#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 -2.66 2.12 4.71 -1.26 -4.96 120.64 118.59 2jri n GLU 2 Ca 0.00 0.00 -0.42 0.00 -0.01 0.00 0.00 57.16 56.73 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 -0.30 6.57 -0.11 1.62 0.01 -1.26 -4.96 113.70 115.26 2jri s SER 3 Ca 0.00 -1.70 0.01 0.00 1.31 0.00 0.00 55.95 55.57 2jri s SER 3 Cb 0.00 -2.53 -0.01 0.00 0.21 0.00 0.00 66.02 63.69 2jri s SER 3 CO 0.00 -1.36 -0.15 -0.63 0.41 0.00 0.00 173.24 171.51 2jri s ILE 4 N 4.30 2.87 -1.18 1.44 1.01 -1.26 -2.78 121.20 125.60 2jri s ILE 4 Ca 0.43 -0.74 -0.21 0.00 0.00 0.00 0.00 60.65 60.13 2jri s ILE 4 Cb -0.01 -2.17 -0.02 0.00 0.01 0.00 0.00 42.46 40.27 2jri s ILE 4 CO -0.08 0.54 1.83 -0.36 0.00 0.00 0.00 174.94 176.87 2jri s PHE 5 N 0.12 2.27 -0.73 3.97 0.40 -1.26 -4.78 117.98 117.97 2jri s PHE 5 Ca -0.07 -0.34 -0.03 0.00 -0.60 0.00 0.00 56.93 55.88 2jri s PHE 5 Cb -0.15 -4.32 0.16 0.00 0.51 0.00 0.00 43.02 39.22 2jri s PHE 5 CO 0.05 -1.52 2.46 1.58 0.70 0.00 0.00 175.22 178.49 2jri n HIS 6 N 11.85 2.17 -1.66 0.36 -0.00 -1.26 -4.70 115.22 121.98 2jri n HIS 6 Ca 0.45 -2.22 -0.46 0.00 0.46 0.00 0.00 57.72 55.95 2jri n HIS 6 Cb 0.47 -1.39 -0.04 0.00 -0.12 0.00 0.00 29.99 28.91 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 0.60 2.41 -4.96 1.57 -0.58 -1.26 -4.96 120.64 113.45 2jri n GLU 7 Ca 0.52 0.87 -0.32 0.00 -0.42 0.00 0.00 57.16 57.80 2jri n GLU 7 Cb 0.40 -2.83 -0.14 0.00 -0.57 0.00 0.00 31.44 28.31 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 4.48 2.40 0.12 3.49 2.47 -1.26 -4.90 119.74 126.54 2jri s LYS 8 Ca 0.92 -0.76 -0.16 0.00 -1.56 0.00 0.00 55.97 54.42 2jri s LYS 8 Cb -0.57 -2.30 0.03 0.00 -1.46 0.00 0.00 37.83 33.53 2jri s LYS 8 CO 0.47 0.61 0.39 1.14 0.16 0.00 0.00 175.35 178.11 2jri s GLN 9 N -0.75 1.05 -0.02 4.03 0.00 -1.26 -5.13 119.66 117.59 2jri s GLN 9 Ca 0.11 -0.72 -0.05 0.00 -0.00 0.00 0.00 55.36 54.71 2jri s GLN 9 Cb -0.10 0.46 0.00 0.00 0.00 0.00 0.00 33.01 33.37 2jri s GLN 9 CO 0.00 -0.41 0.10 -1.21 0.00 0.00 0.00 175.29 173.78 2jri s GLU 10 N -3.79 0.28 -0.01 9.60 2.02 -1.26 -4.85 118.70 120.69 2jri s GLU 10 Ca 0.03 -0.14 -0.00 0.00 0.02 0.00 0.00 54.97 54.88 2jri s GLU 10 Cb 0.02 0.12 0.00 0.00 0.10 0.00 0.00 34.13 34.37 2jri s GLU 10 CO -0.12 -0.05 0.01 0.41 0.02 0.00 0.00 175.26 175.53 2jri n GLY 11 N 2.29 -1.77 7.00 -1.39 0.00 -1.26 -4.95 105.19 105.11 2jri n GLY 11 Ca -0.17 -0.15 0.00 0.00 0.00 0.00 0.00 46.02 45.69 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 -0.24 -4.25 -2.10 1.61 7.64 -1.26 -4.88 113.62 110.13 2jri n SER 12 Ca 0.00 0.00 -0.18 0.00 1.01 0.00 0.00 58.87 59.71 2jri n SER 12 Cb 0.01 0.00 -0.03 0.00 -1.01 0.00 0.00 64.21 63.17 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 -1.51 0.01 -3.43 7.99 -1.14 -4.82 117.00 114.09 2jri n LEU 13 Ca 0.00 0.19 0.06 0.00 -0.01 0.00 0.00 56.01 56.25 2jri n LEU 13 Cb 0.00 -2.59 0.25 0.00 -0.11 0.00 0.00 43.42 40.98 2jri n LEU 13 CO 0.00 -0.44 0.69 0.00 -1.51 0.00 0.00 177.39 176.13 2jri h ALA 15 N 2.38 1.41 0.00 0.00 0.00 -1.93 -1.13 119.26 119.99 2jri h ALA 15 Ca 0.00 -0.24 -0.05 0.00 0.00 0.00 0.00 54.91 54.62 2jri h ALA 15 Cb 0.20 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 2jri h ALA 15 CO 0.00 0.41 -0.25 0.37 0.00 0.00 0.00 179.25 179.78 2jri h GLN 16 N 0.26 0.00 0.02 0.00 -0.00 -1.85 -2.37 115.11 111.18 2jri h GLN 16 Ca 0.05 0.00 -0.00 0.00 -0.00 0.00 0.00 58.65 58.70 2jri h GLN 16 Cb 0.45 0.00 0.00 0.00 0.00 0.00 0.00 27.48 27.93 2jri h GLN 16 CO 0.03 0.25 -0.01 1.25 0.00 0.00 0.00 178.83 180.34 2jri h HIS 17 N 0.00 -0.03 -0.51 3.99 2.76 -1.37 -1.61 115.15 118.38 2jri h HIS 17 Ca -0.00 -0.00 -0.06 0.00 -2.20 0.00 0.00 60.37 58.11 2jri h HIS 17 Cb 0.76 0.01 -0.02 0.00 1.55 0.00 0.00 27.41 29.71 2jri h HIS 17 CO 0.00 0.70 0.07 0.00 -1.30 0.00 0.00 177.93 177.40 2jri h LEU 19 N 0.77 -0.34 -1.49 0.00 5.85 -1.51 -2.52 115.31 116.07 2jri h LEU 19 Ca 0.16 -0.08 -0.05 0.00 0.84 0.00 0.00 57.88 58.75 2jri h LEU 19 Cb 0.36 0.09 -0.01 0.00 0.37 0.00 0.00 40.66 41.47 2jri h LEU 19 CO 0.01 0.14 -0.25 0.78 -0.34 0.00 0.00 178.44 178.77 2jri h ASN 20 N -1.06 0.00 0.17 1.25 4.21 -1.34 0.21 115.58 119.02 2jri h ASN 20 Ca -0.04 0.00 -0.29 0.00 1.21 0.00 0.00 56.30 57.18 2jri h ASN 20 Cb 0.40 0.00 0.03 0.00 -1.12 0.00 0.00 38.32 37.63 2jri h ASN 20 CO 0.07 0.25 -1.23 0.78 -1.29 0.00 0.00 177.43 176.01 2jri h ASN 21 N 0.00 0.79 -0.06 5.81 -0.26 -1.22 -0.31 115.58 120.33 2jri h ASN 21 Ca -0.00 -0.88 -0.10 0.00 -0.56 0.00 0.00 56.30 54.76 2jri h ASN 21 Cb 0.46 -0.25 0.00 0.00 -1.06 0.00 0.00 38.32 37.47 2jri h ASN 21 CO 0.03 1.60 -0.34 0.25 -1.06 0.00 0.00 177.43 177.91 2jri h LEU 22 N 0.10 0.41 0.00 1.61 7.12 -1.30 -3.19 115.31 120.06 2jri h LEU 22 Ca -0.20 -0.66 0.00 0.00 0.13 0.00 0.00 57.88 57.15 2jri h LEU 22 Cb 1.94 -0.12 0.00 0.00 -0.53 0.00 0.00 40.66 41.95 2jri h LEU 22 CO 0.23 1.01 -0.05 -0.07 -0.13 0.00 0.00 178.44 179.43 2jri h LEU 23 N -0.16 0.00 -1.52 2.25 3.38 -1.09 -3.48 115.31 114.69 2jri h LEU 23 Ca -0.03 -0.02 -0.34 0.00 0.09 0.00 0.00 57.88 57.59 2jri h LEU 23 Cb 1.00 0.00 0.16 0.00 0.09 0.00 0.00 40.66 41.92 2jri h LEU 23 CO 0.07 0.01 -0.75 0.00 0.09 0.00 0.00 178.44 177.86 2jri n GLN 24 N -2.30 -6.82 0.00 1.13 1.13 -0.19 -4.67 117.38 105.65 2jri n GLN 24 Ca 0.05 0.84 0.00 0.00 -1.94 0.00 0.00 57.00 55.95 2jri n GLN 24 Cb 0.44 -5.85 0.00 0.00 0.11 0.00 0.00 30.24 24.93 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 -1.28 2.78 3.56 1.08 0.00 -0.81 -4.71 105.19 105.83 2jri n GLY 25 Ca -0.24 -0.67 -0.42 0.00 0.00 0.00 0.00 46.02 44.68 2jri n GLY 25 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2jri s GLU 26 N -2.00 3.47 0.00 1.61 8.01 -1.26 -4.34 118.70 124.18 2jri s GLU 26 Ca 0.00 0.10 0.10 0.00 0.01 0.00 0.00 54.97 55.19 2jri s GLU 26 Cb 0.00 -4.02 0.10 0.00 -4.31 0.00 0.00 34.13 25.90 2jri s GLU 