#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 -1.92 2.12 4.71 -1.26 -4.98 120.64 119.30 2jri n GLU 2 Ca 0.00 0.00 -0.40 0.00 -0.01 0.00 0.00 57.16 56.75 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 -0.13 5.33 0.01 1.62 0.01 -1.26 -4.95 113.70 114.33 2jri s SER 3 Ca 0.00 0.84 0.02 0.00 1.31 0.00 0.00 55.95 58.12 2jri s SER 3 Cb 0.00 -2.52 -0.01 0.00 0.21 0.00 0.00 66.02 63.70 2jri s SER 3 CO 0.00 -2.24 -0.06 -0.63 0.41 0.00 0.00 173.24 170.72 2jri s ILE 4 N 8.90 0.48 -1.20 1.44 1.01 -1.26 -3.15 121.20 127.41 2jri s ILE 4 Ca 0.78 -0.55 -0.19 0.00 0.00 0.00 0.00 60.65 60.68 2jri s ILE 4 Cb -0.17 -0.46 -0.02 0.00 0.01 0.00 0.00 42.46 41.81 2jri s ILE 4 CO 0.26 -0.07 1.93 0.49 0.00 0.00 0.00 174.94 177.56 2jri n PHE 5 N 2.39 3.39 -2.15 3.97 3.01 -1.26 -4.76 117.46 122.05 2jri n PHE 5 Ca -0.17 -2.31 -0.39 0.00 1.01 0.00 0.00 57.45 55.59 2jri n PHE 5 Cb 0.57 -2.44 0.01 0.00 -0.01 0.00 0.00 39.48 37.61 2jri n PHE 5 CO 0.00 0.00 0.00 1.58 1.01 0.00 0.00 176.76 179.35 2jri n HIS 6 N 9.30 2.64 -1.75 1.38 -0.00 -1.26 -4.65 115.22 120.88 2jri n HIS 6 Ca 0.49 -2.44 -0.42 0.00 0.46 0.00 0.00 57.72 55.80 2jri n HIS 6 Cb 0.44 -1.32 -0.03 0.00 -0.12 0.00 0.00 29.99 28.95 2jri n HIS 6 CO 0.00 0.00 0.00 -1.21 0.46 0.00 0.00 176.34 175.59 2jri s GLU 7 N -3.38 3.86 -0.17 1.57 0.41 -1.26 -4.97 118.70 114.76 2jri s GLU 7 Ca 0.48 2.31 -0.06 0.00 -0.41 0.00 0.00 54.97 57.30 2jri s GLU 7 Cb 0.29 -4.18 -0.03 0.00 -1.78 0.00 0.00 34.13 28.43 2jri s GLU 7 CO -0.23 -1.26 0.01 0.21 -0.49 0.00 0.00 175.26 173.51 2jri s LYS 8 N 4.89 3.80 0.03 1.61 2.47 -1.26 -4.91 119.74 126.38 2jri s LYS 8 Ca 0.87 -0.44 -0.03 0.00 -1.56 0.00 0.00 55.97 54.82 2jri s LYS 8 Cb -0.37 -3.07 -0.02 0.00 -1.46 0.00 0.00 37.83 32.91 2jri s LYS 8 CO 0.37 0.23 0.03 1.14 0.16 0.00 0.00 175.35 177.28 2jri s GLN 9 N 0.44 0.51 0.06 4.03 0.00 -1.26 -5.16 119.66 118.29 2jri s GLN 9 Ca -0.00 -0.82 -0.07 0.00 -0.00 0.00 0.00 55.36 54.47 2jri s GLN 9 Cb -0.13 0.19 -0.01 0.00 0.00 0.00 0.00 33.01 33.06 2jri s GLN 9 CO 0.02 -0.11 0.14 -1.21 0.00 0.00 0.00 175.29 174.13 2jri s GLU 10 N -2.56 0.72 -0.12 9.60 2.02 -1.26 -4.90 118.70 122.20 2jri s GLU 10 Ca -0.06 -0.87 -0.01 0.00 0.02 0.00 0.00 54.97 54.06 2jri s GLU 10 Cb -0.02 0.29 0.00 0.00 0.10 0.00 0.00 34.13 34.50 2jri s GLU 10 CO -0.05 -0.20 0.12 0.41 0.02 0.00 0.00 175.26 175.56 2jri n GLY 11 N 0.32 -0.53 7.00 -1.39 0.00 -1.26 -4.91 105.19 104.42 2jri n GLY 11 Ca -0.17 -0.04 0.00 0.00 0.00 0.00 0.00 46.02 45.81 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 -1.01 -4.44 -3.18 1.61 7.64 -1.26 -4.91 113.62 108.08 2jri n SER 12 Ca 0.00 0.00 -0.23 0.00 1.01 0.00 0.00 58.87 59.65 2jri n SER 12 Cb 0.42 0.00 0.03 0.00 -1.01 0.00 0.00 64.21 63.65 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 -2.46 0.04 -3.43 7.99 -0.88 -4.85 117.00 113.42 2jri n LEU 13 Ca 0.00 -0.35 0.07 0.00 -0.01 0.00 0.00 56.01 55.72 2jri n LEU 13 Cb 0.00 -2.76 0.32 0.00 -0.11 0.00 0.00 43.42 40.87 2jri n LEU 13 CO 0.00 0.26 0.73 0.00 -1.51 0.00 0.00 177.39 176.87 2jri h ALA 15 N 2.34 1.32 -0.09 0.00 0.00 -1.94 -2.03 119.26 118.86 2jri h ALA 15 Ca 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.65 2jri h ALA 15 Cb 0.23 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.97 2jri h ALA 15 CO 0.00 0.35 0.00 0.94 0.00 0.00 0.00 179.25 180.54 2jri n GLN 16 N -3.89 1.58 0.02 0.00 0.00 -0.92 -3.32 117.38 110.85 2jri n GLN 16 Ca -0.02 -0.48 0.00 0.00 -0.00 0.00 0.00 57.00 56.50 2jri n GLN 16 Cb 0.36 -1.58 0.00 0.00 0.00 0.00 0.00 30.24 29.02 2jri n GLN 16 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 177.06 178.64 2jri n HIS 17 N 0.08 -0.23 0.17 3.69 -0.00 -0.79 -4.47 115.22 113.67 2jri n HIS 17 Ca 0.04 0.04 -0.14 0.00 0.46 0.00 0.00 57.72 58.12 2jri n HIS 17 Cb 0.38 0.17 -0.07 0.00 -0.12 0.00 0.00 29.99 30.35 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 -0.42 0.68 -0.06 0.00 5.85 -1.84 -2.43 115.31 117.09 2jri h LEU 19 Ca -0.02 -0.46 -0.00 0.00 0.84 0.00 0.00 57.88 58.23 2jri h LEU 19 Cb 0.36 -0.20 -0.00 0.00 0.37 0.00 0.00 40.66 41.18 2jri h LEU 19 CO 0.02 1.23 0.03 -1.13 -0.34 0.00 0.00 178.44 178.24 2jri h ASN 20 N 0.37 0.08 1.02 1.25 -0.73 -1.73 0.13 115.58 115.98 2jri h ASN 20 Ca -0.05 -0.14 0.00 0.00 1.87 0.00 0.00 56.30 57.98 2jri h ASN 20 Cb 1.40 -0.02 0.00 0.00 0.27 0.00 0.00 38.32 39.97 2jri h ASN 20 CO 0.15 0.20 0.00 0.59 -0.37 0.00 0.00 177.43 178.00 2jri n ASN 21 N -4.97 0.75 -0.08 1.15 5.03 0.41 -0.52 115.26 117.03 2jri n ASN 21 Ca -0.06 0.64 -0.13 0.00 0.87 0.00 0.00 54.58 55.90 2jri n ASN 21 Cb 0.10 -0.81 -0.08 0.00 -1.02 0.00 0.00 39.78 37.96 2jri n ASN 21 CO 0.00 0.00 0.00 0.25 -1.83 0.00 0.00 177.26 175.68 2jri h LEU 22 N 0.00 0.00 -0.71 3.41 7.12 -0.97 -3.37 115.31 120.79 2jri h LEU 22 Ca 0.00 -0.49 -0.14 0.00 0.13 0.00 0.00 57.88 57.38 2jri h LEU 22 Cb 0.51 0.00 -0.01 0.00 -0.53 0.00 0.00 40.66 40.63 2jri h LEU 22 CO 0.00 1.03 -0.52 -0.07 -0.13 0.00 0.00 178.44 178.75 2jri h LEU 23 N -1.00 0.36 -1.08 2.25 3.38 -0.76 -3.48 115.31 114.99 2jri h LEU 23 Ca -0.12 -0.18 -0.31 0.00 0.09 0.00 0.00 57.88 57.36 2jri h LEU 23 Cb 0.84 -0.10 0.12 0.00 0.09 0.00 0.00 40.66 41.61 2jri h LEU 23 CO -0.07 0.82 -0.56 0.00 0.09 0.00 0.00 178.44 178.71 2jri n GLN 24 N -3.94 -6.17 -3.61 1.13 1.13 0.32 -4.49 117.38 101.74 2jri n GLN 24 Ca -0.02 0.67 -0.10 0.00 -1.94 0.00 0.00 57.00 55.61 2jri n GLN 24 Cb 0.57 -5.22 -0.06 0.00 0.11 0.00 0.00 30.24 25.63 2jri n GLN 24 CO 0.00 0.00 0.00 0.20 -1.44 0.00 0.00 177.06 175.82 2jri s GLY 25 N -3.45 -0.22 -1.14 1.08 0.00 -1.25 -4.27 107.32 98.06 2jri s GLY 25 Ca 0.36 2.38 -0.17 0.00 0.00 0.00 0.00 44.72 47.29 2jri s GLY 25 CO 0.59 1.52 1.44 1.85 0.00 0.00 0.00 173.10 178.50 2jri s GLU 26 N -0.27 3.89 0.03 2.90 2.12 -1.26 -4.50 118.70 121.60 2jri s GLU 26 