#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dgk s ARG 31 N 0.00 1.84 0.17 1.97 0.52 -1.26 -4.99 118.95 117.21 2dgk s ARG 31 Ca 0.00 0.32 -0.31 0.00 -0.52 0.00 0.00 55.73 55.23 2dgk s ARG 31 Cb 0.00 -1.92 -0.09 0.00 0.52 0.00 0.00 34.95 33.46 2dgk s ARG 31 CO 0.00 -1.72 1.42 0.12 0.02 0.00 0.00 175.30 175.14 2dgk s PHE 32 N -3.36 3.16 0.41 -0.53 2.19 -1.26 -4.93 117.98 113.65 2dgk s PHE 32 Ca 0.62 0.95 -0.25 0.00 0.33 0.00 0.00 56.93 58.58 2dgk s PHE 32 Cb -0.13 -3.75 -0.11 0.00 -1.31 0.00 0.00 43.02 37.72 2dgk s PHE 32 CO 0.52 -2.58 1.01 -2.30 1.83 0.00 0.00 175.22 173.69 2dgk n PRO 33 N 3.32 1.35 -0.10 10.12 -0.02 -1.26 -4.96 135.00 143.45 2dgk n PRO 33 Ca 0.10 0.48 -0.19 0.00 -2.02 0.00 0.00 63.50 61.87 2dgk n PRO 33 Cb 0.41 -2.02 -0.10 0.00 -0.02 0.00 0.00 33.50 31.77 2dgk n PRO 33 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 2dgk h LEU 34 N 1.57 0.00-10.25 2.45 6.46 -2.06 -3.48 115.31 110.00 2dgk h LEU 34 Ca -0.44 -0.43 -0.46 0.00 -0.12 0.00 0.00 57.88 56.43 2dgk h LEU 34 Cb 1.34 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 41.27 2dgk h LEU 34 CO 0.57 1.37 -0.32 -1.00 -0.62 0.00 0.00 178.44 178.44 2dgk s HIS 35 N -2.34 3.37 1.03 1.25 3.76 -1.26 -5.11 115.29 115.99 2dgk s HIS 35 Ca -0.26 0.05 -0.16 0.00 -0.15 0.00 0.00 55.06 54.54 2dgk s HIS 35 Cb 0.05 -1.81 0.21 0.00 1.11 0.00 0.00 32.58 32.14 2dgk s HIS 35 CO 0.53 0.19 1.19 -1.21 -0.85 0.00 0.00 174.74 174.59 2dgk s GLU 36 N -4.16 0.16 -0.01 1.40 2.02 -1.26 -5.10 118.70 111.76 2dgk s GLU 36 Ca 0.39 -0.08 -0.16 0.00 0.02 0.00 0.00 54.97 55.14 2dgk s GLU 36 Cb -0.09 -1.76 0.03 0.00 0.10 0.00 0.00 34.13 32.40 2dgk s GLU 36 CO 0.32 -2.79 0.33 1.41 0.02 0.00 0.00 175.26 174.55 2dgk s MET 37 N -5.54 0.71 0.50 1.61 -2.45 -1.26 -5.13 119.30 107.73 2dgk s MET 37 Ca 0.70 -0.20 -0.24 0.00 -1.25 0.00 0.00 55.69 54.70 2dgk s MET 37 Cb -0.09 0.32 -0.07 0.00 1.25 0.00 0.00 34.83 36.24 2dgk s MET 37 CO 0.54 -0.20 1.40 1.03 1.05 0.00 0.00 175.02 178.84 2dgk s ARG 38 N -1.45 3.42 0.30 4.11 0.52 -1.26 -4.84 118.95 119.75 2dgk s ARG 38 Ca -0.13 2.35 -0.00 0.00 -0.52 0.00 0.00 55.73 57.43 2dgk s ARG 38 Cb -0.04 -2.47 0.47 0.00 0.52 0.00 0.00 34.95 33.43 2dgk s ARG 38 CO 0.04 -1.01 1.89 0.38 0.02 0.00 0.00 175.30 176.63 2dgk h ASP 39 N 1.91 0.77 0.00 0.23 3.04 -2.00 -1.68 116.42 118.70 2dgk h ASP 39 Ca -0.51 -0.09 -0.11 0.00 -3.24 0.00 0.00 57.03 53.08 2dgk h ASP 39 Cb 1.28 -0.20 -0.01 0.00 -1.04 0.00 0.00 39.33 39.36 2dgk h ASP 39 CO 0.59 0.68 -0.33 -2.24 -2.04 0.00 0.00 179.24 175.91 2dgk h ASP 40 N 0.84 0.47 -0.04 4.15 2.03 -1.99 -1.35 116.42 120.53 2dgk h ASP 40 Ca 0.20 -0.18 -0.02 0.00 -0.73 0.00 0.00 57.03 56.31 2dgk h ASP 40 Cb 0.14 -0.13 -0.00 0.00 -0.83 0.00 0.00 39.33 38.51 2dgk h ASP 40 CO -0.02 0.77 -0.04 0.58 -1.03 0.00 0.00 179.24 179.51 2dgk h VAL 41 N 0.40 1.37 -0.48 4.15 2.07 -1.82 -1.31 116.25 120.64 2dgk h VAL 41 Ca 0.05 -1.16 0.05 0.00 0.82 0.00 0.00 66.70 66.45 2dgk h VAL 41 Cb 0.77 2.07 -0.05 0.00 -1.52 0.00 0.00 31.29 32.56 2dgk h VAL 41 CO 0.06 0.31 0.22 0.00 0.02 0.00 0.00 177.57 178.18 2dgk h ALA 42 N 0.55 0.60 -0.40 1.67 0.00 -1.24 -0.09 119.26 120.34 2dgk h ALA 42 Ca 0.01 0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 2dgk h ALA 42 Cb 0.52 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.26 2dgk h ALA 42 CO 0.01 -0.15 0.22 0.35 0.00 0.00 0.00 179.25 179.68 2dgk h PHE 43 N 0.43 0.54 -0.39 0.00 3.57 -1.24 -2.52 116.94 117.33 2dgk h PHE 43 Ca 0.22 -0.01 0.03 0.00 3.53 0.00 0.00 57.97 61.73 2dgk h PHE 43 Cb 0.16 -0.17 -0.03 0.00 2.79 0.00 0.00 35.95 38.69 2dgk h PHE 43 CO -0.12 0.41 0.20 0.37 -2.23 0.00 0.00 178.31 176.94 2dgk h GLN 44 N 0.52 0.40 0.04 1.11 -0.00 -0.62 0.30 115.11 116.86 2dgk h GLN 44 Ca 0.14 -0.02 0.03 0.00 -0.00 0.00 0.00 58.65 58.79 2dgk h GLN 44 Cb 0.04 -0.09 -0.04 0.00 0.00 0.00 0.00 27.48 27.39 2dgk h GLN 44 CO -0.02 0.26 -0.26 0.82 0.00 0.00 0.00 178.83 179.63 2dgk h ILE 45 N 0.41 0.42 -0.29 2.39 2.04 -0.83 -1.08 117.51 120.57 2dgk h ILE 45 Ca 0.16 0.00 -0.06 0.00 1.00 0.00 0.00 64.86 65.96 2dgk h ILE 45 Cb 0.06 0.42 -0.01 0.00 -0.74 0.00 0.00 36.82 36.55 2dgk h ILE 45 CO -0.11 0.00 -0.05 0.40 0.00 0.00 0.00 178.15 178.40 2dgk h ILE 46 N -0.42 1.27 -0.65 -0.67 2.04 -1.24 -2.40 117.51 115.44 2dgk h ILE 46 Ca 0.05 -1.05 0.10 0.00 1.00 0.00 0.00 64.86 64.96 2dgk h ILE 46 Cb 0.48 1.38 -0.08 0.00 -0.74 0.00 0.00 36.82 37.86 2dgk h ILE 46 CO -0.20 0.34 0.26 -1.13 0.00 0.00 0.00 178.15 177.42 2dgk h ASN 47 N 0.31 0.28 -0.11 1.72 -1.24 -0.27 -0.85 115.58 115.43 2dgk h ASN 47 Ca 0.08 0.08 -0.07 0.00 0.71 0.00 0.00 56.30 57.09 2dgk h ASN 47 Cb 0.51 0.05 -0.02 0.00 0.73 0.00 0.00 38.32 39.60 2dgk h ASN 47 CO 0.02 0.16 -0.15 0.44 -1.29 0.00 0.00 177.43 176.61 2dgk h ASP 48 N 0.45 0.46 -0.42 1.15 3.32 -1.06 -2.89 116.42 117.42 2dgk h ASP 48 Ca 0.33 -0.12 -0.12 0.00 0.02 0.00 0.00 57.03 57.14 2dgk h ASP 48 Cb 0.41 -0.12 -0.01 0.00 0.22 0.00 0.00 39.33 39.82 2dgk h ASP 48 CO -0.31 0.63 -0.20 -0.33 -1.72 0.00 0.00 179.24 177.31 2dgk h GLU 49 N 0.43 0.92 0.00 3.56 5.08 -0.68 -3.19 114.58 120.70 2dgk h GLU 49 Ca 0.08 -0.37 0.00 0.00 -1.00 0.00 0.00 59.36 58.06 2dgk h GLU 49 Cb 0.52 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.72 2dgk h GLU 49 CO 0.03 1.03 0.10 -0.07 -1.00 0.00 0.00 179.01 179.10 2dgk h LEU 50 N 0.80 0.00 -0.67 1.33 3.38 -1.04 -0.71 115.31 118.41 2dgk h LEU 50 Ca 0.11 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.08 2dgk h LEU 50 Cb 0.75 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.50 2dgk h LEU 50 CO 0.06 0.00 0.00 -1.22 0.09 0.00 0.00 178.44 177.37 2dgk n TYR 51 N -2.67 0.64 0.58 1.13 4.01 -1.21 -1.64 117.16 118.01 2dgk n TYR 51 Ca -0.02 0.26 0.11 0.00 -0.16 0.00 0.00 57.90 58.10 2dgk n TYR 51 Cb 0.15 -0.93 0.45 0.00 -0.31 0.00 0.00 39.34 38.70 2dgk n TYR 51 CO 0.00 0.00 0.00 1.28 -0.46 0.00 0.00 176.86 177.68 2dgk n LEU 52 N -2.09 0.39 -4.84 7.72 4.32 -0.27 -4.71 117.00 117.52 2dgk n LEU 52 Ca 0.02 0.57 -0.33 0.00 -0.02 0.00 0.00 56.01 56.25 2dgk n LEU 52 Cb 0.18 -0.49 -0.06 0.00 -1.62 0.00 0.00 43.42 41.43 2dgk n LEU 52 CO 0.16 -0.29 0.49 -1.81 -1.22 0.00 0.00 177.39 174.73 2dgk s ASP 53 N -3.73 6.82 0.63 -1.43 1.01 -0.65 -5.07 116.67 114.25 2dgk s ASP 53 Ca 0.08 1.41 -0.07 0.00 0.71 0.00 0.00 52.55 54.68 2dgk s ASP 53 Cb 0.12 -2.43 0.01 0.00 1.01 0.00 0.00 42.92 41.64 2dgk s ASP 53 CO 0.42 -0.26 0.96 -0.83 0.21 0.00 0.00 175.17 175.67 2dgk s GLY 54 N -2.28 1.62 0.00 0.21 0.00 -1.26 -4.98 107.32 100.63 2dgk s GLY 54 Ca 0.57 -0.63 0.25 0.00 0.00 0.00 0.00 44.72 44.91 2dgk s GLY 54 CO 0.16 -0.31 1.38 1.16 0.00 0.00 0.00 173.10 175.49 2dgk n ASN 55 N -2.72 2.38 0.00 1.64 0.23 -1.26 -4.97 115.26 110.55 2dgk n ASN 55 Ca 0.05 -1.74 0.00 0.00 -0.53 0.00 0.00 54.58 52.36 2dgk n ASN 55 Cb 0.58 0.07 0.00 0.00 -2.08 0.00 0.00 39.78 38.35 2dgk n ASN 55 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2dgk n ALA 56 N 0.75 0.00 0.22 -2.53 0.00 -1.26 -4.83 120.51 112.86 2dgk n ALA 56 Ca 0.14 0.00 0.05 0.00 0.00 0.00 0.00 53.44 53.64 2dgk n ALA 56 Cb 0.51 -1.14 0.49 0.00 0.00 0.00 0.00 19.45 19.30 2dgk n ALA 56 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2dgk h ARG 57 N 0.12 0.00 -0.73 0.00 2.47 -1.93 -0.88 114.38 113.43 2dgk h ARG 57 Ca 0.00 -0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.72 2dgk h ARG 57 Cb 0.40 -0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.72 2dgk h ARG 57 CO 0.00 0.19 0.00 1.04 0.56 0.00 0.00 179.97 181.76 2dgk n GLN 58 N -4.31 2.77 -3.14 0.04 6.02 -1.26 -4.85 117.38 112.64 2dgk n GLN 58 Ca -0.02 -2.67 -0.42 0.00 -0.01 0.00 0.00 57.00 53.88 2dgk n GLN 58 Cb 0.25 -1.58 -0.07 0.00 1.02 0.00 0.00 30.24 29.87 2dgk n GLN 58 CO 0.00 0.00 0.00 1.21 -1.01 0.00 0.00 177.06 177.26 2dgk s ASN 59 N -1.00 6.39 -0.22 1.08 3.84 -0.34 -1.63 114.94 123.06 2dgk s ASN 59 Ca 0.49 0.05 0.15 0.00 0.21 0.00 0.00 52.86 53.76 2dgk s ASN 59 Cb 0.26 -2.31 0.63 0.00 -0.55 0.00 0.00 41.25 39.28 2dgk s ASN 59 CO 0.33 -0.59 1.55 0.18 -2.79 0.00 0.00 177.10 175.79 2dgk n LEU 60 N 5.99 4.64 -0.10 3.21 4.77 0.27 -4.43 117.00 131.35 2dgk n LEU 60 Ca -0.02 -3.06 -0.13 0.00 -0.03 0.00 0.00 56.01 52.77 2dgk n LEU 60 Cb 0.49 -0.61 -0.14 0.00 -2.33 0.00 0.00 43.42 40.82 2dgk n LEU 60 CO 0.48 0.70 -1.14 0.00 -1.33 0.00 0.00 177.39 176.11 2dgk n ALA 61 N -0.20 1.44 -1.86 -1.18 0.00 -1.20 -0.82 120.51 116.69 2dgk n ALA 61 Ca 0.26 -1.16 -0.33 0.00 0.00 0.00 0.00 53.44 52.21 2dgk n ALA 61 Cb 1.04 -0.25 -0.05 0.00 0.00 0.00 0.00 19.45 20.18 2dgk n ALA 61 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.50 177.42 2dgk s THR 62 N -2.52 4.48 -0.11 0.00 -1.32 -1.26 -4.79 115.64 110.12 2dgk s THR 62 Ca -0.18 1.32 0.22 0.00 -1.21 0.00 0.00 61.69 61.84 2dgk s THR 62 Cb 0.07 -3.65 -0.27 0.00 -1.51 0.00 0.00 72.50 67.14 2dgk s THR 62 CO 0.75 -0.46 0.61 0.49 -2.21 0.00 0.00 174.62 173.80 2dgk n PHE 63 N -1.01 0.19 -2.51 9.09 3.01 -1.26 -4.86 117.46 120.10 2dgk n PHE 63 Ca 0.06 0.05 -0.34 0.00 1.01 0.00 0.00 57.45 58.24 2dgk n PHE 63 Cb 0.54 -0.57 -0.03 0.00 -0.01 0.00 0.00 39.48 39.41 2dgk n PHE 63 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2dgk n GLN 65 N -1.03 2.48 0.00 0.00 1.13 -0.13 -4.89 117.38 114.94 2dgk n GLN 65 Ca 0.09 0.89 0.00 0.00 -1.94 0.00 0.00 57.00 56.04 2dgk n GLN 65 Cb 0.52 -2.69 0.00 0.00 0.11 0.00 0.00 30.24 28.18 2dgk n GLN 65 CO 0.00 0.00 0.00 0.25 -1.44 0.00 0.00 177.06 175.87 2dgk n THR 66 N 3.54 0.37 -3.10 5.09 -2.24 -1.26 -4.79 114.28 111.89 2dgk n THR 66 Ca 0.16 -0.41 -0.32 0.00 -2.27 0.00 0.00 64.05 61.21 2dgk n THR 66 Cb 0.32 0.92 -0.05 0.00 -2.10 0.00 0.00 70.33 69.42 2dgk n THR 66 CO 0.00 0.00 0.00 0.86 -0.57 0.00 0.00 175.07 175.36 2dgk s TRP 67 N -0.37 3.41 -0.11 4.78 -0.00 -1.26 -4.90 118.94 120.50 2dgk s TRP 67 Ca 0.00 1.11 0.01 0.00 -0.00 0.00 0.00 56.10 57.22 2dgk s TRP 67 Cb 0.00 -2.46 -0.02 0.00 -0.00 0.00 0.00 33.47 30.99 2dgk s TRP 67 CO 0.00 0.06 -0.15 -0.51 -0.00 0.00 0.00 176.95 176.35 2dgk s ASP 68 N -2.56 3.88 -0.13 5.86 1.01 -1.26 -5.09 116.67 118.38 2dgk s ASP 68 Ca 0.52 -0.33 0.01 0.00 0.71 0.00 0.00 52.55 53.46 2dgk s ASP 68 Cb -0.10 -1.39 0.02 0.00 1.01 0.00 0.00 42.92 42.45 2dgk s ASP 68 CO 0.22 0.21 -0.14 -0.62 0.21 0.00 0.00 175.17 175.04 2dgk s ASP 69 N 0.10 2.60 0.31 0.27 -1.08 -1.26 -5.03 116.67 112.58 2dgk s ASP 69 Ca -0.07 -0.46 0.04 0.00 -0.52 0.00 0.00 52.55 51.54 2dgk s ASP 69 Cb -0.15 -1.14 0.64 0.00 -1.46 0.00 0.00 42.92 40.81 2dgk s ASP 69 CO 0.05 -0.03 1.87 -0.08 0.52 0.00 0.00 175.17 177.49 2dgk h GLU 70 N 7.85 0.87 -0.23 4.34 4.81 -1.99 -1.17 114.58 129.06 2dgk h GLU 70 Ca -0.36 -0.05 -0.11 0.00 -0.13 0.00 0.00 59.36 58.71 2dgk h GLU 70 Cb 1.15 -0.20 -0.01 0.00 0.63 0.00 0.00 28.75 30.32 2dgk h GLU 70 CO 0.51 0.58 -0.31 -0.91 -0.73 0.00 0.00 179.01 178.15 2dgk h ASN 71 N 0.90 0.48 -0.33 1.04 2.35 -1.99 -1.21 115.58 116.83 2dgk h ASN 71 Ca 0.45 -0.18 -0.09 0.00 -0.55 0.00 0.00 56.30 55.94 2dgk h ASN 71 Cb 0.49 -0.13 -0.01 0.00 0.05 0.00 0.00 38.32 38.72 2dgk h ASN 71 CO -0.22 0.77 -0.13 0.58 -1.65 0.00 0.00 177.43 176.79 2dgk h VAL 72 N 0.41 1.29 -0.69 2.81 2.07 -1.70 -0.96 116.25 119.47 2dgk h VAL 72 Ca 0.05 -1.22 0.05 0.00 0.82 0.00 0.00 66.70 66.40 2dgk h VAL 72 Cb 0.75 1.39 -0.05 0.00 -1.52 0.00 0.00 31.29 31.85 2dgk h VAL 72 CO 0.06 0.39 0.41 0.45 0.02 0.00 0.00 177.57 178.90 2dgk h HIS 73 N 0.44 0.76 -0.48 1.57 3.86 -0.98 -0.03 115.15 120.28 2dgk h HIS 73 Ca 0.08 0.02 -0.04 0.00 -1.16 0.00 0.00 60.37 59.27 2dgk h HIS 73 Cb 0.65 -0.24 -0.02 0.00 1.06 0.00 0.00 27.41 28.86 2dgk h HIS 73 CO 0.06 0.40 0.14 0.87 0.86 0.00 0.00 177.93 180.25 2dgk h LYS 74 N 0.77 0.76 -0.48 2.45 1.57 -0.96 -1.05 116.57 119.63 2dgk h LYS 74 Ca 0.30 -0.17 -0.04 0.00 -1.87 0.00 0.00 60.65 58.86 2dgk h LYS 74 Cb 0.12 -0.11 -0.02 0.00 0.08 0.00 0.00 32.23 32.30 2dgk h LYS 74 CO -0.15 0.73 0.15 -0.07 -0.57 0.00 0.00 179.45 179.54 2dgk h LEU 75 N 0.65 0.70 -0.66 2.94 3.38 -0.69 -1.37 115.31 120.27 2dgk h LEU 75 Ca 0.15 -0.20 -0.05 0.00 0.09 0.00 0.00 57.88 57.87 2dgk h LEU 75 Cb 0.30 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 40.84 2dgk h LEU 75 CO -0.00 0.72 0.24 0.24 0.09 0.00 0.00 178.44 179.72 2dgk h MET 76 N 0.65 1.01 -0.53 1.13 2.86 -0.94 -1.88 114.93 117.23 2dgk h MET 76 Ca 0.16 -0.20 -0.04 0.00 -2.06 0.00 0.00 59.70 57.55 2dgk h MET 76 Cb 0.27 -0.15 -0.02 0.00 0.06 0.00 0.00 31.60 31.75 2dgk h MET 76 CO -0.01 0.86 0.15 0.22 1.06 0.00 0.00 176.91 179.20 2dgk h ASP 77 N 0.95 0.73 0.94 1.22 3.58 -0.92 -2.09 116.42 120.83 2dgk h ASP 77 Ca 0.22 -0.12 -0.05 0.00 0.42 0.00 0.00 57.03 57.50 2dgk h ASP 77 Cb 0.25 -0.19 -0.01 0.00 1.72 0.00 0.00 39.33 41.11 2dgk h ASP 77 CO -0.01 0.71 -0.22 -0.07 -2.88 0.00 0.00 179.24 176.76 2dgk h LEU 78 N 0.77 0.00 -2.66 2.28 3.38 -0.85 -3.27 115.31 114.96 2dgk h LEU 78 Ca 0.17 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.14 2dgk h LEU 78 Cb 0.25 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.00 2dgk h LEU 78 CO -0.01 0.22 0.00 -1.20 0.09 0.00 0.00 178.44 177.54 2dgk n SER 79 N -3.38 3.54 -0.29 -0.43 7.64 -0.74 -4.63 113.62 115.32 2dgk n SER 79 Ca 0.00 -1.98 0.21 0.00 1.01 0.00 0.00 58.87 58.11 2dgk n SER 79 Cb 0.43 -0.36 0.51 0.00 -1.01 0.00 0.00 64.21 63.77 2dgk n SER 79 CO 0.00 0.00 0.00 -0.29 -3.01 0.00 0.00 175.04 171.74 2dgk h ILE 80 N 3.68 0.60 -0.39 0.44 2.10 -1.54 -1.57 117.51 120.84 2dgk h ILE 80 Ca 0.00 -0.14 0.00 0.00 1.08 0.00 0.00 64.86 65.80 2dgk h ILE 80 Cb 0.91 0.15 0.00 0.00 -1.09 0.00 0.00 36.82 36.79 2dgk h ILE 80 CO 0.00 0.07 0.00 0.59 -1.08 0.00 0.00 178.15 177.73 2dgk n ASN 81 N -4.56 3.10 -4.60 2.19 3.02 -1.26 -4.85 115.26 108.30 2dgk n ASN 81 Ca 0.23 -1.93 -0.43 0.00 -0.03 0.00 0.00 54.58 52.42 2dgk n ASN 81 Cb 0.79 -0.26 -0.02 0.00 -0.61 0.00 0.00 39.78 39.68 2dgk n ASN 81 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 2dgk s LYS 82 N -1.07 3.66 -0.42 3.52 1.02 -0.59 -4.98 119.74 120.88 2dgk s LYS 82 Ca 0.30 0.61 -0.28 0.00 0.02 0.00 0.00 55.97 56.62 2dgk s LYS 82 Cb 0.16 -3.95 0.02 0.00 -0.52 0.00 0.00 37.83 33.55 2dgk s LYS 82 CO 0.22 -1.47 1.06 1.21 -0.92 0.00 0.00 175.35 175.45 2dgk s ASN 83 N 2.89 6.69 0.46 2.83 3.84 -1.26 -0.79 114.94 129.59 2dgk s ASN 83 Ca 0.51 0.57 0.18 0.00 0.21 0.00 0.00 52.86 54.33 2dgk s ASN 83 Cb -0.09 -2.52 1.15 0.00 -0.55 0.00 0.00 41.25 39.24 2dgk s ASN 83 CO 0.31 -1.08 1.94 -0.25 -2.79 0.00 0.00 177.10 175.24 2dgk h TRP 84 N 8.84 0.34 0.00 0.43 7.01 -0.75 -1.78 115.95 130.04 2dgk h TRP 84 Ca -0.23 0.01 0.00 0.00 2.11 0.00 0.00 58.89 60.78 2dgk h TRP 84 Cb 1.06 -0.11 0.00 0.00 -2.10 0.00 0.00 