#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jri n GLU 2 N 0.00 0.00 -2.32 2.12 4.71 -1.26 -4.97 120.64 118.92 2jri n GLU 2 Ca 0.00 0.00 -0.41 0.00 -0.01 0.00 0.00 57.16 56.74 2jri n GLU 2 Cb 0.00 0.00 -0.03 0.00 -1.01 0.00 0.00 31.44 30.40 2jri n GLU 2 CO 0.00 0.00 0.00 -1.12 0.09 0.00 0.00 177.13 176.10 2jri s SER 3 N -0.74 6.04 -0.02 1.62 0.01 -1.26 -4.97 113.70 114.37 2jri s SER 3 Ca 0.00 0.42 0.02 0.00 1.31 0.00 0.00 55.95 57.70 2jri s SER 3 Cb 0.00 -2.54 0.00 0.00 0.21 0.00 0.00 66.02 63.69 2jri s SER 3 CO 0.00 -1.75 -0.09 -0.63 0.41 0.00 0.00 173.24 171.18 2jri s ILE 4 N 6.36 0.75 -1.15 1.44 1.01 -1.26 -2.99 121.20 125.36 2jri s ILE 4 Ca 0.57 -0.36 -0.21 0.00 0.00 0.00 0.00 60.65 60.65 2jri s ILE 4 Cb -0.12 -0.66 0.04 0.00 0.01 0.00 0.00 42.46 41.73 2jri s ILE 4 CO 0.26 0.23 1.67 -0.36 0.00 0.00 0.00 174.94 176.74 2jri s PHE 5 N 0.10 2.53 -0.78 3.97 0.40 -1.26 -4.80 117.98 118.14 2jri s PHE 5 Ca -0.02 -0.95 0.02 0.00 -0.60 0.00 0.00 56.93 55.39 2jri s PHE 5 Cb -0.07 -4.61 0.32 0.00 0.51 0.00 0.00 43.02 39.17 2jri s PHE 5 CO 0.00 -1.79 1.23 1.58 0.70 0.00 0.00 175.22 176.94 2jri n HIS 6 N 9.62 3.41 -1.73 0.36 -0.00 -1.26 -4.65 115.22 120.98 2jri n HIS 6 Ca 0.42 -3.45 -0.42 0.00 0.46 0.00 0.00 57.72 54.73 2jri n HIS 6 Cb 0.48 -0.79 -0.03 0.00 -0.12 0.00 0.00 29.99 29.53 2jri n HIS 6 CO 0.00 0.00 0.00 0.39 0.46 0.00 0.00 176.34 177.19 2jri n GLU 7 N 0.18 2.79 -5.05 1.57 -0.58 -1.26 -5.00 120.64 113.28 2jri n GLU 7 Ca 0.35 1.00 -0.32 0.00 -0.42 0.00 0.00 57.16 57.77 2jri n GLU 7 Cb 0.35 -2.84 -0.15 0.00 -0.57 0.00 0.00 31.44 28.23 2jri n GLU 7 CO 0.00 0.00 0.00 0.21 -0.48 0.00 0.00 177.13 176.86 2jri s LYS 8 N 0.80 2.85 0.12 3.49 2.47 -1.26 -4.90 119.74 123.31 2jri s LYS 8 Ca 0.72 -0.80 -0.15 0.00 -1.56 0.00 0.00 55.97 54.19 2jri s LYS 8 Cb -0.50 -2.36 0.03 0.00 -1.46 0.00 0.00 37.83 33.55 2jri s LYS 8 CO 0.36 0.35 0.36 1.14 0.16 0.00 0.00 175.35 177.72 2jri s GLN 9 N -0.05 1.03 0.15 4.03 0.00 -1.26 -5.16 119.66 118.40 2jri s GLN 9 Ca -0.05 -0.76 -0.05 0.00 -0.00 0.00 0.00 55.36 54.51 2jri s GLN 9 Cb -0.14 0.45 -0.03 0.00 0.00 0.00 0.00 33.01 33.29 2jri s GLN 9 CO 0.04 -0.39 0.17 -1.21 0.00 0.00 0.00 175.29 173.90 2jri s GLU 10 N -3.82 1.06 -0.34 9.60 2.02 -1.26 -4.93 118.70 121.02 2jri s GLU 10 Ca 0.03 -1.33 -0.04 0.00 0.02 0.00 0.00 54.97 53.65 2jri s GLU 10 Cb 0.02 0.31 0.01 0.00 0.10 0.00 0.00 34.13 34.57 2jri s GLU 10 CO -0.12 -0.35 0.37 0.41 0.02 0.00 0.00 175.26 175.60 2jri n GLY 11 N -0.16 -0.93 7.00 -1.39 0.00 -1.26 -4.87 105.19 103.57 2jri n GLY 11 Ca -0.06 0.40 0.00 0.00 0.00 0.00 0.00 46.02 46.36 2jri n GLY 11 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2jri n SER 12 N -0.97 -5.00 -2.60 1.61 7.64 -1.26 -4.89 113.62 108.14 2jri n SER 12 Ca 0.03 0.00 -0.19 0.00 1.01 0.00 0.00 58.87 59.72 2jri n SER 12 Cb 0.39 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.60 2jri n SER 12 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 2jri n LEU 13 N 0.00 -1.89 0.01 -3.43 7.99 -1.00 -4.84 117.00 113.83 2jri n LEU 13 Ca 0.00 -0.05 0.07 0.00 -0.01 0.00 0.00 56.01 56.02 2jri n LEU 13 Cb 0.00 -2.71 0.31 0.00 -0.11 0.00 0.00 43.42 40.91 2jri n LEU 13 CO 0.00 -0.08 0.73 0.00 -1.51 0.00 0.00 177.39 176.53 2jri h ALA 15 N 2.49 1.55 -0.10 0.00 0.00 -1.95 -1.52 119.26 119.73 2jri h ALA 15 Ca 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.70 2jri h ALA 15 Cb 0.25 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.98 2jri h ALA 15 CO 0.00 0.33 0.00 0.94 0.00 0.00 0.00 179.25 180.52 2jri n GLN 16 N -4.26 1.65 0.03 0.00 7.27 -1.06 -3.46 117.38 117.54 2jri n GLN 16 Ca -0.01 -0.53 -0.01 0.00 0.07 0.00 0.00 57.00 56.51 2jri n GLN 16 Cb 0.28 -1.60 -0.00 0.00 2.41 0.00 0.00 30.24 31.33 2jri n GLN 16 CO 0.00 0.00 0.00 1.58 0.07 0.00 0.00 177.06 178.71 2jri n HIS 17 N 0.09 0.00 0.18 3.69 -0.00 -0.58 -4.37 115.22 114.22 2jri n HIS 17 Ca 0.05 0.00 -0.15 0.00 0.46 0.00 0.00 57.72 58.08 2jri n HIS 17 Cb 0.39 -0.05 -0.07 0.00 -0.12 0.00 0.00 29.99 30.14 2jri n HIS 17 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 2jri h LEU 19 N -0.66 0.90 -0.16 0.00 6.46 -1.85 0.18 115.31 120.18 2jri h LEU 19 Ca -0.00 -0.26 0.00 0.00 -0.12 0.00 0.00 57.88 57.50 2jri h LEU 19 Cb 0.63 -0.24 -0.01 0.00 -0.73 0.00 0.00 40.66 40.32 2jri h LEU 19 CO -0.12 0.94 0.11 -1.13 -0.62 0.00 0.00 178.44 177.61 2jri h ASN 20 N 0.83 0.19 0.64 1.25 -0.73 -1.70 -0.31 115.58 115.74 2jri h ASN 20 Ca 0.17 -0.01 -0.11 0.00 1.87 0.00 0.00 56.30 58.22 2jri h ASN 20 Cb 0.43 -0.05 -0.02 0.00 0.27 0.00 0.00 38.32 38.95 2jri h ASN 20 CO 0.01 0.14 -0.53 0.78 -0.37 0.00 0.00 177.43 177.46 2jri h ASN 21 N 0.21 0.00 0.05 1.15 -0.26 -0.37 -0.65 115.58 115.72 2jri h ASN 21 Ca 0.06 0.00 -0.00 0.00 -0.56 0.00 0.00 56.30 55.80 2jri h ASN 21 Cb -0.02 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.24 2jri h ASN 21 CO -0.01 0.53 -0.02 0.25 -1.06 0.00 0.00 177.43 177.12 2jri h LEU 22 N 0.00 -0.06 -0.88 1.61 7.12 -0.52 -3.08 115.31 119.49 2jri h LEU 22 Ca -0.01 -0.40 -0.00 0.00 0.13 0.00 0.00 57.88 57.60 2jri h LEU 22 Cb 1.00 0.01 -0.00 0.00 -0.53 0.00 0.00 40.66 41.14 2jri h LEU 22 CO 0.07 0.38 -0.02 -0.07 -0.13 0.00 0.00 178.44 178.67 2jri h LEU 23 N -0.51 0.00 -0.88 2.25 3.38 -1.07 -3.47 115.31 115.02 2jri h LEU 23 Ca -0.01 0.00 -0.35 0.00 0.09 0.00 0.00 57.88 57.61 2jri h LEU 23 Cb 0.45 0.00 0.12 0.00 0.09 0.00 0.00 40.66 41.33 2jri h LEU 23 CO 0.01 0.02 -0.59 0.00 0.09 0.00 0.00 178.44 177.97 2jri n GLN 24 N -3.11 -6.99 0.00 1.13 1.13 -0.27 -4.55 117.38 104.73 2jri n GLN 24 Ca 0.02 0.73 0.00 0.00 -1.94 0.00 0.00 57.00 55.80 2jri n GLN 24 Cb 0.40 -5.46 0.00 0.00 0.11 0.00 0.00 30.24 25.29 2jri n GLN 24 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2jri n GLY 25 N -1.82 1.42 2.73 1.08 0.00 -1.12 -4.59 105.19 102.89 2jri n GLY 25 Ca 0.01 -0.51 -0.42 0.00 0.00 0.00 0.00 46.02 45.09 2jri n GLY 25 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2jri n GLU 26 N -0.24 2.94 -0.86 1.61 1.02 -1.26 -4.55 120.64 119.30 2jri n GLU 26 