#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2uug s THR 6 N 0.00 2.27 0.14 -5.08 -4.23 -1.26 -3.49 115.64 104.00 2uug s THR 6 Ca 0.00 -1.70 -0.12 0.00 -1.18 0.00 0.00 61.69 58.69 2uug s THR 6 Cb 0.00 -2.98 -0.01 0.00 1.34 0.00 0.00 72.50 70.85 2uug s THR 6 CO 0.00 0.00 1.53 -0.50 -0.54 0.00 0.00 174.62 175.11 2uug h TRP 7 N 1.42 1.02 0.00 3.99 -0.00 -1.96 -2.28 115.95 118.14 2uug h TRP 7 Ca -0.43 -0.24 -0.02 0.00 -0.00 0.00 0.00 58.89 58.21 2uug h TRP 7 Cb 1.25 -0.24 -0.00 0.00 -0.00 0.00 0.00 29.16 30.17 2uug h TRP 7 CO 0.65 1.02 -0.08 0.45 -0.00 0.00 0.00 178.44 180.48 2uug h HIS 8 N 0.72 0.00 0.05 0.49 3.86 -1.96 0.32 115.15 118.63 2uug h HIS 8 Ca 0.10 0.00 -0.07 0.00 -1.16 0.00 0.00 60.37 59.25 2uug h HIS 8 Cb 0.72 0.00 0.01 0.00 1.06 0.00 0.00 27.41 29.20 2uug h HIS 8 CO 0.05 0.08 -0.30 -0.44 0.86 0.00 0.00 177.93 178.18 2uug h ASP 9 N 0.00 0.16 0.76 2.45 3.32 -1.90 -3.00 116.42 118.22 2uug h ASP 9 Ca -0.00 -0.98 -0.25 0.00 0.02 0.00 0.00 57.03 55.82 2uug h ASP 9 Cb 0.20 -0.05 -0.04 0.00 0.22 0.00 0.00 39.33 39.66 2uug h ASP 9 CO 0.01 1.14 -1.33 -0.37 -1.72 0.00 0.00 179.24 176.97 2uug h VAL 10 N -0.78 1.27 -0.01 -1.35 -1.51 -1.28 -3.35 116.25 109.24 2uug h VAL 10 Ca -0.05 -3.03 0.00 0.00 -1.23 0.00 0.00 66.70 62.38 2uug h VAL 10 Cb 1.23 2.62 0.00 0.00 -2.13 0.00 0.00 31.29 33.01 2uug h VAL 10 CO 0.05 0.72 -0.34 0.18 -1.23 0.00 0.00 177.57 176.95 2uug n LEU 11 N -3.19 0.93 -0.11 4.19 4.77 0.11 -4.38 117.00 119.32 2uug n LEU 11 Ca -0.08 -0.22 -0.05 0.00 -0.03 0.00 0.00 56.01 55.63 2uug n LEU 11 Cb 0.99 -0.15 0.01 0.00 -2.33 0.00 0.00 43.42 41.94 2uug n LEU 11 CO 0.46 0.18 0.79 0.00 -1.33 0.00 0.00 177.39 177.50 2uug h ALA 12 N 3.51 0.26 0.00 -1.18 0.00 -1.64 -1.09 119.26 119.12 2uug h ALA 12 Ca 0.00 0.15 -0.06 0.00 0.00 0.00 0.00 54.91 55.00 2uug h ALA 12 Cb 0.51 0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.58 2uug h ALA 12 CO 0.00 -0.45 -0.28 1.49 0.00 0.00 0.00 179.25 180.01 2uug h GLU 13 N 0.01 0.00 0.00 0.00 4.81 -1.84 -2.70 114.58 114.86 2uug h GLU 13 Ca 0.18 0.00 -0.15 0.00 -0.13 0.00 0.00 59.36 59.26 2uug h GLU 13 Cb 0.28 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.64 2uug h GLU 13 CO -0.39 0.28 -0.72 1.49 -0.73 0.00 0.00 179.01 178.94 2uug h GLU 14 N 0.00 0.00 0.00 1.92 4.57 -1.56 -3.13 114.58 116.38 2uug h GLU 14 Ca -0.00 0.00 -0.02 0.00 -1.18 0.00 0.00 59.36 58.16 2uug h GLU 14 Cb 0.50 0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 29.08 2uug h GLU 14 CO 0.04 0.72 -0.08 0.87 -1.18 0.00 0.00 179.01 179.38 2uug h LYS 15 N 0.00 0.00 0.00 1.92 1.79 -0.89 -2.61 116.57 116.78 2uug h LYS 15 Ca -0.01 0.00 -0.16 0.00 -2.18 0.00 0.00 60.65 58.30 2uug h LYS 15 Cb 1.32 0.00 -0.02 0.00 -1.58 0.00 0.00 32.23 31.94 2uug h LYS 15 CO 0.09 0.08 -0.78 1.96 -1.08 0.00 0.00 179.45 179.73 2uug h GLN 16 N 0.00 0.00 -6.33 3.15 1.08 -1.60 -3.42 115.11 108.00 2uug h GLN 16 Ca -0.00 0.00 -0.65 0.00 -1.45 0.00 0.00 58.65 56.55 2uug h GLN 16 Cb 0.28 0.00 0.08 0.00 -0.05 0.00 0.00 27.48 27.78 2uug h GLN 16 CO 0.01 0.74 0.29 1.04 -0.95 0.00 0.00 178.83 179.96 2uug n GLN 17 N -3.28 1.16 -0.31 1.46 1.13 -0.99 -4.85 117.38 111.71 2uug n GLN 17 Ca 0.01 0.42 0.06 0.00 -1.94 0.00 0.00 57.00 55.54 2uug n GLN 17 Cb 0.84 -1.93 0.21 0.00 0.11 0.00 0.00 30.24 29.48 2uug n GLN 17 CO 0.00 0.00 0.00 -1.35 -1.44 0.00 0.00 177.06 174.27 2uug h PRO 18 N 3.50 0.74 -0.30 -1.09 0.11 -1.91 -1.88 132.00 131.17 2uug h PRO 18 Ca -0.44 -0.04 -0.07 0.00 0.11 0.00 0.00 66.00 65.56 2uug h PRO 18 Cb 1.34 -0.17 -0.02 0.00 0.11 0.00 0.00 31.00 32.27 2uug h PRO 18 CO 0.71 0.49 -0.09 0.10 -0.21 0.00 0.00 178.00 179.00 2uug h TYR 19 N 0.76 0.53 -0.14 0.65 -0.00 -1.96 -1.42 116.97 115.39 2uug h TYR 19 Ca 0.46 -0.07 -0.06 0.00 0.00 0.00 0.00 58.73 59.05 2uug h TYR 19 Cb 0.54 -0.14 -0.00 0.00 0.00 0.00 0.00 36.73 37.12 2uug h TYR 19 CO -0.06 0.58 -0.16 0.35 -0.00 0.00 0.00 178.16 178.87 2uug h PHE 20 N 0.46 0.44 -0.57 0.10 3.57 -1.66 -2.14 116.94 117.14 2uug h PHE 20 Ca 0.09 -0.14 -0.06 0.00 3.53 0.00 0.00 57.97 61.40 2uug h PHE 20 Cb 0.45 -0.09 -0.03 0.00 2.79 0.00 0.00 35.95 39.07 2uug h PHE 20 CO 0.01 0.77 0.13 -0.07 -2.23 0.00 0.00 178.31 176.92 2uug h LEU 21 N -0.01 0.83 -0.47 0.59 3.38 -1.37 -1.99 115.31 116.26 2uug h LEU 21 Ca 0.02 -0.16 0.02 0.00 0.09 0.00 0.00 57.88 57.85 2uug h LEU 21 Cb 0.70 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 41.20 2uug h LEU 21 CO 0.04 0.82 0.28 -1.13 0.09 0.00 0.00 178.44 178.53 2uug h ASN 22 N 0.85 0.44 0.54 -0.43 -0.73 -1.24 -0.74 115.58 114.27 2uug h ASN 22 Ca 0.18 0.01 -0.03 0.00 1.87 0.00 0.00 56.30 58.33 2uug h ASN 22 Cb 0.32 -0.09 0.01 0.00 0.27 0.00 0.00 38.32 38.83 2uug h ASN 22 CO 0.00 0.32 -0.26 0.74 -0.37 0.00 0.00 177.43 177.86 2uug h THR 23 N 0.55 0.37 -0.88 -3.57 2.02 -0.91 -0.95 112.91 109.54 2uug h THR 23 Ca 0.19 -0.32 0.12 0.00 0.77 0.00 0.00 66.41 67.17 2uug h THR 23 Cb 0.02 0.49 -0.07 0.00 -1.74 0.00 0.00 68.15 66.85 2uug h THR 23 CO -0.09 0.04 0.57 -0.07 0.37 0.00 0.00 175.52 176.34 2uug h LEU 24 N -0.95 0.72 -0.72 2.58 3.38 -1.32 -0.57 115.31 118.43 2uug h LEU 24 Ca -0.07 0.03 -0.13 0.00 0.09 0.00 0.00 57.88 57.80 2uug h LEU 24 Cb 0.63 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.25 2uug h LEU 24 CO 0.12 0.39 -0.37 -0.61 0.09 0.00 0.00 178.44 178.07 2uug h GLN 25 N 0.78 0.56 -0.12 1.13 5.75 -1.05 0.34 115.11 122.50 2uug h GLN 25 Ca 0.43 -0.27 -0.05 0.00 -0.15 0.00 0.00 58.65 58.61 2uug h GLN 25 Cb 0.57 -0.00 -0.00 0.00 1.07 0.00 0.00 27.48 29.11 2uug h GLN 25 CO -0.19 0.84 -0.12 1.15 -2.65 0.00 0.00 178.83 177.86 2uug h THR 26 N 0.47 1.35 0.21 2.39 2.02 0.28 -0.75 112.91 118.89 2uug h THR 26 Ca 0.05 -1.27 -0.00 0.00 0.77 0.00 0.00 66.41 65.95 2uug h THR 26 Cb 0.85 1.91 -0.01 0.00 -1.74 0.00 0.00 68.15 69.17 2uug h THR 26 CO 0.07 0.37 -0.15 0.58 0.37 0.00 0.00 175.52 176.76 2uug h VAL 27 N -0.09 0.67 -1.00 3.16 2.07 -1.18 -1.40 116.25 118.49 2uug h VAL 27 Ca 0.02 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.59 2uug h VAL 27 Cb 0.64 0.67 -0.06 0.00 -1.52 0.00 0.00 31.29 31.02 2uug h VAL 27 CO 0.03 0.00 0.65 0.00 0.02 0.00 0.00 177.57 178.27 2uug h ALA 28 N 0.40 1.37 -0.66 1.67 0.00 -0.95 -0.90 119.26 120.19 2uug h ALA 28 Ca -0.01 -0.04 -0.08 0.00 0.00 0.00 0.00 54.91 54.78 2uug h ALA 28 Cb 0.32 -0.34 -0.03 0.00 0.00 0.00 0.00 17.79 17.75 2uug h ALA 28 CO 0.00 0.51 0.10 1.03 0.00 0.00 0.00 179.25 180.89 2uug h SER 29 N 1.23 1.06 -0.46 0.00 0.87 -0.88 -0.91 113.55 114.45 2uug h SER 29 Ca 0.41 -0.26 -0.12 0.00 -1.23 0.00 0.00 61.79 60.59 2uug h SER 29 Cb 0.07 -0.28 -0.02 0.00 -0.44 0.00 0.00 62.40 61.73 2uug h SER 29 CO -0.14 1.05 -0.16 -0.33 -0.53 0.00 0.00 176.83 176.72 2uug h GLU 30 N 1.02 0.96 -0.47 2.24 5.08 -0.62 -0.80 114.58 121.99 2uug h GLU 30 Ca 0.20 -0.37 -0.03 0.00 -1.00 0.00 0.00 59.36 58.16 2uug h GLU 30 Cb 0.45 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.62 2uug h GLU 30 CO 0.01 1.04 0.18 0.00 -1.00 0.00 0.00 179.01 179.25 2uug h ARG 31 N 0.84 0.70 -0.14 2.33 3.08 -0.92 -0.39 114.38 119.88 2uug h ARG 31 Ca 0.12 -0.13 -0.04 0.00 0.07 0.00 0.00 59.98 60.00 2uug h ARG 31 Cb 0.72 -0.11 -0.01 0.00 0.08 0.00 0.00 29.97 30.64 2uug h ARG 31 CO 0.05 0.63 -0.11 1.96 -1.07 0.00 0.00 179.97 181.44 2uug h GLN 32 N 0.61 0.22 -0.09 0.04 1.08 -0.94 -2.29 115.11 113.74 2uug h GLN 32 Ca 0.16 -0.05 0.00 0.00 -1.45 0.00 0.00 58.65 57.31 2uug h GLN 32 Cb 0.20 -0.03 0.00 0.00 -0.05 0.00 0.00 27.48 27.59 2uug h GLN 32 CO -0.01 0.34 0.00 0.43 -0.95 0.00 0.00 