#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2rii n GLY 4 N 0.00 2.95 0.20 0.46 0.00 -1.23 -1.43 105.19 106.14 2rii n GLY 4 Ca 0.00 -0.15 -0.14 0.00 0.00 0.00 0.00 46.02 45.74 2rii n GLY 4 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 2rii h ASN 5 N 2.07 0.72 -0.88 1.61 4.21 -1.71 -3.46 115.58 118.13 2rii h ASN 5 Ca 0.00 -0.49 -0.80 0.00 1.21 0.00 0.00 56.30 56.21 2rii h ASN 5 Cb 0.00 -0.20 -0.00 0.00 -1.12 0.00 0.00 38.32 36.99 2rii h ASN 5 CO 0.00 1.07 0.96 0.00 -1.29 0.00 0.00 177.43 178.17 2rii n ALA 6 N -2.50 -0.47 -3.44 -0.83 0.00 -0.51 -4.92 120.51 107.84 2rii n ALA 6 Ca -0.05 0.35 -0.26 0.00 0.00 0.00 0.00 53.44 53.48 2rii n ALA 6 Cb 0.48 -2.09 -0.17 0.00 0.00 0.00 0.00 19.45 17.68 2rii n ALA 6 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 2rii s LYS 7 N 4.18 1.95 0.39 0.00 2.20 -1.26 -2.13 119.74 125.07 2rii s LYS 7 Ca 1.08 -0.50 -0.26 0.00 -0.36 0.00 0.00 55.97 55.93 2rii s LYS 7 Cb -1.34 -1.59 -0.09 0.00 -1.51 0.00 0.00 37.83 33.30 2rii s LYS 7 CO 0.71 0.04 1.24 0.42 -0.36 0.00 0.00 175.35 177.40 2rii s ILE 8 N 0.66 2.88 0.00 5.43 1.01 -1.26 -2.53 121.20 127.38 2rii s ILE 8 Ca -0.14 0.78 0.00 0.00 0.00 0.00 0.00 60.65 61.28 2rii s ILE 8 Cb -0.16 -3.45 0.00 0.00 0.01 0.00 0.00 42.46 38.86 2rii s ILE 8 CO 0.04 0.10 0.00 0.61 0.00 0.00 0.00 174.94 175.69 2rii n GLY 9 N 0.69 2.76 3.73 6.18 0.00 -0.28 -4.98 105.19 113.29 2rii n GLY 9 Ca 0.04 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.83 2rii n GLY 9 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2rii s HIS 10 N -2.10 2.91 0.61 1.61 3.76 -1.05 -4.86 115.29 116.17 2rii s HIS 10 Ca 0.00 -0.16 -0.19 0.00 -0.15 0.00 0.00 55.06 54.56 2rii s HIS 10 Cb 0.00 -1.30 -0.03 0.00 1.11 0.00 0.00 32.58 32.36 2rii s HIS 10 CO 0.00 0.57 1.21 -2.30 -0.85 0.00 0.00 174.74 173.36 2rii n PRO 11 N -1.00 1.17 -2.51 8.40 -0.02 -1.26 -1.85 135.00 137.92 2rii n PRO 11 Ca -0.07 0.45 -0.42 0.00 -2.02 0.00 0.00 63.50 61.44 2rii n PRO 11 Cb 0.58 -2.43 -0.03 0.00 -0.02 0.00 0.00 33.50 31.60 2rii n PRO 11 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2rii s ALA 12 N -1.40 3.33 -0.80 3.55 0.00 -0.52 -4.67 121.76 121.24 2rii s ALA 12 Ca 0.78 0.76 -0.24 0.00 0.00 0.00 0.00 51.96 53.27 2rii s ALA 12 Cb -0.40 -3.41 -0.18 0.00 0.00 0.00 0.00 23.12 19.13 2rii s ALA 12 CO 0.44 -0.36 2.43 -2.30 0.00 0.00 0.00 175.76 175.98 2rii n PRO 13 N 3.77 0.44 -0.76 0.00 -0.02 -1.26 -4.88 135.00 132.28 2rii n PRO 13 Ca 0.08 -0.21 -0.32 0.00 -2.02 0.00 0.00 63.50 61.02 2rii n PRO 13 Cb 0.48 -2.49 0.13 0.00 -0.02 0.00 0.00 33.50 31.60 2rii n PRO 13 CO 0.00 0.00 0.00 -1.71 1.98 0.00 0.00 175.50 175.77 2rii n ASN 14 N 13.04 -1.72 -3.43 2.55 5.15 -1.26 -5.02 115.26 124.57 2rii n ASN 14 Ca 0.53 0.31 -0.12 0.00 -0.60 0.00 0.00 54.58 54.70 2rii n ASN 14 Cb 0.30 -1.24 -0.02 0.00 -0.53 0.00 0.00 39.78 38.29 2rii n ASN 14 CO 0.00 0.00 0.00 0.72 1.40 0.00 0.00 177.26 179.38 2rii s PHE 15 N -2.43 -0.54 -0.19 1.20 -0.12 -1.26 -5.01 117.98 109.64 2rii s PHE 15 Ca 0.59 0.38 -0.04 0.00 -0.05 0.00 0.00 56.93 57.81 2rii s PHE 15 Cb -0.21 0.55 0.09 0.00 -0.63 0.00 0.00 43.02 42.82 2rii s PHE 15 CO 0.66 -0.82 0.22 0.21 -0.05 0.00 0.00 175.22 175.44 2rii s LYS 16 N -3.55 0.18 0.16 1.99 2.20 -1.26 -2.53 119.74 116.92 2rii s LYS 16 Ca 0.00 0.30 -0.08 0.00 -0.36 0.00 0.00 55.97 55.84 2rii s LYS 16 Cb -0.01 -0.98 -0.01 0.00 -1.51 0.00 0.00 37.83 35.32 2rii s LYS 16 CO -0.11 -0.58 0.25 0.00 -0.36 0.00 0.00 175.35 174.54 2rii s ALA 17 N 2.34 0.14 -0.10 3.13 0.00 -0.02 -4.93 121.76 122.32 2rii s ALA 17 Ca 0.06 -0.98 -0.30 0.00 0.00 0.00 0.00 51.96 50.74 2rii s ALA 17 Cb -0.15 0.87 -0.02 0.00 0.00 0.00 0.00 23.12 23.83 2rii s ALA 17 CO -0.11 -0.63 1.10 0.99 0.00 0.00 0.00 175.76 177.11 2rii s THR 18 N -3.98 4.55 -0.03 0.00 2.01 -1.26 -0.99 115.64 115.94 2rii s THR 18 Ca 0.19 1.84 0.07 0.00 0.31 0.00 0.00 61.69 64.10 2rii s THR 18 Cb 0.04 -4.18 -0.02 0.00 0.01 0.00 0.00 72.50 68.35 2rii s THR 18 CO 0.01 -0.03 -0.25 0.00 -0.69 0.00 0.00 174.62 173.66 2rii s ALA 19 N 2.31 2.11 -0.31 7.40 0.00 -0.94 -2.44 121.76 129.88 2rii s ALA 19 Ca 0.51 -1.08 -0.26 0.00 0.00 0.00 0.00 51.96 51.13 2rii s ALA 19 Cb -0.20 -0.56 0.01 0.00 0.00 0.00 0.00 23.12 22.36 2rii s ALA 19 CO 0.18 0.49 0.94 0.08 0.00 0.00 0.00 175.76 177.45 2rii s VAL 20 N -0.50 4.65 0.68 0.00 1.01 -0.44 -2.54 120.40 123.26 2rii s VAL 20 Ca 0.07 1.51 -0.07 0.00 0.00 0.00 0.00 61.98 63.48 2rii s VAL 20 Cb -0.11 -4.29 0.04 0.00 0.00 0.00 0.00 36.38 32.03 2rii s VAL 20 CO 0.00 -0.35 1.01 -0.04 0.00 0.00 0.00 175.10 175.71 2rii s MET 21 N 3.31 2.46 0.62 2.72 1.00 -1.01 -0.63 119.30 127.76 2rii s MET 21 Ca 0.39 -0.06 0.29 0.00 0.00 0.00 0.00 55.69 56.31 2rii s MET 21 Cb -0.13 -2.16 1.55 0.00 0.00 0.00 0.00 34.83 34.09 2rii s MET 21 CO 0.13 -1.09 1.93 -1.35 0.00 0.00 0.00 175.02 174.64 2rii h PRO 22 N -0.53 0.00 0.00 2.03 0.11 -1.81 -3.04 132.00 128.76 2rii h PRO 22 Ca -0.45 0.00 -0.22 0.00 0.11 0.00 0.00 66.00 65.44 2rii h PRO 22 Cb 1.29 0.00 -0.04 0.00 0.11 0.00 0.00 31.00 32.37 2rii h PRO 22 CO 0.61 0.00 -1.27 0.38 -0.21 0.00 0.00 178.00 177.51 2rii h ASP 23 N 0.00 0.00 0.00 -2.05 3.04 -1.93 -3.42 116.42 112.06 2rii h ASP 23 Ca 0.12 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.91 2rii h ASP 23 Cb 0.91 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 39.20 2rii h ASP 23 CO -0.00 0.87 0.00 0.61 -2.04 0.00 0.00 179.24 178.68 2rii n GLY 24 N 1.42 1.20 3.80 7.15 0.00 -1.15 -5.13 105.19 112.48 2rii n GLY 24 Ca -0.08 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.65 2rii n GLY 24 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2rii s GLN 25 N 0.00 2.98 0.60 1.61 -0.21 -1.26 -4.86 119.66 118.51 2rii s GLN 25 Ca 0.00 -0.69 -0.15 0.00 0.02 0.00 0.00 55.36 54.53 2rii s GLN 25 Cb 0.00 -2.76 -0.03 0.00 1.00 0.00 0.00 