29.16 28.02 2dgk h TRP 84 CO 0.91 0.13 -0.51 1.51 -2.79 0.00 0.00 178.44 177.69 2dgk n ILE 85 N -4.45 0.41 -3.04 2.65 0.13 -1.26 -4.56 119.36 109.24 2dgk n ILE 85 Ca 0.13 -0.28 -0.44 0.00 -1.10 0.00 0.00 62.75 61.06 2dgk n ILE 85 Cb 0.54 -0.21 -0.00 0.00 -0.84 0.00 0.00 39.64 39.12 2dgk n ILE 85 CO 0.00 0.00 0.00 -0.62 2.80 0.00 0.00 176.55 178.73 2dgk s ASP 86 N -4.30 7.05 0.49 9.51 -1.08 -0.67 -4.80 116.67 122.87 2dgk s ASP 86 Ca 0.07 -2.97 0.33 0.00 -0.52 0.00 0.00 52.55 49.46 2dgk s ASP 86 Cb 0.13 -2.35 1.47 0.00 -1.46 0.00 0.00 42.92 40.70 2dgk s ASP 86 CO 0.70 -0.69 1.98 0.11 0.52 0.00 0.00 175.17 177.78 2dgk h LYS 87 N 7.33 0.00 0.00 4.34 6.56 -1.80 -2.41 116.57 130.59 2dgk h LYS 87 Ca 0.26 0.00 -0.00 0.00 -1.06 0.00 0.00 60.65 59.85 2dgk h LYS 87 Cb 0.90 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.56 2dgk h LYS 87 CO 1.16 0.00 -0.00 1.49 -2.06 0.00 0.00 179.45 180.03 2dgk h GLU 88 N 0.00 -0.00 0.04 3.15 4.81 -1.95 -3.03 114.58 117.58 2dgk h GLU 88 Ca 0.00 0.00 -0.22 0.00 -0.13 0.00 0.00 59.36 59.01 2dgk h GLU 88 Cb 0.35 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.72 2dgk h GLU 88 CO 0.00 0.89 -1.00 1.49 -0.73 0.00 0.00 179.01 179.66 2dgk h GLU 89 N -0.93 0.19 -2.25 1.92 4.57 -1.95 -3.37 114.58 112.76 2dgk h GLU 89 Ca -0.00 -0.25 -0.61 0.00 -1.18 0.00 0.00 59.36 57.32 2dgk h GLU 89 Cb 0.89 0.08 -0.41 0.00 -0.16 0.00 0.00 28.75 29.15 2dgk h GLU 89 CO 0.00 1.04 -0.54 0.66 -1.18 0.00 0.00 179.01 178.99 2dgk n TYR 90 N -3.58 3.75 0.10 0.92 4.01 -0.91 -4.92 117.16 116.53 2dgk n TYR 90 Ca -0.04 -4.03 0.03 0.00 -0.16 0.00 0.00 57.90 53.69 2dgk n TYR 90 Cb 0.89 -0.57 0.42 0.00 -0.31 0.00 0.00 39.34 39.77 2dgk n TYR 90 CO 0.00 0.00 0.00 -1.00 -0.46 0.00 0.00 176.86 175.40 2dgk h PRO 91 N 3.81 0.31 -0.02 -0.72 0.13 -1.70 -2.67 132.00 131.15 2dgk h PRO 91 Ca 0.18 -0.05 -0.22 0.00 -0.87 0.00 0.00 66.00 65.05 2dgk h PRO 91 Cb 0.60 -0.05 0.00 0.00 0.13 0.00 0.00 31.00 31.68 2dgk h PRO 91 CO 0.85 0.34 -0.89 0.37 -0.23 0.00 0.00 178.00 178.44 2dgk h GLN 92 N 0.31 0.42 -0.90 0.86 5.75 -1.91 -0.90 115.11 118.73 2dgk h GLN 92 Ca 0.07 -0.42 -0.01 0.00 -0.15 0.00 0.00 58.65 58.14 2dgk h GLN 92 Cb 0.21 0.11 -0.04 0.00 1.07 0.00 0.00 27.48 28.83 2dgk h GLN 92 CO 0.00 1.08 0.53 0.77 -2.65 0.00 0.00 178.83 178.57 2dgk h SER 93 N 0.25 1.09 -0.59 -0.69 0.02 -1.92 -0.45 113.55 111.25 2dgk h SER 93 Ca -0.07 -0.07 -0.08 0.00 -0.84 0.00 0.00 61.79 60.73 2dgk h SER 93 Cb 1.52 -0.27 -0.02 0.00 0.14 0.00 0.00 62.40 63.76 2dgk h SER 93 CO 0.15 0.84 0.04 0.00 -1.14 0.00 0.00 176.83 176.73 2dgk h ALA 94 N 1.29 0.79 -0.70 3.77 0.00 -1.28 -1.91 119.26 121.23 2dgk h ALA 94 Ca 0.32 -0.29 -0.06 0.00 0.00 0.00 0.00 54.91 54.88 2dgk h ALA 94 Cb -0.04 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 17.50 2dgk h ALA 94 CO -0.06 0.59 0.19 0.00 0.00 0.00 0.00 179.25 179.97 2dgk h ALA 95 N 0.99 1.00 -0.58 0.00 0.00 -0.55 -1.98 119.26 118.14 2dgk h ALA 95 Ca 0.17 -0.24 -0.09 0.00 0.00 0.00 0.00 54.91 54.75 2dgk h ALA 95 Cb 0.50 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 18.00 2dgk h ALA 95 CO 0.02 0.65 -0.01 0.82 0.00 0.00 0.00 179.25 180.74 2dgk h ILE 96 N 1.05 1.26 -0.57 0.00 2.04 -0.97 -1.61 117.51 118.72 2dgk h ILE 96 Ca 0.22 -1.14 -0.01 0.00 1.00 0.00 0.00 64.86 64.93 2dgk h ILE 96 Cb 0.34 0.82 -0.03 0.00 -0.74 0.00 0.00 36.82 37.21 2dgk h ILE 96 CO -0.00 0.41 0.32 -0.78 0.00 0.00 0.00 178.15 178.10 2dgk h ASP 97 N 0.94 0.71 -0.60 1.72 3.58 -1.00 -1.12 116.42 120.64 2dgk h ASP 97 Ca 0.17 -0.09 -0.04 0.00 0.42 0.00 0.00 57.03 57.49 2dgk h ASP 97 Cb 0.55 -0.18 -0.03 0.00 1.72 0.00 0.00 39.33 41.39 2dgk h ASP 97 CO 0.03 0.59 0.25 -0.07 -2.88 0.00 0.00 179.24 177.16 2dgk h LEU 98 N 0.77 0.84 -0.57 2.28 3.38 -1.10 -1.08 115.31 119.84 2dgk h LEU 98 Ca 0.20 -0.11 -0.03 0.00 0.09 0.00 0.00 57.88 58.03 2dgk h LEU 98 Cb 0.04 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 40.54 2dgk h LEU 98 CO -0.03 0.76 0.25 0.03 0.09 0.00 0.00 178.44 179.53 2dgk h ARG 99 N 0.91 0.83 -0.51 1.13 3.08 -0.67 -1.88 114.38 117.26 2dgk h ARG 99 Ca 0.21 -0.14 -0.00 0.00 0.07 0.00 0.00 59.98 60.12 2dgk h ARG 99 Cb 0.18 -0.14 -0.02 0.00 0.08 0.00 0.00 29.97 30.06 2dgk h ARG 99 CO -0.02 0.70 0.31 0.00 -1.07 0.00 0.00 179.97 179.89 2dgk h VAL 101 N 0.68 0.92 -0.67 0.00 2.07 -0.95 0.67 116.25 118.97 2dgk h VAL 101 Ca 0.18 -0.13 -0.02 0.00 0.82 0.00 0.00 66.70 67.55 2dgk h VAL 101 Cb -0.02 0.50 -0.03 0.00 -1.52 0.00 0.00 31.29 30.22 2dgk h VAL 101 CO -0.03 0.07 0.32 0.78 0.02 0.00 0.00 177.57 178.73 2dgk h ASN 102 N 0.38 0.87 -0.50 0.57 2.35 -0.87 -1.36 115.58 117.02 2dgk h ASN 102 Ca 0.20 -0.13 -0.04 0.00 -0.55 0.00 0.00 56.30 55.78 2dgk h ASN 102 Cb 0.15 -0.22 -0.02 0.00 0.05 0.00 0.00 38.32 38.27 2dgk h ASN 102 CO -0.17 0.75 0.16 0.24 -1.65 0.00 0.00 177.43 176.76 2dgk h MET 103 N 0.92 0.77 -0.52 0.81 2.86 -0.19 -0.48 114.93 119.11 2dgk h MET 103 Ca 0.23 -0.17 -0.11 0.00 -2.06 0.00 0.00 59.70 57.59 2dgk h MET 103 Cb 0.11 -0.11 -0.02 0.00 0.06 0.00 0.00 31.60 31.64 2dgk h MET 103 CO -0.03 0.72 -0.11 0.28 1.06 0.00 0.00 176.91 178.84 2dgk h VAL 104 N 0.68 1.27 -0.66 -2.22 2.07 -0.76 -0.52 116.25 116.10 2dgk h VAL 104 Ca 0.16 -1.25 0.00 0.00 0.82 0.00 0.00 66.70 66.43 2dgk h VAL 104 Cb 0.27 1.00 -0.03 0.00 -1.52 0.00 0.00 31.29 31.01 2dgk h VAL 104 CO -0.01 0.44 0.41 0.00 0.02 0.00 0.00 177.57 178.44 2dgk h ALA 105 N 0.91 0.84 -0.53 1.67 0.00 -1.07 -1.09 119.26 119.99 2dgk h ALA 105 Ca 0.14 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 2dgk h ALA 105 Cb 0.67 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 18.17 2dgk h ALA 105 CO 0.05 0.29 0.31 0.22 0.00 0.00 0.00 179.25 180.12 2dgk h ASP 106 N 0.89 0.64 -0.74 0.00 3.58 -0.78 -1.45 116.42 118.55 2dgk h ASP 106 Ca 0.24 -0.07 0.06 0.00 0.42 0.00 0.00 57.03 57.68 2dgk h ASP 106 Cb -0.06 -0.16 -0.05 0.00 1.72 0.00 0.00 39.33 40.78 2dgk h ASP 106 CO -0.05 0.52 0.49 0.25 -2.88 0.00 0.00 179.24 177.57 2dgk h LEU 107 N 0.70 0.70 -2.58 2.28 5.85 -0.40 -1.74 115.31 120.13 2dgk h LEU 107 Ca 0.19 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.91 2dgk h LEU 107 Cb 0.01 -0.15 0.00 0.00 0.37 0.00 0.00 40.66 40.89 2dgk h LEU 107 CO -0.03 0.45 0.00 0.79 -0.34 0.00 0.00 178.44 179.31 2dgk n TRP 108 N -4.48 1.23 -3.13 1.25 8.01 -0.48 -4.93 117.44 114.91 2dgk n TRP 108 Ca 0.11 -0.48 -0.22 0.00 -1.31 0.00 0.00 57.50 55.60 2dgk n TRP 108 Cb 0.22 -0.24 0.05 0.00 -2.01 0.00 0.00 31.31 29.33 2dgk n TRP 108 CO 0.00 0.00 0.00 0.72 -1.01 0.00 0.00 177.69 177.40 2dgk n HIS 109 N 0.78 -2.11 -2.15 -5.99 8.25 -0.65 -2.50 115.22 110.83 2dgk n HIS 109 Ca 0.20 0.62 -0.36 0.00 -0.26 0.00 0.00 57.72 57.92 2dgk n HIS 109 Cb 0.76 -4.50 0.01 0.00 1.12 0.00 0.00 29.99 27.38 2dgk n HIS 109 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2dgk s ALA 110 N -3.20 2.76 0.42 -1.41 0.00 -0.60 -4.33 121.76 115.39 2dgk s ALA 110 Ca 0.36 0.95 -0.26 0.00 0.00 0.00 0.00 51.96 53.01 2dgk s ALA 110 Cb -0.16 -3.41 -0.09 0.00 0.00 0.00 0.00 23.12 19.46 2dgk s ALA 110 CO 0.45 -0.89 1.37 -2.14 0.00 0.00 0.00 175.76 174.55 2dgk s PRO 111 N -3.07 3.87 0.15 0.00 0.02 -1.26 -4.86 135.00 129.85 2dgk s PRO 111 Ca 0.71 2.31 -0.34 0.00 0.02 0.00 0.00 61.00 63.70 2dgk s PRO 111 Cb -0.29 -2.74 -0.14 0.00 0.02 0.00 0.00 34.50 31.36 2dgk s PRO 111 CO 0.33 -0.63 1.61 0.00 -0.33 0.00 0.00 177.00 177.98 2dgk n ALA 112 N 0.04 1.45 -1.96 -1.55 0.00 -1.26 -4.93 120.51 112.30 2dgk n ALA 112 Ca 0.04 0.43 -0.41 0.00 0.00 0.00 0.00 53.44 53.51 2dgk n ALA 112 Cb 0.42 -2.37 -0.05 0.00 0.00 0.00 0.00 19.45 17.45 2dgk n ALA 112 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 2dgk s PRO 113 N 1.12 4.73 0.24 0.00 0.04 -1.26 -4.97 135.00 134.89 2dgk s PRO 113 Ca 0.79 1.58 -0.06 0.00 0.04 0.00 0.00 61.00 63.35 2dgk s PRO 113 Cb -0.67 -3.29 0.32 0.00 0.04 0.00 0.00 34.50 30.90 2dgk s PRO 113 CO 0.38 0.30 1.84 0.87 0.04 0.00 0.00 177.00 180.43 2dgk h LYS 114 N 4.69 0.89 -0.07 4.56 1.57 -1.91 -2.02 116.57 124.29 2dgk h LYS 114 Ca -0.45 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.28 2dgk h LYS 114 Cb 1.21 -0.20 0.00 0.00 0.08 0.00 0.00 32.23 33.32 2dgk h LYS 114 CO 0.70 0.59 0.00 0.27 -0.57 0.00 0.00 179.45 180.44 2dgk n ASN 115 N -4.65 1.11 0.00 0.86 0.23 -1.26 -4.92 115.26 106.63 2dgk n ASN 115 Ca 0.12 -1.50 0.00 0.00 -0.53 0.00 0.00 54.58 52.67 2dgk n ASN 115 Cb 0.18 -0.04 0.00 0.00 -2.08 0.00 0.00 39.78 37.84 2dgk n ASN 115 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2dgk n GLY 116 N 1.07 0.70 2.85 4.83 0.00 -0.76 -5.03 105.19 108.85 2dgk n GLY 116 Ca 0.18 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.95 2dgk n GLY 116 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2dgk s GLN 117 N -0.20 1.13 0.71 1.61 2.00 -1.26 -4.97 119.66 118.69 2dgk s GLN 117 Ca 0.00 -0.10 -0.16 0.00 -2.00 0.00 0.00 55.36 53.10 2dgk s GLN 117 Cb 0.00 -1.32 0.03 0.00 0.80 0.00 0.00 33.01 32.52 2dgk s GLN 117 CO 0.00 -0.28 1.24 0.00 -0.50 0.00 0.00 175.29 175.75 2dgk s ALA 118 N 1.80 2.16 -0.37 1.58 0.00 -1.26 -4.83 121.76 120.83 2dgk s ALA 118 Ca 0.05 1.00 -0.21 0.00 0.00 0.00 0.00 51.96 52.79 2dgk s ALA 118 Cb -0.12 -3.51 0.01 0.00 0.00 0.00 0.00 23.12 19.50 2dgk s ALA 118 CO -0.07 -1.85 0.69 0.08 0.00 0.00 0.00 175.76 174.61 2dgk s VAL 119 N -1.80 4.83 0.00 0.00 1.01 -1.26 -4.88 120.40 118.30 2dgk s VAL 119 Ca 0.77 0.62 0.00 0.00 0.00 0.00 0.00 61.98 63.37 2dgk s VAL 119 Cb -0.32 -4.14 0.00 0.00 0.00 0.00 0.00 36.38 31.92 2dgk s VAL 119 CO 0.44 -0.39 0.00 0.61 0.00 0.00 0.00 175.10 175.76 2dgk n GLY 120 N 4.68 -0.34 3.38 4.51 0.00 -1.26 -0.14 105.19 116.01 2dgk n GLY 120 Ca 0.00 -1.03 -0.14 0.00 0.00 0.00 0.00 46.02 44.86 2dgk n GLY 120 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2dgk s THR 121 N -2.00 0.04 0.48 2.61 -1.32 -0.29 -5.00 115.64 110.16 2dgk s THR 121 Ca 0.00 -0.30 -0.18 0.00 -1.21 0.00 0.00 61.69 60.00 2dgk s THR 121 Cb 0.00 -0.97 -0.09 0.00 -1.51 0.00 0.00 72.50 69.93 2dgk s THR 121 CO 0.00 -0.16 0.98 0.21 -2.21 0.00 0.00 174.62 173.43 2dgk s ASN 122 N -1.97 6.71 0.29 8.08 3.84 -1.26 -2.12 114.94 128.50 2dgk s ASN 122 Ca -0.05 1.64 0.04 0.00 0.21 0.00 0.00 52.86 54.69 2dgk s ASN 122 Cb -0.01 -2.52 -0.03 0.00 -0.55 0.00 0.00 41.25 38.14 2dgk s ASN 122 CO -0.02 -0.52 0.24 0.42 -2.79 0.00 0.00 177.10 174.43 2dgk s THR 123 N -2.43 0.00 0.26 -5.21 -4.23 0.14 -4.94 115.64 99.23 2dgk s THR 123 Ca 0.61 -1.97 0.10 0.00 -1.18 0.00 0.00 61.69 59.25 2dgk s THR 123 Cb -0.10 -2.50 -0.04 0.00 1.34 0.00 0.00 72.50 71.20 2dgk s THR 123 CO 0.24 0.00 1.59 0.40 -0.54 0.00 0.00 174.62 176.31 2dgk h ILE 124 N 2.29 1.46 -1.88 2.99 1.08 -1.83 0.18 117.51 121.81 2dgk h ILE 124 Ca -0.29 -2.21 0.13 0.00 -0.39 0.00 0.00 64.86 62.10 2dgk h ILE 124 Cb 1.24 2.20 -0.02 0.00 -3.07 0.00 0.00 36.82 37.16 2dgk h ILE 124 CO 0.42 0.63 0.39 0.61 -0.69 0.00 0.00 178.15 179.51 2dgk n GLY 125 N 0.33 0.67 0.24 5.37 0.00 -1.26 -1.08 105.19 109.46 2dgk n GLY 125 Ca -0.01 -0.99 0.09 0.00 0.00 0.00 0.00 46.02 45.11 2dgk n GLY 125 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2dgk h SER 126 N 1.04 0.00 0.26 1.61 0.02 -1.85 -2.79 113.55 111.84 2dgk h SER 126 Ca -0.13 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 60.81 2dgk h SER 126 Cb 0.62 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.16 2dgk h SER 126 CO 0.18 0.18 -0.16 0.28 -1.14 0.00 0.00 176.83 176.17 2dgk h SER 127 N 0.00 -0.39 -0.36 3.07 0.02 -1.95 0.44 113.55 114.38 2dgk h SER 127 Ca -0.00 0.02 -0.01 0.00 -0.84 0.00 0.00 61.79 60.96 2dgk h SER 127 Cb 0.40 0.11 -0.02 0.00 0.14 0.00 0.00 62.40 63.04 2dgk h SER 127 CO 0.02 -0.25 0.17 -0.08 -1.14 0.00 0.00 176.83 175.55 2dgk h GLU 128 N -0.40 0.53 -0.64 3.45 4.81 -1.95 -1.87 114.58 118.50 2dgk h GLU 128 Ca -0.03 -0.08 0.06 0.00 -0.13 0.00 0.00 59.36 59.19 2dgk h GLU 128 Cb 0.33 -0.09 -0.06 0.00 0.63 0.00 0.00 28.75 29.56 2dgk h GLU 128 CO 0.03 0.48 0.33 0.00 -0.73 0.00 0.00 179.01 179.13 2dgk h ALA 129 N 1.02 0.85 -0.72 2.92 0.00 -1.23 -0.86 119.26 121.25 2dgk h ALA 129 Ca 0.12 0.03 -0.05 0.00 0.00 0.00 0.00 54.91 55.01 2dgk h ALA 129 Cb 0.13 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 17.80 2dgk h ALA 129 CO -0.01 -0.01 0.24 0.00 0.00 0.00 0.00 179.25 179.46 2dgk h MET 131 N 1.06 0.89 -0.35 0.00 2.86 -0.58 0.39 114.93 119.19 2dgk h MET 131 Ca 0.24 -0.32 -0.05 0.00 -2.06 0.00 0.00 59.70 57.51 2dgk h MET 131 Cb 0.27 -0.06 -0.01 0.00 0.06 0.00 0.00 31.60 31.85 2dgk h MET 131 CO -0.01 0.96 0.02 -0.07 1.06 0.00 0.00 176.91 178.86 2dgk h LEU 132 N 0.80 0.60 -0.93 1.22 3.38 -0.94 0.65 115.31 120.08 2dgk h LEU 132 Ca 0.13 -0.30 -0.03 0.00 0.09 0.00 0.00 57.88 57.77 2dgk h LEU 132 Cb 0.64 -0.16 -0.04 0.00 0.09 0.00 0.00 40.66 41.19 2dgk h LEU 132 CO 0.04 0.74 0.36 1.23 0.09 0.00 0.00 178.44 180.90 2dgk h GLY 133 N 0.43 1.20 0.86 0.83 0.00 -0.85 -1.58 103.07 103.96 2dgk h GLY 133 Ca 0.10 -0.60 -0.01 0.00 0.00 0.00 0.00 47.33 46.81 2dgk h GLY 133 CO 0.01 0.57 0.06 -1.33 0.00 0.00 0.00 176.54 175.85 2dgk h GLY 134 N 1.14 0.30 0.98 4.60 0.00 0.14 -1.38 103.07 108.86 2dgk h GLY 134 Ca 0.27 -0.18 0.01 0.00 0.00 0.00 0.00 47.33 47.43 2dgk h GLY 134 CO -0.03 0.17 0.45 -0.33 0.00 0.00 0.00 176.54 176.80 2dgk h MET 135 N 0.11 0.90 -0.77 4.80 2.07 -0.62 0.02 114.93 121.44 2dgk h MET 135 Ca 0.06 -0.05 -0.01 0.00 -2.07 0.00 0.00 59.70 57.62 2dgk h MET 135 Cb 0.23 -0.20 -0.04 0.00 -1.87 0.00 0.00 31.60 29.72 2dgk h MET 135 CO -0.00 0.59 0.43 0.00 1.07 0.00 0.00 176.91 179.01 2dgk h ALA 136 N 1.26 0.99 -0.09 6.32 0.00 -1.16 -0.52 119.26 126.07 2dgk h ALA 136 Ca 0.26 -0.11 -0.00 0.00 0.00 0.00 0.00 54.91 55.06 2dgk h ALA 136 Cb -0.09 -0.31 -0.00 0.00 0.00 0.00 0.00 17.79 17.39 2dgk h ALA 136 CO -0.06 0.49 0.05 1.98 0.00 0.00 0.00 179.25 181.70 2dgk h MET 137 N 1.06 0.12 -0.90 0.00 -1.53 -0.67 -0.28 114.93 112.74 2dgk h MET 137 Ca 0.27 -0.01 0.01 0.00 -3.44 0.00 0.00 59.70 56.53 2dgk h MET 137 Cb 0.01 -0.02 -0.05 0.00 -0.55 0.00 0.00 31.60 30.99 2dgk h MET 137 CO -0.05 0.14 0.59 -0.22 0.14 0.00 0.00 176.91 177.52 2dgk h LYS 138 N 0.07 1.16 -0.23 0.39 3.64 -0.68 -1.80 116.57 119.12 2dgk h LYS 138 Ca 0.03 -0.07 -0.03 0.00 -1.27 0.00 0.00 60.65 59.31 2dgk h LYS 138 Cb 0.06 -0.26 -0.01 0.00 -0.41 0.00 0.00 32.23 31.60 2dgk h LYS 138 CO -0.01 0.77 0.04 -1.49 -2.27 0.00 0.00 179.45 176.49 2dgk h TRP 139 N 1.19 0.40 -0.94 1.91 6.55 -0.73 0.01 115.95 124.35 2dgk h TRP 139 Ca 0.34 -0.06 0.02 0.00 0.95 0.00 0.00 58.89 60.14 2dgk h TRP 139 Cb -0.11 -0.11 -0.05 0.00 -0.86 0.00 0.00 29.16 28.03 2dgk h TRP 139 CO -0.01 0.51 0.62 0.00 -1.05 0.00 0.00 178.44 178.50 