178.83 178.64 2uug n SER 33 N -4.30 0.53 0.00 1.46 7.64 -0.33 -4.87 113.62 113.75 2uug n SER 33 Ca -0.01 -1.88 0.00 0.00 1.01 0.00 0.00 58.87 57.99 2uug n SER 33 Cb 0.25 -0.06 0.00 0.00 -1.01 0.00 0.00 64.21 63.39 2uug n SER 33 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2uug n GLY 34 N 0.72 0.70 3.45 0.23 0.00 -0.86 -5.04 105.19 104.39 2uug n GLY 34 Ca 0.06 -0.32 -0.44 0.00 0.00 0.00 0.00 46.02 45.33 2uug n GLY 34 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2uug s VAL 35 N -2.00 4.98 0.07 1.61 1.01 -0.19 -5.03 120.40 120.84 2uug s VAL 35 Ca 0.00 -0.49 -0.31 0.00 0.00 0.00 0.00 61.98 61.18 2uug s VAL 35 Cb 0.00 -4.20 -0.08 0.00 0.00 0.00 0.00 36.38 32.10 2uug s VAL 35 CO 0.00 -0.66 1.60 -0.89 0.00 0.00 0.00 175.10 175.15 2uug s THR 36 N 2.37 3.12 -0.01 3.92 2.01 -1.26 -3.93 115.64 121.85 2uug s THR 36 Ca 0.13 0.59 0.05 0.00 0.31 0.00 0.00 61.69 62.78 2uug s THR 36 Cb -0.19 -3.38 -0.01 0.00 0.01 0.00 0.00 72.50 68.93 2uug s THR 36 CO 0.12 0.00 -0.17 -0.63 -0.69 0.00 0.00 174.62 173.25 2uug s ILE 37 N 2.43 1.36 0.01 1.82 1.01 -1.26 -0.42 121.20 126.15 2uug s ILE 37 Ca 0.72 -0.73 0.05 0.00 0.00 0.00 0.00 60.65 60.69 2uug s ILE 37 Cb -0.39 -1.14 -0.03 0.00 0.01 0.00 0.00 42.46 40.92 2uug s ILE 37 CO 0.31 0.39 -0.15 -0.31 0.00 0.00 0.00 174.94 175.18 2uug s TYR 38 N -0.38 2.66 0.82 3.97 2.02 -0.39 -4.20 117.35 121.85 2uug s TYR 38 Ca 0.06 -0.19 -0.12 0.00 -0.37 0.00 0.00 57.07 56.46 2uug s TYR 38 Cb -0.07 -1.53 0.18 0.00 -0.40 0.00 0.00 41.96 40.14 2uug s TYR 38 CO -0.01 0.26 1.12 -0.35 -1.57 0.00 0.00 175.55 175.00 2uug n PRO 39 N 1.73 -0.91 -1.54 -1.71 -0.04 -1.26 -2.13 135.00 129.14 2uug n PRO 39 Ca -0.16 -1.95 -0.37 0.00 -0.04 0.00 0.00 63.50 60.98 2uug n PRO 39 Cb 0.52 -1.08 0.07 0.00 -0.04 0.00 0.00 33.50 32.98 2uug n PRO 39 CO 0.00 0.00 0.00 -2.30 -0.04 0.00 0.00 175.50 173.16 2uug n PRO 40 N -3.31 0.79 -0.25 0.54 -0.02 -1.26 -4.75 135.00 126.74 2uug n PRO 40 Ca 0.15 0.32 0.26 0.00 -2.02 0.00 0.00 63.50 62.21 2uug n PRO 40 Cb 0.51 -2.31 0.63 0.00 -0.02 0.00 0.00 33.50 32.32 2uug n PRO 40 CO 0.00 0.00 0.00 0.37 1.98 0.00 0.00 175.50 177.85 2uug h GLN 41 N 0.17 0.18 0.00 -0.52 5.75 -1.98 0.13 115.11 118.84 2uug h GLN 41 Ca -0.49 -0.01 -0.00 0.00 -0.15 0.00 0.00 58.65 58.00 2uug h GLN 41 Cb 1.35 -0.04 -0.00 0.00 1.07 0.00 0.00 27.48 29.85 2uug h GLN 41 CO 0.50 0.12 -0.01 1.57 -2.65 0.00 0.00 178.83 178.36 2uug h LYS 42 N 0.18 0.00 -0.02 1.69 2.10 -2.01 -3.01 116.57 115.50 2uug h LYS 42 Ca 0.50 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.15 2uug h LYS 42 Cb 1.63 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.96 2uug h LYS 42 CO -0.11 0.01 -0.07 -0.25 -2.00 0.00 0.00 179.45 177.03 2uug n ASP 43 N -3.13 2.17 -0.05 7.07 8.00 0.46 -4.66 116.55 126.41 2uug n ASP 43 Ca -0.01 -1.59 0.07 0.00 0.71 0.00 0.00 54.79 53.97 2uug n ASP 43 Cb 0.19 0.10 0.44 0.00 -0.02 0.00 0.00 41.12 41.84 2uug n ASP 43 CO 0.00 0.00 0.00 0.58 -0.39 0.00 0.00 177.20 177.39 2uug h VAL 44 N 2.84 1.02 -0.39 2.53 2.07 -1.46 -2.82 116.25 120.03 2uug h VAL 44 Ca 0.00 -0.18 -0.12 0.00 0.82 0.00 0.00 66.70 67.22 2uug h VAL 44 Cb 0.64 0.45 -0.07 0.00 -1.52 0.00 0.00 31.29 30.78 2uug h VAL 44 CO 0.00 0.10 0.04 0.49 0.02 0.00 0.00 177.57 178.22 2uug n PHE 45 N -4.47 1.30 -0.14 1.57 3.72 -1.26 -4.70 117.46 113.48 2uug n PHE 45 Ca 0.06 -1.24 0.05 0.00 -0.05 0.00 0.00 57.45 56.27 2uug n PHE 45 Cb 0.19 -0.46 0.36 0.00 -0.94 0.00 0.00 39.48 38.63 2uug n PHE 45 CO 0.00 0.00 0.00 -0.91 -0.05 0.00 0.00 176.76 175.80 2uug h ASN 46 N 1.56 0.63 -0.98 4.37 2.35 -1.69 -2.55 115.58 119.28 2uug h ASN 46 Ca 0.15 -0.01 0.11 0.00 -0.55 0.00 0.00 56.30 56.01 2uug h ASN 46 Cb 1.72 -0.14 -0.08 0.00 0.05 0.00 0.00 38.32 39.86 2uug h ASN 46 CO 0.40 0.43 0.61 0.00 -1.65 0.00 0.00 177.43 177.22 2uug h ALA 47 N 1.63 1.46 0.01 -0.83 0.00 -1.82 0.10 119.26 119.81 2uug h ALA 47 Ca 0.26 0.02 -0.19 0.00 0.00 0.00 0.00 54.91 55.00 2uug h ALA 47 Cb 0.12 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 2uug h ALA 47 CO -0.07 0.23 -0.92 0.74 0.00 0.00 0.00 179.25 179.23 2uug h PHE 48 N 0.98 0.06 0.63 0.00 0.04 -1.69 -2.44 116.94 114.53 2uug h PHE 48 Ca 0.48 -0.04 -0.03 0.00 2.80 0.00 0.00 57.97 61.18 2uug h PHE 48 Cb 0.45 -0.00 0.01 0.00 2.20 0.00 0.00 35.95 38.60 2uug h PHE 48 CO -0.01 0.93 -0.30 -0.09 -0.60 0.00 0.00 178.31 178.24 2uug h ARG 49 N 0.02 -0.81 -0.33 1.51 2.43 -0.76 -3.26 114.38 113.17 2uug h ARG 49 Ca -0.02 0.06 -0.08 0.00 -0.81 0.00 0.00 59.98 59.13 2uug h ARG 49 Cb 1.61 0.19 -0.02 0.00 -0.42 0.00 0.00 29.97 31.32 2uug h ARG 49 CO 0.12 -0.51 -0.12 0.74 -1.51 0.00 0.00 179.97 178.69 2uug h PHE 50 N -0.97 0.61 -3.72 2.20 0.04 -0.94 -3.40 116.94 110.77 2uug h PHE 50 Ca -0.09 -0.10 -0.65 0.00 2.80 0.00 0.00 57.97 59.93 2uug h PHE 50 Cb 0.68 -0.16 -0.38 0.00 2.20 0.00 0.00 35.95 38.29 2uug h PHE 50 CO -0.01 0.67 -0.77 0.99 -0.60 0.00 0.00 178.31 178.60 2uug s THR 51 N -4.74 2.01 0.86 -1.55 2.01 -0.92 -4.40 115.64 108.91 2uug s THR 51 Ca -0.08 -1.80 -0.12 0.00 0.31 0.00 0.00 61.69 60.00 2uug s THR 51 Cb 0.14 -2.30 0.11 0.00 0.01 0.00 0.00 72.50 70.46 2uug s THR 51 CO 0.79 -0.29 1.11 -0.70 -0.69 0.00 0.00 174.62 174.84 2uug s GLU 52 N 1.12 1.58 0.14 4.92 2.56 -1.25 -4.48 118.70 123.28 2uug s GLU 52 Ca -0.00 0.53 -0.18 0.00 0.00 0.00 0.00 54.97 55.32 2uug s GLU 52 Cb -0.19 -1.87 -0.02 0.00 2.00 0.00 0.00 34.13 34.05 2uug s GLU 52 CO -0.08 -1.95 1.77 1.25 -0.56 0.00 0.00 175.26 175.70 2uug h LEU 53 N -1.33 0.38 -1.36 2.70 5.85 -1.90 -2.45 115.31 117.21 2uug h LEU 53 Ca -0.49 -0.04 0.00 0.00 0.84 0.00 0.00 57.88 58.19 2uug h LEU 53 Cb 1.30 -0.10 0.00 0.00 0.37 0.00 0.00 40.66 42.23 2uug h LEU 53 CO 0.60 0.31 0.00 1.23 -0.34 0.00 0.00 178.44 180.24 2uug h GLY 54 N 0.42 0.00 1.16 3.75 0.00 -1.94 -2.96 103.07 103.50 2uug h GLY 54 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.45 2uug h GLY 54 CO -0.02 0.00 -0.48 1.22 0.00 0.00 0.00 176.54 177.25 2uug n ASP 55 N -2.84 0.51 -4.65 0.19 8.00 -0.94 -4.89 116.55 111.92 2uug n ASP 55 Ca 0.01 -0.05 -0.42 0.00 0.71 0.00 0.00 54.79 55.03 2uug n ASP 55 Cb 0.26 0.14 -0.03 0.00 -0.02 0.00 0.00 41.12 41.47 2uug n ASP 55 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 2uug s VAL 56 N -3.05 3.32 -0.05 2.53 1.01 -1.09 -4.19 120.40 118.87 2uug s VAL 56 Ca 0.10 0.37 0.00 0.00 0.00 0.00 0.00 61.98 62.45 2uug s VAL 56 Cb 0.16 -3.26 -0.03 0.00 0.00 0.00 0.00 36.38 33.25 2uug s VAL 56 CO 0.69 -0.06 -0.05 0.29 0.00 0.00 0.00 175.10 175.97 2uug n LYS 57 N 7.49 0.13 -4.81 2.72 5.02 0.10 -4.86 118.16 123.95 2uug n LYS 57 Ca 0.19 0.03 -0.25 0.00 -2.02 0.00 0.00 58.31 56.27 2uug n LYS 57 Cb 0.42 -1.07 -0.15 0.00 -0.02 0.00 0.00 35.03 34.21 2uug n LYS 57 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 2uug s VAL 58 N -2.11 1.34 -0.21 -0.18 1.01 -0.45 -1.66 120.40 118.15 2uug s VAL 58 Ca -0.07 -0.72 0.01 0.00 0.00 0.00 0.00 61.98 61.21 2uug s VAL 58 Cb 0.02 -1.12 0.04 0.00 0.00 0.00 0.00 36.38 35.32 2uug s VAL 58 CO 0.12 0.38 -0.14 -0.69 0.00 0.00 0.00 175.10 174.77 2uug s VAL 59 N -0.34 1.92 -0.24 2.92 1.01 -0.63 -0.25 120.40 124.79 2uug s VAL 59 Ca 0.05 -1.15 -0.02 0.00 0.00 0.00 0.00 61.98 60.86 2uug s VAL 59 Cb -0.07 -1.91 0.02 0.00 0.00 0.00 0.00 36.38 34.41 2uug s VAL 59 CO -0.00 0.24 -0.06 -0.63 0.00 0.00 0.00 175.10 174.64 2uug s ILE 60 N 1.28 2.96 -0.01 2.22 1.01 -0.76 -0.33 121.20 127.58 2uug s ILE 60 Ca -0.01 -0.89 -0.18 0.00 0.00 0.00 0.00 60.65 59.56 2uug s ILE 60 Cb -0.16 -2.45 -0.06 0.00 0.01 0.00 0.00 42.46 39.80 