Ca 0.00 -2.68 -0.07 0.00 -0.02 0.00 0.00 57.16 54.39 2jri n GLU 26 Cb 0.00 -3.24 0.22 0.00 -0.02 0.00 0.00 31.44 28.39 2jri n GLU 26 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 2jri n TYR 27 N 5.83 1.62 -3.71 -0.32 4.01 -1.26 -4.93 117.16 118.40 2jri n TYR 27 Ca 0.51 -1.50 -0.12 0.00 -0.16 0.00 0.00 57.90 56.63 2jri n TYR 27 Cb 0.38 -0.58 -0.10 0.00 -0.31 0.00 0.00 39.34 38.73 2jri n TYR 27 CO 0.00 0.00 0.00 0.12 -0.46 0.00 0.00 176.86 176.52 2jri s PHE 28 N -3.17 -0.57 0.08 -0.72 5.36 -1.26 -5.17 117.98 112.53 2jri s PHE 28 Ca 0.48 1.27 0.03 0.00 -0.96 0.00 0.00 56.93 57.75 2jri s PHE 28 Cb 0.42 0.23 -0.04 0.00 -0.34 0.00 0.00 43.02 43.29 2jri s PHE 28 CO 0.05 -0.30 0.09 -1.12 -1.46 0.00 0.00 175.22 172.48 2jri s SER 29 N 0.84 5.60 0.48 6.13 0.01 -1.26 -5.01 113.70 120.49 2jri s SER 29 Ca -0.05 0.01 0.22 0.00 1.31 0.00 0.00 55.95 57.44 2jri s SER 29 Cb -0.06 -1.53 1.25 0.00 0.21 0.00 0.00 66.02 65.89 2jri s SER 29 CO -0.07 0.17 1.94 -0.65 0.41 0.00 0.00 173.24 175.05 2jri h PRO 30 N 3.28 0.19 -0.48 12.44 0.11 -2.02 -0.63 132.00 144.90 2jri h PRO 30 Ca -0.47 -0.01 -0.03 0.00 0.11 0.00 0.00 66.00 65.60 2jri h PRO 30 Cb 1.16 -0.04 -0.02 0.00 0.11 0.00 0.00 31.00 32.21 2jri h PRO 30 CO 0.67 0.13 0.17 -0.24 -0.21 0.00 0.00 178.00 178.52 2jri h VAL 31 N 0.20 1.18 -0.19 3.15 3.04 -1.99 -1.97 116.25 119.67 2jri h VAL 31 Ca 0.34 -0.59 -0.06 0.00 -1.01 0.00 0.00 66.70 65.38 2jri h VAL 31 Cb 1.04 0.64 -0.00 0.00 -2.01 0.00 0.00 31.29 30.95 2jri h VAL 31 CO -0.06 0.23 -0.10 -0.33 -1.01 0.00 0.00 177.57 176.29 2jri h GLU 32 N 0.68 0.41 -0.86 4.17 5.08 -1.52 -1.83 114.58 120.70 2jri h GLU 32 Ca 0.16 -0.18 0.10 0.00 -1.00 0.00 0.00 59.36 58.44 2jri h GLU 32 Cb 0.16 -0.01 -0.06 0.00 0.50 0.00 0.00 28.75 29.34 2jri h GLU 32 CO -0.01 0.71 0.56 -0.07 -1.00 0.00 0.00 179.01 179.20 2jri h LEU 33 N 0.09 0.75 -0.31 1.33 3.38 -1.28 0.40 115.31 119.67 2jri h LEU 33 Ca 0.04 0.02 -0.16 0.00 0.09 0.00 0.00 57.88 57.88 2jri h LEU 33 Cb 0.60 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 41.19 2jri h LEU 33 CO 0.03 0.44 -0.74 0.28 0.09 0.00 0.00 178.44 178.54 2jri h SER 34 N 0.83 0.00 0.33 -0.43 0.02 -1.24 -3.18 113.55 109.87 2jri h SER 34 Ca 0.40 0.00 -0.33 0.00 -0.84 0.00 0.00 61.79 61.02 2jri h SER 34 Cb 0.44 0.00 0.02 0.00 0.14 0.00 0.00 62.40 63.00 2jri h SER 34 CO -0.17 0.74 -1.52 0.28 -1.14 0.00 0.00 176.83 175.03 2jri h SER 35 N 0.00 0.66 0.31 3.07 0.02 -0.21 -3.31 113.55 114.10 2jri h SER 35 Ca -0.01 -0.79 -0.04 0.00 -0.84 0.00 0.00 61.79 60.11 2jri h SER 35 Cb 1.42 -0.22 -0.01 0.00 0.14 0.00 0.00 62.40 63.74 2jri h SER 35 CO 0.10 1.64 -0.18 0.16 -1.14 0.00 0.00 176.83 177.40 2jri h ILE 36 N 0.12 0.87 -0.73 3.27 3.07 -0.36 -2.30 117.51 121.46 2jri h ILE 36 Ca -0.26 -0.69 -0.06 0.00 1.55 0.00 0.00 64.86 65.40 2jri h ILE 36 Cb 2.10 1.40 -0.03 0.00 -0.27 0.00 0.00 36.82 40.02 2jri h ILE 36 CO 0.23 0.18 0.21 0.00 -1.05 0.00 0.00 178.15 177.72 2jri h ALA 37 N 1.82 0.96 0.00 0.16 0.00 -1.63 -2.42 119.26 118.14 2jri h ALA 37 Ca -0.00 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.68 2jri h ALA 37 Cb 0.39 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 17.90 2jri h ALA 37 CO 0.02 0.65 0.00 1.25 0.00 0.00 0.00 179.25 181.18 2jri h HIS 38 N 1.09 0.00 -0.01 0.00 2.76 -1.53 -3.00 115.15 114.46 2jri h HIS 38 Ca 0.23 0.00 -0.08 0.00 -2.20 0.00 0.00 60.37 58.32 2jri h HIS 38 Cb 0.33 0.00 -0.01 0.00 1.55 0.00 0.00 27.41 29.28 2jri h HIS 38 CO 0.03 0.00 -0.39 0.37 -1.30 0.00 0.00 177.93 176.64 2jri h GLN 39 N 0.00 0.01 0.00 5.26 -0.00 -0.93 -1.26 115.11 118.20 2jri h GLN 39 Ca 0.00 -0.01 -0.06 0.00 -0.00 0.00 0.00 58.65 58.58 2jri h GLN 39 Cb 0.92 -0.00 -0.01 0.00 0.00 0.00 0.00 27.48 28.39 2jri h GLN 39 CO 0.00 0.40 -0.29 1.25 0.00 0.00 0.00 178.83 180.19 2jri h LEU 40 N 0.01 0.00 -0.84 -2.39 7.12 -1.37 -2.69 115.31 115.15 2jri h LEU 40 Ca -0.00 0.00 -0.03 0.00 0.13 0.00 0.00 57.88 57.98 2jri h LEU 40 Cb 0.69 0.00 -0.04 0.00 -0.53 0.00 0.00 40.66 40.78 2jri h LEU 40 CO 0.05 0.29 0.42 -0.78 -0.13 0.00 0.00 178.44 178.28 2jri h ASP 41 N 0.00 1.08 -0.81 1.25 3.58 -1.27 0.12 116.42 120.37 2jri h ASP 41 Ca -0.00 -0.13 -0.01 0.00 0.42 0.00 0.00 57.03 57.31 2jri h ASP 41 Cb 0.83 -0.28 -0.04 0.00 1.72 0.00 0.00 39.33 41.56 2jri h ASP 41 CO 0.04 0.91 0.46 -0.08 -2.88 0.00 0.00 179.24 177.68 2jri h GLU 42 N 1.18 1.12 -0.47 0.28 4.57 -1.38 0.37 114.58 120.24 2jri h GLU 42 Ca 0.29 -0.12 -0.11 0.00 -1.18 0.00 0.00 59.36 58.24 2jri h GLU 42 Cb 0.10 -0.22 -0.02 0.00 -0.16 0.00 0.00 28.75 28.45 2jri h GLU 42 CO -0.04 0.81 -0.14 0.93 -1.18 0.00 0.00 179.01 179.39 2jri h GLU 43 N 1.12 0.90 -0.21 1.92 5.08 -1.29 -1.51 114.58 120.58 2jri h GLU 43 Ca 0.29 -0.33 -0.10 0.00 -1.00 0.00 0.00 59.36 58.21 2jri h GLU 43 Cb 0.01 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.19 2jri h GLU 43 CO -0.05 0.98 -0.32 0.93 -1.00 0.00 0.00 179.01 179.55 2jri h GLU 44 N 0.80 0.43 -0.34 2.33 4.39 -0.14 -2.29 114.58 119.76 2jri h GLU 44 Ca 0.12 -0.18 -0.05 0.00 0.34 0.00 0.00 59.36 59.59 2jri h GLU 44 Cb 0.68 -0.02 -0.02 0.00 -0.10 0.00 0.00 28.75 29.29 2jri h GLU 44 CO 0.05 0.70 -0.01 -0.09 -1.16 0.00 0.00 179.01 178.50 2jri h ARG 45 N 0.37 0.53 -0.09 2.33 2.43 0.16 0.82 114.38 120.93 2jri h ARG 45 Ca 0.05 -0.12 -0.01 0.00 -0.81 0.00 0.00 59.98 59.08 2jri h ARG 45 Cb 0.75 -0.07 -0.00 0.00 -0.42 0.00 0.00 29.97 30.22 2jri h ARG 45 CO 0.06 0.57 0.01 0.52 -1.51 0.00 0.00 179.97 179.61 2jri h MET 46 N 0.51 0.16 0.00 0.20 2.86 -0.77 -2.60 114.93 115.29 2jri h MET 46 Ca 0.11 -0.05 -0.03 0.00 -2.06 0.00 0.00 59.70 57.67 2jri h MET 46 Cb 0.35 -0.02 -0.00 0.00 0.06 0.00 0.00 31.60 31.99 2jri h MET 46 CO 0.01 0.40 -0.16 -0.09 1.06 0.00 0.00 176.91 178.13 2jri h ARG 47 N -0.11 0.00 -0.33 1.72 1.12 -1.06 -1.22 114.38 114.51 2jri h ARG 47 Ca 0.03 0.00 -0.01 0.00 -1.11 0.00 0.00 59.98 58.88 2jri h ARG 47 Cb 0.32 0.00 -0.01 0.00 -0.01 0.00 0.00 29.97 30.27 2jri h ARG 47 CO 0.00 0.16 0.16 1.98 -3.11 0.00 0.00 179.97 179.16 2jri h MET 48 N 0.00 0.47 0.03 0.20 