2dgk h ARG 140 N 0.18 1.19 0.06 0.49 3.08 -0.87 -1.43 114.38 117.09 2dgk h ARG 140 Ca 0.07 -0.07 -0.00 0.00 0.07 0.00 0.00 59.98 60.04 2dgk h ARG 140 Cb 0.32 -0.27 0.00 0.00 0.08 0.00 0.00 29.97 30.11 2dgk h ARG 140 CO 0.00 0.79 -0.03 2.35 -1.07 0.00 0.00 179.97 182.01 2dgk h TRP 141 N 1.22 -0.08 -0.99 3.04 7.01 -1.10 -2.44 115.95 122.61 2dgk h TRP 141 Ca 0.36 -0.00 0.07 0.00 2.11 0.00 0.00 58.89 61.43 2dgk h TRP 141 Cb -0.07 0.03 -0.07 0.00 -2.10 0.00 0.00 29.16 26.95 2dgk h TRP 141 CO -0.01 0.14 0.64 -0.09 -2.79 0.00 0.00 178.44 176.33 2dgk h ARG 142 N -0.29 1.12 -0.40 2.65 2.43 -0.72 -0.68 114.38 118.49 2dgk h ARG 142 Ca -0.01 -0.07 -0.01 0.00 -0.81 0.00 0.00 59.98 59.08 2dgk h ARG 142 Cb 0.25 -0.25 -0.02 0.00 -0.42 0.00 0.00 29.97 29.53 2dgk h ARG 142 CO 0.01 0.74 0.21 -0.22 -1.51 0.00 0.00 179.97 179.20 2dgk h LYS 143 N 1.15 0.57 -0.40 0.20 3.64 -1.18 -0.39 116.57 120.16 2dgk h LYS 143 Ca 0.43 -0.07 -0.02 0.00 -1.27 0.00 0.00 60.65 59.71 2dgk h LYS 143 Cb 0.19 -0.11 -0.02 0.00 -0.41 0.00 0.00 32.23 31.89 2dgk h LYS 143 CO -0.18 0.48 0.16 0.00 -2.27 0.00 0.00 179.45 177.64 2dgk h ARG 144 N 0.51 0.60 -0.70 1.90 3.08 -0.86 -2.37 114.38 116.54 2dgk h ARG 144 Ca 0.14 -0.11 -0.06 0.00 0.07 0.00 0.00 59.98 60.01 2dgk h ARG 144 Cb 0.09 -0.10 -0.03 0.00 0.08 0.00 0.00 29.97 30.01 2dgk h ARG 144 CO -0.02 0.57 0.19 0.52 -1.07 0.00 0.00 179.97 180.16 2dgk h MET 145 N 0.50 1.11 -0.73 0.04 2.86 -0.96 -2.36 114.93 115.39 2dgk h MET 145 Ca 0.13 -0.25 -0.03 0.00 -2.06 0.00 0.00 59.70 57.48 2dgk h MET 145 Cb 0.20 -0.15 -0.03 0.00 0.06 0.00 0.00 31.60 31.67 2dgk h MET 145 CO -0.01 0.97 0.33 0.93 1.06 0.00 0.00 176.91 180.18 2dgk h GLU 146 N 1.05 1.07 0.00 1.72 5.08 -0.95 0.34 114.58 122.88 2dgk h GLU 146 Ca 0.22 -0.17 -0.04 0.00 -1.00 0.00 0.00 59.36 58.37 2dgk h GLU 146 Cb 0.34 -0.18 -0.01 0.00 0.50 0.00 0.00 28.75 29.40 2dgk h GLU 146 CO -0.00 0.86 -0.21 0.00 -1.00 0.00 0.00 179.01 178.66 2dgk h ALA 147 N 1.16 1.32 -0.01 3.43 0.00 -1.22 -0.55 119.26 123.38 2dgk h ALA 147 Ca 0.25 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.97 2dgk h ALA 147 Cb 0.16 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.92 2dgk h ALA 147 CO -0.03 0.26 -0.01 0.00 0.00 0.00 0.00 179.25 179.47 2dgk n ALA 148 N -2.35 2.62 -2.19 0.00 0.00 -0.68 -4.91 120.51 113.00 2dgk n ALA 148 Ca -0.02 -0.39 -0.13 0.00 0.00 0.00 0.00 53.44 52.91 2dgk n ALA 148 Cb 0.31 -1.24 -0.01 0.00 0.00 0.00 0.00 19.45 18.51 2dgk n ALA 148 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2dgk n GLY 149 N 1.15 -0.06 3.70 0.00 0.00 -0.22 -5.02 105.19 104.74 2dgk n GLY 149 Ca 0.20 -0.36 -0.28 0.00 0.00 0.00 0.00 46.02 45.58 2dgk n GLY 149 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2dgk s LYS 150 N -4.54 2.55 0.51 1.61 1.02 0.02 -5.02 119.74 115.90 2dgk s LYS 150 Ca 0.00 -0.95 -0.23 0.00 0.02 0.00 0.00 55.97 54.80 2dgk s LYS 150 Cb 0.00 -2.48 -0.06 0.00 -0.52 0.00 0.00 37.83 34.77 2dgk s LYS 150 CO 0.00 0.49 1.39 -2.14 -0.92 0.00 0.00 175.35 174.17 2dgk s PRO 151 N -2.71 3.34 -0.13 -1.68 0.02 -1.26 -4.20 135.00 128.37 2dgk s PRO 151 Ca 0.27 2.32 0.16 0.00 0.02 0.00 0.00 61.00 63.77 2dgk s PRO 151 Cb -0.10 -2.41 0.30 0.00 0.02 0.00 0.00 34.50 32.30 2dgk s PRO 151 CO 0.19 -1.06 1.15 0.25 -0.33 0.00 0.00 177.00 177.21 2dgk n THR 152 N -0.72 1.78 0.31 0.99 -2.24 -1.26 -4.74 114.28 108.40 2dgk n THR 152 Ca 0.08 -2.27 0.12 0.00 -2.27 0.00 0.00 64.05 59.71 2dgk n THR 152 Cb 0.44 -0.17 0.25 0.00 -2.10 0.00 0.00 70.33 68.75 2dgk n THR 152 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 2dgk n ASP 153 N -1.24 3.32 -2.75 3.42 5.75 -1.26 -4.50 116.55 119.29 2dgk n ASP 153 Ca 0.15 -1.97 -0.19 0.00 -0.01 0.00 0.00 54.79 52.77 2dgk n ASP 153 Cb 0.66 -0.28 -0.00 0.00 -1.03 0.00 0.00 41.12 40.47 2dgk n ASP 153 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 2dgk n LYS 154 N 1.38 2.13 -2.18 0.11 5.02 -1.26 -5.10 118.16 118.26 2dgk n LYS 154 Ca 0.20 -3.91 -0.38 0.00 -2.02 0.00 0.00 58.31 52.19 2dgk n LYS 154 Cb 0.57 -1.79 -0.01 0.00 -0.02 0.00 0.00 35.03 33.79 2dgk n LYS 154 CO 0.00 0.00 0.00 -2.14 -0.52 0.00 0.00 177.40 174.74 2dgk s PRO 155 N -3.17 3.85 0.07 1.97 0.02 -1.26 -4.80 135.00 131.67 2dgk s PRO 155 Ca 0.39 1.93 0.01 0.00 0.02 0.00 0.00 61.00 63.35 2dgk s PRO 155 Cb 0.39 -2.57 -0.04 0.00 0.02 0.00 0.00 34.50 32.31 2dgk s PRO 155 CO -0.08 -0.52 -0.05 0.54 -0.33 0.00 0.00 177.00 176.56 2dgk s ASN 156 N -1.10 0.84 -0.07 2.53 2.20 -0.15 -1.10 114.94 118.09 2dgk s ASN 156 Ca 0.61 -0.91 0.02 0.00 -0.94 0.00 0.00 52.86 51.64 2dgk s ASN 156 Cb -0.33 0.12 0.01 0.00 -2.00 0.00 0.00 41.25 39.06 2dgk s ASN 156 CO 0.40 -0.46 -0.11 -0.22 -2.94 0.00 0.00 177.10 173.77 2dgk s LEU 157 N -2.70 1.58 -0.20 3.54 2.96 0.88 -0.84 118.68 123.90 2dgk s LEU 157 Ca 0.05 -0.29 -0.10 0.00 -0.22 0.00 0.00 54.13 53.57 2dgk s LEU 157 Cb 0.03 -0.82 -0.05 0.00 0.50 0.00 0.00 46.19 45.85 2dgk s LEU 157 CO -0.05 0.01 0.14 -0.69 -1.32 0.00 0.00 176.35 174.44 2dgk s VAL 158 N 0.79 5.40 0.38 1.68 1.01 -1.04 0.06 120.40 128.67 2dgk s VAL 158 Ca -0.12 0.21 -0.13 0.00 0.00 0.00 0.00 61.98 61.94 2dgk s VAL 158 Cb -0.15 -3.48 0.04 0.00 0.00 0.00 0.00 36.38 32.79 2dgk s VAL 158 CO 0.02 0.42 0.72 0.00 0.00 0.00 0.00 175.10 176.26 2dgk n GLY 160 N -0.54 2.86 3.00 0.00 0.00 -1.26 -0.72 105.19 108.54 2dgk n GLY 160 Ca -0.06 -1.83 -0.42 0.00 0.00 0.00 0.00 46.02 43.71 2dgk n GLY 160 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2dgk n PRO 161 N 0.00 1.76 -1.18 1.61 -0.04 -1.26 -4.57 135.00 131.31 2dgk n PRO 161 Ca 0.00 -1.94 -0.31 0.00 -0.04 0.00 0.00 63.50 61.20 2dgk n PRO 161 Cb 0.00 -2.95 0.10 0.00 -0.04 0.00 0.00 33.50 30.62 2dgk n PRO 161 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 2dgk s VAL 162 N 4.61 2.99 0.75 0.52 -7.23 -1.26 -4.62 120.40 116.15 2dgk s VAL 162 Ca 0.55 0.34 -0.11 0.00 -1.81 0.00 0.00 61.98 60.95 2dgk s VAL 162 Cb 0.14 -2.73 0.04 0.00 0.56 0.00 0.00 36.38 34.39 2dgk s VAL 162 CO 0.08 -0.40 1.08 -1.58 -0.31 0.00 0.00 175.10 173.96 2dgk s GLN 163 N -4.73 2.50 0.59 4.82 -0.44 -1.26 -4.91 119.66 116.23 2dgk s GLN 163 Ca 0.63 0.94 0.29 0.00 -2.50 0.00 0.00 55.36 54.72 2dgk s GLN 163 Cb -0.19 -1.94 1.55 0.00 -1.64 0.00 0.00 33.01 30.78 2dgk s GLN 163 CO 0.55 -1.40 1.98 0.97 0.50 0.00 0.00 175.29 177.88 2dgk h ILE 164 N -0.94 0.40 -0.05 -2.34 2.10 -1.93 -2.16 117.51 112.59 2dgk h ILE 164 Ca -0.45 0.00 0.02 0.00 1.08 0.00 0.00 64.86 65.51 2dgk h ILE 164 Cb 1.23 0.70 -0.00 0.00 -1.09 0.00 0.00 36.82 37.66 2dgk h ILE 164 CO 0.56 0.00 0.05 0.00 -1.08 0.00 0.00 178.15 177.68 2dgk h TRP 166 N 0.00 0.00 -0.19 0.00 4.06 -1.75 -1.12 115.95 116.96 2dgk h TRP 166 Ca 0.03 0.00 -0.16 0.00 2.06 0.00 0.00 58.89 60.81 2dgk h TRP 166 Cb 0.13 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 28.28 2dgk h TRP 166 CO 0.00 0.63 -0.56 0.45 -3.56 0.00 0.00 178.44 175.39 2dgk h HIS 167 N 0.00 0.72 -0.21 0.49 3.86 -1.13 -1.47 115.15 117.40 2dgk h HIS 167 Ca -0.01 -0.26 -0.02 0.00 -1.16 0.00 0.00 60.37 58.92 2dgk h HIS 167 Cb 1.48 -0.13 -0.01 0.00 1.06 0.00 0.00 27.41 29.81 2dgk h HIS 167 CO 0.00 1.00 0.04 0.87 0.86 0.00 0.00 177.93 180.70 2dgk h LYS 168 N 0.44 0.34 -0.15 2.45 1.57 -1.08 -2.00 116.57 118.13 2dgk h LYS 168 Ca 0.01 -0.09 0.04 0.00 -1.87 0.00 0.00 60.65 58.74 2dgk h LYS 168 Cb 1.11 -0.04 -0.04 0.00 0.08 0.00 0.00 32.23 33.34 2dgk h LYS 168 CO 0.11 0.48 -0.08 0.35 -0.57 0.00 0.00 179.45 179.73 2dgk h PHE 169 N 0.15 -0.19 -0.47 -1.35 3.57 -1.06 0.23 116.94 117.82 2dgk h PHE 169 Ca 0.06 0.02 0.06 0.00 3.53 0.00 0.00 57.97 61.64 2dgk h PHE 169 Cb 0.29 0.11 -0.05 0.00 2.79 0.00 0.00 35.95 39.09 2dgk h PHE 169 CO 0.01 -0.13 0.19 0.00 -2.23 0.00 0.00 178.31 176.16 2dgk h ALA 170 N 1.06 0.58 0.19 2.41 0.00 -1.20 0.16 119.26 122.47 2dgk h ALA 170 Ca 0.09 0.05 -0.01 0.00 0.00 0.00 0.00 54.91 55.04 2dgk h ALA 170 Cb 0.20 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.00 2dgk h ALA 170 CO -0.20 -0.19 -0.09 -0.09 0.00 0.00 0.00 179.25 178.68 2dgk h ARG 171 N 0.38 -0.25 -0.20 0.00 9.65 -0.95 0.17 114.38 123.18 2dgk h ARG 171 Ca 0.22 0.02 -0.05 0.00 -1.10 0.00 0.00 59.98 59.06 2dgk h ARG 171 Cb 0.20 0.06 -0.01 0.00 -1.39 0.00 0.00 29.97 28.82 2dgk h ARG 171 CO -0.20 0.08 -0.10 1.88 2.80 0.00 0.00 179.97 184.43 2dgk h TYR 172 N -0.61 0.34 -0.39 2.20 0.05 -0.42 -3.04 116.97 115.10 2dgk h TYR 172 Ca -0.03 -0.04 0.00 0.00 0.05 0.00 0.00 58.73 58.72 2dgk h TYR 172 Cb 0.45 -0.10 0.00 0.00 1.01 0.00 0.00 36.73 38.09 2dgk h TYR 172 CO 0.03 0.42 0.00 0.91 -1.05 0.00 0.00 178.16 178.48 2dgk n TRP 173 N -4.27 1.29 -3.91 4.88 8.01 0.03 -4.99 117.44 118.49 2dgk n TRP 173 Ca -0.00 -0.79 -0.31 0.00 -1.31 0.00 0.00 57.50 55.08 2dgk n TRP 173 Cb 0.27 -0.35 0.00 0.00 -2.01 0.00 0.00 31.31 29.22 2dgk n TRP 173 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 177.69 176.43 2dgk n ASP 174 N 0.00 -2.53 -4.29 -0.99 8.00 -0.83 -4.98 116.55 110.94 2dgk n ASP 174 Ca 0.23 -1.08 -0.32 0.00 0.71 0.00 0.00 54.79 54.33 2dgk n ASP 174 Cb 0.96 -2.82 -0.16 0.00 -0.02 0.00 0.00 41.12 39.08 2dgk n ASP 174 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 2dgk s VAL 175 N -3.76 2.28 -0.19 2.53 1.01 -0.01 -4.71 120.40 117.55 2dgk s VAL 175 Ca 0.24 -0.97 -0.29 0.00 0.00 0.00 0.00 61.98 60.96 2dgk s VAL 175 Cb -0.10 -1.87 -0.02 0.00 0.00 0.00 0.00 36.38 34.39 2dgk s VAL 175 CO 0.90 0.56 1.42 -0.70 0.00 0.00 0.00 175.10 177.28 2dgk s GLU 176 N 0.01 4.06 -0.28 2.72 2.12 -0.26 -4.49 118.70 122.56 2dgk s GLU 176 Ca -0.08 1.66 -0.24 0.00 0.36 0.00 0.00 54.97 56.67 2dgk s GLU 176 Cb -0.15 -3.89 -0.00 0.00 0.26 0.00 0.00 34.13 30.35 2dgk s GLU 176 CO 0.05 -0.95 0.82 -1.17 -0.54 0.00 0.00 175.26 173.47 2dgk s LEU 177 N 4.17 4.07 -0.84 2.70 2.96 -1.26 -0.09 118.68 130.39 2dgk s LEU 177 Ca 0.62 0.83 -0.06 0.00 -0.22 0.00 0.00 54.13 55.30 2dgk s LEU 177 Cb -0.23 -3.15 0.21 0.00 0.50 0.00 0.00 46.19 43.52 2dgk s LEU 177 CO 0.22 -0.60 0.74 -0.13 -1.32 0.00 0.00 176.35 175.26 2dgk s ARG 178 N 2.96 3.29 -0.37 1.98 0.52 0.11 -4.93 118.95 122.52 2dgk s ARG 178 Ca 0.34 -2.90 -0.23 0.00 -0.52 0.00 0.00 55.73 52.42 2dgk s ARG 178 Cb -0.14 -4.08 0.01 0.00 0.52 0.00 0.00 34.95 31.25 2dgk s ARG 178 CO 0.11 -1.24 0.76 -2.00 0.02 0.00 0.00 175.30 172.95 2dgk s GLU 179 N -0.68 3.70 -0.01 3.54 2.12 -1.26 -2.13 118.70 123.98 2dgk s GLU 179 Ca 0.23 0.22 -0.30 0.00 0.36 0.00 0.00 54.97 55.49 2dgk s GLU 179 Cb -0.12 -3.83 -0.07 0.00 0.26 0.00 0.00 34.13 30.38 2dgk s GLU 179 CO -0.08 -0.87 1.68 0.42 -0.54 0.00 0.00 175.26 175.87 2dgk s ILE 180 N 3.07 3.38 0.53 -3.70 1.09 0.10 -4.94 121.20 120.73 2dgk s ILE 180 Ca 0.30 0.58 -0.19 0.00 -1.10 0.00 0.00 60.65 60.24 2dgk s ILE 180 Cb -0.13 -3.38 -0.06 0.00 -1.06 0.00 0.00 42.46 37.83 2dgk s ILE 180 CO 0.17 -0.04 1.09 -2.16 -0.10 0.00 0.00 174.94 173.91 2dgk s PRO 181 N 3.66 3.49 0.52 2.79 0.04 -1.26 -4.28 135.00 139.96 2dgk s PRO 181 Ca 0.75 1.50 -0.19 0.00 0.04 0.00 0.00 61.00 63.10 2dgk s PRO 181 Cb -0.36 -2.04 -0.07 0.00 0.04 0.00 0.00 34.50 32.07 2dgk s PRO 181 CO 0.32 -0.71 1.04 -1.64 0.04 0.00 0.00 177.00 176.04 2dgk s MET 182 N -3.33 3.68 0.01 4.56 -1.94 -1.26 -4.75 119.30 116.28 2dgk s MET 182 Ca 0.70 1.29 -0.23 0.00 -1.71 0.00 0.00 55.69 55.74 2dgk s MET 182 Cb -0.21 -2.08 0.05 0.00 2.01 0.00 0.00 34.83 34.60 2dgk s MET 182 CO 0.25 -0.52 0.51 -0.98 -0.01 0.00 0.00 175.02 174.28 2dgk s ARG 183 N -3.51 0.97 -0.21 2.03 1.70 -0.78 0.35 118.95 119.50 2dgk s ARG 183 Ca 0.66 -0.13 -0.42 0.00 -0.47 0.00 0.00 55.73 55.37 2dgk s ARG 183 Cb -0.16 0.45 -0.18 0.00 -0.57 0.00 0.00 34.95 34.49 2dgk s ARG 183 CO 0.25 -0.33 1.46 -2.30 -1.08 0.00 0.00 175.30 173.31 2dgk n PRO 184 N 0.67 0.52 -0.83 3.89 -0.02 -1.26 -0.22 135.00 137.75 2dgk n PRO 184 Ca -0.19 0.19 0.00 0.00 -2.02 0.00 0.00 63.50 61.48 2dgk n PRO 184 Cb 0.59 -1.77 0.00 0.00 -0.02 0.00 0.00 33.50 32.30 2dgk n PRO 184 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2dgk n GLY 185 N 3.18 1.07 2.70 -1.23 0.00 -1.26 -4.89 105.19 104.76 2dgk n GLY 185 Ca 0.25 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.19 2dgk n GLY 185 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 2dgk n GLN 186 N -2.00 0.60 -1.01 1.61 7.27 0.69 -5.01 117.38 119.53 2dgk n GLN 186 Ca 0.00 -2.08 -0.20 0.00 0.07 0.00 0.00 57.00 54.79 2dgk n GLN 186 Cb 0.00 -1.47 0.03 0.00 2.41 0.00 0.00 30.24 31.21 2dgk n GLN 186 CO 0.00 0.00 0.00 1.28 0.07 0.00 0.00 177.06 178.41 2dgk n LEU 187 N 2.42 6.63 -3.78 1.69 4.77 -1.22 -1.86 117.00 125.64 2dgk n LEU 187 Ca 0.16 -3.50 -0.05 0.00 -0.03 0.00 0.00 56.01 52.59 2dgk n LEU 187 Cb 0.58 -1.07 -0.02 0.00 -2.33 0.00 0.00 43.42 40.58 2dgk n LEU 187 CO 0.02 1.31 0.62 0.72 -1.33 0.00 0.00 177.39 178.72 2dgk s PHE 188 N -2.06 -0.17 -0.44 -1.77 -0.71 -1.26 -4.84 117.98 106.73 2dgk s PHE 188 Ca 0.38 -0.19 -0.29 0.00 -1.04 0.00 0.00 56.93 55.79 2dgk s PHE 188 Cb 0.29 0.66 0.02 0.00 -1.21 0.00 0.00 43.02 42.79 2dgk s PHE 188 CO -0.03 -0.98 1.17 1.41 -1.34 0.00 0.00 175.22 175.46 2dgk s MET 189 N -3.53 3.76 0.26 1.99 -2.45 -1.26 -4.91 119.30 113.15 2dgk s MET 189 Ca 0.11 0.71 -0.04 0.00 -1.25 0.00 0.00 55.69 55.22 2dgk s MET 189 Cb -0.03 -3.90 -0.05 0.00 1.25 0.00 0.00 34.83 32.10 2dgk s MET 189 CO 0.03 -1.33 0.51 0.16 1.05 0.00 0.00 175.02 175.44 2dgk s ASP 190 N 2.56 6.44 0.24 1.11 -4.77 -1.26 -4.94 116.67 116.05 2dgk s ASP 190 Ca 0.50 0.64 -0.06 0.00 -3.30 0.00 0.00 52.55 50.32 2dgk s ASP 190 Cb -0.09 -2.11 0.44 0.00 -1.09 0.00 0.00 42.92 40.07 2dgk s ASP 190 CO 0.29 -0.15 1.68 -0.65 0.70 0.00 0.00 175.17 177.05 2dgk h PRO 191 N 1.82 0.23 0.37 2.11 0.11 -1.95 -1.25 132.00 133.44 2dgk h PRO 191 Ca -0.48 -0.01 -0.02 0.00 0.11 0.00 0.00 66.00 65.60 2dgk h PRO 191 Cb 1.19 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.25 2dgk h PRO 191 CO 0.67 0.15 -0.19 -0.22 -0.21 0.00 0.00 178.00 178.19 2dgk h LYS 192 N 0.24 -0.51 0.00 1.05 3.64 -1.97 -1.73 116.57 117.28 2dgk h LYS 192 Ca 0.40 0.03 -0.06 0.00 -1.27 0.00 0.00 60.65 59.76 2dgk h LYS 192 Cb 0.69 0.11 -0.01 0.00 -0.41 0.00 0.00 32.23 32.62 2dgk h LYS 192 CO -0.52 -0.34 -0.27 0.00 -2.27 0.00 0.00 179.45 176.04 2dgk h ARG 193 N -0.52 0.00 0.54 1.90 3.08 -1.94 -2.36 114.38 115.08 2dgk h ARG 193 Ca -0.05 0.00 -0.03 0.00 0.07 0.00 0.00 59.98 59.98 2dgk h ARG 193 Cb 0.41 0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.47 2dgk h ARG 193 CO 0.07 0.27 -0.26 1.98 -1.07 0.00 0.00 179.97 180.96 2dgk h MET 194 N 0.00 -0.70 -0.93 0.04 4.05 -1.00 -2.97 114.93 113.43 2dgk h MET 194 Ca -0.00 0.05 0.10 0.00 -0.28 0.00 0.00 59.70 59.57 2dgk h MET 194 Cb 0.75 0.16 -0.08 0.00 -0.80 0.00 0.00 