26 CO 0.00 -1.61 0.87 0.66 0.01 0.00 0.00 175.26 175.19 2jri n TYR 27 N 8.11 0.04 -3.46 1.61 4.01 -1.26 -5.01 117.16 121.20 2jri n TYR 27 Ca 0.07 -0.05 -0.12 0.00 -0.16 0.00 0.00 57.90 57.64 2jri n TYR 27 Cb 0.49 -0.00 -0.03 0.00 -0.31 0.00 0.00 39.34 39.49 2jri n TYR 27 CO 0.00 0.00 0.00 -0.06 -0.46 0.00 0.00 176.86 176.34 2jri s PHE 28 N -0.88 -0.50 0.26 -0.72 0.08 -1.26 -5.15 117.98 109.81 2jri s PHE 28 Ca 0.13 0.41 0.09 0.00 0.12 0.00 0.00 56.93 57.68 2jri s PHE 28 Cb 0.09 0.53 -0.04 0.00 -0.57 0.00 0.00 43.02 43.03 2jri s PHE 28 CO 0.13 -0.73 0.01 -1.12 -0.10 0.00 0.00 175.22 173.41 2jri s SER 29 N -2.44 4.62 0.37 1.36 0.01 -1.26 -4.97 113.70 111.39 2jri s SER 29 Ca 0.00 -0.61 0.17 0.00 1.31 0.00 0.00 55.95 56.83 2jri s SER 29 Cb -0.01 -0.89 1.11 0.00 0.21 0.00 0.00 66.02 66.44 2jri s SER 29 CO -0.09 0.00 1.70 -0.65 0.41 0.00 0.00 173.24 174.61 2jri h PRO 30 N 1.91 0.35 -0.57 12.44 0.11 -2.00 0.24 132.00 144.48 2jri h PRO 30 Ca -0.45 -0.02 -0.06 0.00 0.11 0.00 0.00 66.00 65.59 2jri h PRO 30 Cb 1.25 -0.08 -0.03 0.00 0.11 0.00 0.00 31.00 32.25 2jri h PRO 30 CO 0.60 0.23 0.13 -0.24 -0.21 0.00 0.00 178.00 178.51 2jri h VAL 31 N 0.36 1.24 0.03 3.15 3.04 -2.00 -2.10 116.25 119.96 2jri h VAL 31 Ca 0.69 -0.86 -0.23 0.00 -1.01 0.00 0.00 66.70 65.29 2jri h VAL 31 Cb 1.69 0.66 -0.02 0.00 -2.01 0.00 0.00 31.29 31.60 2jri h VAL 31 CO -0.47 0.32 -1.08 -0.33 -1.01 0.00 0.00 177.57 175.00 2jri h GLU 32 N 0.85 0.06 -0.19 4.17 3.07 -1.06 -3.18 114.58 118.30 2jri h GLU 32 Ca 0.18 -0.10 -0.04 0.00 -0.50 0.00 0.00 59.36 58.90 2jri h GLU 32 Cb 0.32 0.04 -0.01 0.00 -0.84 0.00 0.00 28.75 28.26 2jri h GLU 32 CO 0.00 1.03 -0.05 -0.07 -1.40 0.00 0.00 179.01 178.53 2jri h LEU 33 N 0.02 0.26 0.00 1.33 3.38 -0.38 0.10 115.31 120.01 2jri h LEU 33 Ca -0.05 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 57.88 2jri h LEU 33 Cb 1.82 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 42.51 2jri h LEU 33 CO 0.14 0.35 -0.02 0.77 0.09 0.00 0.00 178.44 179.78 2jri h SER 34 N 0.27 0.00 0.40 -0.43 4.64 -1.42 -3.24 113.55 113.77 2jri h SER 34 Ca 0.06 -0.00 -0.31 0.00 -0.47 0.00 0.00 61.79 61.06 2jri h SER 34 Cb 0.27 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.33 2jri h SER 34 CO 0.01 0.00 -1.70 0.28 -0.87 0.00 0.00 176.83 174.55 2jri h SER 35 N 0.00 0.25 0.62 4.97 0.02 -1.03 -3.31 113.55 115.06 2jri h SER 35 Ca 0.00 -0.45 -0.01 0.00 -0.84 0.00 0.00 61.79 60.49 2jri h SER 35 Cb 0.84 -0.08 -0.00 0.00 0.14 0.00 0.00 62.40 63.30 2jri h SER 35 CO 0.00 1.39 -0.05 0.16 -1.14 0.00 0.00 176.83 177.19 2jri h ILE 36 N 0.04 0.19 -0.01 3.27 3.07 -0.91 -1.66 117.51 121.50 2jri h ILE 36 Ca -0.30 -0.46 -0.16 0.00 1.55 0.00 0.00 64.86 65.49 2jri h ILE 36 Cb 2.01 1.38 -0.02 0.00 -0.27 0.00 0.00 36.82 39.92 2jri h ILE 36 CO 0.11 0.05 -0.74 0.00 -1.05 0.00 0.00 178.15 176.52 2jri h ALA 37 N 1.95 0.74 0.00 0.16 0.00 -1.65 -2.94 119.26 117.53 2jri h ALA 37 Ca -0.00 -0.65 0.00 0.00 0.00 0.00 0.00 54.91 54.26 2jri h ALA 37 Cb 0.37 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.07 2jri h ALA 37 CO 0.01 0.87 0.00 1.58 0.00 0.00 0.00 179.25 181.71 2jri n HIS 38 N -3.71 0.86 0.28 0.00 -0.00 -0.63 -2.31 115.22 109.70 2jri n HIS 38 Ca -0.02 0.31 0.16 0.00 -0.00 0.00 0.00 57.72 58.16 2jri n HIS 38 Cb 0.71 -1.00 0.83 0.00 -0.00 0.00 0.00 29.99 30.54 2jri n HIS 38 CO 0.00 0.00 0.00 0.37 -0.00 0.00 0.00 176.34 176.71 2jri h GLN 39 N 0.00 0.00 -0.04 1.57 5.75 -1.47 -0.84 115.11 120.08 2jri h GLN 39 Ca 0.00 0.00 -0.15 0.00 -0.15 0.00 0.00 58.65 58.35 2jri h GLN 39 Cb 0.49 0.00 -0.01 0.00 1.07 0.00 0.00 27.48 29.02 2jri h GLN 39 CO 0.00 0.07 -0.67 -0.07 -2.65 0.00 0.00 178.83 175.51 2jri h LEU 40 N 0.00 0.19 -0.91 -2.39 -0.00 -1.61 -2.92 115.31 107.67 2jri h LEU 40 Ca -0.00 -0.12 -0.04 0.00 -0.00 0.00 0.00 57.88 57.72 2jri h LEU 40 Cb 0.29 -0.06 -0.04 0.00 -0.00 0.00 0.00 40.66 40.85 2jri h LEU 40 CO 0.01 0.80 0.34 -0.78 -0.00 0.00 0.00 178.44 178.81 2jri h ASP 41 N 0.12 1.03 -0.58 -0.43 1.82 0.41 0.38 116.42 119.18 2jri h ASP 41 Ca -0.01 -0.14 -0.03 0.00 -0.39 0.00 0.00 57.03 56.46 2jri h ASP 41 Cb 1.19 -0.27 -0.03 0.00 0.68 0.00 0.00 39.33 40.91 2jri h ASP 41 CO 0.10 0.89 0.27 -0.08 -1.61 0.00 0.00 179.24 178.81 2jri h GLU 42 N 1.11 0.87 -0.08 0.28 4.57 -1.42 -1.24 114.58 118.68 2jri h GLU 42 Ca 0.26 -0.12 -0.21 0.00 -1.18 0.00 0.00 59.36 58.11 2jri h GLU 42 Cb 0.16 -0.16 0.00 0.00 -0.16 0.00 0.00 28.75 28.59 2jri h GLU 42 CO -0.03 0.69 -0.80 0.93 -1.18 0.00 0.00 179.01 178.62 2jri h GLU 43 N 0.87 0.52 -0.50 1.92 5.08 -1.09 -3.12 114.58 118.27 2jri h GLU 43 Ca 0.21 -0.46 -0.02 0.00 -1.00 0.00 0.00 59.36 58.10 2jri h GLU 43 Cb 0.12 0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.46 2jri h GLU 43 CO -0.02 1.09 0.25 0.93 -1.00 0.00 0.00 179.01 180.25 2jri h GLU 44 N 0.34 0.69 -0.52 2.33 4.39 0.43 -0.73 114.58 121.51 2jri h GLU 44 Ca -0.05 -0.08 -0.02 0.00 0.34 0.00 0.00 59.36 59.55 2jri h GLU 44 Cb 1.41 -0.14 -0.03 0.00 -0.10 0.00 0.00 28.75 29.89 2jri h GLU 44 CO 0.15 0.53 0.24 -0.09 -1.16 0.00 0.00 179.01 178.67 2jri h ARG 45 N 0.69 0.73 -0.32 2.33 2.43 -1.19 -1.44 114.38 117.61 2jri h ARG 45 Ca 0.17 -0.09 -0.13 0.00 -0.81 0.00 0.00 59.98 59.12 2jri h ARG 45 Cb 0.06 -0.14 -0.01 0.00 -0.42 0.00 0.00 29.97 29.46 2jri h ARG 45 CO -0.02 0.58 -0.34 0.52 -1.51 0.00 0.00 179.97 179.20 2jri h MET 46 N 0.73 0.72 -0.77 0.20 2.86 -1.16 -2.15 114.93 115.36 2jri h MET 46 Ca 0.18 -0.34 -0.02 0.00 -2.06 0.00 0.00 59.70 57.46 2jri h MET 46 Cb 0.10 -0.01 -0.04 0.00 0.06 0.00 0.00 31.60 31.72 2jri h MET 46 CO -0.02 0.95 0.41 -0.09 1.06 0.00 0.00 176.91 179.22 2jri h ARG 47 N 0.60 1.08 -0.41 1.72 2.43 -0.47 -1.91 114.38 117.43 2jri h ARG 47 Ca 0.06 -0.13 -0.09 0.00 -0.81 0.00 0.00 59.98 59.01 2jri h ARG 47 Cb 0.86 -0.21 -0.02 0.00 -0.42 0.00 0.00 29.97 30.18 2jri h ARG 47 CO 0.07 0.81 -0.13 