0.40 -4.91 116.67 115.71 1wdy s ASP 37 Ca 0.62 -3.00 -0.19 0.00 -0.52 0.00 0.00 52.55 49.46 1wdy s ASP 37 Cb -0.29 -2.25 -0.04 0.00 -1.46 0.00 0.00 42.92 38.89 1wdy s ASP 37 CO 0.77 -0.53 1.76 0.58 0.52 0.00 0.00 175.17 178.26 1wdy h VAL 38 N 4.46 0.97 -0.93 1.11 2.07 -1.91 -0.73 116.25 121.30 1wdy h VAL 38 Ca 0.16 -0.07 0.05 0.00 0.82 0.00 0.00 66.70 67.65 1wdy h VAL 38 Cb 0.96 0.75 -0.06 0.00 -1.52 0.00 0.00 31.29 31.42 1wdy h VAL 38 CO 0.93 0.04 0.60 0.44 0.02 0.00 0.00 177.57 179.59 1wdy h ASP 39 N 0.21 0.98 -0.30 0.57 3.32 -1.98 -0.54 116.42 118.67 1wdy h ASP 39 Ca 0.09 -0.00 -0.14 0.00 0.02 0.00 0.00 57.03 57.01 1wdy h ASP 39 Cb 0.04 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 39.37 1wdy h ASP 39 CO -0.08 0.65 -0.31 0.25 -1.72 0.00 0.00 179.24 178.04 1wdy h LEU 40 N 1.13 0.85 -0.25 1.55 5.85 -1.86 -1.16 115.31 121.42 1wdy h LEU 40 Ca 0.38 -0.35 -0.00 0.00 0.84 0.00 0.00 57.88 58.75 1wdy h LEU 40 Cb 0.06 -0.24 -0.01 0.00 0.37 0.00 0.00 40.66 40.85 1wdy h LEU 40 CO -0.14 1.09 0.14 0.58 -0.34 0.00 0.00 178.44 179.77 1wdy h VAL 41 N 0.69 1.11 -0.38 1.05 2.07 -0.29 -0.87 116.25 119.64 1wdy h VAL 41 Ca 0.08 -0.30 0.05 0.00 0.82 0.00 0.00 66.70 67.34 1wdy h VAL 41 Cb 0.85 0.86 -0.04 0.00 -1.52 0.00 0.00 31.29 31.44 1wdy h VAL 41 CO 0.07 0.11 0.12 1.56 0.02 0.00 0.00 177.57 179.46 1wdy h GLN 42 N 0.29 0.27 -0.32 1.57 4.20 -1.00 -1.50 115.11 118.61 1wdy h GLN 42 Ca 0.09 -0.02 -0.01 0.00 0.06 0.00 0.00 58.65 58.77 1wdy h GLN 42 Cb 0.06 -0.06 -0.01 0.00 0.30 0.00 0.00 27.48 27.76 1wdy h GLN 42 CO -0.01 0.18 0.16 0.37 -0.67 0.00 0.00 178.83 178.85 1wdy h GLN 43 N 0.27 0.46 -0.62 1.46 4.15 -0.90 -0.70 115.11 119.22 1wdy h GLN 43 Ca 0.18 -0.06 -0.06 0.00 0.77 0.00 0.00 58.65 59.47 1wdy h GLN 43 Cb 0.16 -0.08 -0.03 0.00 0.21 0.00 0.00 27.48 27.74 1wdy h GLN 43 CO -0.19 0.42 0.13 -0.07 -1.93 0.00 0.00 178.83 177.19 1wdy h LEU 44 N 0.39 0.94 -0.18 -2.39 3.38 -1.01 -0.35 115.31 116.09 1wdy h LEU 44 Ca 0.11 -0.20 -0.06 0.00 0.09 0.00 0.00 57.88 57.82 1wdy h LEU 44 Cb 0.10 -0.25 -0.00 0.00 0.09 0.00 0.00 40.66 40.60 1wdy h LEU 44 CO -0.02 0.92 -0.13 -0.07 0.09 0.00 0.00 178.44 179.24 1wdy h LEU 45 N 0.94 0.42 -1.78 1.67 3.38 -1.03 -1.25 115.31 117.66 1wdy h LEU 45 Ca 0.20 -0.44 -0.03 0.00 0.09 0.00 0.00 57.88 57.70 1wdy h LEU 45 Cb 0.37 -0.12 -0.00 0.00 0.09 0.00 0.00 40.66 41.00 1wdy h LEU 45 CO 0.00 0.77 -0.13 -0.33 0.09 0.00 0.00 178.44 178.85 1wdy h GLU 46 N 0.07 0.00 -0.00 1.13 5.08 -1.05 -1.97 114.58 117.84 1wdy h GLU 46 Ca 0.03 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.39 1wdy h GLU 46 Cb 0.63 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.88 1wdy h GLU 46 CO 0.03 0.13 -0.04 0.41 -1.00 0.00 0.00 179.01 178.54 1wdy n GLY 47 N -0.50 -1.08 0.00 -3.84 0.00 -0.15 -4.92 105.19 94.71 1wdy n GLY 47 Ca -0.01 -0.21 0.00 0.00 0.00 0.00 0.00 46.02 45.80 1wdy n GLY 47 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1wdy n GLY 48 N 1.23 1.17 3.74 -0.02 0.00 -0.74 -5.04 105.19 105.52 1wdy n GLY 48 Ca 0.16 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.83 1wdy n GLY 48 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wdy s ALA 49 N -2.00 2.35 -0.52 4.61 0.00 -0.50 -4.92 121.76 120.78 1wdy s ALA 49 Ca 0.00 0.89 -0.28 0.00 0.00 0.00 0.00 51.96 52.57 1wdy s ALA 49 Cb 0.00 -3.44 0.02 0.00 0.00 0.00 0.00 23.12 19.70 1wdy s ALA 49 CO 0.00 -1.49 1.25 1.21 0.00 0.00 0.00 175.76 176.73 1wdy s ASN 50 N -1.92 6.42 0.60 0.00 3.84 -1.26 -4.80 114.94 117.83 1wdy s ASN 50 Ca 0.75 0.36 0.36 0.00 0.21 0.00 0.00 52.86 54.53 1wdy s ASN 50 Cb -0.29 -2.55 1.95 0.00 -0.55 0.00 0.00 41.25 39.82 1wdy s ASN 50 CO 0.40 -1.45 2.24 1.62 -2.79 0.00 0.00 177.10 177.11 1wdy h VAL 51 N 6.27 0.25 -0.39 -5.21 3.04 -1.91 -2.24 116.25 116.07 1wdy h VAL 51 Ca -0.25 -0.18 0.00 0.00 -1.01 0.00 0.00 66.70 65.26 1wdy h VAL 51 Cb 1.07 1.14 0.00 0.00 -2.01 0.00 0.00 31.29 31.49 1wdy h VAL 51 CO 1.15 0.03 0.00 0.59 -1.01 0.00 0.00 177.57 178.33 1wdy n ASN 52 N -3.39 4.63 -4.72 3.17 3.02 -1.26 -4.44 115.26 112.28 1wdy n ASN 52 Ca -0.02 -2.98 -0.43 0.00 -0.03 0.00 0.00 54.58 51.12 1wdy n ASN 52 Cb 0.14 -0.60 -0.02 0.00 -0.61 0.00 0.00 39.78 38.69 1wdy n ASN 52 CO 0.00 0.00 0.00 0.33 -2.62 0.00 0.00 177.26 174.97 1wdy n PHE 53 N -0.05 2.64 -4.27 3.10 7.35 -0.84 -4.95 117.46 120.44 1wdy n PHE 53 Ca 0.24 0.33 -0.34 0.00 -0.76 0.00 0.00 57.45 56.92 1wdy n PHE 53 Cb 1.02 -2.55 -0.15 0.00 0.35 0.00 0.00 39.48 38.15 1wdy n PHE 53 CO 0.00 0.00 0.00 -0.65 -0.76 0.00 0.00 176.76 175.35 1wdy s GLN 54 N -0.62 3.27 0.65 -4.13 -0.21 -1.26 -4.07 119.66 113.29 1wdy s GLN 54 Ca 0.64 -0.71 -0.15 0.00 0.02 0.00 0.00 55.36 55.16 1wdy s GLN 54 Cb -0.54 -2.76 -0.00 0.00 1.00 0.00 0.00 33.01 30.71 1wdy s GLN 54 CO 0.50 -0.07 1.11 -1.83 -2.12 0.00 0.00 175.29 172.89 1wdy s GLU 55 N 1.06 2.83 0.19 2.91 4.04 -0.65 -4.86 118.70 124.22 1wdy s GLU 55 Ca -0.00 1.42 0.10 0.00 0.04 0.00 0.00 54.97 56.53 1wdy s GLU 55 Cb -0.15 -1.95 -0.06 0.00 0.02 0.00 0.00 34.13 31.99 1wdy s GLU 55 CO -0.03 -1.23 1.37 1.49 -1.84 0.00 0.00 175.26 175.02 1wdy h GLU 56 N 0.12 0.00 -0.14 -4.83 4.81 -1.96 -0.72 114.58 111.86 1wdy h GLU 56 Ca -0.47 0.00 -0.12 0.00 -0.13 0.00 0.00 59.36 58.64 1wdy h GLU 56 Cb 1.25 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.63 1wdy h GLU 56 CO 0.54 0.78 -0.39 0.93 -0.73 0.00 0.00 179.01 180.14 1wdy h GLU 57 N 0.00 0.51 0.00 1.92 5.08 -1.99 -3.39 114.58 116.71 1wdy h GLU 57 Ca -0.01 -0.36 0.00 0.00 -1.00 0.00 0.00 59.36 57.99 1wdy h GLU 57 Cb 1.58 0.06 0.00 0.00 0.50 0.00 0.00 28.75 30.88 1wdy h GLU 57 CO 0.10 0.98 0.00 0.41 -1.00 0.00 0.00 179.01 179.50 1wdy n GLY 58 N 0.54 0.30 2.14 -3.84 0.00 -1.25 -5.03 105.19 98.05 1wdy n GLY 58 Ca -0.07 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 45.93 1wdy n GLY 58 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1wdy n GLY 59 N 0.45 0.53 3.77 -0.02 0.00 -0.28 -1.43 105.19 108.22 1wdy n GLY 59 Ca 0.00 -0.45 -0.40 0.00 0.00 0.00 0.00 46.02 45.17 1wdy n GLY 59 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1wdy s TRP 60 N -1.98 3.00 0.41 1.61 0.52 -1.25 -4.36 118.94 116.89 1wdy s TRP 60 Ca 0.00 1.45 0.08 0.00 0.02 0.00 0.00 56.10 57.65 1wdy s TRP 60 Cb 0.00 -3.61 -0.02 0.00 -1.15 0.00 0.00 33.47 28.68 1wdy s TRP 60 CO 0.00 -1.79 0.36 0.95 0.02 0.00 0.00 176.95 176.49 1wdy s THR 61 N -1.22 2.71 0.25 2.01 -4.23 -1.26 -1.63 115.64 112.26 1wdy s THR 61 Ca 0.52 -1.37 -0.04 0.00 -1.18 0.00 0.00 61.69 59.62 1wdy s THR 61 Cb -0.37 -3.01 0.23 0.00 1.34 0.00 0.00 72.50 70.69 1wdy s THR 61 CO 0.49 -0.02 1.70 -0.65 -0.54 0.00 0.00 174.62 175.60 1wdy h PRO 62 N 1.08 0.32 -0.53 3.99 0.11 -1.78 -2.40 132.00 132.79 1wdy h PRO 62 Ca -0.42 -0.02 -0.06 0.00 0.11 0.00 0.00 66.00 65.62 1wdy h PRO 62 Cb 1.26 -0.07 -0.02 0.00 0.11 0.00 0.00 31.00 32.28 1wdy h PRO 62 CO 0.58 0.21 0.10 1.25 -0.21 0.00 0.00 178.00 179.94 1wdy h LEU 63 N 0.33 0.83 -0.54 2.35 5.85 -1.94 -1.10 115.31 121.09 1wdy h LEU 63 Ca 0.43 -0.25 0.06 0.00 0.84 0.00 0.00 57.88 58.96 1wdy h LEU 63 Cb 0.72 -0.22 -0.05 0.00 0.37 0.00 0.00 40.66 41.48 1wdy h LEU 63 CO -0.48 0.87 0.26 0.45 -0.34 0.00 0.00 178.44 179.19 1wdy h HIS 64 N 0.76 0.47 -0.66 1.25 3.86 -1.87 -1.09 115.15 117.86 1wdy h HIS 64 Ca 0.16 0.02 -0.02 0.00 -1.16 0.00 0.00 60.37 59.37 1wdy h HIS 64 Cb 0.38 -0.13 -0.03 0.00 1.06 0.00 0.00 27.41 28.69 1wdy h HIS 64 CO 0.03 0.21 0.32 -0.91 0.86 0.00 0.00 177.93 178.44 1wdy h ASN 65 N 0.49 0.86 -0.76 2.45 2.35 -1.07 -1.10 115.58 118.80 1wdy h ASN 65 Ca 0.25 -0.13 -0.06 0.00 -0.55 0.00 0.00 56.30 55.81 1wdy h ASN 65 Cb 0.19 -0.22 -0.03 0.00 0.05 0.00 0.00 38.32 38.31 1wdy h ASN 65 CO -0.19 0.74 0.25 0.00 -1.65 0.00 0.00 177.43 176.58 1wdy h ALA 66 N 1.15 0.99 -0.35 -0.83 0.00 -0.73 -2.40 119.26 117.08 1wdy h ALA 66 Ca 0.23 -0.22 -0.10 0.00 0.00 0.00 0.00 54.91 54.81 1wdy h ALA 66 Cb 0.11 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 1wdy h ALA 66 CO -0.03 0.66 -0.18 0.28 0.00 0.00 0.00 179.25 179.98 1wdy h VAL 67 N 1.12 1.29 -0.49 0.00 2.07 -1.08 -1.94 116.25 117.22 1wdy h VAL 67 Ca 0.24 -1.31 0.10 0.00 0.82 0.00 0.00 66.70 66.55 1wdy h VAL 67 Cb 0.29 1.38 -0.03 0.00 -1.52 0.00 0.00 31.29 31.42 1wdy h VAL 67 CO -0.01 0.43 0.34 -0.61 0.02 0.00 0.00 177.57 177.74 1wdy h GLN 68 N 0.52 0.24 -0.21 1.57 4.15 -0.85 0.13 115.11 120.66 1wdy h GLN 68 Ca 0.08 -0.01 0.00 0.00 0.77 0.00 0.00 58.65 59.48 1wdy h GLN 68 Cb 0.73 -0.05 0.00 0.00 0.21 0.00 0.00 27.48 28.37 1wdy h GLN 68 CO 0.05 0.16 0.00 -1.33 -1.93 0.00 0.00 178.83 175.78 1wdy n MET 69 N -4.46 2.14 -2.72 1.69 2.81 -0.94 -4.89 117.12 110.76 1wdy n MET 69 Ca 0.08 -1.70 -0.21 0.00 -1.81 0.00 0.00 57.70 54.05 1wdy n MET 69 Cb 0.39 -1.46 0.01 0.00 -0.71 0.00 0.00 33.22 31.45 1wdy n MET 69 CO 0.00 0.00 0.00 0.43 1.51 0.00 0.00 175.97 177.91 1wdy n SER 70 N 0.96 -5.99 -4.37 7.83 7.64 0.03 -4.93 113.62 114.79 1wdy n SER 70 Ca 0.17 -0.16 -0.46 0.00 1.01 0.00 0.00 58.87 59.43 1wdy n SER 70 Cb 0.49 -4.89 -0.02 0.00 -1.01 0.00 0.00 64.21 58.78 1wdy n SER 70 CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 1wdy s ARG 71 N -5.38 3.65 0.35 1.43 1.81 -0.77 -4.89 118.95 115.15 1wdy s ARG 71 Ca 0.16 -2.32 0.03 0.00 -1.72 0.00 0.00 55.73 51.88 1wdy s ARG 71 Cb -0.07 -4.58 0.65 0.00 -0.45 0.00 0.00 34.95 30.50 1wdy s ARG 71 CO 0.20 -1.43 1.98 0.93 -0.68 0.00 0.00 175.30 176.31 1wdy h GLU 72 N 7.98 0.74 -0.53 3.54 5.08 -1.92 -0.44 114.58 129.04 1wdy h GLU 72 Ca 0.13 -0.07 -0.09 0.00 -1.00 0.00 0.00 59.36 58.33 1wdy h GLU 72 Cb 1.02 -0.15 -0.02 0.00 0.50 0.00 0.00 28.75 30.10 1wdy h GLU 72 CO 0.87 0.54 -0.05 0.38 -1.00 0.00 0.00 179.01 179.75 1wdy h ASP 73 N 0.75 0.92 -0.10 1.42 2.03 -1.98 -1.21 116.42 118.26 1wdy h ASP 73 Ca 0.19 -0.27 -0.23 0.00 -0.73 0.00 0.00 57.03 56.00 1wdy h ASP 73 Cb 0.00 -0.25 0.01 0.00 -0.83 0.00 0.00 39.33 38.27 1wdy h ASP 73 CO -0.03 1.01 -0.83 0.40 -1.03 0.00 0.00 179.24 178.75 1wdy h ILE 74 N 0.85 1.28 -0.39 4.15 2.04 -1.79 -1.75 117.51 121.90 1wdy h ILE 74 Ca 0.15 -2.04 0.07 0.00 1.00 0.00 0.00 64.86 64.04 1wdy h ILE 74 Cb 0.57 2.06 -0.06 0.00 -0.74 0.00 0.00 36.82 38.65 1wdy h ILE 74 CO 0.03 0.64 0.01 0.58 0.00 0.00 0.00 178.15 179.42 1wdy h VAL 75 N 0.50 0.72 -0.46 1.67 2.07 -1.01 -1.08 116.25 118.66 1wdy h VAL 75 Ca -0.07 -0.04 -0.10 0.00 0.82 0.00 0.00 66.70 67.31 1wdy h VAL 75 Cb 1.46 0.59 -0.02 0.00 -1.52 0.00 0.00 31.29 31.81 1wdy h VAL 75 CO 0.17 0.02 -0.13 -0.08 0.02 0.00 0.00 177.57 177.57 1wdy h GLU 76 N 0.12 0.86 -0.33 1.57 4.57 -1.10 -1.13 114.58 119.14 1wdy h GLU 76 Ca 0.19 -0.30 0.03 0.00 -1.18 0.00 0.00 59.36 58.10 1wdy h GLU 76 Cb 0.27 -0.06 -0.03 0.00 -0.16 0.00 0.00 28.75 28.76 1wdy h GLU 76 CO -0.31 0.94 0.14 1.25 -1.18 0.00 0.00 179.01 179.85 1wdy h LEU 77 N 0.77 0.19 -0.59 1.64 5.85 -0.93 -1.31 115.31 120.93 1wdy h LEU 77 Ca 0.12 0.02 -0.07 0.00 0.84 0.00 0.00 57.88 58.79 1wdy h LEU 77 Cb 0.64 -0.01 -0.02 0.00 0.37 0.00 0.00 40.66 41.64 1wdy h LEU 77 CO 0.04 0.15 0.08 -0.07 -0.34 0.00 0.00 178.44 178.30 1wdy h LEU 78 N 0.30 0.95 -1.03 2.25 3.38 -0.84 -2.37 115.31 117.95 1wdy h LEU 78 Ca 0.14 -0.27 -0.04 0.00 0.09 0.00 0.00 57.88 57.81 1wdy h LEU 78 Cb 0.08 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 40.55 1wdy h LEU 78 CO -0.12 0.98 0.25 -0.07 0.09 0.00 0.00 178.44 179.57 1wdy h LEU 79 N 0.88 0.87 -1.33 1.67 3.38 -0.95 -1.64 115.31 118.19 1wdy h LEU 79 Ca 0.18 -0.12 -0.07 0.00 0.09 0.00 0.00 57.88 57.96 1wdy h LEU 79 Cb 0.45 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.96 1wdy h LEU 79 CO 0.02 0.78 -0.33 0.03 0.09 0.00 0.00 178.44 179.02 1wdy h ARG 80 N 0.93 0.00 -0.19 1.13 3.08 -0.95 -1.39 114.38 116.98 1wdy h ARG 80 Ca 0.22 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.27 1wdy h ARG 80 Cb 0.19 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.24 1wdy h ARG 80 CO -0.02 0.33 0.00 0.72 -1.07 0.00 0.00 179.97 179.93 1wdy n HIS 81 N -4.02 0.26 -0.33 3.04 8.25 -0.88 -4.92 115.22 116.61 1wdy n HIS 81 Ca -0.02 -0.13 0.00 0.00 -0.26 0.00 0.00 57.72 57.31 1wdy n HIS 81 Cb 0.38 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.49 1wdy n HIS 81 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1wdy n GLY 82 N 0.83 0.80 3.68 -1.41 0.00 -0.52 -4.86 105.19 103.69 1wdy n GLY 82 Ca 0.07 -0.31 -0.45 0.00 0.00 0.00 0.00 46.02 45.33 1wdy n GLY 82 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wdy n ALA 83 N -1.00 1.44 -2.19 4.61 0.00 -0.67 -4.90 120.51 117.81 1wdy n ALA 83 Ca 0.00 0.42 -0.43 0.00 0.00 0.00 0.00 53.44 53.44 1wdy n ALA 83 Cb 0.00 -2.34 -0.02 0.00 0.00 0.00 0.00 19.45 17.09 1wdy n ALA 83 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1wdy s ASP 84 N 0.65 6.38 0.10 0.00 -1.08 -1.26 -4.73 116.67 116.73 1wdy s ASP 84 Ca 0.73 1.42 0.17 0.00 -0.52 0.00 0.00 52.55 54.35 1wdy s ASP 84 Cb -0.64 -2.53 0.74 0.00 -1.46 0.00 0.00 42.92 39.02 1wdy s ASP 84 CO 0.43 -1.29 1.54 -0.81 0.52 0.00 0.00 175.17 175.55 1wdy n PRO 85 N 7.72 0.08 -0.07 4.34 -0.04 -1.26 -2.96 135.00 142.81 1wdy n PRO 85 Ca 0.18 0.34 0.04 0.00 -0.04 0.00 0.00 63.50 64.02 1wdy n PRO 85 Cb 0.46 -1.65 0.06 0.00 -0.04 0.00 0.00 33.50 32.33 1wdy n PRO 85 CO 0.00 0.00 0.00 1.33 -0.04 0.00 0.00 175.50 176.79 1wdy n VAL 86 N -1.79 1.24 -2.25 0.52 0.24 -1.26 -4.43 118.33 110.59 1wdy n VAL 86 Ca 0.03 -1.40 -0.42 0.00 -2.04 0.00 0.00 64.34 60.51 1wdy n VAL 86 Cb 0.18 0.22 -0.03 0.00 -1.47 0.00 0.00 33.84 32.74 1wdy n VAL 86 CO 0.00 0.00 0.00 -0.22 -2.14 0.00 0.00 176.83 174.47 1wdy s LEU 87 N -1.66 4.31 0.27 1.34 2.96 -1.16 -4.86 118.68 119.89 1wdy s LEU 87 Ca 0.14 2.08 -0.08 0.00 -0.22 0.00 0.00 54.13 56.05 1wdy s LEU 87 Cb 0.12 -3.56 -0.06 0.00 0.50 0.00 0.00 46.19 43.19 1wdy s LEU 87 CO 0.01 -0.70 0.58 -0.13 -1.32 0.00 0.00 176.35 174.79 1wdy s ARG 88 N 2.33 3.73 0.22 1.98 0.52 -1.26 -4.38 118.95 122.10 1wdy s ARG 88 Ca 0.63 0.19 -0.00 0.00 -0.52 0.00 0.00 55.73 56.03 1wdy s ARG 88 Cb -0.31 -2.62 0.04 0.00 0.52 0.00 0.00 34.95 32.59 1wdy s ARG 88 CO 0.26 0.24 0.31 0.36 0.02 0.00 0.00 175.30 176.48 1wdy n LYS 89 N -0.58 0.40 0.18 3.54 2.85 -0.86 -4.92 118.16 118.77 1wdy n LYS 89 Ca -0.00 -0.83 0.03 0.00 -1.05 0.00 0.00 58.31 56.46 1wdy n LYS 89 Cb 0.53 -0.20 0.42 0.00 -0.65 0.00 0.00 35.03 35.13 1wdy n LYS 89 CO 0.00 0.00 0.00 0.87 -0.05 0.00 0.00 177.40 178.22 1wdy h LYS 90 N 0.00 0.06 -0.01 -1.58 1.57 -1.47 0.05 116.57 115.19 1wdy h LYS 90 Ca -0.10 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.66 1wdy h LYS 90 Cb 0.37 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.68 1wdy h LYS 90 CO 0.11 0.31 0.00 0.27 -0.57 0.00 0.00 179.45 179.56 1wdy n ASN 91 N -4.23 0.27 0.00 0.86 6.94 -1.26 -4.89 115.26 112.95 1wdy n ASN 91 Ca -0.02 -1.16 0.00 0.00 -0.02 0.00 0.00 54.58 53.38 1wdy n ASN 91 Cb 0.31 -0.00 0.00 0.00 -2.36 0.00 0.00 39.78 37.73 1wdy n ASN 91 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1wdy n GLY 92 N 0.99 0.77 3.75 4.83 0.00 0.00 -1.07 105.19 114.48 1wdy n GLY 92 Ca 0.21 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.83 1wdy n GLY 92 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wdy s ALA 93 N -2.86 3.42 0.45 4.61 0.00 -1.26 -4.33 121.76 121.79 1wdy s ALA 93 Ca 0.00 0.93 0.05 0.00 0.00 0.00 0.00 51.96 52.94 1wdy s ALA 93 Cb 0.00 -3.35 0.01 0.00 0.00 0.00 0.00 23.12 19.78 1wdy s ALA 93 CO 0.00 -0.23 0.63 0.95 0.00 0.00 0.00 175.76 177.11 1wdy s THR 94 N -0.93 3.17 0.30 0.00 -4.23 -1.26 -2.03 115.64 110.66 1wdy s THR 94 Ca 0.46 -0.84 0.06 0.00 -1.18 0.00 0.00 61.69 60.19 1wdy s THR 94 Cb -0.32 -3.11 0.30 0.00 1.34 0.00 0.00 72.50 70.70 1wdy s THR 94 CO 0.41 -0.06 1.76 -0.65 -0.54 0.00 0.00 174.62 175.54 1wdy h PRO 95 N 0.48 0.69 -0.40 3.99 0.11 -1.77 -2.26 132.00 132.84 1wdy h PRO 95 Ca -0.42 -0.04 0.04 0.00 0.11 0.00 0.00 66.00 65.69 1wdy h PRO 95 Cb 1.28 -0.16 -0.04 0.00 0.11 0.00 0.00 31.00 32.19 1wdy h PRO 95 CO 0.50 0.46 0.17 0.35 -0.21 0.00 0.00 178.00 179.26 1wdy h PHE 96 N 0.71 0.30 -0.56 0.65 3.57 -1.91 -0.83 116.94 118.87 1wdy h PHE 96 Ca 0.58 0.02 -0.07 0.00 3.53 0.00 0.00 57.97 62.04 1wdy h PHE 96 Cb 0.94 -0.07 -0.02 0.00 2.79 0.00 0.00 35.95 39.59 1wdy h PHE 96 CO -0.02 0.13 0.08 -0.07 -2.23 0.00 0.00 178.31 176.21 1wdy h LEU 97 N 0.34 0.85 -1.21 0.59 3.38 -1.81 -2.19 115.31 115.27 1wdy h LEU 97 Ca 0.18 -0.18 -0.06 0.00 0.09 0.00 0.00 57.88 57.90 1wdy h LEU 97 Cb 0.14 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.65 1wdy h LEU 97 CO -0.16 0.86 -0.14 -0.07 0.09 0.00 0.00 178.44 179.02 1wdy h LEU 98 N 0.85 0.36 -1.29 1.67 3.38 -0.99 -2.33 115.31 116.96 1wdy h LEU 98 Ca 0.17 -0.09 -0.04 0.00 0.09 0.00 0.00 57.88 58.02 1wdy h LEU 98 Cb 0.39 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 41.02 1wdy h LEU 98 CO 0.01 0.53 0.07 0.00 0.09 0.00 0.00 178.44 179.14 1wdy h ALA 99 N 1.51 1.43 -0.30 1.53 0.00 -0.54 -1.00 119.26 121.89 1wdy h ALA 99 Ca 0.07 -0.17 -0.06 0.00 0.00 0.00 0.00 54.91 54.75 1wdy h ALA 99 Cb 0.46 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 1wdy h ALA 99 CO 0.03 0.41 -0.03 0.00 0.00 0.00 0.00 179.25 179.66 1wdy h ALA 100 N 1.54 0.41 -0.85 0.00 0.00 -1.10 0.58 119.26 119.84 1wdy h ALA 100 Ca 0.12 -0.26 0.04 0.00 0.00 0.00 0.00 54.91 54.81 1wdy h ALA 100 Cb 0.24 -0.11 -0.05 0.00 0.00 0.00 0.00 17.79 17.87 1wdy h ALA 100 CO 0.00 0.19 0.54 0.82 0.00 0.00 0.00 179.25 180.81 1wdy h ILE 101 N 0.34 1.12 0.00 0.00 2.04 -1.15 -1.77 117.51 118.09 1wdy h ILE 101 Ca 0.08 -0.36 -0.02 0.00 1.00 0.00 0.00 64.86 65.57 1wdy h ILE 101 Cb 0.49 -0.02 -0.00 0.00 -0.74 0.00 0.00 36.82 36.55 1wdy h ILE 101 CO 0.02 0.19 -0.09 0.00 0.00 0.00 0.00 178.15 178.28 1wdy h ALA 102 N 1.36 1.02 -0.10 1.87 0.00 -0.97 -3.47 119.26 118.96 1wdy h ALA 102 Ca 0.34 -0.08 -0.04 0.00 0.00 0.00 0.00 54.91 55.13 1wdy h ALA 102 Cb 0.03 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 1wdy h ALA 102 CO -0.13 0.11 -0.04 0.41 0.00 0.00 0.00 179.25 179.60 1wdy n GLY 103 N 0.09 0.55 3.49 0.00 0.00 0.05 -5.00 105.19 104.36 1wdy n GLY 103 Ca 0.00 -0.94 -0.43 0.00 0.00 0.00 0.00 46.02 44.66 1wdy n GLY 103 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1wdy s SER 104 N -2.93 6.26 