Ca 0.01 -2.06 0.00 0.00 0.36 0.00 0.00 54.97 53.28 2jri s GLU 26 Cb -0.03 -5.18 0.00 0.00 0.26 0.00 0.00 34.13 29.18 2jri s GLU 26 CO -0.03 -1.94 0.00 0.66 -0.54 0.00 0.00 175.26 173.41 2jri n TYR 27 N 6.94 -0.11 -2.13 5.30 4.01 -1.26 -5.04 117.16 124.87 2jri n TYR 27 Ca 0.36 0.02 -0.42 0.00 -0.16 0.00 0.00 57.90 57.70 2jri n TYR 27 Cb 0.46 0.10 -0.03 0.00 -0.31 0.00 0.00 39.34 39.56 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 -2.00 2.88 0.11 -0.72 5.36 -1.26 -5.01 117.98 117.34 2jri s PHE 28 Ca 0.00 0.74 -0.16 0.00 -0.96 0.00 0.00 56.93 56.55 2jri s PHE 28 Cb 0.00 -3.74 -0.07 0.00 -0.34 0.00 0.00 43.02 38.87 2jri s PHE 28 CO 0.00 -2.77 0.54 0.45 -1.46 0.00 0.00 175.22 171.98 2jri s SER 29 N 1.74 6.90 0.66 6.13 0.15 -1.26 -4.96 113.70 123.06 2jri s SER 29 Ca 0.66 1.13 0.41 0.00 0.70 0.00 0.00 55.95 58.85 2jri s SER 29 Cb -0.35 -2.31 2.26 0.00 -1.71 0.00 0.00 66.02 63.91 2jri s SER 29 CO 0.29 0.18 2.29 -0.65 1.20 0.00 0.00 173.24 176.54 2jri h PRO 30 N 3.96 0.00 0.00 5.44 0.11 -2.02 -0.28 132.00 139.21 2jri h PRO 30 Ca -0.49 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.60 2jri h PRO 30 Cb 1.20 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.31 2jri h PRO 30 CO 0.65 0.00 -0.08 -0.24 -0.21 0.00 0.00 178.00 178.11 2jri h VAL 31 N 0.00 0.18 0.00 3.15 3.04 -2.02 -2.88 116.25 117.71 2jri h VAL 31 Ca 0.00 -0.89 -0.01 0.00 -1.01 0.00 0.00 66.70 64.78 2jri h VAL 31 Cb 0.13 1.76 -0.00 0.00 -2.01 0.00 0.00 31.29 31.17 2jri h VAL 31 CO -0.00 0.08 -0.07 -0.33 -1.01 0.00 0.00 177.57 176.24 2jri h GLU 32 N 0.00 0.00 -0.81 4.17 5.08 -1.44 -3.25 114.58 118.33 2jri h GLU 32 Ca -0.00 0.00 0.07 0.00 -1.00 0.00 0.00 59.36 58.43 2jri h GLU 32 Cb 0.76 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 29.95 2jri h GLU 32 CO 0.01 0.07 0.49 -0.07 -1.00 0.00 0.00 179.01 178.51 2jri h LEU 33 N 0.00 0.74 -0.64 1.33 3.38 -1.61 0.22 115.31 118.73 2jri h LEU 33 Ca -0.00 0.03 -0.12 0.00 0.09 0.00 0.00 57.88 57.88 2jri h LEU 33 Cb 0.93 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.54 2jri h LEU 33 CO 0.01 0.46 -0.23 0.28 0.09 0.00 0.00 178.44 179.05 2jri h SER 34 N 0.87 0.84 -0.20 -0.43 0.02 -1.74 -1.32 113.55 111.59 2jri h SER 34 Ca 0.37 -0.31 -0.04 0.00 -0.84 0.00 0.00 61.79 60.97 2jri h SER 34 Cb 0.22 -0.23 -0.01 0.00 0.14 0.00 0.00 62.40 62.53 2jri h SER 34 CO -0.19 1.04 -0.03 0.28 -1.14 0.00 0.00 176.83 176.78 2jri h SER 35 N 0.71 0.37 0.62 3.07 0.02 -1.44 -1.99 113.55 114.91 2jri h SER 35 Ca 0.10 -0.35 -0.11 0.00 -0.84 0.00 0.00 61.79 60.58 2jri h SER 35 Cb 0.76 -0.10 -0.02 0.00 0.14 0.00 0.00 62.40 63.18 2jri h SER 35 CO 0.06 0.63 -0.54 0.16 -1.14 0.00 0.00 176.83 176.00 2jri h ILE 36 N 0.10 1.33 -0.11 3.27 3.07 -0.98 -2.30 117.51 121.89 2jri h ILE 36 Ca 0.05 -1.90 -0.03 0.00 1.55 0.00 0.00 64.86 64.54 2jri h ILE 36 Cb 0.46 2.04 -0.00 0.00 -0.27 0.00 0.00 36.82 39.05 2jri h ILE 36 CO 0.02 0.53 -0.05 0.00 -1.05 0.00 0.00 178.15 177.60 2jri h ALA 37 N 1.46 0.16 0.00 0.16 0.00 -1.15 -2.84 119.26 117.05 2jri h ALA 37 Ca -0.01 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.66 2jri h ALA 37 Cb 1.00 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.75 2jri h ALA 37 CO 0.07 -0.07 0.00 1.58 0.00 0.00 0.00 179.25 180.83 2jri n HIS 38 N -4.71 0.56 0.21 0.00 -0.00 -0.76 -2.20 115.22 108.32 2jri n HIS 38 Ca -0.06 0.20 0.06 0.00 0.46 0.00 0.00 57.72 58.38 2jri n HIS 38 Cb 0.27 -0.83 0.49 0.00 -0.12 0.00 0.00 29.99 29.80 2jri n HIS 38 CO 0.00 0.00 0.00 0.37 0.46 0.00 0.00 176.34 177.17 2jri h GLN 39 N 0.00 0.00 -0.14 1.57 4.15 -1.15 -1.62 115.11 117.92 2jri h GLN 39 Ca 0.00 0.00 -0.10 0.00 0.77 0.00 0.00 58.65 59.32 2jri h GLN 39 Cb 0.41 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 28.09 2jri h GLN 39 CO 0.00 0.26 -0.36 -0.07 -1.93 0.00 0.00 178.83 176.73 2jri h LEU 40 N 0.00 0.30 -0.70 -2.39 -0.00 -1.50 -2.55 115.31 108.47 2jri h LEU 40 Ca -0.00 -0.12 0.03 0.00 -0.00 0.00 0.00 57.88 57.79 2jri h LEU 40 Cb 0.53 -0.08 -0.04 0.00 -0.00 0.00 0.00 40.66 41.06 2jri h LEU 40 CO 0.03 0.65 0.44 -0.78 -0.00 0.00 0.00 178.44 178.78 2jri h ASP 41 N 0.25 0.72 -0.61 -0.43 3.58 -0.96 0.52 116.42 119.49 2jri h ASP 41 Ca 0.03 -0.00 -0.04 0.00 0.42 0.00 0.00 57.03 57.44 2jri h ASP 41 Cb 0.76 -0.16 -0.03 0.00 1.72 0.00 0.00 39.33 41.63 2jri h ASP 41 CO 0.06 0.50 0.24 -0.08 -2.88 0.00 0.00 179.24 177.08 2jri h GLU 42 N 0.86 0.91 -0.11 0.28 4.57 -1.42 -0.17 114.58 119.50 2jri h GLU 42 Ca 0.28 -0.16 -0.03 0.00 -1.18 0.00 0.00 59.36 58.26 2jri h GLU 42 Cb 0.02 -0.15 -0.00 0.00 -0.16 0.00 0.00 28.75 28.46 2jri h GLU 42 CO -0.11 0.77 -0.06 0.93 -1.18 0.00 0.00 179.01 179.36 2jri h GLU 43 N 0.85 0.23 -0.25 1.92 5.08 -0.96 -2.55 114.58 118.90 2jri h GLU 43 Ca 0.20 -0.10 -0.01 0.00 -1.00 0.00 0.00 59.36 58.44 2jri h GLU 43 Cb 0.20 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.44 2jri h GLU 43 CO -0.02 0.59 0.09 0.93 -1.00 0.00 0.00 179.01 179.61 2jri h GLU 44 N -0.13 0.34 -0.45 2.33 4.39 0.10 0.13 114.58 121.29 2jri h GLU 44 Ca 0.02 -0.04 -0.03 0.00 0.34 0.00 0.00 59.36 59.65 2jri h GLU 44 Cb 0.53 -0.07 -0.02 0.00 -0.10 0.00 0.00 28.75 29.09 2jri h GLU 44 CO 0.02 0.30 0.15 -0.09 -1.16 0.00 0.00 179.01 178.22 2jri h ARG 45 N 0.35 0.69 -0.11 2.33 2.43 -0.89 0.29 114.38 119.46 2jri h ARG 45 Ca 0.09 -0.14 -0.12 0.00 -0.81 0.00 0.00 59.98 58.99 2jri h ARG 45 Cb 0.09 -0.10 -0.01 0.00 -0.42 0.00 0.00 29.97 29.52 2jri h ARG 45 CO -0.01 0.66 -0.47 0.52 -1.51 0.00 0.00 179.97 179.16 2jri h MET 46 N 0.58 0.28 -0.33 0.20 2.86 -0.90 -2.14 114.93 115.49 2jri h MET 46 Ca 0.15 -0.15 -0.02 0.00 -2.06 0.00 0.00 59.70 57.61 2jri h MET 46 Cb 0.25 0.01 -0.01 0.00 0.06 0.00 0.00 31.60 31.90 2jri h MET 46 CO -0.01 0.70 0.12 -0.09 1.06 0.00 0.00 176.91 178.70 2jri h ARG 47 N 0.23 0.49 0.00 1.72 1.12 -0.33 -2.11 114.38 