0.52 -1.51 0.00 0.00 179.97 179.74 2jri h MET 48 N 1.07 0.74 0.00 0.20 2.86 -1.09 -2.18 114.93 116.52 2jri h MET 48 Ca 0.27 -0.25 -0.05 0.00 -2.06 0.00 0.00 59.70 57.61 2jri h MET 48 Cb 0.05 -0.06 -0.01 0.00 0.06 0.00 0.00 31.60 31.64 2jri h MET 48 CO -0.04 0.84 -0.25 0.00 1.06 0.00 0.00 176.91 178.51 2jri h ALA 49 N 1.19 1.50 -0.49 6.32 0.00 -0.85 -1.40 119.26 125.54 2jri h ALA 49 Ca 0.11 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.79 2jri h ALA 49 Cb 0.60 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.35 2jri h ALA 49 CO 0.04 0.31 0.00 0.39 0.00 0.00 0.00 179.25 179.99 2jri n GLU 50 N -4.12 2.20 0.00 0.00 -0.58 -0.77 -4.88 120.64 112.49 2jri n GLU 50 Ca -0.02 -1.85 0.00 0.00 -0.42 0.00 0.00 57.16 54.87 2jri n GLU 50 Cb 0.31 -1.41 0.00 0.00 -0.57 0.00 0.00 31.44 29.77 2jri n GLU 50 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2jri n GLY 51 N 1.33 0.40 3.56 0.62 0.00 -0.56 -5.05 105.19 105.49 2jri n GLY 51 Ca 0.18 0.30 -0.36 0.00 0.00 0.00 0.00 46.02 46.14 2jri n GLY 51 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2jri s GLY 52 N 0.00 0.60 0.00 -0.02 0.00 -1.03 -4.75 107.32 102.12 2jri s GLY 52 Ca 0.00 -1.50 0.27 0.00 0.00 0.00 0.00 44.72 43.49 2jri s GLY 52 CO 0.00 3.11 1.57 3.33 0.00 0.00 0.00 173.10 181.11 2jri n VAL 53 N 7.20 0.00 -1.85 1.40 0.24 -1.20 -4.22 118.33 119.89 2jri n VAL 53 Ca 0.27 -0.30 -0.34 0.00 -2.04 0.00 0.00 64.34 61.93 2jri n VAL 53 Cb 0.50 0.77 0.04 0.00 -1.47 0.00 0.00 33.84 33.68 2jri n VAL 53 CO 0.00 0.00 0.00 0.42 -2.14 0.00 0.00 176.83 175.11 2jri s THR 54 N -2.09 2.95 0.13 3.34 -4.23 -1.26 -4.79 115.64 109.70 2jri s THR 54 Ca 0.33 0.50 -0.20 0.00 -1.18 0.00 0.00 61.69 61.14 2jri s THR 54 Cb 0.20 -3.08 -0.03 0.00 1.34 0.00 0.00 72.50 70.93 2jri s THR 54 CO 0.36 -0.22 1.71 0.28 -0.54 0.00 0.00 174.62 176.22 2jri h SER 55 N 0.37 -0.13 -0.93 3.99 0.02 -1.95 0.25 113.55 115.16 2jri h SER 55 Ca -0.48 0.05 0.03 0.00 -0.84 0.00 0.00 61.79 60.55 2jri h SER 55 Cb 1.27 0.10 -0.05 0.00 0.14 0.00 0.00 62.40 63.86 2jri h SER 55 CO 0.54 -0.04 0.61 -0.33 -1.14 0.00 0.00 176.83 176.47 2jri h GLU 56 N 0.03 1.15 -0.24 3.45 5.08 -1.98 -2.43 114.58 119.65 2jri h GLU 56 Ca 0.10 -0.07 -0.09 0.00 -1.00 0.00 0.00 59.36 58.29 2jri h GLU 56 Cb 0.14 -0.26 -0.00 0.00 0.50 0.00 0.00 28.75 29.12 2jri h GLU 56 CO -0.19 0.76 -0.21 -0.44 -1.00 0.00 0.00 179.01 177.93 2jri h ASP 57 N 1.19 0.61 0.00 1.42 5.19 -1.75 -1.28 116.42 121.79 2jri h ASP 57 Ca 0.36 -0.46 0.00 0.00 -0.62 0.00 0.00 57.03 56.31 2jri h ASP 57 Cb -0.03 -0.17 0.00 0.00 0.18 0.00 0.00 39.33 39.31 2jri h ASP 57 CO -0.11 0.94 0.00 -1.22 -3.12 0.00 0.00 179.24 175.73 2jri n TYR 58 N -4.39 0.00 0.05 4.55 4.01 0.83 -2.02 117.16 120.20 2jri n TYR 58 Ca -0.04 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.70 2jri n TYR 58 Cb 0.42 -0.02 0.00 0.00 -0.31 0.00 0.00 39.34 39.42 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 -0.30 0.00 -0.03 -0.72 5.12 -0.95 -4.50 116.66 115.26 2jri n ARG 59 Ca 0.00 0.00 -0.12 0.00 -1.93 0.00 0.00 57.85 55.80 2jri n ARG 59 Cb 0.06 -0.38 -0.07 0.00 -1.16 0.00 0.00 32.46 30.91 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 1.26 0.00 0.55 1.35 -1.28 -2.35 112.91 112.44 2jri h THR 60 Ca 0.00 -0.84 0.00 0.00 -0.55 0.00 0.00 66.41 65.02 2jri h THR 60 Cb 0.24 1.61 0.00 0.00 -1.73 0.00 0.00 68.15 68.26 2jri h THR 60 CO 0.00 0.24 -0.05 0.49 -0.25 0.00 0.00 175.52 175.96 2jri n PHE 61 N -4.79 0.04 0.24 4.73 3.72 -0.86 -2.62 117.46 117.92 2jri n PHE 61 Ca -0.06 0.01 0.12 0.00 -0.05 0.00 0.00 57.45 57.47 2jri n PHE 61 Cb 0.21 -0.50 0.11 0.00 -0.94 0.00 0.00 39.48 38.36 2jri n PHE 61 CO 0.00 0.00 0.00 1.25 -0.05 0.00 0.00 176.76 177.96 2jri h LEU 62 N 0.00 0.00 -3.51 4.37 5.85 -1.59 -3.17 115.31 117.26 2jri h LEU 62 Ca 0.00 -0.03 -0.10 0.00 0.84 0.00 0.00 57.88 58.59 2jri h LEU 62 Cb 0.51 0.00 -0.06 0.00 0.37 0.00 0.00 40.66 41.48 2jri h LEU 62 CO 0.00 0.02 0.10 1.67 -0.34 0.00 0.00 178.44 179.88 2jri n GLN 63 N -2.71 3.49 -1.67 1.25 7.27 -0.90 -4.85 117.38 119.26 2jri n GLN 63 Ca 0.02 -3.04 -0.48 0.00 0.07 0.00 0.00 57.00 53.57 2jri n GLN 63 Cb 0.52 -2.07 -0.05 0.00 2.41 0.00 0.00 30.24 31.06 2jri n GLN 63 CO 0.00 0.00 0.00 0.94 0.07 0.00 0.00 177.06 178.07 2jri n GLN 64 N -0.23 2.05 -1.78 3.69 -0.06 -1.20 -4.88 117.38 114.97 2jri n GLN 64 Ca 0.31 0.74 -0.39 0.00 -2.00 0.00 0.00 57.00 55.67 2jri n GLN 64 Cb 1.16 -2.53 0.03 0.00 -4.06 0.00 0.00 30.24 24.84 2jri n GLN 64 CO 0.00 0.00 0.00 -1.25 -0.20 0.00 0.00 177.06 175.61 2jri s PRO 65 N 2.04 3.43 0.00 3.69 0.04 -1.26 -2.12 135.00 140.82 2jri s PRO 65 Ca 0.85 2.35 0.00 0.00 0.04 0.00 0.00 61.00 64.24 2jri s PRO 65 Cb -0.72 -2.48 0.00 0.00 0.04 0.00 0.00 34.50 31.34 2jri s PRO 65 CO 0.44 -1.00 0.00 0.43 0.04 0.00 0.00 177.00 176.91 2jri n SER 66 N -0.57 0.00 0.13 6.66 7.64 -1.26 -4.67 113.62 121.54 2jri n SER 66 Ca 0.07 0.00 -0.21 0.00 1.01 0.00 0.00 58.87 59.74 2jri n SER 66 Cb 0.43 0.00 -0.15 0.00 -1.01 0.00 0.00 64.21 63.48 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 0.50 1.02 0.23 0.00 -1.71 -3.33 103.07 99.78 2jri h GLY 67 Ca 0.00 -1.27 -0.23 0.00 0.00 0.00 0.00 47.33 45.83 2jri h GLY 67 CO 0.00 1.11 -0.92 3.43 0.00 0.00 0.00 176.54 180.16 2jri h ASN 68 N 0.12 0.74 0.00 0.19 -0.26 -1.73 -0.55 115.58 114.10 2jri h ASN 68 Ca -0.21 -0.78 0.00 0.00 -0.56 0.00 0.00 56.30 54.74 2jri h ASN 68 Cb 2.10 -0.23 0.00 0.00 -1.06 0.00 0.00 38.32 39.13 2jri h ASN 68 CO 0.25 1.44 0.00 0.80 -1.06 0.00 0.00 177.43 178.85 2jri n MET 69 N -3.99 0.00 0.00 0.81 0.00 -1.25 -3.63 117.12 109.06 2jri n MET 69 Ca -0.12 0.00 0.00 0.00 0.00 0.00 0.00 57.70 57.58 2jri n MET 69 Cb 0.83 0.00 0.00 0.00 0.00 0.00 0.00 33.22 34.05 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 -0.58 0.95 0.03 6.12 2.03 -1.26 -4.29 116.55 119.55 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 -0.03 0.00 1.67 -0.08 -1.26 -4.55 116.55 112.30 2jri n ASP 71 Ca 0.00 0.12 0.00 0.00 -1.51 0.00 0.00 54.79 53.40 2jri n ASP 71 Cb 0.00 0.09 0.00 0.00 2.34 0.00 0.00 41.12 43.55 2jri n ASP 71 CO 0.00 0.00 0.00 -1.20 0.12 0.00 0.00 177.20 176.12 2jri n SER 72 N -2.76 0.25 -0.43 1.67 7.64 -1.26 -4.96 113.62 113.77 2jri n SER 72 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 2jri n SER 72 Cb 0.02 0.00 0.01 0.00 -1.01 0.00 0.00 64.21 63.23 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 1.00 2.97 0.23 0.00 -1.26 -4.81 105.19 108.32 2jri n GLY 73 Ca 0.00 -0.03 -0.18 0.00 0.00 0.00 0.00 46.02 45.81 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 -0.08 -3.20 -3.71 1.61 3.72 -1.26 -2.89 117.46 111.65 2jri n PHE 74 Ca 0.01 -1.27 -0.14 0.00 -0.05 0.00 0.00 57.45 56.00 2jri n PHE 74 Cb 0.22 -0.60 -0.14 0.00 -0.94 0.00 0.00 39.48 38.02 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 -2.47 -0.26 0.83 1.38 0.08 -1.26 -4.80 117.98 111.48 2jri s PHE 75 Ca 0.52 0.69 -0.11 0.00 0.12 0.00 0.00 56.93 58.15 2jri s PHE 75 Cb -0.03 -0.08 0.09 0.00 -0.57 0.00 0.00 43.02 42.43 2jri s PHE 75 CO 0.35 -0.25 1.09 -1.12 -0.10 0.00 0.00 175.22 175.19 2jri s SER 76 N 1.69 4.08 0.55 1.36 0.01 -1.26 -4.92 113.70 115.21 2jri s SER 76 Ca -0.04 1.59 0.37 0.00 1.31 0.00 0.00 55.95 59.17 2jri s SER 76 Cb -0.11 -2.30 1.84 0.00 0.21 0.00 0.00 66.02 65.66 2jri s SER 76 CO -0.07 -2.27 2.11 -0.29 0.41 0.00 0.00 173.24 173.12 2jri h ILE 77 N -1.29 0.00 -0.18 1.44 2.10 -1.96 -2.67 117.51 114.94 2jri h ILE 77 Ca -0.47 -0.16 0.05 0.00 1.08 0.00 0.00 64.86 65.37 2jri h ILE 77 Cb 1.26 1.06 -0.01 0.00 -1.09 0.00 0.00 36.82 38.04 2jri h ILE 77 CO 0.54 0.00 0.17 1.56 -1.08 0.00 0.00 178.15 179.34 2jri h GLN 78 N 0.00 0.00 0.00 2.19 7.50 -1.91 -0.07 115.11 122.82 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 0.17 0.00 -0.00 0.00 0.05 0.00 0.00 27.48 27.70 2jri h GLN 78 CO 0.00 0.00 -0.02 -0.39 -1.50 0.00 0.00 178.83 176.92 2jri h VAL 79 N 0.00 0.05 0.23 -0.54 -1.51 -1.82 -2.76 116.25 109.90 2jri h VAL 79 Ca 0.09 -0.68 -0.01 0.00 -1.23 0.00 0.00 66.70 64.86 2jri h VAL 79 Cb 0.42 1.65 0.00 0.00 -2.13 0.00 0.00 31.29 31.23 2jri h VAL 79 CO -0.00 0.02 -0.11 0.40 -1.23 0.00 0.00 177.57 176.65 2jri h ILE 80 N 0.00 0.00 -0.04 7.19 1.08 -1.22 -1.88 117.51 122.65 2jri h ILE 80 Ca -0.00 -0.74 -0.01 0.00 -0.39 0.00 0.00 64.86 63.72 2jri h ILE 80 Cb 0.65 0.00 -0.00 0.00 -3.07 0.00 0.00 36.82 34.39 2jri h ILE 80 CO 0.00 0.00 -0.01 0.28 -0.69 0.00 0.00 178.15 177.73 2jri h SER 81 N -1.05 0.05 0.24 1.72 0.02 -1.64 -2.85 113.55 110.05 2jri h SER 81 Ca -0.03 -0.00 -0.34 0.00 -0.84 0.00 0.00 61.79 60.57 2jri h SER 81 Cb 0.24 -0.01 0.03 0.00 0.14 0.00 0.00 62.40 62.79 2jri h SER 81 CO 0.05 0.07 -1.59 -1.13 -1.14 0.00 0.00 176.83 173.10 2jri h ASN 82 N 0.06 0.77 -0.43 3.07 -1.24 -1.59 -3.02 115.58 113.19 2jri h ASN 82 Ca 0.02 -0.92 0.06 0.00 0.71 0.00 0.00 56.30 56.16 2jri h ASN 82 Cb 0.06 -0.25 -0.05 0.00 0.73 0.00 0.00 38.32 38.81 2jri h ASN 82 CO 0.00 1.74 0.14 0.00 -1.29 0.00 0.00 177.43 178.02 2jri h ALA 83 N 0.14 0.50 -0.17 1.57 0.00 -1.10 0.41 119.26 120.62 2jri h ALA 83 Ca -0.29 0.06 -0.18 0.00 0.00 0.00 0.00 54.91 54.50 2jri h ALA 83 Cb 2.15 0.05 -0.00 0.00 0.00 0.00 0.00 17.79 19.98 2jri h ALA 83 CO 0.24 -0.26 -0.63 -0.07 0.00 0.00 0.00 179.25 178.53 2jri h LEU 84 N 0.29 0.69 0.04 0.00 -0.00 -1.69 -2.87 115.31 111.79 2jri h LEU 84 Ca 0.20 -0.41 -0.00 0.00 -0.00 0.00 0.00 57.88 57.67 2jri h LEU 84 Cb 0.20 -0.20 0.00 0.00 -0.00 0.00 0.00 40.66 40.66 2jri h LEU 84 CO -0.22 1.15 -0.02 0.50 -0.00 0.00 0.00 178.44 179.86 2jri h LYS 85 N 0.45 -0.05 0.00 1.13 3.64 -1.27 0.13 116.57 120.59 2jri h LYS 85 Ca -0.01 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.37 2jri h LYS 85 Cb 1.21 0.01 0.00 0.00 -0.41 0.00 0.00 32.23 33.04 2jri h LYS 85 CO 0.12 0.05 0.00 -0.39 -2.27 0.00 0.00 179.45 176.96 2jri h VAL 86 N -0.14 0.00 -0.00 2.00 -1.51 -0.99 -1.04 116.25 114.56 2jri h VAL 86 Ca -0.01 -0.36 0.00 0.00 -1.23 0.00 0.00 66.70 65.11 2jri h VAL 86 Cb 0.13 1.33 0.00 0.00 -2.13 0.00 0.00 31.29 30.62 2jri h VAL 86 CO 0.01 0.00 -0.08 1.87 -1.23 0.00 0.00 177.57 178.14 2jri n TRP 87 N -3.03 0.00 -0.14 5.19 -0.00 -0.89 -4.88 117.44 113.68 2jri n TRP 87 Ca -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.50 57.50 2jri n TRP 87 Cb 0.24 -0.21 0.00 0.00 -0.00 0.00 0.00 31.31 31.33 2jri n TRP 87 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 177.69 178.10 2jri n GLY 88 N 1.28 0.78 3.97 5.87 0.00 -0.39 -5.07 105.19 111.62 2jri n GLY 88 Ca 0.14 0.00 -0.21 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 3.21 0.03 0.99 2.01 0.40 -4.94 118.68 120.39 2jri s LEU 89 Ca 0.00 -0.81 0.04 0.00 0.01 0.00 0.00 54.13 53.37 2jri s LEU 89 Cb 0.00 -1.86 -0.02 0.00 0.01 0.00 0.00 46.19 44.32 2jri s LEU 89 CO 0.00 -1.01 -0.12 -0.70 1.01 0.00 0.00 176.35 175.52 2jri s GLU 90 N -4.40 0.84 -0.16 1.70 2.12 -0.98 -3.56 118.70 114.26 2jri s GLU 90 Ca 0.52 -0.70 -0.02 0.00 0.36 0.00 0.00 54.97 55.12 2jri s GLU 90 Cb -0.05 -0.81 -0.02 0.00 0.26 0.00 0.00 34.13 33.51 2jri s GLU 90 CO 0.32 0.20 -0.08 -1.17 -0.54 0.00 0.00 175.26 173.98 2jri s LEU 91 N -1.10 2.89 -0.10 2.70 2.96 -1.26 -0.38 118.68 124.39 2jri s LEU 91 Ca 0.00 -0.30 0.03 0.00 -0.22 0.00 0.00 54.13 53.64 2jri s LEU 91 Cb -0.08 -1.69 0.01 0.00 0.50 0.00 0.00 46.19 44.94 2jri s LEU 91 CO 0.01 0.11 -0.18 -0.63 -1.32 0.00 0.00 176.35 174.34 2jri s ILE 92 N 0.67 1.67 -1.01 6.68 -1.09 0.38 -4.95 121.20 123.55 2jri s ILE 92 Ca -0.05 -0.77 -0.22 0.00 -2.23 0.00 0.00 60.65 57.38 2jri s ILE 92 Cb -0.15 -1.48 0.07 0.00 -1.58 0.00 0.00 42.46 39.31 2jri s ILE 92 CO 0.02 0.47 1.39 -0.22 -1.23 0.00 0.00 174.94 175.38 2jri s LEU 93 N 0.66 3.81 0.45 2.97 2.96 -1.26 0.16 118.68 128.43 2jri s LEU 93 Ca -0.13 -1.58 0.31 0.00 -0.22 0.00 0.00 54.13 