0.22 1.61 0.15 -0.35 -4.45 113.70 114.21 1wdy s SER 104 Ca 0.00 -0.68 -0.08 0.00 0.70 0.00 0.00 55.95 55.90 1wdy s SER 104 Cb 0.00 -2.41 0.17 0.00 -1.71 0.00 0.00 66.02 62.07 1wdy s SER 104 CO 0.00 -1.27 1.81 0.58 1.20 0.00 0.00 173.24 175.56 1wdy h VAL 105 N 5.98 1.26 -0.77 4.45 2.07 -1.93 -0.94 116.25 126.37 1wdy h VAL 105 Ca -0.27 -0.73 0.00 0.00 0.82 0.00 0.00 66.70 66.51 1wdy h VAL 105 Cb 1.07 0.21 -0.04 0.00 -1.52 0.00 0.00 31.29 31.02 1wdy h VAL 105 CO 1.11 0.31 0.48 0.11 0.02 0.00 0.00 177.57 179.61 1wdy h LYS 106 N 1.18 1.04 -0.07 1.57 1.57 -1.98 -0.07 116.57 119.81 1wdy h LYS 106 Ca 0.28 -0.08 -0.19 0.00 -1.87 0.00 0.00 60.65 58.79 1wdy h LYS 106 Cb 0.13 -0.22 -0.00 0.00 0.08 0.00 0.00 32.23 32.21 1wdy h LYS 106 CO -0.03 0.72 -0.77 -0.07 -0.57 0.00 0.00 179.45 178.72 1wdy h LEU 107 N 1.06 0.53 -0.41 2.94 3.38 -1.89 -1.65 115.31 119.27 1wdy h LEU 107 Ca 0.28 -0.36 0.02 0.00 0.09 0.00 0.00 57.88 57.91 1wdy h LEU 107 Cb -0.07 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 40.49 1wdy h LEU 107 CO -0.06 1.12 0.22 -0.07 0.09 0.00 0.00 178.44 179.74 1wdy h LEU 108 N 0.29 0.34 -0.81 1.67 3.38 -0.90 -1.40 115.31 117.88 1wdy h LEU 108 Ca -0.04 0.01 0.01 0.00 0.09 0.00 0.00 57.88 57.95 1wdy h LEU 108 Cb 1.36 -0.06 -0.04 0.00 0.09 0.00 0.00 40.66 42.02 1wdy h LEU 108 CO 0.13 0.25 0.53 0.11 0.09 0.00 0.00 178.44 179.56 1wdy h LYS 109 N 0.45 1.06 -0.21 1.13 1.57 -0.92 -1.87 116.57 117.77 1wdy h LYS 109 Ca 0.17 -0.07 -0.02 0.00 -1.87 0.00 0.00 60.65 58.86 1wdy h LYS 109 Cb 0.04 -0.24 -0.01 0.00 0.08 0.00 0.00 32.23 32.10 1wdy h LYS 109 CO -0.10 0.71 0.06 1.25 -0.57 0.00 0.00 179.45 180.80 1wdy h LEU 110 N 1.10 0.31 -0.85 2.94 5.85 -0.95 -2.47 115.31 121.25 1wdy h LEU 110 Ca 0.30 -0.21 -0.11 0.00 0.84 0.00 0.00 57.88 58.69 1wdy h LEU 110 Cb -0.13 -0.08 -0.02 0.00 0.37 0.00 0.00 40.66 40.81 1wdy h LEU 110 CO -0.06 0.45 -0.51 -0.26 -0.34 0.00 0.00 178.44 177.71 1wdy h PHE 111 N 0.17 0.00 0.00 1.25 0.04 -1.12 -1.84 116.94 115.44 1wdy h PHE 111 Ca 0.07 0.00 -0.04 0.00 2.80 0.00 0.00 57.97 60.80 1wdy h PHE 111 Cb 0.25 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.39 1wdy h PHE 111 CO 0.01 0.51 -0.18 -0.07 -0.60 0.00 0.00 178.31 177.98 1wdy h LEU 112 N 0.00 0.00 -0.01 1.54 3.38 -1.16 -1.46 115.31 117.60 1wdy h LEU 112 Ca -0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.96 1wdy h LEU 112 Cb 1.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.75 1wdy h LEU 112 CO 0.07 0.18 0.00 -1.54 0.09 0.00 0.00 178.44 177.23 1wdy n SER 113 N -4.28 0.44 -0.61 -0.43 3.41 -0.71 -3.75 113.62 107.68 1wdy n SER 113 Ca -0.02 0.54 0.06 0.00 -0.26 0.00 0.00 58.87 59.19 1wdy n SER 113 Cb 0.24 -0.66 0.17 0.00 -0.26 0.00 0.00 64.21 63.70 1wdy n SER 113 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1wdy n LYS 114 N -1.91 2.83 0.00 4.33 4.76 -0.68 -4.97 118.16 122.51 1wdy n LYS 114 Ca 0.06 -2.24 0.00 0.00 -2.87 0.00 0.00 58.31 53.26 1wdy n LYS 114 Cb 0.38 -1.42 0.00 0.00 -1.84 0.00 0.00 35.03 32.16 1wdy n LYS 114 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1wdy n GLY 115 N 0.01 1.09 3.76 0.72 0.00 -1.04 -4.82 105.19 104.92 1wdy n GLY 115 Ca 0.13 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.78 1wdy n GLY 115 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wdy s ALA 116 N -2.00 2.87 -0.14 4.61 0.00 -0.64 -5.02 121.76 121.44 1wdy s ALA 116 Ca 0.00 1.04 -0.05 0.00 0.00 0.00 0.00 51.96 52.95 1wdy s ALA 116 Cb 0.00 -3.44 -0.04 0.00 0.00 0.00 0.00 23.12 19.65 1wdy s ALA 116 CO 0.00 -0.91 0.05 0.34 0.00 0.00 0.00 175.76 175.24 1wdy s ASP 117 N -1.31 5.54 0.56 0.00 2.15 -1.26 -4.65 116.67 117.71 1wdy s ASP 117 Ca 0.68 0.13 0.25 0.00 0.43 0.00 0.00 52.55 54.04 1wdy s ASP 117 Cb -0.32 -1.82 1.53 0.00 -0.30 0.00 0.00 42.92 42.01 1wdy s ASP 117 CO 0.37 0.26 2.10 1.62 -0.17 0.00 0.00 175.17 179.36 1wdy h VAL 118 N 4.58 0.65 -0.58 1.11 3.04 -1.95 -1.59 116.25 121.51 1wdy h VAL 118 Ca -0.43 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.26 1wdy h VAL 118 Cb 1.18 0.86 0.00 0.00 -2.01 0.00 0.00 31.29 31.33 1wdy h VAL 118 CO 0.64 0.00 0.00 0.59 -1.01 0.00 0.00 177.57 177.79 1wdy n ASN 119 N -4.10 4.34 -4.73 3.17 3.02 -1.26 -4.52 115.26 111.18 1wdy n ASN 119 Ca 0.02 -2.39 -0.32 0.00 -0.03 0.00 0.00 54.58 51.86 1wdy n ASN 119 Cb 0.32 -0.52 0.10 0.00 -0.61 0.00 0.00 39.78 39.07 1wdy n ASN 119 CO 0.00 0.00 0.00 -1.83 -2.62 0.00 0.00 177.26 172.81 1wdy s GLU 120 N -1.73 1.97 0.05 3.52 -1.05 -0.60 -4.93 118.70 115.93 1wdy s GLU 120 Ca 0.46 1.50 -0.03 0.00 -0.15 0.00 0.00 54.97 56.75 1wdy s GLU 120 Cb 0.29 -1.84 -0.02 0.00 -0.44 0.00 0.00 34.13 32.12 1wdy s GLU 120 CO 0.23 -1.91 0.03 0.00 0.95 0.00 0.00 175.26 174.56 1wdy n ASP 122 N 0.52 -0.55 0.02 0.00 5.68 -0.62 -4.88 116.55 116.72 1wdy n ASP 122 Ca -0.17 -1.17 0.11 0.00 -0.50 0.00 0.00 54.79 53.06 1wdy n ASP 122 Cb 0.59 -0.64 0.48 0.00 -1.14 0.00 0.00 41.12 40.41 1wdy n ASP 122 CO 0.00 0.00 0.00 0.49 -1.33 0.00 0.00 177.20 176.36 1wdy n PHE 123 N -3.45 0.17 0.18 2.11 3.72 -0.23 -1.69 117.46 118.27 1wdy n PHE 123 Ca 0.10 0.06 0.10 0.00 -0.05 0.00 0.00 57.45 57.66 1wdy n PHE 123 Cb 0.37 -0.59 0.20 0.00 -0.94 0.00 0.00 39.48 38.52 1wdy n PHE 123 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 1wdy n TYR 124 N -1.64 0.50 -0.16 1.38 4.01 -1.26 -3.39 117.16 116.60 1wdy n TYR 124 Ca 0.05 -0.29 0.00 0.00 -0.16 0.00 0.00 57.90 57.51 1wdy n TYR 124 Cb 0.28 -0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.31 1wdy n TYR 124 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1wdy n GLY 125 N 1.31 0.58 3.68 2.72 0.00 -0.68 -4.40 105.19 108.41 1wdy n GLY 125 Ca 0.18 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.77 1wdy n GLY 125 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1wdy s PHE 126 N -2.34 2.68 0.52 1.61 0.08 -1.26 -4.42 117.98 114.85 1wdy s PHE 126 Ca 0.00 0.68 0.03 0.00 0.12 0.00 0.00 56.93 57.76 1wdy s PHE 126 Cb 0.00 -3.73 0.03 0.00 -0.57 0.00 0.00 43.02 38.75 1wdy s PHE 126 CO 0.00 -2.79 0.72 0.95 -0.10 0.00 0.00 175.22 174.00 1wdy s THR 127 N 2.68 2.75 0.23 0.64 -4.23 -1.26 -1.59 115.64 114.87 1wdy s THR 127 Ca 0.66 -0.75 -0.07 0.00 -1.18 0.00 0.00 61.69 60.35 1wdy s THR 127 Cb -0.32 -2.99 0.21 0.00 1.34 0.00 0.00 72.50 70.73 1wdy s THR 127 CO 0.27 0.00 1.88 0.00 -0.54 0.00 0.00 174.62 176.23 1wdy h ALA 128 N 0.22 1.14 -0.50 3.99 0.00 -1.80 -0.99 119.26 121.32 1wdy h ALA 128 Ca -0.41 -0.03 -0.04 0.00 0.00 0.00 0.00 54.91 54.42 1wdy h ALA 128 Cb 1.29 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 18.77 1wdy h ALA 128 CO 0.50 0.39 0.15 0.35 0.00 0.00 0.00 179.25 180.64 1wdy h PHE 129 N 1.07 0.82 -0.69 0.00 3.57 -1.93 -0.21 116.94 119.57 1wdy h PHE 129 Ca 0.34 -0.09 -0.02 0.00 3.53 0.00 0.00 57.97 61.74 1wdy h PHE 129 Cb 0.02 -0.23 -0.03 0.00 2.79 0.00 0.00 35.95 38.49 1wdy h PHE 129 CO -0.02 0.71 0.37 0.52 -2.23 0.00 0.00 178.31 177.66 1wdy h MET 130 N 0.68 0.96 -0.44 1.11 2.86 -1.86 -1.79 114.93 116.46 1wdy h MET 130 Ca 0.16 -0.12 -0.08 0.00 -2.06 0.00 0.00 59.70 57.60 1wdy h MET 130 Cb 0.29 -0.19 -0.02 0.00 0.06 0.00 0.00 31.60 31.74 1wdy h MET 130 CO -0.00 0.73 -0.07 0.93 1.06 0.00 0.00 176.91 179.56 1wdy h GLU 131 N 0.94 0.75 -0.57 1.72 4.39 -0.64 0.11 114.58 121.29 1wdy h GLU 131 Ca 0.24 -0.23 -0.07 0.00 0.34 0.00 0.00 59.36 59.64 1wdy h GLU 131 Cb 0.05 -0.07 -0.02 0.00 -0.10 0.00 0.00 28.75 28.60 1wdy h GLU 131 CO -0.04 0.81 0.06 0.00 -1.16 0.00 0.00 179.01 178.68 1wdy h ALA 132 N 1.23 1.04 -0.14 3.43 0.00 -0.78 -1.37 119.26 122.68 1wdy h ALA 132 Ca 0.13 -0.26 -0.02 0.00 0.00 0.00 0.00 54.91 54.75 1wdy h ALA 132 Cb 0.52 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 18.09 1wdy h ALA 132 CO 0.03 0.61 -0.00 0.00 0.00 0.00 0.00 179.25 179.89 1wdy h ALA 133 N 1.19 0.19 -0.79 0.00 0.00 -0.62 0.13 119.26 119.34 1wdy h ALA 133 Ca 0.17 -0.19 0.09 0.00 0.00 0.00 0.00 54.91 54.98 1wdy h ALA 133 Cb 0.43 -0.05 -0.07 0.00 0.00 0.00 0.00 17.79 18.09 1wdy h ALA 133 CO 0.01 -0.11 0.44 0.28 0.00 0.00 0.00 179.25 179.87 1wdy h VAL 134 N -0.02 0.89 -0.48 0.00 2.07 -0.56 -2.72 116.25 115.44 1wdy h VAL 134 Ca 0.04 -0.25 0.00 0.00 0.82 0.00 0.00 66.70 67.30 1wdy h VAL 134 Cb 0.37 0.09 0.00 0.00 -1.52 0.00 0.00 31.29 30.23 1wdy h VAL 134 CO 0.01 0.14 0.00 -1.22 0.02 0.00 0.00 177.57 176.51 1wdy n TYR 135 N -4.77 0.63 -2.71 1.57 4.01 -0.54 -4.91 117.16 110.44 1wdy n TYR 135 Ca 0.13 -0.31 -0.19 0.00 -0.16 0.00 0.00 57.90 57.36 1wdy n TYR 135 Cb 0.27 0.00 0.02 0.00 -0.31 0.00 0.00 39.34 39.32 1wdy n TYR 135 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1wdy n GLY 136 N 1.52 -0.39 3.44 2.72 0.00 -0.55 -4.94 105.19 107.00 1wdy n GLY 136 Ca 0.21 -0.03 -0.44 0.00 0.00 0.00 0.00 46.02 45.76 1wdy n GLY 136 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1wdy s LYS 137 N -5.32 3.89 0.17 1.61 -0.14 0.33 -4.88 119.74 115.41 1wdy s LYS 137 Ca 0.16 -2.34 -0.13 0.00 -1.36 0.00 0.00 55.97 52.30 1wdy s LYS 137 Cb -0.07 -4.93 0.06 0.00 -1.68 0.00 0.00 37.83 31.21 1wdy s LYS 137 CO 0.20 -1.69 1.76 0.28 -0.76 0.00 0.00 175.35 175.14 