31.60 31.63 2dgk h MET 194 CO 0.04 -0.41 0.57 0.82 0.23 0.00 0.00 176.91 178.16 2dgk h ILE 195 N -0.89 0.94 0.00 1.77 1.08 -1.21 -0.01 117.51 119.20 2dgk h ILE 195 Ca -0.07 -0.32 0.00 0.00 -0.39 0.00 0.00 64.86 64.07 2dgk h ILE 195 Cb 0.62 -0.08 0.00 0.00 -3.07 0.00 0.00 36.82 34.29 2dgk h ILE 195 CO 0.12 0.17 0.00 -0.33 -0.69 0.00 0.00 178.15 177.42 2dgk h GLU 196 N 0.94 0.00 0.00 2.37 5.08 -1.33 -1.52 114.58 120.13 2dgk h GLU 196 Ca 0.45 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.81 2dgk h GLU 196 Cb 0.38 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.63 2dgk h GLU 196 CO -0.24 0.00 -1.38 0.00 -1.00 0.00 0.00 179.01 176.39 2dgk n ALA 197 N -1.86 4.00 -1.92 3.43 0.00 -0.05 -4.98 120.51 119.13 2dgk n ALA 197 Ca -0.01 -0.56 -0.38 0.00 0.00 0.00 0.00 53.44 52.49 2dgk n ALA 197 Cb 0.09 -0.76 -0.06 0.00 0.00 0.00 0.00 19.45 18.72 2dgk n ALA 197 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2dgk n ASP 199 N 1.00 -1.74 0.00 0.00 5.68 -1.26 -5.01 116.55 115.22 2dgk n ASP 199 Ca -0.02 -2.41 0.02 0.00 -0.50 0.00 0.00 54.79 51.87 2dgk n ASP 199 Cb 0.50 2.96 0.07 0.00 -1.14 0.00 0.00 41.12 43.51 2dgk n ASP 199 CO 0.00 0.00 0.00 -1.84 -1.33 0.00 0.00 177.20 174.03 2dgk n GLU 200 N -0.46 0.00 0.00 0.11 0.28 -1.26 -1.40 120.64 117.91 2dgk n GLU 200 Ca -0.05 0.45 0.12 0.00 -0.16 0.00 0.00 57.16 57.52 2dgk n GLU 200 Cb 0.50 -1.51 0.21 0.00 1.43 0.00 0.00 31.44 32.07 2dgk n GLU 200 CO 0.00 0.00 0.00 0.09 -0.16 0.00 0.00 177.13 177.06 2dgk n ASN 201 N -1.51 2.61 -4.64 -1.84 3.02 -1.26 -4.89 115.26 106.76 2dgk n ASN 201 Ca 0.01 -1.87 -0.43 0.00 -0.03 0.00 0.00 54.58 52.26 2dgk n ASN 201 Cb 0.04 0.00 -0.02 0.00 -0.61 0.00 0.00 39.78 39.19 2dgk n ASN 201 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 2dgk s THR 202 N -2.01 4.30 -0.01 3.41 2.01 -0.49 -0.97 115.64 121.87 2dgk s THR 202 Ca 0.30 1.49 0.26 0.00 0.31 0.00 0.00 61.69 64.05 2dgk s THR 202 Cb 0.20 -4.26 0.29 0.00 0.01 0.00 0.00 72.50 68.74 2dgk s THR 202 CO 0.31 -0.46 1.80 0.16 -0.69 0.00 0.00 174.62 175.74 2dgk h ILE 203 N 5.84 0.31 0.00 1.82 3.07 -1.32 -3.48 117.51 123.74 2dgk h ILE 203 Ca -0.24 -1.02 0.00 0.00 1.55 0.00 0.00 64.86 65.15 2dgk h ILE 203 Cb 1.08 1.80 0.00 0.00 -0.27 0.00 0.00 36.82 39.43 2dgk h ILE 203 CO 1.03 0.14 0.00 0.61 -1.05 0.00 0.00 178.15 178.88 2dgk n GLY 204 N 0.40 -0.68 3.24 0.16 0.00 -1.26 -4.62 105.19 102.43 2dgk n GLY 204 Ca 0.01 -1.15 -0.30 0.00 0.00 0.00 0.00 46.02 44.58 2dgk n GLY 204 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2dgk s VAL 205 N -2.00 1.90 -0.42 1.61 1.01 -0.34 -2.51 120.40 119.66 2dgk s VAL 205 Ca 0.00 -0.98 0.01 0.00 0.00 0.00 0.00 61.98 61.00 2dgk s VAL 205 Cb 0.00 -1.61 0.11 0.00 0.00 0.00 0.00 36.38 34.89 2dgk s VAL 205 CO 0.00 0.53 0.18 -0.69 0.00 0.00 0.00 175.10 175.12 2dgk s VAL 206 N -0.16 2.86 0.25 2.92 1.01 -0.10 -2.30 120.40 124.89 2dgk s VAL 206 Ca -0.02 -2.41 -0.27 0.00 0.00 0.00 0.00 61.98 59.28 2dgk s VAL 206 Cb -0.13 -3.00 -0.09 0.00 0.00 0.00 0.00 36.38 33.16 2dgk s VAL 206 CO 0.03 -0.69 0.89 -2.84 0.00 0.00 0.00 175.10 172.49 2dgk s PRO 207 N 0.76 4.65 -0.40 2.72 0.02 -1.24 -4.06 135.00 137.44 2dgk s PRO 207 Ca 0.11 1.31 -0.11 0.00 0.02 0.00 0.00 61.00 62.33 2dgk s PRO 207 Cb -0.21 -3.07 0.05 0.00 0.02 0.00 0.00 34.50 31.28 2dgk s PRO 207 CO -0.05 0.43 0.25 0.99 -0.33 0.00 0.00 177.00 178.29 2dgk s THR 208 N -1.36 4.64 -1.42 0.99 2.01 -1.26 -1.76 115.64 117.47 2dgk s THR 208 Ca 0.43 -1.00 -0.12 0.00 0.31 0.00 0.00 61.69 61.32 2dgk s THR 208 Cb -0.22 -3.67 0.07 0.00 0.01 0.00 0.00 72.50 68.69 2dgk s THR 208 CO 0.27 -0.35 2.23 0.33 -0.69 0.00 0.00 174.62 176.41 2dgk n PHE 209 N 5.02 3.15 0.00 4.92 7.35 -0.16 -1.99 117.46 135.75 2dgk n PHE 209 Ca -0.11 -2.93 0.00 0.00 -0.76 0.00 0.00 57.45 53.65 2dgk n PHE 209 Cb 0.45 -2.32 0.00 0.00 0.35 0.00 0.00 39.48 37.96 2dgk n PHE 209 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 2dgk n GLY 210 N 3.48 0.64 3.73 7.13 0.00 -1.24 -2.19 105.19 116.74 2dgk n GLY 210 Ca 0.53 -0.34 -0.42 0.00 0.00 0.00 0.00 46.02 45.79 2dgk n GLY 210 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2dgk s VAL 211 N 0.00 2.52 0.16 1.61 1.01 0.27 -4.73 120.40 121.23 2dgk s VAL 211 Ca 0.00 0.40 -0.16 0.00 0.00 0.00 0.00 61.98 62.22 2dgk s VAL 211 Cb 0.00 -3.25 0.02 0.00 0.00 0.00 0.00 36.38 33.15 2dgk s VAL 211 CO 0.00 0.04 1.77 0.74 0.00 0.00 0.00 175.10 177.66 2dgk h THR 212 N 3.79 0.96 -0.58 3.92 2.02 -1.90 0.43 112.91 121.54 2dgk h THR 212 Ca -0.44 -0.13 -0.02 0.00 0.77 0.00 0.00 66.41 66.59 2dgk h THR 212 Cb 1.21 0.56 -0.03 0.00 -1.74 0.00 0.00 68.15 68.15 2dgk h THR 212 CO 0.86 0.07 0.27 1.88 0.37 0.00 0.00 175.52 178.97 2dgk h TYR 213 N 0.38 0.82 0.00 3.16 0.05 -1.87 -3.37 116.97 116.14 2dgk h TYR 213 Ca 0.16 -0.03 0.00 0.00 0.05 0.00 0.00 58.73 58.91 2dgk h TYR 213 Cb 0.08 -0.26 0.00 0.00 1.01 0.00 0.00 36.73 37.56 2dgk h TYR 213 CO -0.11 0.61 -0.94 0.25 -1.05 0.00 0.00 178.16 176.92 2dgk n THR 214 N -4.35 0.00 -0.42 -2.88 -2.24 -1.17 -4.91 114.28 98.32 2dgk n THR 214 Ca 0.05 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.83 2dgk n THR 214 Cb 0.14 0.18 0.00 0.00 -2.10 0.00 0.00 70.33 68.55 2dgk n THR 214 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2dgk n GLY 215 N 2.46 0.95 3.83 3.38 0.00 0.15 -4.59 105.19 111.37 2dgk n GLY 215 Ca 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.67 2dgk n GLY 215 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2dgk s ASN 216 N -3.01 6.93 0.18 1.61 0.01 -1.26 -0.80 114.94 118.60 2dgk s ASN 216 Ca 0.00 1.34 -0.30 0.00 -0.71 0.00 0.00 52.86 53.19 2dgk s ASN 216 Cb 0.00 -2.39 -0.08 0.00 0.41 0.00 0.00 41.25 39.19 2dgk s ASN 216 CO 0.00 -0.06 0.95 -0.31 -1.51 0.00 0.00 177.10 176.17 2dgk s TYR 217 N -1.71 3.91 -0.42 2.20 2.02 0.41 -0.57 117.35 123.20 2dgk s TYR 217 Ca 0.47 1.87 -0.17 0.00 -0.37 0.00 0.00 57.07 58.87 2dgk s TYR 217 Cb -0.14 -3.02 0.02 0.00 -0.40 0.00 0.00 41.96 38.43 2dgk s TYR 217 CO 0.19 0.34 0.40 -2.00 -1.57 0.00 0.00 175.55 172.91 2dgk s GLU 218 N -0.66 3.06 -0.15 -0.62 2.12 -0.84 -4.87 118.70 116.73 2dgk s GLU 218 Ca 0.44 -0.84 -0.29 0.00 0.36 0.00 0.00 54.97 54.63 2dgk s GLU 218 Cb -0.25 -3.97 -0.03 0.00 0.26 0.00 0.00 34.13 30.14 2dgk s GLU 218 CO 0.31 -0.83 1.42 -0.06 -0.54 0.00 0.00 175.26 175.56 2dgk s PHE 219 N 2.01 2.49 0.28 5.30 0.08 -1.26 -4.43 117.98 122.45 2dgk s PHE 219 Ca 0.10 0.70 0.05 0.00 0.12 0.00 0.00 56.93 57.90 2dgk s PHE 219 Cb -0.18 -3.72 0.42 0.00 -0.57 0.00 0.00 43.02 38.98 2dgk s PHE 219 CO 0.13 -2.49 1.69 -1.35 -0.10 0.00 0.00 175.22 173.10 2dgk h PRO 220 N 8.99 0.31 -0.32 0.24 0.11 -1.89 -3.34 132.00 136.10 2dgk h PRO 220 Ca -0.31 -0.14 0.04 0.00 0.11 0.00 0.00 66.00 65.70 2dgk h PRO 220 Cb 1.13 -0.00 -0.07 0.00 0.11 0.00 0.00 31.00 32.17 2dgk h PRO 220 CO 0.97 0.66 -0.47 0.37 -0.21 0.00 0.00 178.00 179.32 2dgk h GLN 221 N 0.26 -0.34 -0.80 1.05 5.75 -1.92 0.43 115.11 119.54 2dgk h GLN 221 Ca 0.03 0.02 0.04 0.00 -0.15 0.00 0.00 58.65 58.59 2dgk h GLN 221 Cb 0.80 0.08 -0.05 0.00 1.07 0.00 0.00 27.48 29.38 2dgk h GLN 221 CO 0.06 -0.23 0.53 -1.35 -2.65 0.00 0.00 178.83 175.20 2dgk h PRO 222 N -0.35 0.94 -0.33 -2.39 0.11 -1.94 -1.49 132.00 126.55 2dgk h PRO 222 Ca 0.06 -0.06 -0.10 0.00 0.11 0.00 0.00 66.00 66.01 2dgk h PRO 222 Cb 0.51 -0.21 -0.01 0.00 0.11 0.00 0.00 31.00 31.39 2dgk h PRO 222 CO -0.48 0.62 -0.22 -0.07 -0.21 0.00 0.00 178.00 177.64 2dgk h LEU 223 N 0.97 0.64 -0.67 2.35 3.38 -1.47 -2.37 115.31 118.14 2dgk h LEU 223 Ca 0.33 -0.22 -0.08 0.00 0.09 0.00 0.00 57.88 57.99 2dgk h LEU 223 Cb 0.08 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 40.63 2dgk h LEU 223 CO -0.10 0.85 0.09 -0.74 0.09 0.00 0.00 178.44 178.64 2dgk h HIS 224 N 0.56 1.20 -0.60 1.13 2.76 0.81 -1.37 115.15 119.64 2dgk h HIS 224 Ca 0.08 -0.17 -0.08 0.00 -2.20 0.00 0.00 60.37 58.00 2dgk h HIS 224 Cb 0.68 -0.32 -0.02 0.00 1.55 0.00 0.00 27.41 29.29 2dgk h HIS 224 CO 0.03 1.00 0.06 -0.44 -1.30 0.00 0.00 177.93 177.29 2dgk h ASP 225 N 1.04 0.96 -0.35 3.26 3.32 -1.17 -0.60 116.42 122.88 2dgk h ASP 225 Ca 0.20 -0.23 -0.06 0.00 0.02 0.00 0.00 57.03 56.96 2dgk h ASP 225 Cb 0.47 -0.25 -0.02 0.00 0.22 0.00 0.00 39.33 39.74 2dgk h ASP 225 CO 0.02 0.98 0.03 0.00 -1.72 0.00 0.00 179.24 178.55 2dgk h ALA 226 N 1.13 1.25 -0.01 3.45 0.00 -1.01 -1.61 119.26 122.46 2dgk h ALA 226 Ca 0.18 -0.22 -0.16 0.00 0.00 0.00 0.00 54.91 54.71 2dgk h ALA 226 Cb 0.45 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.04 2dgk h ALA 226 CO 0.02 0.51 -0.72 -0.07 0.00 0.00 0.00 179.25 178.98 2dgk h LEU 227 N 0.65 0.12 -0.47 0.00 3.38 -0.79 -0.99 115.31 117.21 2dgk h LEU 227 Ca 0.14 -0.08 -0.04 0.00 0.09 0.00 0.00 57.88 57.98 2dgk h LEU 227 Cb 0.36 -0.04 -0.02 0.00 0.09 0.00 0.00 40.66 41.05 2dgk h LEU 227 CO 0.01 0.80 0.14 0.44 0.09 0.00 0.00 178.44 179.92 2dgk h ASP 228 N 0.06 0.69 -0.12 -0.43 3.32 -0.48 -2.09 116.42 117.37 2dgk h ASP 228 Ca -0.02 -0.21 -0.12 0.00 0.02 0.00 0.00 57.03 56.70 2dgk h ASP 228 Cb 1.28 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 40.63 2dgk h ASP 228 CO 0.10 0.72 -0.34 0.50 -1.72 0.00 0.00 179.24 178.50 2dgk h LYS 229 N 0.63 0.62 -0.83 3.56 3.64 -1.23 -2.86 116.57 120.10 2dgk h LYS 229 Ca 0.15 -0.29 0.02 0.00 -1.27 0.00 0.00 60.65 59.26 2dgk h LYS 229 Cb 0.28 -0.01 -0.04 0.00 -0.41 0.00 0.00 32.23 32.05 2dgk h LYS 229 CO -0.00 0.87 0.55 0.35 -2.27 0.00 0.00 179.45 178.95 2dgk h PHE 230 N 0.52 1.02 0.00 1.91 3.57 -0.82 -0.61 116.94 122.53 2dgk h PHE 230 Ca 0.06 0.02 -0.12 0.00 3.53 0.00 0.00 57.97 61.46 2dgk h PHE 230 Cb 0.84 -0.34 -0.02 0.00 2.79 0.00 0.00 35.95 39.22 2dgk h PHE 230 CO 0.04 0.62 -0.58 0.37 -2.23 0.00 0.00 178.31 176.53 2dgk h GLN 231 N 1.08 0.00 -0.22 1.11 4.15 -1.23 -0.94 115.11 119.06 2dgk h GLN 231 Ca 0.31 0.00 -0.19 0.00 0.77 0.00 0.00 58.65 59.54 2dgk h GLN 231 Cb -0.06 0.00 0.00 0.00 0.21 0.00 0.00 27.48 27.64 2dgk h GLN 231 CO -0.08 0.58 -0.62 0.00 -1.93 0.00 0.00 178.83 176.78 2dgk h ALA 232 N 1.42 0.37 0.00 3.38 0.00 -1.09 0.48 119.26 123.82 2dgk h ALA 232 Ca -0.01 -0.54 0.00 0.00 0.00 0.00 0.00 54.91 54.36 2dgk h ALA 232 Cb 1.20 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.95 2dgk h ALA 232 CO 0.08 0.64 -0.43 -0.44 0.00 0.00 0.00 179.25 179.09 2dgk h ASP 233 N 0.56 0.00 0.00 0.00 3.32 -1.11 -3.40 116.42 115.79 2dgk h ASP 233 Ca -0.01 -0.06 0.00 0.00 0.02 0.00 0.00 57.03 56.98 2dgk h ASP 233 Cb 1.24 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.79 2dgk h ASP 233 CO 0.13 0.03 -0.37 0.35 -1.72 0.00 0.00 179.24 177.67 2dgk n THR 234 N -2.56 0.00 -0.89 0.35 -2.24 -0.36 -5.01 114.28 103.57 2dgk n THR 234 Ca 0.03 -0.05 0.00 0.00 -2.27 0.00 0.00 64.05 61.76 2dgk n THR 234 Cb 0.49 0.38 0.00 0.00 -2.10 0.00 0.00 70.33 69.10 2dgk n THR 234 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2dgk n GLY 235 N 1.01 1.10 3.64 3.38 0.00 0.17 -4.99 105.19 109.50 2dgk n GLY 235 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 2dgk n GLY 235 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2dgk s ILE 236 N -3.84 4.74 -0.50 -0.61 1.01 -1.26 -4.95 121.20 115.79 2dgk s ILE 236 Ca 0.00 1.71 -0.16 0.00 0.00 0.00 0.00 60.65 62.20 2dgk s ILE 236 Cb 0.00 -4.22 0.10 0.00 0.01 0.00 0.00 42.46 38.35 2dgk s ILE 236 CO 0.00 -0.18 0.44 -0.62 0.00 0.00 0.00 174.94 174.59 2dgk s ASP 237 N 1.36 6.17 -0.15 3.58 -1.08 -1.26 -3.62 116.67 121.67 2dgk s ASP 237 Ca 0.39 -1.54 -0.05 0.00 -0.52 0.00 0.00 52.55 50.83 2dgk s ASP 237 Cb -0.15 -2.20 -0.03 0.00 -1.46 0.00 0.00 42.92 39.08 2dgk s ASP 237 CO 0.08 -0.75 0.01 -0.63 0.52 0.00 0.00 175.17 174.41 2dgk s ILE 238 N 1.62 4.33 0.51 4.11 1.01 -1.26 -5.06 121.20 126.46 2dgk s ILE 238 Ca 0.04 -0.21 0.08 0.00 0.00 0.00 0.00 60.65 60.55 2dgk s ILE 238 Cb -0.27 -2.90 0.04 0.00 0.01 0.00 0.00 42.46 39.34 2dgk s ILE 238 CO 0.05 0.51 0.53 -1.81 0.00 0.00 0.00 174.94 174.22 2dgk s ASP 239 N 0.02 4.97 0.17 3.58 1.01 -1.26 -4.95 116.67 120.21 2dgk s ASP 239 Ca 0.03 -0.93 0.09 0.00 0.71 0.00 0.00 52.55 52.44 2dgk s ASP 239 Cb -0.13 0.04 -0.04 0.00 1.01 0.00 0.00 42.92 43.80 2dgk s ASP 239 CO 0.02 -1.04 -0.18 -0.04 0.21 0.00 0.00 175.17 174.14 2dgk s MET 240 N -4.37 1.29 -0.10 8.23 -1.94 0.17 -1.19 119.30 121.39 2dgk s MET 240 Ca 0.48 -1.43 0.00 0.00 -1.71 0.00 0.00 55.69 53.03 2dgk s MET 240 Cb -0.04 -1.33 0.02 0.00 2.01 0.00 0.00 34.83 35.50 2dgk s MET 240 CO 0.29 0.26 -0.08 -1.58 -0.01 0.00 0.00 175.02 173.91 2dgk s HIS 241 N -2.14 1.38 -0.22 -0.03 2.46 -0.97 -1.66 115.29 114.11 2dgk s HIS 241 Ca 0.17 -0.63 -0.19 0.00 0.47 0.00 0.00 55.06 54.87 2dgk s HIS 241 Cb -0.05 -1.14 -0.03 0.00 -0.13 0.00 0.00 32.58 31.23 2dgk s HIS 241 CO 0.07 -0.44 0.56 0.42 -2.47 0.00 0.00 174.74 172.88 2dgk s ILE 242 N 1.48 5.06 -0.79 0.89 -1.09 -0.46 -3.69 121.20 122.61 2dgk s ILE 242 Ca 0.00 1.02 -0.21 0.00 -2.23 0.00 0.00 60.65 59.23 2dgk s ILE 242 Cb -0.13 -3.87 0.10 0.00 -1.58 0.00 0.00 42.46 36.97 2dgk s ILE 242 CO -0.05 0.12 1.04 -0.62 -1.23 0.00 0.00 174.94 174.21 2dgk s ASP 243 N 1.28 6.38 -0.45 3.58 -1.08 -0.72 -1.79 116.67 123.88 2dgk s ASP 243 Ca 0.25 -1.49 0.04 0.00 -0.52 0.00 0.00 52.55 50.83 2dgk s ASP 243 Cb -0.16 -2.41 0.53 0.00 -1.46 0.00 0.00 42.92 39.42 2dgk s ASP 243 CO 0.09 -1.27 1.73 0.00 0.52 0.00 0.00 175.17 176.24 2dgk n ALA 244 N 7.20 5.39 -0.26 3.66 0.00 0.58 -0.99 120.51 136.09 2dgk n ALA 244 Ca 0.10 -3.27 0.03 0.00 0.00 0.00 0.00 53.44 50.29 2dgk n ALA 244 Cb 0.47 -1.19 0.08 0.00 0.00 0.00 0.00 19.45 18.81 2dgk n ALA 244 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2dgk n ALA 245 N -1.02 0.08 -0.12 0.00 0.00 -1.17 -0.69 120.51 117.60 2dgk n ALA 245 Ca 0.51 0.75 -0.25 0.00 0.00 0.00 0.00 53.44 54.45 2dgk n ALA 245 Cb 1.10 -0.42 -0.09 0.00 0.00 0.00 0.00 19.45 20.05 2dgk n ALA 245 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 2dgk n SER 246 N -5.12 1.73 0.21 0.00 3.41 -1.26 -0.92 113.62 111.68 2dgk n SER 246 Ca 0.10 0.27 0.13 0.00 -0.26 0.00 0.00 58.87 59.11 2dgk n SER 246 Cb 0.33 -0.69 0.74 0.00 -0.26 0.00 0.00 64.21 64.32 2dgk n SER 246 CO 0.00 0.00 0.00 1.23 -0.16 0.00 0.00 175.04 176.11 2dgk h GLY 247 N -0.74 0.00 1.44 5.00 0.00 -1.30 -2.97 103.07 104.51 2dgk h GLY 247 Ca -0.61 0.00 0.04 0.00 0.00 0.00 0.00 47.33 46.76 2dgk h GLY 247 CO -0.36 0.00 0.24 -1.33 0.00 0.00 0.00 176.54 175.09 2dgk h GLY 248 N 0.00 0.00 -0.94 4.60 0.00 -1.13 -1.24 103.07 104.35 2dgk h GLY 248 Ca 0.06 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.37 2dgk h GLY 248 CO -0.00 0.00 -0.03 0.69 0.00 0.00 0.00 176.54 177.20 2dgk n PHE 249 N -3.49 0.52 0.01 5.60 3.72 -1.12 -4.66 117.46 118.04 