33.01 31.22 2rii s GLN 25 CO 0.00 0.55 1.06 -0.06 -2.12 0.00 0.00 175.29 174.72 2rii s PHE 26 N -1.49 2.98 -0.30 0.91 0.08 -1.26 -2.41 117.98 116.49 2rii s PHE 26 Ca 0.31 1.51 -0.10 0.00 0.12 0.00 0.00 56.93 58.76 2rii s PHE 26 Cb -0.12 -3.01 0.17 0.00 -0.57 0.00 0.00 43.02 39.50 2rii s PHE 26 CO 0.23 -1.15 0.88 0.21 -0.10 0.00 0.00 175.22 175.29 2rii s LYS 27 N -4.14 0.35 0.01 0.44 2.20 -1.05 -4.94 119.74 112.60 2rii s LYS 27 Ca 0.63 0.72 -0.30 0.00 -0.36 0.00 0.00 55.97 56.67 2rii s LYS 27 Cb -0.16 0.42 -0.07 0.00 -1.51 0.00 0.00 37.83 36.51 2rii s LYS 27 CO 0.38 -0.28 1.65 -0.51 -0.36 0.00 0.00 175.35 176.24 2rii s ASP 28 N 2.77 6.64 0.26 1.43 1.01 -1.26 -2.22 116.67 125.30 2rii s ASP 28 Ca 0.04 2.36 0.01 0.00 0.71 0.00 0.00 52.55 55.67 2rii s ASP 28 Cb -0.10 -2.55 -0.05 0.00 1.01 0.00 0.00 42.92 41.23 2rii s ASP 28 CO -0.16 -0.90 0.11 0.27 0.21 0.00 0.00 175.17 174.70 2rii s ILE 29 N 3.34 0.46 0.03 0.77 -4.36 -0.16 -4.95 121.20 116.32 2rii s ILE 29 Ca 0.74 -2.00 -0.00 0.00 -0.26 0.00 0.00 60.65 59.13 2rii s ILE 29 Cb -0.36 -2.60 -0.03 0.00 1.25 0.00 0.00 42.46 40.72 2rii s ILE 29 CO 0.31 0.00 -0.04 -0.94 0.24 0.00 0.00 174.94 174.52 2rii s SER 30 N -3.30 0.41 0.54 4.36 1.04 -1.26 -0.84 113.70 114.64 2rii s SER 30 Ca 0.38 -0.67 0.25 0.00 0.48 0.00 0.00 55.95 56.39 2rii s SER 30 Cb 0.07 0.12 1.54 0.00 0.10 0.00 0.00 66.02 67.86 2rii s SER 30 CO 0.14 -0.39 2.16 0.25 0.98 0.00 0.00 173.24 176.39 2rii h LEU 31 N 4.13 0.00 -1.03 2.42 5.85 -1.89 -1.95 115.31 122.84 2rii h LEU 31 Ca -0.33 0.00 0.09 0.00 0.84 0.00 0.00 57.88 58.48 2rii h LEU 31 Cb 1.19 0.00 -0.08 0.00 0.37 0.00 0.00 40.66 42.14 2rii h LEU 31 CO 0.49 0.05 0.64 0.28 -0.34 0.00 0.00 178.44 179.56 2rii h SER 32 N 0.00 0.97 0.00 1.25 0.02 -1.97 -3.08 113.55 110.74 2rii h SER 32 Ca -0.00 0.03 0.00 0.00 -0.84 0.00 0.00 61.79 60.98 2rii h SER 32 Cb 0.12 -0.17 0.00 0.00 0.14 0.00 0.00 62.40 62.49 2rii h SER 32 CO 0.01 0.57 0.16 0.44 -1.14 0.00 0.00 176.83 176.87 2rii h ASP 33 N 1.07 0.00 -0.02 3.07 3.32 -1.76 0.45 116.42 122.55 2rii h ASP 33 Ca 0.46 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.51 2rii h ASP 33 Cb 0.34 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.89 2rii h ASP 33 CO -0.22 0.00 -0.05 -1.22 -1.72 0.00 0.00 179.24 176.04 2rii n TYR 34 N -2.54 0.00 -1.72 4.55 4.02 -1.16 -4.96 117.16 115.35 2rii n TYR 34 Ca -0.02 0.00 -0.60 0.00 -0.01 0.00 0.00 57.90 57.27 2rii n TYR 34 Cb 0.20 0.00 -0.08 0.00 -0.02 0.00 0.00 39.34 39.44 2rii n TYR 34 CO 0.00 0.00 0.00 1.17 -1.01 0.00 0.00 176.86 177.02 2rii n LYS 35 N 0.68 0.81 0.00 -0.72 3.00 0.16 -0.09 118.16 121.99 2rii n LYS 35 Ca 0.08 0.30 0.00 0.00 -0.00 0.00 0.00 58.31 58.69 2rii n LYS 35 Cb 0.36 -1.92 0.00 0.00 0.00 0.00 0.00 35.03 33.47 2rii n LYS 35 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 2rii n GLY 36 N 4.06 1.01 3.18 3.14 0.00 0.52 -5.04 105.19 112.06 2rii n GLY 36 Ca 0.27 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 46.08 2rii n GLY 36 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2rii s LYS 37 N -0.43 1.08 0.17 1.61 1.02 0.87 -4.83 119.74 119.22 2rii s LYS 37 Ca 0.00 -0.84 -0.31 0.00 0.02 0.00 0.00 55.97 54.84 2rii s LYS 37 Cb 0.00 -1.13 -0.09 0.00 -0.52 0.00 0.00 37.83 36.09 2rii s LYS 37 CO 0.00 0.28 1.46 0.71 -0.92 0.00 0.00 175.35 176.88 2rii s TYR 38 N -0.86 3.13 -0.15 3.18 1.51 -1.00 -3.69 117.35 119.47 2rii s TYR 38 Ca 0.03 0.88 -0.01 0.00 -1.01 0.00 0.00 57.07 56.96 2rii s TYR 38 Cb -0.08 -3.79 -0.01 0.00 -0.11 0.00 0.00 41.96 37.96 2rii s TYR 38 CO 0.02 -2.76 -0.11 0.08 -1.11 0.00 0.00 175.55 171.66 2rii s VAL 39 N 0.78 3.14 -0.34 0.71 1.01 -0.39 -1.20 120.40 124.11 2rii s VAL 39 Ca 0.65 -0.62 -0.14 0.00 0.00 0.00 0.00 61.98 61.86 2rii s VAL 39 Cb -0.40 -2.34 -0.01 0.00 0.00 0.00 0.00 36.38 33.62 2rii s VAL 39 CO 0.34 0.51 0.32 -0.69 0.00 0.00 0.00 175.10 175.58 2rii s VAL 40 N 0.55 5.21 -0.18 2.92 1.01 -1.01 -0.60 120.40 128.31 2rii s VAL 40 Ca -0.07 -0.05 -0.00 0.00 0.00 0.00 0.00 61.98 61.85 2rii s VAL 40 Cb -0.15 -3.79 0.01 0.00 0.00 0.00 0.00 36.38 32.44 2rii s VAL 40 CO 0.03 -0.07 -0.15 0.12 0.00 0.00 0.00 175.10 175.03 2rii s PHE 41 N 1.92 2.81 -0.01 5.22 5.36 0.18 -1.36 117.98 132.09 2rii s PHE 41 Ca 0.10 -1.24 0.02 0.00 -0.96 0.00 0.00 56.93 54.84 2rii s PHE 41 Cb -0.17 -1.94 -0.00 0.00 -0.34 0.00 0.00 43.02 40.57 2rii s PHE 41 CO 0.11 -0.61 -0.07 -0.59 -1.46 0.00 0.00 175.22 172.60 2rii s PHE 42 N 1.11 0.66 0.30 10.12 -0.12 -0.41 0.13 117.98 129.76 2rii s PHE 42 Ca 0.00 -0.13 -0.03 0.00 -0.05 0.00 0.00 56.93 56.72 2rii s PHE 42 Cb -0.14 -0.45 -0.05 0.00 -0.63 0.00 0.00 43.02 41.76 2rii s PHE 42 CO -0.05 -0.03 0.55 -0.06 -0.05 0.00 0.00 175.22 175.58 2rii s PHE 43 N -0.04 3.49 -0.05 3.49 0.40 0.20 -0.76 117.98 124.71 2rii s PHE 43 Ca 0.01 0.56 -0.16 0.00 -0.60 0.00 0.00 56.93 56.74 2rii s PHE 43 Cb -0.04 -2.05 0.03 0.00 0.51 0.00 0.00 43.02 41.47 2rii s PHE 43 CO -0.00 0.16 0.37 1.52 0.70 0.00 0.00 175.22 177.96 2rii s TYR 44 N -2.15 -0.29 0.12 0.36 -0.85 -0.43 -3.67 117.35 110.45 2rii s TYR 44 Ca 0.43 0.53 -0.19 0.00 -0.52 0.00 0.00 57.07 57.31 2rii s TYR 44 Cb -0.10 0.14 -0.06 0.00 0.38 0.00 0.00 41.96 42.32 2rii s TYR 44 CO 0.32 -0.37 1.76 -1.00 -1.52 0.00 0.00 175.55 174.73 2rii h PRO 45 N 4.13 0.32 -3.34 -3.49 0.13 -1.85 -3.39 132.00 124.51 2rii h PRO 45 Ca -0.29 -0.03 -0.04 0.00 -0.87 0.00 0.00 66.00 64.77 2rii h PRO 45 Cb 1.17 -0.07 -0.12 0.00 0.13 0.00 0.00 31.00 32.11 2rii h PRO 45 CO 0.37 0.24 -0.03 -0.51 -0.23 0.00 0.00 178.00 177.84 2rii s LEU 46 N -10.11 0.24 -0.11 1.56 1.43 -1.26 -4.43 118.68 106.00 2rii s LEU 46 Ca -0.13 -0.31 -0.05 0.00 -1.03 0.00 0.00 54.13 52.61 2rii s LEU 46 Cb 0.09 1.97 -0.26 0.00 0.03 0.00 0.00 46.19 48.01 2rii s LEU 46 CO 0.70 -0.90 0.42 0.44 0.23 0.00 0.00 176.35 177.25 2rii h ASP 