115.51 2jri h ARG 47 Ca 0.01 -0.09 -0.02 0.00 -1.11 0.00 0.00 59.98 58.77 2jri h ARG 47 Cb 0.92 -0.08 -0.00 0.00 -0.01 0.00 0.00 29.97 30.80 2jri h ARG 47 CO 0.08 0.50 -0.11 1.98 -3.11 0.00 0.00 179.97 179.31 2jri h MET 48 N 0.38 0.00 0.00 0.20 4.05 -0.84 -0.11 114.93 118.61 2jri h MET 48 Ca 0.11 0.00 -0.11 0.00 -0.28 0.00 0.00 59.70 59.42 2jri h MET 48 Cb 0.20 0.00 -0.02 0.00 -0.80 0.00 0.00 31.60 30.98 2jri h MET 48 CO -0.01 0.11 -0.51 0.00 0.23 0.00 0.00 176.91 176.73 2jri h ALA 49 N 1.89 0.88 0.13 0.39 0.00 -0.94 -1.71 119.26 119.91 2jri h ALA 49 Ca -0.00 -0.46 -0.35 0.00 0.00 0.00 0.00 54.91 54.10 2jri h ALA 49 Cb 0.70 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.40 2jri h ALA 49 CO 0.01 0.64 -1.84 1.49 0.00 0.00 0.00 179.25 179.56 2jri h GLU 50 N 0.00 0.28 -1.85 0.00 4.81 -0.85 -3.39 114.58 113.58 2jri h GLU 50 Ca -0.01 -0.48 -0.63 0.00 -0.13 0.00 0.00 59.36 58.11 2jri h GLU 50 Cb 1.10 0.18 -0.39 0.00 0.63 0.00 0.00 28.75 30.27 2jri h GLU 50 CO 0.07 1.17 -0.33 0.41 -0.73 0.00 0.00 179.01 179.60 2jri n GLY 51 N 1.87 5.85 3.58 1.92 0.00 -0.10 -4.98 105.19 113.33 2jri n GLY 51 Ca -0.26 -2.72 -0.01 0.00 0.00 0.00 0.00 46.02 43.02 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 -3.02 -0.09 -0.01 -0.02 0.00 -0.64 -4.80 107.32 98.74 2jri s GLY 52 Ca 0.48 3.08 0.04 0.00 0.00 0.00 0.00 44.72 48.32 2jri s GLY 52 CO -0.20 2.77 0.09 3.33 0.00 0.00 0.00 173.10 179.09 2jri n VAL 53 N 4.10 0.00 -3.17 1.40 0.24 -1.26 -4.71 118.33 114.93 2jri n VAL 53 Ca -0.16 -0.09 -0.39 0.00 -2.04 0.00 0.00 64.34 61.66 2jri n VAL 53 Cb 0.56 0.42 -0.06 0.00 -1.47 0.00 0.00 33.84 33.29 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 -2.26 4.82 0.31 3.34 -4.23 -1.26 -4.97 115.64 111.38 2jri s THR 54 Ca -0.01 1.33 0.03 0.00 -1.18 0.00 0.00 61.69 61.86 2jri s THR 54 Cb 0.03 -3.97 0.11 0.00 1.34 0.00 0.00 72.50 70.01 2jri s THR 54 CO 0.16 0.44 1.79 0.28 -0.54 0.00 0.00 174.62 176.76 2jri h SER 55 N 5.36 0.48 -0.73 3.99 0.02 -1.99 -2.14 113.55 118.54 2jri h SER 55 Ca -0.46 -0.13 -0.07 0.00 -0.84 0.00 0.00 61.79 60.29 2jri h SER 55 Cb 1.20 -0.13 -0.03 0.00 0.14 0.00 0.00 62.40 63.58 2jri h SER 55 CO 0.68 0.65 0.20 -0.33 -1.14 0.00 0.00 176.83 176.89 2jri h GLU 56 N 0.46 1.15 -0.31 3.45 4.39 -1.99 -0.68 114.58 121.04 2jri h GLU 56 Ca 0.08 -0.27 -0.10 0.00 0.34 0.00 0.00 59.36 59.41 2jri h GLU 56 Cb 0.52 -0.16 -0.01 0.00 -0.10 0.00 0.00 28.75 29.00 2jri h GLU 56 CO 0.03 1.00 -0.23 -0.44 -1.16 0.00 0.00 179.01 178.21 2jri h ASP 57 N 1.10 0.60 -0.13 1.42 5.19 -1.90 -2.02 116.42 120.67 2jri h ASP 57 Ca 0.23 -0.20 -0.02 0.00 -0.62 0.00 0.00 57.03 56.42 2jri h ASP 57 Cb 0.35 -0.16 -0.00 0.00 0.18 0.00 0.00 39.33 39.69 2jri h ASP 57 CO -0.00 0.82 0.00 0.22 -3.12 0.00 0.00 179.24 177.16 2jri h TYR 58 N 0.53 0.25 -0.31 4.55 3.20 -0.88 -2.60 116.97 121.71 2jri h TYR 58 Ca 0.08 -0.04 -0.00 0.00 3.14 0.00 0.00 58.73 61.90 2jri h TYR 58 Cb 0.68 -0.06 -0.02 0.00 1.54 0.00 0.00 36.73 38.87 2jri h TYR 58 CO 0.03 0.46 0.17 -0.09 -1.64 0.00 0.00 178.16 177.08 2jri h ARG 59 N -0.03 0.41 -0.84 1.82 2.43 -1.04 0.10 114.38 117.23 2jri h ARG 59 Ca 0.04 -0.03 0.01 0.00 -0.81 0.00 0.00 59.98 59.18 2jri h ARG 59 Cb 0.36 -0.09 -0.04 0.00 -0.42 0.00 0.00 29.97 29.78 2jri h ARG 59 CO 0.01 0.30 0.55 1.15 -1.51 0.00 0.00 179.97 180.48 2jri h THR 60 N 0.42 1.22 0.00 0.20 2.02 -1.05 -2.34 112.91 113.38 2jri h THR 60 Ca 0.11 -0.39 -0.13 0.00 0.77 0.00 0.00 66.41 66.77 2jri h THR 60 Cb 0.01 -0.02 -0.02 0.00 -1.74 0.00 0.00 68.15 66.38 2jri h THR 60 CO -0.02 0.21 -0.70 -0.26 0.37 0.00 0.00 175.52 175.12 2jri h PHE 61 N 1.14 0.00 -0.03 3.16 -1.00 -0.91 -2.87 116.94 116.44 2jri h PHE 61 Ca 0.31 0.00 -0.03 0.00 2.81 0.00 0.00 57.97 61.05 2jri h PHE 61 Cb -0.13 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 39.42 2jri h PHE 61 CO -0.01 0.61 -0.14 -0.07 -1.61 0.00 0.00 178.31 177.09 2jri h LEU 62 N 0.00 0.04 -3.49 1.54 3.38 -0.49 -2.66 115.31 113.63 2jri h LEU 62 Ca -0.02 -0.01 -0.27 0.00 0.09 0.00 0.00 57.88 57.67 2jri h LEU 62 Cb 1.48 -0.01 -0.24 0.00 0.09 0.00 0.00 40.66 41.98 2jri h LEU 62 CO 0.08 0.18 -0.72 1.67 0.09 0.00 0.00 178.44 179.74 2jri n GLN 63 N -4.36 2.41 -2.61 1.13 7.27 -1.03 -5.00 117.38 115.19 2jri n GLN 63 Ca -0.02 -3.63 -0.41 0.00 0.07 0.00 0.00 57.00 53.01 2jri n GLN 63 Cb 0.22 -1.82 -0.04 0.00 2.41 0.00 0.00 30.24 31.01 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 -3.24 4.62 0.78 3.69 2.00 -1.00 -5.02 119.66 121.49 2jri s GLN 64 Ca 0.43 1.59 -0.13 0.00 -2.00 0.00 0.00 55.36 55.25 2jri s GLN 64 Cb 0.39 -3.34 0.07 0.00 0.80 0.00 0.00 33.01 30.93 2jri s GLN 64 CO -0.02 0.10 1.19 -1.25 -0.50 0.00 0.00 175.29 174.80 2jri s PRO 65 N -0.01 1.84 0.00 1.67 0.04 -1.26 -3.01 135.00 134.28 2jri s PRO 65 Ca 0.49 1.67 0.00 0.00 0.04 0.00 0.00 61.00 63.20 2jri s PRO 65 Cb -0.26 -1.81 0.00 0.00 0.04 0.00 0.00 34.50 32.47 2jri s PRO 65 CO 0.32 -2.04 0.00 0.43 0.04 0.00 0.00 177.00 175.75 2jri n SER 66 N -3.17 0.00 -0.07 6.66 7.64 -1.26 -4.61 113.62 118.81 2jri n SER 66 Ca 0.13 0.00 -0.09 0.00 1.01 0.00 0.00 58.87 59.92 2jri n SER 66 Cb 0.51 0.00 0.06 0.00 -1.01 0.00 0.00 64.21 63.77 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 0.83 0.80 0.23 0.00 -1.85 -3.08 103.07 100.00 2jri h GLY 67 Ca 0.00 -0.78 -0.07 0.00 0.00 0.00 0.00 47.33 46.48 2jri h GLY 67 CO 0.00 0.71 -0.14 3.43 0.00 0.00 0.00 176.54 180.54 2jri h ASN 68 N 0.64 0.45 0.00 0.19 2.35 -1.81 -2.73 115.58 114.67 2jri h ASN 68 Ca 0.07 -0.45 0.00 0.00 -0.55 0.00 0.00 56.30 55.37 2jri h ASN 68 Cb 0.85 -0.13 0.00 0.00 0.05 0.00 0.00 38.32 39.10 2jri h ASN 68 CO 0.07 0.81 0.00 0.80 -1.65 0.00 0.00 177.43 177.46 2jri n MET 69 N -4.52 0.00 0.00 0.81 1.56 -1.16 -3.70 117.12 110.11 2jri n MET 69 Ca -0.05 0.00 0.00 0.00 -0.27 0.00 0.00 57.70 57.38 2jri n MET 69 