52.51 2jri s LEU 93 Cb -0.16 -2.54 1.48 0.00 0.50 0.00 0.00 46.19 45.47 2jri s LEU 93 CO 0.03 -1.42 1.94 0.15 -1.32 0.00 0.00 176.35 175.74 2jri h PHE 94 N 9.57 0.00 0.00 5.38 3.57 -0.92 -1.70 116.94 132.84 2jri h PHE 94 Ca 0.20 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.70 2jri h PHE 94 Cb 1.01 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.75 2jri h PHE 94 CO 1.26 0.00 0.00 -0.97 -2.23 0.00 0.00 178.31 176.37 2jri h ASN 95 N 0.00 0.00 -3.34 0.41 -1.24 -1.84 -3.33 115.58 106.24 2jri h ASN 95 Ca 0.00 0.00 -0.56 0.00 0.71 0.00 0.00 56.30 56.45 2jri h ASN 95 Cb 0.24 0.00 -0.04 0.00 0.73 0.00 0.00 38.32 39.25 2jri h ASN 95 CO 0.00 0.00 0.04 -0.44 -1.29 0.00 0.00 177.43 175.74 2jri s SER 96 N -4.51 7.10 0.35 1.15 0.01 -0.64 -4.95 113.70 112.22 2jri s SER 96 Ca 0.04 1.31 0.11 0.00 1.31 0.00 0.00 55.95 58.72 2jri s SER 96 Cb 0.09 -2.40 0.89 0.00 0.21 0.00 0.00 66.02 64.81 2jri s SER 96 CO 0.43 0.16 1.81 -0.65 0.41 0.00 0.00 173.24 175.40 2jri h PRO 97 N 5.12 0.60 0.00 12.44 0.11 -1.87 0.18 132.00 148.57 2jri h PRO 97 Ca -0.47 -0.04 -0.01 0.00 0.11 0.00 0.00 66.00 65.60 2jri h PRO 97 Cb 1.21 -0.13 -0.00 0.00 0.11 0.00 0.00 31.00 32.18 2jri h PRO 97 CO 0.67 0.40 -0.03 1.05 -0.21 0.00 0.00 178.00 179.88 2jri h GLU 98 N 0.62 0.00 -0.05 1.05 9.09 -1.93 -2.32 114.58 121.03 2jri h GLU 98 Ca 0.53 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.94 2jri h GLU 98 Cb 1.01 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.11 2jri h GLU 98 CO -0.28 0.03 0.00 0.66 0.05 0.00 0.00 179.01 179.47 2jri n TYR 99 N -3.22 0.06 1.35 2.06 4.01 0.37 -4.52 117.16 117.28 2jri n TYR 99 Ca -0.01 -0.16 0.08 0.00 -0.16 0.00 0.00 57.90 57.65 2jri n TYR 99 Cb 0.20 -0.01 0.32 0.00 -0.31 0.00 0.00 39.34 39.54 2jri n TYR 99 CO 0.00 0.00 0.00 0.94 -0.46 0.00 0.00 176.86 177.34 2jri n GLN 100 N 0.16 1.55 -2.30 -0.72 7.27 0.18 -3.79 117.38 119.74 2jri n GLN 100 Ca 0.04 -0.84 -0.19 0.00 0.07 0.00 0.00 57.00 56.07 2jri n GLN 100 Cb 0.19 -1.31 0.02 0.00 2.41 0.00 0.00 30.24 31.55 2jri n GLN 100 CO 0.00 0.00 0.00 2.89 0.07 0.00 0.00 177.06 180.02 2jri n ARG 101 N 0.10 3.07 0.12 3.69 1.85 -1.25 -4.75 116.66 119.49 2jri n ARG 101 Ca 0.13 -4.05 0.12 0.00 -1.00 0.00 0.00 57.85 53.05 2jri n ARG 101 Cb 0.24 -2.08 0.16 0.00 -1.05 0.00 0.00 32.46 29.73 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 2.38 0.00 2.33 2.89 8.10 -1.90 -3.47 115.31 125.64 2jri h LEU 102 Ca 0.23 -0.06 -0.41 0.00 0.11 0.00 0.00 57.88 57.75 2jri h LEU 102 Cb 1.35 0.00 0.01 0.00 -0.44 0.00 0.00 40.66 41.58 2jri h LEU 102 CO 0.65 0.03 -0.56 0.54 -4.11 0.00 0.00 178.44 174.99 2jri n ARG 103 N -2.56 -2.75 -4.10 0.17 3.00 -1.26 -4.99 116.66 104.17 2jri n ARG 103 Ca 0.03 0.97 -0.29 0.00 -0.01 0.00 0.00 57.85 58.56 2jri n ARG 103 Cb 0.49 -5.71 -0.07 0.00 0.00 0.00 0.00 32.46 27.18 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 -3.08 4.30 -0.13 0.55 1.01 -1.26 -5.10 121.20 117.48 2jri s ILE 104 Ca 0.10 -1.00 -0.15 0.00 0.00 0.00 0.00 60.65 59.60 2jri s ILE 104 Cb -0.04 -3.12 -0.05 0.00 0.01 0.00 0.00 42.46 39.26 2jri s ILE 104 CO 0.12 0.02 0.36 -0.62 0.00 0.00 0.00 174.94 174.82 2jri s ASP 105 N -2.67 6.54 0.47 3.58 2.15 -1.26 -4.98 116.67 120.50 2jri s ASP 105 Ca 0.29 0.64 0.22 0.00 0.43 0.00 0.00 52.55 54.12 2jri s ASP 105 Cb -0.11 -2.22 1.15 0.00 -0.30 0.00 0.00 42.92 41.45 2jri s ASP 105 CO 0.21 0.09 1.97 1.55 -0.17 0.00 0.00 175.17 178.83 2jri h PRO 106 N 6.51 0.00 0.00 4.34 0.13 -1.99 -2.07 132.00 138.92 2jri h PRO 106 Ca -0.42 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.71 2jri h PRO 106 Cb 1.17 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.30 2jri h PRO 106 CO 0.74 0.20 0.00 0.82 -0.23 0.00 0.00 178.00 179.53 2jri h ILE 107 N 0.00 0.00 -0.45 -3.56 2.04 -1.93 -2.82 117.51 110.79 2jri h ILE 107 Ca -0.00 -0.79 0.00 0.00 1.00 0.00 0.00 64.86 65.07 2jri h ILE 107 Cb 0.46 1.78 0.00 0.00 -0.74 0.00 0.00 36.82 38.32 2jri h ILE 107 CO 0.03 0.00 0.00 -3.20 0.00 0.00 0.00 178.15 174.98 2jri n ASN 108 N -2.94 3.83 -3.05 1.72 5.15 -0.78 -4.92 115.26 114.26 2jri n ASN 108 Ca 0.03 -2.43 -0.10 0.00 -0.60 0.00 0.00 54.58 51.49 2jri n ASN 108 Cb 0.46 -0.54 0.05 0.00 -0.53 0.00 0.00 39.78 39.22 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 0.65 0.27 0.00 1.20 -0.58 -1.06 -4.96 120.64 116.16 2jri n GLU 109 Ca 0.19 -1.13 0.00 0.00 -0.42 0.00 0.00 57.16 55.80 2jri n GLU 109 Cb 0.76 -0.29 0.00 0.00 -0.57 0.00 0.00 31.44 31.33 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 -1.80 2.38 -0.52 3.49 0.00 -1.26 -4.97 116.66 113.98 2jri n ARG 110 Ca 0.07 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.92 2jri n ARG 110 Cb 0.25 -0.78 0.00 0.00 -0.00 0.00 0.00 32.46 31.93 2jri n ARG 110 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.63 178.06 2jri n SER 111 N -1.17 0.00 0.00 2.89 7.64 -1.26 -3.37 113.62 118.34 2jri n SER 111 Ca 0.00 -0.46 0.00 0.00 1.01 0.00 0.00 58.87 59.42 2jri n SER 111 Cb 0.18 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.38 2jri n SER 111 CO 0.00 0.00 0.00 2.22 -3.01 0.00 0.00 175.04 174.25 2jri n PHE 112 N 0.00 0.00 0.00 1.43 -1.74 -1.26 -4.20 117.46 111.69 2jri n PHE 112 Ca 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 57.45 56.89 2jri n PHE 112 Cb 0.00 0.00 0.00 0.00 1.52 0.00 0.00 39.48 41.00 2jri n PHE 112 CO 0.00 0.00 0.00 0.44 -0.56 0.00 0.00 176.76 176.64 2jri n ILE 113 N 9.00 0.00 -3.64 1.97 -5.35 -0.45 -4.71 119.36 116.17 2jri n ILE 113 Ca 0.00 0.00 -0.14 0.00 -0.27 0.00 0.00 62.75 62.34 2jri n ILE 113 Cb 0.00 0.00 -0.07 0.00 -1.74 0.00 0.00 39.64 37.83 2jri n ILE 113 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2jri s ASN 115 N 0.39 2.83 -0.28 0.00 2.20 -1.16 -0.67 114.94 118.25 2jri s ASN 115 Ca -0.00 -0.81 0.12 0.00 -0.94 0.00 0.00 52.86 51.23 2jri s ASN 115 Cb -0.05 -0.17 0.47 0.00 -2.00 0.00 0.00 41.25 