47 N 2.30 0.40 -2.28 2.29 5.19 -1.98 -3.38 116.42 118.96 2rii h ASP 47 Ca -0.33 -0.87 -0.71 0.00 -0.62 0.00 0.00 57.03 54.49 2rii h ASP 47 Cb 1.26 -0.13 -0.34 0.00 0.18 0.00 0.00 39.33 40.30 2rii h ASP 47 CO 0.44 1.78 0.26 0.49 -3.12 0.00 0.00 179.24 179.10 2rii n PHE 48 N -3.46 3.34 -1.56 4.55 3.72 -1.26 -4.99 117.46 117.81 2rii n PHE 48 Ca -0.30 -3.23 -0.35 0.00 -0.05 0.00 0.00 57.45 53.53 2rii n PHE 48 Cb 1.05 -0.88 0.08 0.00 -0.94 0.00 0.00 39.48 38.79 2rii n PHE 48 CO 0.00 0.00 0.00 0.99 -0.05 0.00 0.00 176.76 177.70 2rii s THR 49 N -4.31 2.31 -1.98 4.37 2.01 -1.26 -4.92 115.64 111.86 2rii s THR 49 Ca 0.43 0.16 0.27 0.00 0.31 0.00 0.00 61.69 62.87 2rii s THR 49 Cb 0.22 -2.83 0.37 0.00 0.01 0.00 0.00 72.50 70.28 2rii s THR 49 CO -0.12 -0.07 1.65 0.49 -0.69 0.00 0.00 174.62 175.87 2rii n PHE 50 N -2.44 0.00 -2.62 4.92 3.01 -1.26 -4.82 117.46 114.25 2rii n PHE 50 Ca 0.14 0.00 -0.41 0.00 1.01 0.00 0.00 57.45 58.19 2rii n PHE 50 Cb 0.50 -0.09 -0.05 0.00 -0.01 0.00 0.00 39.48 39.83 2rii n PHE 50 CO 0.00 0.00 0.00 0.08 1.01 0.00 0.00 176.76 177.85 2rii s VAL 51 N -2.34 3.98 0.01 -4.37 1.01 -1.26 -5.01 120.40 112.42 2rii s VAL 51 Ca 0.29 1.83 -0.30 0.00 0.00 0.00 0.00 61.98 63.80 2rii s VAL 51 Cb 0.20 -4.17 -0.07 0.00 0.00 0.00 0.00 36.38 32.34 2rii s VAL 51 CO 0.46 0.37 1.72 0.00 0.00 0.00 0.00 175.10 177.65 2rii n PRO 53 N 6.67 0.70 -0.31 0.00 -0.04 -1.26 -4.46 135.00 136.31 2rii n PRO 53 Ca 0.17 0.00 0.26 0.00 -0.04 0.00 0.00 63.50 63.89 2rii n PRO 53 Cb 0.42 -1.24 0.44 0.00 -0.04 0.00 0.00 33.50 33.08 2rii n PRO 53 CO 0.00 0.00 0.00 -2.37 -0.04 0.00 0.00 175.50 173.09 2rii n THR 54 N -0.06 -0.16 0.21 0.52 5.66 -1.26 -0.46 114.28 118.74 2rii n THR 54 Ca 0.00 1.16 -0.16 0.00 -3.05 0.00 0.00 64.05 61.99 2rii n THR 54 Cb 0.12 -1.90 -0.09 0.00 -1.55 0.00 0.00 70.33 66.92 2rii n THR 54 CO 0.00 0.00 0.00 -0.08 -3.05 0.00 0.00 175.07 171.94 2rii h GLU 55 N 0.00 -0.80 -0.34 1.09 4.81 -1.96 -1.18 114.58 116.21 2rii h GLU 55 Ca 0.57 0.05 -0.07 0.00 -0.13 0.00 0.00 59.36 59.78 2rii h GLU 55 Cb 1.85 0.18 -0.01 0.00 0.63 0.00 0.00 28.75 31.40 2rii h GLU 55 CO -0.29 -0.53 -0.06 0.82 -0.73 0.00 0.00 179.01 178.21 2rii h ILE 56 N -0.83 1.28 -0.86 2.32 2.04 -1.15 -2.08 117.51 118.22 2rii h ILE 56 Ca -0.02 -1.11 0.21 0.00 1.00 0.00 0.00 64.86 64.94 2rii h ILE 56 Cb 0.77 1.31 -0.06 0.00 -0.74 0.00 0.00 36.82 38.10 2rii h ILE 56 CO -0.14 0.36 0.58 0.40 0.00 0.00 0.00 178.15 179.36 2rii h ILE 57 N 0.43 0.66 -0.14 -0.67 1.08 -1.55 0.11 117.51 117.43 2rii h ILE 57 Ca 0.09 -0.10 -0.18 0.00 -0.39 0.00 0.00 64.86 64.28 2rii h ILE 57 Cb 0.56 0.35 -0.00 0.00 -3.07 0.00 0.00 36.82 34.65 2rii h ILE 57 CO 0.03 0.05 -0.66 0.00 -0.69 0.00 0.00 178.15 176.88 2rii h ALA 58 N 1.61 0.58 -0.01 1.87 0.00 -0.49 0.34 119.26 123.16 2rii h ALA 58 Ca 0.44 -0.57 -0.23 0.00 0.00 0.00 0.00 54.91 54.55 2rii h ALA 58 Cb 1.25 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.98 2rii h ALA 58 CO -0.12 0.72 -0.94 0.74 0.00 0.00 0.00 179.25 179.65 2rii h PHE 59 N 0.39 0.68 -0.38 0.00 -1.00 -0.95 -2.66 116.94 113.02 2rii h PHE 59 Ca -0.02 -0.36 -0.12 0.00 2.81 0.00 0.00 57.97 60.28 2rii h PHE 59 Cb 1.23 -0.08 -0.01 0.00 3.61 0.00 0.00 35.95 40.70 2rii h PHE 59 CO 0.05 1.18 -0.22 1.03 -1.61 0.00 0.00 178.31 178.74 2rii h SER 60 N 0.27 0.84 -0.50 2.17 0.87 -0.77 -2.85 113.55 113.58 2rii h SER 60 Ca -0.08 -0.42 -0.01 0.00 -1.23 0.00 0.00 61.79 60.05 2rii h SER 60 Cb 1.57 -0.23 -0.02 0.00 -0.44 0.00 0.00 62.40 63.27 2rii h SER 60 CO 0.17 1.08 0.27 0.44 -0.53 0.00 0.00 176.83 178.26 2rii h ASP 61 N 0.61 0.63 -0.71 6.23 3.32 -0.31 -2.97 116.42 123.22 2rii h ASP 61 Ca 0.08 -0.10 -0.28 0.00 0.02 0.00 0.00 57.03 56.75 2rii h ASP 61 Cb 0.78 -0.16 -0.17 0.00 0.22 0.00 0.00 39.33 40.00 2rii h ASP 61 CO 0.06 0.55 0.36 0.54 -1.72 0.00 0.00 179.24 179.03 2rii n ARG 62 N -4.65 2.85 -0.07 3.56 1.74 -1.01 -4.60 116.66 114.50 2rii n ARG 62 Ca 0.02 -2.58 0.20 0.00 -0.77 0.00 0.00 57.85 54.72 2rii n ARG 62 Cb 0.09 -2.05 0.64 0.00 -1.02 0.00 0.00 32.46 30.12 2rii n ARG 62 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2rii h ALA 63 N 2.06 2.44 -0.46 7.54 0.00 -1.33 -1.72 119.26 127.79 2rii h ALA 63 Ca 0.35 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 55.21 2rii h ALA 63 Cb 2.29 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 20.07 2rii h ALA 63 CO 0.75 -0.62 0.13 0.93 0.00 0.00 0.00 179.25 180.44 2rii h GLU 64 N 0.11 0.67 -0.65 0.00 3.07 -1.88 0.29 114.58 116.20 2rii h GLU 64 Ca 0.31 -0.11 -0.03 0.00 -0.50 0.00 0.00 59.36 59.02 2rii h GLU 64 Cb 1.05 -0.11 -0.03 0.00 -0.84 0.00 0.00 28.75 28.82 2rii h GLU 64 CO -0.04 0.60 0.29 0.93 -1.40 0.00 0.00 179.01 179.40 2rii h GLU 65 N 0.66 0.93 0.08 2.33 5.08 -1.68 0.04 114.58 122.01 2rii h GLU 65 Ca 0.15 -0.13 -0.23 0.00 -1.00 0.00 0.00 59.36 58.15 2rii h GLU 65 Cb 0.22 -0.17 0.02 0.00 0.50 0.00 0.00 28.75 29.32 2rii h GLU 65 CO -0.01 0.73 -0.94 0.74 -1.00 0.00 0.00 179.01 178.53 2rii h PHE 66 N 0.92 0.80 -0.70 4.33 -1.00 -1.34 -3.24 116.94 116.72 2rii h PHE 66 Ca 0.22 -0.49 0.15 0.00 2.81 0.00 0.00 57.97 60.67 2rii h PHE 66 Cb 0.13 -0.07 -0.12 0.00 3.61 0.00 0.00 35.95 39.50 2rii h PHE 66 CO 0.01 1.34 0.02 0.87 -1.61 0.00 0.00 178.31 178.94 2rii h LYS 67 N 0.04 0.12 0.00 1.51 1.79 -0.26 -0.03 116.57 119.75 2rii h LYS 67 Ca -0.14 -0.01 0.00 0.00 -2.18 0.00 0.00 60.65 58.32 2rii h LYS 67 Cb 1.65 -0.03 0.00 0.00 -1.58 0.00 0.00 32.23 32.28 2rii h LYS 67 CO 0.18 0.08 0.00 1.17 -1.08 0.00 0.00 179.45 179.80 2rii n LYS 68 N -5.30 0.09 -0.19 3.15 3.00 -0.02 -1.52 118.16 117.37 2rii n LYS 68 Ca 0.12 0.24 0.09 0.00 -0.00 0.00 0.00 58.31 58.76 2rii n LYS 68 Cb 0.43 -1.50 0.15 0.00 0.00 0.00 0.00 35.03 34.11 2rii n LYS 68 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.40 178.68 2rii n LEU 69 N -1.33 2.37 -3.61 