2uug s ILE 60 CO -0.09 0.27 0.51 -0.76 0.00 0.00 0.00 174.94 174.87 2uug s LEU 61 N 1.36 4.43 0.00 2.97 1.43 -1.24 -2.17 118.68 125.47 2uug s LEU 61 Ca 0.02 1.05 0.00 0.00 -1.03 0.00 0.00 54.13 54.18 2uug s LEU 61 Cb -0.16 -2.77 0.00 0.00 0.03 0.00 0.00 46.19 43.29 2uug s LEU 61 CO -0.05 0.18 0.04 0.61 0.23 0.00 0.00 176.35 177.37 2uug n GLY 62 N 2.28 3.61 0.00 -3.19 0.00 0.43 -4.69 105.19 103.63 2uug n GLY 62 Ca -0.10 -2.23 0.00 0.00 0.00 0.00 0.00 46.02 43.69 2uug n GLY 62 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2uug n GLN 63 N -0.51 0.00 -4.29 1.61 6.02 -1.26 -2.49 117.38 116.46 2uug n GLN 63 Ca -0.03 0.00 -0.16 0.00 -0.01 0.00 0.00 57.00 56.80 2uug n GLN 63 Cb 0.15 0.00 -0.10 0.00 1.02 0.00 0.00 30.24 31.31 2uug n GLN 63 CO 0.00 0.00 0.00 0.16 -1.01 0.00 0.00 177.06 176.21 2uug s ASP 64 N -0.42 2.03 0.76 1.08 -4.77 -1.26 -1.28 116.67 112.81 2uug s ASP 64 Ca 0.00 -1.05 -0.14 0.00 -3.30 0.00 0.00 52.55 48.06 2uug s ASP 64 Cb 0.00 -0.04 0.06 0.00 -1.09 0.00 0.00 42.92 41.84 2uug s ASP 64 CO 0.00 -0.32 1.18 -2.16 0.70 0.00 0.00 175.17 174.57 2uug s PRO 65 N -3.74 1.99 0.44 2.11 0.04 -1.25 -4.94 135.00 129.65 2uug s PRO 65 Ca 0.20 1.66 -0.25 0.00 0.04 0.00 0.00 61.00 62.65 2uug s PRO 65 Cb 0.02 -1.83 -0.09 0.00 0.04 0.00 0.00 34.50 32.65 2uug s PRO 65 CO 0.04 -1.93 1.40 0.66 0.04 0.00 0.00 177.00 177.21 2uug n TYR 66 N -3.02 2.57 0.51 0.56 4.01 -1.26 -4.82 117.16 115.72 2uug n TYR 66 Ca 0.13 0.45 0.11 0.00 -0.16 0.00 0.00 57.90 58.43 2uug n TYR 66 Cb 0.51 -2.44 0.26 0.00 -0.31 0.00 0.00 39.34 37.36 2uug n TYR 66 CO 0.00 0.00 0.00 -2.39 -0.46 0.00 0.00 176.86 174.01 2uug n HIS 67 N -0.20 0.48 -3.81 -0.72 1.44 -1.26 -4.50 115.22 106.64 2uug n HIS 67 Ca 0.05 -0.24 -0.29 0.00 -2.01 0.00 0.00 57.72 55.23 2uug n HIS 67 Cb 0.41 0.00 -0.04 0.00 0.12 0.00 0.00 29.99 30.48 2uug n HIS 67 CO 0.00 0.00 0.00 0.20 -2.81 0.00 0.00 176.34 173.73 2uug s GLY 68 N -1.41 1.97 0.01 -1.39 0.00 -1.26 -1.48 107.32 103.75 2uug s GLY 68 Ca 0.37 -0.83 -0.32 0.00 0.00 0.00 0.00 44.72 43.94 2uug s GLY 68 CO 0.29 -0.80 1.88 -1.55 0.00 0.00 0.00 173.10 172.93 2uug n PRO 69 N -0.23 2.50 -1.00 2.90 -0.04 -1.26 -2.71 135.00 135.17 2uug n PRO 69 Ca -0.05 0.92 0.00 0.00 -0.04 0.00 0.00 63.50 64.33 2uug n PRO 69 Cb 0.53 -2.80 0.00 0.00 -0.04 0.00 0.00 33.50 31.19 2uug n PRO 69 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2uug n GLY 70 N 4.35 0.83 0.02 0.55 0.00 -1.26 -4.96 105.19 104.71 2uug n GLY 70 Ca 0.21 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.22 2uug n GLY 70 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 2uug h GLN 71 N 2.31 -0.01 -7.09 1.61 4.20 -1.87 -3.37 115.11 110.89 2uug h GLN 71 Ca 0.00 0.00 -0.51 0.00 0.06 0.00 0.00 58.65 58.20 2uug h GLN 71 Cb 0.00 0.00 0.09 0.00 0.30 0.00 0.00 27.48 27.87 2uug h GLN 71 CO 0.00 -0.01 0.44 0.00 -0.67 0.00 0.00 178.83 178.59 2uug s ALA 72 N -2.94 2.64 -0.03 3.87 0.00 -1.26 -2.06 121.76 121.98 2uug s ALA 72 Ca -0.00 0.88 0.10 0.00 0.00 0.00 0.00 51.96 52.93 2uug s ALA 72 Cb 0.00 -3.39 0.18 0.00 0.00 0.00 0.00 23.12 19.91 2uug s ALA 72 CO 0.01 -0.90 1.09 -2.39 0.00 0.00 0.00 175.76 173.57 2uug n HIS 73 N -1.42 -0.09 0.00 0.00 1.44 -1.26 -4.77 115.22 109.12 2uug n HIS 73 Ca 0.12 -0.64 0.00 0.00 -2.01 0.00 0.00 57.72 55.20 2uug n HIS 73 Cb 0.51 0.34 0.00 0.00 0.12 0.00 0.00 29.99 30.96 2uug n HIS 73 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 2uug n GLY 74 N 0.03 2.06 3.70 -1.39 0.00 -1.22 -4.81 105.19 103.56 2uug n GLY 74 Ca -0.16 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.54 2uug n GLY 74 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2uug s LEU 75 N 0.00 3.56 0.40 0.99 1.43 -1.26 -3.13 118.68 120.67 2uug s LEU 75 Ca 0.00 0.00 -0.25 0.00 -1.03 0.00 0.00 54.13 52.85 2uug s LEU 75 Cb 0.00 -2.06 -0.08 0.00 0.03 0.00 0.00 46.19 44.08 2uug s LEU 75 CO 0.00 0.27 1.16 0.00 0.23 0.00 0.00 176.35 178.02 2uug s ALA 76 N -1.11 3.15 0.00 4.21 0.00 -0.75 -3.59 121.76 123.67 2uug s ALA 76 Ca 0.20 0.96 0.00 0.00 0.00 0.00 0.00 51.96 53.12 2uug s ALA 76 Cb -0.12 -3.38 0.00 0.00 0.00 0.00 0.00 23.12 19.63 2uug s ALA 76 CO 0.11 -0.51 0.00 1.19 0.00 0.00 0.00 175.76 176.55 2uug n PHE 77 N 0.08 0.00 -2.48 0.00 3.72 -1.26 -4.89 117.46 112.62 2uug n PHE 77 Ca 0.04 0.00 -0.40 0.00 -0.05 0.00 0.00 57.45 57.05 2uug n PHE 77 Cb 0.47 0.00 -0.04 0.00 -0.94 0.00 0.00 39.48 38.96 2uug n PHE 77 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 2uug s SER 78 N 0.00 7.16 0.16 4.37 0.15 -1.24 -4.83 113.70 119.48 2uug s SER 78 Ca 0.00 2.23 0.10 0.00 0.70 0.00 0.00 55.95 58.98 2uug s SER 78 Cb 0.00 -2.62 -0.04 0.00 -1.71 0.00 0.00 66.02 61.65 2uug s SER 78 CO 0.00 -0.22 -0.22 0.68 1.20 0.00 0.00 173.24 174.68 2uug s VAL 79 N -1.26 2.09 1.07 4.45 -7.23 -0.93 -4.52 120.40 114.07 2uug s VAL 79 Ca 0.47 -1.89 -0.13 0.00 -1.81 0.00 0.00 61.98 58.62 2uug s VAL 79 Cb -0.30 -1.94 0.23 0.00 0.56 0.00 0.00 36.38 34.92 2uug s VAL 79 CO 0.39 -0.14 1.07 -0.13 -0.31 0.00 0.00 175.10 175.97 2uug s ARG 80 N -2.52 -0.12 0.30 4.82 0.52 -0.87 -2.61 118.95 118.47 2uug s ARG 80 Ca 0.16 0.64 -0.29 0.00 -0.52 0.00 0.00 55.73 55.72 2uug s ARG 80 Cb -0.08 -1.66 -0.10 0.00 0.52 0.00 0.00 34.95 33.63 2uug s ARG 80 CO 0.08 -3.13 1.29 -2.14 0.02 0.00 0.00 175.30 171.42 2uug s PRO 81 N -4.77 4.39 0.00 3.54 0.02 -1.26 -2.90 135.00 134.01 2uug s PRO 81 Ca 0.67 2.15 0.00 0.00 0.02 0.00 0.00 61.00 63.83 2uug s PRO 81 Cb -0.21 -3.11 0.00 0.00 0.02 0.00 0.00 34.50 31.20 2uug s PRO 81 CO 0.60 -0.17 0.00 0.41 -0.33 0.00 0.00 177.00 177.51 2uug n GLY 82 N 1.21 0.58 3.84 0.52 0.00 -1.26 -5.05 105.19 105.02 2uug n GLY 82 Ca 0.01 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.66 2uug n GLY 82 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2uug s ILE 83 N -2.23 5.12 0.38 -0.61 -1.09 -1.14 -5.06 121.20 116.57 2uug s ILE 83 Ca 0.00 0.73 -0.27 0.00 -2.23 0.00 0.00 60.65 58.88 2uug s ILE 83 Cb 0.00 -3.66 -0.10 0.00 -1.58 0.00 0.00 42.46 37.12 2uug s ILE 83 CO 0.00 0.58 1.37 0.00 -1.23 0.00 0.00 174.94 175.65 2uug s ALA 84 N -1.00 3.41 0.02 9.38 0.00 -1.26 -4.52 121.76 127.80 2uug s ALA 84 Ca 0.22 1.36 -0.30 0.00 0.00 0.00 0.00 51.96 53.24 2uug s ALA 84 Cb -0.16 -3.53 -0.07 0.00 0.00 0.00 0.00 23.12 19.36 2uug s ALA 84 CO 0.11 -0.87 1.70 0.42 0.00 0.00 0.00 175.76 177.12 2uug s ILE 85 N -1.18 3.22 0.70 0.00 1.01 -1.26 -4.93 121.20 118.75 2uug s ILE 85 Ca 0.54 0.50 -0.15 0.00 0.00 0.00 0.00 60.65 61.53 2uug s ILE 85 Cb -0.41 -3.32 0.02 0.00 0.01 0.00 0.00 42.46 38.76 2uug s ILE 85 CO 0.55 -0.02 1.17 -2.84 0.00 0.00 0.00 174.94 173.80 2uug s PRO 86 N 3.34 2.43 0.20 2.79 0.02 -1.26 -4.81 135.00 137.71 2uug s PRO 86 Ca 0.76 1.63 -0.13 0.00 0.02 0.00 0.00 61.00 63.28 2uug s PRO 86 Cb -0.38 -1.88 0.24 0.00 0.02 0.00 0.00 34.50 32.50 2uug s PRO 86 CO 0.33 -1.58 1.65 -1.35 -0.33 0.00 0.00 177.00 175.71 2uug h PRO 87 N -0.10 0.05 -0.02 5.54 0.11 -1.98 -1.40 132.00 134.20 2uug h PRO 87 Ca -0.47 -0.00 0.01 0.00 0.11 0.00 0.00 66.00 65.64 2uug h PRO 87 Cb 1.28 -0.01 -0.01 0.00 0.11 0.00 0.00 31.00 32.37 2uug h PRO 87 CO 0.52 0.03 -0.03 0.77 -0.21 0.00 0.00 178.00 179.08 2uug h SER 88 N 0.05 -0.10 -0.72 -2.05 0.02 -1.92 -1.48 113.55 107.35 2uug h SER 88 Ca 0.29 0.02 0.04 0.00 -0.84 0.00 0.00 61.79 61.31 2uug h SER 88 Cb 0.46 0.05 -0.04 0.00 0.14 0.00 0.00 62.40 63.01 2uug h SER 88 CO -0.55 -0.05 0.47 0.25 -1.14 0.00 0.00 176.83 175.81 2uug h LEU 89 N -0.05 0.72 -0.62 5.07 5.85 -1.81 -0.37 115.31 124.10 2uug h LEU 89 Ca 0.02 -0.00 0.02 