2dgk n PHE 249 Ca 0.01 -1.02 -0.00 0.00 -0.05 0.00 0.00 57.45 56.39 2dgk n PHE 249 Cb 0.35 -0.26 -0.00 0.00 -0.94 0.00 0.00 39.48 38.63 2dgk n PHE 249 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 176.76 177.99 2dgk n LEU 250 N -0.98 0.26 -0.32 4.37 4.77 -0.49 -4.74 117.00 119.86 2dgk n LEU 250 Ca 0.20 0.03 0.14 0.00 -0.03 0.00 0.00 56.01 56.35 2dgk n LEU 250 Cb 0.79 -0.09 0.32 0.00 -2.33 0.00 0.00 43.42 42.11 2dgk n LEU 250 CO 0.09 -0.56 1.10 0.00 -1.33 0.00 0.00 177.39 176.69 2dgk h ALA 251 N -0.04 1.54 -0.12 -1.18 0.00 -1.80 -0.00 119.26 117.65 2dgk h ALA 251 Ca 0.00 0.13 0.03 0.00 0.00 0.00 0.00 54.91 55.08 2dgk h ALA 251 Cb 0.00 0.06 -0.00 0.00 0.00 0.00 0.00 17.79 17.85 2dgk h ALA 251 CO 0.00 -0.26 0.17 -1.35 0.00 0.00 0.00 179.25 177.81 2dgk h PRO 252 N 0.52 0.00 0.00 0.00 0.11 -1.82 0.48 132.00 131.29 2dgk h PRO 252 Ca 0.57 0.00 -0.37 0.00 0.11 0.00 0.00 66.00 66.31 2dgk h PRO 252 Cb 1.04 0.00 -0.07 0.00 0.11 0.00 0.00 31.00 32.08 2dgk h PRO 252 CO -0.48 0.00 -2.41 1.19 -0.21 0.00 0.00 178.00 176.09 2dgk n PHE 253 N -3.61 0.00 0.53 0.65 3.72 -0.08 -4.35 117.46 114.32 2dgk n PHE 253 Ca 0.00 0.00 0.06 0.00 -0.05 0.00 0.00 57.45 57.46 2dgk n PHE 253 Cb 0.27 -0.96 -0.04 0.00 -0.94 0.00 0.00 39.48 37.81 2dgk n PHE 253 CO 0.00 0.00 0.00 1.33 -0.05 0.00 0.00 176.76 178.04 2dgk n VAL 254 N -3.18 0.00 -2.79 -4.37 0.24 -0.78 -4.69 118.33 102.75 2dgk n VAL 254 Ca -0.43 -0.28 -0.10 0.00 -2.04 0.00 0.00 64.34 61.49 2dgk n VAL 254 Cb 0.99 1.04 0.05 0.00 -1.47 0.00 0.00 33.84 34.46 2dgk n VAL 254 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2dgk n ALA 255 N -0.93 1.76 0.21 2.33 0.00 0.05 -4.88 120.51 119.05 2dgk n ALA 255 Ca 0.03 -2.37 0.18 0.00 0.00 0.00 0.00 53.44 51.28 2dgk n ALA 255 Cb 0.20 -0.99 0.79 0.00 0.00 0.00 0.00 19.45 19.44 2dgk n ALA 255 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 2dgk h PRO 256 N 2.72 0.00 0.00 0.00 0.13 -1.46 -1.44 132.00 131.94 2dgk h PRO 256 Ca -0.11 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.02 2dgk h PRO 256 Cb 1.16 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.29 2dgk h PRO 256 CO 0.27 0.00 -0.01 -0.25 -0.23 0.00 0.00 178.00 177.79 2dgk n ASP 257 N -3.36 0.08 -4.68 1.44 8.00 -1.26 -4.71 116.55 112.04 2dgk n ASP 257 Ca 0.03 0.50 -0.42 0.00 0.71 0.00 0.00 54.79 55.60 2dgk n ASP 257 Cb 0.49 -0.52 -0.03 0.00 -0.02 0.00 0.00 41.12 41.05 2dgk n ASP 257 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 2dgk s ILE 258 N -3.01 4.11 -0.59 0.53 1.01 -0.54 -4.95 121.20 117.75 2dgk s ILE 258 Ca 0.14 1.44 -0.18 0.00 0.00 0.00 0.00 60.65 62.05 2dgk s ILE 258 Cb 0.18 -3.92 0.12 0.00 0.01 0.00 0.00 42.46 38.85 2dgk s ILE 258 CO 0.54 -0.02 0.65 -0.69 0.00 0.00 0.00 174.94 175.42 2dgk s VAL 259 N 2.41 4.97 0.00 2.92 1.01 -1.26 -4.76 120.40 125.69 2dgk s VAL 259 Ca 0.58 -1.23 0.00 0.00 0.00 0.00 0.00 61.98 61.33 2dgk s VAL 259 Cb -0.26 -4.45 0.00 0.00 0.00 0.00 0.00 36.38 31.67 2dgk s VAL 259 CO 0.23 -1.05 0.00 -2.67 0.00 0.00 0.00 175.10 171.60 2dgk n TRP 260 N 5.90 0.00 -0.48 5.22 4.27 -1.26 -3.91 117.44 127.18 2dgk n TRP 260 Ca -0.09 0.00 0.00 0.00 -3.89 0.00 0.00 57.50 53.52 2dgk n TRP 260 Cb 0.42 0.00 0.00 0.00 -1.36 0.00 0.00 31.31 30.37 2dgk n TRP 260 CO 0.00 0.00 0.00 -0.40 -2.29 0.00 0.00 177.69 175.00 2dgk n ASP 261 N -0.63 0.00 0.00 -0.67 5.68 -1.26 -4.85 116.55 114.82 2dgk n ASP 261 Ca 0.00 0.00 0.05 0.00 -0.50 0.00 0.00 54.79 54.34 2dgk n ASP 261 Cb 0.00 0.00 0.22 0.00 -1.14 0.00 0.00 41.12 40.20 2dgk n ASP 261 CO 0.00 0.00 0.00 0.49 -1.33 0.00 0.00 177.20 176.36 2dgk n PHE 262 N 0.00 0.00 0.30 2.11 3.72 -1.04 -1.57 117.46 120.98 2dgk n PHE 262 Ca 0.00 0.00 0.19 0.00 -0.05 0.00 0.00 57.45 57.59 2dgk n PHE 262 Cb 0.00 -0.36 0.93 0.00 -0.94 0.00 0.00 39.48 39.12 2dgk n PHE 262 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2dgk h ARG 263 N 0.00 0.00 -5.39 -1.08 3.08 -1.78 -3.38 114.38 105.82 2dgk h ARG 263 Ca 0.00 0.00 -0.61 0.00 0.07 0.00 0.00 59.98 59.44 2dgk h ARG 263 Cb 0.11 0.00 -0.12 0.00 0.08 0.00 0.00 29.97 30.04 2dgk h ARG 263 CO 0.00 0.02 -0.10 -0.51 -1.07 0.00 0.00 179.97 178.31 2dgk s LEU 264 N -6.42 4.10 0.26 3.04 1.43 -0.61 -4.99 118.68 115.50 2dgk s LEU 264 Ca -0.02 0.53 -0.02 0.00 -1.03 0.00 0.00 54.13 53.59 2dgk s LEU 264 Cb 0.12 -2.60 0.54 0.00 0.03 0.00 0.00 46.19 44.28 2dgk s LEU 264 CO 0.49 -0.19 1.72 -0.65 0.23 0.00 0.00 176.35 177.95 2dgk h PRO 265 N 7.72 0.41 0.00 1.29 0.11 -1.87 -2.36 132.00 137.30 2dgk h PRO 265 Ca -0.32 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.76 2dgk h PRO 265 Cb 1.15 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 32.17 2dgk h PRO 265 CO 0.71 0.27 0.00 0.00 -0.21 0.00 0.00 178.00 178.77 2dgk h ARG 266 N 0.42 0.00 -6.28 1.05 3.08 -1.93 -3.41 114.38 107.30 2dgk h ARG 266 Ca 0.46 0.00 -0.53 0.00 0.07 0.00 0.00 59.98 59.98 2dgk h ARG 266 Cb 0.77 0.00 -0.06 0.00 0.08 0.00 0.00 29.97 30.76 2dgk h ARG 266 CO -0.46 0.00 1.16 0.08 -1.07 0.00 0.00 179.97 179.69 2dgk s VAL 267 N -3.34 3.65 -0.30 2.04 1.01 -0.89 -0.65 120.40 121.92 2dgk s VAL 267 Ca 0.05 0.49 0.23 0.00 0.00 0.00 0.00 61.98 62.74 2dgk s VAL 267 Cb 0.10 -4.39 -0.05 0.00 0.00 0.00 0.00 36.38 32.03 2dgk s VAL 267 CO 0.46 -1.23 1.00 0.29 0.00 0.00 0.00 175.10 175.62 2dgk n LYS 268 N 8.95 0.54 -3.52 2.72 4.76 -0.67 -4.71 118.16 126.23 2dgk n LYS 268 Ca 0.13 0.06 -0.14 0.00 -2.87 0.00 0.00 58.31 55.49 2dgk n LYS 268 Cb 0.50 -1.75 -0.05 0.00 -1.84 0.00 0.00 35.03 31.90 2dgk n LYS 268 CO 0.00 0.00 0.00 -1.54 -1.37 0.00 0.00 177.40 174.49 2dgk s SER 269 N -4.95 -0.52 -0.01 4.39 1.04 -1.24 -0.41 113.70 112.00 2dgk s SER 269 Ca -0.00 0.25 -0.02 0.00 0.48 0.00 0.00 55.95 56.66 2dgk s SER 269 Cb 0.11 0.53 -0.00 0.00 0.10 0.00 0.00 66.02 66.76 2dgk s SER 269 CO 0.80 -0.76 0.04 -0.63 0.98 0.00 0.00 173.24 173.67 2dgk s ILE 270 N -2.51 0.04 0.08 -1.02 1.01 -0.65 -1.36 121.20 116.80 2dgk s ILE 270 Ca -0.05 -0.37 0.04 0.00 0.00 0.00 0.00 60.65 60.27 2dgk s ILE 270 Cb -0.01 -0.19 -0.03 0.00 0.01 0.00 0.00 42.46 42.24 2dgk s ILE 270 CO -0.02 -0.20 -0.11 -0.94 0.00 0.00 0.00 174.94 173.67 2dgk s SER 271 N -0.61 1.45 0.16 3.58 1.04 -0.74 -1.30 113.70 117.28 2dgk s SER 271 Ca -0.07 -0.72 -0.21 0.00 0.48 0.00 0.00 55.95 55.44 2dgk s SER 271 Cb -0.04 -0.01 0.06 0.00 0.10 0.00 0.00 66.02 66.13 2dgk s SER 271 CO -0.00 -0.19 0.56 0.00 0.98 0.00 0.00 173.24 174.58 2dgk s ALA 272 N -1.93 -1.38 -0.37 5.32 0.00 -0.61 -0.31 121.76 122.49 2dgk s ALA 272 Ca 0.01 0.28 -0.14 0.00 0.00 0.00 0.00 51.96 52.10 2dgk s ALA 272 Cb -0.06 0.84 -0.00 0.00 0.00 0.00 0.00 23.12 23.90 2dgk s ALA 272 CO 0.01 -0.76 0.29 -1.12 0.00 0.00 0.00 175.76 174.18 2dgk s SER 273 N -2.78 6.10 0.36 0.00 0.01 -0.09 -0.73 113.70 116.56 2dgk s SER 273 Ca 0.03 -0.59 0.07 0.00 1.31 0.00 0.00 55.95 56.77 2dgk s SER 273 Cb -0.01 -2.16 0.67 0.00 0.21 0.00 0.00 66.02 64.74 2dgk s SER 273 CO -0.11 -0.34 1.87 1.23 0.41 0.00 0.00 173.24 176.30 2dgk h GLY 274 N 8.60 0.37 0.54 3.44 0.00 -1.05 -2.40 103.07 112.58 2dgk h GLY 274 Ca -0.29 -0.24 0.00 0.00 0.00 0.00 0.00 47.33 46.80 2dgk h GLY 274 CO 0.68 0.22 0.00 -2.39 0.00 0.00 0.00 176.54 175.06 2dgk n HIS 275 N -4.25 0.00 0.00 5.60 1.44 -1.01 -0.61 115.22 116.39 2dgk n HIS 275 Ca -0.00 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.71 2dgk n HIS 275 Cb 0.29 0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.40 2dgk n HIS 275 CO 0.00 0.00 0.00 1.63 -2.81 0.00 0.00 176.34 175.16 2dgk n LYS 276 N -0.77 0.00 0.00 -1.40 5.02 -0.90 -0.95 118.16 119.15 2dgk n LYS 276 Ca 0.12 0.00 0.11 0.00 -2.02 0.00 0.00 58.31 56.52 2dgk n LYS 276 Cb 0.05 0.00 0.64 0.00 -0.02 0.00 0.00 35.03 35.70 2dgk n LYS 276 CO 0.00 0.00 0.00 1.19 -0.52 0.00 0.00 177.40 178.07 2dgk n PHE 277 N 0.00 0.00 0.96 2.13 3.72 -1.26 -2.13 117.46 120.88 2dgk n PHE 277 Ca 0.00 0.00 0.13 0.00 -0.05 0.00 0.00 57.45 57.53 2dgk n PHE 277 Cb 0.00 0.00 0.58 0.00 -0.94 0.00 0.00 39.48 39.12 2dgk n PHE 277 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2dgk n GLY 278 N 0.62 -1.40 2.67 1.37 0.00 -1.07 -4.82 105.19 102.56 2dgk n GLY 278 Ca 0.16 -0.10 0.00 0.00 0.00 0.00 0.00 46.02 46.08 2dgk n GLY 278 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2dgk n LEU 279 N -1.48 0.52 -4.90 0.99 4.77 -0.55 -4.88 117.00 111.48 2dgk n LEU 279 Ca 0.07 0.00 -0.28 0.00 -0.03 0.00 0.00 56.01 55.77 2dgk n LEU 279 Cb 0.30 -1.43 0.00 0.00 -2.33 0.00 0.00 43.42 39.97 2dgk n LEU 279 CO 0.24 -0.48 0.52 0.00 -1.33 0.00 0.00 177.39 176.34 2dgk s ALA 280 N -1.62 3.32 0.64 -1.18 0.00 0.21 -4.98 121.76 118.16 2dgk s ALA 280 Ca 0.00 -0.41 -0.14 0.00 0.00 0.00 0.00 51.96 51.40 2dgk s ALA 280 Cb 0.00 -2.71 -0.01 0.00 0.00 0.00 0.00 23.12 20.40 2dgk s ALA 280 CO 0.00 -0.47 1.08 -1.25 0.00 0.00 0.00 175.76 175.12 2dgk s PRO 281 N -4.87 3.02 0.11 0.00 0.04 -1.26 -3.93 135.00 128.11 2dgk s PRO 281 Ca 0.50 1.22 -0.34 0.00 0.04 0.00 0.00 61.00 62.42 2dgk s PRO 281 Cb -0.10 -1.99 -0.18 0.00 0.04 0.00 0.00 34.50 32.27 2dgk s PRO 281 CO 0.47 -1.06 0.93 1.28 0.04 0.00 0.00 177.00 178.67 2dgk n LEU 282 N -2.42 0.04 0.00 -3.56 4.77 -1.26 -3.86 117.00 110.71 2dgk n LEU 282 Ca 0.09 1.15 0.00 0.00 -0.03 0.00 0.00 56.01 57.22 2dgk n LEU 282 Cb 0.53 -1.01 0.00 0.00 -2.33 0.00 0.00 43.42 40.61 2dgk n LEU 282 CO 0.49 -2.06 0.00 0.61 -1.33 0.00 0.00 177.39 175.10 2dgk n GLY 283 N 1.80 1.89 2.77 -0.72 0.00 -1.25 -4.94 105.19 104.74 2dgk n GLY 283 Ca 0.18 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 46.02 2dgk n GLY 283 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dgk s GLY 285 N 2.14 1.38 0.02 0.00 0.00 0.65 -0.44 107.32 111.06 2dgk s GLY 285 Ca 0.03 -1.67 -0.00 0.00 0.00 0.00 0.00 44.72 43.07 2dgk s GLY 285 CO -0.04 -1.56 -0.03 -0.98 0.00 0.00 0.00 173.10 170.49 2dgk s TRP 286 N -3.66 0.24 -0.10 1.90 0.52 0.09 -0.68 118.94 117.25 2dgk s TRP 286 Ca 0.28 -0.48 -0.05 0.00 0.02 0.00 0.00 56.10 55.87 2dgk s TRP 286 Cb 0.06 -0.17 0.05 0.00 -1.15 0.00 0.00 33.47 32.26 2dgk s TRP 286 CO 0.07 -0.17 0.22 0.54 0.02 0.00 0.00 176.95 177.62 2dgk s VAL 287 N -1.33 -0.09 0.02 4.03 0.11 -0.90 -1.57 120.40 120.67 2dgk s VAL 287 Ca -0.15 0.18 0.07 0.00 -2.93 0.00 0.00 61.98 59.16 2dgk s VAL 287 Cb -0.09 -0.35 -0.02 0.00 -1.53 0.00 0.00 36.38 34.39 2dgk s VAL 287 CO -0.01 0.07 -0.22 -0.63 -3.33 0.00 0.00 175.10 170.98 2dgk s ILE 288 N 1.41 1.76 0.09 7.04 -1.09 -0.42 -1.14 121.20 128.86 2dgk s ILE 288 Ca -0.08 -1.10 0.04 0.00 -2.23 0.00 0.00 60.65 57.29 2dgk s ILE 288 Cb -0.11 -1.50 -0.04 0.00 -1.58 0.00 0.00 42.46 39.23 2dgk s ILE 288 CO -0.08 0.36 0.04 0.26 -1.23 0.00 0.00 174.94 174.29 2dgk s TRP 289 N -0.66 3.07 0.20 3.97 0.51 0.80 -1.63 118.94 125.20 2dgk s TRP 289 Ca 0.09 0.01 -0.11 0.00 -2.12 0.00 0.00 56.10 53.97 2dgk s TRP 289 Cb -0.09 -1.57 0.23 0.00 -0.81 0.00 0.00 33.47 31.24 2dgk s TRP 289 CO 0.01 0.50 1.72 -0.09 -0.51 0.00 0.00 176.95 178.58 2dgk h ARG 290 N 3.32 0.28 0.00 4.98 2.43 -1.02 -3.40 114.38 120.97 2dgk h ARG 290 Ca -0.47 -0.02 0.07 0.00 -0.81 0.00 0.00 59.98 58.76 2dgk h ARG 290 Cb 1.17 -0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 30.64 2dgk h ARG 290 CO 0.62 0.18 0.40 -0.40 -1.51 0.00 0.00 179.97 179.26 2dgk n ASP 291 N -5.08 -1.63 -0.32 -3.80 5.68 -1.26 -4.19 116.55 105.95 2dgk n ASP 291 Ca 0.07 -1.97 0.08 0.00 -0.50 0.00 0.00 54.79 52.47 2dgk n ASP 291 Cb 0.27 2.67 0.29 0.00 -1.14 0.00 0.00 41.12 43.20 2dgk n ASP 291 CO 0.00 0.00 0.00 -0.33 -1.33 0.00 0.00 177.20 175.54 2dgk h GLU 292 N 0.00 0.87 -0.20 0.11 4.39 -1.93 -1.46 114.58 116.37 2dgk h GLU 292 Ca -0.25 -0.05 -0.03 0.00 0.34 0.00 0.00 59.36 59.38 2dgk h GLU 292 Cb 1.01 -0.20 -0.01 0.00 -0.10 0.00 0.00 28.75 29.45 2dgk h GLU 292 CO 0.32 0.58 0.01 1.49 -1.16 0.00 0.00 179.01 180.25 2dgk h GLU 293 N 0.90 0.28 0.00 2.33 4.81 -2.00 -2.40 114.58 118.50 2dgk h GLU 293 Ca 0.46 -0.04 -0.02 0.00 -0.13 0.00 0.00 59.36 59.63 2dgk h GLU 293 Cb 0.52 -0.05 -0.00 0.00 0.63 0.00 0.00 28.75 29.85 2dgk h GLU 293 CO -0.23 0.30 -0.10 0.00 -0.73 0.00 0.00 179.01 178.25 2dgk h ALA 294 N 1.74 1.07 -3.00 2.92 0.00 -1.61 -3.40 119.26 116.98 2dgk h ALA 294 Ca 0.07 -0.09 -0.70 0.00 0.00 0.00 0.00 54.91 54.18 2dgk h ALA 294 Cb 0.18 -0.02 -0.30 0.00 0.00 0.00 0.00 17.79 17.65 2dgk h ALA 294 CO 0.00 0.13 -0.53 -1.17 0.00 0.00 0.00 179.25 177.68 2dgk s LEU 295 N -6.63 4.95 0.03 0.00 2.96 -0.90 -4.86 118.68 114.22 2dgk s LEU 295 Ca -0.00 -1.58 -0.34 0.00 -0.22 0.00 0.00 54.13 51.98 2dgk s LEU 295 Cb 0.11 -1.90 -0.12 0.00 0.50 0.00 0.00 46.19 44.77 2dgk s LEU 295 CO 0.57 -0.49 1.76 -2.65 -1.32 0.00 0.00 176.35 174.23 2dgk n PRO 296 N 4.79 2.24 0.21 0.98 -0.02 -1.26 -4.85 135.00 137.08 2dgk n PRO 296 Ca -0.09 0.81 0.12 0.00 -2.02 0.00 0.00 63.50 62.33 2dgk n PRO 296 Cb 0.43 -2.64 0.71 0.00 -0.02 0.00 0.00 33.50 31.98 2dgk n PRO 296 CO 0.00 0.00 0.00 1.96 1.98 0.00 0.00 175.50 179.44 2dgk h GLN 297 N 7.92 0.00 0.00 -0.52 1.08 -1.95 -1.57 115.11 120.08 2dgk h GLN 297 Ca -0.47 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 56.73 2dgk h GLN 297 Cb 1.26 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.69 2dgk h GLN 297 CO 0.92 0.00 0.00 0.39 -0.95 0.00 0.00 178.83 179.19 2dgk n GLU 298 N -4.33 0.07 0.00 1.46 4.71 -1.26 -1.32 120.64 119.97 2dgk n GLU 298 Ca -0.00 0.46 0.11 0.00 -0.01 0.00 0.00 57.16 57.72 2dgk n GLU 298 Cb 0.21 -1.67 0.07 0.00 -1.01 0.00 0.00 31.44 29.03 2dgk n GLU 298 CO 0.00 0.00 0.00 1.28 0.09 0.00 0.00 177.13 178.50 2dgk n LEU 299 N -1.81 1.17 -4.78 -4.62 4.77 -0.59 -4.90 117.00 106.25 2dgk n LEU 299 Ca 0.01 -0.43 -0.36 0.00 -0.03 0.00 0.00 56.01 55.20 2dgk n LEU 299 Cb 0.09 -0.07 -0.07 0.00 -2.33 0.00 0.00 43.42 41.04 2dgk n LEU 299 CO 0.09 0.25 -0.07 -0.69 -1.33 0.00 0.00 177.39 175.64 2dgk s VAL 300 N -2.78 5.34 -0.13 4.08 1.01 -0.43 -4.67 120.40 122.81 2dgk s VAL 300 Ca 0.14 0.44 -0.00 0.00 0.00 0.00 0.00 61.98 62.56 2dgk s VAL 300 Cb 0.17 -3.56 -0.01 0.00 0.00 0.00 0.00 36.38 32.98 2dgk s VAL 300 CO 0.70 0.48 -0.13 -0.36 0.00 0.00 0.00 175.10 175.79 2dgk s PHE 301 N -0.11 2.81 0.24 5.22 0.40 -0.07 -4.89 117.98 121.59 2dgk s PHE 301 Ca 0.15 -0.65 -0.26 0.00 -0.60 0.00 0.00 56.93 55.57 2dgk s PHE 301 Cb -0.13 -1.84 -0.09 0.00 0.51 0.00 0.00 43.02 41.47 2dgk s PHE 301 CO 0.04 -0.21 0.87 -0.80 0.70 0.00 0.00 175.22 175.81 2dgk s ASN 302 N 0.35 7.41 -0.04 1.36 0.01 -1.26 -0.34 114.94 122.43 2dgk s ASN 302 Ca -0.11 1.76 0.03 0.00 -0.71 0.00 0.00 52.86 53.83 2dgk s ASN 302 Cb -0.16 -2.55 0.00 0.00 0.41 0.00 0.00 41.25 38.96 2dgk s ASN 302 CO 0.06 0.09 -0.11 -0.69 -1.51 0.00 0.00 177.10 174.94 2dgk s VAL 303 N -1.34 0.99 0.29 1.60 1.01 -0.81 -4.94 120.40 117.20 2dgk s VAL 303 Ca 0.42 -0.46 -0.29 0.00 0.00 0.00 0.00 61.98 61.66 2dgk s VAL 303 Cb -0.22 -0.87 -0.10 0.00 0.00 0.00 0.00 36.38 35.19 2dgk s VAL 303 CO 0.27 0.30 1.21 -1.81 0.00 0.00 0.00 175.10 175.07 2dgk s ASP 304 N 0.26 7.02 -0.01 3.32 1.01 -1.26 -1.15 116.67 125.85 2dgk s ASP 304 Ca -0.05 2.46 -0.13 0.00 0.71 0.00 0.00 52.55 55.54 2dgk s ASP 304 Cb -0.11 -2.63 0.02 0.00 1.01 0.00 0.00 42.92 41.21 2dgk s ASP 304 CO 0.01 -0.35 0.28 -0.31 0.21 0.00 0.00 175.17 175.01 2dgk s TYR 305 N -1.02 -0.15 0.33 4.23 2.02 -1.25 -4.91 117.35 116.60 2dgk s TYR 305 Ca 0.48 0.22 0.09 0.00 -0.37 0.00 0.00 57.07 57.49 2dgk s TYR 305 Cb -0.36 0.07 0.85 0.00 -0.40 0.00 0.00 41.96 42.12 2dgk s TYR 305 CO 0.46 -0.37 1.78 -0.07 -1.57 0.00 0.00 175.55 175.79 2dgk h LEU 306 N 3.99 0.68 -0.31 -1.29 3.38 -1.97 0.32 115.31 120.12 2dgk h LEU 306 Ca -0.30 0.09 0.00 0.00 0.09 0.00 0.00 57.88 57.77 2dgk h LEU 306 Cb 1.18 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.90 2dgk h LEU 306 CO 0.40 0.22 0.00 0.61 0.09 0.00 0.00 178.44 179.76 2dgk n GLY 307 N -1.37 -0.54 0.00 0.83 0.00 -1.26 -4.96 105.19 97.89 2dgk n GLY 307 Ca 0.23 -0.07 0.00 0.00 0.00 0.00 0.00 46.02 46.18 2dgk n GLY 307 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2dgk n GLY 308 N 0.57 2.82 3.74 -0.02 0.00 0.11 -5.05 105.19 107.37 2dgk n GLY 308 Ca 0.02 -1.76 -0.35 0.00 0.00 0.00 0.00 46.02 43.93 2dgk n GLY 308 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2dgk s GLN 309 N -3.92 2.68 -0.03 1.61 -2.07 -1.26 -3.79 119.66 112.87 2dgk s GLN 309 Ca 0.00 1.76 0.02 0.00 -1.82 0.00 0.00 55.36 55.32 2dgk s GLN 309 Cb 0.00 -1.90 0.01 0.00 -1.09 0.00 0.00 33.01 30.03 2dgk s GLN 309 CO 0.00 -1.42 -0.06 0.42 -1.32 0.00 0.00 175.29 172.90 2dgk s ILE 310 N -1.80 0.61 0.25 3.63 1.01 -0.30 -4.89 121.20 119.72 2dgk s ILE 310 Ca 0.75 -0.23 -0.30 0.00 0.00 0.00 0.00 60.65 60.87 2dgk s ILE 310 Cb -0.29 -0.58 -0.09 0.00 0.01 0.00 0.00 42.46 41.51 2dgk s ILE 310 CO 0.38 0.21 0.98 -0.83 0.00 0.00 0.00 174.94 175.68 2dgk s GLY 311 N 0.45 3.10 -0.02 6.18 0.00 -1.26 -1.92 107.32 113.85 2dgk s GLY 311 Ca -0.06 0.68 0.04 0.00 0.00 0.00 0.00 44.72 45.38 2dgk s GLY 311 CO 0.00 1.26 -0.13 -1.08 0.00 0.00 0.00 173.10 173.15 2dgk s THR 312 N -1.19 1.08 -0.42 0.90 -1.32 0.54 -4.91 115.64 110.32 2dgk s THR 312 Ca 0.42 -0.56 0.02 0.00 -1.21 0.00 0.00 61.69 60.35 2dgk s THR 312 Cb -0.27 -0.91 0.13 0.00 -1.51 0.00 0.00 72.50 69.94 2dgk s THR 312 CO 0.34 0.31 0.22 0.12 -2.21 0.00 0.00 174.62 173.40 2dgk s PHE 313 N -0.18 1.79 0.14 9.09 5.36 -1.26 -0.89 117.98 132.03 2dgk s PHE 313 Ca 0.03 -2.26 -0.19 0.00 -0.96 0.00 0.00 56.93 53.54 2dgk s PHE 313 Cb -0.07 -1.74 0.05 0.00 -0.34 0.00 0.00 43.02 40.92 2dgk s PHE 313 CO -0.00 -0.80 0.50 0.00 -1.46 0.00 0.00 175.22 173.46 2dgk s ALA 314 N 0.56 -1.25 -0.04 11.12 0.00 -1.26 -4.95 121.76 125.93 2dgk s ALA 314 Ca 0.17 0.21 -0.05 0.00 0.00 0.00 0.00 51.96 52.28 2dgk s ALA 314 Cb -0.24 0.79 -0.28 0.00 0.00 0.00 0.00 23.12 23.39 2dgk s ALA 314 CO -0.01 -0.71 0.69 0.82 0.00 0.00 0.00 175.76 176.55 2dgk h ILE 315 N 2.18 0.96 -3.40 0.00 2.04 -1.98 -3.47 117.51 113.84 2dgk h ILE 315 Ca -0.34 -2.61 -0.48 0.00 1.00 0.00 0.00 64.86 62.43 2dgk h ILE 315 Cb 1.28 2.69 0.04 0.00 -0.74 0.00 0.00 36.82 40.09 2dgk h ILE 315 CO 0.42 0.82 0.07 0.20 0.00 0.00 0.00 178.15 179.66 2dgk s ASN 316 N -7.03 6.08 0.00 1.72 0.01 -1.26 -5.07 114.94 109.39 2dgk s ASN 316 Ca -0.13 0.76 0.00 0.00 -0.71 0.00 0.00 52.86 52.77 2dgk s ASN 316 Cb 0.06 -2.03 0.00 0.00 0.41 0.00 0.00 41.25 39.69 2dgk s ASN 316 CO 0.84 -0.66 0.00 0.33 -1.51 0.00 0.00 177.10 176.10 2dgk n PHE 317 N -2.25 0.00 -1.98 2.20 7.35 -1.26 -5.05 117.46 116.48 2dgk n PHE 317 Ca 0.01 0.00 -0.42 0.00 -0.76 0.00 0.00 57.45 56.28 2dgk n PHE 317 Cb 0.56 0.00 -0.03 0.00 0.35 0.00 0.00 39.48 40.36 2dgk n PHE 317 CO 0.00 0.00 0.00 -1.12 -0.76 0.00 0.00 176.76 174.88 2dgk s SER 318 N 1.00 6.62 -0.19 -2.13 0.01 -1.26 -4.32 113.70 113.43 2dgk s SER 318 Ca 0.00 2.64 -0.34 0.00 1.31 0.00 0.00 55.95 59.56 2dgk s SER 318 Cb 0.00 -2.61 0.14 0.00 0.21 0.00 0.00 66.02 63.76 2dgk s SER 318 CO 0.00 -0.76 1.20 0.00 0.41 0.00 0.00 173.24 174.09 2dgk s ARG 319 N 0.33 0.32 0.48 12.44 1.70 -1.26 -5.02 118.95 127.94 2dgk s ARG 319 Ca 0.64 -0.10 -0.21 0.00 -0.47 0.00 0.00 55.73 55.60 2dgk s ARG 319 Cb -0.43 0.15 -0.08 0.00 -0.57 0.00 0.00 34.95 34.03 2dgk s ARG 319 CO 0.38 -0.14 1.08 -1.25 -1.08 0.00 0.00 175.30 174.29 2dgk s PRO 320 N -2.27 3.73 0.00 3.89 0.04 -1.26 -0.09 135.00 139.05 2dgk s PRO 320 Ca 0.09 1.50 0.24 0.00 0.04 0.00 0.00 61.00 62.87 2dgk s PRO 320 Cb -0.01 -2.17 0.57 0.00 0.04 0.00 0.00 34.50 32.93 2dgk s PRO 320 CO -0.05 -0.51 1.47 0.00 0.04 0.00 0.00 177.00 177.95 2dgk n ALA 321 N -0.86 2.50 -0.37 8.56 0.00 0.03 -4.53 120.51 125.83 2dgk n ALA 321 Ca 0.09 -0.65 0.04 0.00 0.00 0.00 0.00 53.44 52.92 2dgk n ALA 321 Cb 0.51 -0.97 0.19 0.00 0.00 0.00 0.00 19.45 19.19 2dgk n ALA 321 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 2dgk h GLY 322 N 4.77 1.54 1.61 0.00 0.00 -1.82 -2.29 103.07 106.90 2dgk h GLY 322 Ca 0.00 -0.46 -0.11 0.00 0.00 0.00 0.00 47.33 46.75 2dgk h GLY 322 CO 0.00 0.30 -0.36 1.46 0.00 0.00 0.00 176.54 177.93 2dgk h GLN 323 N 1.13 0.43 -0.40 4.80 7.50 -1.88 -0.35 115.11 126.35 2dgk h GLN 323 Ca 0.45 -0.20 -0.05 0.00 0.50 0.00 0.00 58.65 59.35 2dgk h GLN 323 Cb 0.24 -0.01 -0.02 0.00 0.05 0.00 0.00 27.48 27.75 2dgk h GLN 323 CO -0.19 0.74 0.06 0.28 -1.50 0.00 0.00 178.83 178.22 2dgk h VAL 324 N 0.37 1.24 -0.53 -0.54 2.07 -1.78 0.75 116.25 117.84 2dgk h VAL 324 Ca 0.04 -0.87 -0.02 0.00 0.82 0.00 0.00 66.70 66.67 2dgk h VAL 324 Cb 0.81 1.04 -0.02 0.00 -1.52 0.00 0.00 31.29 31.60 2dgk h VAL 324 CO 0.07 0.30 0.26 0.40 0.02 0.00 0.00 177.57 178.61 2dgk h ILE 325 N 0.51 1.20 -0.58 4.57 2.04 -1.21 -1.28 117.51 122.75 2dgk h ILE 325 Ca 0.12 -0.55 -0.07 0.00 1.00 0.00 0.00 64.86 65.36 2dgk h ILE 325 Cb 0.37 0.58 -0.02 0.00 -0.74 0.00 0.00 36.82 37.01 2dgk h ILE 325 CO 0.01 0.22 0.08 0.00 0.00 0.00 0.00 178.15 178.45 2dgk h ALA 326 N 1.10 1.03 -0.50 1.87 0.00 -0.87 -1.14 119.26 120.75 2dgk h ALA 326 Ca 0.18 -0.26 -0.01 0.00 0.00 0.00 0.00 54.91 54.82 2dgk h ALA 326 Cb 0.11 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.65 2dgk h ALA 326 CO -0.02 0.61 0.26 0.37 0.00 0.00 0.00 179.25 180.48 2dgk h GLN 327 N 0.90 0.71 -0.63 0.00 5.75 -0.39 -1.44 115.11 120.00 2dgk h GLN 327 Ca 0.18 -0.09 -0.02 0.00 -0.15 0.00 0.00 58.65 58.57 2dgk h GLN 327 Cb 0.42 -0.13 -0.03 0.00 1.07 0.00 0.00 27.48 28.80 2dgk h GLN 327 CO 0.01 0.56 0.32 -0.92 -2.65 0.00 0.00 178.83 176.15 2dgk h TYR 328 N 0.67 0.87 -0.53 3.99 3.20 -0.88 -0.89 116.97 123.40 2dgk h TYR 328 Ca 0.18 -0.02 -0.02 0.00 3.14 0.00 0.00 58.73 62.00 2dgk h TYR 328 Cb 0.07 -0.28 -0.02 0.00 1.54 0.00 0.00 36.73 38.04 2dgk h TYR 328 CO -0.01 0.62 0.26 -0.92 -1.64 0.00 0.00 178.16 176.47 2dgk h TYR 329 N 0.88 0.75 -0.56 -3.82 3.20 -0.53 0.28 116.97 117.17 2dgk h TYR 329 Ca 0.22 -0.03 -0.03 0.00 3.14 0.00 0.00 58.73 62.03 2dgk h TYR 329 Cb 0.07 -0.23 -0.03 0.00 1.54 0.00 0.00 36.73 38.08 2dgk h TYR 329 CO 0.01 0.58 0.24 0.93 -1.64 0.00 0.00 178.16 178.29 2dgk h GLU 330 N 0.70 0.82 -0.20 1.82 4.39 -0.49 0.73 114.58 122.35 2dgk h GLU 330 Ca 0.18 -0.14 -0.00 0.00 0.34 0.00 0.00 59.36 59.74 2dgk h GLU 330 Cb 0.11 -0.14 -0.01 0.00 -0.10 0.00 0.00 28.75 28.61 2dgk h GLU 330 CO -0.02 0.69 0.13 0.74 -1.16 0.00 0.00 179.01 179.39 2dgk h PHE 331 N 0.76 0.27 -0.35 4.33 0.04 -0.74 -0.41 116.94 120.84 2dgk h PHE 331 Ca 0.19 0.00 -0.14 0.00 2.80 0.00 0.00 57.97 60.82 2dgk h PHE 331 Cb 0.16 -0.09 -0.01 0.00 2.20 0.00 0.00 35.95 38.22 2dgk h PHE 331 CO 0.00 0.20 -0.34 -0.07 -0.60 0.00 0.00 178.31 177.51 2dgk h LEU 332 N 0.25 0.90 -0.15 1.54 3.38 -0.82 -1.36 115.31 119.05 2dgk h LEU 332 Ca 0.07 -0.47 -0.04 0.00 0.09 0.00 0.00 57.88 57.54 2dgk h LEU 332 Cb 0.01 -0.25 -0.00 0.00 0.09 0.00 0.00 40.66 40.50 2dgk h LEU 332 CO -0.01 1.18 -0.05 -0.09 0.09 0.00 0.00 178.44 179.56 2dgk h ARG 333 N 0.63 0.30 0.00 1.13 9.65 -0.79 -3.39 114.38 121.92 2dgk h ARG 333 Ca 0.06 -0.12 -0.15 0.00 -1.10 0.00 0.00 59.98 58.67 2dgk h ARG 333 Cb 0.92 -0.01 -0.02 0.00 -1.39 0.00 0.00 29.97 29.47 2dgk h ARG 333 CO 0.08 0.59 -0.92 -0.07 2.80 0.00 0.00 179.97 182.46 2dgk h LEU 334 N -0.02 0.00 0.00 3.80 3.38 -1.15 -3.47 115.31 117.85 2dgk h LEU 334 Ca 0.04 -0.43 0.15 0.00 0.09 0.00 0.00 57.88 57.72 2dgk h LEU 334 Cb 0.49 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.20 2dgk h LEU 334 CO 0.02 1.25 -0.20 0.61 0.09 0.00 0.00 178.44 180.20 2dgk n GLY 335 N 1.50 -1.97 0.14 0.83 0.00 -0.51 -0.28 105.19 104.90 2dgk n GLY 335 Ca -0.23 -1.32 -0.09 0.00 0.00 0.00 0.00 46.02 44.38 2dgk n GLY 335 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 2dgk h ARG 336 N 0.00 0.34 -0.53 1.61 3.08 -1.98 -0.94 114.38 115.97 2dgk h ARG 336 Ca 0.01 -0.02 -0.03 0.00 0.07 0.00 0.00 59.98 60.01 2dgk h ARG 336 Cb 0.51 -0.08 -0.03 0.00 0.08 0.00 0.00 29.97 30.45 2dgk h ARG 336 CO 0.00 0.23 0.22 0.93 -1.07 0.00 0.00 179.97 180.28 2dgk h GLU 337 N 0.35 0.76 -0.11 0.04 5.08 -2.00 -1.00 114.58 117.70 2dgk h GLU 337 Ca 0.12 -0.11 -0.07 0.00 -1.00 0.00 0.00 59.36 58.30 2dgk h GLU 337 Cb -0.00 -0.14 -0.00 0.00 0.50 0.00 0.00 28.75 29.11 2dgk h GLU 337 CO -0.05 0.62 -0.19 0.78 -1.00 0.00 0.00 179.01 179.16 2dgk h GLY 338 N 0.88 0.36 1.22 -3.84 0.00 -0.24 -2.81 103.07 98.65 2dgk h GLY 338 Ca 0.18 -0.41 -0.03 0.00 0.00 0.00 0.00 47.33 47.07 2dgk h GLY 338 CO -0.02 0.37 0.33 -0.97 0.00 0.00 0.00 176.54 176.25 2dgk h TYR 339 N -0.10 1.00 -0.67 5.60 -1.99 -1.03 -2.00 116.97 117.78 2dgk h TYR 339 Ca 0.01 -0.04 0.02 0.00 2.00 0.00 0.00 58.73 60.72 2dgk h TYR 339 Cb 0.76 -0.31 -0.04 0.00 2.00 0.00 0.00 36.73 39.14 2dgk h TYR 339 CO 0.10 0.73 0.43 1.15 -0.00 0.00 0.00 178.16 180.58 2dgk h THR 340 N 1.00 1.12 -0.29 -2.88 2.02 -1.17 -0.13 112.91 112.59 2dgk h THR 340 Ca 0.24 -0.30 -0.02 0.00 0.77 0.00 0.00 66.41 67.11 2dgk h THR 340 Cb 0.11 0.19 -0.01 0.00 -1.74 0.00 0.00 68.15 66.70 2dgk h THR 340 CO -0.03 0.16 0.11 0.11 0.37 0.00 0.00 175.52 176.24 2dgk h LYS 341 N 0.86 0.44 -0.10 6.66 1.57 -1.15 -0.50 116.57 124.35 2dgk h LYS 341 Ca 0.26 -0.08 -0.00 0.00 -1.87 0.00 0.00 60.65 58.96 2dgk h LYS 341 Cb -0.03 -0.07 -0.00 0.00 0.08 0.00 0.00 32.23 32.21 2dgk h LYS 341 CO -0.08 0.47 0.06 0.28 -0.57 0.00 0.00 179.45 179.60 2dgk h VAL 342 N 0.32 1.08 -0.32 0.50 2.07 -0.98 -1.70 116.25 117.22 2dgk h VAL 342 Ca 0.10 -0.21 -0.11 0.00 0.82 0.00 0.00 66.70 67.29 2dgk h VAL 342 Cb 0.20 1.04 -0.01 0.00 -1.52 0.00 0.00 31.29 31.00 2dgk h VAL 342 CO -0.01 0.07 -0.27 1.56 0.02 0.00 0.00 177.57 178.95 2dgk h GLN 343 N 0.08 0.64 -0.98 1.57 1.08 -1.01 -2.69 115.11 113.80 2dgk h GLN 343 Ca 0.04 -0.27 0.00 0.00 -1.45 0.00 0.00 58.65 56.97 2dgk h GLN 343 Cb 0.06 -0.03 -0.05 0.00 -0.05 0.00 0.00 27.48 27.42 2dgk h GLN 343 CO -0.01 0.84 0.62 -0.91 -0.95 0.00 0.00 178.83 178.43 2dgk h ASN 344 N 0.56 1.15 -0.75 1.46 -0.26 -0.92 -0.80 115.58 116.02 2dgk h ASN 344 Ca 0.07 -0.05 -0.04 0.00 -0.56 0.00 0.00 56.30 55.73 2dgk h ASN 344 Cb 0.75 -0.29 -0.03 0.00 -1.06 0.00 0.00 38.32 37.68 2dgk h ASN 344 CO 0.06 0.85 0.33 0.00 -1.06 0.00 0.00 177.43 177.61 2dgk h ALA 345 N 1.35 1.14 -0.46 -0.83 0.00 -0.99 0.01 119.26 119.48 2dgk h ALA 345 Ca 0.35 -0.17 -0.14 0.00 0.00 0.00 0.00 54.91 54.95 2dgk h ALA 345 Cb -0.11 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.37 2dgk h ALA 345 CO -0.07 0.63 -0.26 0.77 0.00 0.00 0.00 179.25 180.31 2dgk h SER 346 N 1.09 1.03 0.16 0.00 0.02 -1.12 -2.59 113.55 112.13 2dgk h SER 346 Ca 0.26 -0.41 -0.10 0.00 -0.84 0.00 0.00 61.79 60.70 2dgk h SER 346 Cb 0.17 -0.28 -0.01 0.00 0.14 0.00 0.00 62.40 62.41 2dgk h SER 346 CO -0.03 1.21 -0.35 1.88 -1.14 0.00 0.00 176.83 178.41 2dgk h TYR 347 N 0.84 0.31 -0.48 3.45 0.05 -0.76 -1.54 116.97 118.84 2dgk h TYR 347 Ca 0.10 -0.07 -0.04 0.00 0.05 0.00 0.00 58.73 58.76 2dgk h TYR 347 Cb 0.85 -0.07 -0.02 0.00 1.01 0.00 0.00 36.73 38.49 2dgk h TYR 347 CO 0.06 0.59 0.13 1.96 -1.05 0.00 0.00 178.16 179.85 2dgk h GLN 348 N 0.24 0.76 -0.43 4.88 4.20 -0.84 -0.57 115.11 123.35 2dgk h GLN 348 Ca 0.03 -0.17 -0.10 0.00 0.06 0.00 0.00 58.65 58.47 2dgk h GLN 348 Cb 0.73 -0.10 -0.01 0.00 0.30 0.00 0.00 27.48 28.40 2dgk h GLN 348 CO 0.06 0.73 -0.11 0.28 -0.67 0.00 0.00 178.83 179.12 2dgk h VAL 349 N 0.65 1.27 -0.41 -0.54 2.07 -1.26 -1.58 116.25 116.46 2dgk h VAL 349 Ca 0.15 -1.21 -0.02 0.00 0.82 0.00 0.00 66.70 66.44 2dgk h VAL 349 Cb 0.30 1.18 -0.02 0.00 -1.52 0.00 0.00 31.29 31.23 2dgk h VAL 349 CO -0.00 0.41 0.18 0.00 0.02 0.00 0.00 177.57 178.17 2dgk h ALA 350 N 0.86 0.53 -0.55 1.67 0.00 -1.11 -1.06 119.26 119.60 2dgk h ALA 350 Ca 0.11 -0.13 -0.07 0.00 0.00 0.00 0.00 54.91 54.82 2dgk h ALA 350 Cb 0.64 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.25 2dgk h ALA 350 CO 0.04 0.11 0.07 0.00 0.00 0.00 0.00 179.25 179.48 2dgk h ALA 351 N 1.02 1.10 -0.42 0.00 0.00 -1.06 -1.22 119.26 118.68 2dgk h ALA 351 Ca 0.14 -0.25 -0.02 0.00 0.00 0.00 0.00 54.91 54.78 2dgk h ALA 351 Cb 0.16 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.72 2dgk h ALA 351 CO -0.01 0.59 0.18 -0.92 0.00 0.00 0.00 179.25 179.08 2dgk h TYR 352 N 0.83 0.63 -0.57 0.00 3.20 -0.95 -1.95 116.97 118.17 2dgk h TYR 352 Ca 0.17 -0.04 -0.10 0.00 3.14 0.00 0.00 58.73 61.90 2dgk h TYR 352 Cb 0.39 -0.19 -0.02 0.00 1.54 0.00 0.00 36.73 38.45 2dgk h TYR 352 CO 0.02 0.54 -0.04 -0.07 -1.64 0.00 0.00 178.16 176.97 2dgk h LEU 353 N 0.54 1.02 -0.43 2.82 3.38 -0.90 -1.77 115.31 119.97 2dgk h LEU 353 Ca 0.14 -0.33 -0.04 0.00 0.09 0.00 0.00 57.88 57.75 2dgk h LEU 353 Cb 0.17 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.63 2dgk h LEU 353 CO -0.01 1.10 0.13 0.00 0.09 0.00 0.00 178.44 179.75 2dgk h ALA 354 N 0.95 0.57 -0.70 1.53 0.00 -1.13 0.15 119.26 120.63 2dgk h ALA 354 Ca 0.16 -0.18 -0.05 0.00 0.00 0.00 0.00 54.91 54.84 2dgk h ALA 354 Cb 0.61 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 18.20 2dgk h ALA 354 CO 0.04 0.23 0.25 0.22 0.00 0.00 0.00 179.25 179.99 2dgk h ASP 355 N 0.56 0.99 -0.04 0.00 3.58 -1.27 -2.65 116.42 117.60 2dgk h ASP 355 Ca 0.14 -0.19 -0.14 0.00 0.42 0.00 0.00 57.03 57.26 2dgk h ASP 355 Cb 0.28 -0.26 0.01 0.00 1.72 0.00 0.00 39.33 41.08 2dgk h ASP 355 CO -0.00 0.91 -0.53 -0.33 -2.88 0.00 0.00 179.24 176.41 2dgk h GLU 356 N 1.02 0.43 -0.32 0.28 4.39 -1.16 -3.29 114.58 115.93 2dgk h GLU 356 Ca 0.23 -0.41 -0.01 0.00 0.34 0.00 0.00 59.36 59.51 2dgk h GLU 356 Cb 0.25 0.10 -0.02 0.00 -0.10 0.00 0.00 28.75 28.99 2dgk h