3.14 4.77 -0.06 -4.98 117.00 117.31 2rii n LEU 69 Ca 0.03 -3.21 -0.22 0.00 -0.03 0.00 0.00 56.01 52.59 2rii n LEU 69 Cb 0.07 -0.44 0.05 0.00 -2.33 0.00 0.00 43.42 40.76 2rii n LEU 69 CO 0.06 0.84 -0.04 -3.20 -1.33 0.00 0.00 177.39 173.72 2rii n ASN 70 N -1.34 -2.73 -4.06 -1.43 2.85 -0.57 -4.77 115.26 103.20 2rii n ASN 70 Ca 0.16 -0.82 -0.11 0.00 -0.11 0.00 0.00 54.58 53.70 2rii n ASN 70 Cb 0.65 -4.21 -0.11 0.00 1.24 0.00 0.00 39.78 37.35 2rii n ASN 70 CO 0.00 0.00 0.00 -0.44 -2.11 0.00 0.00 177.26 174.71 2rii s SER 71 N -4.07 0.72 -0.15 1.20 0.01 -1.00 -2.37 113.70 108.04 2rii s SER 71 Ca 0.15 -0.65 -0.01 0.00 1.31 0.00 0.00 55.95 56.74 2rii s SER 71 Cb -0.04 0.08 0.04 0.00 0.21 0.00 0.00 66.02 66.31 2rii s SER 71 CO 0.80 -0.31 -0.01 -1.58 0.41 0.00 0.00 173.24 172.55 2rii s GLN 72 N -2.13 1.00 -0.18 12.44 2.00 -0.34 -3.95 119.66 128.51 2rii s GLN 72 Ca -0.06 -0.32 -0.24 0.00 -2.00 0.00 0.00 55.36 52.74 2rii s GLN 72 Cb -0.06 -1.76 -0.02 0.00 0.80 0.00 0.00 33.01 31.98 2rii s GLN 72 CO -0.02 -0.45 0.77 0.08 -0.50 0.00 0.00 175.29 175.17 2rii s VAL 73 N 1.79 4.92 -0.08 1.34 1.01 -1.26 -2.41 120.40 125.71 2rii s VAL 73 Ca 0.01 1.49 0.04 0.00 0.00 0.00 0.00 61.98 63.53 2rii s VAL 73 Cb -0.15 -4.08 -0.00 0.00 0.00 0.00 0.00 36.38 32.15 2rii s VAL 73 CO -0.07 0.05 -0.22 -0.63 0.00 0.00 0.00 175.10 174.23 2rii s ILE 74 N 2.08 1.86 0.37 2.22 1.01 -0.47 -4.13 121.20 124.15 2rii s ILE 74 Ca 0.35 -0.93 0.07 0.00 0.00 0.00 0.00 60.65 60.15 2rii s ILE 74 Cb -0.16 -1.61 -0.02 0.00 0.01 0.00 0.00 42.46 40.68 2rii s ILE 74 CO 0.12 0.52 0.37 -0.83 0.00 0.00 0.00 174.94 175.12 2rii s GLY 75 N 0.22 1.91 -0.15 6.18 0.00 -0.93 -1.29 107.32 113.26 2rii s GLY 75 Ca -0.13 -1.72 -0.28 0.00 0.00 0.00 0.00 44.72 42.59 2rii s GLY 75 CO 0.06 -1.59 0.72 0.00 0.00 0.00 0.00 173.10 172.29 2rii s ALA 76 N -2.36 -1.79 0.30 3.20 0.00 0.06 0.72 121.76 121.89 2rii s ALA 76 Ca 0.45 1.62 -0.02 0.00 0.00 0.00 0.00 51.96 54.02 2rii s ALA 76 Cb -0.06 -0.54 -0.01 0.00 0.00 0.00 0.00 23.12 22.51 2rii s ALA 76 CO 0.28 -0.35 0.36 -1.54 0.00 0.00 0.00 175.76 174.51 2rii s SER 77 N -0.53 0.76 0.10 0.00 1.04 -1.03 -1.31 113.70 112.72 2rii s SER 77 Ca -0.06 -1.44 0.25 0.00 0.48 0.00 0.00 55.95 55.18 2rii s SER 77 Cb -0.02 0.57 0.96 0.00 0.10 0.00 0.00 66.02 67.63 2rii s SER 77 CO 0.06 -1.13 1.77 1.33 0.98 0.00 0.00 173.24 176.24 2rii n VAL 78 N -0.49 0.48 -1.59 5.02 0.24 -1.26 -1.26 118.33 119.48 2rii n VAL 78 Ca 0.02 0.00 -0.31 0.00 -2.04 0.00 0.00 64.34 62.02 2rii n VAL 78 Cb 0.63 -0.72 0.06 0.00 -1.47 0.00 0.00 33.84 32.35 2rii n VAL 78 CO 0.00 0.00 0.00 -1.81 -2.14 0.00 0.00 176.83 172.88 2rii s ASP 79 N -3.61 5.05 0.87 -1.34 -0.00 -1.26 -3.38 116.67 113.00 2rii s ASP 79 Ca 0.10 1.46 -0.11 0.00 -0.00 0.00 0.00 52.55 54.00 2rii s ASP 79 Cb 0.14 -2.28 0.11 0.00 -0.00 0.00 0.00 42.92 40.89 2rii s ASP 79 CO 0.48 -1.63 1.09 -0.94 -0.00 0.00 0.00 175.17 174.17 2rii s SER 80 N -3.88 3.72 0.56 0.27 1.04 -1.26 -4.07 113.70 110.08 2rii s SER 80 Ca 0.59 1.49 0.35 0.00 0.48 0.00 0.00 55.95 58.86 2rii s SER 80 Cb -0.14 -2.18 1.52 0.00 0.10 0.00 0.00 66.02 65.32 2rii s SER 80 CO 0.54 -2.48 2.04 1.12 0.98 0.00 0.00 173.24 175.44 2rii h HIS 81 N -1.44 0.00 0.03 5.02 2.07 -1.93 -2.47 115.15 116.42 2rii h HIS 81 Ca -0.49 0.00 -0.25 0.00 -2.85 0.00 0.00 60.37 56.78 2rii h HIS 81 Cb 1.28 0.00 0.01 0.00 2.57 0.00 0.00 27.41 31.27 2rii h HIS 81 CO 0.44 0.00 -1.05 0.74 -3.07 0.00 0.00 177.93 175.00 2rii h PHE 82 N 0.00 0.79 -0.37 6.12 0.05 -1.98 -2.81 116.94 118.74 2rii h PHE 82 Ca 0.00 -0.45 0.04 0.00 3.82 0.00 0.00 57.97 61.38 2rii h PHE 82 Cb 0.42 -0.08 -0.04 0.00 2.00 0.00 0.00 35.95 38.26 2rii h PHE 82 CO 0.00 1.29 0.15 0.93 -0.18 0.00 0.00 178.31 180.50 2rii h GLU 83 N 0.27 0.31 0.06 1.51 4.39 -1.81 -2.49 114.58 116.83 2rii h GLU 83 Ca -0.12 -0.02 -0.00 0.00 0.34 0.00 0.00 59.36 59.56 2rii h GLU 83 Cb 1.70 -0.07 -0.00 0.00 -0.10 0.00 0.00 28.75 30.28 2rii h GLU 83 CO 0.19 0.21 -0.07 0.45 -1.16 0.00 0.00 179.01 178.63 2rii h HIS 84 N 0.32 -0.19 -0.09 4.33 3.86 -1.41 -0.35 115.15 121.62 2rii h HIS 84 Ca 0.16 0.00 0.01 0.00 -1.16 0.00 0.00 60.37 59.38 2rii h HIS 84 Cb 0.11 0.08 -0.01 0.00 1.06 0.00 0.00 27.41 28.65 2rii h HIS 84 CO -0.12 -0.09 -0.05 1.28 0.86 0.00 0.00 177.93 179.80 2rii n LEU 85 N -2.72 -0.09 0.09 2.43 4.77 -1.07 -0.21 117.00 120.21 2rii n LEU 85 Ca -0.02 0.16 -0.01 0.00 -0.03 0.00 0.00 56.01 56.12 2rii n LEU 85 Cb 0.06 -0.02 0.26 0.00 -2.33 0.00 0.00 43.42 41.39 2rii n LEU 85 CO 0.03 -0.13 0.70 0.00 -1.33 0.00 0.00 177.39 176.66 2rii h ALA 86 N 0.04 1.19 -0.14 -1.18 0.00 -0.93 0.32 119.26 118.56 2rii h ALA 86 Ca 0.01 -0.36 -0.16 0.00 0.00 0.00 0.00 54.91 54.40 2rii h ALA 86 Cb 0.04 -0.09 0.01 0.00 0.00 0.00 0.00 17.79 17.74 2rii h ALA 86 CO -0.08 0.54 -0.54 2.35 0.00 0.00 0.00 179.25 181.52 2rii h TRP 87 N 0.22 0.81 -0.18 0.00 7.01 0.11 -2.54 115.95 121.38 2rii h TRP 87 Ca 0.03 -0.34 -0.04 0.00 2.11 0.00 0.00 58.89 60.65 2rii h TRP 87 Cb 0.71 -0.13 -0.01 0.00 -2.10 0.00 0.00 29.16 27.62 2rii h TRP 87 CO 0.01 1.13 -0.06 0.28 -2.79 0.00 0.00 178.44 177.02 2rii h VAL 88 N 0.27 1.15 -0.29 2.65 2.07 -0.65 -1.67 116.25 119.78 2rii h VAL 88 Ca -0.03 -0.63 0.00 0.00 0.82 0.00 0.00 66.70 66.86 2rii h VAL 88 Cb 1.17 1.08 0.00 0.00 -1.52 0.00 0.00 31.29 32.01 2rii h VAL 88 CO 0.11 0.20 0.00 0.59 0.02 0.00 0.00 177.57 178.50 2rii n ASN 89 N -4.33 1.55 -4.30 0.57 5.03 0.07 -2.77 115.26 111.08 2rii n ASN 89 Ca -0.00 -2.00 -0.38 0.00 0.87 0.00 0.00 54.58 53.07 2rii n ASN 89 Cb 0.22 -0.19 -0.12 0.00 -1.02 0.00 0.00 39.78 38.66 2rii n ASN 89 CO 0.00 0.00 0.00 -0.89 -1.83 0.00 0.00 177.26 174.54 2rii s THR 90 N -1.61 3.89 0.16 3.41 2.01 -0.97 -4.99 115.64 117.53 2rii s THR 90 Ca 0.19 -1.01 -0.33 0.00 0.31 0.00 0.00 61.69 60.85 2rii s THR 90 Cb 0.10 -3.15 -0.16 