4.05 -0.52 0.46 114.93 119.62 2jri h MET 48 Ca -0.00 -0.07 -0.22 0.00 -0.28 0.00 0.00 59.70 59.13 2jri h MET 48 Cb 0.28 -0.08 -0.01 0.00 -0.80 0.00 0.00 31.60 30.99 2jri h MET 48 CO 0.02 0.43 -0.99 0.00 0.23 0.00 0.00 176.91 176.60 2jri h ALA 49 N 1.01 0.39 0.10 0.39 0.00 -1.08 -0.63 119.26 119.44 2jri h ALA 49 Ca 0.11 -0.82 -0.20 0.00 0.00 0.00 0.00 54.91 54.01 2jri h ALA 49 Cb 0.11 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.82 2jri h ALA 49 CO -0.01 1.03 -0.96 0.93 0.00 0.00 0.00 179.25 180.24 2jri h GLU 50 N 0.06 0.21 0.00 0.00 3.07 -1.16 -3.38 114.58 113.38 2jri h GLU 50 Ca -0.05 -0.36 -0.02 0.00 -0.50 0.00 0.00 59.36 58.43 2jri h GLU 50 Cb 1.68 0.14 -0.00 0.00 -0.84 0.00 0.00 28.75 29.73 2jri h GLU 50 CO 0.15 1.17 -1.01 0.78 -1.40 0.00 0.00 179.01 178.70 2jri h GLY 51 N -0.35 0.00 0.00 -3.84 0.00 -0.21 -3.48 103.07 95.19 2jri h GLY 51 Ca -0.20 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.13 2jri h GLY 51 CO 0.07 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.22 2jri n GLY 52 N 1.20 4.03 0.00 4.60 0.00 -0.24 -5.03 105.19 109.75 2jri n GLY 52 Ca -0.01 -1.89 0.00 0.00 0.00 0.00 0.00 46.02 44.12 2jri n GLY 52 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2jri n VAL 53 N 0.00 0.00 -3.50 1.61 0.24 -1.24 -4.78 118.33 110.66 2jri n VAL 53 Ca 0.00 0.00 -0.29 0.00 -2.04 0.00 0.00 64.34 62.01 2jri n VAL 53 Cb 0.00 -0.23 -0.13 0.00 -1.47 0.00 0.00 33.84 32.01 2jri n VAL 53 CO 0.00 0.00 0.00 -0.89 -2.14 0.00 0.00 176.83 173.80 2jri s THR 54 N 1.72 0.11 0.00 3.34 2.01 -1.26 -4.54 115.64 117.03 2jri s THR 54 Ca 0.00 -1.43 0.00 0.00 0.31 0.00 0.00 61.69 60.57 2jri s THR 54 Cb 0.00 -1.10 0.00 0.00 0.01 0.00 0.00 72.50 71.41 2jri s THR 54 CO 0.00 -0.90 0.00 -1.54 -0.69 0.00 0.00 174.62 171.49 2jri n SER 55 N 4.42 0.00 0.14 3.53 3.41 -1.26 -4.97 113.62 118.89 2jri n SER 55 Ca 0.06 0.00 0.13 0.00 -0.26 0.00 0.00 58.87 58.80 2jri n SER 55 Cb 0.39 0.00 0.31 0.00 -0.26 0.00 0.00 64.21 64.64 2jri n SER 55 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 2jri h GLU 56 N 0.00 0.00 -0.93 4.33 3.07 -2.01 -3.24 114.58 115.80 2jri h GLU 56 Ca 0.00 0.00 0.10 0.00 -0.50 0.00 0.00 59.36 58.96 2jri h GLU 56 Cb 0.00 0.00 -0.07 0.00 -0.84 0.00 0.00 28.75 27.84 2jri h GLU 56 CO 0.00 0.00 0.60 0.38 -1.40 0.00 0.00 179.01 178.59 2jri h ASP 57 N 0.00 0.85 0.00 1.42 3.04 -1.93 0.24 116.42 120.04 2jri h ASP 57 Ca 0.00 0.03 0.00 0.00 -3.24 0.00 0.00 57.03 53.82 2jri h ASP 57 Cb 0.83 -0.15 0.00 0.00 -1.04 0.00 0.00 39.33 38.97 2jri h ASP 57 CO 0.00 0.49 0.00 -1.22 -2.04 0.00 0.00 179.24 176.47 2jri n TYR 58 N -4.55 0.00 0.04 4.15 4.01 -1.22 -0.83 117.16 118.75 2jri n TYR 58 Ca 0.16 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.90 2jri n TYR 58 Cb 0.32 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.35 2jri n TYR 58 CO 0.00 0.00 0.00 0.54 -0.46 0.00 0.00 176.86 176.94 2jri n ARG 59 N -0.84 0.00 -0.08 -0.72 5.12 0.40 -4.48 116.66 116.06 2jri n ARG 59 Ca 0.07 0.00 -0.14 0.00 -1.93 0.00 0.00 57.85 55.84 2jri n ARG 59 Cb 0.03 -0.39 -0.04 0.00 -1.16 0.00 0.00 32.46 30.89 2jri n ARG 59 CO 0.00 0.00 0.00 1.79 -1.93 0.00 0.00 177.63 177.49 2jri h THR 60 N 0.00 1.29 0.00 0.55 1.35 -0.68 -1.70 112.91 113.72 2jri h THR 60 Ca 0.00 -1.66 -0.00 0.00 -0.55 0.00 0.00 66.41 64.20 2jri h THR 60 Cb 0.35 1.64 -0.00 0.00 -1.73 0.00 0.00 68.15 68.41 2jri h THR 60 CO 0.00 0.54 -0.27 0.15 -0.25 0.00 0.00 175.52 175.69 2jri h PHE 61 N 0.59 0.00 0.10 4.73 3.57 -1.17 -3.07 116.94 121.68 2jri h PHE 61 Ca 0.02 0.00 -0.27 0.00 3.53 0.00 0.00 57.97 61.25 2jri h PHE 61 Cb 1.07 0.00 0.03 0.00 2.79 0.00 0.00 35.95 39.84 2jri h PHE 61 CO 0.08 0.00 -1.13 1.25 -2.23 0.00 0.00 178.31 176.28 2jri h LEU 62 N 0.00 0.82 -2.65 0.59 5.85 -1.43 -3.15 115.31 115.34 2jri h LEU 62 Ca -0.00 -0.82 -0.04 0.00 0.84 0.00 0.00 57.88 57.86 2jri h LEU 62 Cb 1.00 -0.26 -0.03 0.00 0.37 0.00 0.00 40.66 41.75 2jri h LEU 62 CO 0.00 1.55 0.05 1.67 -0.34 0.00 0.00 178.44 181.38 2jri n GLN 63 N -3.87 3.17 -1.96 1.25 7.27 -0.65 -4.82 117.38 117.76 2jri n GLN 63 Ca -0.13 -1.91 -0.41 0.00 0.07 0.00 0.00 57.00 54.62 2jri n GLN 63 Cb 0.93 -1.94 -0.01 0.00 2.41 0.00 0.00 30.24 31.64 2jri n GLN 63 CO 0.00 0.00 0.00 -1.14 0.07 0.00 0.00 177.06 175.99 2jri s GLN 64 N -2.06 4.20 0.80 3.69 2.00 -1.16 -4.90 119.66 122.22 2jri s GLN 64 Ca 0.33 2.38 -0.15 0.00 -2.00 0.00 0.00 55.36 55.92 2jri s GLN 64 Cb 0.26 -2.99 0.02 0.00 0.80 0.00 0.00 33.01 31.10 2jri s GLN 64 CO 0.09 -0.38 0.72 -0.35 -0.50 0.00 0.00 175.29 174.87 2jri n PRO 65 N 0.57 0.14 0.00 1.67 -0.04 -1.26 -2.74 135.00 133.34 2jri n PRO 65 Ca 0.01 0.10 0.00 0.00 -0.04 0.00 0.00 63.50 63.57 2jri n PRO 65 Cb 0.41 -2.04 0.00 0.00 -0.04 0.00 0.00 33.50 31.83 2jri n PRO 65 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 2jri n SER 66 N -1.48 0.00 0.01 3.54 7.64 -1.25 -4.61 113.62 117.47 2jri n SER 66 Ca 0.10 0.00 -0.04 0.00 1.01 0.00 0.00 58.87 59.94 2jri n SER 66 Cb 0.51 0.00 0.19 0.00 -1.01 0.00 0.00 64.21 63.89 2jri n SER 66 CO 0.00 0.00 0.00 1.23 -3.01 0.00 0.00 175.04 173.26 2jri h GLY 67 N 0.00 0.55 0.69 0.23 0.00 -1.80 -3.03 103.07 99.71 2jri h GLY 67 Ca 0.00 -0.46 -0.01 0.00 0.00 0.00 0.00 47.33 46.86 2jri h GLY 67 CO 0.00 0.42 -0.01 3.43 0.00 0.00 0.00 176.54 180.38 2jri h ASN 68 N 0.45 0.11 0.00 0.19 2.35 -1.81 -3.32 115.58 113.55 2jri h ASN 68 Ca 0.06 -0.36 0.00 0.00 -0.55 0.00 0.00 56.30 55.46 2jri h ASN 68 Cb 0.69 -0.03 0.00 0.00 0.05 0.00 0.00 38.32 39.03 2jri h ASN 68 CO 0.05 0.44 0.00 0.80 -1.65 0.00 0.00 177.43 177.08 2jri n MET 69 N -4.83 0.00 0.00 0.81 0.00 -1.15 -4.32 117.12 107.63 2jri n MET 69 Ca -0.07 0.00 0.00 0.00 0.00 0.00 0.00 57.70 57.63 2jri n MET 69 Cb 0.21 0.00 0.00 0.00 0.00 0.00 0.00 33.22 33.43 2jri n MET 69 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 175.97 172.50 2jri n ASP 70 N 0.00 0.00 0.00 6.12 2.03 -1.26 -4.00 116.55 119.44 2jri n ASP 70 Ca 0.00 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.31 2jri n ASP 70 Cb 0.00 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.40 