Cb 0.36 0.00 0.00 0.00 2.15 0.00 0.00 33.22 35.73 2jri n MET 69 CO 0.00 0.00 0.00 -3.47 -0.73 0.00 0.00 175.97 171.77 2jri n ASP 70 N 0.00 0.00 0.07 6.12 2.03 -1.26 -4.03 116.55 119.48 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 -1.28 0.00 1.67 2.03 -1.26 -3.98 116.55 113.73 2jri n ASP 71 Ca 0.00 0.56 0.00 0.00 0.52 0.00 0.00 54.79 55.87 2jri n ASP 71 Cb 0.00 1.49 0.00 0.00 -0.72 0.00 0.00 41.12 41.89 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 -3.02 0.00 -0.06 1.67 7.64 -1.26 -4.96 113.62 113.62 2jri n SER 72 Ca 0.00 0.00 0.04 0.00 1.01 0.00 0.00 58.87 59.92 2jri n SER 72 Cb 0.00 0.00 0.23 0.00 -1.01 0.00 0.00 64.21 63.43 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 -0.84 1.49 0.23 0.00 -1.26 -4.81 105.19 104.99 2jri n GLY 73 Ca 0.00 -0.08 -0.11 0.00 0.00 0.00 0.00 46.02 45.83 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 -0.51 -3.86 -3.68 1.61 3.72 -1.26 -2.06 117.46 111.42 2jri n PHE 74 Ca 0.07 -0.49 -0.10 0.00 -0.05 0.00 0.00 57.45 56.88 2jri n PHE 74 Cb 0.06 -0.38 -0.10 0.00 -0.94 0.00 0.00 39.48 38.12 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 -1.93 -0.69 0.78 1.38 0.08 -1.26 -4.78 117.98 111.56 2jri s PHE 75 Ca 0.28 1.39 -0.11 0.00 0.12 0.00 0.00 56.93 58.62 2jri s PHE 75 Cb -0.01 0.28 0.06 0.00 -0.57 0.00 0.00 43.02 42.78 2jri s PHE 75 CO 0.20 -0.41 1.09 -1.12 -0.10 0.00 0.00 175.22 174.88 2jri s SER 76 N 1.95 4.55 0.47 1.36 0.01 -1.26 -4.92 113.70 115.87 2jri s SER 76 Ca -0.06 1.48 0.32 0.00 1.31 0.00 0.00 55.95 59.00 2jri s SER 76 Cb -0.10 -2.24 1.66 0.00 0.21 0.00 0.00 66.02 65.55 2jri s SER 76 CO -0.13 -1.95 1.97 -0.29 0.41 0.00 0.00 173.24 173.25 2jri h ILE 77 N -1.08 0.00 -0.16 1.44 2.10 -1.95 -2.46 117.51 115.40 2jri h ILE 77 Ca -0.46 -0.07 0.05 0.00 1.08 0.00 0.00 64.86 65.45 2jri h ILE 77 Cb 1.25 0.83 -0.01 0.00 -1.09 0.00 0.00 36.82 37.80 2jri h ILE 77 CO 0.57 0.00 0.12 1.56 -1.08 0.00 0.00 178.15 179.32 2jri h GLN 78 N 0.00 0.00 0.00 2.19 7.50 -1.91 -0.15 115.11 122.75 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 0.09 0.00 0.00 0.00 0.05 0.00 0.00 27.48 27.62 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 -4.41 0.00 -0.09 -0.54 0.24 -0.93 -2.51 118.33 110.09 2jri n VAL 79 Ca 0.01 0.00 -0.16 0.00 -2.04 0.00 0.00 64.34 62.15 2jri n VAL 79 Cb 0.25 -0.34 -0.08 0.00 -1.47 0.00 0.00 33.84 32.21 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 -0.84 1.04 -0.12 1.34 2.08 -0.08 -3.53 119.36 119.26 2jri n ILE 80 Ca 0.16 -0.33 -0.06 0.00 0.56 0.00 0.00 62.75 63.08 2jri n ILE 80 Cb 0.07 -1.43 0.12 0.00 -0.75 0.00 0.00 39.64 37.65 2jri n ILE 80 CO 0.00 0.00 0.00 0.77 0.56 0.00 0.00 176.55 177.88 2jri h SER 81 N -0.33 0.82 1.30 4.38 4.64 -1.56 -2.61 113.55 120.19 2jri h SER 81 Ca -0.44 -0.23 0.00 0.00 -0.47 0.00 0.00 61.79 60.65 2jri h SER 81 Cb 1.53 -0.22 0.00 0.00 -0.31 0.00 0.00 62.40 63.40 2jri h SER 81 CO -0.17 0.91 -0.51 -1.13 -0.87 0.00 0.00 176.83 175.06 2jri h ASN 82 N 0.77 0.00 0.06 4.97 -1.24 -1.73 -3.25 115.58 115.16 2jri h ASN 82 Ca 0.14 -0.05 0.01 0.00 0.71 0.00 0.00 56.30 57.11 2jri h ASN 82 Cb 0.54 0.00 -0.02 0.00 0.73 0.00 0.00 38.32 39.57 2jri h ASN 82 CO 0.03 0.03 -0.12 0.00 -1.29 0.00 0.00 177.43 176.08 2jri h ALA 83 N 2.19 -0.18 0.00 1.57 0.00 -1.51 -0.41 119.26 120.92 2jri h ALA 83 Ca 0.00 -0.01 -0.12 0.00 0.00 0.00 0.00 54.91 54.78 2jri h ALA 83 Cb 0.91 0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.87 2jri h ALA 83 CO 0.00 -0.63 -0.55 -0.07 0.00 0.00 0.00 179.25 178.00 2jri h LEU 84 N -0.23 0.00 -0.44 0.00 -0.00 -1.70 -3.26 115.31 109.68 2jri h LEU 84 Ca 0.02 0.00 -0.04 0.00 -0.00 0.00 0.00 57.88 57.87 2jri h LEU 84 Cb 0.25 0.00 -0.02 0.00 -0.00 0.00 0.00 40.66 40.90 2jri h LEU 84 CO -0.08 0.55 0.12 0.50 -0.00 0.00 0.00 178.44 179.54 2jri h LYS 85 N 0.00 0.69 0.00 1.13 3.64 -1.46 0.21 116.57 120.78 2jri h LYS 85 Ca -0.01 -0.16 0.00 0.00 -1.27 0.00 0.00 60.65 59.22 2jri h LYS 85 Cb 1.31 -0.10 0.00 0.00 -0.41 0.00 0.00 32.23 33.03 2jri h LYS 85 CO 0.07 0.68 0.00 -0.39 -2.27 0.00 0.00 179.45 177.54 2jri h VAL 86 N 0.57 0.00 -0.01 2.00 -1.51 -1.14 -1.81 116.25 114.35 2jri h VAL 86 Ca 0.14 -0.43 0.00 0.00 -1.23 0.00 0.00 66.70 65.18 2jri h VAL 86 Cb 0.29 1.33 0.00 0.00 -2.13 0.00 0.00 31.29 30.78 2jri h VAL 86 CO -0.00 0.00 -0.09 0.79 -1.23 0.00 0.00 177.57 177.04 2jri n TRP 87 N -2.77 0.00 -1.55 5.19 7.02 -0.88 -4.93 117.44 119.52 2jri n TRP 87 Ca 0.01 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.49 2jri n TRP 87 Cb 0.29 -0.03 0.00 0.00 -2.42 0.00 0.00 31.31 29.15 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 1.25 0.49 3.56 6.99 0.00 -0.68 -5.06 105.19 111.74 2jri n GLY 88 Ca 0.16 -0.87 -0.24 0.00 0.00 0.00 0.00 46.02 45.07 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 2.88 0.12 0.99 2.01 0.68 -5.00 118.68 120.35 2jri s LEU 89 Ca 0.00 -0.90 0.06 0.00 0.01 0.00 0.00 54.13 53.30 2jri s LEU 89 Cb 0.00 -1.35 -0.04 0.00 0.01 0.00 0.00 46.19 44.81 2jri s LEU 89 CO 0.00 -0.04 0.00 -0.70 1.01 0.00 0.00 176.35 176.62 2jri s GLU 90 N -3.61 2.50 -0.19 1.70 2.12 -1.09 -3.61 118.70 116.52 2jri s GLU 90 Ca 0.31 -0.92 0.01 0.00 0.36 0.00 0.00 54.97 54.74 2jri s GLU 90 Cb -0.04 -2.48 0.03 0.00 0.26 0.00 0.00 34.13 31.89 2jri s GLU 90 CO 0.18 0.51 -0.18 -1.17 -0.54 0.00 0.00 175.26 174.05 2jri s LEU 91 N -2.51 2.28 -0.18 2.70 2.96 -1.26 0.01 118.68 122.67 2jri s LEU 91 Ca 0.26 -0.74 -0.03 0.00 -0.22 0.00 0.00 54.13 53.40 2jri s LEU 91 Cb -0.11 -1.47 -0.02 0.00 0.50 0.00 0.00 46.19 45.10 2jri s LEU 91 CO 0.18 -0.03 -0.06 -0.63 -1.32 0.00 0.00 176.35 174.49 2jri s ILE 92 N 1.28 3.46 -1.18 6.68 -1.09 0.97 -4.93 121.20 126.39 2jri s ILE 92 Ca 0.03 -0.49 -0.17 0.00 -2.23 0.00 0.00 60.65 57.79 2jri s ILE 92 Cb -0.14 -2.53 0.12 0.00 -1.58 0.00 0.00 42.46 38.33 2jri s ILE 92 CO -0.12 0.47 