39.50 2jri s ASN 115 CO 0.01 0.03 1.17 0.00 -2.94 0.00 0.00 177.10 175.37 2jri n TYR 116 N 0.53 2.25 0.00 1.54 9.36 0.18 -1.99 117.16 129.04 2jri n TYR 116 Ca -0.15 -2.17 0.00 0.00 3.32 0.00 0.00 57.90 58.90 2jri n TYR 116 Cb 0.56 -0.31 0.00 0.00 -0.63 0.00 0.00 39.34 38.96 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 -0.68 0.00 -0.02 2.98 4.81 -1.26 -4.34 118.16 119.65 2jri n LYS 117 Ca 0.33 0.00 -0.04 0.00 -0.87 0.00 0.00 58.31 57.72 2jri n LYS 117 Cb 0.92 -0.27 -0.02 0.00 0.02 0.00 0.00 35.03 35.68 2jri n LYS 117 CO 0.00 0.00 0.00 -1.91 1.17 0.00 0.00 177.40 176.66 2jri n GLU 118 N 0.00 0.09 -4.30 1.64 0.00 -1.26 -5.08 120.64 111.73 2jri n GLU 118 Ca 0.00 0.04 -0.23 0.00 0.00 0.00 0.00 57.16 56.97 2jri n GLU 118 Cb 0.00 -0.72 -0.07 0.00 0.00 0.00 0.00 31.44 30.65 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 -2.08 2.66 0.37 4.31 3.76 -1.26 -5.14 115.29 117.91 2jri s HIS 119 Ca -0.06 -0.24 0.04 0.00 -0.15 0.00 0.00 55.06 54.65 2jri s HIS 119 Cb 0.02 -1.20 -0.05 0.00 1.11 0.00 0.00 32.58 32.46 2jri s HIS 119 CO 0.08 0.62 0.07 -1.58 -0.85 0.00 0.00 174.74 173.07 2jri s TRP 120 N -2.35 1.97 -0.22 1.40 0.52 -1.26 -0.65 118.94 118.36 2jri s TRP 120 Ca 0.32 -1.01 -0.01 0.00 0.02 0.00 0.00 56.10 55.41 2jri s TRP 120 Cb -0.06 -1.34 0.06 0.00 -1.15 0.00 0.00 33.47 30.98 2jri s TRP 120 CO 0.20 0.00 0.00 -0.06 0.02 0.00 0.00 176.95 177.11 2jri s PHE 121 N -3.17 1.66 -0.88 -1.98 0.08 0.16 -4.82 117.98 109.03 2jri s PHE 121 Ca 0.30 -1.31 0.09 0.00 0.12 0.00 0.00 56.93 56.13 2jri s PHE 121 Cb 0.07 -1.32 0.43 0.00 -0.57 0.00 0.00 43.02 41.63 2jri s PHE 121 CO 0.14 -0.70 1.21 2.41 -0.10 0.00 0.00 175.22 178.18 2jri n THR 122 N 4.87 1.31 -0.65 0.64 -1.04 -1.25 -3.13 114.28 115.02 2jri n THR 122 Ca -0.10 -0.72 -0.28 0.00 -2.04 0.00 0.00 64.05 60.91 2jri n THR 122 Cb 0.45 -0.25 -0.05 0.00 -1.82 0.00 0.00 70.33 68.67 2jri n THR 122 CO 0.00 0.00 0.00 0.52 -0.64 0.00 0.00 175.07 174.95 2jri n VAL 123 N 0.41 0.00 -4.21 12.58 0.31 -1.26 -4.54 118.33 121.63 2jri n VAL 123 Ca 0.15 0.00 -0.25 0.00 -0.01 0.00 0.00 64.34 64.23 2jri n VAL 123 Cb 0.68 -0.22 -0.07 0.00 -0.91 0.00 0.00 33.84 33.32 2jri n VAL 123 CO 0.00 0.00 0.00 -0.60 -1.32 0.00 0.00 176.83 174.91 2jri s ARG 124 N 2.16 2.49 0.19 5.55 6.06 -0.89 -4.26 118.95 130.26 2jri s ARG 124 Ca 0.51 -1.16 -0.30 0.00 -2.50 0.00 0.00 55.73 52.28 2jri s ARG 124 Cb -0.67 -2.36 -0.08 0.00 0.06 0.00 0.00 34.95 31.90 2jri s ARG 124 CO 0.33 0.43 1.15 0.21 -2.50 0.00 0.00 175.30 174.91 2jri s LYS 125 N -3.28 4.54 -0.48 5.12 2.20 -1.22 -2.98 119.74 123.65 2jri s LYS 125 Ca 0.29 1.81 0.06 0.00 -0.36 0.00 0.00 55.97 57.78 2jri s LYS 125 Cb -0.08 -3.25 0.39 0.00 -1.51 0.00 0.00 37.83 33.38 2jri s LYS 125 CO 0.20 0.00 1.02 1.28 -0.36 0.00 0.00 175.35 177.49 2jri n LEU 126 N 2.30 4.25 0.00 5.43 4.32 0.42 -4.46 117.00 129.26 2jri n LEU 126 Ca 0.03 -5.31 0.00 0.00 -0.02 0.00 0.00 56.01 50.72 2jri n LEU 126 Cb 0.45 -0.39 0.00 0.00 -1.62 0.00 0.00 43.42 41.86 2jri n LEU 126 CO 0.55 2.25 0.00 0.61 -1.22 0.00 0.00 177.39 179.58 2jri n GLY 127 N -0.33 2.44 0.00 -0.72 0.00 -1.26 -3.59 105.19 101.74 2jri n GLY 127 Ca 0.33 -0.56 0.00 0.00 0.00 0.00 0.00 46.02 45.80 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 0.00 -2.34 1.61 0.00 -1.26 -4.87 118.16 111.29 2jri n LYS 128 Ca 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 58.31 58.05 2jri n LYS 128 Cb 0.00 0.00 0.05 0.00 0.00 0.00 0.00 35.03 35.08 2jri n LYS 128 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.40 176.75 2jri s GLN 129 N -0.89 2.56 0.08 1.64 1.11 -1.24 -4.92 119.66 118.01 2jri s GLN 129 Ca 0.00 -0.20 0.08 0.00 0.01 0.00 0.00 55.36 55.25 2jri s GLN 129 Cb 0.00 -2.25 -0.03 0.00 -1.01 0.00 0.00 33.01 29.72 2jri s GLN 129 CO 0.00 -0.94 -0.21 -1.58 0.01 0.00 0.00 175.29 172.58 2jri s TRP 130 N -3.08 1.78 -0.02 0.91 0.52 -1.15 -0.44 118.94 117.47 2jri s TRP 130 Ca 0.57 -0.40 -0.01 0.00 0.02 0.00 0.00 56.10 56.27 2jri s TRP 130 Cb -0.11 -1.01 0.01 0.00 -1.15 0.00 0.00 33.47 31.22 2jri s TRP 130 CO 0.44 0.17 0.05 -0.06 0.02 0.00 0.00 176.95 177.56 2jri s PHE 131 N -1.04 -0.04 0.25 -1.98 0.40 -1.16 -2.14 117.98 112.27 2jri s PHE 131 Ca 0.07 0.14 -0.15 0.00 -0.60 0.00 0.00 56.93 56.39 2jri s PHE 131 Cb -0.10 -0.05 -0.08 0.00 0.51 0.00 0.00 43.02 43.30 2jri s PHE 131 CO 0.03 -0.05 0.66 1.21 0.70 0.00 0.00 175.22 177.77 2jri s ASN 132 N 0.35 6.82 -0.25 1.36 2.47 -1.13 -2.09 114.94 122.47 2jri s ASN 132 Ca -0.03 1.19 -0.04 0.00 0.42 0.00 0.00 52.86 54.41 2jri s ASN 132 Cb -0.04 -2.34 0.09 0.00 -1.45 0.00 0.00 41.25 37.51 2jri s ASN 132 CO -0.01 -0.06 0.11 -0.76 -3.72 0.00 0.00 177.10 172.65 2jri s LEU 133 N -2.52 0.75 -0.03 3.21 1.43 -1.26 -3.14 118.68 117.12 2jri s LEU 133 Ca 0.47 -1.11 -0.11 0.00 -1.03 0.00 0.00 54.13 52.35 2jri s LEU 133 Cb -0.13 -0.40 0.02 0.00 0.03 0.00 0.00 46.19 45.70 2jri s LEU 133 CO 0.19 -0.40 0.24 0.21 0.23 0.00 0.00 176.35 176.82 2jri s ASN 134 N 2.03 -0.14 -0.94 2.29 2.47 -1.26 -3.91 114.94 115.48 2jri s ASN 134 Ca 0.06 0.10 -0.24 0.00 0.42 0.00 0.00 52.86 53.20 2jri s ASN 134 Cb -0.16 0.33 -0.05 0.00 -1.45 0.00 0.00 41.25 39.92 2jri s ASN 134 CO -0.26 -0.33 1.93 -0.44 -3.72 0.00 0.00 177.10 174.28 2jri s SER 135 N -0.97 5.19 0.03 -4.21 0.01 -1.26 -3.20 113.70 109.29 2jri s SER 135 Ca -0.11 -0.83 0.00 0.00 1.31 0.00 0.00 55.95 56.32 2jri s SER 135 Cb -0.05 -2.56 0.00 0.00 0.21 0.00 0.00 66.02 63.61 2jri s SER 135 CO 0.02 -2.73 0.00 -0.11 0.41 0.00 0.00 173.24 170.83 2jri n LEU 136 N 13.80 -0.30 -4.72 2.44 7.94 -1.26 -5.09 117.00 129.81 2jri n LEU 136 Ca 0.40 0.26 -0.42 0.00 -1.11 0.00 0.00 56.01 55.15 2jri n LEU 136 Cb 0.47 0.51 -0.03 0.00 0.53 0.00 0.00 43.42 44.90 2jri n LEU 136 CO 0.61 -0.01 1.09 -1.48 -1.11 0.00 0.00 177.39 176.49 2jri s LEU 137 N -4.62 4.38 0.24 -1.96 2.34 -1.19 -4.92 118.68 112.94 2jri s LEU 137 