2jri n ASP 70 CO 0.00 0.00 0.00 -0.67 -1.92 0.00 0.00 177.20 174.61 2jri n ASP 71 N 0.00 0.00 0.00 1.67 2.03 -1.26 -3.88 116.55 115.11 2jri n ASP 71 Ca 0.00 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.31 2jri n ASP 71 Cb 0.00 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.40 2jri n ASP 71 CO 0.00 0.00 0.00 -1.20 -1.92 0.00 0.00 177.20 174.08 2jri n SER 72 N 0.00 0.00 -0.66 1.67 7.64 -1.26 -4.96 113.62 116.05 2jri n SER 72 Ca 0.00 0.00 0.03 0.00 1.01 0.00 0.00 58.87 59.91 2jri n SER 72 Cb 0.00 0.00 0.10 0.00 -1.01 0.00 0.00 64.21 63.30 2jri n SER 72 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2jri n GLY 73 N 5.00 1.02 0.00 0.23 0.00 -1.26 -4.83 105.19 105.36 2jri n GLY 73 Ca 0.00 -0.24 0.00 0.00 0.00 0.00 0.00 46.02 45.78 2jri n GLY 73 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2jri n PHE 74 N 0.14 -1.02 -3.64 1.61 3.72 -1.26 -2.39 117.46 114.62 2jri n PHE 74 Ca 0.07 0.00 -0.05 0.00 -0.05 0.00 0.00 57.45 57.42 2jri n PHE 74 Cb 0.36 0.00 -0.07 0.00 -0.94 0.00 0.00 39.48 38.83 2jri n PHE 74 CO 0.00 0.00 0.00 -0.06 -0.05 0.00 0.00 176.76 176.65 2jri s PHE 75 N 0.41 -0.92 0.81 1.38 0.08 -1.26 -4.80 117.98 113.69 2jri s PHE 75 Ca 0.00 1.82 -0.11 0.00 0.12 0.00 0.00 56.93 58.75 2jri s PHE 75 Cb 0.00 0.55 0.08 0.00 -0.57 0.00 0.00 43.02 43.07 2jri s PHE 75 CO 0.00 -0.45 1.10 -1.12 -0.10 0.00 0.00 175.22 174.64 2jri s SER 76 N 1.59 4.38 0.48 1.36 0.01 -1.26 -4.91 113.70 115.35 2jri s SER 76 Ca -0.09 1.32 0.33 0.00 1.31 0.00 0.00 55.95 58.81 2jri s SER 76 Cb -0.05 -2.04 1.74 0.00 0.21 0.00 0.00 66.02 65.88 2jri s SER 76 CO -0.18 -2.04 2.00 -0.29 0.41 0.00 0.00 173.24 173.13 2jri h ILE 77 N -1.14 0.00 -0.24 1.44 2.10 -1.96 -2.35 117.51 115.36 2jri h ILE 77 Ca -0.47 -0.03 0.07 0.00 1.08 0.00 0.00 64.86 65.51 2jri h ILE 77 Cb 1.27 0.78 -0.01 0.00 -1.09 0.00 0.00 36.82 37.77 2jri h ILE 77 CO 0.59 0.00 0.21 1.56 -1.08 0.00 0.00 178.15 179.43 2jri h GLN 78 N 0.00 0.00 -0.00 2.19 7.50 -1.92 0.10 115.11 122.98 2jri h GLN 78 Ca 0.00 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.15 2jri h GLN 78 Cb 0.04 0.00 0.00 0.00 0.05 0.00 0.00 27.48 27.57 2jri h GLN 78 CO 0.00 0.00 0.00 1.33 -1.50 0.00 0.00 178.83 178.66 2jri n VAL 79 N -4.07 0.00 -0.07 -0.54 0.24 -0.88 -2.41 118.33 110.60 2jri n VAL 79 Ca 0.03 -0.00 -0.14 0.00 -2.04 0.00 0.00 64.34 62.19 2jri n VAL 79 Cb 0.36 -0.42 -0.05 0.00 -1.47 0.00 0.00 33.84 32.25 2jri n VAL 79 CO 0.00 0.00 0.00 -0.38 -2.14 0.00 0.00 176.83 174.31 2jri n ILE 80 N -0.92 0.75 -0.22 1.34 2.08 0.32 -3.95 119.36 118.75 2jri n ILE 80 Ca 0.21 -0.20 -0.05 0.00 0.56 0.00 0.00 62.75 63.26 2jri n ILE 80 Cb 0.10 -1.59 0.10 0.00 -0.75 0.00 0.00 39.64 37.50 2jri n ILE 80 CO 0.00 0.00 0.00 0.28 0.56 0.00 0.00 176.55 177.39 2jri h SER 81 N -0.42 0.98 0.92 4.38 0.02 -1.55 -2.68 113.55 115.20 2jri h SER 81 Ca -0.34 -0.19 0.00 0.00 -0.84 0.00 0.00 61.79 60.42 2jri h SER 81 Cb 1.32 -0.26 0.00 0.00 0.14 0.00 0.00 62.40 63.61 2jri h SER 81 CO -0.19 0.93 -0.59 -1.13 -1.14 0.00 0.00 176.83 174.71 2jri h ASN 82 N 1.00 0.00 -0.78 3.07 -1.24 -1.74 -3.31 115.58 112.58 2jri h ASN 82 Ca 0.22 -0.19 -0.02 0.00 0.71 0.00 0.00 56.30 57.01 2jri h ASN 82 Cb 0.31 0.00 -0.04 0.00 0.73 0.00 0.00 38.32 39.33 2jri h ASN 82 CO -0.00 0.10 0.40 0.00 -1.29 0.00 0.00 177.43 176.63 2jri h ALA 83 N 2.49 1.22 0.00 1.57 0.00 -1.60 -2.44 119.26 120.50 2jri h ALA 83 Ca 0.00 -0.14 -0.09 0.00 0.00 0.00 0.00 54.91 54.68 2jri h ALA 83 Cb 0.76 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 18.21 2jri h ALA 83 CO 0.00 0.61 -0.99 -0.07 0.00 0.00 0.00 179.25 178.80 2jri h LEU 84 N 1.12 0.00 -0.51 0.00 -0.00 -1.69 -3.35 115.31 110.89 2jri h LEU 84 Ca 0.28 0.00 -0.07 0.00 -0.00 0.00 0.00 57.88 58.09 2jri h LEU 84 Cb 0.07 0.00 -0.02 0.00 -0.00 0.00 0.00 40.66 40.71 2jri h LEU 84 CO -0.04 0.33 0.06 0.50 -0.00 0.00 0.00 178.44 179.29 2jri h LYS 85 N 0.00 0.86 0.00 1.13 3.64 -1.54 -0.11 116.57 120.55 2jri h LYS 85 Ca -0.07 -0.24 0.00 0.00 -1.27 0.00 0.00 60.65 59.07 2jri h LYS 85 Cb 1.31 -0.09 0.00 0.00 -0.41 0.00 0.00 32.23 33.04 2jri h LYS 85 CO 0.03 0.86 0.00 -0.39 -2.27 0.00 0.00 179.45 177.68 2jri h VAL 86 N 0.73 0.00 -0.01 2.00 -1.51 -1.58 -1.25 116.25 114.63 2jri h VAL 86 Ca 0.15 -0.38 0.00 0.00 -1.23 0.00 0.00 66.70 65.24 2jri h VAL 86 Cb 0.43 1.36 0.00 0.00 -2.13 0.00 0.00 31.29 30.95 2jri h VAL 86 CO 0.01 0.00 -0.10 0.79 -1.23 0.00 0.00 177.57 177.04 2jri n TRP 87 N -3.02 0.00 -0.68 5.19 7.02 -0.87 -4.90 117.44 120.18 2jri n TRP 87 Ca -0.00 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.48 2jri n TRP 87 Cb 0.25 -0.07 0.00 0.00 -2.42 0.00 0.00 31.31 29.07 2jri n TRP 87 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 2jri n GLY 88 N 1.23 0.72 4.00 6.99 0.00 -0.47 -5.05 105.19 112.61 2jri n GLY 88 Ca 0.16 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.96 2jri n GLY 88 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2jri s LEU 89 N 0.00 2.99 -0.00 0.99 2.01 -0.11 -5.00 118.68 119.56 2jri s LEU 89 Ca 0.00 -0.50 0.03 0.00 0.01 0.00 0.00 54.13 53.68 2jri s LEU 89 Cb 0.00 -1.85 -0.01 0.00 0.01 0.00 0.00 46.19 44.34 2jri s LEU 89 CO 0.00 -1.78 -0.11 -0.70 1.01 0.00 0.00 176.35 174.77 2jri s GLU 90 N -5.05 0.87 -0.28 1.70 2.12 -1.09 -4.10 118.70 112.87 2jri s GLU 90 Ca 0.66 -0.44 -0.07 0.00 0.36 0.00 0.00 54.97 55.49 2jri s GLU 90 Cb -0.05 -0.84 0.00 0.00 0.26 0.00 0.00 34.13 33.50 2jri s GLU 90 CO 0.43 0.23 0.07 -1.17 -0.54 0.00 0.00 175.26 174.28 2jri s LEU 91 N -0.38 3.73 -0.20 2.70 2.96 -1.26 -0.34 118.68 125.89 2jri s LEU 91 Ca 0.03 -0.62 -0.04 0.00 -0.22 0.00 0.00 54.13 53.28 2jri s LEU 91 Cb -0.05 -1.88 -0.02 0.00 0.50 0.00 0.00 46.19 44.75 2jri s LEU 91 CO -0.00 -0.16 -0.02 -0.63 -1.32 0.00 0.00 176.35 174.22 2jri s ILE 92 N 1.51 3.77 -1.16 6.68 -1.09 0.46 -4.94 121.20 126.43 2jri s ILE 92 Ca 0.03 -0.38 -0.19 0.00 -2.23 0.00 0.00 60.65 57.88 2jri s ILE 92 Cb -0.17 -2.69 0.08 0.00 -1.58 0.00 0.00 42.46 38.10 2jri s ILE 92 CO 0.02 0.44 1.54 -0.22 -1.23 0.00 