0.00 0.84 0.00 0.00 57.88 58.76 2uug h LEU 89 Cb 0.08 -0.16 -0.04 0.00 0.37 0.00 0.00 40.66 40.91 2uug h LEU 89 CO -0.05 0.48 0.39 0.25 -0.34 0.00 0.00 178.44 179.18 2uug h LEU 90 N 0.83 0.66 -1.27 2.25 5.85 -0.38 -0.47 115.31 122.76 2uug h LEU 90 Ca 0.29 -0.01 -0.07 0.00 0.84 0.00 0.00 57.88 58.94 2uug h LEU 90 Cb 0.13 -0.15 -0.01 0.00 0.37 0.00 0.00 40.66 41.00 2uug h LEU 90 CO -0.09 0.46 -0.31 0.78 -0.34 0.00 0.00 178.44 178.94 2uug h ASN 91 N 0.78 0.00 0.02 1.25 2.35 -0.16 0.31 115.58 120.13 2uug h ASN 91 Ca 0.24 0.00 -0.13 0.00 -0.55 0.00 0.00 56.30 55.86 2uug h ASN 91 Cb -0.02 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.33 2uug h ASN 91 CO -0.08 0.31 -0.40 0.24 -1.65 0.00 0.00 177.43 175.85 2uug h MET 92 N 0.00 0.49 -0.06 0.81 2.86 0.14 -2.37 114.93 116.80 2uug h MET 92 Ca -0.00 -0.24 -0.02 0.00 -2.06 0.00 0.00 59.70 57.37 2uug h MET 92 Cb 0.69 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.35 2uug h MET 92 CO 0.04 0.81 -0.04 1.88 1.06 0.00 0.00 176.91 180.66 2uug h TYR 93 N 0.41 0.15 -0.71 -0.22 0.05 -0.18 -2.29 116.97 114.18 2uug h TYR 93 Ca 0.04 -0.04 0.10 0.00 0.05 0.00 0.00 58.73 58.87 2uug h TYR 93 Cb 0.88 -0.03 -0.05 0.00 1.01 0.00 0.00 36.73 38.54 2uug h TYR 93 CO 0.03 0.55 0.47 0.87 -1.05 0.00 0.00 178.16 179.04 2uug h LYS 94 N -0.29 0.56 0.00 4.88 1.57 -0.86 0.55 116.57 122.98 2uug h LYS 94 Ca 0.01 -0.03 -0.20 0.00 -1.87 0.00 0.00 60.65 58.56 2uug h LYS 94 Cb 0.52 -0.13 -0.01 0.00 0.08 0.00 0.00 32.23 32.69 2uug h LYS 94 CO 0.01 0.37 -0.87 1.49 -0.57 0.00 0.00 179.45 179.89 2uug h GLU 95 N 0.58 0.20 -0.30 3.15 4.57 -1.37 -2.96 114.58 118.45 2uug h GLU 95 Ca 0.33 -0.22 -0.18 0.00 -1.18 0.00 0.00 59.36 58.12 2uug h GLU 95 Cb 0.52 0.06 -0.00 0.00 -0.16 0.00 0.00 28.75 29.17 2uug h GLU 95 CO -0.11 0.95 -0.52 -0.07 -1.18 0.00 0.00 179.01 178.08 2uug h LEU 96 N 0.11 0.95 -0.78 1.64 3.38 -0.55 -2.51 115.31 117.55 2uug h LEU 96 Ca -0.04 -0.49 -0.04 0.00 0.09 0.00 0.00 57.88 57.40 2uug h LEU 96 Cb 1.49 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 41.94 2uug h LEU 96 CO 0.13 1.29 0.34 -0.33 0.09 0.00 0.00 178.44 179.96 2uug h GLU 97 N 0.67 1.14 0.00 1.13 5.08 -0.99 0.36 114.58 121.96 2uug h GLU 97 Ca 0.02 -0.19 -0.08 0.00 -1.00 0.00 0.00 59.36 58.11 2uug h GLU 97 Cb 1.12 -0.20 -0.01 0.00 0.50 0.00 0.00 28.75 30.16 2uug h GLU 97 CO 0.12 0.90 -0.39 -0.97 -1.00 0.00 0.00 179.01 177.67 2uug h ASN 98 N 1.11 0.00 0.00 1.42 -1.24 -1.45 -3.38 115.58 112.03 2uug h ASN 98 Ca 0.26 0.00 -0.11 0.00 0.71 0.00 0.00 56.30 57.16 2uug h ASN 98 Cb 0.17 0.00 -0.02 0.00 0.73 0.00 0.00 38.32 39.19 2uug h ASN 98 CO -0.03 0.39 -1.43 0.35 -1.29 0.00 0.00 177.43 175.42 2uug n THR 99 N -3.91 0.43 -3.04 -3.57 -2.24 -0.95 -4.99 114.28 96.01 2uug n THR 99 Ca -0.01 -0.21 -0.42 0.00 -2.27 0.00 0.00 64.05 61.14 2uug n THR 99 Cb 0.44 -0.81 -0.06 0.00 -2.10 0.00 0.00 70.33 67.81 2uug n THR 99 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 2uug s ILE 100 N -2.15 4.86 0.20 2.28 -1.09 0.12 -4.95 121.20 120.47 2uug s ILE 100 Ca -0.07 0.90 -0.32 0.00 -2.23 0.00 0.00 60.65 58.93 2uug s ILE 100 Cb 0.02 -4.08 -0.12 0.00 -1.58 0.00 0.00 42.46 36.70 2uug s ILE 100 CO 0.21 -0.25 1.74 -2.84 -1.23 0.00 0.00 174.94 172.58 2uug s PRO 101 N 2.79 4.12 0.00 2.79 0.02 -1.26 -2.04 135.00 141.42 2uug s PRO 101 Ca 0.28 2.62 0.00 0.00 0.02 0.00 0.00 61.00 63.91 2uug s PRO 101 Cb -0.14 -3.13 0.00 0.00 0.02 0.00 0.00 34.50 31.25 2uug s PRO 101 CO 0.13 -0.77 0.00 0.41 -0.33 0.00 0.00 177.00 176.45 2uug n GLY 102 N 4.01 1.25 3.70 0.52 0.00 -1.26 -5.04 105.19 108.37 2uug n GLY 102 Ca 0.16 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.77 2uug n GLY 102 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2uug s PHE 103 N -2.52 3.54 -0.01 1.61 2.19 -0.87 -5.05 117.98 116.88 2uug s PHE 103 Ca 0.00 1.42 0.05 0.00 0.33 0.00 0.00 56.93 58.73 2uug s PHE 103 Cb 0.00 -3.00 -0.01 0.00 -1.31 0.00 0.00 43.02 38.69 2uug s PHE 103 CO 0.00 -0.08 -0.16 0.95 1.83 0.00 0.00 175.22 177.76 2uug s THR 104 N 1.44 1.27 0.02 0.12 -4.23 -1.26 -4.68 115.64 108.32 2uug s THR 104 Ca 0.43 -0.68 -0.37 0.00 -1.18 0.00 0.00 61.69 59.89 2uug s THR 104 Cb -0.18 -1.06 -0.16 0.00 1.34 0.00 0.00 72.50 72.44 2uug s THR 104 CO 0.19 0.36 1.45 -1.14 -0.54 0.00 0.00 174.62 174.93 2uug n ARG 105 N 2.70 1.26 -1.81 3.99 0.63 -1.26 -4.98 116.66 117.19 2uug n ARG 105 Ca -0.15 0.45 -0.30 0.00 -0.92 0.00 0.00 57.85 56.94 2uug n ARG 105 Cb 0.54 -2.12 0.19 0.00 0.45 0.00 0.00 32.46 31.53 2uug n ARG 105 CO 0.00 0.00 0.00 -2.14 -2.51 0.00 0.00 177.63 172.98 2uug s PRO 106 N 1.16 0.36 -0.03 -0.14 0.02 -1.26 -5.01 135.00 130.10 2uug s PRO 106 Ca 0.87 -0.36 0.11 0.00 0.02 0.00 0.00 61.00 61.63 2uug s PRO 106 Cb -0.95 -1.81 0.30 0.00 0.02 0.00 0.00 34.50 32.07 2uug s PRO 106 CO 0.50 -2.61 1.25 0.27 -0.33 0.00 0.00 177.00 176.08 2uug n ASN 107 N -3.91 2.96 -3.29 2.53 2.04 -1.26 -5.02 115.26 109.30 2uug n ASN 107 Ca 0.15 -2.21 -0.14 0.00 -0.44 0.00 0.00 54.58 51.94 2uug n ASN 107 Cb 0.59 -0.26 -0.04 0.00 -2.53 0.00 0.00 39.78 37.54 2uug n ASN 107 CO 0.00 0.00 0.00 -1.38 -0.44 0.00 0.00 177.26 175.44 2uug s HIS 108 N -1.37 0.97 -0.07 -2.53 -3.43 -1.26 -4.93 115.29 102.67 2uug s HIS 108 Ca 0.24 -1.23 0.10 0.00 -0.80 0.00 0.00 55.06 53.36 2uug s HIS 108 Cb 0.15 -0.02 0.15 0.00 -1.43 0.00 0.00 32.58 31.43 2uug s HIS 108 CO 0.12 -1.14 1.05 0.41 -2.00 0.00 0.00 174.74 173.17 2uug n GLY 109 N -0.55 3.31 3.62 -1.38 0.00 -1.26 -4.91 105.19 104.02 2uug n GLY 109 Ca 0.00 -0.60 -0.43 0.00 0.00 0.00 0.00 46.02 44.99 2uug n GLY 109 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2uug s TYR 110 N -1.81 2.80 -0.41 1.61 5.04 -1.07 -2.19 117.35 121.32 2uug s TYR 110 Ca 0.17 0.88 0.05 0.00 -2.44 0.00 0.00 57.07 55.73 2uug s TYR 110 Cb 0.15 -4.06 0.53 0.00 0.35 0.00 0.00 41.96 38.92 2uug s TYR 110 CO 0.02 -1.38 1.66 1.28 -1.34 0.00 0.00 175.55 175.79 2uug n LEU 111 N 7.67 5.65 -0.20 6.97 4.77 -1.26 -4.48 117.00 136.11 2uug n LEU 111 Ca 0.13 -3.99 -0.01 0.00 -0.03 0.00 0.00 56.01 52.11 2uug n LEU 111 Cb 0.48 -0.72 0.21 0.00 -2.33 0.00 0.00 43.42 41.06 2uug n LEU 111 CO 0.66 1.38 1.16 -0.08 -1.33 0.00 0.00 177.39 179.18 2uug h GLU 112 N 1.38 0.97 -0.04 3.23 4.81 -1.92 -2.10 114.58 120.91 2uug h GLU 112 Ca 0.43 -0.10 0.01 0.00 -0.13 0.00 0.00 59.36 59.57 2uug h GLU 112 Cb 1.76 -0.20 -0.00 0.00 0.63 0.00 0.00 28.75 30.94 2uug h GLU 112 CO 0.88 0.71 0.03 0.66 -0.73 0.00 0.00 179.01 180.56 2uug h SER 113 N 0.98 0.00 -0.03 1.04 4.64 -1.84 -0.00 113.55 118.34 2uug h SER 113 Ca 0.25 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.55 2uug h SER 113 Cb 0.02 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.11 2uug h SER 113 CO -0.04 0.00 -0.06 -0.50 -0.87 0.00 0.00 176.83 175.36 2uug h TRP 114 N 0.00 0.12 -0.63 4.77 4.06 -1.71 -2.80 115.95 119.77 2uug h TRP 114 Ca 0.02 -0.04 0.03 0.00 2.06 0.00 0.00 58.89 60.95 2uug h TRP 114 Cb 0.08 -0.02 -0.03 0.00 -1.00 0.00 0.00 29.16 28.19 2uug h TRP 114 CO 0.00 0.63 0.41 0.00 -3.56 0.00 0.00 178.44 175.92 2uug h ALA 115 N 0.47 1.65 0.00 1.49 0.00 -1.28 -0.41 119.26 121.18 2uug h ALA 115 Ca 0.00 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.88 2uug h ALA 115 Cb 0.62 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 18.20 2uug h ALA 115 CO 0.01 0.29 -0.01 0.00 0.00 0.00 0.00 179.25 179.55 2uug h ARG 116 N 0.75 0.00 -0.36 0.00 2.47 -0.98 -2.89 114.38 113.38 2uug h ARG 116 Ca 0.25 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.97 2uug h ARG 116 Cb 0.05 