1wdy h VAL 138 N 5.00 1.19 -0.62 3.17 2.07 -1.92 -0.08 116.25 125.06 1wdy h VAL 138 Ca 0.23 -0.51 -0.01 0.00 0.82 0.00 0.00 66.70 67.24 1wdy h VAL 138 Cb 0.94 0.54 -0.03 0.00 -1.52 0.00 0.00 31.29 31.22 1wdy h VAL 138 CO 1.14 0.21 0.35 0.11 0.02 0.00 0.00 177.57 179.41 1wdy h LYS 139 N 0.72 0.85 -0.61 1.57 1.57 -1.91 -1.04 116.57 117.73 1wdy h LYS 139 Ca 0.19 -0.09 -0.09 0.00 -1.87 0.00 0.00 60.65 58.79 1wdy h LYS 139 Cb 0.08 -0.17 -0.02 0.00 0.08 0.00 0.00 32.23 32.20 1wdy h LYS 139 CO -0.03 0.63 0.03 0.00 -0.57 0.00 0.00 179.45 179.52 1wdy h ALA 140 N 1.17 0.82 -0.39 3.86 0.00 -1.73 -1.32 119.26 121.67 1wdy h ALA 140 Ca 0.22 -0.30 0.02 0.00 0.00 0.00 0.00 54.91 54.86 1wdy h ALA 140 Cb 0.01 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 17.55 1wdy h ALA 140 CO -0.04 0.63 0.21 1.25 0.00 0.00 0.00 179.25 181.30 1wdy h LEU 141 N 0.95 0.32 -0.49 0.00 5.85 -0.55 -0.22 115.31 121.18 1wdy h LEU 141 Ca 0.18 0.01 -0.08 0.00 0.84 0.00 0.00 57.88 58.83 1wdy h LEU 141 Cb 0.52 -0.05 -0.02 0.00 0.37 0.00 0.00 40.66 41.48 1wdy h LEU 141 CO 0.02 0.23 -0.01 0.11 -0.34 0.00 0.00 178.44 178.46 1wdy h LYS 142 N 0.42 0.87 -0.20 1.25 1.57 -1.06 -1.29 116.57 118.13 1wdy h LYS 142 Ca 0.16 -0.28 0.00 0.00 -1.87 0.00 0.00 60.65 58.66 1wdy h LYS 142 Cb 0.04 -0.08 -0.01 0.00 0.08 0.00 0.00 32.23 32.27 1wdy h LYS 142 CO -0.09 0.91 0.14 0.35 -0.57 0.00 0.00 179.45 180.18 1wdy h PHE 143 N 0.73 0.26 -0.64 -1.35 3.57 -0.86 -1.99 116.94 116.66 1wdy h PHE 143 Ca 0.14 0.01 -0.04 0.00 3.53 0.00 0.00 57.97 61.61 1wdy h PHE 143 Cb 0.52 -0.09 -0.03 0.00 2.79 0.00 0.00 35.95 39.15 1wdy h PHE 143 CO 0.04 0.16 0.25 -0.07 -2.23 0.00 0.00 178.31 176.46 1wdy h LEU 144 N 0.28 0.89 -0.39 0.59 3.38 -0.93 -1.62 115.31 117.50 1wdy h LEU 144 Ca 0.08 -0.17 0.05 0.00 0.09 0.00 0.00 57.88 57.92 1wdy h LEU 144 Cb -0.03 -0.23 -0.04 0.00 0.09 0.00 0.00 40.66 40.44 1wdy h LEU 144 CO -0.02 0.82 0.14 0.22 0.09 0.00 0.00 178.44 179.70 1wdy h TYR 145 N 0.91 0.25 0.00 1.13 3.20 -1.04 -1.43 116.97 119.98 1wdy h TYR 145 Ca 0.21 0.02 0.00 0.00 3.14 0.00 0.00 58.73 62.10 1wdy h TYR 145 Cb 0.21 -0.06 0.00 0.00 1.54 0.00 0.00 36.73 38.43 1wdy h TYR 145 CO 0.01 0.10 0.00 0.87 -1.64 0.00 0.00 178.16 177.51 1wdy h LYS 146 N 0.30 0.00 -0.22 1.82 1.57 -1.05 -1.98 116.57 117.01 1wdy h LYS 146 Ca 0.18 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.96 1wdy h LYS 146 Cb 0.16 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.47 1wdy h LYS 146 CO -0.18 0.00 0.00 0.54 -0.57 0.00 0.00 179.45 179.24 1wdy n ARG 147 N -2.50 1.80 -0.11 3.15 5.12 -0.64 -4.94 116.66 118.55 1wdy n ARG 147 Ca 0.03 -1.21 0.00 0.00 -1.93 0.00 0.00 57.85 54.73 1wdy n ARG 147 Cb 0.31 -1.38 0.00 0.00 -1.16 0.00 0.00 32.46 30.23 1wdy n ARG 147 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1wdy n GLY 148 N 1.14 0.94 3.76 -0.13 0.00 -0.74 -4.92 105.19 105.24 1wdy n GLY 148 Ca 0.16 -0.10 -0.41 0.00 0.00 0.00 0.00 46.02 45.66 1wdy n GLY 148 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wdy s ALA 149 N -2.00 3.66 -0.44 4.61 0.00 -0.61 -4.89 121.76 122.08 1wdy s ALA 149 Ca 0.00 1.48 -0.29 0.00 0.00 0.00 0.00 51.96 53.15 1wdy s ALA 149 Cb 0.00 -3.60 0.03 0.00 0.00 0.00 0.00 23.12 19.54 1wdy s ALA 149 CO 0.00 -0.91 1.13 1.21 0.00 0.00 0.00 175.76 177.19 1wdy s ASN 150 N 0.26 6.69 0.34 0.00 3.84 -1.26 -4.81 114.94 120.00 1wdy s ASN 150 Ca 0.59 0.61 0.12 0.00 0.21 0.00 0.00 52.86 54.39 1wdy s ASN 150 Cb -0.45 -2.55 0.60 0.00 -0.55 0.00 0.00 41.25 38.30 1wdy s ASN 150 CO 0.50 -1.17 1.76 0.58 -2.79 0.00 0.00 177.10 175.97 1wdy h VAL 151 N 6.13 1.32 -0.52 -5.21 2.07 -1.91 -3.23 116.25 114.88 1wdy h VAL 151 Ca -0.23 -1.54 0.00 0.00 0.82 0.00 0.00 66.70 65.75 1wdy h VAL 151 Cb 1.06 1.83 0.00 0.00 -1.52 0.00 0.00 31.29 32.66 1wdy h VAL 151 CO 1.11 0.44 0.00 0.59 0.02 0.00 0.00 177.57 179.73 1wdy n ASN 152 N -4.00 3.91 -4.73 0.57 3.02 -1.26 -4.43 115.26 108.34 1wdy n ASN 152 Ca -0.02 -2.28 -0.42 0.00 -0.03 0.00 0.00 54.58 51.83 1wdy n ASN 152 Cb 0.47 -0.45 -0.01 0.00 -0.61 0.00 0.00 39.78 39.19 1wdy n ASN 152 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 1wdy n LEU 153 N 0.84 4.14 -4.75 3.41 4.77 -1.22 -4.98 117.00 119.21 1wdy n LEU 153 Ca 0.21 1.19 -0.36 0.00 -0.03 0.00 0.00 56.01 57.02 1wdy n LEU 153 Cb 0.69 -1.55 -0.08 0.00 -2.33 0.00 0.00 43.42 40.14 1wdy n LEU 153 CO 0.16 -0.08 -0.25 -0.13 -1.33 0.00 0.00 177.39 175.76 1wdy s ARG 154 N -1.31 3.30 0.09 3.23 0.52 -1.26 -4.37 118.95 119.14 1wdy s ARG 154 Ca 0.59 -0.30 -0.31 0.00 -0.52 0.00 0.00 55.73 55.20 1wdy s ARG 154 Cb -0.53 -3.00 -0.09 0.00 0.52 0.00 0.00 34.95 31.85 1wdy s ARG 154 CO 0.57 0.67 1.73 1.03 0.02 0.00 0.00 175.30 179.31 1wdy s ARG 155 N -0.75 4.17 -0.25 3.54 0.52 -0.19 -4.73 118.95 121.26 1wdy s ARG 155 Ca 0.12 2.44 -0.14 0.00 -0.52 0.00 0.00 55.73 57.64 1wdy s ARG 155 Cb -0.12 -3.60 -0.04 0.00 0.52 0.00 0.00 34.95 31.71 1wdy s ARG 155 CO 0.03 -0.78 0.31 0.21 0.02 0.00 0.00 175.30 175.08 1wdy s LYS 156 N 2.69 4.06 0.30 3.54 2.20 -1.26 -0.60 119.74 130.66 1wdy s LYS 156 Ca 0.77 -0.03 0.00 0.00 -0.36 0.00 0.00 55.97 56.35 1wdy s LYS 156 Cb -0.42 -3.60 -0.00 0.00 -1.51 0.00 0.00 37.83 32.30 1wdy s LYS 156 CO 0.34 -0.13 0.01 -2.37 -0.36 0.00 0.00 175.35 172.84 1wdy n THR 157 N 4.72 0.00 -1.93 3.43 5.66 -1.26 -2.26 114.28 122.63 1wdy n THR 157 Ca -0.11 -1.43 -0.37 0.00 -3.05 0.00 0.00 64.05 59.09 1wdy n THR 157 Cb 0.51 0.30 0.03 0.00 -1.55 0.00 0.00 70.33 69.62 1wdy n THR 157 CO 0.00 0.00 0.00 -0.54 -3.05 0.00 0.00 175.07 171.48 1wdy s LYS 158 N -3.08 3.19 0.17 1.09 1.02 -1.22 -4.78 119.74 116.13 1wdy s LYS 158 Ca 0.01 2.03 -0.15 0.00 0.02 0.00 0.00 55.97 57.88 1wdy s LYS 158 Cb 0.00 -2.18 0.11 0.00 -0.52 0.00 0.00 37.83 35.24 1wdy s LYS 158 CO 0.01 -1.09 1.74 1.49 -0.92 0.00 0.00 175.35 176.58 1wdy h GLU 159 N 1.39 0.27 -1.00 1.68 4.81 -1.99 -0.76 114.58 118.98 1wdy h GLU 159 Ca -0.50 -0.02 0.13 0.00 -0.13 0.00 0.00 59.36 58.84 1wdy h GLU 159 Cb 1.29 -0.06 -0.09 0.00 0.63 0.00 0.00 28.75 30.52 1wdy h GLU 159 CO 0.57 0.18 0.63 0.38 -0.73 0.00 0.00 179.01 180.04 1wdy h ASP 160 N 0.28 0.91 -0.17 1.04 3.04 -2.00 -1.89 116.42 117.62 1wdy h ASP 160 Ca 0.20 0.05 -0.17 0.00 -3.24 0.00 0.00 57.03 53.87 1wdy h ASP 160 Cb 0.21 -0.13 0.01 0.00 -1.04 0.00 0.00 39.33 38.38 1wdy h ASP 160 CO -0.22 0.47 -0.57 1.56 -2.04 0.00 0.00 179.24 178.44 1wdy h GLN 161 N 0.97 0.69 -0.23 4.15 1.08 -1.67 -3.15 115.11 116.95 1wdy h GLN 161 Ca 0.51 -0.51 -0.01 0.00 -1.45 0.00 0.00 58.65 57.18 1wdy h GLN 161 Cb 0.53 0.09 -0.01 0.00 -0.05 0.00 0.00 27.48 28.04 1wdy h GLN 161 CO -0.28 1.13 0.11 1.49 -0.95 0.00 0.00 178.83 180.33 1wdy h GLU 162 N 0.39 0.32 0.00 1.46 4.81 -0.78 -1.31 114.58 119.47 1wdy h GLU 162 Ca -0.02 -0.03 -0.07 0.00 -0.13 0.00 0.00 59.36 59.11 1wdy h GLU 162 Cb 1.20 -0.07 -0.01 0.00 0.63 0.00 0.00 28.75 30.50 1wdy h GLU 162 CO 0.12 0.25 -0.32 0.00 -0.73 0.00 0.00 179.01 178.34 1wdy h ARG 163 N 0.32 0.00 -0.71 1.92 3.08 -1.34 -1.82 114.38 115.83 1wdy h ARG 163 Ca 0.08 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.13 1wdy h ARG 163 Cb 0.04 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.09 1wdy h ARG 163 CO -0.01 0.32 0.00 1.28 -1.07 0.00 0.00 179.97 180.48 1wdy n LEU 164 N -3.59 2.15 -1.04 3.04 4.77 -0.55 -4.90 117.00 116.88 1wdy n LEU 164 Ca -0.01 -1.09 -0.14 0.00 -0.03 0.00 0.00 56.01 54.75 1wdy n LEU 164 Cb 0.44 -0.46 -0.06 0.00 -2.33 0.00 0.00 43.42 41.02 1wdy n LEU 164 CO 0.35 0.35 -0.13 0.54 -1.33 0.00 0.00 177.39 177.18 1wdy n ARG 165 N 0.19 -1.21 -2.30 3.23 1.74 -0.68 -5.01 116.66 112.62 1wdy n ARG 165 Ca 0.08 0.96 -0.26 0.00 -0.77 0.00 0.00 57.85 57.86 1wdy n ARG 165 Cb 0.45 -5.15 0.05 0.00 -1.02 0.00 0.00 32.46 26.79 1wdy n ARG 165 CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 1wdy s LYS 166 N -3.08 2.66 0.00 5.56 1.02 -0.83 -2.74 119.74 122.33 1wdy s LYS 166 Ca 0.00 -0.07 0.00 0.00 0.02 0.00 0.00 55.97 55.92 1wdy s LYS 166 Cb 0.00 -2.22 0.00 0.00 -0.52 0.00 0.00 37.83 35.09 1wdy s LYS 166 CO 0.00 -0.91 0.00 0.41 -0.92 0.00 0.00 175.35 173.93 1wdy n GLY 167 N -2.72 -0.47 1.25 -3.33 0.00 -1.26 -4.15 105.19 94.50 1wdy n GLY 167 Ca 0.06 -1.77 0.00 0.00 0.00 0.00 0.00 46.02 44.31 1wdy n GLY 167 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1wdy n GLY 168 N -0.49 0.82 3.83 -0.02 0.00 0.23 -1.36 105.19 108.19 1wdy n GLY 168 Ca 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.71 1wdy n GLY 168 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wdy s ALA 169 N -2.75 2.78 0.37 4.61 0.00 -1.26 -3.97 121.76 121.53 1wdy s ALA 169 Ca 0.00 0.07 0.08 0.00 0.00 0.00 0.00 51.96 52.11 1wdy s ALA 169 Cb 0.00 -3.16 -0.07 0.00 0.00 0.00 0.00 23.12 19.89 1wdy s ALA 169 CO 0.00 -1.07 -0.03 0.95 0.00 0.00 0.00 175.76 175.61 1wdy s THR 170 N -3.03 2.19 0.36 0.00 -4.23 -1.26 -1.03 115.64 108.64 1wdy s THR 170 Ca 0.58 -2.07 0.07 0.00 -1.18 0.00 0.00 61.69 59.08 1wdy s THR 170 Cb -0.13 -2.82 0.30 0.00 1.34 0.00 0.00 72.50 71.19 1wdy s THR 170 CO 0.53 -0.11 1.93 0.00 -0.54 0.00 0.00 174.62 176.43 1wdy h ALA 