0.00 174.94 175.49 2jri s LEU 93 N 1.01 4.02 0.57 2.97 2.96 -1.26 -0.60 118.68 128.34 2jri s LEU 93 Ca 0.01 -2.17 0.38 0.00 -0.22 0.00 0.00 54.13 52.13 2jri s LEU 93 Cb -0.14 -2.53 1.96 0.00 0.50 0.00 0.00 46.19 45.97 2jri s LEU 93 CO 0.01 -1.21 2.15 0.15 -1.32 0.00 0.00 176.35 176.14 2jri h PHE 94 N 8.35 0.00 0.00 5.38 3.57 -1.25 -2.01 116.94 130.97 2jri h PHE 94 Ca 0.32 0.00 -0.06 0.00 3.53 0.00 0.00 57.97 61.77 2jri h PHE 94 Cb 0.93 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 39.66 2jri h PHE 94 CO 1.31 0.00 -0.26 -0.97 -2.23 0.00 0.00 178.31 176.16 2jri h ASN 95 N 0.00 0.00 -3.43 0.41 -1.24 -1.85 -3.27 115.58 106.20 2jri h ASN 95 Ca 0.00 0.00 -0.54 0.00 0.71 0.00 0.00 56.30 56.47 2jri h ASN 95 Cb 0.11 0.00 -0.03 0.00 0.73 0.00 0.00 38.32 39.13 2jri h ASN 95 CO 0.00 0.26 0.28 -0.44 -1.29 0.00 0.00 177.43 176.24 2jri s SER 96 N -6.49 7.28 0.39 1.15 0.01 -0.76 -4.89 113.70 110.40 2jri s SER 96 Ca -0.02 1.54 0.19 0.00 1.31 0.00 0.00 55.95 58.97 2jri s SER 96 Cb 0.13 -2.52 1.13 0.00 0.21 0.00 0.00 66.02 64.97 2jri s SER 96 CO 0.66 -0.16 1.72 -0.65 0.41 0.00 0.00 173.24 175.22 2jri h PRO 97 N 6.44 0.34 -0.17 12.44 0.11 -1.88 0.30 132.00 149.59 2jri h PRO 97 Ca -0.42 -0.02 -0.03 0.00 0.11 0.00 0.00 66.00 65.65 2jri h PRO 97 Cb 1.21 -0.08 -0.01 0.00 0.11 0.00 0.00 31.00 32.23 2jri h PRO 97 CO 0.74 0.22 -0.01 1.05 -0.21 0.00 0.00 178.00 179.80 2jri h GLU 98 N 0.35 0.25 0.00 1.05 9.09 -1.92 -2.68 114.58 120.72 2jri h GLU 98 Ca 0.67 -0.04 0.00 0.00 0.05 0.00 0.00 59.36 60.04 2jri h GLU 98 Cb 1.70 -0.04 0.00 0.00 -1.65 0.00 0.00 28.75 28.75 2jri h GLU 98 CO -0.39 0.28 -1.30 0.66 0.05 0.00 0.00 179.01 178.31 2jri n TYR 99 N -4.38 0.00 0.24 2.06 4.01 0.52 -4.29 117.16 115.32 2jri n TYR 99 Ca -0.00 0.00 0.12 0.00 -0.16 0.00 0.00 57.90 57.86 2jri n TYR 99 Cb 0.18 -0.19 0.54 0.00 -0.31 0.00 0.00 39.34 39.57 2jri n TYR 99 CO 0.00 0.00 0.00 0.37 -0.46 0.00 0.00 176.86 176.77 2jri h GLN 100 N 0.00 0.00 -1.90 -0.72 4.15 -0.22 -3.22 115.11 113.20 2jri h GLN 100 Ca 0.00 0.00 -0.46 0.00 0.77 0.00 0.00 58.65 58.96 2jri h GLN 100 Cb 0.62 0.00 -0.17 0.00 0.21 0.00 0.00 27.48 28.15 2jri h GLN 100 CO 0.00 0.15 0.38 2.89 -1.93 0.00 0.00 178.83 180.32 2jri n ARG 101 N -3.32 2.28 0.13 1.69 1.85 -1.16 -4.39 116.66 113.73 2jri n ARG 101 Ca 0.00 -2.17 0.10 0.00 -1.00 0.00 0.00 57.85 54.79 2jri n ARG 101 Cb 0.38 -2.04 0.03 0.00 -1.05 0.00 0.00 32.46 29.78 2jri n ARG 101 CO 0.00 0.00 0.00 1.37 -0.01 0.00 0.00 177.63 178.99 2jri h LEU 102 N 3.68 0.00 -2.05 2.89 8.10 -1.87 -3.49 115.31 122.57 2jri h LEU 102 Ca 0.37 0.00 -0.32 0.00 0.11 0.00 0.00 57.88 58.04 2jri h LEU 102 Cb 0.78 0.00 0.16 0.00 -0.44 0.00 0.00 40.66 41.16 2jri h LEU 102 CO 0.84 0.06 -0.82 0.54 -4.11 0.00 0.00 178.44 174.95 2jri n ARG 103 N -2.81 -4.49 -4.44 0.17 3.00 -1.26 -5.03 116.66 101.80 2jri n ARG 103 Ca 0.00 0.79 -0.23 0.00 -0.01 0.00 0.00 57.85 58.41 2jri n ARG 103 Cb 0.57 -5.63 -0.09 0.00 0.00 0.00 0.00 32.46 27.31 2jri n ARG 103 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.63 178.05 2jri s ILE 104 N -3.43 0.59 -0.22 0.55 1.01 -1.26 -5.14 121.20 113.30 2jri s ILE 104 Ca 0.19 -2.00 -0.06 0.00 0.00 0.00 0.00 60.65 58.78 2jri s ILE 104 Cb -0.03 -2.47 -0.03 0.00 0.01 0.00 0.00 42.46 39.94 2jri s ILE 104 CO 0.76 0.00 0.03 -0.62 0.00 0.00 0.00 174.94 175.10 2jri s ASP 105 N -3.51 5.01 0.56 3.58 2.15 -1.26 -4.99 116.67 118.21 2jri s ASP 105 Ca 0.30 -0.18 0.33 0.00 0.43 0.00 0.00 52.55 53.43 2jri s ASP 105 Cb 0.04 -1.87 1.59 0.00 -0.30 0.00 0.00 42.92 42.38 2jri s ASP 105 CO 0.16 0.04 2.08 1.55 -0.17 0.00 0.00 175.17 178.83 2jri h PRO 106 N 7.67 0.00 0.00 4.34 0.13 -2.00 -2.15 132.00 140.00 2jri h PRO 106 Ca -0.37 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.76 2jri h PRO 106 Cb 1.18 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.31 2jri h PRO 106 CO 0.61 0.06 0.00 0.82 -0.23 0.00 0.00 178.00 179.26 2jri h ILE 107 N 0.00 0.00 -0.60 -3.56 2.04 -1.94 -2.94 117.51 110.51 2jri h ILE 107 Ca -0.00 -0.61 0.00 0.00 1.00 0.00 0.00 64.86 65.25 2jri h ILE 107 Cb 0.37 1.60 0.00 0.00 -0.74 0.00 0.00 36.82 38.05 2jri h ILE 107 CO 0.01 0.00 0.00 -3.20 0.00 0.00 0.00 178.15 174.96 2jri n ASN 108 N -2.51 3.23 -2.66 1.72 5.15 -0.81 -4.92 115.26 114.46 2jri n ASN 108 Ca 0.05 -2.00 0.00 0.00 -0.60 0.00 0.00 54.58 52.03 2jri n ASN 108 Cb 0.45 -0.40 0.00 0.00 -0.53 0.00 0.00 39.78 39.30 2jri n ASN 108 CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04 2jri n GLU 109 N 1.27 0.81 0.00 1.20 -0.58 -1.11 -5.03 120.64 117.20 2jri n GLU 109 Ca 0.20 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.94 2jri n GLU 109 Cb 0.51 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 31.38 2jri n GLU 109 CO 0.00 0.00 0.00 2.89 -0.48 0.00 0.00 177.13 179.54 2jri n ARG 110 N -0.26 0.00 -3.56 3.49 0.00 -1.26 -4.94 116.66 110.13 2jri n ARG 110 Ca 0.00 0.00 -0.01 0.00 -0.00 0.00 0.00 57.85 57.84 2jri n ARG 110 Cb 0.00 -0.47 -0.06 0.00 -0.00 0.00 0.00 32.46 31.93 2jri n ARG 110 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.63 176.09 2jri s SER 111 N -4.28 -0.52 0.00 2.89 1.04 -1.26 -1.60 113.70 109.97 2jri s SER 111 Ca 0.00 0.78 -0.01 0.00 0.48 0.00 0.00 55.95 57.20 2jri s SER 111 Cb 0.00 1.36 -0.01 0.00 0.10 0.00 0.00 66.02 67.47 2jri s SER 111 CO 0.00 -0.12 0.02 0.72 0.98 0.00 0.00 173.24 174.84 2jri s PHE 112 N 1.71 0.07 -0.14 5.02 -0.71 -0.47 -1.44 117.98 122.02 2jri s PHE 112 Ca -0.07 -0.15 -0.01 0.00 -1.04 0.00 0.00 56.93 55.66 2jri s PHE 112 Cb -0.04 -0.06 -0.02 0.00 -1.21 0.00 0.00 43.02 41.69 2jri s PHE 112 CO -0.16 -0.10 -0.10 0.42 -1.34 0.00 0.00 175.22 173.95 2jri s ILE 113 N -0.59 3.25 -0.27 -4.49 1.01 0.00 -1.13 121.20 118.98 2jri s ILE 113 Ca -0.07 -0.58 -0.06 0.00 0.00 0.00 0.00 60.65 59.94 2jri s ILE 113 Cb -0.04 -2.39 0.00 0.00 0.01 0.00 0.00 42.46 40.04 2jri s ILE 113 CO -0.00 0.51 0.04 0.00 0.00 0.00 0.00 174.94 175.49 2jri s ASN 115 N 1.49 7.00 -0.41 0.00 2.47 -0.50 0.71 114.94 125.71 2jri s ASN 115 Ca 0.03 1.19 0.06 0.00 0.42 0.00 0.00 