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.37 2uug h ARG 116 CO -0.07 0.01 0.00 1.04 0.56 0.00 0.00 179.97 181.51 2uug n GLN 117 N -3.10 2.41 0.00 0.04 6.02 -0.23 -4.94 117.38 117.59 2uug n GLN 117 Ca 0.00 -2.13 0.00 0.00 -0.01 0.00 0.00 57.00 54.86 2uug n GLN 117 Cb 0.29 -1.50 0.00 0.00 1.02 0.00 0.00 30.24 30.05 2uug n GLN 117 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2uug n GLY 118 N 1.46 1.15 3.35 1.08 0.00 -1.09 -4.81 105.19 106.33 2uug n GLY 118 Ca 0.19 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.76 2uug n GLY 118 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2uug s VAL 119 N -2.00 5.14 -0.65 1.61 1.01 -0.80 0.01 120.40 124.71 2uug s VAL 119 Ca 0.00 -1.21 -0.27 0.00 0.00 0.00 0.00 61.98 60.50 2uug s VAL 119 Cb 0.00 -4.29 0.01 0.00 0.00 0.00 0.00 36.38 32.09 2uug s VAL 119 CO 0.00 -0.81 1.55 -0.22 0.00 0.00 0.00 175.10 175.62 2uug s LEU 120 N 1.85 3.25 -1.00 3.92 2.96 0.65 -3.76 118.68 126.56 2uug s LEU 120 Ca 0.05 0.01 -0.18 0.00 -0.22 0.00 0.00 54.13 53.80 2uug s LEU 120 Cb -0.27 -2.63 0.14 0.00 0.50 0.00 0.00 46.19 43.93 2uug s LEU 120 CO 0.05 -2.05 1.21 -0.76 -1.32 0.00 0.00 176.35 173.49 2uug s LEU 121 N 7.23 5.00 -0.20 -0.68 1.43 -1.26 -1.83 118.68 128.38 2uug s LEU 121 Ca 0.52 -2.26 -0.06 0.00 -1.03 0.00 0.00 54.13 51.30 2uug s LEU 121 Cb -0.11 -2.41 -0.03 0.00 0.03 0.00 0.00 46.19 43.68 2uug s LEU 121 CO 0.19 -1.00 0.02 -0.22 0.23 0.00 0.00 176.35 175.57 2uug s LEU 122 N 2.50 3.45 0.09 1.79 2.96 -0.92 -1.82 118.68 126.72 2uug s LEU 122 Ca 0.36 -0.11 -0.15 0.00 -0.22 0.00 0.00 54.13 54.01 2uug s LEU 122 Cb -0.04 -1.87 -0.06 0.00 0.50 0.00 0.00 46.19 44.71 2uug s LEU 122 CO -0.07 0.10 0.50 0.20 -1.32 0.00 0.00 176.35 175.76 2uug s ASN 123 N 0.82 6.85 0.46 3.68 0.01 -1.26 -0.43 114.94 125.07 2uug s ASN 123 Ca 0.02 1.06 0.26 0.00 -0.71 0.00 0.00 52.86 53.48 2uug s ASN 123 Cb -0.14 -2.28 0.97 0.00 0.41 0.00 0.00 41.25 40.20 2uug s ASN 123 CO 0.02 0.20 1.84 0.71 -1.51 0.00 0.00 177.10 178.37 2uug h THR 124 N 3.18 0.44 -3.37 1.60 1.35 -0.97 -3.40 112.91 111.75 2uug h THR 124 Ca -0.50 -1.02 -0.60 0.00 -0.55 0.00 0.00 66.41 63.74 2uug h THR 124 Cb 1.20 1.74 -0.37 0.00 -1.73 0.00 0.00 68.15 68.99 2uug h THR 124 CO 0.64 0.18 -0.81 -0.69 -0.25 0.00 0.00 175.52 174.59 2uug s VAL 125 N -3.63 1.50 -2.03 6.82 1.01 -0.40 -3.48 120.40 120.20 2uug s VAL 125 Ca 0.01 -0.87 0.23 0.00 0.00 0.00 0.00 61.98 61.35 2uug s VAL 125 Cb 0.10 -1.58 0.65 0.00 0.00 0.00 0.00 36.38 35.54 2uug s VAL 125 CO 0.62 0.19 1.87 0.18 0.00 0.00 0.00 175.10 177.97 2uug n LEU 126 N 4.74 0.12 -4.05 3.92 4.77 -1.26 -3.77 117.00 121.47 2uug n LEU 126 Ca -0.14 -0.05 -0.10 0.00 -0.03 0.00 0.00 56.01 55.69 2uug n LEU 126 Cb 0.47 -0.01 -0.07 0.00 -2.33 0.00 0.00 43.42 41.49 2uug n LEU 126 CO 0.19 0.02 0.06 0.42 -1.33 0.00 0.00 177.39 176.76 2uug s THR 127 N -1.99 0.00 -0.12 -5.08 -4.23 -1.26 -4.51 115.64 98.45 2uug s THR 127 Ca 0.35 -1.57 -0.30 0.00 -1.18 0.00 0.00 61.69 58.99 2uug s THR 127 Cb 0.16 -2.28 0.08 0.00 1.34 0.00 0.00 72.50 71.81 2uug s THR 127 CO 0.27 -0.00 0.77 0.54 -0.54 0.00 0.00 174.62 175.65 2uug s VAL 128 N -4.06 0.00 0.02 2.29 0.11 -0.90 -4.50 120.40 113.36 2uug s VAL 128 Ca 0.27 0.00 -0.29 0.00 -2.93 0.00 0.00 61.98 59.03 2uug s VAL 128 Cb 0.01 -1.00 -0.04 0.00 -1.53 0.00 0.00 36.38 33.83 2uug s VAL 128 CO 0.10 0.00 0.94 -0.13 -3.33 0.00 0.00 175.10 172.68 2uug s ARG 129 N -0.85 4.57 0.17 1.54 0.52 -1.26 -1.26 118.95 122.38 2uug s ARG 129 Ca -0.07 1.36 -0.33 0.00 -0.52 0.00 0.00 55.73 56.17 2uug s ARG 129 Cb -0.01 -3.44 -0.15 0.00 0.52 0.00 0.00 34.95 31.87 2uug s ARG 129 CO 0.06 0.03 1.24 0.00 0.02 0.00 0.00 175.30 176.65 2uug n ALA 130 N 3.62 -0.48 0.00 2.13 0.00 0.44 -1.90 120.51 124.31 2uug n ALA 130 Ca 0.04 0.47 0.00 0.00 0.00 0.00 0.00 53.44 53.95 2uug n ALA 130 Cb 0.51 -2.08 0.00 0.00 0.00 0.00 0.00 19.45 17.88 2uug n ALA 130 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2uug n GLY 131 N 2.18 2.99 3.11 0.00 0.00 -0.55 -4.97 105.19 107.94 2uug n GLY 131 Ca 0.15 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.83 2uug n GLY 131 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2uug s GLN 132 N -0.12 2.08 0.47 1.61 -0.21 -0.80 -5.06 119.66 117.64 2uug s GLN 132 Ca 0.00 -1.55 -0.24 0.00 0.02 0.00 0.00 55.36 53.59 2uug s GLN 132 Cb 0.00 -3.24 -0.07 0.00 1.00 0.00 0.00 33.01 30.70 2uug s GLN 132 CO 0.00 -0.79 1.35 0.00 -2.12 0.00 0.00 175.29 173.72 2uug s ALA 133 N 1.12 3.08 -1.58 6.09 0.00 -1.26 -3.10 121.76 126.10 2uug s ALA 133 Ca 0.01 1.31 0.00 0.00 0.00 0.00 0.00 51.96 53.28 2uug s ALA 133 Cb -0.20 -3.53 0.00 0.00 0.00 0.00 0.00 23.12 19.38 2uug s ALA 133 CO -0.04 -1.10 0.00 1.58 0.00 0.00 0.00 175.76 176.20 2uug n HIS 134 N -0.42 -0.86 0.62 0.00 -0.00 -1.26 -4.87 115.22 108.41 2uug n HIS 134 Ca 0.07 0.00 0.12 0.00 -0.00 0.00 0.00 57.72 57.90 2uug n HIS 134 Cb 0.44 -3.32 0.46 0.00 -0.00 0.00 0.00 29.99 27.56 2uug n HIS 134 CO 0.00 0.00 0.00 -1.13 -0.00 0.00 0.00 176.34 175.21 2uug n SER 135 N -1.62 0.42 -0.59 0.26 3.41 -1.18 -3.54 113.62 110.79 2uug n SER 135 Ca -0.19 0.57 0.08 0.00 -0.26 0.00 0.00 58.87 59.06 2uug n SER 135 Cb 0.63 -0.67 0.20 0.00 -0.26 0.00 0.00 64.21 64.11 2uug n SER 135 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 2uug n HIS 136 N -1.92 0.55 -1.82 7.33 8.25 -1.26 -4.84 115.22 121.50 2uug n HIS 136 Ca 0.04 -1.03 -0.29 0.00 -0.26 0.00 0.00 57.72 56.18 2uug n HIS 136 Cb 0.30 -0.27 0.08 0.00 1.12 0.00 0.00 29.99 31.22 2uug n HIS 136 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2uug s ALA 137 N -2.92 2.61 -1.34 -1.41 0.00 -1.23 -3.88 121.76 113.60 2uug s ALA 137 Ca 0.38 -0.48 -0.13 0.00 0.00 0.00 0.00 51.96 51.74 2uug s ALA 137 Cb 0.33 -3.01 0.11 0.00 0.00 0.00 0.00 23.12 20.55 2uug s ALA 137 CO 0.05 -1.54 0.52 0.43 0.00 0.00 0.00 175.76 175.22 2uug n SER 138 N -3.26 -3.05 0.00 0.00 7.64 -1.26 -4.77 113.62 108.92 2uug n SER 138 Ca 0.07 -0.57 0.00 0.00 1.01 0.00 0.00 58.87 59.38 2uug n SER 138 Cb 0.59 -2.55 0.00 0.00 -1.01 0.00 0.00 64.21 61.24 2uug n SER 138 CO 0.00 0.00 0.00 -0.11 -3.01 0.00 0.00 175.04 171.92 2uug n LEU 139 N -3.80 0.91 0.00 -3.43 7.94 -1.25 -5.03 117.00 112.34 2uug n LEU 139 Ca 0.03 -0.91 0.00 0.00 -1.11 0.00 0.00 56.01 54.02 2uug n LEU 139 Cb 0.51 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.46 2uug n LEU 139 CO 0.61 0.23 0.00 0.61 -1.11 0.00 0.00 177.39 177.72 2uug n GLY 140 N -0.05 1.14 0.32 -3.96 0.00 -1.26 -4.52 105.19 96.86 2uug n GLY 140 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2uug n GLY 140 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 173.32 174.81 2uug h TRP 141 N 0.00 0.82 -0.84 1.61 4.06 -1.85 -2.79 115.95 116.96 2uug h TRP 141 Ca 0.00 -0.02 -0.02 0.00 2.06 0.00 0.00 58.89 60.91 2uug h TRP 141 Cb 0.00 -0.26 -0.04 0.00 -1.00 0.00 0.00 29.16 27.86 2uug h TRP 141 CO 0.00 0.58 0.43 0.93 -3.56 0.00 0.00 178.44 176.83 2uug h GLU 142 N 0.84 1.19 -0.44 0.49 4.39 -1.93 0.18 114.58 119.28 2uug h GLU 142 Ca 0.21 -0.16 -0.04 0.00 0.34 0.00 0.00 59.36 59.72 2uug h GLU 142 Cb 0.05 -0.22 -0.02 0.00 -0.10 0.00 0.00 28.75 28.46 2uug h GLU 142 CO -0.03 0.89 0.13 1.15 -1.16 0.00 0.00 179.01 179.99 2uug h THR 143 N 1.18 1.23 0.08 1.13 2.02 -1.84 0.16 112.91 116.87 2uug h THR 143 Ca 0.29 -0.77 -0.00 0.00 0.77 0.00 0.00 66.41 66.70 2uug h THR 143 Cb 0.07 0.89 0.00 0.00 -1.74 0.00 0.00 68.15 67.37 2uug h THR 143 CO -0.04 0.27 -0.04 0.15 0.37 0.00 0.00 175.52 176.23 2uug h PHE 144 N 0.58 -0.11 0.00 3.16 3.57 -1.17 -1.66 116.94 121.31 