Ca 0.00 2.42 0.05 0.00 0.06 0.00 0.00 54.13 56.66 2jri s LEU 137 Cb 0.00 -3.59 0.25 0.00 -0.56 0.00 0.00 46.19 42.29 2jri s LEU 137 CO 0.00 -0.68 1.56 0.00 -1.06 0.00 0.00 176.35 176.17 2jri h THR 138 N 4.09 1.39 -3.59 5.48 1.03 -2.00 -3.45 112.91 115.86 2jri h THR 138 Ca -0.43 -2.01 -0.47 0.00 -0.01 0.00 0.00 66.41 63.49 2jri h THR 138 Cb 1.21 2.03 -0.19 0.00 -1.07 0.00 0.00 68.15 70.13 2jri h THR 138 CO 0.86 0.59 -0.78 -0.83 -0.01 0.00 0.00 175.52 175.35 2jri s GLY 139 N -4.35 1.18 0.12 2.99 0.00 -1.26 -5.10 107.32 100.90 2jri s GLY 139 Ca -0.04 -1.32 -0.32 0.00 0.00 0.00 0.00 44.72 43.05 2jri s GLY 139 CO 0.80 -1.36 1.79 -1.05 0.00 0.00 0.00 173.10 173.28 2jri n PRO 140 N 0.64 2.62 -1.95 2.90 -0.02 -1.26 -4.90 135.00 133.02 2jri n PRO 140 Ca -0.16 0.95 -0.42 0.00 -2.02 0.00 0.00 63.50 61.85 2jri n PRO 140 Cb 0.56 -2.82 -0.03 0.00 -0.02 0.00 0.00 33.50 31.19 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 2.41 4.21 0.28 -0.52 2.02 -1.19 -4.76 118.70 121.15 2jri s GLU 141 Ca 0.82 2.30 -0.29 0.00 0.02 0.00 0.00 54.97 57.81 2jri s GLU 141 Cb -0.54 -3.58 -0.10 0.00 0.10 0.00 0.00 34.13 30.01 2jri s GLU 141 CO 0.38 -0.72 1.23 -1.17 0.02 0.00 0.00 175.26 175.01 2jri s LEU 142 N 2.57 4.47 -0.17 1.80 2.96 -1.26 -2.84 118.68 126.20 2jri s LEU 142 Ca 0.73 2.46 -0.04 0.00 -0.22 0.00 0.00 54.13 57.06 2jri s LEU 142 Cb -0.39 -3.63 0.07 0.00 0.50 0.00 0.00 46.19 42.74 2jri s LEU 142 CO 0.32 -0.39 0.14 -0.63 -1.32 0.00 0.00 176.35 174.47 2jri s ILE 143 N -0.83 -0.19 0.80 6.68 1.01 -0.91 -5.00 121.20 122.77 2jri s ILE 143 Ca 0.49 -0.10 -0.11 0.00 0.00 0.00 0.00 60.65 60.93 2jri s ILE 143 Cb -0.36 -0.59 0.10 0.00 0.01 0.00 0.00 42.46 41.62 2jri s ILE 143 CO 0.45 -0.22 1.15 -0.44 0.00 0.00 0.00 174.94 175.88 2jri s SER 144 N 2.22 4.32 0.02 3.58 0.01 -1.26 -2.92 113.70 119.67 2jri s SER 144 Ca 0.04 0.54 -0.10 0.00 1.31 0.00 0.00 55.95 57.74 2jri s SER 144 Cb -0.16 -0.99 -0.05 0.00 0.21 0.00 0.00 66.02 65.04 2jri s SER 144 CO -0.10 -1.97 1.15 0.44 0.41 0.00 0.00 173.24 173.17 2jri h ASP 145 N -1.02 -0.37 0.03 2.44 5.19 -2.00 -1.07 116.42 119.63 2jri h ASP 145 Ca -0.45 0.03 -0.02 0.00 -0.62 0.00 0.00 57.03 55.97 2jri h ASP 145 Cb 1.31 0.12 -0.00 0.00 0.18 0.00 0.00 39.33 40.93 2jri h ASP 145 CO 0.58 -0.19 -0.06 0.74 -3.12 0.00 0.00 179.24 177.19 2jri h THR 146 N -0.30 1.07 0.00 0.35 2.02 -2.01 -1.13 112.91 112.91 2jri h THR 146 Ca -0.02 -0.32 -0.02 0.00 0.77 0.00 0.00 66.41 66.81 2jri h THR 146 Cb 0.25 1.10 -0.00 0.00 -1.74 0.00 0.00 68.15 67.76 2jri h THR 146 CO 0.00 0.10 -0.10 0.22 0.37 0.00 0.00 175.52 176.10 2jri h TYR 147 N 0.07 0.00 0.01 3.16 3.20 -1.89 -2.39 116.97 119.14 2jri h TYR 147 Ca 0.02 0.00 -0.24 0.00 3.14 0.00 0.00 58.73 61.65 2jri h TYR 147 Cb 0.15 0.00 0.01 0.00 1.54 0.00 0.00 36.73 38.43 2jri h TYR 147 CO 0.00 0.10 -0.99 1.25 -1.64 0.00 0.00 178.16 176.88 2jri h LEU 148 N 0.00 0.62 -1.19 2.82 5.85 0.13 0.11 115.31 123.65 2jri h LEU 148 Ca -0.00 -0.51 -0.05 0.00 0.84 0.00 0.00 57.88 58.16 2jri h LEU 148 Cb 0.42 -0.19 -0.02 0.00 0.37 0.00 0.00 40.66 41.24 2jri h LEU 148 CO 0.01 1.31 0.03 0.00 -0.34 0.00 0.00 178.44 179.45 2jri h ALA 149 N 0.64 1.34 -0.01 1.25 0.00 -1.43 0.56 119.26 121.62 2jri h ALA 149 Ca -0.10 -0.20 -0.16 0.00 0.00 0.00 0.00 54.91 54.45 2jri h ALA 149 Cb 1.64 -0.16 0.01 0.00 0.00 0.00 0.00 17.79 19.28 2jri h ALA 149 CO 0.18 0.46 -0.63 1.25 0.00 0.00 0.00 179.25 180.51 2jri h LEU 150 N 0.56 0.57 -0.38 0.00 5.85 -1.37 -3.10 115.31 117.44 2jri h LEU 150 Ca 0.12 -0.75 0.04 0.00 0.84 0.00 0.00 57.88 58.14 2jri h LEU 150 Cb 0.32 -0.17 -0.04 0.00 0.37 0.00 0.00 40.66 41.14 2jri h LEU 150 CO 0.01 1.24 0.14 0.15 -0.34 0.00 0.00 178.44 179.63 2jri h PHE 151 N -0.04 0.24 -0.26 1.25 3.57 -0.38 0.17 116.94 121.49 2jri h PHE 151 Ca -0.08 0.02 0.03 0.00 3.53 0.00 0.00 57.97 61.47 2jri h PHE 151 Cb 1.33 -0.05 -0.01 0.00 2.79 0.00 0.00 35.95 40.00 2jri h PHE 151 CO 0.14 0.10 0.17 -0.07 -2.23 0.00 0.00 178.31 176.42 2jri h LEU 152 N 0.29 0.21 0.20 0.59 -0.00 -0.98 -1.64 115.31 113.99 2jri h LEU 152 Ca 0.17 -0.00 -0.31 0.00 -0.00 0.00 0.00 57.88 57.73 2jri h LEU 152 Cb 0.15 -0.05 0.03 0.00 -0.00 0.00 0.00 40.66 40.78 2jri h LEU 152 CO -0.17 0.15 -1.38 0.00 -0.00 0.00 0.00 178.44 177.03 2jri h ALA 153 N 1.85 -0.07 -0.70 1.53 0.00 -1.16 -3.27 119.26 117.44 2jri h ALA 153 Ca 0.11 -0.86 -0.01 0.00 0.00 0.00 0.00 54.91 54.15 2jri h ALA 153 Cb 0.12 0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.99 2jri h ALA 153 CO -0.02 0.78 0.39 1.96 0.00 0.00 0.00 179.25 182.36 2jri h GLN 154 N 0.14 0.97 -0.93 0.00 1.08 0.05 -1.06 115.11 115.35 2jri h GLN 154 Ca -0.21 -0.10 0.01 0.00 -1.45 0.00 0.00 58.65 56.89 2jri h GLN 154 Cb 2.08 -0.20 -0.05 0.00 -0.05 0.00 0.00 27.48 29.27 2jri h GLN 154 CO 0.25 0.70 0.60 -0.07 -0.95 0.00 0.00 178.83 179.37 2jri h LEU 155 N 0.97 1.07 -0.44 1.46 3.38 -1.40 0.73 115.31 121.08 2jri h LEU 155 Ca 0.25 -0.04 -0.17 0.00 0.09 0.00 0.00 57.88 58.01 2jri h LEU 155 Cb 0.02 -0.27 -0.00 0.00 0.09 0.00 0.00 40.66 40.49 2jri h LEU 155 CO -0.04 0.79 -0.57 1.56 0.09 0.00 0.00 178.44 180.27 2jri h GLN 156 N 1.26 0.64 -0.19 1.13 4.20 -1.40 0.23 115.11 120.98 2jri h GLN 156 Ca 0.34 -0.41 -0.05 0.00 0.06 0.00 0.00 58.65 58.58 2jri h GLN 156 Cb -0.13 0.05 -0.00 0.00 0.30 0.00 0.00 27.48 27.70 2jri h GLN 156 CO -0.07 1.03 -0.10 1.96 -0.67 0.00 0.00 178.83 180.98 2jri h GLN 157 N 0.49 0.40 -0.09 1.46 4.20 -0.69 -3.27 115.11 117.60 2jri h GLN 157 Ca 0.01 -0.18 -0.02 0.00 0.06 0.00 0.00 58.65 58.52 2jri h GLN 157 Cb 1.13 -0.01 -0.00 0.00 0.30 0.00 0.00 27.48 28.90 2jri h GLN 157 CO 0.11 0.70 -0.02 1.49 -0.67 0.00 0.00 178.83 180.45 2jri h GLU 158 N 0.09 0.17 0.00 1.46 4.57 -0.91 -3.48 114.58 116.48 2jri h GLU 158 Ca 0.04 -0.06 0.00 0.00 -1.18 0.00 0.00 59.36 58.16 2jri h GLU 158 Cb 0.58 -0.01 0.00 0.00 -0.16 0.00 0.00 28.75 