52.86 54.56 2jri s ASN 115 Cb -0.16 -2.33 0.43 0.00 -1.45 0.00 0.00 41.25 37.73 2jri s ASN 115 CO 0.01 0.28 1.12 0.00 -3.72 0.00 0.00 177.10 174.78 2jri n TYR 116 N 1.68 3.22 0.00 0.43 9.36 0.17 -0.33 117.16 131.68 2jri n TYR 116 Ca -0.11 -2.95 0.00 0.00 3.32 0.00 0.00 57.90 58.16 2jri n TYR 116 Cb 0.51 -0.13 0.00 0.00 -0.63 0.00 0.00 39.34 39.09 2jri n TYR 116 CO 0.00 0.00 0.00 1.17 0.22 0.00 0.00 176.86 178.25 2jri n LYS 117 N -0.51 0.00 0.00 2.98 3.00 -1.26 -3.77 118.16 118.60 2jri n LYS 117 Ca 0.39 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.70 2jri n LYS 117 Cb 0.72 -0.37 0.00 0.00 0.00 0.00 0.00 35.03 35.38 2jri n LYS 117 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.40 175.49 2jri n GLU 118 N 0.00 0.00 -4.38 1.64 0.00 -1.26 -5.07 120.64 111.56 2jri n GLU 118 Ca 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 57.16 56.81 2jri n GLU 118 Cb 0.00 -0.66 -0.10 0.00 0.00 0.00 0.00 31.44 30.69 2jri n GLU 118 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.13 176.12 2jri s HIS 119 N -1.41 3.13 0.06 4.31 3.76 -1.25 -5.11 115.29 118.79 2jri s HIS 119 Ca 0.00 0.13 0.04 0.00 -0.15 0.00 0.00 55.06 55.08 2jri s HIS 119 Cb 0.00 -1.81 -0.04 0.00 1.11 0.00 0.00 32.58 31.84 2jri s HIS 119 CO 0.00 0.40 -0.04 -1.58 -0.85 0.00 0.00 174.74 172.67 2jri s TRP 120 N -0.71 2.92 -0.41 1.40 0.52 -1.26 0.41 118.94 121.80 2jri s TRP 120 Ca 0.11 -0.05 -0.06 0.00 0.02 0.00 0.00 56.10 56.13 2jri s TRP 120 Cb -0.12 -1.55 0.09 0.00 -1.15 0.00 0.00 33.47 30.75 2jri s TRP 120 CO 0.02 0.44 0.23 -0.06 0.02 0.00 0.00 176.95 177.59 2jri s PHE 121 N -1.17 3.44 -0.52 -1.98 0.40 0.22 -4.77 117.98 113.59 2jri s PHE 121 Ca 0.22 -1.95 -0.28 0.00 -0.60 0.00 0.00 56.93 54.32 2jri s PHE 121 Cb -0.11 -3.06 0.03 0.00 0.51 0.00 0.00 43.02 40.39 2jri s PHE 121 CO 0.13 -0.91 1.14 0.99 0.70 0.00 0.00 175.22 177.27 2jri s THR 122 N 1.29 4.15 -0.43 0.64 2.01 -1.26 -0.93 115.64 121.11 2jri s THR 122 Ca 0.04 1.03 -0.07 0.00 0.31 0.00 0.00 61.69 63.00 2jri s THR 122 Cb -0.23 -4.65 0.10 0.00 0.01 0.00 0.00 72.50 67.74 2jri s THR 122 CO -0.01 -1.14 0.26 -0.69 -0.69 0.00 0.00 174.62 172.35 2jri s VAL 123 N 4.61 3.86 -0.12 3.82 1.01 -0.28 -0.29 120.40 133.00 2jri s VAL 123 Ca 0.45 -1.77 -0.04 0.00 0.00 0.00 0.00 61.98 60.62 2jri s VAL 123 Cb -0.08 -3.52 -0.04 0.00 0.00 0.00 0.00 36.38 32.75 2jri s VAL 123 CO 0.28 -0.66 0.03 -0.60 0.00 0.00 0.00 175.10 174.16 2jri s ARG 124 N 1.30 3.37 0.03 2.72 6.06 -0.95 -1.37 118.95 130.11 2jri s ARG 124 Ca 0.05 -0.36 -0.30 0.00 -2.50 0.00 0.00 55.73 52.62 2jri s ARG 124 Cb -0.24 -2.97 -0.06 0.00 0.06 0.00 0.00 34.95 31.74 2jri s ARG 124 CO -0.01 0.56 1.30 0.21 -2.50 0.00 0.00 175.30 174.86 2jri s LYS 125 N -0.47 4.35 -0.13 5.12 2.36 -0.63 -2.53 119.74 127.81 2jri s LYS 125 Ca 0.09 1.87 -0.01 0.00 -2.55 0.00 0.00 55.97 55.38 2jri s LYS 125 Cb -0.12 -3.45 0.03 0.00 -1.05 0.00 0.00 37.83 33.24 2jri s LYS 125 CO 0.02 -0.43 -0.06 -0.51 1.55 0.00 0.00 175.35 175.91 2jri s LEU 126 N 1.75 1.30 0.00 5.43 1.02 0.00 -4.79 118.68 123.38 2jri s LEU 126 Ca 0.61 -0.42 0.00 0.00 0.02 0.00 0.00 54.13 54.34 2jri s LEU 126 Cb -0.30 -0.85 0.00 0.00 0.02 0.00 0.00 46.19 45.06 2jri s LEU 126 CO 0.27 -0.15 0.00 0.61 0.02 0.00 0.00 176.35 177.11 2jri n GLY 127 N 4.93 0.82 0.00 -3.19 0.00 -0.94 -1.51 105.19 105.30 2jri n GLY 127 Ca -0.12 0.39 0.00 0.00 0.00 0.00 0.00 46.02 46.29 2jri n GLY 127 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2jri n LYS 128 N 0.00 0.10 -2.04 1.61 0.00 -1.26 -4.83 118.16 111.74 2jri n LYS 128 Ca 0.00 0.00 -0.27 0.00 0.00 0.00 0.00 58.31 58.04 2jri n LYS 128 Cb 0.00 -0.18 0.18 0.00 0.00 0.00 0.00 35.03 35.03 2jri n LYS 128 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.40 178.44 2jri n GLN 129 N -0.48 -0.95 -4.27 1.64 3.00 -0.57 -4.99 117.38 110.76 2jri n GLN 129 Ca 0.00 -2.19 -0.21 0.00 -0.01 0.00 0.00 57.00 54.58 2jri n GLN 129 Cb 0.00 -1.15 -0.12 0.00 0.00 0.00 0.00 30.24 28.97 2jri n GLN 129 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.06 175.48 2jri s TRP 130 N -3.63 1.64 -0.01 1.08 0.52 -1.09 -0.82 118.94 116.63 2jri s TRP 130 Ca 0.71 -0.47 -0.00 0.00 0.02 0.00 0.00 56.10 56.37 2jri s TRP 130 Cb -0.02 -0.87 0.01 0.00 -1.15 0.00 0.00 33.47 31.44 2jri s TRP 130 CO 0.49 0.21 0.01 -0.06 0.02 0.00 0.00 176.95 177.62 2jri s PHE 131 N -1.62 -0.00 -0.10 -1.98 0.08 -1.05 -1.39 117.98 111.91 2jri s PHE 131 Ca 0.08 0.04 -0.19 0.00 0.12 0.00 0.00 56.93 56.99 2jri s PHE 131 Cb -0.08 -0.05 -0.04 0.00 -0.57 0.00 0.00 43.02 42.29 2jri s PHE 131 CO 0.04 -0.02 0.51 1.21 -0.10 0.00 0.00 175.22 176.86 2jri s ASN 132 N 0.22 6.74 -0.52 1.36 2.47 -1.20 -2.25 114.94 121.76 2jri s ASN 132 Ca -0.02 0.88 0.03 0.00 0.42 0.00 0.00 52.86 54.18 2jri s ASN 132 Cb -0.03 -2.31 0.13 0.00 -1.45 0.00 0.00 41.25 37.60 2jri s ASN 132 CO -0.01 -0.00 0.27 -0.76 -3.72 0.00 0.00 177.10 172.88 2jri s LEU 133 N 0.57 4.46 0.10 3.21 1.43 0.60 -3.50 118.68 125.55 2jri s LEU 133 Ca 0.28 -2.95 0.09 0.00 -1.03 0.00 0.00 54.13 50.52 2jri s LEU 133 Cb -0.16 -1.67 -0.04 0.00 0.03 0.00 0.00 46.19 44.36 2jri s LEU 133 CO 0.12 -0.26 -0.22 0.21 0.23 0.00 0.00 176.35 176.43 2jri s ASN 134 N -0.10 2.65 0.36 2.29 2.47 -1.26 -4.14 114.94 117.21 2jri s ASN 134 Ca 0.17 -0.69 0.27 0.00 0.42 0.00 0.00 52.86 53.03 2jri s ASN 134 Cb -0.25 -0.15 1.16 0.00 -1.45 0.00 0.00 41.25 40.56 2jri s ASN 134 CO -0.01 0.08 1.81 0.28 -3.72 0.00 0.00 177.10 175.54 2jri h SER 135 N 4.09 0.00 0.00 -4.21 0.02 -1.91 -3.27 113.55 108.27 2jri h SER 135 Ca -0.47 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.48 2jri h SER 135 Cb 1.18 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.72 2jri h SER 135 CO 0.40 0.00 0.00 -0.11 -1.14 0.00 0.00 176.83 175.98 2jri n LEU 136 N -2.52 0.16 -4.52 5.07 7.94 -1.26 -4.81 117.00 117.06 2jri n LEU 136 Ca 0.01 0.77 -0.33 0.00 -1.11 0.00 0.00 56.01 55.35 2jri n LEU 136 Cb 0.23 -0.38 0.12 0.00 0.53 0.00 0.00 43.42 43.92 2jri n LEU 136 CO 0.21 -0.38 0.23 0.00 -1.11 0.00 0.00 177.39 176.34 2jri n LEU 137 N -1.65 