0.00 0.01 0.00 0.00 72.50 69.30 2rii s THR 90 CO 0.13 -0.12 1.21 -2.65 -0.69 0.00 0.00 174.62 172.50 2rii n PRO 91 N 4.84 1.24 -0.21 4.92 -0.02 -1.26 -2.26 135.00 142.24 2rii n PRO 91 Ca -0.13 0.44 -0.06 0.00 -2.02 0.00 0.00 63.50 61.74 2rii n PRO 91 Cb 0.46 -1.98 -0.05 0.00 -0.02 0.00 0.00 33.50 31.91 2rii n PRO 91 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 2rii n LYS 92 N 1.92 -0.22 -0.35 -0.52 5.02 -1.26 -0.06 118.16 122.70 2rii n LYS 92 Ca 0.15 1.02 0.28 0.00 -2.02 0.00 0.00 58.31 57.74 2rii n LYS 92 Cb 0.24 -1.50 0.58 0.00 -0.02 0.00 0.00 35.03 34.33 2rii n LYS 92 CO 0.00 0.00 0.00 0.87 -0.52 0.00 0.00 177.40 177.75 2rii h LYS 93 N 0.00 0.25 -0.43 1.97 1.57 -1.90 1.16 116.57 119.19 2rii h LYS 93 Ca 0.08 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.85 2rii h LYS 93 Cb 0.21 -0.06 0.00 0.00 0.08 0.00 0.00 32.23 32.46 2rii h LYS 93 CO -0.47 0.17 0.00 1.04 -0.57 0.00 0.00 179.45 179.62 2rii n GLN 94 N -4.55 1.11 -1.82 3.15 6.02 0.92 -4.88 117.38 117.33 2rii n GLN 94 Ca 0.28 -0.12 -0.01 0.00 -0.01 0.00 0.00 57.00 57.13 2rii n GLN 94 Cb 1.05 -1.24 0.01 0.00 1.02 0.00 0.00 30.24 31.08 2rii n GLN 94 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2rii n GLY 95 N 0.33 -0.00 0.00 1.08 0.00 0.39 -4.91 105.19 102.08 2rii n GLY 95 Ca 0.01 -0.09 0.00 0.00 0.00 0.00 0.00 46.02 45.94 2rii n GLY 95 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2rii n GLY 96 N -1.29 2.87 0.13 -0.02 0.00 -0.81 -4.96 105.19 101.12 2rii n GLY 96 Ca -0.01 -1.13 -0.20 0.00 0.00 0.00 0.00 46.02 44.68 2rii n GLY 96 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2rii n LEU 97 N 0.00 2.53 0.00 0.99 4.77 -0.65 -4.10 117.00 120.54 2rii n LEU 97 Ca 0.00 0.16 0.02 0.00 -0.03 0.00 0.00 56.01 56.17 2rii n LEU 97 Cb 0.00 -0.97 -0.01 0.00 -2.33 0.00 0.00 43.42 40.11 2rii n LEU 97 CO 0.00 0.83 -0.03 0.61 -1.33 0.00 0.00 177.39 177.47 2rii n GLY 98 N 2.01 -1.73 3.73 -0.72 0.00 -0.96 -4.55 105.19 102.96 2rii n GLY 98 Ca -0.33 -1.27 -0.42 0.00 0.00 0.00 0.00 46.02 43.99 2rii n GLY 98 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2rii n PRO 99 N -1.30 2.68 -4.80 1.61 -0.04 -1.25 -4.52 135.00 127.39 2rii n PRO 99 Ca 0.00 0.96 -0.33 0.00 -0.04 0.00 0.00 63.50 64.09 2rii n PRO 99 Cb 0.08 -2.76 -0.13 0.00 -0.04 0.00 0.00 33.50 30.65 2rii n PRO 99 CO 0.00 0.00 0.00 -1.64 -0.04 0.00 0.00 175.50 173.82 2rii s MET 100 N 0.21 2.78 0.00 0.54 -1.94 -1.26 -5.02 119.30 114.61 2rii s MET 100 Ca 0.69 -0.66 0.28 0.00 -1.71 0.00 0.00 55.69 54.29 2rii s MET 100 Cb -0.52 -2.49 1.02 0.00 2.01 0.00 0.00 34.83 34.85 2rii s MET 100 CO 0.42 0.53 1.72 0.09 -0.01 0.00 0.00 175.02 177.77 2rii n ASN 101 N 2.60 1.52 -4.04 3.03 3.02 -1.26 -4.21 115.26 115.92 2rii n ASN 101 Ca -0.18 -1.49 -0.22 0.00 -0.03 0.00 0.00 54.58 52.67 2rii n ASN 101 Cb 0.52 0.01 -0.16 0.00 -0.61 0.00 0.00 39.78 39.54 2rii n ASN 101 CO 0.00 0.00 0.00 0.27 -2.62 0.00 0.00 177.26 174.91 2rii s ILE 102 N -2.02 0.94 0.64 2.41 -5.25 -1.26 -4.79 121.20 111.86 2rii s ILE 102 Ca 0.37 -0.45 -0.17 0.00 -0.99 0.00 0.00 60.65 59.41 2rii s ILE 102 Cb 0.21 -0.82 -0.06 0.00 2.95 0.00 0.00 42.46 44.74 2rii s ILE 102 CO 0.34 0.28 0.61 -0.81 -1.79 0.00 0.00 174.94 173.57 2rii n PRO 103 N 3.23 0.48 -4.01 0.37 -0.04 -1.26 -4.59 135.00 129.19 2rii n PRO 103 Ca -0.18 0.20 -0.31 0.00 -0.04 0.00 0.00 63.50 63.17 2rii n PRO 103 Cb 0.54 -1.84 -0.16 0.00 -0.04 0.00 0.00 33.50 32.00 2rii n PRO 103 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2rii s LEU 104 N -0.20 2.26 0.38 1.53 1.43 0.20 -2.19 118.68 122.08 2rii s LEU 104 Ca 0.69 -0.85 -0.25 0.00 -1.03 0.00 0.00 54.13 52.68 2rii s LEU 104 Cb -0.40 -1.25 -0.09 0.00 0.03 0.00 0.00 46.19 44.48 2rii s LEU 104 CO 0.54 -0.13 1.09 -0.69 0.23 0.00 0.00 176.35 177.39 2rii s VAL 105 N 1.39 3.53 -0.06 -1.59 1.01 0.22 -1.33 120.40 123.57 2rii s VAL 105 Ca -0.01 1.25 0.03 0.00 0.00 0.00 0.00 61.98 63.26 2rii s VAL 105 Cb -0.16 -3.69 -0.02 0.00 0.00 0.00 0.00 36.38 32.51 2rii s VAL 105 CO -0.09 0.09 -0.14 -0.55 0.00 0.00 0.00 175.10 174.41 2rii s SER 106 N -1.35 4.04 -0.38 3.32 0.15 -1.02 -2.48 113.70 115.98 2rii s SER 106 Ca 0.56 -0.20 0.11 0.00 0.70 0.00 0.00 55.95 57.11 2rii s SER 106 Cb -0.26 -0.92 0.33 0.00 -1.71 0.00 0.00 66.02 63.46 2rii s SER 106 CO 0.33 0.33 0.70 -0.67 1.20 0.00 0.00 173.24 175.13 2rii n ASP 107 N 2.41 0.85 0.28 5.45 2.03 -0.39 -4.45 116.55 122.74 2rii n ASP 107 Ca -0.17 -2.98 0.15 0.00 0.52 0.00 0.00 54.79 52.31 2rii n ASP 107 Cb 0.52 -0.62 0.84 0.00 -0.72 0.00 0.00 41.12 41.14 2rii n ASP 107 CO 0.00 0.00 0.00 1.55 -1.92 0.00 0.00 177.20 176.83 2rii h PRO 108 N 3.19 0.00 0.00 -0.67 0.13 -1.80 -1.46 132.00 131.39 2rii h PRO 108 Ca 0.10 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.23 2rii h PRO 108 Cb 0.94 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.07 2rii h PRO 108 CO 0.51 0.07 0.00 1.63 -0.23 0.00 0.00 178.00 179.97 2rii n LYS 109 N -3.53 0.15 -1.39 0.86 5.02 -1.26 -4.90 118.16 113.10 2rii n LYS 109 Ca -0.02 0.04 -0.13 0.00 -2.02 0.00 0.00 58.31 56.18 2rii n LYS 109 Cb 0.19 -1.50 -0.06 0.00 -0.02 0.00 0.00 35.03 33.64 2rii n LYS 109 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 2rii n ARG 110 N -1.42 -1.14 -0.00 1.97 5.12 -0.55 -4.87 116.66 115.77 2rii n ARG 110 Ca 0.09 0.96 -0.15 0.00 -1.93 0.00 0.00 57.85 56.82 2rii n ARG 110 Cb 0.27 -5.11 -0.14 0.00 -1.16 0.00 0.00 32.46 26.32 2rii n ARG 110 CO 0.00 0.00 0.00 1.79 -1.93 0.00 0.00 177.63 177.49 2rii h THR 111 N 0.00 0.77 -0.47 0.55 1.35 -1.91 -2.45 112.91 110.76 2rii h THR 111 Ca -0.28 -2.55 -0.12 0.00 -0.55 0.00 0.00 66.41 62.92 2rii h THR 111 Cb 0.98 2.49 -0.01 0.00 -1.73 0.00 0.00 68.15 69.87 2rii h THR 111 CO 0.40 0.70 -0.16 0.40 -0.25 0.00 0.00 175.52 176.61 2rii h ILE 112 N 0.04 1.27 -0.28 6.82 2.04 -1.89 0.32 117.51 125.83 2rii h ILE 