1.49 -0.22 -1.23 0.00 0.00 174.94 175.34 2jri s LEU 93 N 0.83 4.46 0.47 2.97 2.96 -1.26 -0.24 118.68 128.88 2jri s LEU 93 Ca -0.02 -2.50 0.32 0.00 -0.22 0.00 0.00 54.13 51.72 2jri s LEU 93 Cb -0.15 -2.48 1.62 0.00 0.50 0.00 0.00 46.19 45.68 2jri s LEU 93 CO 0.01 -1.02 1.98 0.15 -1.32 0.00 0.00 176.35 176.15 2jri h PHE 94 N 7.85 0.00 -0.10 5.38 3.57 -1.33 -2.41 116.94 129.89 2jri h PHE 94 Ca 0.32 0.00 -0.08 0.00 3.53 0.00 0.00 57.97 61.74 2jri h PHE 94 Cb 0.91 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 39.64 2jri h PHE 94 CO 1.24 0.00 -0.30 -0.97 -2.23 0.00 0.00 178.31 176.05 2jri h ASN 95 N 0.00 0.19 -3.44 0.41 -1.24 -1.86 -3.31 115.58 106.33 2jri h ASN 95 Ca 0.00 -0.06 -0.54 0.00 0.71 0.00 0.00 56.30 56.41 2jri h ASN 95 Cb 0.15 -0.05 -0.04 0.00 0.73 0.00 0.00 38.32 39.11 2jri h ASN 95 CO 0.00 0.49 0.20 -0.44 -1.29 0.00 0.00 177.43 176.39 2jri s SER 96 N -6.89 7.24 0.42 1.15 0.01 -0.91 -4.89 113.70 109.84 2jri s SER 96 Ca -0.04 1.49 0.25 0.00 1.31 0.00 0.00 55.95 58.95 2jri s SER 96 Cb 0.14 -2.49 1.28 0.00 0.21 0.00 0.00 66.02 65.17 2jri s SER 96 CO 0.75 -0.04 1.68 -0.65 0.41 0.00 0.00 173.24 175.40 2jri h PRO 97 N 5.87 0.21 0.00 12.44 0.11 -1.87 0.30 132.00 149.06 2jri h PRO 97 Ca -0.43 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 65.66 2jri h PRO 97 Cb 1.21 -0.05 -0.00 0.00 0.11 0.00 0.00 31.00 32.27 2jri h PRO 97 CO 0.72 0.14 -0.05 1.05 -0.21 0.00 0.00 178.00 179.65 2jri h GLU 98 N 0.21 0.00 -0.01 1.05 9.09 -1.92 -2.01 114.58 120.99 2jri h GLU 98 Ca 0.73 0.00 0.00 0.00 0.05 0.00 0.00 59.36 60.14 2jri h GLU 98 Cb 2.10 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 29.20 2jri h GLU 98 CO -0.38 0.05 -0.03 0.66 0.05 0.00 0.00 179.01 179.36 2jri n TYR 99 N -3.81 0.00 -0.03 2.06 4.01 0.84 -4.59 117.16 115.64 2jri n TYR 99 Ca -0.03 0.00 -0.10 0.00 -0.16 0.00 0.00 57.90 57.61 2jri n TYR 99 Cb 0.14 0.00 0.07 0.00 -0.31 0.00 0.00 39.34 39.24 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 1.53 -2.76 -0.72 7.27 0.14 -3.81 117.38 119.19 2jri n GLN 100 Ca 0.03 -1.24 -0.03 0.00 0.07 0.00 0.00 57.00 55.82 2jri n GLN 100 Cb 0.14 -1.49 0.06 0.00 2.41 0.00 0.00 30.24 31.36 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 -0.09 1.48 0.05 3.69 1.85 -1.26 -4.87 116.66 117.52 2jri n ARG 101 Ca 0.25 -3.03 0.12 0.00 -1.00 0.00 0.00 57.85 54.18 2jri n ARG 101 Cb 0.93 -1.14 0.10 0.00 -1.05 0.00 0.00 32.46 31.30 2jri n ARG 101 CO 0.00 0.00 0.00 1.47 -0.01 0.00 0.00 177.63 179.09 2jri n LEU 102 N -0.56 0.68 -2.75 2.89 -0.00 -1.25 -4.96 117.00 111.05 2jri n LEU 102 Ca 0.04 0.16 -0.21 0.00 -0.00 0.00 0.00 56.01 56.00 2jri n LEU 102 Cb 0.82 -0.14 0.01 0.00 -0.00 0.00 0.00 43.42 44.11 2jri n LEU 102 CO 0.09 -0.04 -0.12 0.54 -0.00 0.00 0.00 177.39 177.86 2jri n ARG 103 N -2.13 -3.23 -3.94 1.47 3.00 -1.26 -4.99 116.66 105.59 2jri n ARG 103 Ca 0.02 0.86 -0.21 0.00 -0.01 0.00 0.00 57.85 58.51 2jri n ARG 103 Cb 0.45 -5.60 -0.04 0.00 0.00 0.00 0.00 32.46 27.27 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 -3.03 4.03 -0.17 0.55 1.01 -1.26 -5.11 121.20 117.22 2jri s ILE 104 Ca 0.16 -1.36 -0.12 0.00 0.00 0.00 0.00 60.65 59.34 2jri s ILE 104 Cb -0.08 -3.32 -0.05 0.00 0.01 0.00 0.00 42.46 39.03 2jri s ILE 104 CO 0.20 -0.26 0.21 -0.62 0.00 0.00 0.00 174.94 174.48 2jri s ASP 105 N -3.93 6.34 0.55 3.58 2.15 -1.26 -4.99 116.67 119.11 2jri s ASP 105 Ca 0.37 0.40 0.25 0.00 0.43 0.00 0.00 52.55 54.00 2jri s ASP 105 Cb -0.07 -2.14 1.56 0.00 -0.30 0.00 0.00 42.92 41.98 2jri s ASP 105 CO 0.26 0.16 2.17 1.55 -0.17 0.00 0.00 175.17 179.15 2jri h PRO 106 N 6.50 0.00 0.00 4.34 0.13 -1.99 -1.46 132.00 139.52 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 1.16 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.29 2jri h PRO 106 CO 0.74 0.04 -0.26 -0.89 -0.23 0.00 0.00 178.00 177.40 2jri n ILE 107 N -3.98 0.38 0.31 -3.56 5.41 -1.26 -3.13 119.36 113.53 2jri n ILE 107 Ca -0.03 -0.22 0.08 0.00 1.00 0.00 0.00 62.75 63.58 2jri n ILE 107 Cb 0.13 -0.34 0.23 0.00 -0.71 0.00 0.00 39.64 38.95 2jri n ILE 107 CO 0.00 0.00 0.00 -3.20 0.00 0.00 0.00 176.55 173.35 2jri n ASN 108 N -2.04 2.88 -1.74 4.38 5.15 -0.55 -4.90 115.26 118.44 2jri n ASN 108 Ca 0.05 -2.08 0.00 0.00 -0.60 0.00 0.00 54.58 51.95 2jri n ASN 108 Cb 0.41 -0.37 0.00 0.00 -0.53 0.00 0.00 39.78 39.29 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 0.91 1.20 0.00 1.20 -0.58 -1.19 -4.97 120.64 117.22 2jri n GLU 109 Ca 0.17 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.91 2jri n GLU 109 Cb 0.48 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 31.35 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 -0.56 0.00 -3.58 3.49 0.00 -1.26 -4.94 116.66 109.81 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 -0.58 -0.06 0.00 -0.00 0.00 0.00 32.46 31.82 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 -4.41 -0.51 0.00 2.89 1.04 -1.26 -1.78 113.70 109.67 2jri s SER 111 Ca 0.00 0.79 0.01 0.00 0.48 0.00 0.00 55.95 57.23 2jri s SER 111 Cb 0.00 1.33 -0.01 0.00 0.10 0.00 0.00 66.02 67.44 2jri s SER 111 CO 0.00 -0.12 -0.03 0.72 0.98 0.00 0.00 173.24 174.79 2jri s PHE 112 N 1.63 0.31 -0.12 5.02 -0.71 -0.69 -1.02 117.98 122.40 2jri s PHE 112 Ca -0.07 -0.13 0.00 0.00 -1.04 0.00 0.00 56.93 55.69 2jri s PHE 112 Cb -0.04 -0.20 -0.02 0.00 -1.21 0.00 0.00 43.02 41.56 2jri s PHE 112 CO -0.15 -0.03 -0.13 0.42 -1.34 0.00 0.00 175.22 173.99 2jri s ILE 113 N -0.30 3.04 -0.19 -4.49 1.01 0.17 -1.93 121.20 118.50 2jri s ILE 113 Ca -0.01 -0.67 -0.03 0.00 0.00 0.00 0.00 60.65 59.94 2jri s ILE 113 Cb -0.03 -2.26 -0.01 0.00 0.01 0.00 0.00 42.46 40.17 2jri s ILE 113 CO -0.00 0.53 -0.07 0.00 0.00 0.00 0.00 174.94 175.40 2jri s ASN 115 N 1.12 7.08 -0.21 0.00 2.47 -0.80 0.44 114.94 125.04 2jri s ASN 115 Ca 0.01 1.34 0.11 0.00 0.42 0.00 0.00 52.86 54.74 