1.40 -1.67 -1.96 -0.00 -1.24 -4.95 117.00 106.94 2jri n LEU 137 Ca 0.00 0.43 -0.17 0.00 -0.00 0.00 0.00 56.01 56.27 2jri n LEU 137 Cb 0.00 -1.31 0.10 0.00 -0.00 0.00 0.00 43.42 42.21 2jri n LEU 137 CO 0.00 -2.95 0.51 1.07 -0.00 0.00 0.00 177.39 176.02 2jri n THR 138 N -3.51 2.65 0.00 1.47 5.66 -1.26 -4.84 114.28 114.45 2jri n THR 138 Ca 0.09 -3.55 0.00 0.00 -3.05 0.00 0.00 64.05 57.54 2jri n THR 138 Cb 0.52 -0.82 0.00 0.00 -1.55 0.00 0.00 70.33 68.48 2jri n THR 138 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2jri n GLY 139 N -0.90 2.22 3.68 1.09 0.00 -1.26 -5.12 105.19 104.90 2jri n GLY 139 Ca 0.41 0.11 -0.48 0.00 0.00 0.00 0.00 46.02 46.06 2jri n GLY 139 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2jri n PRO 140 N -0.17 2.20 -2.28 1.61 -0.02 -1.26 -4.91 135.00 130.17 2jri n PRO 140 Ca 0.00 0.80 -0.43 0.00 -2.02 0.00 0.00 63.50 61.86 2jri n PRO 140 Cb 0.00 -2.64 -0.02 0.00 -0.02 0.00 0.00 33.50 30.81 2jri n PRO 140 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 2jri s GLU 141 N 3.64 4.20 -0.22 -0.52 2.02 -1.23 -4.82 118.70 121.77 2jri s GLU 141 Ca 0.91 1.82 -0.29 0.00 0.02 0.00 0.00 54.97 57.43 2jri s GLU 141 Cb -0.68 -3.84 -0.03 0.00 0.10 0.00 0.00 34.13 29.68 2jri s GLU 141 CO 0.49 -0.77 1.65 -1.17 0.02 0.00 0.00 175.26 175.48 2jri s LEU 142 N 3.72 3.87 -0.36 1.80 2.96 -1.26 -3.25 118.68 126.16 2jri s LEU 142 Ca 0.61 1.63 -0.06 0.00 -0.22 0.00 0.00 54.13 56.10 2jri s LEU 142 Cb -0.25 -3.53 0.06 0.00 0.50 0.00 0.00 46.19 42.97 2jri s LEU 142 CO 0.20 -1.30 0.14 -0.63 -1.32 0.00 0.00 176.35 173.44 2jri s ILE 143 N 5.35 3.66 0.92 6.68 1.01 -0.49 -5.04 121.20 133.30 2jri s ILE 143 Ca 0.73 -1.41 -0.12 0.00 0.00 0.00 0.00 60.65 59.85 2jri s ILE 143 Cb -0.25 -3.20 0.15 0.00 0.01 0.00 0.00 42.46 39.16 2jri s ILE 143 CO 0.30 -0.34 1.14 -0.44 0.00 0.00 0.00 174.94 175.60 2jri s SER 144 N 1.63 3.40 0.03 3.58 0.01 -1.26 -2.68 113.70 118.41 2jri s SER 144 Ca 0.01 0.95 -0.14 0.00 1.31 0.00 0.00 55.95 58.08 2jri s SER 144 Cb -0.21 -1.51 -0.07 0.00 0.21 0.00 0.00 66.02 64.44 2jri s SER 144 CO 0.01 -2.62 1.22 0.44 0.41 0.00 0.00 173.24 172.69 2jri h ASP 145 N -1.54 -0.52 0.11 2.44 5.19 -1.99 0.10 116.42 120.21 2jri h ASP 145 Ca -0.50 0.04 -0.02 0.00 -0.62 0.00 0.00 57.03 55.92 2jri h ASP 145 Cb 1.33 0.17 -0.00 0.00 0.18 0.00 0.00 39.33 41.00 2jri h ASP 145 CO 0.61 -0.27 -0.11 0.71 -3.12 0.00 0.00 179.24 177.06 2jri h THR 146 N -0.41 1.08 -0.28 0.35 1.35 -2.01 -2.07 112.91 110.92 2jri h THR 146 Ca -0.03 -0.40 -0.13 0.00 -0.55 0.00 0.00 66.41 65.30 2jri h THR 146 Cb 0.35 1.20 -0.01 0.00 -1.73 0.00 0.00 68.15 67.96 2jri h THR 146 CO -0.01 0.11 -0.37 0.22 -0.25 0.00 0.00 175.52 175.23 2jri h TYR 147 N 0.01 0.74 -0.96 4.73 3.20 -1.88 -2.97 116.97 119.85 2jri h TYR 147 Ca 0.00 -0.21 0.00 0.00 3.14 0.00 0.00 58.73 61.67 2jri h TYR 147 Cb 0.20 -0.16 -0.05 0.00 1.54 0.00 0.00 36.73 38.26 2jri h TYR 147 CO 0.00 0.91 0.61 1.25 -1.64 0.00 0.00 178.16 179.28 2jri h LEU 148 N 0.53 1.12 -0.70 2.82 5.85 -0.05 0.37 115.31 125.25 2jri h LEU 148 Ca 0.05 -0.05 0.01 0.00 0.84 0.00 0.00 57.88 58.73 2jri h LEU 148 Cb 0.87 -0.28 -0.03 0.00 0.37 0.00 0.00 40.66 41.59 2jri h LEU 148 CO 0.08 0.84 0.46 0.00 -0.34 0.00 0.00 178.44 179.48 2jri h ALA 149 N 1.33 0.88 -0.24 1.25 0.00 -1.45 0.10 119.26 121.14 2jri h ALA 149 Ca 0.35 -0.05 -0.13 0.00 0.00 0.00 0.00 54.91 55.07 2jri h ALA 149 Cb -0.10 -0.28 -0.00 0.00 0.00 0.00 0.00 17.79 17.40 2jri h ALA 149 CO -0.07 0.31 -0.38 1.25 0.00 0.00 0.00 179.25 180.36 2jri h LEU 150 N 0.95 0.74 -0.16 0.00 5.85 -1.29 -2.78 115.31 118.62 2jri h LEU 150 Ca 0.26 -0.52 0.04 0.00 0.84 0.00 0.00 57.88 58.50 2jri h LEU 150 Cb -0.11 -0.21 -0.05 0.00 0.37 0.00 0.00 40.66 40.66 2jri h LEU 150 CO -0.06 1.12 -0.13 0.15 -0.34 0.00 0.00 178.44 179.18 2jri h PHE 151 N 0.38 -0.33 -0.55 1.25 3.57 0.15 0.68 116.94 122.09 2jri h PHE 151 Ca 0.02 0.02 0.05 0.00 3.53 0.00 0.00 57.97 61.59 2jri h PHE 151 Cb 0.97 0.17 -0.05 0.00 2.79 0.00 0.00 35.95 39.84 2jri h PHE 151 CO 0.08 -0.20 0.29 -0.07 -2.23 0.00 0.00 178.31 176.18 2jri h LEU 152 N -0.15 0.42 -0.79 0.59 -0.00 -0.83 -1.89 115.31 112.67 2jri h LEU 152 Ca 0.10 0.03 -0.08 0.00 -0.00 0.00 0.00 57.88 57.93 2jri h LEU 152 Cb 0.30 -0.06 -0.02 0.00 -0.00 0.00 0.00 40.66 40.88 2jri h LEU 152 CO -0.25 0.29 0.06 0.00 -0.00 0.00 0.00 178.44 178.54 2jri h ALA 153 N 1.29 0.99 -0.75 1.53 0.00 -1.13 -2.77 119.26 118.43 2jri h ALA 153 Ca 0.24 -0.27 -0.03 0.00 0.00 0.00 0.00 54.91 54.85 2jri h ALA 153 Cb 0.13 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 17.66 2jri h ALA 153 CO -0.16 0.63 0.33 1.96 0.00 0.00 0.00 179.25 182.01 2jri h GLN 154 N 0.91 1.09 -0.74 0.00 1.08 -0.31 -2.45 115.11 114.69 2jri h GLN 154 Ca 0.18 -0.18 -0.02 0.00 -1.45 0.00 0.00 58.65 57.18 2jri h GLN 154 Cb 0.45 -0.19 -0.04 0.00 -0.05 0.00 0.00 27.48 27.66 2jri h GLN 154 CO 0.02 0.87 0.38 -0.07 -0.95 0.00 0.00 178.83 179.08 2jri h LEU 155 N 1.06 0.94 -1.50 1.46 3.38 -1.14 0.95 115.31 120.45 2jri h LEU 155 Ca 0.25 -0.09 -0.05 0.00 0.09 0.00 0.00 57.88 58.08 2jri h LEU 155 Cb 0.16 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.66 2jri h LEU 155 CO -0.03 0.77 -0.25 1.56 0.09 0.00 0.00 178.44 180.58 2jri h GLN 156 N 1.04 0.00 0.07 1.13 4.20 -1.18 -0.66 115.11 119.72 2jri h GLN 156 Ca 0.26 0.00 -0.33 0.00 0.06 0.00 0.00 58.65 58.64 2jri h GLN 156 Cb 0.07 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 27.82 2jri h GLN 156 CO -0.04 0.25 -1.82 1.96 -0.67 0.00 0.00 178.83 178.51 2jri h GLN 157 N 0.00 0.16 -0.02 1.46 4.20 -0.97 -3.36 115.11 116.58 2jri h GLN 157 Ca -0.00 -0.27 -0.12 0.00 0.06 0.00 0.00 58.65 58.32 2jri h GLN 157 Cb 0.52 0.10 -0.02 0.00 0.30 0.00 0.00 27.48 28.38 2jri h GLN 157 CO 0.03 0.91 -0.56 1.49 -0.67 0.00 0.00 178.83 180.04 2jri h GLU 158 N 0.04 0.06 0.00 1.46 4.57 -0.72 -3.47 114.58 116.51 2jri h GLU 158 Ca -0.35 -0.04 0.00 0.00 -1.18 0.00 0.00 59.36 57.80 2jri h GLU 158 Cb 2.02 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 30.62 2jri h GLU 158 CO 0.09 0.60 