112 Ca -0.34 -1.31 0.06 0.00 1.00 0.00 0.00 64.86 64.27 2rii h ILE 112 Cb 2.02 1.13 -0.06 0.00 -0.74 0.00 0.00 36.82 39.18 2rii h ILE 112 CO 0.09 0.45 -0.09 0.00 0.00 0.00 0.00 178.15 178.60 2rii h ALA 113 N 0.87 0.16 -0.34 1.87 0.00 -1.90 -2.30 119.26 117.62 2rii h ALA 113 Ca 0.11 0.11 -0.04 0.00 0.00 0.00 0.00 54.91 55.09 2rii h ALA 113 Cb 0.72 0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.74 2rii h ALA 113 CO 0.06 -0.48 0.04 1.96 0.00 0.00 0.00 179.25 180.82 2rii h GLN 114 N -0.03 0.51 0.00 0.00 4.20 -1.06 -1.47 115.11 117.26 2rii h GLN 114 Ca 0.14 -0.09 0.00 0.00 0.06 0.00 0.00 58.65 58.76 2rii h GLN 114 Cb 0.24 -0.08 0.00 0.00 0.30 0.00 0.00 27.48 27.94 2rii h GLN 114 CO -0.30 0.50 0.00 -3.47 -0.67 0.00 0.00 178.83 174.89 2rii n ASP 115 N -4.32 0.70 -0.25 1.46 -0.08 0.11 -2.21 116.55 111.96 2rii n ASP 115 Ca 0.02 0.60 0.07 0.00 -1.51 0.00 0.00 54.79 53.96 2rii n ASP 115 Cb 0.21 -0.77 -0.02 0.00 2.34 0.00 0.00 41.12 42.88 2rii n ASP 115 CO 0.00 0.00 0.00 -1.22 0.12 0.00 0.00 177.20 176.10 2rii n TYR 116 N -2.19 0.00 -1.06 -0.67 4.02 -0.86 -2.37 117.16 114.03 2rii n TYR 116 Ca 0.04 0.00 -0.02 0.00 -0.01 0.00 0.00 57.90 57.91 2rii n TYR 116 Cb 0.35 0.00 -0.01 0.00 -0.02 0.00 0.00 39.34 39.66 2rii n TYR 116 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2rii n GLY 117 N 1.13 0.54 0.45 2.72 0.00 -0.61 -3.57 105.19 105.85 2rii n GLY 117 Ca 0.05 -0.88 0.08 0.00 0.00 0.00 0.00 46.02 45.27 2rii n GLY 117 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2rii n VAL 118 N -2.93 1.90 -3.42 1.61 0.24 -0.86 -4.64 118.33 110.23 2rii n VAL 118 Ca -0.02 -1.89 -0.38 0.00 -2.04 0.00 0.00 64.34 60.02 2rii n VAL 118 Cb 0.07 -0.12 -0.06 0.00 -1.47 0.00 0.00 33.84 32.26 2rii n VAL 118 CO 0.00 0.00 0.00 -0.22 -2.14 0.00 0.00 176.83 174.47 2rii s LEU 119 N -2.53 4.33 -0.30 1.34 2.96 -1.23 -1.26 118.68 121.99 2rii s LEU 119 Ca 0.33 0.79 -0.11 0.00 -0.22 0.00 0.00 54.13 54.92 2rii s LEU 119 Cb 0.27 -2.60 -0.03 0.00 0.50 0.00 0.00 46.19 44.33 2rii s LEU 119 CO 0.06 0.12 0.17 -1.59 -1.32 0.00 0.00 176.35 173.79 2rii s LYS 120 N 0.09 3.65 0.15 1.98 -2.85 -0.34 -4.94 119.74 117.48 2rii s LYS 120 Ca 0.23 -0.52 -0.23 0.00 -1.00 0.00 0.00 55.97 54.46 2rii s LYS 120 Cb -0.15 -3.62 0.02 0.00 -2.06 0.00 0.00 37.83 32.02 2rii s LYS 120 CO 0.10 -0.30 1.63 0.00 0.10 0.00 0.00 175.35 176.88 2rii h ALA 121 N 8.37 -0.14 -1.00 0.59 0.00 -1.97 -1.55 119.26 123.56 2rii h ALA 121 Ca -0.34 0.07 0.39 0.00 0.00 0.00 0.00 54.91 55.03 2rii h ALA 121 Cb 1.17 0.49 -0.17 0.00 0.00 0.00 0.00 17.79 19.27 2rii h ALA 121 CO 0.59 -0.67 0.50 -0.44 0.00 0.00 0.00 179.25 179.23 2rii h ASP 122 N -0.25 0.28 0.00 0.00 3.32 -1.97 -2.83 116.42 114.97 2rii h ASP 122 Ca 0.13 0.25 -0.10 0.00 0.02 0.00 0.00 57.03 57.33 2rii h ASP 122 Cb 0.45 0.26 -0.02 0.00 0.22 0.00 0.00 39.33 40.25 2rii h ASP 122 CO -0.36 -0.37 -1.59 -0.62 -1.72 0.00 0.00 179.24 174.57 2rii n GLU 123 N -5.24 1.41 -2.67 3.56 -0.58 -0.96 -5.01 120.64 111.15 2rii n GLU 123 Ca 0.35 -0.05 -0.07 0.00 -0.42 0.00 0.00 57.16 56.97 2rii n GLU 123 Cb 1.18 -1.26 0.02 0.00 -0.57 0.00 0.00 31.44 30.81 2rii n GLU 123 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2rii n GLY 124 N 2.15 0.38 3.21 0.62 0.00 -0.62 -5.05 105.19 105.88 2rii n GLY 124 Ca -0.10 -0.43 -0.09 0.00 0.00 0.00 0.00 46.02 45.40 2rii n GLY 124 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2rii s ILE 125 N -2.91 0.10 0.19 -0.61 -4.36 -1.23 -4.93 121.20 107.46 2rii s ILE 125 Ca 0.14 -1.68 -0.22 0.00 -0.26 0.00 0.00 60.65 58.63 2rii s ILE 125 Cb -0.06 -1.90 -0.08 0.00 1.25 0.00 0.00 42.46 41.66 2rii s ILE 125 CO 0.18 -0.45 0.73 -0.94 0.24 0.00 0.00 174.94 174.70 2rii s SER 126 N -3.00 7.17 0.74 4.36 1.04 -1.26 -1.19 113.70 121.56 2rii s SER 126 Ca 0.20 1.49 -0.11 0.00 0.48 0.00 0.00 55.95 58.01 2rii s SER 126 Cb 0.06 -2.45 0.03 0.00 0.10 0.00 0.00 66.02 63.77 2rii s SER 126 CO -0.00 0.11 1.07 -0.36 0.98 0.00 0.00 173.24 175.04 2rii s PHE 127 N -1.37 2.89 -1.20 5.02 2.99 -0.39 -3.56 117.98 122.36 2rii s PHE 127 Ca 0.40 1.43 -0.20 0.00 0.00 0.00 0.00 56.93 58.55 2rii s PHE 127 Cb -0.19 -2.97 -0.04 0.00 0.00 0.00 0.00 43.02 39.83 2rii s PHE 127 CO 0.23 -1.51 1.89 0.54 -0.00 0.00 0.00 175.22 176.37 2rii n ARG 128 N -3.31 2.20 -4.06 0.44 1.74 -1.03 -4.41 116.66 108.22 2rii n ARG 128 Ca 0.08 -2.67 -0.31 0.00 -0.77 0.00 0.00 57.85 54.17 2rii n ARG 128 Cb 0.54 -3.54 -0.07 0.00 -1.02 0.00 0.00 32.46 28.38 2rii n ARG 128 CO 0.00 0.00 0.00 0.20 -1.52 0.00 0.00 177.63 176.31 2rii s GLY 129 N 5.35 2.03 -0.07 -0.13 0.00 -1.24 -1.55 107.32 111.71 2rii s GLY 129 Ca 0.61 -0.96 -0.05 0.00 0.00 0.00 0.00 44.72 44.33 2rii s GLY 129 CO 0.10 -0.91 0.18 -2.27 0.00 0.00 0.00 173.10 170.20 2rii s LEU 130 N -2.18 0.88 -0.05 0.66 0.20 0.82 0.61 118.68 119.62 2rii s LEU 130 Ca 0.28 0.37 0.02 0.00 0.69 0.00 0.00 54.13 55.48 2rii s LEU 130 Cb -0.12 0.53 0.01 0.00 -0.43 0.00 0.00 46.19 46.18 2rii s LEU 130 CO 0.20 -0.12 -0.10 -0.36 -0.29 0.00 0.00 176.35 175.68 2rii s PHE 131 N 0.79 1.18 -0.30 5.38 0.40 0.34 -1.24 117.98 124.54 2rii s PHE 131 Ca -0.06 -0.39 -0.08 0.00 -0.60 0.00 0.00 56.93 55.80 2rii s PHE 131 Cb -0.07 -0.89 -0.00 0.00 0.51 0.00 0.00 43.02 42.56 2rii s PHE 131 CO -0.04 -0.22 0.11 0.42 0.70 0.00 0.00 175.22 176.19 2rii s ILE 132 N 0.62 4.29 0.06 0.64 1.01 -0.56 0.48 121.20 127.75 2rii s ILE 132 Ca -0.12 -0.52 0.07 0.00 0.00 0.00 0.00 60.65 60.08 2rii s ILE 132 Cb -0.14 -3.18 -0.04 0.00 0.01 0.00 0.00 42.46 39.11 2rii s ILE 132 CO 0.02 0.10 -0.13 -0.63 0.00 0.00 0.00 174.94 174.30 2rii s ILE 133 N 1.56 3.16 0.70 2.92 1.01 0.24 -0.63 121.20 130.15 2rii s ILE 133 Ca 0.04 -1.17 0.02 0.00 0.00 0.00 0.00 60.65 59.54 2rii s ILE 133 Cb -0.17 -2.40 0.13 0.00 0.01 0.00 0.00 42.46 40.02 2rii s ILE 133 CO 0.04 0.25 0.96 1.51 0.00 0.00 0.00 