2jri s ASN 115 Cb -0.15 -2.39 0.42 0.00 -1.45 0.00 0.00 41.25 37.69 2jri s ASN 115 CO -0.02 0.18 1.22 0.00 -3.72 0.00 0.00 177.10 174.76 2jri n TYR 116 N 1.31 0.19 -1.94 0.43 9.36 0.14 -1.16 117.16 125.49 2jri n TYR 116 Ca -0.07 -1.55 -0.16 0.00 3.32 0.00 0.00 57.90 59.44 2jri n TYR 116 Cb 0.51 -0.26 -0.03 0.00 -0.63 0.00 0.00 39.34 38.93 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 -1.09 -1.21 0.00 2.98 3.00 -1.26 -4.28 118.16 116.30 2jri n LYS 117 Ca 0.21 0.91 0.00 0.00 -0.00 0.00 0.00 58.31 59.42 2jri n LYS 117 Cb 0.71 -5.21 0.00 0.00 0.00 0.00 0.00 35.03 30.53 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 -2.54 0.00 -4.21 1.64 0.00 -1.26 -5.14 120.64 109.13 2jri n GLU 118 Ca -0.18 0.00 -0.27 0.00 0.00 0.00 0.00 57.16 56.72 2jri n GLU 118 Cb 0.59 0.00 -0.08 0.00 0.00 0.00 0.00 31.44 31.96 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 0.00 2.83 0.02 4.31 3.76 -1.26 -5.13 115.29 119.82 2jri s HIS 119 Ca 0.00 -0.14 0.08 0.00 -0.15 0.00 0.00 55.06 54.85 2jri s HIS 119 Cb 0.00 -1.37 -0.02 0.00 1.11 0.00 0.00 32.58 32.30 2jri s HIS 119 CO 0.00 0.52 -0.24 -1.58 -0.85 0.00 0.00 174.74 172.59 2jri s TRP 120 N -1.73 2.10 -0.54 1.40 0.52 -1.26 0.27 118.94 119.70 2jri s TRP 120 Ca 0.27 -0.40 -0.16 0.00 0.02 0.00 0.00 56.10 55.84 2jri s TRP 120 Cb -0.09 -1.29 0.13 0.00 -1.15 0.00 0.00 33.47 31.07 2jri s TRP 120 CO 0.18 0.06 0.49 -0.06 0.02 0.00 0.00 176.95 177.65 2jri s PHE 121 N -0.72 3.26 -0.68 -1.98 0.40 0.17 -4.82 117.98 113.61 2jri s PHE 121 Ca 0.10 -1.33 -0.27 0.00 -0.60 0.00 0.00 56.93 54.83 2jri s PHE 121 Cb -0.09 -3.78 0.03 0.00 0.51 0.00 0.00 43.02 39.69 2jri s PHE 121 CO 0.01 -1.02 1.24 0.99 0.70 0.00 0.00 175.22 177.14 2jri s THR 122 N 1.59 3.84 -0.43 0.64 2.01 -1.23 -1.86 115.64 120.21 2jri s THR 122 Ca 0.03 0.54 -0.07 0.00 0.31 0.00 0.00 61.69 62.50 2jri s THR 122 Cb -0.30 -4.85 0.10 0.00 0.01 0.00 0.00 72.50 67.46 2jri s THR 122 CO 0.03 -1.67 0.26 -0.69 -0.69 0.00 0.00 174.62 171.85 2jri s VAL 123 N 5.41 3.92 -0.08 3.82 1.01 -0.81 -0.66 120.40 133.01 2jri s VAL 123 Ca 0.37 -1.68 -0.01 0.00 0.00 0.00 0.00 61.98 60.66 2jri s VAL 123 Cb -0.08 -3.52 -0.03 0.00 0.00 0.00 0.00 36.38 32.75 2jri s VAL 123 CO 0.18 -0.61 -0.02 -0.60 0.00 0.00 0.00 175.10 174.05 2jri s ARG 124 N 1.33 2.93 0.08 2.72 6.06 -0.93 -1.70 118.95 129.43 2jri s ARG 124 Ca 0.05 -0.45 -0.30 0.00 -2.50 0.00 0.00 55.73 52.52 2jri s ARG 124 Cb -0.24 -2.74 -0.06 0.00 0.06 0.00 0.00 34.95 31.98 2jri s ARG 124 CO -0.01 0.68 1.19 0.21 -2.50 0.00 0.00 175.30 174.88 2jri s LYS 125 N -0.84 4.45 -0.14 5.12 2.36 -0.73 -2.12 119.74 127.84 2jri s LYS 125 Ca 0.13 1.78 -0.01 0.00 -2.55 0.00 0.00 55.97 55.32 2jri s LYS 125 Cb -0.11 -3.33 0.03 0.00 -1.05 0.00 0.00 37.83 33.37 2jri s LYS 125 CO 0.02 -0.22 -0.06 -0.51 1.55 0.00 0.00 175.35 176.13 2jri s LEU 126 N 0.83 1.36 0.00 5.43 1.02 0.79 -4.83 118.68 123.28 2jri s LEU 126 Ca 0.57 -0.47 0.00 0.00 0.02 0.00 0.00 54.13 54.26 2jri s LEU 126 Cb -0.30 -0.86 0.00 0.00 0.02 0.00 0.00 46.19 45.06 2jri s LEU 126 CO 0.30 -0.15 0.00 0.61 0.02 0.00 0.00 176.35 177.13 2jri n GLY 127 N 4.92 0.47 0.00 -3.19 0.00 -1.06 -1.05 105.19 105.27 2jri n GLY 127 Ca -0.12 0.04 0.00 0.00 0.00 0.00 0.00 46.02 45.94 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 0.06 -2.06 1.61 0.00 -1.26 -4.87 118.16 111.64 2jri n LYS 128 Ca 0.00 0.00 -0.28 0.00 0.00 0.00 0.00 58.31 58.03 2jri n LYS 128 Cb 0.00 -0.02 0.18 0.00 0.00 0.00 0.00 35.03 35.19 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 -0.38 -1.00 -4.21 1.64 3.00 -0.22 -5.00 117.38 111.21 2jri n GLN 129 Ca 0.00 -2.21 -0.18 0.00 -0.01 0.00 0.00 57.00 54.59 2jri n GLN 129 Cb 0.00 -1.19 -0.12 0.00 0.00 0.00 0.00 30.24 28.94 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 -3.69 1.34 -0.01 1.08 0.52 -1.06 -0.15 118.94 116.97 2jri s TRP 130 Ca 0.73 -0.51 -0.00 0.00 0.02 0.00 0.00 56.10 56.34 2jri s TRP 130 Cb -0.02 -0.73 0.02 0.00 -1.15 0.00 0.00 33.47 31.59 2jri s TRP 130 CO 0.50 0.11 0.02 -0.06 0.02 0.00 0.00 176.95 177.54 2jri s PHE 131 N -1.72 0.01 -0.08 -1.98 0.08 -0.90 -1.43 117.98 111.95 2jri s PHE 131 Ca 0.04 0.08 -0.16 0.00 0.12 0.00 0.00 56.93 57.02 2jri s PHE 131 Cb -0.07 -0.11 -0.05 0.00 -0.57 0.00 0.00 43.02 42.22 2jri s PHE 131 CO 0.03 -0.05 0.41 1.21 -0.10 0.00 0.00 175.22 176.71 2jri s ASN 132 N 0.53 6.68 -0.07 1.36 2.47 -1.23 -2.19 114.94 122.49 2jri s ASN 132 Ca -0.04 0.80 0.02 0.00 0.42 0.00 0.00 52.86 54.06 2jri s ASN 132 Cb -0.06 -2.25 0.01 0.00 -1.45 0.00 0.00 41.25 37.50 2jri s ASN 132 CO -0.02 0.16 -0.12 -0.76 -3.72 0.00 0.00 177.10 172.64 2jri s LEU 133 N -0.10 1.63 0.25 3.21 1.43 0.17 -3.18 118.68 122.09 2jri s LEU 133 Ca 0.23 -0.30 -0.20 0.00 -1.03 0.00 0.00 54.13 52.83 2jri s LEU 133 Cb -0.15 -0.82 0.03 0.00 0.03 0.00 0.00 46.19 45.27 2jri s LEU 133 CO 0.10 0.03 0.67 0.21 0.23 0.00 0.00 176.35 177.58 2jri s ASN 134 N 0.70 -0.29 0.00 2.29 2.47 -1.26 -3.49 114.94 115.35 2jri s ASN 134 Ca -0.14 -0.53 0.26 0.00 0.42 0.00 0.00 52.86 52.86 2jri s ASN 134 Cb -0.16 0.69 1.12 0.00 -1.45 0.00 0.00 41.25 41.45 2jri s ASN 134 CO 0.03 -1.25 1.83 -1.20 -3.72 0.00 0.00 177.10 172.79 2jri n SER 135 N -0.43 0.00 0.00 -4.21 7.64 -1.26 -4.17 113.62 111.19 2jri n SER 135 Ca -0.06 0.45 0.00 0.00 1.01 0.00 0.00 58.87 60.27 2jri n SER 135 Cb 0.60 -0.48 0.00 0.00 -1.01 0.00 0.00 64.21 63.32 2jri n SER 135 CO 0.00 0.00 0.00 -0.11 -3.01 0.00 0.00 175.04 171.92 2jri n LEU 136 N -1.48 2.80 -4.63 -3.43 7.94 -1.26 -4.85 117.00 112.10 2jri n LEU 136 Ca 0.07 0.03 -0.48 0.00 -1.11 0.00 0.00 56.01 54.52 2jri n LEU 136 Cb 0.29 -0.01 -0.04 0.00 0.53 0.00 0.00 43.42 44.20 2jri n LEU 136 CO 0.24 -0.01 0.92 0.00 -1.11 0.00 0.00 177.39 177.43 2jri n LEU 137 N -0.53 2.32 -2.08 -1.96 -0.00 -1.26 -4.87 117.00 108.63 2jri n LEU 137 Ca 0.00 1.13 -0.25 0.00 -0.00 0.00 0.00 56.01 56.89 2jri n LEU 137 Cb 0.00 -1.32 0.06 0.00 -0.00 0.00 0.00 43.42 42.16 2jri n LEU 137 CO 0.00 -0.83 1.32 1.07 -0.00 0.00 0.00 177.39 178.96 2jri n THR 138 N 2.11 3.15 0.00 1.47 5.66 -1.26 -4.66 114.28 120.76 2jri n THR 138 Ca 0.15 -2.21 0.00 0.00 -3.05 0.00 0.00 64.05 58.94 2jri n THR 138 Cb 0.27 -1.26 0.00 0.00 -1.55 0.00 0.00 70.33 67.79 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 -0.21 2.14 3.67 1.09 0.00 -1.26 -5.12 105.19 105.50 2jri n GLY 139 Ca 0.44 0.04 -0.43 0.00 0.00 0.00 0.00 46.02 46.07 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 -0.28 2.75 -2.15 1.61 -0.02 -1.26 -4.91 135.00 130.73 2jri n PRO 140 Ca 0.00 1.01 -0.43 0.00 -2.02 0.00 0.00 63.50 62.06 2jri n PRO 140 Cb 0.00 -2.93 -0.03 0.00 -0.02 0.00 0.00 33.50 30.52 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 4.04 4.12 -0.57 -0.52 2.02 -1.19 -4.84 118.70 121.76 2jri s GLU 141 Ca 0.88 1.93 -0.26 0.00 0.02 0.00 0.00 54.97 57.54 2jri s GLU 141 Cb -0.49 -3.93 -0.04 0.00 0.10 0.00 0.00 34.13 29.78 2jri s GLU 141 CO 0.43 -0.90 2.03 -1.17 0.02 0.00 0.00 175.26 175.67 2jri s LEU 142 N 4.12 3.33 -0.40 1.80 2.96 -1.26 -3.47 118.68 125.76 2jri s LEU 142 Ca 0.68 0.58 -0.16 0.00 -0.22 0.00 0.00 54.13 55.01 2jri s LEU 142 Cb -0.28 -2.53 0.01 0.00 0.50 0.00 0.00 46.19 43.89 2jri s LEU 142 CO 0.25 -2.54 0.36 -0.63 -1.32 0.00 0.00 176.35 172.48 2jri s ILE 143 N 10.06 5.17 0.76 6.68 1.01 -0.52 -5.04 121.20 139.32 2jri s ILE 143 Ca 0.77 -0.36 -0.07 0.00 0.00 0.00 0.00 60.65 60.99 2jri s ILE 143 Cb -0.14 -3.94 0.10 0.00 0.01 0.00 0.00 42.46 38.49 2jri s ILE 143 CO 0.22 -0.29 1.07 -0.94 0.00 0.00 0.00 174.94 175.00 2jri s SER 144 N 1.75 4.39 0.05 3.58 1.04 -1.26 -2.56 113.70 120.69 2jri s SER 144 Ca 0.09 0.25 -0.35 0.00 0.48 0.00 0.00 55.95 56.42 2jri s SER 144 Cb -0.18 -0.73 -0.20 0.00 0.10 0.00 0.00 66.02 65.02 2jri s SER 144 CO 0.12 -1.87 1.47 0.44 0.98 0.00 0.00 173.24 174.39 2jri h ASP 145 N -0.78 -1.05 -0.82 7.02 5.19 -1.97 0.71 116.42 124.72 2jri h ASP 145 Ca -0.43 0.03 -0.04 0.00 -0.62 0.00 0.00 57.03 55.98 2jri h ASP 145 Cb 1.29 0.27 -0.04 0.00 0.18 0.00 0.00 39.33 41.04 2jri h ASP 145 CO 0.52 -0.72 0.35 0.74 -3.12 0.00 0.00 179.24 177.01 2jri h THR 146 N -1.31 1.26 -0.58 0.35 2.02 -2.01 -2.60 112.91 110.05 2jri h THR 146 Ca -0.13 -0.79 -0.05 0.00 0.77 0.00 0.00 66.41 66.21 2jri h THR 146 Cb 0.96 0.26 -0.03 0.00 -1.74 0.00 0.00 68.15 67.60 2jri h THR 146 CO 0.21 0.33 0.16 0.22 0.37 0.00 0.00 175.52 176.81 2jri h TYR 147 N 1.18 0.91 -0.71 3.16 3.20 -1.94 -2.42 116.97 120.35 2jri h TYR 147 Ca 0.28 -0.08 -0.01 0.00 3.14 0.00 0.00 58.73 62.06 2jri h TYR 147 Cb 0.18 -0.27 -0.03 0.00 1.54 0.00 0.00 36.73 38.15 2jri h TYR 147 CO 0.02 0.75 0.42 1.25 -1.64 0.00 0.00 178.16 178.96 2jri h LEU 148 N 0.86 0.86 -1.03 2.82 5.85 -0.46 0.51 115.31 124.71 2jri h LEU 148 Ca 0.19 -0.05 -0.04 0.00 0.84 0.00 0.00 57.88 58.82 2jri h LEU 148 Cb 0.28 -0.22 -0.03 0.00 0.37 0.00 0.00 40.66 41.06 2jri h LEU 148 CO -0.01 0.66 0.19 0.00 -0.34 0.00 0.00 178.44 178.95 2jri h ALA 149 N 1.48 1.22 0.12 1.25 0.00 -1.27 0.05 119.26 122.11 2jri h ALA 149 Ca 0.26 -0.19 -0.28 0.00 0.00 0.00 0.00 54.91 54.70 2jri h ALA 149 Cb -0.03 -0.24 0.02 0.00 0.00 0.00 0.00 17.79 17.54 2jri h ALA 149 CO -0.05 0.55 -1.22 1.25 0.00 0.00 0.00 179.25 179.78 2jri h LEU 150 N 0.87 0.66 -0.20 0.00 5.85 -1.15 -3.13 115.31 118.21 2jri h LEU 150 Ca 0.20 -0.64 0.02 0.00 0.84 0.00 0.00 57.88 58.30 2jri h LEU 150 Cb 0.24 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 41.03 2jri h LEU 150 CO -0.01 1.47 0.05 0.15 -0.34 0.00 0.00 178.44 179.76 2jri h PHE 151 N 0.19 0.09 -0.66 1.25 3.57 0.39 0.18 116.94 121.95 2jri h PHE 151 Ca -0.16 0.01 0.04 0.00 3.53 0.00 0.00 57.97 61.39 2jri h PHE 151 Cb 1.90 -0.01 -0.04 0.00 2.79 0.00 0.00 35.95 40.59 2jri h PHE 151 CO 0.09 0.04 0.40 -0.07 -2.23 0.00 0.00 178.31 176.54 2jri h LEU 152 N 0.14 0.64 -0.46 0.59 -0.00 -1.08 -1.27 115.31 113.87 2jri h LEU 152 Ca 0.09 0.01 -0.06 0.00 -0.00 0.00 0.00 57.88 57.91 2jri h LEU 152 Cb 0.07 -0.13 -0.02 0.00 -0.00 0.00 0.00 40.66 40.59 2jri h LEU 152 CO -0.11 0.44 0.03 0.00 -0.00 0.00 0.00 178.44 178.80 2jri h ALA 153 N 1.30 0.61 -0.70 1.53 0.00 -1.39 -2.83 119.26 117.78 2jri h ALA 153 Ca 0.27 -0.25 0.05 0.00 0.00 0.00 0.00 54.91 54.98 2jri h ALA 153 Cb 0.06 -0.17 -0.05 0.00 0.00 0.00 0.00 17.79 17.63 2jri h ALA 153 CO -0.12 0.38 0.41 1.96 0.00 0.00 0.00 179.25 181.88 2jri h GLN 154 N 0.64 0.74 -0.88 0.00 1.08 -0.09 0.13 115.11 116.73 2jri h GLN 154 Ca 0.13 -0.04 -0.01 0.00 -1.45 0.00 0.00 58.65 57.28 2jri h GLN 154 Cb 0.45 -0.17 -0.04 0.00 -0.05 0.00 0.00 27.48 27.67 2jri h GLN 154 CO 0.02 0.49 0.50 -0.07 -0.95 0.00 0.00 178.83 178.82 2jri h LEU 155 N 0.76 1.08 -0.26 1.46 3.38 -1.11 0.46 115.31 121.08 2jri h LEU 155 Ca 0.31 -0.08 -0.12 0.00 0.09 0.00 0.00 57.88 58.07 2jri h LEU 155 Cb 0.15 -0.27 -0.00 0.00 0.09 0.00 0.00 40.66 40.62 2jri h LEU 155 CO -0.16 0.85 -0.32 1.56 0.09 0.00 0.00 178.44 180.46 2jri h GLN 156 N 1.23 0.68 -0.70 1.13 4.20 -1.12 0.17 115.11 120.70 2jri h GLN 156 Ca 0.31 -0.38 -0.07 0.00 0.06 0.00 0.00 58.65 58.57 2jri h GLN 156 Cb -0.01 0.02 -0.03 0.00 0.30 0.00 0.00 27.48 27.77 2jri h GLN 156 CO -0.05 1.00 0.17 1.96 -0.67 0.00 0.00 178.83 181.23 2jri h GLN 157 N 0.41 1.11 0.25 1.46 4.20 -0.65 -3.19 115.11 118.70 2jri h GLN 157 Ca 0.03 -0.26 -0.01 0.00 0.06 0.00 0.00 58.65 58.47 2jri h GLN 157 Cb 0.90 -0.15 0.00 0.00 0.30 0.00 0.00 27.48 28.53 2jri h GLN 157 CO 0.08 0.98 -0.12 1.49 -0.67 0.00 0.00 178.83 180.58 2jri h GLU 158 N 1.06 -0.33 0.00 1.46 4.57 -0.89 -3.49 114.58 116.96 2jri h GLU 158 Ca 0.22 0.02 0.00 0.00 -1.18 0.00 0.00 59.36 58.42 2jri h GLU 158 Cb 0.36 0.07 0.00 0.00 -0.16 0.00 0.00 28.75 29.03 2jri h GLU 158 CO 0.00 0.03 0.00 