GLU 356 CO -0.01 1.06 0.15 0.82 -1.16 0.00 0.00 179.01 179.87 2dgk h ILE 357 N -0.05 1.11 -0.39 3.13 2.04 -0.98 -1.99 117.51 120.38 2dgk h ILE 357 Ca -0.06 -0.32 0.02 0.00 1.00 0.00 0.00 64.86 65.51 2dgk h ILE 357 Cb 1.22 0.71 -0.02 0.00 -0.74 0.00 0.00 36.82 37.98 2dgk h ILE 357 CO 0.11 0.13 0.26 0.00 0.00 0.00 0.00 178.15 178.65 2dgk h ALA 358 N 1.73 1.80 0.00 1.87 0.00 -1.53 -1.33 119.26 121.80 2dgk h ALA 358 Ca 0.11 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.00 2dgk h ALA 358 Cb 0.05 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.71 2dgk h ALA 358 CO -0.02 0.17 0.00 0.87 0.00 0.00 0.00 179.25 180.27 2dgk h LYS 359 N 0.46 0.00 -0.00 0.00 1.57 -1.47 -3.25 116.57 113.89 2dgk h LYS 359 Ca 0.15 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.93 2dgk h LYS 359 Cb 0.04 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.35 2dgk h LYS 359 CO -0.04 0.00 -0.37 1.28 -0.57 0.00 0.00 179.45 179.75 2dgk n LEU 360 N -2.83 0.84 -3.83 2.94 4.77 -0.50 -5.01 117.00 113.38 2dgk n LEU 360 Ca 0.02 -0.18 -0.01 0.00 -0.03 0.00 0.00 56.01 55.81 2dgk n LEU 360 Cb 0.34 -0.17 0.01 0.00 -2.33 0.00 0.00 43.42 41.27 2dgk n LEU 360 CO 0.27 0.17 0.90 -0.83 -1.33 0.00 0.00 177.39 176.57 2dgk s GLY 361 N -2.70 -0.10 -1.30 -0.72 0.00 -1.23 -5.07 107.32 96.21 2dgk s GLY 361 Ca 0.19 0.01 -0.16 0.00 0.00 0.00 0.00 44.72 44.76 2dgk s GLY 361 CO 0.60 2.20 1.74 -1.55 0.00 0.00 0.00 173.10 176.09 2dgk n PRO 362 N -0.66 3.22 -4.28 2.90 -0.04 -1.26 -4.85 135.00 130.02 2dgk n PRO 362 Ca -0.03 -3.35 -0.26 0.00 -0.04 0.00 0.00 63.50 59.82 2dgk n PRO 362 Cb 0.60 -3.32 -0.09 0.00 -0.04 0.00 0.00 33.50 30.65 2dgk n PRO 362 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 2dgk s TYR 363 N 3.18 2.66 -0.20 0.54 2.02 -1.26 -1.59 117.35 122.69 2dgk s TYR 363 Ca 0.49 -0.21 0.01 0.00 -0.37 0.00 0.00 57.07 56.99 2dgk s TYR 363 Cb 0.04 -1.28 0.03 0.00 -0.40 0.00 0.00 41.96 40.35 2dgk s TYR 363 CO 0.03 0.53 -0.16 -2.00 -1.57 0.00 0.00 175.55 172.38 2dgk s GLU 364 N -2.95 2.84 0.04 -0.62 2.12 0.31 -4.74 118.70 115.70 2dgk s GLU 364 Ca 0.26 -0.94 -0.22 0.00 0.36 0.00 0.00 54.97 54.43 2dgk s GLU 364 Cb -0.08 -2.69 -0.06 0.00 0.26 0.00 0.00 34.13 31.55 2dgk s GLU 364 CO 0.16 -0.30 0.65 -0.06 -0.54 0.00 0.00 175.26 175.17 2dgk s PHE 365 N 1.26 3.74 -0.23 5.30 0.40 -1.26 -1.41 117.98 125.78 2dgk s PHE 365 Ca 0.02 1.33 0.08 0.00 -0.60 0.00 0.00 56.93 57.75 2dgk s PHE 365 Cb -0.15 -2.66 -0.20 0.00 0.51 0.00 0.00 43.02 40.52 2dgk s PHE 365 CO -0.10 0.39 -0.10 -0.89 0.70 0.00 0.00 175.22 175.21 2dgk n ILE 366 N 2.46 1.46 -3.80 0.64 5.41 0.92 -4.95 119.36 121.50 2dgk n ILE 366 Ca -0.06 -0.68 -0.14 0.00 1.00 0.00 0.00 62.75 62.87 2dgk n ILE 366 Cb 0.50 -1.07 -0.15 0.00 -0.71 0.00 0.00 39.64 38.21 2dgk n ILE 366 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2dgk n THR 368 N 3.87 1.70 -1.65 0.00 -2.24 -1.26 -1.16 114.28 113.54 2dgk n THR 368 Ca -0.23 -2.54 -0.11 0.00 -2.27 0.00 0.00 64.05 58.89 2dgk n THR 368 Cb 0.53 -0.01 -0.03 0.00 -2.10 0.00 0.00 70.33 68.71 2dgk n THR 368 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2dgk n GLY 369 N -0.88 0.76 3.70 3.38 0.00 -0.11 -4.15 105.19 107.89 2dgk n GLY 369 Ca 0.15 -0.47 -0.41 0.00 0.00 0.00 0.00 46.02 45.29 2dgk n GLY 369 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2dgk s ARG 370 N -3.54 4.43 0.56 1.61 0.52 -1.26 -4.43 118.95 116.83 2dgk s ARG 370 Ca 0.00 1.15 0.25 0.00 -0.52 0.00 0.00 55.73 56.62 2dgk s ARG 370 Cb 0.00 -3.50 1.57 0.00 0.52 0.00 0.00 34.95 33.54 2dgk s ARG 370 CO 0.00 -0.15 2.14 -1.35 0.02 0.00 0.00 175.30 175.97 2dgk h PRO 371 N 7.00 0.00 -0.01 3.54 0.11 -1.92 -1.49 132.00 139.24 2dgk h PRO 371 Ca -0.36 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.75 2dgk h PRO 371 Cb 1.17 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.28 2dgk h PRO 371 CO 0.80 0.00 -0.08 -0.40 -0.21 0.00 0.00 178.00 178.10 2dgk n ASP 372 N -4.07 0.63 -0.00 -2.05 5.68 -1.26 -4.12 116.55 111.35 2dgk n ASP 372 Ca 0.00 -0.84 0.00 0.00 -0.50 0.00 0.00 54.79 53.45 2dgk n ASP 372 Cb 0.23 -0.03 -0.01 0.00 -1.14 0.00 0.00 41.12 40.17 2dgk n ASP 372 CO 0.00 0.00 0.00 -0.62 -1.33 0.00 0.00 177.20 175.25 2dgk n GLU 373 N -0.73 1.55 -0.15 0.11 1.02 -0.61 -5.03 120.64 116.81 2dgk n GLU 373 Ca 0.17 -0.01 0.00 0.00 -0.02 0.00 0.00 57.16 57.30 2dgk n GLU 373 Cb 0.27 -1.04 0.00 0.00 -0.02 0.00 0.00 31.44 30.65 2dgk n GLU 373 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2dgk n GLY 374 N 2.61 -0.81 3.97 0.62 0.00 -0.93 -0.44 105.19 110.22 2dgk n GLY 374 Ca -0.01 -0.27 -0.23 0.00 0.00 0.00 0.00 46.02 45.51 2dgk n GLY 374 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2dgk s ILE 375 N -3.95 2.45 -0.59 -0.61 -4.36 0.02 -4.48 121.20 109.67 2dgk s ILE 375 Ca 0.00 -0.58 -0.21 0.00 -0.26 0.00 0.00 60.65 59.61 2dgk s ILE 375 Cb 0.00 -2.87 -0.18 0.00 1.25 0.00 0.00 42.46 40.66 2dgk s ILE 375 CO 0.00 0.00 1.83 -2.65 0.24 0.00 0.00 174.94 174.36 2dgk n PRO 376 N -2.59 1.20 -4.19 0.37 -0.02 -1.26 -4.41 135.00 124.10 2dgk n PRO 376 Ca 0.10 -1.56 -0.12 0.00 -2.02 0.00 0.00 63.50 59.91 2dgk n PRO 376 Cb 0.60 -2.73 -0.10 0.00 -0.02 0.00 0.00 33.50 31.25 2dgk n PRO 376 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2dgk s ALA 377 N 5.20 1.10 -0.10 3.55 0.00 -1.26 -1.10 121.76 129.15 2dgk s ALA 377 Ca 0.54 -1.48 0.01 0.00 0.00 0.00 0.00 51.96 51.03 2dgk s ALA 377 Cb 0.13 0.48 0.02 0.00 0.00 0.00 0.00 23.12 23.75 2dgk s ALA 377 CO 0.14 -0.33 -0.11 0.08 0.00 0.00 0.00 175.76 175.54 2dgk s VAL 378 N -3.74 1.18 -0.04 0.00 1.01 -0.33 -0.94 120.40 117.54 2dgk s VAL 378 Ca 0.19 -0.43 0.01 0.00 0.00 0.00 0.00 61.98 61.76 2dgk s VAL 378 Cb 0.06 -1.13 0.02 0.00 0.00 0.00 0.00 36.38 35.33 2dgk s VAL 378 CO 0.00 0.38 -0.05 0.00 0.00 0.00 0.00 175.10 175.43 2dgk s PHE 380 N 0.80 0.41 0.18 0.00 -0.71 -0.69 -0.06 117.98 117.91 2dgk s PHE 380 Ca -0.11 -0.76 -0.02 0.00 -1.04 0.00 0.00 56.93 55.00 2dgk s PHE 380 Cb -0.14 0.14 -0.04 0.00 -1.21 0.00 0.00 43.02 41.77 2dgk s PHE 380 CO 0.01 -0.96 0.13 -1.59 -1.34 0.00 0.00 175.22 171.47 2dgk s LYS 381 N -4.02 1.14 0.16 1.99 -2.85 -0.50 -1.34 119.74 114.32 2dgk s LYS 381 Ca 0.23 -1.54 -0.30 0.00 -1.00 0.00 0.00 55.97 53.37 2dgk s LYS 381 Cb -0.00 0.28 -0.07 0.00 -2.06 0.00 0.00 37.83 35.97 2dgk s LYS 381 CO 0.09 -0.37 0.95 -0.51 0.10 0.00 0.00 175.35 175.61 2dgk s LEU 382 N -3.11 4.56 0.62 2.77 1.43 -1.26 -0.53 118.68 123.16 2dgk s LEU 382 Ca 0.33 1.85 -0.18 0.00 -1.03 0.00 0.00 54.13 55.10 2dgk s LEU 382 Cb 0.07 -3.59 -0.04 0.00 0.03 0.00 0.00 46.19 42.65 2dgk s LEU 382 CO 0.08 0.03 0.89 0.29 0.23 0.00 0.00 176.35 177.88 2dgk n LYS 383 N 2.24 0.77 -2.04 1.70 5.02 -0.62 -4.74 118.16 120.49 2dgk n LYS 383 Ca 0.00 0.30 -0.41 0.00 -2.02 0.00 0.00 58.31 56.19 2dgk n LYS 383 Cb 0.48 -2.11 -0.02 0.00 -0.02 0.00 0.00 35.03 33.37 2dgk n LYS 383 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2dgk s ASP 384 N -1.31 6.66 -0.01 4.39 1.01 -1.26 -2.23 116.67 123.93 2dgk s ASP 384 Ca 0.75 2.78 0.00 0.00 0.71 0.00 0.00 52.55 56.79 2dgk s ASP 384 Cb -0.41 -2.65 0.00 0.00 1.01 0.00 0.00 42.92 40.87 2dgk s ASP 384 CO 0.48 -0.62 0.00 0.61 0.21 0.00 0.00 175.17 175.85 2dgk n GLY 385 N 0.78 0.26 3.64 0.21 0.00 -1.26 -4.98 105.19 103.83 2dgk n GLY 385 Ca 0.00 -0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.68 2dgk n GLY 385 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2dgk s GLU 386 N -1.00 3.57 -0.32 1.61 2.56 -0.95 -5.08 118.70 119.10 2dgk s GLU 386 Ca 0.00 -0.38 -0.01 0.00 0.00 0.00 0.00 54.97 54.58 2dgk s GLU 386 Cb 0.00 -3.02 0.10 0.00 2.00 0.00 0.00 34.13 33.21 2dgk s GLU 386 CO 0.00 0.44 0.11 0.34 -0.56 0.00 0.00 175.26 175.59 2dgk s ASP 387 N -0.12 3.97 0.00 -1.70 -1.08 -1.26 -4.79 116.67 111.69 2dgk s ASP 387 Ca 0.05 -1.73 0.28 0.00 -0.52 0.00 0.00 52.55 50.63 2dgk s ASP 387 Cb -0.12 -0.86 1.52 0.00 -1.46 0.00 0.00 42.92 41.99 2dgk s ASP 387 CO 0.02 -0.40 1.99 -0.81 0.52 0.00 0.00 175.17 176.49 2dgk n PRO 388 N 4.73 1.17 -0.07 4.34 -0.04 -1.26 -4.87 135.00 138.99 2dgk n PRO 388 Ca -0.01 -0.24 0.00 0.00 -0.04 0.00 0.00 63.50 63.21 2dgk n PRO 388 Cb 0.41 -1.45 0.00 0.00 -0.04 0.00 0.00 33.50 32.43 2dgk n PRO 388 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2dgk n GLY 389 N 1.00 0.96 3.59 0.55 0.00 -1.26 -4.98 105.19 105.04 2dgk n GLY 389 Ca 0.21 -0.07 -0.04 0.00 0.00 0.00 0.00 46.02 46.11 2dgk n GLY 389 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2dgk s TYR 390 N -2.00 -0.14 0.38 1.61 -0.85 -1.26 -4.45 117.35 110.64 2dgk s TYR 390 Ca 0.00 0.07 0.08 0.00 -0.52 0.00 0.00 57.07 56.70 2dgk s TYR 390 Cb 0.00 0.52 -0.03 0.00 0.38 0.00 0.00 41.96 42.83 2dgk s TYR 390 CO 0.00 -0.26 0.27 0.95 -1.52 0.00 0.00 175.55 174.99 2dgk s THR 391 N -2.52 2.88 0.40 -3.49 -4.23 -1.26 -4.98 115.64 102.44 2dgk s THR 391 Ca 0.09 -1.49 0.29 0.00 -1.18 0.00 0.00 61.69 59.41 2dgk s THR 391 Cb -0.00 -3.04 0.31 0.00 1.34 0.00 0.00 72.50 71.11 2dgk s THR 391 CO -0.05 -0.08 2.08 -0.07 -0.54 0.00 0.00 174.62 175.96 2dgk h LEU 392 N 1.26 0.00 -0.41 4.79 3.38 -1.95 -1.78 115.31 120.60 2dgk h LEU 392 Ca -0.43 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.49 2dgk h LEU 392 Cb 1.26 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.99 2dgk h LEU 392 CO 0.61 0.11 0.06 1.88 0.09 0.00 0.00 178.44 181.19 2dgk h TYR 393 N 0.00 0.72 -0.55 1.13 0.05 -1.92 -0.62 116.97 115.78 2dgk h TYR 393 Ca -0.00 -0.10 -0.05 0.00 0.05 0.00 0.00 58.73 58.63 2dgk h TYR 393 Cb 0.34 -0.20 -0.02 0.00 1.01 0.00 0.00 36.73 37.86 2dgk h TYR 393 CO 0.00 0.71 0.15 -0.44 -1.05 0.00 0.00 178.16 177.53 2dgk h ASP 394 N 0.53 0.82 -0.62 3.88 3.32 -1.60 -1.86 116.42 120.90 2dgk h ASP 394 Ca 0.12 -0.22 -0.04 0.00 0.02 0.00 0.00 57.03 56.90 2dgk h ASP 394 Cb 0.38 -0.22 -0.03 0.00 0.22 0.00 0.00 39.33 39.68 2dgk h ASP 394 CO 0.01 0.83 0.23 0.25 -1.72 0.00 0.00 179.24 178.84 2dgk h LEU 395 N 0.78 0.90 -0.49 1.55 5.85 -1.28 -2.31 115.31 120.30 2dgk h LEU 395 Ca 0.17 -0.14 -0.01 0.00 0.84 0.00 0.00 57.88 58.75 2dgk h LEU 395 Cb 0.32 -0.23 -0.02 0.00 0.37 0.00 0.00 40.66 41.09 2dgk h LEU 395 CO -0.00 0.83 0.28 -1.28 -0.34 0.00 0.00 178.44 177.93 2dgk h SER 396 N 0.95 0.61 -0.44 1.25 0.87 -0.71 -1.50 113.55 114.57 2dgk h SER 396 Ca 0.22 -0.08 -0.01 0.00 -1.23 0.00 0.00 61.79 60.69 2dgk h SER 396 Cb 0.23 -0.15 -0.02 0.00 -0.44 0.00 0.00 62.40 62.02 2dgk h SER 396 CO -0.01 0.51 0.22 -0.08 -0.53 0.00 0.00 176.83 176.93 2dgk h GLU 397 N 0.66 0.63 -0.53 2.24 4.81 -1.02 -1.27 114.58 120.10 2dgk h GLU 397 Ca 0.18 -0.09 0.03 0.00 -0.13 0.00 0.00 59.36 59.34 2dgk h GLU 397 Cb 0.02 -0.11 -0.04 0.00 0.63 0.00 0.00 28.75 29.25 2dgk h GLU 397 CO -0.03 0.53 0.31 0.00 -0.73 0.00 0.00 179.01 179.09 2dgk h ARG 398 N 0.57 0.59 -0.35 1.92 2.47 -1.18 -1.82 114.38 116.57 2dgk h ARG 398 Ca 0.15 -0.04 -0.03 0.00 -1.26 0.00 0.00 59.98 58.80 2dgk h ARG 398 Cb 0.11 -0.13 -0.02 0.00 -1.65 0.00 0.00 29.97 28.28 2dgk h ARG 398 CO -0.02 0.39 0.07 -0.07 0.56 0.00 0.00 179.97 180.90 2dgk h LEU 399 N 0.61 0.48 -1.09 3.04 3.38 -1.01 -2.40 115.31 118.32 2dgk h LEU 399 Ca 0.22 -0.07 -0.05 0.00 0.09 0.00 0.00 57.88 58.07 2dgk h LEU 399 Cb 0.04 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 40.65 2dgk h LEU 399 CO -0.11 0.50 0.09 -0.09 0.09 0.00 0.00 178.44 178.92 2dgk h ARG 400 N 0.51 0.73 0.00 1.13 2.43 -0.42 -0.44 114.38 118.33 2dgk h ARG 400 Ca 0.12 -0.15 0.00 0.00 -0.81 0.00 0.00 59.98 59.14 2dgk h ARG 400 Cb 0.22 -0.11 0.00 0.00 -0.42 0.00 0.00 29.97 29.66 2dgk h ARG 400 CO -0.00 0.69 0.00 -0.07 -1.51 0.00 0.00 179.97 179.08 2dgk h LEU 401 N 0.71 0.00 -2.70 3.80 3.38 -0.90 -0.75 115.31 118.85 2dgk h LEU 401 Ca 0.15 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.12 2dgk h LEU 401 Cb 0.31 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.06 2dgk h LEU 401 CO 0.00 0.00 0.00 0.54 0.09 0.00 0.00 178.44 179.07 2dgk n ARG 402 N -2.65 2.70 -0.05 1.13 1.74 -0.28 -4.95 116.66 114.30 2dgk n ARG 402 Ca 0.01 -2.64 0.00 0.00 -0.77 0.00 0.00 57.85 54.45 2dgk n ARG 402 Cb 0.24 -1.57 0.00 0.00 -1.02 0.00 0.00 32.46 30.12 2dgk n ARG 402 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2dgk n GLY 403 N 1.67 0.76 3.87 -0.13 0.00 -0.29 -5.07 105.19 106.00 2dgk n GLY 403 Ca 0.24 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.90 2dgk n GLY 403 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2dgk s TRP 404 N -2.32 3.64 -0.40 1.61 0.52 -0.57 -4.72 118.94 116.70 2dgk s TRP 404 Ca 0.00 0.67 -0.03 0.00 0.02 0.00 0.00 56.10 56.76 2dgk s TRP 404 Cb 0.00 -2.05 0.10 0.00 -1.15 0.00 0.00 33.47 30.37 2dgk s TRP 404 CO 0.00 0.69 0.19 -1.14 0.02 0.00 0.00 176.95 176.72 2dgk s GLN 405 N -1.15 2.11 -0.33 4.98 2.00 -0.65 -2.43 119.66 124.19 2dgk s GLN 405 Ca 0.19 -1.74 0.03 0.00 -2.00 0.00 0.00 55.36 51.85 2dgk s GLN 405 Cb -0.14 -3.57 0.09 0.00 0.80 0.00 0.00 33.01 30.19 2dgk s GLN 405 CO 0.08 -1.02 0.02 0.08 -0.50 0.00 0.00 175.29 173.95 2dgk s VAL 406 N 1.18 2.34 0.29 1.34 1.01 -1.26 -0.56 120.40 124.74 2dgk s VAL 406 Ca 0.06 -2.14 -0.30 0.00 0.00 0.00 0.00 61.98 59.60 2dgk s VAL 406 Cb -0.23 -2.64 -0.11 0.00 0.00 0.00 0.00 36.38 33.41 2dgk s VAL 406 CO -0.03 -0.46 1.53 -2.16 0.00 0.00 0.00 175.10 173.97 2dgk s PRO 407 N 0.97 4.17 -0.05 2.72 0.04 -1.26 -4.69 135.00 136.89 2dgk s PRO 407 Ca 0.06 2.49 0.05 0.00 0.04 0.00 0.00 61.00 63.64 2dgk s PRO 407 Cb -0.19 -3.04 -0.01 0.00 0.04 0.00 0.00 34.50 31.30 2dgk s PRO 407 CO -0.07 -0.55 -0.21 0.00 0.04 0.00 0.00 177.00 176.21 2dgk s ALA 408 N -0.19 1.84 0.15 8.56 0.00 -1.26 -2.20 121.76 128.66 2dgk s ALA 408 Ca 0.60 -0.87 -0.24 0.00 0.00 0.00 0.00 51.96 51.46 2dgk s ALA 408 Cb -0.46 -0.59 0.07 0.00 0.00 0.00 0.00 23.12 22.14 2dgk s ALA 408 CO 0.49 0.34 0.63 -0.59 0.00 0.00 0.00 175.76 176.63 2dgk s PHE 409 N -0.05 -0.52 0.12 0.00 -0.12 -0.28 -3.43 117.98 113.70 2dgk s PHE 409 Ca -0.04 0.32 -0.14 0.00 -0.05 0.00 0.00 56.93 57.01 2dgk s PHE 409 Cb -0.13 0.56 -0.07 0.00 -0.63 0.00 0.00 43.02 42.75 2dgk s PHE 409 CO 0.03 -0.82 0.52 0.95 -0.05 0.00 0.00 175.22 175.85 2dgk s THR 410 N -3.69 4.89 0.65 -4.49 -4.23 -1.26 -0.42 115.64 107.09 2dgk s THR 410 Ca 0.01 0.81 -0.09 0.00 -1.18 0.00 0.00 61.69 61.24 2dgk s THR 410 Cb -0.01 -3.74 0.00 0.00 1.34 0.00 0.00 72.50 70.10 2dgk s THR 410 CO -0.13 0.30 1.01 -0.76 -0.54 0.00 0.00 174.62 174.51 2dgk s LEU 411 N -1.80 3.09 0.00 4.79 1.43 -0.08 -4.96 118.68 121.14 2dgk s LEU 411 Ca 0.35 1.03 0.00 0.00 -1.03 0.00 0.00 54.13 54.48 2dgk s LEU 411 Cb -0.15 -3.88 0.00 0.00 0.03 0.00 0.00 46.19 42.19 2dgk s LEU 411 CO 0.19 -1.15 0.00 0.61 0.23 0.00 0.00 176.35 176.23 