174.94 177.70 2rii s ASP 134 N -1.77 4.46 0.56 3.58 1.47 -0.10 -1.26 116.67 123.62 2rii s ASP 134 Ca 0.18 -0.53 0.33 0.00 1.18 0.00 0.00 52.55 53.70 2rii s ASP 134 Cb -0.11 0.15 1.65 0.00 -0.34 0.00 0.00 42.92 44.28 2rii s ASP 134 CO 0.09 -1.79 2.12 -2.24 0.68 0.00 0.00 175.17 174.03 2rii h ASP 135 N -0.39 0.00 -0.55 2.11 2.03 -1.88 0.14 116.42 117.88 2rii h ASP 135 Ca -0.34 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 55.96 2rii h ASP 135 Cb 1.27 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.77 2rii h ASP 135 CO 0.39 0.06 0.00 0.29 -1.03 0.00 0.00 179.24 178.95 2rii n LYS 136 N -3.36 3.79 -1.01 4.15 5.02 -1.26 -0.35 118.16 125.14 2rii n LYS 136 Ca -0.01 -2.61 -0.00 0.00 -2.02 0.00 0.00 58.31 53.66 2rii n LYS 136 Cb 0.22 -1.96 -0.00 0.00 -0.02 0.00 0.00 35.03 33.27 2rii n LYS 136 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2rii n GLY 137 N 0.86 0.38 3.81 0.72 0.00 0.50 -5.01 105.19 106.45 2rii n GLY 137 Ca 0.23 -0.04 -0.38 0.00 0.00 0.00 0.00 46.02 45.83 2rii n GLY 137 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2rii s ILE 138 N -1.74 5.01 0.10 -0.61 -1.09 -1.26 -1.43 121.20 120.18 2rii s ILE 138 Ca 0.00 0.92 -0.31 0.00 -2.23 0.00 0.00 60.65 59.04 2rii s ILE 138 Cb 0.00 -3.76 -0.07 0.00 -1.58 0.00 0.00 42.46 37.05 2rii s ILE 138 CO 0.00 0.52 1.28 -0.22 -1.23 0.00 0.00 174.94 175.30 2rii s LEU 139 N -0.71 4.38 -0.00 2.97 2.96 -0.77 -0.92 118.68 126.58 2rii s LEU 139 Ca 0.25 2.18 0.02 0.00 -0.22 0.00 0.00 54.13 56.36 2rii s LEU 139 Cb -0.17 -3.58 -0.03 0.00 0.50 0.00 0.00 46.19 42.91 2rii s LEU 139 CO 0.14 -0.54 0.04 0.54 -1.32 0.00 0.00 176.35 175.20 2rii n ARG 140 N 3.80 0.10 -3.63 1.98 1.74 0.20 -1.12 116.66 119.73 2rii n ARG 140 Ca 0.10 -0.02 -0.08 0.00 -0.77 0.00 0.00 57.85 57.08 2rii n ARG 140 Cb 0.44 -1.05 -0.06 0.00 -1.02 0.00 0.00 32.46 30.77 2rii n ARG 140 CO 0.00 0.00 0.00 1.14 -1.52 0.00 0.00 177.63 177.25 2rii s GLN 141 N -2.14 0.40 -0.09 5.56 1.03 -1.10 -4.91 119.66 118.41 2rii s GLN 141 Ca -0.01 0.35 0.03 0.00 0.04 0.00 0.00 55.36 55.77 2rii s GLN 141 Cb 0.01 0.19 0.01 0.00 0.03 0.00 0.00 33.01 33.25 2rii s GLN 141 CO 0.08 -0.07 -0.18 0.42 -2.54 0.00 0.00 175.29 173.00 2rii s ILE 142 N -0.19 1.63 -0.06 3.63 1.01 -1.26 -1.50 121.20 124.46 2rii s ILE 142 Ca 0.03 -0.76 0.01 0.00 0.00 0.00 0.00 60.65 59.94 2rii s ILE 142 Cb -0.04 -1.44 0.02 0.00 0.01 0.00 0.00 42.46 41.01 2rii s ILE 142 CO -0.07 0.47 -0.07 0.42 0.00 0.00 0.00 174.94 175.69 2rii s THR 143 N 0.57 0.79 -0.06 2.92 -4.23 -0.37 -5.01 115.64 110.25 2rii s THR 143 Ca -0.15 -0.25 0.03 0.00 -1.18 0.00 0.00 61.69 60.14 2rii s THR 143 Cb -0.17 -0.78 0.01 0.00 1.34 0.00 0.00 72.50 72.90 2rii s THR 143 CO 0.05 0.29 -0.14 -0.69 -0.54 0.00 0.00 174.62 173.59 2rii s VAL 144 N 0.98 1.25 -0.08 2.29 1.01 -1.26 -0.13 120.40 124.46 2rii s VAL 144 Ca -0.09 -0.56 0.04 0.00 0.00 0.00 0.00 61.98 61.36 2rii s VAL 144 Cb -0.15 -1.12 -0.01 0.00 0.00 0.00 0.00 36.38 35.10 2rii s VAL 144 CO 0.00 0.38 -0.20 0.20 0.00 0.00 0.00 175.10 175.47 2rii s ASN 145 N 0.52 3.43 0.78 3.32 -0.87 -0.60 -4.97 114.94 116.55 2rii s ASN 145 Ca -0.13 -0.43 -0.14 0.00 -1.57 0.00 0.00 52.86 50.58 2rii s ASN 145 Cb -0.15 -1.13 0.05 0.00 -0.02 0.00 0.00 41.25 40.00 2rii s ASN 145 CO 0.04 0.22 1.08 -0.67 -2.57 0.00 0.00 177.10 175.20 2rii n ASP 146 N 3.10 0.70 -0.25 -1.22 2.03 -1.26 -2.46 116.55 117.19 2rii n ASP 146 Ca -0.18 0.61 0.06 0.00 0.52 0.00 0.00 54.79 55.80 2rii n ASP 146 Cb 0.52 -1.46 0.18 0.00 -0.72 0.00 0.00 41.12 39.64 2rii n ASP 146 CO 0.00 0.00 0.00 -0.07 -1.92 0.00 0.00 177.20 175.21 2rii h LEU 147 N -0.67 -0.08 -0.93 -2.67 3.38 -1.96 -2.84 115.31 109.53 2rii h LEU 147 Ca -0.47 0.16 0.17 0.00 0.09 0.00 0.00 57.88 57.83 2rii h LEU 147 Cb 1.31 0.24 -0.10 0.00 0.09 0.00 0.00 40.66 42.20 2rii h LEU 147 CO 0.46 -0.08 0.53 1.55 0.09 0.00 0.00 178.44 180.99 2rii h PRO 148 N 0.22 0.68 -5.71 1.13 0.13 -2.04 -3.44 132.00 122.98 2rii h PRO 148 Ca 0.41 -0.04 -0.66 0.00 -0.87 0.00 0.00 66.00 64.85 2rii h PRO 148 Cb 0.72 -0.15 -0.06 0.00 0.13 0.00 0.00 31.00 31.63 2rii h PRO 148 CO -0.55 0.45 -0.46 0.14 -0.23 0.00 0.00 178.00 177.35 2rii s VAL 149 N -5.91 5.46 0.67 1.56 -7.23 -1.08 -5.11 120.40 108.77 2rii s VAL 149 Ca -0.12 0.16 0.04 0.00 -1.81 0.00 0.00 61.98 60.26 2rii s VAL 149 Cb 0.23 -3.45 0.12 0.00 0.56 0.00 0.00 36.38 33.84 2rii s VAL 149 CO 0.79 0.54 0.93 -0.83 -0.31 0.00 0.00 175.10 176.22 2rii s GLY 150 N -1.26 1.73 0.09 2.32 0.00 -1.26 -4.74 107.32 104.20 2rii s GLY 150 Ca 0.19 -2.01 0.05 0.00 0.00 0.00 0.00 44.72 42.95 2rii s GLY 150 CO 0.08 -1.45 -0.01 0.50 0.00 0.00 0.00 173.10 172.22 2rii s ARG 151 N -4.96 2.50 -0.13 2.90 3.00 -1.26 -5.08 118.95 115.92 2rii s ARG 151 Ca 0.65 -0.86 -0.20 0.00 0.00 0.00 0.00 55.73 55.32 2rii s ARG 151 Cb -0.05 -2.51 -0.04 0.00 0.00 0.00 0.00 34.95 32.35 2rii s ARG 151 CO 0.43 0.54 0.56 0.45 0.00 0.00 0.00 175.30 177.27 2rii s SER 152 N -2.30 6.74 0.11 0.23 0.15 -1.26 -4.95 113.70 112.42 2rii s SER 152 Ca 0.25 0.89 -0.22 0.00 0.70 0.00 0.00 55.95 57.58 2rii s SER 152 Cb -0.12 -2.33 -0.10 0.00 -1.71 0.00 0.00 66.02 61.77 2rii s SER 152 CO 0.18 -0.09 1.73 0.58 1.20 0.00 0.00 173.24 176.84 2rii h VAL 153 N 4.84 0.93 -0.76 4.45 2.07 -1.96 -1.96 116.25 123.87 2rii h VAL 153 Ca -0.39 -0.01 0.15 0.00 0.82 0.00 0.00 66.70 67.28 2rii h VAL 153 Cb 1.18 0.91 -0.10 0.00 -1.52 0.00 0.00 31.29 31.75 2rii h VAL 153 CO 0.76 0.00 0.27 0.44 0.02 0.00 0.00 177.57 179.06 2rii h ASP 154 N 0.02 0.21 0.62 0.57 3.45 -1.99 -0.72 116.42 118.57 2rii h ASP 154 Ca 0.04 0.12 -0.12 0.00 0.43 0.00 0.00 57.03 57.50 2rii h ASP 154 Cb 0.05 0.12 -0.02 0.00 -0.56 0.00 0.00 39.33 38.92 2rii h ASP 154 CO -0.08 0.06 -0.57 -0.08 -1.57 0.00 0.00 179.24 177.01 2rii h GLU 155 N 0.39 0.00 -0.05 3.56 4.57 -1.93 -0.28 114.58 120.84 2rii h GLU 