171 N 1.87 1.74 -0.64 3.99 0.00 -1.78 -1.84 119.26 122.59 1wdy h ALA 171 Ca -0.43 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.44 1wdy h ALA 171 Cb 1.25 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 18.83 1wdy h ALA 171 CO 0.74 0.11 0.27 1.25 0.00 0.00 0.00 179.25 181.62 1wdy h LEU 172 N 0.75 0.88 -1.08 0.00 5.85 -1.95 -0.64 115.31 119.12 1wdy h LEU 172 Ca 0.36 -0.16 -0.05 0.00 0.84 0.00 0.00 57.88 58.87 1wdy h LEU 172 Cb 0.41 -0.23 -0.02 0.00 0.37 0.00 0.00 40.66 41.19 1wdy h LEU 172 CO -0.14 0.80 0.14 0.24 -0.34 0.00 0.00 178.44 179.14 1wdy h MET 173 N 0.90 0.79 -0.44 1.25 2.86 -1.72 -1.27 114.93 117.31 1wdy h MET 173 Ca 0.22 -0.15 -0.06 0.00 -2.06 0.00 0.00 59.70 57.64 1wdy h MET 173 Cb 0.19 -0.13 -0.02 0.00 0.06 0.00 0.00 31.60 31.70 1wdy h MET 173 CO -0.02 0.71 0.02 -0.44 1.06 0.00 0.00 176.91 178.24 1wdy h ASP 174 N 0.77 0.74 -0.74 1.22 3.32 -0.79 -0.47 116.42 120.47 1wdy h ASP 174 Ca 0.17 -0.29 -0.03 0.00 0.02 0.00 0.00 57.03 56.90 1wdy h ASP 174 Cb 0.26 -0.20 -0.03 0.00 0.22 0.00 0.00 39.33 39.58 1wdy h ASP 174 CO -0.00 0.85 0.35 0.00 -1.72 0.00 0.00 179.24 178.71 1wdy h ALA 175 N 0.92 1.20 -0.17 3.45 0.00 -0.82 -1.14 119.26 122.69 1wdy h ALA 175 Ca 0.13 -0.16 -0.04 0.00 0.00 0.00 0.00 54.91 54.84 1wdy h ALA 175 Cb 0.46 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 1wdy h ALA 175 CO 0.02 0.61 -0.05 0.00 0.00 0.00 0.00 179.25 179.82 1wdy h ALA 176 N 1.31 0.24 -0.59 0.00 0.00 -0.99 -1.00 119.26 118.22 1wdy h ALA 176 Ca 0.26 -0.25 -0.01 0.00 0.00 0.00 0.00 54.91 54.91 1wdy h ALA 176 Cb 0.13 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 17.83 1wdy h ALA 176 CO -0.03 0.01 0.32 1.49 0.00 0.00 0.00 179.25 181.04 1wdy h GLU 177 N 0.04 0.83 -0.01 0.00 4.81 -0.96 -2.95 114.58 116.33 1wdy h GLU 177 Ca 0.04 -0.10 0.00 0.00 -0.13 0.00 0.00 59.36 59.17 1wdy h GLU 177 Cb 0.49 -0.16 0.00 0.00 0.63 0.00 0.00 28.75 29.71 1wdy h GLU 177 CO 0.02 0.64 -0.12 1.63 -0.73 0.00 0.00 179.01 180.45 1wdy n LYS 178 N -4.57 1.20 -1.88 1.92 4.76 -0.44 -4.58 118.16 114.56 1wdy n LYS 178 Ca 0.04 -0.67 -0.05 0.00 -2.87 0.00 0.00 58.31 54.77 1wdy n LYS 178 Cb 0.09 -1.49 -0.01 0.00 -1.84 0.00 0.00 35.03 31.79 1wdy n LYS 178 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1wdy n GLY 179 N 1.25 0.30 3.46 0.72 0.00 -0.49 -4.97 105.19 105.45 1wdy n GLY 179 Ca 0.16 -0.73 -0.43 0.00 0.00 0.00 0.00 46.02 45.01 1wdy n GLY 179 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1wdy s HIS 180 N -2.22 2.99 0.09 1.61 3.76 -0.54 -4.83 115.29 116.15 1wdy s HIS 180 Ca 0.00 -1.18 -0.19 0.00 -0.15 0.00 0.00 55.06 53.54 1wdy s HIS 180 Cb 0.00 -4.31 -0.08 0.00 1.11 0.00 0.00 32.58 29.30 1wdy s HIS 180 CO 0.00 -1.55 1.58 0.28 -0.85 0.00 0.00 174.74 174.20 1wdy h VAL 181 N 5.93 1.21 -0.55 -0.90 2.07 -1.93 -1.49 116.25 120.59 1wdy h VAL 181 Ca 0.06 -0.70 -0.01 0.00 0.82 0.00 0.00 66.70 66.87 1wdy h VAL 181 Cb 1.03 1.24 -0.03 0.00 -1.52 0.00 0.00 31.29 32.01 1wdy h VAL 181 CO 1.14 0.22 0.30 -0.08 0.02 0.00 0.00 177.57 179.18 1wdy h GLU 182 N 0.19 0.76 -0.42 1.57 4.57 -1.99 -0.79 114.58 118.47 1wdy h GLU 182 Ca 0.07 -0.09 0.03 0.00 -1.18 0.00 0.00 59.36 58.20 1wdy h GLU 182 Cb 0.29 -0.15 -0.03 0.00 -0.16 0.00 0.00 28.75 28.69 1wdy h GLU 182 CO 0.00 0.58 0.22 0.28 -1.18 0.00 0.00 179.01 178.91 1wdy h VAL 183 N 0.74 0.98 -0.51 0.32 2.07 -1.92 -0.89 116.25 117.04 1wdy h VAL 183 Ca 0.19 -0.15 0.02 0.00 0.82 0.00 0.00 66.70 67.58 1wdy h VAL 183 Cb 0.04 0.51 -0.03 0.00 -1.52 0.00 0.00 31.29 30.29 1wdy h VAL 183 CO -0.03 0.08 0.32 0.25 0.02 0.00 0.00 177.57 178.20 1wdy h LEU 184 N 0.43 0.52 -0.70 2.57 5.85 -0.73 0.36 115.31 123.62 1wdy h LEU 184 Ca 0.18 -0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.89 1wdy h LEU 184 Cb 0.08 -0.11 -0.03 0.00 0.37 0.00 0.00 40.66 40.96 1wdy h LEU 184 CO -0.12 0.37 0.40 0.11 -0.34 0.00 0.00 178.44 178.86 1wdy h LYS 185 N 0.64 0.96 -0.41 1.25 1.57 -0.76 -1.38 116.57 118.44 1wdy h LYS 185 Ca 0.20 -0.10 -0.05 0.00 -1.87 0.00 0.00 60.65 58.83 1wdy h LYS 185 Cb -0.01 -0.19 -0.02 0.00 0.08 0.00 0.00 32.23 32.10 1wdy h LYS 185 CO -0.08 0.71 0.05 0.82 -0.57 0.00 0.00 179.45 180.38 1wdy h ILE 186 N 0.95 1.25 -0.51 1.86 2.04 -0.60 -0.04 117.51 122.46 1wdy h ILE 186 Ca 0.25 -0.91 0.02 0.00 1.00 0.00 0.00 64.86 65.21 1wdy h ILE 186 Cb 0.01 1.05 -0.03 0.00 -0.74 0.00 0.00 36.82 37.11 1wdy h ILE 186 CO -0.04 0.31 0.31 -0.07 0.00 0.00 0.00 178.15 178.66 1wdy h LEU 187 N 0.53 0.51 0.11 1.44 3.38 -0.59 -0.80 115.31 119.89 1wdy h LEU 187 Ca 0.12 0.00 -0.28 0.00 0.09 0.00 0.00 57.88 57.81 1wdy h LEU 187 Cb 0.40 -0.11 0.03 0.00 0.09 0.00 0.00 40.66 41.07 1wdy h LEU 187 CO 0.01 0.36 -1.16 -0.07 0.09 0.00 0.00 178.44 177.68 1wdy h LEU 188 N 0.63 0.83 0.00 1.67 3.38 -1.12 -1.57 115.31 119.12 1wdy h LEU 188 Ca 0.20 -0.83 -0.20 0.00 0.09 0.00 0.00 57.88 57.15 1wdy h LEU 188 Cb -0.00 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 40.45 1wdy h LEU 188 CO -0.08 1.57 -1.54 0.47 0.09 0.00 0.00 178.44 178.95 1wdy n ASP 189 N -3.86 0.79 -0.00 -0.43 8.00 -0.04 -4.37 116.55 116.65 1wdy n ASP 189 Ca -0.13 0.35 -0.00 0.00 0.71 0.00 0.00 54.79 55.72 1wdy n ASP 189 Cb 0.95 0.21 -0.00 0.00 -0.02 0.00 0.00 41.12 42.26 1wdy n ASP 189 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1wdy n GLU 190 N -2.89 3.43 -0.05 -1.24 1.02 -0.35 -4.82 120.64 115.74 1wdy n GLU 190 Ca -0.12 -0.00 0.03 0.00 -0.02 0.00 0.00 57.16 57.05 1wdy n GLU 190 Cb 0.89 -1.01 0.06 0.00 -0.02 0.00 0.00 31.44 31.35 1wdy n GLU 190 CO 0.00 0.00 0.00 -1.33 1.18 0.00 0.00 177.13 176.98 1wdy n MET 191 N -1.95 1.28 -2.21 3.49 2.81 -0.92 -5.00 117.12 114.61 1wdy n MET 191 Ca -0.01 -1.32 -0.10 0.00 -1.81 0.00 0.00 57.70 54.47 1wdy n MET 191 Cb 0.45 -1.14 -0.00 0.00 -0.71 0.00 0.00 33.22 31.81 1wdy n MET 191 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1wdy n GLY 192 N 0.26 -0.02 3.77 3.03 0.00 -1.07 -4.86 105.19 106.30 1wdy n GLY 192 Ca 0.05 -0.48 -0.41 0.00 0.00 0.00 0.00 46.02 45.19 1wdy n GLY 192 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wdy s ALA 193 N -2.50 3.47 -0.47 4.61 0.00 -0.61 -4.92 121.76 121.34 1wdy s ALA 193 Ca 0.01 1.31 -0.26 0.00 0.00 0.00 0.00 51.96 53.02 1wdy s ALA 193 Cb -0.00 -3.50 0.03 0.00 0.00 0.00 0.00 23.12 19.64 1wdy s ALA 193 CO 0.01 -0.73 0.94 0.34 0.00 0.00 0.00 175.76 176.32 1wdy s ASP 194 N -0.47 6.50 0.51 0.00 2.15 -1.26 -4.78 116.67 119.32 1wdy s ASP 194 Ca 0.51 0.11 0.20 0.00 0.43 0.00 0.00 52.55 53.80 1wdy s ASP 194 Cb -0.41 -2.46 1.32 0.00 -0.30 0.00 0.00 42.92 41.08 1wdy s ASP 194 CO 0.54 -1.08 2.11 1.62 -0.17 0.00 0.00 175.17 178.19 1wdy h VAL 195 N 6.09 0.89 -0.32 1.11 3.04 -1.92 -3.15 116.25 122.00 1wdy h VAL 195 Ca -0.24 -0.27 0.00 0.00 -1.01 0.00 0.00 66.70 65.18 1wdy h VAL 195 Cb 1.07 1.15 0.00 0.00 -2.01 0.00 0.00 31.29 31.50 1wdy h VAL 195 CO 1.04 0.07 0.00 0.59 -1.01 0.00 0.00 177.57 178.26 1wdy n ASN 196 N -4.22 3.50 -4.66 3.17 3.02 -1.26 -4.22 115.26 110.59 1wdy n ASN 196 Ca -0.03 -2.52 -0.39 0.00 -0.03 0.00 0.00 54.58 51.61 1wdy n ASN 196 Cb 0.16 -0.40 0.03 0.00 -0.61 0.00 0.00 39.78 38.96 1wdy n ASN 196 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1wdy n ALA 197 N 0.04 0.73 -2.44 5.41 0.00 -1.19 -4.96 120.51 118.10 1wdy n ALA 197 Ca 0.17 0.13 -0.27 0.00 0.00 0.00 0.00 53.44 53.47 1wdy n ALA 197 Cb 0.68 -2.19 -0.14 0.00 0.00 0.00 0.00 19.45 17.80 1wdy n ALA 197 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1wdy n ASP 199 N 1.76 -0.29 0.20 0.00 5.68 0.11 -4.82 116.55 119.18 1wdy n ASP 199 Ca -0.17 -1.18 0.14 0.00 -0.50 0.00 0.00 54.79 53.08 1wdy n ASP 199 Cb 0.53 -0.55 0.59 0.00 -1.14 0.00 0.00 41.12 40.54 1wdy n ASP 199 CO 0.00 0.00 0.00 0.78 -1.33 0.00 0.00 177.20 176.65 1wdy h ASN 200 N -1.16 0.00 0.53 -1.12 2.35 -1.41 -1.72 115.58 113.04 1wdy h ASN 200 Ca -0.23 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.52 1wdy h ASN 200 Cb 0.66 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.03 1wdy h ASN 200 CO 0.16 0.00 -0.27 0.23 -1.65 0.00 0.00 177.43 175.91 1wdy n MET 201 N -2.63 0.29 -0.39 0.81 2.81 -1.11 -4.85 117.12 112.06 1wdy n MET 201 Ca 0.01 -0.13 0.00 0.00 -1.81 0.00 0.00 57.70 55.77 1wdy n MET 201 Cb 0.26 -1.50 0.00 0.00 -0.71 0.00 0.00 33.22 31.27 1wdy n MET 201 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1wdy n GLY 202 N 1.42 0.79 3.78 3.03 0.00 -0.65 -4.86 105.19 108.71 1wdy n GLY 202 Ca 0.09 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.72 1wdy n GLY 202 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1wdy s ARG 203 N -0.61 4.31 0.31 1.61 0.52 -1.26 -4.34 118.95 119.49 1wdy s ARG 203 Ca 0.00 0.80 0.04 0.00 -0.52 0.00 0.00 55.73 56.05 1wdy s ARG 203 Cb 0.00 -3.29 0.04 0.00 0.52 0.00 0.00 34.95 32.22 1wdy s ARG 203 CO 0.00 0.50 0.30 0.27 0.02 0.00 0.00 175.30 176.39 1wdy n ASN 204 N 2.18 1.73 0.08 0.23 0.23 -1.26 -0.72 115.26 117.74 1wdy n ASN 204 Ca -0.08 -2.00 0.02 0.00 -0.53 0.00 0.00 54.58 51.99 1wdy n ASN 204 Cb 0.51 -0.09 0.38 0.00 -2.08 0.00 0.00 39.78 38.49 1wdy n ASN 204 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1wdy