0.00 0.41 -1.18 0.00 0.00 179.01 178.94 2jri n GLY 159 N 0.10 0.73 0.00 1.92 0.00 -0.69 -5.09 105.19 102.15 2jri n GLY 159 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.00 2jri n GLY 159 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2jri n TYR 160 N 0.00 -1.72 -3.30 1.61 4.02 -0.34 -4.74 117.16 112.69 2jri n TYR 160 Ca 0.00 0.00 -0.20 0.00 -0.01 0.00 0.00 57.90 57.69 2jri n TYR 160 Cb 0.00 0.00 -0.08 0.00 -0.02 0.00 0.00 39.34 39.24 2jri n TYR 160 CO 0.00 0.00 0.00 -1.12 -1.01 0.00 0.00 176.86 174.73 2jri s SER 161 N -1.00 1.09 -0.55 7.72 0.01 0.55 -4.89 113.70 116.64 2jri s SER 161 Ca 0.00 -2.11 -0.28 0.00 1.31 0.00 0.00 55.95 54.87 2jri s SER 161 Cb 0.00 0.34 0.00 0.00 0.21 0.00 0.00 66.02 66.58 2jri s SER 161 CO 0.00 -0.21 1.54 -0.63 0.41 0.00 0.00 173.24 174.35 2jri s ILE 162 N 0.91 3.67 -0.53 1.44 1.01 -1.26 -1.41 121.20 125.03 2jri s ILE 162 Ca 0.23 0.55 -0.15 0.00 0.00 0.00 0.00 60.65 61.29 2jri s ILE 162 Cb -0.09 -4.26 0.13 0.00 0.01 0.00 0.00 42.46 38.24 2jri s ILE 162 CO -0.07 -1.05 0.47 -0.36 0.00 0.00 0.00 174.94 173.93 2jri s PHE 163 N 6.71 3.27 -0.12 3.97 0.08 0.11 -0.80 117.98 131.21 2jri s PHE 163 Ca 0.58 -1.35 -0.16 0.00 0.12 0.00 0.00 56.93 56.11 2jri s PHE 163 Cb -0.12 -3.72 -0.05 0.00 -0.57 0.00 0.00 43.02 38.56 2jri s PHE 163 CO 0.25 -1.00 0.40 0.54 -0.10 0.00 0.00 175.22 175.31 2jri s VAL 164 N 1.57 5.21 -0.20 -0.44 0.11 0.23 -0.82 120.40 126.06 2jri s VAL 164 Ca 0.03 0.79 -0.19 0.00 -2.93 0.00 0.00 61.98 59.69 2jri s VAL 164 Cb -0.29 -3.74 -0.03 0.00 -1.53 0.00 0.00 36.38 30.79 2jri s VAL 164 CO 0.03 0.38 0.56 -0.69 -3.33 0.00 0.00 175.10 172.04 2jri s VAL 165 N 0.34 5.08 -0.12 2.04 1.01 -0.52 -0.40 120.40 127.82 2jri s VAL 165 Ca 0.22 1.03 -0.06 0.00 0.00 0.00 0.00 61.98 63.17 2jri s VAL 165 Cb -0.15 -3.88 -0.04 0.00 0.00 0.00 0.00 36.38 32.32 2jri s VAL 165 CO 0.08 0.15 0.12 -0.54 0.00 0.00 0.00 175.10 174.91 2jri s LYS 166 N 1.74 3.43 0.00 2.72 -0.14 0.54 -4.43 119.74 123.61 2jri s LYS 166 Ca 0.26 -0.18 0.00 0.00 -1.36 0.00 0.00 55.97 54.68 2jri s LYS 166 Cb -0.16 -3.14 0.00 0.00 -1.68 0.00 0.00 37.83 32.85 2jri s LYS 166 CO 0.10 0.72 0.00 0.41 -0.76 0.00 0.00 175.35 175.82 2jri n GLY 167 N 2.15 0.29 3.48 -3.33 0.00 -1.26 -2.67 105.19 103.85 2jri n GLY 167 Ca -0.19 -2.30 -0.37 0.00 0.00 0.00 0.00 46.02 43.15 2jri n GLY 167 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2jri s ASP 168 N -4.00 5.32 0.20 1.61 1.01 -1.26 -4.90 116.67 114.64 2jri s ASP 168 Ca 0.00 -0.16 0.07 0.00 0.71 0.00 0.00 52.55 53.17 2jri s ASP 168 Cb 0.00 -1.96 -0.04 0.00 1.01 0.00 0.00 42.92 41.93 2jri s ASP 168 CO 0.00 -0.03 0.03 -0.76 0.21 0.00 0.00 175.17 174.61 2jri s LEU 169 N 1.63 3.38 0.48 1.23 1.02 -1.26 -4.99 118.68 120.17 2jri s LEU 169 Ca 0.06 -0.40 -0.24 0.00 0.02 0.00 0.00 54.13 53.58 2jri s LEU 169 Cb -0.15 -2.00 -0.08 0.00 0.02 0.00 0.00 46.19 43.98 2jri s LEU 169 CO 0.05 0.06 1.27 -0.81 0.02 0.00 0.00 176.35 176.94 2jri n PRO 170 N -0.36 1.76 -3.94 1.29 -0.04 -1.26 -5.03 135.00 127.42 2jri n PRO 170 Ca -0.09 0.64 -0.26 0.00 -0.04 0.00 0.00 63.50 63.75 2jri n PRO 170 Cb 0.56 -2.43 -0.02 0.00 -0.04 0.00 0.00 33.50 31.58 2jri n PRO 170 CO 0.00 0.00 0.00 0.16 -0.04 0.00 0.00 175.50 175.62 2jri s ASP 171 N -0.72 4.61 0.25 3.54 -4.77 -1.26 -4.75 116.67 113.57 2jri s ASP 171 Ca 0.66 -1.23 0.04 0.00 -3.30 0.00 0.00 52.55 48.72 2jri s ASP 171 Cb -0.47 0.30 -0.02 0.00 -1.09 0.00 0.00 42.92 41.64 2jri s ASP 171 CO 0.54 -1.02 0.16 0.00 0.70 0.00 0.00 175.17 175.55 2jri h GLU 173 N 0.00 0.86 0.00 0.00 4.57 -1.90 -1.60 114.58 116.51 2jri h GLU 173 Ca -0.18 -0.09 -0.01 0.00 -1.18 0.00 0.00 59.36 57.90 2jri h GLU 173 Cb 0.83 -0.18 -0.00 0.00 -0.16 0.00 0.00 28.75 29.24 2jri h GLU 173 CO 0.28 0.64 -0.05 0.00 -1.18 0.00 0.00 179.01 178.70 2jri h ALA 174 N 1.51 1.22 0.02 2.92 0.00 -1.94 0.20 119.26 123.19 2jri h ALA 174 Ca 0.22 -0.04 -0.21 0.00 0.00 0.00 0.00 54.91 54.88 2jri h ALA 174 Cb 0.02 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 2jri h ALA 174 CO -0.04 0.06 -0.96 0.22 0.00 0.00 0.00 179.25 178.53 2jri h ASP 175 N 0.00 0.14 0.32 0.00 1.82 -1.60 -2.67 116.42 114.44 2jri h ASP 175 Ca -0.00 -0.13 -0.33 0.00 -0.39 0.00 0.00 57.03 56.18 2jri h ASP 175 Cb 0.20 -0.05 -0.02 0.00 0.68 0.00 0.00 39.33 40.14 2jri h ASP 175 CO 0.01 1.02 -1.79 1.56 -1.61 0.00 0.00 179.24 178.42 2jri h GLN 176 N 0.04 0.18 0.00 0.28 4.20 -1.16 -2.51 115.11 116.14 2jri h GLN 176 Ca -0.04 -0.31 0.00 0.00 0.06 0.00 0.00 58.65 58.36 2jri h GLN 176 Cb 1.65 0.12 0.00 0.00 0.30 0.00 0.00 27.48 29.55 2jri h GLN 176 CO 0.14 0.97 -0.35 1.37 -0.67 0.00 0.00 178.83 180.29 2jri h LEU 177 N 0.05 0.00 -1.87 1.46 8.10 -0.76 -3.30 115.31 118.99 2jri h LEU 177 Ca -0.34 -0.06 -0.04 0.00 0.11 0.00 0.00 57.88 57.55 2jri h LEU 177 Cb 2.03 0.00 -0.03 0.00 -0.44 0.00 0.00 40.66 42.22 2jri h LEU 177 CO 0.11 0.03 0.05 -0.11 -4.11 0.00 0.00 178.44 174.41 2jri n LEU 178 N -2.51 2.68 0.07 0.17 -0.00 -1.00 -3.72 117.00 112.68 2jri n LEU 178 Ca 0.04 -1.36 0.12 0.00 -0.00 0.00 0.00 56.01 54.80 2jri n LEU 178 Cb 0.48 -0.55 0.12 0.00 -0.00 0.00 0.00 43.42 43.47 2jri n LEU 178 CO 0.35 0.44 0.25 1.56 -0.00 0.00 0.00 177.39 179.99 2jri h GLN 179 N 0.50 0.00 0.00 1.96 1.08 -1.80 -3.36 115.11 113.50 2jri h GLN 179 Ca 0.05 0.00 -0.04 0.00 -1.45 0.00 0.00 58.65 57.21 2jri h GLN 179 Cb 1.03 0.00 -0.08 0.00 -0.05 0.00 0.00 27.48 28.38 2jri h GLN 179 CO 0.14 0.00 -0.47 0.00 -0.95 0.00 0.00 178.83 177.55 2jri n MET 180 N -2.21 0.68 -3.29 1.46 0.00 -1.24 -4.99 117.12 107.53 2jri n MET 180 Ca 0.02 -2.12 -0.39 0.00 0.00 0.00 0.00 57.70 55.21 2jri n MET 180 Cb 0.46 -0.90 -0.07 0.00 0.00 0.00 0.00 33.22 32.71 2jri n MET 180 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 175.97 176.39 2jri s ILE 181 N -1.47 5.13 0.00 3.17 -1.09 -1.26 -5.16 121.20 120.52 2jri s ILE 181 Ca 0.24 0.87 0.00 0.00 -2.23 0.00 0.00 60.65 59.53 2jri s ILE 181 Cb 0.24 -3.81 0.00 0.00 -1.58 0.00 0.00 42.46 37.31 2jri s ILE 181 CO -0.04 0.19 0.00 -1.14 -1.23 0.00 0.00 174.94 172.72