2dgk n GLY 412 N -2.80 3.53 7.00 -3.19 0.00 -1.26 -3.12 105.19 105.35 2dgk n GLY 412 Ca 0.06 -2.03 0.00 0.00 0.00 0.00 0.00 46.02 44.05 2dgk n GLY 412 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2dgk n GLY 413 N 5.00 3.66 2.09 -0.02 0.00 -1.26 -1.86 105.19 112.81 2dgk n GLY 413 Ca 0.00 -0.05 -0.27 0.00 0.00 0.00 0.00 46.02 45.71 2dgk n GLY 413 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2dgk n GLU 414 N 13.70 2.65 -1.06 1.61 1.02 0.16 -4.24 120.64 134.47 2dgk n GLU 414 Ca 0.00 -3.39 0.01 0.00 -0.02 0.00 0.00 57.16 53.76 2dgk n GLU 414 Cb 0.00 -2.20 0.00 0.00 -0.02 0.00 0.00 31.44 29.22 2dgk n GLU 414 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2dgk n ALA 415 N -0.96 2.42 0.38 0.62 0.00 -0.78 -4.13 120.51 118.06 2dgk n ALA 415 Ca 0.55 -1.55 0.04 0.00 0.00 0.00 0.00 53.44 52.48 2dgk n ALA 415 Cb 0.97 -0.56 0.20 0.00 0.00 0.00 0.00 19.45 20.06 2dgk n ALA 415 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 2dgk n THR 416 N 0.25 0.82 0.80 0.00 -2.24 -1.18 -0.71 114.28 112.00 2dgk n THR 416 Ca -0.01 0.20 0.12 0.00 -2.27 0.00 0.00 64.05 62.09 2dgk n THR 416 Cb 0.91 -1.07 0.26 0.00 -2.10 0.00 0.00 70.33 68.32 2dgk n THR 416 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 2dgk n ASP 417 N -1.28 2.74 -4.58 3.42 2.03 -1.26 -4.69 116.55 112.94 2dgk n ASP 417 Ca 0.04 -1.88 -0.36 0.00 0.52 0.00 0.00 54.79 53.11 2dgk n ASP 417 Cb 0.06 -0.14 -0.11 0.00 -0.72 0.00 0.00 41.12 40.22 2dgk n ASP 417 CO 0.00 0.00 0.00 -0.63 -1.92 0.00 0.00 177.20 174.65 2dgk s ILE 418 N -1.73 4.78 -0.20 5.18 -1.09 0.11 -5.03 121.20 123.22 2dgk s ILE 418 Ca 0.35 -0.02 -0.04 0.00 -2.23 0.00 0.00 60.65 58.70 2dgk s ILE 418 Cb 0.21 -3.21 -0.02 0.00 -1.58 0.00 0.00 42.46 37.87 2dgk s ILE 418 CO 0.30 0.38 -0.03 -0.69 -1.23 0.00 0.00 174.94 173.67 2dgk s VAL 419 N 1.00 3.60 0.35 2.92 1.01 -1.26 -0.90 120.40 127.12 2dgk s VAL 419 Ca 0.05 -0.43 0.09 0.00 0.00 0.00 0.00 61.98 61.69 2dgk s VAL 419 Cb -0.14 -2.62 -0.06 0.00 0.00 0.00 0.00 36.38 33.55 2dgk s VAL 419 CO 0.03 0.43 -0.06 0.68 0.00 0.00 0.00 175.10 176.19 2dgk s VAL 420 N 1.15 2.28 -0.07 2.92 -7.23 0.45 -4.40 120.40 115.50 2dgk s VAL 420 Ca 0.02 -2.13 0.04 0.00 -1.81 0.00 0.00 61.98 58.10 2dgk s VAL 420 Cb -0.15 -2.73 0.00 0.00 0.56 0.00 0.00 36.38 34.07 2dgk s VAL 420 CO 0.00 -0.17 -0.19 -0.32 -0.31 0.00 0.00 175.10 174.11 2dgk s MET 421 N -3.65 2.23 -0.09 4.82 1.75 -0.45 -1.13 119.30 122.78 2dgk s MET 421 Ca 0.33 -0.68 0.02 0.00 -1.25 0.00 0.00 55.69 54.11 2dgk s MET 421 Cb 0.03 -1.82 0.01 0.00 2.84 0.00 0.00 34.83 35.90 2dgk s MET 421 CO 0.17 0.20 -0.15 0.50 -0.65 0.00 0.00 175.02 175.09 2dgk s ARG 422 N 0.24 2.11 -0.20 4.11 3.52 -0.93 -1.70 118.95 126.09 2dgk s ARG 422 Ca -0.10 -0.53 -0.02 0.00 -0.13 0.00 0.00 55.73 54.94 2dgk s ARG 422 Cb -0.15 -1.76 -0.00 0.00 -1.56 0.00 0.00 34.95 31.48 2dgk s ARG 422 CO 0.05 -0.02 -0.10 0.42 -0.81 0.00 0.00 175.30 174.84 2dgk s ILE 423 N 0.84 2.94 -0.19 4.11 1.01 0.13 -4.07 121.20 125.97 2dgk s ILE 423 Ca -0.10 -0.65 -0.13 0.00 0.00 0.00 0.00 60.65 59.78 2dgk s ILE 423 Cb -0.15 -2.30 -0.05 0.00 0.01 0.00 0.00 42.46 39.97 2dgk s ILE 423 CO 0.01 0.47 0.24 -0.32 0.00 0.00 0.00 174.94 175.35 2dgk s MET 424 N 1.29 4.20 -0.61 2.79 1.75 0.00 -1.19 119.30 127.53 2dgk s MET 424 Ca 0.03 -0.03 -0.09 0.00 -1.25 0.00 0.00 55.69 54.36 2dgk s MET 424 Cb -0.14 -3.46 0.16 0.00 2.84 0.00 0.00 34.83 34.23 2dgk s MET 424 CO -0.05 0.19 0.49 0.00 -0.65 0.00 0.00 175.02 175.00 2dgk s ARG 426 N 0.69 2.48 0.24 0.00 0.52 -1.26 -4.81 118.95 116.82 2dgk s ARG 426 Ca 0.12 -1.03 -0.31 0.00 -0.52 0.00 0.00 55.73 53.98 2dgk s ARG 426 Cb -0.21 -2.55 -0.12 0.00 0.52 0.00 0.00 34.95 32.59 2dgk s ARG 426 CO -0.03 -0.71 1.66 -2.13 0.02 0.00 0.00 175.30 174.10 2dgk n ARG 427 N -2.27 2.70 0.00 3.54 0.63 -1.26 -1.88 116.66 118.13 2dgk n ARG 427 Ca 0.10 0.97 0.00 0.00 -0.92 0.00 0.00 57.85 58.00 2dgk n ARG 427 Cb 0.60 -2.78 0.00 0.00 0.45 0.00 0.00 32.46 30.72 2dgk n ARG 427 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2dgk n GLY 428 N 3.17 2.66 3.49 5.14 0.00 -1.26 -4.51 105.19 113.89 2dgk n GLY 428 Ca 0.13 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.71 2dgk n GLY 428 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2dgk s PHE 429 N -2.54 3.17 0.83 1.61 5.36 -0.79 -4.99 117.98 120.64 2dgk s PHE 429 Ca 0.00 -1.73 -0.12 0.00 -0.96 0.00 0.00 56.93 54.12 2dgk s PHE 429 Cb 0.00 -4.43 0.09 0.00 -0.34 0.00 0.00 43.02 38.34 2dgk s PHE 429 CO 0.00 -1.55 1.15 -1.21 -1.46 0.00 0.00 175.22 172.15 2dgk s GLU 430 N 2.70 1.78 0.27 10.12 0.41 -1.26 -4.84 118.70 127.88 2dgk s GLU 430 Ca 0.43 0.25 -0.00 0.00 -0.41 0.00 0.00 54.97 55.24 2dgk s GLU 430 Cb -0.02 -1.92 0.54 0.00 -1.78 0.00 0.00 34.13 30.96 2dgk s GLU 430 CO -0.02 -1.75 1.80 0.52 -0.49 0.00 0.00 175.26 175.32 2dgk h MET 431 N -1.17 0.77 0.00 1.61 2.86 -1.94 0.67 114.93 117.73 2dgk h MET 431 Ca -0.48 -0.05 -0.05 0.00 -2.06 0.00 0.00 59.70 57.07 2dgk h MET 431 Cb 1.32 -0.17 -0.01 0.00 0.06 0.00 0.00 31.60 32.80 2dgk h MET 431 CO 0.64 0.51 -0.23 0.38 1.06 0.00 0.00 176.91 179.27 2dgk h ASP 432 N 0.79 0.00 -0.05 1.22 2.03 -1.99 0.49 116.42 118.91 2dgk h ASP 432 Ca 0.48 0.00 -0.22 0.00 -0.73 0.00 0.00 57.03 56.56 2dgk h ASP 432 Cb 0.58 0.00 0.01 0.00 -0.83 0.00 0.00 39.33 39.09 2dgk h ASP 432 CO -0.31 0.23 -0.80 -0.26 -1.03 0.00 0.00 179.24 177.07 2dgk h PHE 433 N 0.00 0.97 -0.36 4.15 -1.00 -1.27 -2.48 116.94 116.96 2dgk h PHE 433 Ca -0.00 -0.44 -0.10 0.00 2.81 0.00 0.00 57.97 60.24 2dgk h PHE 433 Cb 0.52 -0.15 -0.02 0.00 3.61 0.00 0.00 35.95 39.92 2dgk h PHE 433 CO 0.00 1.26 -0.19 0.00 -1.61 0.00 0.00 178.31 177.77 2dgk h ALA 434 N 0.61 1.01 -0.58 2.45 0.00 -0.48 -0.74 119.26 121.53 2dgk h ALA 434 Ca -0.06 -0.34 -0.09 0.00 0.00 0.00 0.00 54.91 54.42 2dgk h ALA 434 Cb 1.42 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 19.04 2dgk h ALA 434 CO 0.16 0.59 0.00 0.93 0.00 0.00 0.00 179.25 180.93 2dgk h GLU 435 N 0.60 1.01 -0.47 0.00 5.08 -0.87 -0.90 114.58 119.02 2dgk h GLU 435 Ca 0.09 -0.31 -0.10 0.00 -1.00 0.00 0.00 59.36 58.04 2dgk h GLU 435 Cb 0.65 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.78 2dgk h GLU 435 CO 0.05 0.99 -0.12 1.25 -1.00 0.00 0.00 179.01 180.18 2dgk h LEU 436 N 0.93 0.87 -0.50 1.33 5.85 -1.10 -2.02 115.31 120.67 2dgk h LEU 436 Ca 0.17 -0.28 0.03 0.00 0.84 0.00 0.00 57.88 58.64 2dgk h LEU 436 Cb 0.53 -0.24 -0.03 0.00 0.37 0.00 0.00 40.66 41.29 2dgk h LEU 436 CO 0.03 1.00 0.29 0.25 -0.34 0.00 0.00 178.44 179.67 2dgk h LEU 437 N 0.79 0.47 -0.74 2.25 6.46 -0.60 -1.29 115.31 122.64 2dgk h LEU 437 Ca 0.13 0.01 -0.01 0.00 -0.12 0.00 0.00 57.88 57.89 2dgk h LEU 437 Cb 0.64 -0.09 -0.04 0.00 -0.73 0.00 0.00 40.66 40.44 2dgk h LEU 437 CO 0.04 0.33 0.44 -0.07 -0.62 0.00 0.00 178.44 178.56 2dgk h LEU 438 N 0.58 0.90 -0.77 2.25 3.38 -0.88 0.27 115.31 121.04 2dgk h LEU 438 Ca 0.20 -0.07 -0.03 0.00 0.09 0.00 0.00 57.88 58.07 2dgk h LEU 438 Cb 0.03 -0.23 -0.04 0.00 0.09 0.00 0.00 40.66 40.52 2dgk h LEU 438 CO -0.10 0.71 0.36 -0.33 0.09 0.00 0.00 178.44 179.17 2dgk h GLU 439 N 1.02 1.12 -0.05 1.13 4.39 -0.84 0.32 114.58 121.67 2dgk h GLU 439 Ca 0.27 -0.18 -0.11 0.00 0.34 0.00 0.00 59.36 59.68 2dgk h GLU 439 Cb -0.02 -0.20 -0.01 0.00 -0.10 0.00 0.00 28.75 28.42 2dgk h GLU 439 CO -0.05 0.88 -0.46 -0.44 -1.16 0.00 0.00 179.01 177.79 2dgk h ASP 440 N 1.10 0.13 -0.05 1.42 3.32 -0.64 -0.85 116.42 120.86 2dgk h ASP 440 Ca 0.26 -0.06 -0.01 0.00 0.02 0.00 0.00 57.03 57.25 2dgk h ASP 440 Cb 0.14 -0.04 -0.00 0.00 0.22 0.00 0.00 39.33 39.65 2dgk h ASP 440 CO -0.03 0.58 0.01 0.22 -1.72 0.00 0.00 179.24 178.29 2dgk h TYR 441 N 0.10 0.08 -0.63 4.55 5.03 0.35 0.82 116.97 127.27 2dgk h TYR 441 Ca 0.00 -0.01 -0.00 0.00 2.58 0.00 0.00 58.73 61.30 2dgk h TYR 441 Cb 0.86 -0.02 -0.03 0.00 1.55 0.00 0.00 36.73 39.08 2dgk h TYR 441 CO 0.01 0.32 0.38 0.87 -1.32 0.00 0.00 178.16 178.43 2dgk h LYS 442 N -0.18 0.86 -0.85 1.82 1.57 -0.82 -1.24 116.57 117.72 2dgk h LYS 442 Ca 0.01 -0.08 0.01 0.00 -1.87 0.00 0.00 60.65 58.72 2dgk h LYS 442 Cb 0.29 -0.18 -0.04 0.00 0.08 0.00 0.00 32.23 32.38 2dgk h LYS 442 CO 0.00 0.61 0.55 0.00 -0.57 0.00 0.00 179.45 180.04 2dgk h ALA 443 N 1.20 1.08 -0.51 3.86 0.00 -0.97 -1.15 119.26 122.77 2dgk h ALA 443 Ca 0.23 -0.07 -0.08 0.00 0.00 0.00 0.00 54.91 54.99 2dgk h ALA 443 Cb -0.03 -0.35 -0.02 0.00 0.00 0.00 0.00 17.79 17.39 2dgk h ALA 443 CO -0.04 0.50 -0.01 0.77 0.00 0.00 0.00 179.25 180.47 2dgk h SER 444 N 1.16 0.84 -0.24 0.00 0.02 -0.36 -1.93 113.55 113.05 2dgk h SER 444 Ca 0.31 -0.22 -0.02 0.00 -0.84 0.00 0.00 61.79 61.03 2dgk h SER 444 Cb -0.11 -0.22 -0.01 0.00 0.14 0.00 0.00 62.40 62.19 2dgk h SER 444 CO -0.07 0.91 0.08 -0.07 -1.14 0.00 0.00 176.83 176.55 2dgk h LEU 445 N 0.80 0.34 -0.77 5.07 3.38 -0.58 -1.44 115.31 122.11 2dgk h LEU 445 Ca 0.15 -0.19 0.01 0.00 0.09 0.00 0.00 57.88 57.94 2dgk h LEU 445 Cb 0.50 -0.09 -0.04 0.00 0.09 0.00 0.00 40.66 41.12 2dgk h LEU 445 CO 0.02 0.44 0.51 0.50 0.09 0.00 0.00 178.44 180.00 2dgk h LYS 446 N 0.22 1.00 -0.65 1.13 3.64 -1.08 0.80 116.57 121.63 2dgk h LYS 446 Ca 0.08 -0.06 -0.03 0.00 -1.27 0.00 0.00 60.65 59.37 2dgk h LYS 446 Cb 0.22 -0.23 -0.03 0.00 -0.41 0.00 0.00 32.23 31.78 2dgk h LYS 446 CO -0.00 0.66 0.28 -0.92 -2.27 0.00 0.00 179.45 177.20 2dgk h TYR 447 N 1.03 0.97 -0.34 1.91 3.20 -1.17 -0.09 116.97 122.49 2dgk h TYR 447 Ca 0.29 -0.06 -0.07 0.00 3.14 0.00 0.00 58.73 62.03 2dgk h TYR 447 Cb -0.10 -0.29 -0.02 0.00 1.54 0.00 0.00 36.73 37.86 2dgk h TYR 447 CO -0.02 0.75 -0.07 -0.07 -1.64 0.00 0.00 178.16 177.11 2dgk h LEU 448 N 0.91 0.53 -0.27 2.82 3.38 -0.61 -0.69 115.31 121.38 2dgk h LEU 448 Ca 0.22 -0.13 -0.05 0.00 0.09 0.00 0.00 57.88 58.01 2dgk h LEU 448 Cb 0.17 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.77 2dgk h LEU 448 CO -0.02 0.66 -0.04 -1.28 0.09 0.00 0.00 178.44 177.84 2dgk h SER 449 N 0.52 0.51 0.77 -0.43 0.87 -0.20 -2.92 113.55 112.67 2dgk h SER 449 Ca 0.10 -0.35 0.00 0.00 -1.23 0.00 0.00 61.79 60.32 2dgk h SER 449 Cb 0.45 -0.14 0.00 0.00 -0.44 0.00 0.00 62.40 62.27 2dgk h SER 449 CO 0.02 0.74 0.00 0.47 -0.53 0.00 0.00 176.83 177.53 2dgk n ASP 450 N -4.55 0.11 -3.20 6.23 8.00 -0.11 -4.02 116.55 119.01 2dgk n ASP 450 Ca -0.03 0.52 -0.23 0.00 0.71 0.00 0.00 54.79 55.76 2dgk n ASP 450 Cb 0.29 -0.54 -0.06 0.00 -0.02 0.00 0.00 41.12 40.79 2dgk n ASP 450 CO 0.00 0.00 0.00 1.41 -0.39 0.00 0.00 177.20 178.22 2dgk n HIS 451 N -1.61 0.89 0.03 1.24 8.25 -0.30 -4.97 115.22 118.75 2dgk n HIS 451 Ca 0.05 -3.78 0.22 0.00 -0.26 0.00 0.00 57.72 53.95 2dgk n HIS 451 Cb 0.25 -0.42 0.64 0.00 1.12 0.00 0.00 29.99 31.59 2dgk n HIS 451 CO 0.00 0.00 0.00 -1.35 0.64 0.00 0.00 176.34 175.63 2dgk h PRO 452 N 3.64 0.00 0.00 -0.41 0.11 -1.68 -0.93 132.00 132.72 2dgk h PRO 452 Ca 0.11 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.22 2dgk h PRO 452 Cb 0.83 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.94 2dgk h PRO 452 CO 0.57 0.00 0.00 0.87 -0.21 0.00 0.00 178.00 179.23 2dgk h LYS 453 N 0.00 0.00 -0.24 1.05 1.57 -1.93 -2.82 116.57 114.19 2dgk h LYS 453 Ca 0.26 0.00 -0.16 0.00 -1.87 0.00 0.00 60.65 58.88 2dgk h LYS 453 Cb 1.61 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.92 2dgk h LYS 453 CO -0.00 0.00 -0.50 -0.07 -0.57 0.00 0.00 179.45 178.30 2dgk h LEU 454 N 0.00 0.74 -9.22 2.94 3.38 -1.51 -3.46 115.31 108.19 2dgk h LEU 454 Ca 0.00 -0.38 -0.70 0.00 0.09 0.00 0.00 57.88 56.89 2dgk h LEU 454 Cb 0.19 -0.21 0.06 0.00 0.09 0.00 0.00 40.66 40.79 2dgk h LEU 454 CO 0.00 1.12 0.34 1.67 0.09 0.00 0.00 178.44 181.66 2dgk n GLN 455 N -3.99 0.92 -0.39 1.13 7.27 -1.07 -2.25 117.38 119.00 2dgk n GLN 455 Ca -0.03 0.33 0.00 0.00 0.07 0.00 0.00 57.00 57.37 2dgk n GLN 455 Cb 0.59 -1.92 0.00 0.00 2.41 0.00 0.00 30.24 31.32 2dgk n GLN 455 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 2dgk n GLY 456 N 2.26 1.72 0.14 1.69 0.00 -1.26 -4.94 105.19 104.79 2dgk n GLY 456 Ca 0.18 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.10 2dgk n GLY 456 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 2dgk h ILE 457 N 0.00 0.72 -2.95 -0.61 2.04 -1.77 -3.45 117.51 111.50 2dgk h ILE 457 Ca 0.00 -1.11 -0.52 0.00 1.00 0.00 0.00 64.86 64.23 2dgk h ILE 457 Cb 0.00 1.23 0.05 0.00 -0.74 0.00 0.00 36.82 37.36 2dgk h ILE 457 CO 0.00 0.19 0.86 0.00 0.00 0.00 0.00 178.15 179.21 2dgk s ALA 458 N -3.58 3.76 0.00 1.87 0.00 -1.26 -4.91 121.76 117.63 2dgk s ALA 458 Ca -0.11 1.39 0.06 0.00 0.00 0.00 0.00 51.96 53.29 2dgk s ALA 458 Cb 0.00 -3.62 0.10 0.00 0.00 0.00 0.00 23.12 19.60 2dgk s ALA 458 CO 0.42 -0.79 0.91 0.00 0.00 0.00 0.00 175.76 176.30 2dgk n GLN 459 N 3.54 0.00 -4.55 0.00 10.64 -1.26 -4.63 117.38 121.11 2dgk n GLN 459 Ca 0.12 -0.98 -0.33 0.00 -1.83 0.00 0.00 57.00 53.98 2dgk n GLN 459 Cb 0.39 -0.13 -0.14 0.00 -0.86 0.00 0.00 30.24 29.49 2dgk n GLN 459 CO 0.00 0.00 0.00 -1.14 -1.83 0.00 0.00 177.06 174.09 2dgk s GLN 460 N 0.00 3.38 0.28 2.61 2.00 -1.26 -5.10 119.66 121.57 2dgk s GLN 460 Ca 0.08 -0.67 -0.29 0.00 -2.00 0.00 0.00 55.36 52.47 2dgk s GLN 460 Cb 0.09 -2.72 -0.10 0.00 0.80 0.00 0.00 33.01 31.08 2dgk s GLN 460 CO -0.04 0.11 1.31 -0.80 -0.50 0.00 0.00 175.29 175.37 2dgk s ASN 461 N 0.62 6.83 0.70 6.67 0.01 -1.26 -4.94 114.94 123.56 2dgk s ASN 461 Ca -0.06 2.57 -0.05 0.00 -0.71 0.00 0.00 52.86 54.61 2dgk s ASN 461 Cb -0.15 -2.63 0.07 0.00 0.41 0.00 0.00 41.25 38.94 2dgk s ASN 461 CO 0.03 -0.52 0.99 -0.44 -1.51 0.00 0.00 177.10 175.65 2dgk s SER 462 N -0.19 4.74 0.17 -1.22 0.01 -1.22 -5.00 113.70 110.99 2dgk s SER 462 Ca 0.52 0.28 -0.32 0.00 1.31 0.00 0.00 55.95 57.75 2dgk s SER 462 Cb -0.38 -0.91 -0.10 0.00 0.21 0.00 0.00 66.02 64.83 2dgk s SER 462 CO 0.47 -1.62 1.62 0.12 0.41 0.00 0.00 173.24 174.24 2dgk s PHE 463 N -3.19 2.95 -0.06 2.43 5.36 -1.26 -4.87 117.98 119.34 2dgk s PHE 463 Ca 0.61 0.52 0.08 0.00 -0.96 0.00 0.00 56.93 57.18 2dgk s PHE 463 Cb -0.10 -3.99 0.13 0.00 -0.34 0.00 0.00 43.02 38.72 2dgk s PHE 463 CO 0.44 -3.70 1.01 0.36 -1.46 0.00 0.00 175.22 171.87 2dgk n LYS 464 N 4.15 0.94 -1.02 10.12 2.85 -1.26 -4.88 118.16 129.07 2dgk n LYS 464 Ca 0.15 -1.70 -0.01 0.00 -1.05 0.00 0.00 58.31 55.70 2dgk n LYS 464 Cb 0.38 -1.00 -0.00 0.00 -0.65 0.00 0.00 35.03 33.76 2dgk n LYS 464 CO 0.00 0.00 0.00 1.58 -0.05 0.00 0.00 177.40 178.93 2dgk n HIS 465 N -0.69 0.00 -1.38 5.58 -0.00 -1.26 -4.82 115.22 112.65 2dgk n HIS 465 Ca 0.07 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.79 2dgk n HIS 465 Cb 0.60 -0.46 0.00 0.00 -0.00 0.00 0.00 29.99 30.12 2dgk n HIS 465 CO 0.00 0.00 0.00 -2.37 -0.00 0.00 0.00 176.34 173.97