0.41 -1.18 0.00 0.00 179.01 178.28 2jri n GLY 159 N 0.23 0.42 0.00 1.92 0.00 -0.41 -5.10 105.19 102.25 2jri n GLY 159 Ca -0.08 -0.08 0.00 0.00 0.00 0.00 0.00 46.02 45.85 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 -0.86 -3.30 1.61 4.02 -0.09 -4.85 117.16 113.70 2jri n TYR 160 Ca 0.00 0.00 -0.22 0.00 -0.01 0.00 0.00 57.90 57.67 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 1.11 -0.50 7.72 0.01 -0.31 -4.88 113.70 115.84 2jri s SER 161 Ca 0.00 -2.56 -0.27 0.00 1.31 0.00 0.00 55.95 54.43 2jri s SER 161 Cb 0.00 0.07 -0.01 0.00 0.21 0.00 0.00 66.02 66.29 2jri s SER 161 CO 0.00 -0.18 1.75 -0.63 0.41 0.00 0.00 173.24 174.59 2jri s ILE 162 N 0.49 3.49 -0.49 1.44 1.01 -1.26 -1.91 121.20 123.96 2jri s ILE 162 Ca 0.29 0.40 -0.12 0.00 0.00 0.00 0.00 60.65 61.22 2jri s ILE 162 Cb -0.03 -3.93 0.12 0.00 0.01 0.00 0.00 42.46 38.63 2jri s ILE 162 CO -0.13 -0.78 0.40 -0.36 0.00 0.00 0.00 174.94 174.07 2jri s PHE 163 N 7.74 3.36 -0.13 3.97 0.08 0.10 -1.02 117.98 132.09 2jri s PHE 163 Ca 0.69 -1.65 -0.15 0.00 0.12 0.00 0.00 56.93 55.93 2jri s PHE 163 Cb -0.15 -3.59 -0.05 0.00 -0.57 0.00 0.00 43.02 38.66 2jri s PHE 163 CO 0.26 -1.00 0.37 0.54 -0.10 0.00 0.00 175.22 175.29 2jri s VAL 164 N 1.45 5.24 0.10 -0.44 0.11 0.67 -0.66 120.40 126.88 2jri s VAL 164 Ca 0.05 0.72 -0.23 0.00 -2.93 0.00 0.00 61.98 59.59 2jri s VAL 164 Cb -0.27 -3.70 -0.07 0.00 -1.53 0.00 0.00 36.38 30.80 2jri s VAL 164 CO 0.01 0.38 0.68 -0.69 -3.33 0.00 0.00 175.10 172.15 2jri s VAL 165 N 0.38 4.60 -0.02 2.04 1.01 -0.19 -0.02 120.40 128.19 2jri s VAL 165 Ca 0.21 1.47 0.03 0.00 0.00 0.00 0.00 61.98 63.69 2jri s VAL 165 Cb -0.14 -4.03 -0.03 0.00 0.00 0.00 0.00 36.38 32.18 2jri s VAL 165 CO 0.07 0.51 -0.09 -0.54 0.00 0.00 0.00 175.10 175.04 2jri s LYS 166 N -0.91 2.55 0.00 2.72 -0.14 0.10 -4.44 119.74 119.62 2jri s LYS 166 Ca 0.33 -0.69 0.00 0.00 -1.36 0.00 0.00 55.97 54.25 2jri s LYS 166 Cb -0.21 -2.48 0.00 0.00 -1.68 0.00 0.00 37.83 33.46 2jri s LYS 166 CO 0.22 0.62 0.00 0.41 -0.76 0.00 0.00 175.35 175.84 2jri n GLY 167 N 1.88 -1.07 3.61 -3.33 0.00 -1.26 -2.68 105.19 102.34 2jri n GLY 167 Ca -0.16 -2.24 -0.40 0.00 0.00 0.00 0.00 46.02 43.22 2jri n GLY 167 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2jri s ASP 168 N -0.85 6.35 0.11 1.61 2.15 -1.26 -4.89 116.67 119.89 2jri s ASP 168 Ca 0.00 0.39 0.04 0.00 0.43 0.00 0.00 52.55 53.42 2jri s ASP 168 Cb 0.00 -2.25 -0.04 0.00 -0.30 0.00 0.00 42.92 40.33 2jri s ASP 168 CO 0.00 -0.26 0.05 -0.76 -0.17 0.00 0.00 175.17 174.03 2jri s LEU 169 N 2.22 3.62 0.26 -1.34 1.02 -1.26 -5.04 118.68 118.15 2jri s LEU 169 Ca 0.19 -0.13 -0.30 0.00 0.02 0.00 0.00 54.13 53.90 2jri s LEU 169 Cb -0.16 -2.31 -0.14 0.00 0.02 0.00 0.00 46.19 43.61 2jri s LEU 169 CO 0.10 0.15 1.20 -0.81 0.02 0.00 0.00 176.35 177.01 2jri n PRO 170 N 0.33 1.64 -4.23 1.29 -0.04 -1.26 -5.00 135.00 127.72 2jri n PRO 170 Ca -0.10 0.58 -0.27 0.00 -0.04 0.00 0.00 63.50 63.67 2jri n PRO 170 Cb 0.52 -2.09 -0.08 0.00 -0.04 0.00 0.00 33.50 31.81 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 -0.15 4.58 0.26 3.54 -4.77 -1.26 -4.68 116.67 114.19 2jri s ASP 171 Ca 0.64 -0.44 0.01 0.00 -3.30 0.00 0.00 52.55 49.45 2jri s ASP 171 Cb -0.70 -0.91 0.01 0.00 -1.09 0.00 0.00 42.92 40.23 2jri s ASP 171 CO 0.56 0.11 0.06 0.00 0.70 0.00 0.00 175.17 176.59 2jri h GLU 173 N 0.00 0.79 0.00 0.00 4.57 -1.89 -1.53 114.58 116.52 2jri h GLU 173 Ca -0.20 -0.05 -0.00 0.00 -1.18 0.00 0.00 59.36 57.93 2jri h GLU 173 Cb 0.64 -0.18 -0.00 0.00 -0.16 0.00 0.00 28.75 29.05 2jri h GLU 173 CO 0.33 0.52 -0.01 0.00 -1.18 0.00 0.00 179.01 178.68 2jri h ALA 174 N 1.61 1.15 0.00 2.92 0.00 -1.94 0.13 119.26 123.13 2jri h ALA 174 Ca 0.26 -0.01 -0.13 0.00 0.00 0.00 0.00 54.91 55.03 2jri h ALA 174 Cb 0.02 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 2jri h ALA 174 CO -0.07 0.01 -1.25 0.22 0.00 0.00 0.00 179.25 178.16 2jri h ASP 175 N 0.00 0.00 0.67 0.00 3.58 -1.60 -2.98 116.42 116.09 2jri h ASP 175 Ca -0.00 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.45 2jri h ASP 175 Cb 0.05 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.10 2jri h ASP 175 CO 0.00 0.44 -1.23 0.00 -2.88 0.00 0.00 179.24 175.57 2jri n GLN 176 N -2.87 0.56 -0.00 0.28 6.02 -0.20 -2.58 117.38 118.59 2jri n GLN 176 Ca -0.07 0.03 0.08 0.00 -0.01 0.00 0.00 57.00 57.03 2jri n GLN 176 Cb 0.77 -1.71 -0.14 0.00 1.02 0.00 0.00 30.24 30.18 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 -2.45 0.19 -1.28 1.08 -0.00 0.30 -4.32 117.00 110.51 2jri n LEU 177 Ca -0.01 0.08 -0.01 0.00 -0.00 0.00 0.00 56.01 56.07 2jri n LEU 177 Cb 0.53 0.06 0.00 0.00 -0.00 0.00 0.00 43.42 44.01 2jri n LEU 177 CO 0.41 0.04 0.77 -0.11 -0.00 0.00 0.00 177.39 178.51 2jri n LEU 178 N -2.43 4.28 -0.14 1.47 -0.00 -1.13 -3.64 117.00 115.42 2jri n LEU 178 Ca -0.07 -2.01 0.11 0.00 -0.00 0.00 0.00 56.01 54.03 2jri n LEU 178 Cb 0.66 -0.83 0.00 0.00 -0.00 0.00 0.00 43.42 43.25 2jri n LEU 178 CO 0.44 0.78 0.17 0.00 -0.00 0.00 0.00 177.39 178.78 2jri n GLN 179 N 0.98 0.35 -2.25 1.96 1.13 -1.26 -3.91 117.38 114.38 2jri n GLN 179 Ca 0.01 -0.28 -0.00 0.00 -1.94 0.00 0.00 57.00 54.79 2jri n GLN 179 Cb 0.51 -1.49 0.04 0.00 0.11 0.00 0.00 30.24 29.41 2jri n GLN 179 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2jri n MET 180 N -1.08 1.02 -3.97 -1.09 0.00 -1.24 -5.04 117.12 105.71 2jri n MET 180 Ca 0.06 -2.43 -0.35 0.00 0.00 0.00 0.00 57.70 54.98 2jri n MET 180 Cb 0.37 -0.59 -0.14 0.00 0.00 0.00 0.00 33.22 32.85 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 -1.69 3.31 0.00 3.17 -1.09 -1.26 -5.16 121.20 118.48 2jri s ILE 181 Ca 0.23 -0.52 0.00 0.00 -2.23 0.00 0.00 60.65 58.13 2jri s ILE 181 Cb 0.33 -2.50 0.00 0.00 -1.58 0.00 0.00 42.46 38.71 2jri s ILE 181 CO -0.09 0.43 0.00 -1.14 -1.23 0.00 0.00 174.94 172.92