2uug h PHE 144 Ca 0.14 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.64 2uug h PHE 144 Cb 0.29 0.03 0.00 0.00 2.79 0.00 0.00 35.95 39.06 2uug h PHE 144 CO 0.02 0.05 0.00 1.79 -2.23 0.00 0.00 178.31 177.93 2uug h THR 145 N -0.24 0.00 -0.19 4.41 1.35 -0.59 -1.36 112.91 116.29 2uug h THR 145 Ca -0.01 -0.34 -0.09 0.00 -0.55 0.00 0.00 66.41 65.41 2uug h THR 145 Cb 0.20 1.34 -0.00 0.00 -1.73 0.00 0.00 68.15 67.95 2uug h THR 145 CO 0.02 0.00 -0.22 0.44 -0.25 0.00 0.00 175.52 175.51 2uug h ASP 146 N 0.00 0.53 -0.62 5.36 3.32 -0.26 -2.30 116.42 122.45 2uug h ASP 146 Ca 0.00 -0.49 -0.07 0.00 0.02 0.00 0.00 57.03 56.48 2uug h ASP 146 Cb 0.35 -0.15 -0.03 0.00 0.22 0.00 0.00 39.33 39.72 2uug h ASP 146 CO 0.00 0.92 0.11 0.50 -1.72 0.00 0.00 179.24 179.05 2uug h LYS 147 N 0.16 1.05 -0.88 3.56 1.63 -0.52 -0.96 116.57 120.61 2uug h LYS 147 Ca 0.03 -0.27 0.04 0.00 -0.85 0.00 0.00 60.65 59.60 2uug h LYS 147 Cb 0.78 -0.13 -0.05 0.00 -0.60 0.00 0.00 32.23 32.23 2uug h LYS 147 CO 0.05 0.96 0.56 0.28 -3.45 0.00 0.00 179.45 177.85 2uug h VAL 148 N 0.99 1.12 0.00 2.00 2.07 -1.16 0.37 116.25 121.64 2uug h VAL 148 Ca 0.20 -0.37 -0.13 0.00 0.82 0.00 0.00 66.70 67.21 2uug h VAL 148 Cb 0.41 -0.05 -0.02 0.00 -1.52 0.00 0.00 31.29 30.11 2uug h VAL 148 CO 0.01 0.20 -0.64 0.40 0.02 0.00 0.00 177.57 177.56 2uug h ILE 149 N 1.08 1.45 -0.32 4.57 2.04 -1.10 -2.21 117.51 123.02 2uug h ILE 149 Ca 0.36 -2.18 -0.16 0.00 1.00 0.00 0.00 64.86 63.88 2uug h ILE 149 Cb 0.04 2.18 -0.01 0.00 -0.74 0.00 0.00 36.82 38.29 2uug h ILE 149 CO -0.13 0.62 -0.42 -1.28 0.00 0.00 0.00 178.15 176.95 2uug h SER 150 N 0.00 0.87 -0.31 1.72 0.87 0.23 -1.61 113.55 115.32 2uug h SER 150 Ca -0.01 -0.41 -0.11 0.00 -1.23 0.00 0.00 61.79 60.03 2uug h SER 150 Cb 1.13 -0.24 -0.01 0.00 -0.44 0.00 0.00 62.40 62.83 2uug h SER 150 CO 0.08 1.17 -0.21 -0.07 -0.53 0.00 0.00 176.83 177.28 2uug h LEU 151 N 0.65 0.79 -0.30 2.23 3.38 -0.14 -2.01 115.31 119.91 2uug h LEU 151 Ca 0.05 -0.28 -0.08 0.00 0.09 0.00 0.00 57.88 57.66 2uug h LEU 151 Cb 0.99 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 41.51 2uug h LEU 151 CO 0.09 0.98 -0.14 0.40 0.09 0.00 0.00 178.44 179.87 2uug h ILE 152 N 0.69 1.29 -0.58 1.22 2.04 -1.27 -1.03 117.51 119.86 2uug h ILE 152 Ca 0.10 -1.23 0.04 0.00 1.00 0.00 0.00 64.86 64.77 2uug h ILE 152 Cb 0.71 1.46 -0.03 0.00 -0.74 0.00 0.00 36.82 38.22 2uug h ILE 152 CO 0.05 0.39 0.39 -1.13 0.00 0.00 0.00 178.15 177.86 2uug h ASN 153 N 0.38 0.55 0.03 1.72 -1.24 -1.17 -2.33 115.58 113.52 2uug h ASN 153 Ca 0.07 -0.00 -0.00 0.00 0.71 0.00 0.00 56.30 57.07 2uug h ASN 153 Cb 0.66 -0.12 0.00 0.00 0.73 0.00 0.00 38.32 39.58 2uug h ASN 153 CO 0.04 0.37 -0.01 -0.61 -1.29 0.00 0.00 177.43 175.93 2uug h GLN 154 N 0.63 -0.04 0.00 6.67 4.15 -1.15 -3.40 115.11 121.98 2uug h GLN 154 Ca 0.24 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.66 2uug h GLN 154 Cb 0.16 0.01 0.00 0.00 0.21 0.00 0.00 27.48 27.86 2uug h GLN 154 CO -0.07 -0.03 0.00 0.45 -1.93 0.00 0.00 178.83 177.26 2uug h HIS 155 N -0.55 0.00 -1.02 3.99 3.86 -1.28 -3.46 115.15 116.69 2uug h HIS 155 Ca -0.00 0.00 -0.52 0.00 -1.16 0.00 0.00 60.37 58.68 2uug h HIS 155 Cb 0.03 0.00 -0.02 0.00 1.06 0.00 0.00 27.41 28.48 2uug h HIS 155 CO 0.01 0.00 -0.29 1.03 0.86 0.00 0.00 177.93 179.54 2uug s ARG 156 N -3.32 2.39 -0.18 2.45 1.81 -0.88 -5.09 118.95 116.15 2uug s ARG 156 Ca 0.06 -1.73 -0.12 0.00 -1.72 0.00 0.00 55.73 52.22 2uug s ARG 156 Cb 0.08 -2.34 0.05 0.00 -0.45 0.00 0.00 34.95 32.29 2uug s ARG 156 CO 0.60 -0.49 0.44 -2.00 -0.68 0.00 0.00 175.30 173.18 2uug s GLU 157 N -4.30 0.47 0.00 3.54 -6.30 -1.26 -4.82 118.70 106.03 2uug s GLU 157 Ca 0.46 0.75 0.00 0.00 -2.50 0.00 0.00 54.97 53.68 2uug s GLU 157 Cb -0.04 0.10 0.00 0.00 0.00 0.00 0.00 34.13 34.19 2uug s GLU 157 CO 0.28 -0.12 0.00 0.41 0.02 0.00 0.00 175.26 175.85 2uug n GLY 158 N 3.69 0.61 3.73 -1.50 0.00 -0.65 -5.02 105.19 106.04 2uug n GLY 158 Ca -0.19 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.41 2uug n GLY 158 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2uug s VAL 159 N -2.35 3.47 -0.29 1.61 1.01 -1.26 -4.60 120.40 117.99 2uug s VAL 159 Ca 0.00 1.17 -0.17 0.00 0.00 0.00 0.00 61.98 62.98 2uug s VAL 159 Cb 0.00 -3.75 -0.02 0.00 0.00 0.00 0.00 36.38 32.61 2uug s VAL 159 CO 0.00 0.15 0.47 0.54 0.00 0.00 0.00 175.10 176.26 2uug s VAL 160 N 0.36 5.09 -0.12 2.92 0.11 -0.66 -2.20 120.40 125.90 2uug s VAL 160 Ca 0.57 0.64 -0.14 0.00 -2.93 0.00 0.00 61.98 60.12 2uug s VAL 160 Cb -0.34 -3.82 -0.05 0.00 -1.53 0.00 0.00 36.38 30.64 2uug s VAL 160 CO 0.35 0.03 0.34 -0.36 -3.33 0.00 0.00 175.10 172.14 2uug s PHE 161 N 2.25 3.53 -0.46 1.54 0.40 0.13 -1.60 117.98 123.77 2uug s PHE 161 Ca 0.18 0.73 -0.02 0.00 -0.60 0.00 0.00 56.93 57.22 2uug s PHE 161 Cb -0.16 -2.35 0.12 0.00 0.51 0.00 0.00 43.02 41.15 2uug s PHE 161 CO 0.10 0.33 0.26 -0.51 0.70 0.00 0.00 175.22 176.10 2uug s LEU 162 N 0.10 5.20 -0.41 -0.37 1.43 0.56 -0.74 118.68 124.46 2uug s LEU 162 Ca 0.20 -2.26 -0.15 0.00 -1.03 0.00 0.00 54.13 50.88 2uug s LEU 162 Cb -0.14 -1.82 0.02 0.00 0.03 0.00 0.00 46.19 44.28 2uug s LEU 162 CO 0.07 -0.49 0.33 -0.76 0.23 0.00 0.00 176.35 175.74 2uug s LEU 163 N 0.80 4.99 -0.18 1.79 1.43 -0.36 -3.58 118.68 123.56 2uug s LEU 163 Ca 0.11 -0.79 -0.04 0.00 -1.03 0.00 0.00 54.13 52.37 2uug s LEU 163 Cb -0.22 -2.22 -0.02 0.00 0.03 0.00 0.00 46.19 43.75 2uug s LEU 163 CO -0.04 -0.47 -0.02 0.26 0.23 0.00 0.00 176.35 176.31 2uug s TRP 164 N 1.81 3.02 0.00 0.29 0.51 -1.25 -2.05 118.94 121.27 2uug s TRP 164 Ca 0.07 -0.45 0.00 0.00 -2.12 0.00 0.00 56.10 53.61 2uug s TRP 164 Cb -0.18 -2.03 0.00 0.00 -0.81 0.00 0.00 33.47 30.44 2uug s TRP 164 CO 0.11 -0.19 0.00 0.41 -0.51 0.00 0.00 176.95 176.77 2uug n GLY 165 N 4.01 -0.92 0.22 0.98 0.00 -0.18 -4.20 105.19 105.11 2uug n GLY 165 Ca -0.17 -1.51 0.05 0.00 0.00 0.00 0.00 46.02 44.39 2uug n GLY 165 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2uug h SER 166 N 0.00 0.00 -0.23 1.61 0.02 -1.94 -1.98 113.55 111.03 2uug h SER 166 Ca 0.00 0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 60.93 2uug h SER 166 Cb 0.00 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.53 2uug h SER 166 CO 0.00 0.19 0.07 -0.74 -1.14 0.00 0.00 176.83 175.21 2uug h HIS 167 N 0.00 0.37 -0.30 3.45 -0.00 -2.00 -2.76 115.15 113.91 2uug h HIS 167 Ca -0.00 -0.04 -0.08 0.00 -0.00 0.00 0.00 60.37 60.25 2uug h HIS 167 Cb 0.34 -0.11 -0.01 0.00 -0.00 0.00 0.00 27.41 27.63 2uug h HIS 167 CO 0.00 0.44 -0.12 0.00 -0.00 0.00 0.00 177.93 178.24 2uug h ALA 168 N 0.89 0.42 -0.30 5.26 0.00 -1.68 -3.07 119.26 120.78 2uug h ALA 168 Ca 0.07 -0.32 0.09 0.00 0.00 0.00 0.00 54.91 54.75 2uug h ALA 168 Cb 0.24 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 2uug h ALA 168 CO -0.00 0.29 0.35 1.96 0.00 0.00 0.00 179.25 181.85 2uug h GLN 169 N 0.37 0.00 0.00 0.00 4.20 -1.27 0.85 115.11 119.25 2uug h GLN 169 Ca 0.07 0.00 -0.02 0.00 0.06 0.00 0.00 58.65 58.76 2uug h GLN 169 Cb 0.64 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.42 2uug h GLN 169 CO 0.04 0.00 -0.09 0.87 -0.67 0.00 0.00 178.83 178.98 2uug h LYS 170 N 0.00 0.00 -0.10 1.46 1.57 -1.39 -2.27 116.57 115.85 2uug h LYS 170 Ca 0.14 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.92 2uug h LYS 170 Cb 0.84 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.15 2uug h LYS 170 CO -0.00 0.09 0.00 1.63 -0.57 0.00 0.00 179.45 180.60 2uug n LYS 171 N -3.34 1.29 0.07 3.15 5.02 0.29 -3.14 118.16 121.50 2uug n LYS 171 Ca -0.01 -0.44 0.12 0.00 -2.02 0.00 0.00 58.31 55.96 2uug n LYS 171 Cb 0.27 -1.22 0.23 0.00 -0.02 0.00 0.00 35.03 34.29 2uug n LYS 171 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2uug n GLY 172 N 0.82 -1.49 0.30 0.72 0.00 -0.85 -3.85 105.19 100.84 2uug n GLY 172 Ca 0.10 -0.19 0.13 0.00 0.00 0.00 0.00 46.02 46.06 2uug n GLY 172 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2uug h ALA 173 N 2.52 1.85 -0.58 4.61 0.00 -1.74 -1.44 119.26 124.48 2uug h ALA 173 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2uug h ALA 173 Cb 0.74 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.54 2uug h ALA 173 CO 0.00 -0.12 0.00 0.44 0.00 0.00 0.00 179.25 179.57 2uug n ILE 174 N -4.15 2.54 -4.22 0.00 -5.35 -1.25 -4.87 119.36 102.06 2uug n ILE 174 Ca -0.01 -1.38 -0.33 0.00 -0.27 0.00 0.00 62.75 60.76 2uug n ILE 174 Cb 0.18 -0.18 -0.16 0.00 -1.74 0.00 0.00 39.64 37.74 2uug n ILE 174 CO 0.00 0.00 0.00 -0.63 -1.76 0.00 0.00 176.55 174.16 2uug s ILE 175 N -2.56 2.09 -0.22 7.28 1.01 -0.54 -4.71 121.20 123.55 2uug s ILE 175 Ca 0.54 -0.94 -0.29 0.00 0.00 0.00 0.00 60.65 59.96 2uug s ILE 175 Cb 0.39 -1.87 -0.02 0.00 0.01 0.00 0.00 42.46 40.97 2uug s ILE 175 CO 0.18 0.54 1.58 -0.62 0.00 0.00 0.00 174.94 176.62 2uug s ASP 176 N 1.21 6.43 0.00 3.58 -1.08 -1.26 -4.88 116.67 120.67 2uug s ASP 176 Ca 0.03 1.61 0.20 0.00 -0.52 0.00 0.00 52.55 53.87 2uug s ASP 176 Cb -0.13 -2.53 1.18 0.00 -1.46 0.00 0.00 42.92 39.97 2uug s ASP 176 CO -0.11 -1.22 1.60 0.29 0.52 0.00 0.00 175.17 176.26 2uug n LYS 177 N 7.58 0.59 -0.03 4.34 5.02 -1.26 -0.97 118.16 133.42 2uug n LYS 177 Ca 0.18 0.01 0.03 0.00 -2.02 0.00 0.00 58.31 56.51 2uug n LYS 177 Cb 0.45 -1.50 -0.12 0.00 -0.02 0.00 0.00 35.03 33.84 2uug n LYS 177 CO 0.00 0.00 0.00 1.04 -0.52 0.00 0.00 177.40 177.92 2uug n GLN 178 N -1.04 0.88 0.08 1.97 6.02 -1.26 -4.43 117.38 119.60 2uug n GLN 178 Ca 0.14 -0.09 -0.20 0.00 -0.01 0.00 0.00 57.00 56.84 2uug n GLN 178 Cb 0.08 -1.37 -0.15 0.00 1.02 0.00 0.00 30.24 29.83 2uug n GLN 178 CO 0.00 0.00 0.00 -0.09 -1.01 0.00 0.00 177.06 175.96 2uug h ARG 179 N 0.00 0.33 -5.83 -1.09 9.65 -1.85 -3.47 114.38 112.12 2uug h ARG 179 Ca -0.14 -0.56 -0.50 0.00 -1.10 0.00 0.00 59.98 57.68 2uug h ARG 179 Cb 1.12 0.21 -0.17 0.00 -1.39 0.00 0.00 29.97 29.74 2uug h ARG 179 CO 0.01 1.22 -0.77 -1.01 2.80 0.00 0.00 179.97 182.22 2uug s HIS 180 N -2.60 1.79 -0.36 2.20 3.76 -0.15 -1.64 115.29 118.28 2uug s HIS 180 Ca -0.11 -0.49 -0.18 0.00 -0.15 0.00 0.00 55.06 54.13 2uug s HIS 180 Cb 0.06 -0.88 -0.00 0.00 1.11 0.00 0.00 32.58 32.87 2uug s HIS 180 CO 0.86 0.34 0.48 -1.01 -0.85 0.00 0.00 174.74 174.56 2uug s HIS 181 N -2.26 3.18 -0.21 1.40 3.76 -0.93 -4.41 115.29 115.81 2uug s HIS 181 Ca 0.17 0.05 -0.04 0.00 -0.15 0.00 0.00 55.06 55.10 2uug s HIS 181 Cb -0.05 -2.90 -0.01 0.00 1.11 0.00 0.00 32.58 30.74 2uug s HIS 181 CO 0.07 -0.56 -0.04 0.08 -0.85 0.00 0.00 174.74 173.43 2uug s VAL 182 N 2.32 3.39 -0.22 -0.90 1.01 -1.26 0.17 120.40 124.90 2uug s VAL 182 Ca 0.17 -0.49 -0.04 0.00 0.00 0.00 0.00 61.98 61.62 2uug s VAL 182 Cb -0.16 -2.54 -0.01 0.00 0.00 0.00 0.00 36.38 33.68 2uug s VAL 182 CO 0.13 0.43 -0.03 -0.76 0.00 0.00 0.00 175.10 174.87 2uug s LEU 183 N 1.40 2.95 0.08 3.92 1.43 0.08 -4.97 118.68 123.57 2uug s LEU 183 Ca 0.05 -0.37 0.03 0.00 -1.03 0.00 0.00 54.13 52.81 2uug s LEU 183 Cb -0.14 -1.76 -0.04 0.00 0.03 0.00 0.00 46.19 44.28 2uug s LEU 183 CO -0.03 -0.02 0.08 -0.54 0.23 0.00 0.00 176.35 176.08 2uug s LYS 184 N 1.45 2.90 -0.14 1.70 1.02 -1.26 -1.22 119.74 124.19 2uug s LYS 184 Ca 0.05 -0.68 -0.34 0.00 0.02 0.00 0.00 55.97 55.03 2uug s LYS 184 Cb -0.14 -2.74 0.13 0.00 -0.52 0.00 0.00 37.83 34.56 2uug s LYS 184 CO -0.02 0.57 1.18 0.00 -0.92 0.00 0.00 175.35 176.15 2uug s ALA 185 N -1.39 -2.06 0.78 5.17 0.00 -0.87 -4.98 121.76 118.41 2uug s ALA 185 Ca 0.29 1.38 -0.11 0.00 0.00 0.00 0.00 51.96 53.53 2uug s ALA 185 Cb -0.12 0.02 0.06 0.00 0.00 0.00 0.00 23.12 23.08 2uug s ALA 185 CO 0.22 -0.68 1.08 -1.25 0.00 0.00 0.00 175.76 175.14 2uug s PRO 186 N -2.52 2.24 0.52 0.00 0.04 -1.26 -1.01 135.00 133.01 2uug s PRO 186 Ca 0.10 0.95 -0.22 0.00 0.04 0.00 0.00 61.00 61.87 2uug s PRO 186 Cb -0.00 -1.91 -0.07 0.00 0.04 0.00 0.00 34.50 32.56 2uug s PRO 186 CO -0.05 -1.60 1.22 -3.47 0.04 0.00 0.00 177.00 173.15 2uug n ASP 187 N -3.46 2.12 0.00 6.66 -0.08 -1.26 -4.13 116.55 116.40 2uug n ASP 187 Ca 0.08 0.98 0.06 0.00 -1.51 0.00 0.00 54.79 54.40 2uug n ASP 187 Cb 0.54 -1.50 0.37 0.00 2.34 0.00 0.00 41.12 42.87 2uug n ASP 187 CO 0.00 0.00 0.00 -0.81 0.12 0.00 0.00 177.20 176.51 2uug n PRO 188 N -0.65 0.88 -1.71 -0.67 -0.04 -1.26 -3.18 135.00 128.38 2uug n PRO 188 Ca 0.10 0.00 -0.42 0.00 -0.04 0.00 0.00 63.50 63.14 2uug n PRO 188 Cb 0.43 -1.22 0.00 0.00 -0.04 0.00 0.00 33.50 32.67 2uug n PRO 188 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2uug n SER 189 N -0.72 2.77 -0.36 3.54 2.88 -1.26 -4.48 113.62 115.99 2uug n SER 189 Ca 0.09 1.17 0.27 0.00 -1.33 0.00 0.00 58.87 59.08 2uug n SER 189 Cb 0.04 -1.50 0.56 0.00 -0.75 0.00 0.00 64.21 62.56 2uug n SER 189 CO 0.00 0.00 0.00 -0.65 -1.23 0.00 0.00 175.04 173.16 2uug h PRO 190 N 2.41 0.28 -0.28 -1.46 0.11 -1.90 0.16 132.00 131.31 2uug h PRO 190 Ca -0.47 -0.02 -0.05 0.00 0.11 0.00 0.00 66.00 65.57 2uug h PRO 190 Cb 1.28 -0.06 -0.02 0.00 0.11 0.00 0.00 31.00 32.32 2uug h PRO 190 CO 0.62 0.18 -0.03 1.25 -0.21 0.00 0.00 178.00 179.80 2uug h LEU 191 N 0.28 0.41 -0.80 2.35 5.85 -1.94 -3.32 115.31 118.15 2uug h LEU 191 Ca 0.66 -0.08 0.00 0.00 0.84 0.00 0.00 57.88 59.30 2uug h LEU 191 Cb 1.85 -0.11 0.00 0.00 0.37 0.00 0.00 40.66 42.77 2uug h LEU 191 CO -0.32 0.50 -0.01 -1.54 -0.34 0.00 0.00 178.44 176.73 2uug n SER 192 N -4.28 0.86 0.03 1.25 3.41 0.33 -4.72 113.62 110.50 2uug n SER 192 Ca 0.01 -0.93 0.02 0.00 -0.26 0.00 0.00 58.87 57.71 2uug n SER 192 Cb 0.25 0.24 0.37 0.00 -0.26 0.00 0.00 64.21 64.81 2uug n SER 192 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2uug h ALA 193 N 0.23 1.53 0.00 7.33 0.00 -0.92 -2.82 119.26 124.62 2uug h ALA 193 Ca 0.00 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.78 2uug h ALA 193 Cb 0.05 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.70 2uug h ALA 193 CO 0.00 0.35 0.00 -2.39 0.00 0.00 0.00 179.25 177.21 2uug n HIS 194 N -4.36 0.00 -1.22 0.00 1.44 -1.26 -1.77 115.22 108.05 2uug n HIS 194 Ca 0.01 0.00 0.07 0.00 -2.01 0.00 0.00 57.72 55.80 2uug n HIS 194 Cb 0.18 0.00 0.18 0.00 0.12 0.00 0.00 29.99 30.47 2uug n HIS 194 CO 0.00 0.00 0.00 2.89 -2.81 0.00 0.00 176.34 176.42 2uug n ARG 195 N -0.66 1.70 0.00 -1.40 1.85 -1.07 -4.92 116.66 112.17 2uug n ARG 195 Ca 0.07 -2.86 0.00 0.00 -1.00 0.00 0.00 57.85 54.06 2uug n ARG 195 Cb 0.03 -1.62 0.00 0.00 -1.05 0.00 0.00 32.46 29.82 2uug n ARG 195 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 2uug n GLY 196 N -1.17 0.78 0.08 2.89 0.00 -1.22 -4.85 105.19 101.70 2uug n GLY 196 Ca 0.20 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 46.08 2uug n GLY 196 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 2uug h PHE 197 N 0.00 0.14 -2.74 1.61 3.57 -1.60 -3.34 116.94 114.58 2uug h PHE 197 Ca 0.00 -0.06 -0.53 0.00 3.53 0.00 0.00 57.97 60.91 2uug h PHE 197 Cb 0.00 -0.02 0.02 0.00 2.79 0.00 0.00 35.95 38.74 2uug h PHE 197 CO 0.00 0.74 0.95 -0.06 -2.23 0.00 0.00 178.31 177.71 2uug s PHE 198 N -3.61 2.57 0.00 0.41 0.08 -0.73 -1.38 117.98 115.33 2uug s PHE 198 Ca -0.16 0.44 0.00 0.00 0.12 0.00 0.00 56.93 57.33 2uug s PHE 198 Cb 0.01 -3.91 0.00 0.00 -0.57 0.00 0.00 