h ALA 205 N 0.58 1.50 -0.24 -2.53 0.00 -1.73 -2.11 119.26 114.72 1wdy h ALA 205 Ca -0.18 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.54 1wdy h ALA 205 Cb 0.71 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.38 1wdy h ALA 205 CO 0.28 0.36 0.15 1.25 0.00 0.00 0.00 179.25 181.29 1wdy h LEU 206 N 0.32 0.29 -0.19 0.00 5.85 -1.92 -0.08 115.31 119.57 1wdy h LEU 206 Ca 0.07 -0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.76 1wdy h LEU 206 Cb 0.32 -0.07 -0.01 0.00 0.37 0.00 0.00 40.66 41.26 1wdy h LEU 206 CO 0.01 0.23 0.12 0.40 -0.34 0.00 0.00 178.44 178.87 1wdy h ILE 207 N 0.31 1.04 -0.48 4.05 1.08 -1.82 -2.52 117.51 119.18 1wdy h ILE 207 Ca 0.09 -0.09 -0.02 0.00 -0.39 0.00 0.00 64.86 64.46 1wdy h ILE 207 Cb -0.01 0.77 -0.02 0.00 -3.07 0.00 0.00 36.82 34.49 1wdy h ILE 207 CO -0.02 0.05 0.22 0.45 -0.69 0.00 0.00 178.15 178.16 1wdy h HIS 208 N 0.25 0.65 -0.61 1.37 3.86 -1.11 -1.28 115.15 118.27 1wdy h HIS 208 Ca 0.07 -0.02 -0.05 0.00 -1.16 0.00 0.00 60.37 59.21 1wdy h HIS 208 Cb -0.03 -0.21 -0.03 0.00 1.06 0.00 0.00 27.41 28.21 1wdy h HIS 208 CO -0.07 0.49 0.17 0.00 0.86 0.00 0.00 177.93 179.38 1wdy h ALA 209 N 1.58 0.80 0.00 2.45 0.00 -0.76 -2.83 119.26 120.51 1wdy h ALA 209 Ca 0.17 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.86 1wdy h ALA 209 Cb 0.08 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 17.63 1wdy h ALA 209 CO -0.02 0.49 -0.10 1.28 0.00 0.00 0.00 179.25 180.90 1wdy n LEU 210 N -4.36 0.40 0.13 0.00 4.77 -0.80 -2.83 117.00 114.30 1wdy n LEU 210 Ca 0.03 0.45 0.12 0.00 -0.03 0.00 0.00 56.01 56.59 1wdy n LEU 210 Cb 0.23 -0.38 0.13 0.00 -2.33 0.00 0.00 43.42 41.07 1wdy n LEU 210 CO 0.41 -0.06 0.43 -0.07 -1.33 0.00 0.00 177.39 176.77 1wdy h LEU 211 N 0.00 0.00 -9.89 2.23 3.38 -1.03 -3.47 115.31 106.53 1wdy h LEU 211 Ca 0.00 -0.05 -0.56 0.00 0.09 0.00 0.00 57.88 57.37 1wdy h LEU 211 Cb 0.60 0.00 0.18 0.00 0.09 0.00 0.00 40.66 41.53 1wdy h LEU 211 CO 0.00 0.02 0.05 -1.54 0.09 0.00 0.00 178.44 177.06 1wdy n SER 212 N -2.64 0.36 -0.09 -0.43 3.41 -1.09 -4.93 113.62 108.20 1wdy n SER 212 Ca 0.03 0.69 0.11 0.00 -0.26 0.00 0.00 58.87 59.44 1wdy n SER 212 Cb 0.51 -1.38 0.14 0.00 -0.26 0.00 0.00 64.21 63.22 1wdy n SER 212 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 1wdy n SER 213 N -1.32 0.87 -4.49 4.04 2.88 -1.26 -4.81 113.62 109.53 1wdy n SER 213 Ca 0.13 -0.69 -0.40 0.00 -1.33 0.00 0.00 58.87 56.58 1wdy n SER 213 Cb 0.49 0.47 -0.11 0.00 -0.75 0.00 0.00 64.21 64.31 1wdy n SER 213 CO 0.00 0.00 0.00 -1.81 -1.23 0.00 0.00 175.04 172.00 1wdy s ASP 214 N -2.87 5.94 0.00 -3.46 1.01 -1.26 -4.96 116.67 111.07 1wdy s ASP 214 Ca 0.13 -0.54 0.22 0.00 0.71 0.00 0.00 52.55 53.07 1wdy s ASP 214 Cb 0.17 -2.11 1.20 0.00 1.01 0.00 0.00 42.92 43.20 1wdy s ASP 214 CO 0.71 -0.26 1.69 0.47 0.21 0.00 0.00 175.17 177.98 1wdy n ASP 215 N 5.08 0.00 0.14 0.27 8.00 -1.26 -3.92 116.55 124.86 1wdy n ASP 215 Ca -0.13 -0.36 -0.14 0.00 0.71 0.00 0.00 54.79 54.87 1wdy n ASP 215 Cb 0.49 -0.14 -0.08 0.00 -0.02 0.00 0.00 41.12 41.37 1wdy n ASP 215 CO 0.00 0.00 0.00 0.28 -0.39 0.00 0.00 177.20 177.09 1wdy h SER 216 N 0.00 -0.24 -0.00 -2.24 0.02 -2.00 -3.38 113.55 105.71 1wdy h SER 216 Ca 0.00 -0.04 0.00 0.00 -0.84 0.00 0.00 61.79 60.91 1wdy h SER 216 Cb 0.10 0.06 0.00 0.00 0.14 0.00 0.00 62.40 62.70 1wdy h SER 216 CO 0.00 -0.11 -0.25 0.47 -1.14 0.00 0.00 176.83 175.79 1wdy n ASP 217 N -5.18 0.90 -0.32 3.07 8.00 -1.25 -4.75 116.55 117.01 1wdy n ASP 217 Ca -0.09 -0.95 0.14 0.00 0.71 0.00 0.00 54.79 54.60 1wdy n ASP 217 Cb 0.15 0.64 0.37 0.00 -0.02 0.00 0.00 41.12 42.26 1wdy n ASP 217 CO 0.00 0.00 0.00 1.62 -0.39 0.00 0.00 177.20 178.43 1wdy h VAL 218 N 0.67 0.74 0.11 2.53 3.04 -1.75 -2.01 116.25 119.58 1wdy h VAL 218 Ca 0.00 -0.24 -0.01 0.00 -1.01 0.00 0.00 66.70 65.45 1wdy h VAL 218 Cb 0.27 -0.02 0.00 0.00 -2.01 0.00 0.00 31.29 29.53 1wdy h VAL 218 CO 0.00 0.13 -0.05 -0.08 -1.01 0.00 0.00 177.57 176.56 1wdy h GLU 219 N 0.70 -0.14 -0.75 4.17 4.81 -1.87 -1.40 114.58 120.10 1wdy h GLU 219 Ca 0.53 0.01 -0.00 0.00 -0.13 0.00 0.00 59.36 59.77 1wdy h GLU 219 Cb 0.90 0.03 -0.04 0.00 0.63 0.00 0.00 28.75 30.27 1wdy h GLU 219 CO -0.29 0.09 0.46 0.00 -0.73 0.00 0.00 179.01 178.54 1wdy h ALA 220 N 0.50 0.95 -0.13 2.92 0.00 -1.76 -2.04 119.26 119.70 1wdy h ALA 220 Ca -0.01 -0.08 -0.03 0.00 0.00 0.00 0.00 54.91 54.79 1wdy h ALA 220 Cb 0.30 -0.30 -0.00 0.00 0.00 0.00 0.00 17.79 17.78 1wdy h ALA 220 CO 0.02 0.41 -0.02 0.82 0.00 0.00 0.00 179.25 180.48 1wdy h ILE 221 N 1.02 1.28 -0.60 0.00 2.04 -1.35 -1.78 117.51 118.11 1wdy h ILE 221 Ca 0.27 -0.92 0.01 0.00 1.00 0.00 0.00 64.86 65.22 1wdy h ILE 221 Cb -0.06 1.62 -0.03 0.00 -0.74 0.00 0.00 36.82 37.61 1wdy h ILE 221 CO -0.05 0.27 0.39 0.74 0.00 0.00 0.00 178.15 179.50 1wdy h THR 222 N -0.05 1.14 -0.87 -0.27 2.02 -1.18 -1.11 112.91 112.60 1wdy h THR 222 Ca 0.04 -0.27 0.01 0.00 0.77 0.00 0.00 66.41 66.95 1wdy h THR 222 Cb 0.42 0.27 -0.04 0.00 -1.74 0.00 0.00 68.15 67.06 1wdy h THR 222 CO 0.01 0.15 0.57 0.45 0.37 0.00 0.00 175.52 177.07 1wdy h HIS 223 N 0.80 1.09 -0.45 3.16 3.86 -1.28 -1.04 115.15 121.29 1wdy h HIS 223 Ca 0.23 0.03 -0.05 0.00 -1.16 0.00 0.00 60.37 59.41 1wdy h HIS 223 Cb -0.07 -0.37 -0.02 0.00 1.06 0.00 0.00 27.41 28.01 1wdy h HIS 223 CO -0.04 0.68 0.09 -0.07 0.86 0.00 0.00 177.93 179.45 1wdy h LEU 224 N 1.17 0.70 -0.39 2.43 3.38 -0.71 -1.20 115.31 120.69 1wdy h LEU 224 Ca 0.32 -0.25 -0.03 0.00 0.09 0.00 0.00 57.88 58.01 1wdy h LEU 224 Cb -0.13 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.42 1wdy h LEU 224 CO -0.07 0.77 0.13 -0.07 0.09 0.00 0.00 178.44 179.28 1wdy h LEU 225 N 0.60 0.56 -1.16 1.67 3.38 -0.91 -2.63 115.31 116.83 1wdy h LEU 225 Ca 0.14 -0.20 -0.05 0.00 0.09 0.00 0.00 57.88 57.86 1wdy h LEU 225 Cb 0.36 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 40.94 1wdy h LEU 225 CO 0.01 0.61 0.02 -0.07 0.09 0.00 0.00 178.44 179.09 1wdy h LEU 226 N 0.48 0.57 -1.29 1.67 3.38 -1.06 -1.59 115.31 117.47 1wdy h LEU 226 Ca 0.13 -0.11 0.06 0.00 0.09 0.00 0.00 57.88 58.05 1wdy h LEU 226 Cb 0.24 -0.15 -0.05 0.00 0.09 0.00 0.00 40.66 40.79 1wdy h LEU 226 CO -0.01 0.63 0.52 0.44 0.09 0.00 0.00 178.44 180.11 1wdy h ASP 227 N 0.58 0.76 -0.42 -0.43 3.32 -0.97 -1.89 116.42 117.37 1wdy h ASP 227 Ca 0.12 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.18 1wdy h ASP 227 Cb 0.34 -0.16 0.00 0.00 0.22 0.00 0.00 39.33 39.73 1wdy h ASP 227 CO 0.01 0.49 0.00 1.41 -1.72 0.00 0.00 179.24 179.43 1wdy n HIS 228 N -4.48 0.81 -1.32 4.55 8.25 -0.67 -4.92 115.22 117.44 1wdy n HIS 228 Ca 0.11 -0.35 0.00 0.00 -0.26 0.00 0.00 57.72 57.23 1wdy n HIS 228 Cb 0.20 -0.11 0.00 0.00 1.12 0.00 0.00 29.99 31.20 1wdy n HIS 228 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1wdy n GLY 229 N 0.96 0.94 3.78 -1.41 0.00 -0.71 -4.88 105.19 103.87 1wdy n GLY 229 Ca 0.16 -0.57 -0.41 0.00 0.00 0.00 0.00 46.02 45.20 1wdy n GLY 229 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wdy s ALA 230 N -2.04 3.58 -0.19 4.61 0.00 -0.79 -4.90 121.76 122.03 1wdy s ALA 230 Ca 0.00 1.58 -0.26 0.00 0.00 0.00 0.00 51.96 53.29 1wdy s ALA 230 Cb 0.00 -3.61 -0.01 0.00 0.00 0.00 0.00 23.12 19.50 1wdy s ALA 230 CO 0.00 -1.07 0.85 0.34 0.00 0.00 0.00 175.76 175.89 1wdy s ASP 231 N -0.13 6.95 0.32 0.00 -1.08 -1.26 -4.83 116.67 116.64 1wdy s ASP 231 Ca 0.53 1.17 0.22 0.00 -0.52 0.00 0.00 52.55 53.95 1wdy s ASP 231 Cb -0.47 -2.46 0.17 0.00 -1.46 0.00 0.00 42.92 38.71 1wdy s ASP 231 CO 0.63 -0.45 1.34 -0.37 0.52 0.00 0.00 175.17 176.84 1wdy h VAL 232 N 5.27 0.03 -2.05 1.11 -1.51 -1.97 -3.40 116.25 113.73 1wdy h VAL 232 Ca -0.27 -1.05 -0.76 0.00 -1.23 0.00 0.00 66.70 63.38 1wdy h VAL 232 Cb 1.12 1.79 -0.19 0.00 -2.13 0.00 0.00 31.29 31.88 1wdy h VAL 232 CO 0.86 0.02 1.49 0.59 -1.23 0.00 0.00 177.57 179.30 1wdy n ASN 233 N -2.91 5.40 -4.16 4.19 3.02 -1.26 -4.36 115.26 115.17 1wdy n ASN 233 Ca 0.02 -3.12 -0.10 0.00 -0.03 0.00 0.00 54.58 51.35 1wdy n ASN 233 Cb 0.55 -1.46 -0.10 0.00 -0.61 0.00 0.00 39.78 38.16 1wdy n ASN 233 CO 0.00 0.00 0.00 0.68 -2.62 0.00 0.00 177.26 175.32 1wdy s VAL 234 N -0.01 0.36 -0.01 2.41 -7.23 -1.26 -5.13 120.40 109.52 1wdy s VAL 234 Ca 0.38 -1.91 0.05 0.00 -1.81 0.00 0.00 61.98 58.70 1wdy s VAL 234 Cb 0.04 -1.88 -0.01 0.00 0.56 0.00 0.00 36.38 35.08 1wdy s VAL 234 CO 0.01 -0.66 -0.18 -0.13 -0.31 0.00 0.00 175.10 173.83 1wdy s ARG 235 N -3.95 1.46 0.00 4.82 1.81 -1.26 -4.21 118.95 117.62 1wdy s ARG 235 Ca 0.18 -0.64 0.00 0.00 -1.72 0.00 0.00 55.73 53.55 1wdy s ARG 235 Cb 0.07 -1.41 0.00 0.00 -0.45 0.00 0.00 34.95 33.16 1wdy s ARG 235 CO -0.02 0.38 0.00 0.41 -0.68 0.00 0.00 175.30 175.40 1wdy n GLY 236 N 2.65 1.30 0.00 -3.53 0.00 0.44 -4.04 105.19 102.01 1wdy n GLY 236 Ca -0.15 -1.97 0.00 0.00 0.00 0.00 0.00 46.02 43.90 1wdy n GLY 236 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1wdy n GLU 237 N -0.30 0.00 -1.12 1.61 1.02 -1.26 -3.05 120.64 117.54 1wdy n GLU 237 Ca 0.00 0.32 -0.16 0.00 -0.02 0.00 0.00 57.16 57.30 1wdy n GLU 237 Cb 0.00 -0.95 -0.14 0.00 -0.02 0.00 0.00 31.44 30.33 1wdy n GLU 237 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 1wdy n ARG 238 N -0.77 2.09 -1.03 3.49 1.74 -1.26 -4.72 116.66 116.20 1wdy n ARG 238 Ca 0.00 -1.33 -0.01 0.00 -0.77 0.00 0.00 57.85 55.74 1wdy n ARG 238 Cb 0.00 -2.02 -0.00 0.00 -1.02 0.00 0.00 32.46 29.41 1wdy n ARG 238 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1wdy n GLY 239 N 2.07 0.34 3.73 -0.13 0.00 -1.17 -1.17 105.19 108.86 1wdy n GLY 239 Ca 0.44 -0.05 -0.41 0.00 0.00 0.00 0.00 46.02 45.99 1wdy n GLY 239 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1wdy s LYS 240 N -1.25 4.50 0.28 1.61 -0.14 -1.26 -4.12 119.74 119.38 1wdy s LYS 240 Ca 0.00 1.76 0.06 0.00 -1.36 0.00 0.00 55.97 56.43 1wdy s LYS 240 Cb 0.00 -3.31 -0.03 0.00 -1.68 0.00 0.00 37.83 32.82 1wdy s LYS 240 CO 0.00 -0.11 0.34 0.95 -0.76 0.00 0.00 175.35 175.77 1wdy s THR 241 N 0.41 4.45 0.30 2.17 -4.23 -1.26 -0.42 115.64 117.06 1wdy s THR 241 Ca 0.54 -1.16 0.05 0.00 -1.18 0.00 0.00 61.69 59.95 1wdy s THR 241 Cb -0.30 -3.51 0.29 0.00 1.34 0.00 0.00 72.50 70.32 1wdy s THR 241 CO 0.32 -0.26 1.73 -0.65 -0.54 0.00 0.00 174.62 175.22 1wdy h PRO 242 N 1.19 0.55 -0.23 3.99 0.11 -1.76 -0.49 132.00 135.36 1wdy h PRO 242 Ca -0.48 -0.03 -0.03 0.00 0.11 0.00 0.00 66.00 65.57 1wdy h PRO 242 Cb 1.24 -0.12 -0.01 0.00 0.11 0.00 0.00 31.00 32.22 1wdy h PRO 242 CO 0.58 0.36 0.04 1.25 -0.21 0.00 0.00 178.00 180.03 1wdy h LEU 243 N 0.56 0.36 -0.77 2.35 5.85 -1.94 -0.61 115.31 121.10 1wdy h LEU 243 Ca 0.58 -0.25 -0.02 0.00 0.84 0.00 0.00 57.88 59.03 1wdy h LEU 243 Cb 1.03 -0.09 -0.04 0.00 0.37 0.00 0.00 40.66 41.93 1wdy h LEU 243 CO -0.46 0.52 0.42 0.40 -0.34 0.00 0.00 178.44 178.97 1wdy h ILE 244 N 0.18 1.23 -0.66 4.05 2.04 -1.82 -1.66 117.51 120.88 1wdy h ILE 244 Ca 0.07 -0.60 -0.05 0.00 1.00 0.00 0.00 64.86 65.29 1wdy h ILE 244 Cb 0.31 0.22 -0.03 0.00 -0.74 0.00 0.00 36.82 36.58 1wdy h ILE 244 CO 0.00 0.26 0.23 -0.07 0.00 0.00 0.00 178.15 178.57 1wdy h LEU 245 N 1.07 0.92 -0.63 1.44 3.38 -0.86 -0.79 115.31 119.84 1wdy h LEU 245 Ca 0.27 -0.15 -0.11 0.00 0.09 0.00 0.00 57.88 57.98 1wdy h LEU 245 Cb 0.05 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.54 1wdy h LEU 245 CO -0.04 0.85 -0.12 0.00 0.09 0.00 0.00 178.44 179.21 1wdy h ALA 246 N 1.28 0.83 -0.65 1.53 0.00 -0.88 -1.94 119.26 119.43 1wdy h ALA 246 Ca 0.22 -0.35 -0.07 0.00 0.00 0.00 0.00 54.91 54.72 1wdy h ALA 246 Cb 0.24 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.82 1wdy h ALA 246 CO -0.01 0.65 0.15 0.28 0.00 0.00 0.00 179.25 180.32 1wdy h VAL 247 N 0.85 1.26 0.00 0.00 2.07 -0.97 -2.18 116.25 117.27 1wdy h VAL 247 Ca 0.13 -0.95 -0.05 0.00 0.82 0.00 0.00 66.70 66.65 1wdy h VAL 247 Cb 0.67 0.63 -0.01 0.00 -1.52 0.00 0.00 31.29 31.06 1wdy h VAL 247 CO 0.05 0.36 -0.23 -0.33 0.02 0.00 0.00 177.57 177.44 1wdy h GLU 248 N 0.96 0.00 -0.01 1.57 5.08 -0.83 -1.01 114.58 120.34 1wdy h GLU 248 Ca 0.20 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.56 1wdy h GLU 248 Cb 0.37 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.62 1wdy h GLU 248 CO 0.00 0.23 -0.11 1.63 -1.00 0.00 0.00 179.01 179.76 1wdy n LYS 249 N -4.11 0.97 -2.84 2.33 5.02 -0.76 -4.95 118.16 113.82 1wdy n LYS 249 Ca -0.02 -0.44 -0.20 0.00 -2.02 0.00 0.00 58.31 55.63 1wdy n LYS 249 Cb 0.30 -1.49 0.03 0.00 -0.02 0.00 0.00 35.03 33.84 1wdy n LYS 249 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1wdy n LYS 250 N -0.63 -3.93 -3.42 1.97 5.02 -0.38 -4.95 118.16 111.83 1wdy n LYS 250 Ca 0.16 0.84 -0.44 0.00 -2.02 0.00 0.00 58.31 56.86 1wdy n LYS 250 Cb 0.30 -5.50 -0.07 0.00 -0.02 0.00 0.00 35.03 29.74 1wdy n LYS 250 CO 0.00 0.00 0.00 -1.58 -0.52 0.00 0.00 177.40 175.30 1wdy s HIS 251 N -3.09 3.33 0.19 2.13 2.46 -1.08 -4.94 115.29 114.29 1wdy s HIS 251 Ca 0.23 -1.53 -0.12 0.00 0.47 0.00 0.00 55.06 54.10 1wdy s HIS 251 Cb -0.10 -3.63 0.13 0.00 -0.13 0.00 0.00 32.58 28.85 1wdy s HIS 251 CO 0.28 -1.00 1.83 1.25 -2.47 0.00 0.00 174.74 174.63 1wdy h LEU 252 N 8.69 0.59 -0.85 8.88 5.85 -1.92 -2.05 115.31 134.49 1wdy h LEU 252 Ca -0.26 0.00 0.02 0.00 0.84 0.00 0.00 57.88 58.48 1wdy h LEU 252 Cb 1.09 -0.13 -0.05 0.00 0.37 0.00 0.00 40.66 41.95 1wdy h LEU 252 CO 0.95 0.42 0.56 1.23 -0.34 0.00 0.00 178.44 181.26 1wdy h GLY 253 N 0.72 1.22 1.13 3.75 0.00 -1.99 -0.47 103.07 107.43 1wdy h GLY 253 Ca 0.24 -0.43 -0.17 0.00 0.00 0.00 0.00 47.33 46.96 1wdy h GLY 253 CO -0.10 0.40 -0.43 1.41 0.00 0.00 0.00 176.54 177.83 1wdy h LEU 254 N 1.11 1.00 -1.05 3.11 3.38 -1.89 -2.11 115.31 118.86 1wdy h LEU 254 Ca 0.33 -0.48 -0.00 0.00 0.09 0.00 0.00 57.88 57.81 1wdy h LEU 254 Cb -0.07 -0.28 -0.04 0.00 0.09 0.00 0.00 40.66 40.36 1wdy h LEU 254 CO -0.09 1.28 0.54 0.58 0.09 0.00 0.00 178.44 180.85 1wdy h VAL 255 N 0.74 1.24 -0.47 1.22 2.07 -1.11 -1.20 116.25 118.74 1wdy h VAL 255 Ca 0.05 -0.51 -0.04 0.00 0.82 0.00 0.00 66.70 67.02 1wdy h VAL 255 Cb 1.03 -0.02 -0.02 0.00 -1.52 0.00 0.00 31.29 30.76 1wdy h VAL 255 CO 0.10 0.25 0.14 1.56 0.02 0.00 0.00 177.57 179.64 1wdy h GLN 256 N 1.22 0.74 -0.30 1.57 4.20 -0.83 -1.41 115.11 120.30 1wdy h GLN 256 Ca 0.32 -0.17 -0.12 0.00 0.06 0.00 0.00 58.65 58.74 1wdy h GLN 256 Cb -0.07 -0.10 -0.00 0.00 0.30 0.00 0.00 27.48 27.60 1wdy h GLN 256 CO -0.06 0.71 -0.30 -0.09 -0.67 0.00 0.00 178.83 178.42 1wdy h ARG 257 N 0.63 0.74 -0.79 1.46 1.12 -1.19 -2.44 114.38 113.92 1wdy h ARG 257 Ca 0.15 -0.39 0.03 0.00 -1.11 0.00 0.00 59.98 58.67 1wdy h ARG 257 Cb 0.29 0.01 -0.04 0.00 -0.01 0.00 0.00 29.97 30.22 1wdy h ARG 257 CO -0.00 1.01 0.52 -0.07 -3.11 0.00 0.00 179.97 178.31 1wdy h LEU 258 N 0.49 0.84 -0.63 3.80 3.38 -1.12 -2.03 115.31 120.03 1wdy h LEU 258 Ca 0.05 -0.01 -0.03 0.00 0.09 0.00 0.00 57.88 57.98 1wdy h LEU 258 Cb 0.87 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 41.42 1wdy h LEU 258 CO 0.07 0.58 -0.12 -0.07 0.09 0.00 0.00 178.44 178.99 1wdy h LEU 259 N 0.97 0.00 -0.48 1.67 3.38 -1.03 -2.59 115.31 117.22 1wdy h LEU 259 Ca 0.31 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.28 1wdy h LEU 259 Cb 0.04 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.79 1wdy h LEU 259 CO -0.09 0.12 0.00 -0.62 0.09 0.00 0.00 178.44 177.95 1wdy n GLU 260 N -3.18 0.19 -2.44 1.13 1.02 -0.77 -4.80 120.64 111.78 1wdy n GLU 260 Ca 0.02 0.35 -0.36 0.00 -0.02 0.00 0.00 57.16 57.15 1wdy n GLU 260 Cb 0.48 -1.82 -0.03 0.00 -0.02 0.00 0.00 31.44 30.05 1wdy n GLU 260 CO 0.00 0.00 0.00 -0.65 1.18 0.00 0.00 177.13 177.66 1wdy s GLN 261 N -3.24 4.00 -0.04 3.49 -1.52 -0.98 -4.99 119.66 116.39 1wdy s GLN 261 Ca 0.06 1.59 -0.25 0.00 -1.95 0.00 0.00 55.36 54.81 1wdy s GLN 261 Cb 0.10 -2.47 -0.21 0.00 -0.22 0.00 0.00 33.01 30.22 1wdy s GLN 261 CO 0.43 -0.30 1.14 0.93 -0.25 0.00 0.00 175.29 177.23 1wdy h GLU 262 N 2.28 0.12 -0.30 2.91 5.08 -1.88 -3.32 114.58 119.48 1wdy h GLU 262 Ca -0.49 -0.09 0.00 0.00 -1.00 0.00 0.00 59.36 57.78 1wdy h GLU 262 Cb 1.23 0.02 0.00 0.00 0.50 0.00 0.00 28.75 30.49 1wdy h GLU 262 CO 0.61 0.74 0.00 0.72 -1.00 0.00 0.00 179.01 180.08 1wdy n HIS 263 N -4.66 0.39 -1.97 4.33 8.25 -1.26 -4.96 115.22 115.34 1wdy n HIS 263 Ca -0.09 -0.20 -0.42 0.00 -0.26 0.00 0.00 57.72 56.76 1wdy n HIS 263 Cb 0.38 0.00 -0.02 0.00 1.12 0.00 0.00 29.99 31.47 1wdy n HIS 263 CO 0.00 0.00 0.00 -1.50 0.64 0.00 0.00 176.34 175.48 1wdy s ILE 264 N -1.61 2.62 -0.49 1.59 2.07 -1.25 -4.87 121.20 119.27 1wdy s ILE 264 Ca 0.25 0.49 -0.13 0.00 -1.41 0.00 0.00 60.65 59.86 1wdy s ILE 264 Cb 0.13 -3.32 0.11 0.00 0.13 0.00 0.00 42.46 39.52 1wdy s ILE 264 CO 0.18 0.06 0.40 -1.61 -1.91 0.00 0.00 174.94 172.06 1wdy s GLU 265 N 0.14 2.75 0.48 3.50 0.41 -1.26 -4.95 118.70 119.77 1wdy s GLU 265 Ca 0.63 -1.64 0.28 0.00 -0.41 0.00 0.00 54.97 53.83 1wdy s GLU 265 Cb -0.43 -4.07 0.94 0.00 -1.78 0.00 0.00 34.13 28.79 1wdy s GLU 265 CO 0.39 -1.19 1.83 -0.84 -0.49 0.00 0.00 175.26 174.96 1wdy h ILE 266 N 5.99 0.18 -0.29 -1.63 3.07 -1.97 -3.26 117.51 119.60 1wdy h ILE 266 Ca -0.26 -0.87 0.00 0.00 1.55 0.00 0.00 64.86 65.28 1wdy h ILE 266 Cb 1.09 1.74 0.00 0.00 -0.27 0.00 0.00 36.82 39.38 1wdy h ILE 266 CO 0.91 0.08 0.00 0.59 -1.05 0.00 0.00 178.15 178.68 1wdy n ASN 267 N -3.17 2.42 -4.77 2.16 3.02 -1.26 -4.36 115.26 109.30 1wdy n ASN 267 Ca 0.01 -1.85 -0.40 0.00 -0.03 0.00 0.00 54.58 52.31 1wdy n ASN 267 Cb 0.41 -0.19 0.01 0.00 -0.61 0.00 0.00 39.78 39.41 1wdy n ASN 267 CO 0.00 0.00 0.00 -1.81 -2.62 0.00 0.00 177.26 172.83 1wdy s ASP 268 N -1.46 6.00 0.00 6.41 1.01 -1.23 -4.90 116.67 122.50 1wdy s ASP 268 Ca 0.34 2.82 0.04 0.00 0.71 0.00 0.00 52.55 56.46 1wdy s ASP 268 Cb 0.19 -2.65 -0.03 0.00 1.01 0.00 0.00 42.92 41.44 1wdy s ASP 268 CO 0.27 -1.08 -0.11 0.42 0.21 0.00 0.00 175.17 174.88 1wdy s THR 269 N -1.23 3.32 0.25 -1.27 -4.23 -1.26 -4.23 115.64 106.99 1wdy s THR 269 Ca 0.60 -0.87 -0.04 0.00 -1.18 0.00 0.00 61.69 60.20 1wdy s THR 269 Cb -0.42 -2.41 0.06 0.00 1.34 0.00 0.00 72.50 71.08 1wdy s THR 269 CO 0.53 0.42 0.32 -0.90 -0.54 0.00 0.00 174.62 174.46 1wdy n ASP 270 N 1.70 -0.13 0.25 3.99 5.68 -0.46 -4.86 116.55 122.72 1wdy n ASP 