29.16 2jri h GLU 158 CO 0.03 0.47 0.00 0.41 -1.18 0.00 0.00 179.01 178.74 2jri n GLY 159 N -0.15 0.62 0.00 1.92 0.00 -0.72 -5.11 105.19 101.76 2jri n GLY 159 Ca -0.07 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.95 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 -1.67 -3.36 1.61 4.02 0.74 -4.82 117.16 113.69 2jri n TYR 160 Ca 0.00 0.00 -0.19 0.00 -0.01 0.00 0.00 57.90 57.70 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 1.37 -0.19 7.72 0.01 -0.84 -4.88 113.70 115.89 2jri s SER 161 Ca 0.00 -1.82 -0.29 0.00 1.31 0.00 0.00 55.95 55.15 2jri s SER 161 Cb 0.00 0.38 -0.02 0.00 0.21 0.00 0.00 66.02 66.59 2jri s SER 161 CO 0.00 -0.25 1.38 -0.63 0.41 0.00 0.00 173.24 174.15 2jri s ILE 162 N 1.23 4.07 -0.36 1.44 1.01 -1.26 -3.00 121.20 124.33 2jri s ILE 162 Ca 0.19 1.26 -0.03 0.00 0.00 0.00 0.00 60.65 62.07 2jri s ILE 162 Cb -0.15 -3.92 0.08 0.00 0.01 0.00 0.00 42.46 38.49 2jri s ILE 162 CO -0.03 -0.23 0.12 -0.36 0.00 0.00 0.00 174.94 174.44 2jri s PHE 163 N 4.03 3.45 0.08 3.97 0.08 0.14 -0.30 117.98 129.43 2jri s PHE 163 Ca 0.60 -2.15 -0.22 0.00 0.12 0.00 0.00 56.93 55.28 2jri s PHE 163 Cb -0.23 -2.76 -0.07 0.00 -0.57 0.00 0.00 43.02 39.40 2jri s PHE 163 CO 0.21 -0.89 0.67 0.54 -0.10 0.00 0.00 175.22 175.64 2jri s VAL 164 N 1.20 4.65 -0.21 -0.44 0.11 0.12 -1.35 120.40 124.48 2jri s VAL 164 Ca 0.03 1.44 -0.11 0.00 -2.93 0.00 0.00 61.98 60.41 2jri s VAL 164 Cb -0.21 -4.01 -0.05 0.00 -1.53 0.00 0.00 36.38 30.57 2jri s VAL 164 CO -0.03 0.49 0.18 -0.69 -3.33 0.00 0.00 175.10 171.72 2jri s VAL 165 N -0.79 5.36 0.07 2.04 1.01 -1.26 -0.47 120.40 126.36 2jri s VAL 165 Ca 0.33 0.25 0.03 0.00 0.00 0.00 0.00 61.98 62.60 2jri s VAL 165 Cb -0.21 -3.52 -0.04 0.00 0.00 0.00 0.00 36.38 32.62 2jri s VAL 165 CO 0.22 0.38 0.03 -0.54 0.00 0.00 0.00 175.10 175.18 2jri s LYS 166 N 0.75 2.72 0.00 2.72 -0.14 0.48 -4.50 119.74 121.77 2jri s LYS 166 Ca 0.09 -0.73 0.00 0.00 -1.36 0.00 0.00 55.97 53.97 2jri s LYS 166 Cb -0.13 -2.64 0.00 0.00 -1.68 0.00 0.00 37.83 33.39 2jri s LYS 166 CO 0.02 0.57 0.00 0.41 -0.76 0.00 0.00 175.35 175.59 2jri n GLY 167 N 0.70 1.12 3.61 -3.33 0.00 -1.26 -2.33 105.19 103.70 2jri n GLY 167 Ca -0.11 -2.16 -0.43 0.00 0.00 0.00 0.00 46.02 43.33 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 0.00 6.73 -0.11 1.61 1.01 -1.26 -4.97 116.67 119.69 2jri s ASP 168 Ca 0.00 0.66 -0.05 0.00 0.71 0.00 0.00 52.55 53.87 2jri s ASP 168 Cb 0.00 -2.52 -0.04 0.00 1.01 0.00 0.00 42.92 41.38 2jri s ASP 168 CO 0.00 -1.01 0.09 -0.76 0.21 0.00 0.00 175.17 173.70 2jri s LEU 169 N 3.87 4.11 0.23 1.23 1.02 -1.26 -4.98 118.68 122.89 2jri s LEU 169 Ca 0.44 0.36 -0.31 0.00 0.02 0.00 0.00 54.13 54.63 2jri s LEU 169 Cb -0.10 -1.98 -0.11 0.00 0.02 0.00 0.00 46.19 44.01 2jri s LEU 169 CO 0.22 0.40 1.62 -2.16 0.02 0.00 0.00 176.35 176.45 2jri s PRO 170 N -0.97 4.16 0.56 1.29 0.04 -1.26 -5.02 135.00 133.80 2jri s PRO 170 Ca 0.14 2.51 0.07 0.00 0.04 0.00 0.00 61.00 63.76 2jri s PRO 170 Cb -0.12 -3.08 0.06 0.00 0.04 0.00 0.00 34.50 31.40 2jri s PRO 170 CO 0.03 -0.65 0.54 0.16 0.04 0.00 0.00 177.00 177.13 2jri s ASP 171 N 0.86 4.79 0.09 6.66 -4.77 -1.26 -4.72 116.67 118.31 2jri s ASP 171 Ca 0.68 -1.12 0.01 0.00 -3.30 0.00 0.00 52.55 48.83 2jri s ASP 171 Cb -0.47 0.40 -0.00 0.00 -1.09 0.00 0.00 42.92 41.75 2jri s ASP 171 CO 0.38 -1.20 0.04 0.00 0.70 0.00 0.00 175.17 175.10 2jri h GLU 173 N 0.00 0.28 0.00 0.00 4.57 -1.94 -3.21 114.58 114.29 2jri h GLU 173 Ca -0.07 -0.02 0.00 0.00 -1.18 0.00 0.00 59.36 58.10 2jri h GLU 173 Cb 0.27 -0.06 0.00 0.00 -0.16 0.00 0.00 28.75 28.80 2jri h GLU 173 CO 0.10 0.19 0.00 0.00 -1.18 0.00 0.00 179.01 178.12 2jri n ALA 174 N -2.55 -0.10 0.00 2.92 0.00 -1.12 -1.89 120.51 117.78 2jri n ALA 174 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.55 2jri n ALA 174 Cb 0.47 0.17 0.00 0.00 0.00 0.00 0.00 19.45 20.09 2jri n ALA 174 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 2jri n ASP 175 N -1.44 0.00 -0.02 0.00 -0.08 -1.21 -1.33 116.55 112.47 2jri n ASP 175 Ca 0.00 0.00 0.02 0.00 -1.51 0.00 0.00 54.79 53.30 2jri n ASP 175 Cb 0.00 0.00 -0.10 0.00 2.34 0.00 0.00 41.12 43.36 2jri n ASP 175 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2jri n GLN 176 N -0.59 0.98 0.00 -0.67 6.02 -0.79 -4.13 117.38 118.20 2jri n GLN 176 Ca 0.00 -0.08 0.01 0.00 -0.01 0.00 0.00 57.00 56.93 2jri n GLN 176 Cb 0.00 -1.30 -0.01 0.00 1.02 0.00 0.00 30.24 29.95 2jri n GLN 176 CO 0.00 0.00 0.00 1.47 -1.01 0.00 0.00 177.06 177.52 2jri n LEU 177 N -2.11 0.25 0.00 1.08 -0.00 -0.71 -4.57 117.00 110.94 2jri n LEU 177 Ca -0.08 -0.55 0.09 0.00 -0.00 0.00 0.00 56.01 55.47 2jri n LEU 177 Cb 0.52 0.00 0.56 0.00 -0.00 0.00 0.00 43.42 44.50 2jri n LEU 177 CO 0.26 0.06 0.77 0.18 -0.00 0.00 0.00 177.39 178.66 2jri n LEU 178 N -0.94 0.00 0.29 1.47 7.99 -0.44 -3.33 117.00 122.04 2jri n LEU 178 Ca 0.01 0.00 0.19 0.00 -0.01 0.00 0.00 56.01 56.19 2jri n LEU 178 Cb 0.05 0.00 0.80 0.00 -0.11 0.00 0.00 43.42 44.16 2jri n LEU 178 CO 0.05 0.00 1.04 1.56 -1.51 0.00 0.00 177.39 178.53 2jri h GLN 179 N 0.00 0.00 -0.14 3.23 1.08 -1.81 -2.83 115.11 114.64 2jri h GLN 179 Ca 0.00 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 2jri h GLN 179 Cb 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.43 2jri h GLN 179 CO 0.00 0.00 0.00 0.00 -0.95 0.00 0.00 178.83 177.88 2jri n MET 180 N -3.09 2.23 -3.69 1.46 0.00 -1.21 -4.98 117.12 107.85 2jri n MET 180 Ca -0.00 -2.61 -0.37 0.00 0.00 0.00 0.00 57.70 54.72 2jri n MET 180 Cb 0.26 -1.62 -0.10 0.00 0.00 0.00 0.00 33.22 31.75 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 -2.64 5.13 0.00 3.17 -1.09 -1.07 -5.14 121.20 119.56 2jri s ILE 181 Ca 0.34 0.10 0.00 0.00 -2.23 0.00 0.00 60.65 58.86 2jri s ILE 181 Cb 0.28 -3.40 0.00 0.00 -1.58 0.00 0.00 42.46 37.76 2jri s ILE 181 CO 0.06 0.32 0.00 -1.14 -1.23 0.00 0.00 174.94 172.96