43.02 38.55 2uug s PHE 198 CO 0.71 -3.57 0.00 0.41 -0.10 0.00 0.00 175.22 172.67 2uug n GLY 199 N 3.90 0.79 0.26 4.36 0.00 -1.26 -4.91 105.19 108.34 2uug n GLY 199 Ca 0.15 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.30 2uug n GLY 199 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2uug n ASN 201 N -3.62 -5.47 -0.27 0.00 5.15 -1.26 -4.87 115.26 104.92 2uug n ASN 201 Ca -0.02 0.49 0.15 0.00 -0.60 0.00 0.00 54.58 54.60 2uug n ASN 201 Cb 0.25 -4.76 0.43 0.00 -0.53 0.00 0.00 39.78 35.17 2uug n ASN 201 CO 0.00 0.00 0.00 0.45 1.40 0.00 0.00 177.26 179.11 2uug h HIS 202 N 0.00 0.73 -0.23 1.20 3.86 -1.91 -1.33 115.15 117.46 2uug h HIS 202 Ca -0.42 0.02 -0.07 0.00 -1.16 0.00 0.00 60.37 58.74 2uug h HIS 202 Cb 1.33 -0.22 -0.01 0.00 1.06 0.00 0.00 27.41 29.57 2uug h HIS 202 CO 0.57 0.22 -0.13 0.74 0.86 0.00 0.00 177.93 180.20 2uug h PHE 203 N 0.57 0.57 -0.10 2.45 0.04 -1.96 -0.68 116.94 117.84 2uug h PHE 203 Ca 0.47 -0.15 -0.21 0.00 2.80 0.00 0.00 57.97 60.89 2uug h PHE 203 Cb 0.94 -0.13 0.00 0.00 2.20 0.00 0.00 35.95 38.96 2uug h PHE 203 CO -0.00 0.78 -0.79 -0.24 -0.60 0.00 0.00 178.31 177.46 2uug h VAL 204 N 0.20 1.33 -0.27 -0.55 3.04 -1.86 -2.84 116.25 115.30 2uug h VAL 204 Ca 0.05 -2.11 -0.05 0.00 -1.01 0.00 0.00 66.70 63.58 2uug h VAL 204 Cb 0.64 2.10 -0.02 0.00 -2.01 0.00 0.00 31.29 32.00 2uug h VAL 204 CO 0.04 0.65 -0.05 -0.07 -1.01 0.00 0.00 177.57 177.13 2uug h LEU 205 N 0.39 0.39 -0.36 3.16 3.38 -1.23 -1.45 115.31 119.58 2uug h LEU 205 Ca -0.05 -0.07 -0.05 0.00 0.09 0.00 0.00 57.88 57.80 2uug h LEU 205 Cb 1.40 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 42.03 2uug h LEU 205 CO 0.15 0.49 0.04 0.00 0.09 0.00 0.00 178.44 179.21 2uug h ALA 206 N 1.56 0.49 -0.14 1.53 0.00 -1.01 -2.35 119.26 119.33 2uug h ALA 206 Ca 0.08 -0.22 -0.12 0.00 0.00 0.00 0.00 54.91 54.65 2uug h ALA 206 Cb 0.34 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 2uug h ALA 206 CO 0.01 0.21 -0.45 -0.91 0.00 0.00 0.00 179.25 178.11 2uug h ASN 207 N 0.45 0.37 -0.47 0.00 2.35 -1.22 -1.98 115.58 115.08 2uug h ASN 207 Ca 0.11 -0.17 -0.10 0.00 -0.55 0.00 0.00 56.30 55.59 2uug h ASN 207 Cb 0.39 -0.11 -0.02 0.00 0.05 0.00 0.00 38.32 38.63 2uug h ASN 207 CO 0.01 0.78 -0.07 1.56 -1.65 0.00 0.00 177.43 178.05 2uug h GLN 208 N 0.29 0.93 0.00 0.81 4.20 -1.20 -0.41 115.11 119.72 2uug h GLN 208 Ca 0.02 -0.31 -0.10 0.00 0.06 0.00 0.00 58.65 58.32 2uug h GLN 208 Cb 0.91 -0.08 -0.01 0.00 0.30 0.00 0.00 27.48 28.60 2uug h GLN 208 CO 0.08 0.96 -0.47 -1.49 -0.67 0.00 0.00 178.83 177.23 2uug h TRP 209 N 0.84 0.00 0.02 2.96 6.55 -1.24 -1.87 115.95 123.20 2uug h TRP 209 Ca 0.14 0.00 -0.20 0.00 0.95 0.00 0.00 58.89 59.78 2uug h TRP 209 Cb 0.60 0.00 -0.02 0.00 -0.86 0.00 0.00 29.16 28.88 2uug h TRP 209 CO 0.04 0.47 -0.92 -0.07 -1.05 0.00 0.00 178.44 176.91 2uug h LEU 210 N 0.00 0.18 -0.03 -4.49 3.38 -0.79 -3.26 115.31 110.30 2uug h LEU 210 Ca -0.00 -0.16 -0.24 0.00 0.09 0.00 0.00 57.88 57.57 2uug h LEU 210 Cb 0.84 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 41.53 2uug h LEU 210 CO 0.06 1.00 -1.08 -0.33 0.09 0.00 0.00 178.44 178.19 2uug h GLU 211 N 0.07 0.22 0.00 1.13 5.08 -0.95 -1.59 114.58 118.54 2uug h GLU 211 Ca -0.04 -0.32 0.00 0.00 -1.00 0.00 0.00 59.36 58.00 2uug h GLU 211 Cb 1.58 0.11 0.00 0.00 0.50 0.00 0.00 28.75 30.94 2uug h GLU 211 CO 0.13 1.10 0.00 0.94 -1.00 0.00 0.00 179.01 180.19 2uug n GLN 212 N -3.55 0.80 -0.09 2.33 -0.06 -0.72 -2.84 117.38 113.24 2uug n GLN 212 Ca -0.06 0.00 0.01 0.00 -2.00 0.00 0.00 57.00 54.96 2uug n GLN 212 Cb 0.94 -1.03 0.01 0.00 -4.06 0.00 0.00 30.24 26.10 2uug n GLN 212 CO 0.00 0.00 0.00 0.54 -0.20 0.00 0.00 177.06 177.40 2uug n ARG 213 N -0.53 0.96 0.00 3.69 1.74 -1.16 -5.01 116.66 116.35 2uug n ARG 213 Ca 0.01 -1.08 0.00 0.00 -0.77 0.00 0.00 57.85 56.01 2uug n ARG 213 Cb 0.00 -0.74 0.00 0.00 -1.02 0.00 0.00 32.46 30.70 2uug n ARG 213 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2uug n GLY 214 N -0.29 2.93 3.82 -0.13 0.00 -1.13 -5.03 105.19 105.36 2uug n GLY 214 Ca 0.02 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.71 2uug n GLY 214 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2uug s GLU 215 N -0.30 3.79 -0.02 1.61 8.01 -0.61 -4.99 118.70 126.19 2uug s GLU 215 Ca 0.00 1.16 -0.29 0.00 0.01 0.00 0.00 54.97 55.85 2uug s GLU 215 Cb 0.00 -2.11 -0.03 0.00 -4.31 0.00 0.00 34.13 27.69 2uug s GLU 215 CO 0.00 -0.41 0.94 0.95 0.01 0.00 0.00 175.26 176.75 2uug s THR 216 N -2.33 4.89 0.91 3.63 -4.23 -1.26 -3.87 115.64 113.38 2uug s THR 216 Ca 0.63 1.96 -0.11 0.00 -1.18 0.00 0.00 61.69 63.00 2uug s THR 216 Cb -0.13 -4.28 0.14 0.00 1.34 0.00 0.00 72.50 69.57 2uug s THR 216 CO 0.26 0.16 1.11 -2.16 -0.54 0.00 0.00 174.62 173.45 2uug s PRO 217 N 1.09 1.12 0.19 3.99 0.04 -1.26 -4.98 135.00 135.19 2uug s PRO 217 Ca 0.49 1.26 -0.23 0.00 0.04 0.00 0.00 61.00 62.56 2uug s PRO 217 Cb -0.20 -1.76 -0.08 0.00 0.04 0.00 0.00 34.50 32.50 2uug s PRO 217 CO 0.25 -2.46 0.76 0.42 0.04 0.00 0.00 177.00 176.01 2uug s ILE 218 N -2.73 4.44 -0.51 0.56 -1.09 -1.26 -5.03 121.20 115.58 2uug s ILE 218 Ca 0.65 1.55 -0.16 0.00 -2.23 0.00 0.00 60.65 60.46 2uug s ILE 218 Cb -0.21 -4.02 0.10 0.00 -1.58 0.00 0.00 42.46 36.75 2uug s ILE 218 CO 0.58 0.39 0.45 -0.62 -1.23 0.00 0.00 174.94 174.51 2uug s ASP 219 N -1.35 6.16 0.19 3.58 2.15 -1.26 -4.94 116.67 121.20 2uug s ASP 219 Ca 0.39 -1.59 0.19 0.00 0.43 0.00 0.00 52.55 51.97 2uug s ASP 219 Cb -0.20 -2.19 0.85 0.00 -0.30 0.00 0.00 42.92 41.07 2uug s ASP 219 CO 0.24 -0.76 1.58 0.79 -0.17 0.00 0.00 175.17 176.85 2uug n TRP 220 N 5.22 0.54 -2.33 -5.34 7.02 -1.26 -4.65 117.44 116.65 2uug n TRP 220 Ca -0.13 0.23 -0.43 0.00 -1.02 0.00 0.00 57.50 56.15 2uug n TRP 220 Cb 0.42 -0.87 -0.02 0.00 -2.42 0.00 0.00 31.31 28.41 2uug n TRP 220 CO 0.00 0.00 0.00 1.41 -2.02 0.00 0.00 177.69 177.08 2uug s MET 221 N -3.26 3.65 0.46 -0.99 1.75 -1.26 -4.99 119.30 114.66 2uug s MET 221 Ca 0.03 1.09 -0.22 0.00 -1.25 0.00 0.00 55.69 55.35 2uug s MET 221 Cb 0.08 -4.00 -0.08 0.00 2.84 0.00 0.00 34.83 33.66 2uug s MET 221 CO 0.29 -1.46 1.07 -1.25 -0.65 0.00 0.00 175.02 173.02 2uug s PRO 222 N 4.79 3.88 0.16 4.11 0.04 -1.26 -4.99 135.00 141.73 2uug s PRO 222 Ca 0.62 1.51 0.11 0.00 0.04 0.00 0.00 61.00 63.28 2uug s PRO 222 Cb -0.16 -2.30 -0.04 0.00 0.04 0.00 0.00 34.50 32.04 2uug s PRO 222 CO 0.30 -0.39 -0.22 0.14 0.04 0.00 0.00 177.00 176.87 2uug s VAL 223 N -1.77 2.51 -0.20 -0.36 -7.23 -1.26 -5.03 120.40 107.06 2uug s VAL 223 Ca 0.64 -1.83 -0.09 0.00 -1.81 0.00 0.00 61.98 58.89 2uug s VAL 223 Cb -0.21 -2.18 -0.05 0.00 0.56 0.00 0.00 36.38 34.51 2uug s VAL 223 CO 0.26 -0.03 0.10 -0.76 -0.31 0.00 0.00 175.10 174.36 2uug s LEU 224 N -2.45 4.01 0.46 1.32 1.43 -1.26 -4.67 118.68 117.51 2uug s LEU 224 Ca 0.19 0.14 -0.21 0.00 -1.03 0.00 0.00 54.13 53.22 2uug s LEU 224 Cb -0.09 -2.03 -0.09 0.00 0.03 0.00 0.00 46.19 44.01 2uug s LEU 224 CO 0.10 0.16 1.03 -2.16 0.23 0.00 0.00 176.35 175.71 2uug s PRO 225 N 0.47 3.92 0.78 1.29 0.04 -1.26 -4.99 135.00 135.26 2uug s PRO 225 Ca 0.06 1.37 -0.16 0.00 0.04 0.00 0.00 61.00 62.31 2uug s PRO 225 Cb -0.12 -2.20 -0.03 0.00 0.04 0.00 0.00 34.50 32.18 2uug s PRO 225 CO -0.00 -0.33 0.39 0.00 0.04 0.00 0.00 177.00 177.10 2uug n ALA 226 N -0.73 -2.08 -0.16 8.56 0.00 -1.26 -5.18 120.51 119.66 2uug n ALA 226 Ca 0.08 -0.34 0.00 0.00 0.00 0.00 0.00 53.44 53.18 2uug n ALA 226 Cb 0.52 -1.78 0.00 0.00 0.00 0.00 0.00 19.45 18.19 2uug n ALA 226 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59