270 Ca -0.16 -1.06 0.16 0.00 -0.50 0.00 0.00 54.79 53.23 1wdy n ASP 270 Cb 0.52 -0.25 0.66 0.00 -1.14 0.00 0.00 41.12 40.91 1wdy n ASP 270 CO 0.00 0.00 0.00 0.77 -1.33 0.00 0.00 177.20 176.64 1wdy h SER 271 N -0.56 0.00 0.22 -1.12 4.64 -1.41 -1.22 113.55 114.10 1wdy h SER 271 Ca -0.11 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.21 1wdy h SER 271 Cb 0.30 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.39 1wdy h SER 271 CO 0.07 0.00 -0.11 0.47 -0.87 0.00 0.00 176.83 176.39 1wdy n ASP 272 N -2.93 0.77 0.00 4.97 8.00 -1.26 -4.93 116.55 121.17 1wdy n ASP 272 Ca 0.01 -0.89 0.00 0.00 0.71 0.00 0.00 54.79 54.62 1wdy n ASP 272 Cb 0.29 -0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.39 1wdy n ASP 272 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1wdy n GLY 273 N 1.24 0.65 3.81 0.44 0.00 -0.46 -5.05 105.19 105.82 1wdy n GLY 273 Ca 0.16 -0.14 -0.37 0.00 0.00 0.00 0.00 46.02 45.67 1wdy n GLY 273 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1wdy s LYS 274 N -0.52 3.89 0.61 1.61 1.02 -1.26 -4.79 119.74 120.30 1wdy s LYS 274 Ca 0.00 0.08 -0.03 0.00 0.02 0.00 0.00 55.97 56.04 1wdy s LYS 274 Cb 0.00 -3.29 0.04 0.00 -0.52 0.00 0.00 37.83 34.06 1wdy s LYS 274 CO 0.00 0.55 0.88 0.95 -0.92 0.00 0.00 175.35 176.80 1wdy s THR 275 N -0.46 2.77 0.22 2.17 -4.23 -1.26 -1.36 115.64 113.50 1wdy s THR 275 Ca 0.17 -0.40 -0.07 0.00 -1.18 0.00 0.00 61.69 60.21 1wdy s THR 275 Cb -0.13 -3.11 0.17 0.00 1.34 0.00 0.00 72.50 70.76 1wdy s THR 275 CO 0.06 -0.10 1.78 0.00 -0.54 0.00 0.00 174.62 175.83 1wdy h ALA 276 N -0.20 0.96 0.03 3.99 0.00 -1.76 -1.84 119.26 120.44 1wdy h ALA 276 Ca -0.44 0.05 -0.00 0.00 0.00 0.00 0.00 54.91 54.52 1wdy h ALA 276 Cb 1.29 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 19.02 1wdy h ALA 276 CO 0.57 -0.03 -0.01 1.25 0.00 0.00 0.00 179.25 181.03 1wdy h LEU 277 N 0.62 -0.03 -0.81 0.00 5.85 -1.95 0.58 115.31 119.57 1wdy h LEU 277 Ca 0.34 -0.06 0.04 0.00 0.84 0.00 0.00 57.88 59.04 1wdy h LEU 277 Cb 0.33 0.01 -0.05 0.00 0.37 0.00 0.00 40.66 41.31 1wdy h LEU 277 CO -0.25 0.04 0.51 -0.07 -0.34 0.00 0.00 178.44 178.33 1wdy h LEU 278 N -0.10 0.84 -0.59 2.25 3.38 -1.89 -0.39 115.31 118.82 1wdy h LEU 278 Ca -0.00 -0.00 -0.06 0.00 0.09 0.00 0.00 57.88 57.91 1wdy h LEU 278 Cb 0.09 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.63 1wdy h LEU 278 CO 0.01 0.57 0.14 -0.07 0.09 0.00 0.00 178.44 179.18 1wdy h LEU 279 N 0.99 0.90 -1.12 1.67 3.38 -1.14 -1.69 115.31 118.29 1wdy h LEU 279 Ca 0.33 -0.24 0.00 0.00 0.09 0.00 0.00 57.88 58.07 1wdy h LEU 279 Cb 0.04 -0.24 -0.04 0.00 0.09 0.00 0.00 40.66 40.51 1wdy h LEU 279 CO -0.12 0.90 0.56 0.00 0.09 0.00 0.00 178.44 179.86 1wdy h ALA 280 N 1.03 1.35 -0.25 1.53 0.00 -0.02 -0.88 119.26 122.02 1wdy h ALA 280 Ca 0.18 -0.07 -0.08 0.00 0.00 0.00 0.00 54.91 54.94 1wdy h ALA 280 Cb 0.36 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 1wdy h ALA 280 CO 0.00 0.59 -0.16 0.28 0.00 0.00 0.00 179.25 179.96 1wdy h VAL 281 N 1.18 1.31 -0.36 0.00 2.07 -0.93 -0.70 116.25 118.82 1wdy h VAL 281 Ca 0.32 -1.28 -0.04 0.00 0.82 0.00 0.00 66.70 66.52 1wdy h VAL 281 Cb -0.11 1.59 -0.02 0.00 -1.52 0.00 0.00 31.29 31.23 1wdy h VAL 281 CO -0.07 0.40 0.06 -0.33 0.02 0.00 0.00 177.57 177.66 1wdy h GLU 282 N 0.28 0.54 -0.01 1.57 5.08 -0.89 -1.82 114.58 119.34 1wdy h GLU 282 Ca 0.05 -0.10 0.00 0.00 -1.00 0.00 0.00 59.36 58.32 1wdy h GLU 282 Cb 0.69 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.85 1wdy h GLU 282 CO 0.05 0.52 -0.12 1.28 -1.00 0.00 0.00 179.01 179.74 1wdy n LEU 283 N -4.32 0.64 -3.07 1.33 4.77 -0.37 -4.94 117.00 111.03 1wdy n LEU 283 Ca 0.02 -0.09 -0.17 0.00 -0.03 0.00 0.00 56.01 55.74 1wdy n LEU 283 Cb 0.21 -0.14 0.07 0.00 -2.33 0.00 0.00 43.42 41.22 1wdy n LEU 283 CO 0.38 0.12 0.14 0.29 -1.33 0.00 0.00 177.39 176.99 1wdy n LYS 284 N -0.80 -6.07 -3.17 3.23 5.02 -0.69 -4.96 118.16 110.73 1wdy n LYS 284 Ca 0.15 0.71 -0.46 0.00 -2.02 0.00 0.00 58.31 56.69 1wdy n LYS 284 Cb 0.29 -5.35 -0.02 0.00 -0.02 0.00 0.00 35.03 29.93 1wdy n LYS 284 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1wdy s LEU 285 N -5.94 6.03 0.10 -0.35 1.43 -0.35 -4.94 118.68 114.66 1wdy s LEU 285 Ca 0.21 -2.36 -0.20 0.00 -1.03 0.00 0.00 54.13 50.75 1wdy s LEU 285 Cb -0.09 -2.29 -0.09 0.00 0.03 0.00 0.00 46.19 43.75 1wdy s LEU 285 CO 0.61 -0.79 1.70 0.11 0.23 0.00 0.00 176.35 178.21 1wdy h LYS 286 N 8.28 0.24 -0.25 1.70 1.57 -1.93 -0.04 116.57 126.13 1wdy h LYS 286 Ca 0.09 -0.03 -0.14 0.00 -1.87 0.00 0.00 60.65 58.70 1wdy h LYS 286 Cb 1.04 -0.05 -0.00 0.00 0.08 0.00 0.00 32.23 33.30 1wdy h LYS 286 CO 0.91 0.23 -0.40 0.87 -0.57 0.00 0.00 179.45 180.49 1wdy h LYS 287 N 0.18 0.72 -0.43 3.15 1.57 -1.98 -2.05 116.57 117.72 1wdy h LYS 287 Ca 0.06 -0.43 -0.04 0.00 -1.87 0.00 0.00 60.65 58.36 1wdy h LYS 287 Cb 0.06 0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.40 1wdy h LYS 287 CO -0.01 1.06 0.10 0.82 -0.57 0.00 0.00 179.45 180.85 1wdy h ILE 288 N 0.44 1.23 -0.35 1.86 2.04 -1.95 -1.89 117.51 118.89 1wdy h ILE 288 Ca 0.02 -0.81 0.00 0.00 1.00 0.00 0.00 64.86 65.07 1wdy h ILE 288 Cb 1.00 0.94 -0.02 0.00 -0.74 0.00 0.00 36.82 37.99 1wdy h ILE 288 CO 0.09 0.28 0.22 0.00 0.00 0.00 0.00 178.15 178.75 1wdy h ALA 289 N 0.96 0.45 -0.62 1.87 0.00 -0.95 -1.03 119.26 119.94 1wdy h ALA 289 Ca 0.14 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.99 1wdy h ALA 289 Cb 0.32 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.94 1wdy h ALA 289 CO 0.00 -0.07 0.34 1.49 0.00 0.00 0.00 179.25 181.01 1wdy h GLU 290 N 0.46 0.86 -0.27 0.00 4.81 -1.29 -0.31 114.58 118.85 1wdy h GLU 290 Ca 0.13 -0.10 0.04 0.00 -0.13 0.00 0.00 59.36 59.30 1wdy h GLU 290 Cb -0.02 -0.17 -0.04 0.00 0.63 0.00 0.00 28.75 29.16 1wdy h GLU 290 CO -0.03 0.66 0.03 -0.07 -0.73 0.00 0.00 179.01 178.87 1wdy h LEU 291 N 0.84 -0.05 -0.33 1.64 3.38 -0.96 -1.03 115.31 118.80 1wdy h LEU 291 Ca 0.22 0.05 -0.09 0.00 0.09 0.00 0.00 57.88 58.15 1wdy h LEU 291 Cb 0.05 0.08 -0.01 0.00 0.09 0.00 0.00 40.66 40.87 1wdy h LEU 291 CO -0.03 0.01 -0.15 -0.07 0.09 0.00 0.00 178.44 178.28 1wdy h LEU 292 N 0.11 0.69 -0.97 1.67 3.38 -0.96 -2.83 115.31 116.41 1wdy h LEU 292 Ca 0.13 -0.40 0.00 0.00 0.09 0.00 0.00 57.88 57.70 1wdy h LEU 292 Cb 0.15 -0.19 -0.05 0.00 0.09 0.00 0.00 40.66 40.66 1wdy h LEU 292 CO -0.19 0.94 0.61 0.00 0.09 0.00 0.00 178.44 179.90 1wdy h LYS 294 N 1.33 0.43 0.00 0.00 1.57 -1.09 -2.41 116.57 116.40 1wdy h LYS 294 Ca 0.35 -0.10 -0.03 0.00 -1.87 0.00 0.00 60.65 59.00 1wdy h LYS 294 Cb -0.11 -0.06 -0.00 0.00 0.08 0.00 0.00 32.23 32.14 1wdy h LYS 294 CO -0.07 0.51 -0.15 -0.09 -0.57 0.00 0.00 179.45 179.08 1wdy h ARG 295 N 0.41 0.00 0.00 3.15 9.65 -1.19 -3.46 114.38 122.94 1wdy h ARG 295 Ca 0.08 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.96 1wdy h ARG 295 Cb 0.38 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 28.96 1wdy h ARG 295 CO 0.02 0.15 0.00 0.41 2.80 0.00 0.00 179.97 183.35 1wdy n GLY 296 N 0.42 1.04 0.10 2.80 0.00 -0.91 -5.03 105.19 103.61 1wdy n GLY 296 Ca 0.01 -1.77 0.12 0.00 0.00 0.00 0.00 46.02 44.37 1wdy n GLY 296 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wdy n ALA 297 N -3.00 2.61 -1.76 4.61 0.00 -1.26 -4.97 120.51 116.74 1wdy n ALA 297 Ca 0.00 -0.24 -0.35 0.00 0.00 0.00 0.00 53.44 52.85 1wdy n ALA 297 Cb 0.00 -1.11 -0.01 0.00 0.00 0.00 0.00 19.45 18.34 1wdy n ALA 297 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1wdy s SER 298 N -5.16 5.87 -0.01 0.00 0.15 -1.26 -4.97 113.70 108.32 1wdy s SER 298 Ca 0.00 2.08 0.21 0.00 0.70 0.00 0.00 55.95 58.95 1wdy s SER 298 Cb 0.10 -2.57 -0.28 0.00 -1.71 0.00 0.00 66.02 61.56 1wdy s SER 298 CO 0.78 -1.11 0.70 0.35 1.20 0.00 0.00 173.24 175.16 1wdy n THR 299 N -1.28 0.00 -3.95 6.45 -2.24 -1.26 -4.80 114.28 107.20 1wdy n THR 299 Ca 0.11 -0.23 -0.30 0.00 -2.27 0.00 0.00 64.05 61.36 1wdy n THR 299 Cb 0.51 0.54 -0.14 0.00 -2.10 0.00 0.00 70.33 69.15 1wdy n THR 299 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1wdy s ASP 300 N -3.68 4.34 0.00 3.42 -1.08 -1.26 -4.93 116.67 113.48 1wdy s ASP 300 Ca 0.01 -3.06 0.04 0.00 -0.52 0.00 0.00 52.55 49.01 1wdy s ASP 300 Cb 0.15 -1.64 0.01 0.00 -1.46 0.00 0.00 42.92 39.97 1wdy s ASP 300 CO 0.88 -0.22 0.45 0.00 0.52 0.00 0.00 175.17 176.80 1wdy n GLY 302 N 0.56 0.34 1.14 0.00 0.00 -1.26 -4.43 105.19 101.53 1wdy n GLY 302 Ca 0.02 -0.58 0.04 0.00 0.00 0.00 0.00 46.02 45.50 1wdy n GLY 302 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1wdy n ASP 303 N 0.51 1.13 0.06 1.61 2.03 -1.26 -4.88 116.55 115.74 1wdy n ASP 303 Ca 0.14 -2.50 -0.11 0.00 0.52 0.00 0.00 54.79 52.84 1wdy n ASP 303 Cb 0.48 -0.35 -0.13 0.00 -0.72 0.00 0.00 41.12 40.39 1wdy n ASP 303 CO 0.00 0.00 0.00 -0.07 -1.92 0.00 0.00 177.20 175.21 1wdy h LEU 304 N 0.87 0.17 -1.74 -2.67 3.38 -1.88 -3.54 115.31 109.90 1wdy h LEU 304 Ca -0.14 -0.21 0.00 0.00 0.09 0.00 0.00 57.88 57.62 1wdy h LEU 304 Cb 1.60 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 42.30 1wdy h LEU 304 CO 0.06 1.17 0.00 0.52 0.09 0.00 0.00 178.44 180.28