155 Ca 0.42 0.00 -0.02 0.00 -1.18 0.00 0.00 59.36 58.58 2rii h GLU 155 Cb 0.67 0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 29.26 2rii h GLU 155 CO -0.44 0.57 -0.04 1.15 -1.18 0.00 0.00 179.01 179.07 2rii h THR 156 N 0.00 1.35 0.04 0.32 2.02 -0.47 -1.81 112.91 114.37 2rii h THR 156 Ca -0.01 -1.12 0.03 0.00 0.77 0.00 0.00 66.41 66.08 2rii h THR 156 Cb 1.03 1.99 -0.04 0.00 -1.74 0.00 0.00 68.15 69.38 2rii h THR 156 CO 0.07 0.31 -0.29 -0.07 0.37 0.00 0.00 175.52 175.91 2rii h LEU 157 N -0.30 -0.84 -1.27 2.58 3.38 -1.14 -0.98 115.31 116.74 2rii h LEU 157 Ca 0.01 0.11 0.20 0.00 0.09 0.00 0.00 57.88 58.29 2rii h LEU 157 Cb 0.51 0.33 -0.09 0.00 0.09 0.00 0.00 40.66 41.51 2rii h LEU 157 CO 0.01 -0.36 0.62 -0.09 0.09 0.00 0.00 178.44 178.70 2rii h ARG 158 N -0.46 0.56 0.30 1.13 2.43 -1.04 -0.91 114.38 116.40 2rii h ARG 158 Ca 0.05 -0.03 -0.01 0.00 -0.81 0.00 0.00 59.98 59.17 2rii h ARG 158 Cb 0.52 -0.13 0.00 0.00 -0.42 0.00 0.00 29.97 29.95 2rii h ARG 158 CO -0.22 0.37 -0.15 -0.07 -1.51 0.00 0.00 179.97 178.39 2rii h LEU 159 N 0.57 -0.34 -1.00 3.80 3.38 -0.88 -2.78 115.31 118.06 2rii h LEU 159 Ca 0.53 -0.14 0.13 0.00 0.09 0.00 0.00 57.88 58.49 2rii h LEU 159 Cb 1.08 0.09 -0.14 0.00 0.09 0.00 0.00 40.66 41.78 2rii h LEU 159 CO -0.28 0.13 -0.47 0.52 0.09 0.00 0.00 178.44 178.43 2rii n VAL 160 N -5.05 -0.59 -0.29 1.22 0.31 -0.41 -0.66 118.33 112.85 2rii n VAL 160 Ca -0.07 2.37 0.06 0.00 -0.01 0.00 0.00 64.34 66.68 2rii n VAL 160 Cb 0.23 -3.04 0.27 0.00 -0.91 0.00 0.00 33.84 30.39 2rii n VAL 160 CO 0.00 0.00 0.00 1.56 -1.32 0.00 0.00 176.83 177.07 2rii h GLN 161 N 0.00 0.93 -0.28 5.55 4.20 -1.28 -1.67 115.11 122.55 2rii h GLN 161 Ca 0.27 -0.06 -0.14 0.00 0.06 0.00 0.00 58.65 58.78 2rii h GLN 161 Cb 0.52 -0.21 -0.01 0.00 0.30 0.00 0.00 27.48 28.08 2rii h GLN 161 CO -0.97 0.62 -0.39 0.00 -0.67 0.00 0.00 178.83 177.41 2rii h ALA 162 N 1.53 0.78 0.00 3.87 0.00 -0.59 0.15 119.26 125.00 2rii h ALA 162 Ca 0.40 -0.44 -0.13 0.00 0.00 0.00 0.00 54.91 54.74 2rii h ALA 162 Cb 0.30 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.96 2rii h ALA 162 CO -0.16 0.65 -0.63 0.74 0.00 0.00 0.00 179.25 179.85 2rii h PHE 163 N 0.55 0.00 -0.13 0.00 0.05 -1.03 -2.79 116.94 113.59 2rii h PHE 163 Ca 0.05 0.00 -0.20 0.00 3.82 0.00 0.00 57.97 61.64 2rii h PHE 163 Cb 0.92 0.00 0.00 0.00 2.00 0.00 0.00 35.95 38.87 2rii h PHE 163 CO 0.04 0.63 -0.74 1.96 -0.18 0.00 0.00 178.31 180.03 2rii h GLN 164 N 0.00 0.61 -0.41 1.51 4.20 -1.05 -1.83 115.11 118.14 2rii h GLN 164 Ca -0.01 -0.48 0.06 0.00 0.06 0.00 0.00 58.65 58.28 2rii h GLN 164 Cb 1.18 0.10 -0.05 0.00 0.30 0.00 0.00 27.48 29.00 2rii h GLN 164 CO 0.08 1.11 0.10 0.35 -0.67 0.00 0.00 178.83 179.80 2rii h PHE 165 N 0.42 0.17 0.00 2.96 3.57 -0.43 0.68 116.94 124.31 2rii h PHE 165 Ca -0.04 0.02 -0.22 0.00 3.53 0.00 0.00 57.97 61.26 2rii h PHE 165 Cb 1.33 -0.01 -0.03 0.00 2.79 0.00 0.00 35.95 40.03 2rii h PHE 165 CO 0.06 0.03 -1.11 1.79 -2.23 0.00 0.00 178.31 176.86 2rii h THR 166 N 0.24 1.59 -0.95 4.41 1.35 -1.57 -2.84 112.91 115.13 2rii h THR 166 Ca 0.20 -3.31 0.09 0.00 -0.55 0.00 0.00 66.41 62.83 2rii h THR 166 Cb 0.23 2.79 -0.07 0.00 -1.73 0.00 0.00 68.15 69.36 2rii h THR 166 CO -0.24 0.90 0.60 0.44 -0.25 0.00 0.00 175.52 176.97 2rii h ASP 167 N 0.00 0.91 1.11 5.36 5.19 -1.03 -2.61 116.42 125.35 2rii h ASP 167 Ca -0.05 0.03 0.00 0.00 -0.62 0.00 0.00 57.03 56.39 2rii h ASP 167 Cb 1.81 -0.15 0.00 0.00 0.18 0.00 0.00 39.33 41.17 2rii h ASP 167 CO 0.12 0.53 0.00 0.29 -3.12 0.00 0.00 179.24 177.06 2rii n LYS 168 N -4.61 0.19 -2.93 3.56 5.02 0.21 -4.50 118.16 115.09 2rii n LYS 168 Ca 0.16 0.26 -0.25 0.00 -2.02 0.00 0.00 58.31 56.46 2rii n LYS 168 Cb 0.27 -1.77 0.00 0.00 -0.02 0.00 0.00 35.03 33.51 2rii n LYS 168 CO 0.00 0.00 0.00 -1.01 -0.52 0.00 0.00 177.40 175.87 2rii s HIS 169 N -3.15 3.41 0.00 2.13 3.76 -0.98 -4.31 115.29 116.14 2rii s HIS 169 Ca 0.09 0.48 0.00 0.00 -0.15 0.00 0.00 55.06 55.48 2rii s HIS 169 Cb 0.12 -2.23 0.00 0.00 1.11 0.00 0.00 32.58 31.57 2rii s HIS 169 CO 0.50 -0.25 0.00 0.41 -0.85 0.00 0.00 174.74 174.55 2rii n GLY 170 N -2.10 0.76 1.72 -2.22 0.00 -1.26 -4.82 105.19 97.27 2rii n GLY 170 Ca -0.00 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.10 2rii n GLY 170 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2rii n GLU 171 N -2.16 4.36 -2.53 1.61 1.02 -1.26 -5.03 120.64 116.64 2rii n GLU 171 Ca 0.00 -3.05 -0.26 0.00 -0.02 0.00 0.00 57.16 53.83 2rii n GLU 171 Cb 0.00 -2.10 0.02 0.00 -0.02 0.00 0.00 31.44 29.34 2rii n GLU 171 CO 0.00 0.00 0.00 0.14 1.18 0.00 0.00 177.13 178.45 2rii s VAL 172 N -2.41 3.82 0.12 2.62 -7.23 -1.26 -5.11 120.40 110.95 2rii s VAL 172 Ca 0.53 -0.08 -0.14 0.00 -1.81 0.00 0.00 61.98 60.47 2rii s VAL 172 Cb 0.38 -3.49 0.03 0.00 0.56 0.00 0.00 36.38 33.86 2rii s VAL 172 CO 0.19 -0.47 0.36 -0.94 -0.31 0.00 0.00 175.10 173.94 2rii s SER 173 N -4.27 -0.16 0.05 4.85 1.04 -1.26 -5.13 113.70 108.82 2rii s SER 173 Ca 0.52 -0.41 -0.26 0.00 0.48 0.00 0.00 55.95 56.28 2rii s SER 173 Cb -0.10 0.45 -0.14 0.00 0.10 0.00 0.00 66.02 66.33 2rii s SER 173 CO 0.44 -0.85 0.64 -2.65 0.98 0.00 0.00 173.24 171.80 2rii n PRO 174 N -0.20 0.00 0.00 4.02 -0.02 -1.26 -4.81 135.00 132.73 2rii n PRO 174 Ca -0.15 0.00 0.11 0.00 -2.02 0.00 0.00 63.50 61.44 2rii n PRO 174 Cb 0.63 -0.97 0.55 0.00 -0.02 0.00 0.00 33.50 33.70 2rii n PRO 174 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2rii n ALA 175 N 0.72 2.14 -2.11 3.55 0.00 -1.26 -4.85 120.51 118.70 2rii n ALA 175 Ca 0.14 -0.10 -0.20 0.00 0.00 0.00 0.00 53.44 53.28 2rii n ALA 175 Cb 0.10 -1.38 -0.04 0.00 0.00 0.00 0.00 19.45 18.14 2rii n ALA 175 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2rii n GLY 176 N 0.75 0.36 3.35 0.00 0.00 -1.26 -4.99 105.19 103.40 2rii n GLY 176 Ca 0.09 -0.03 -0.26 0.00 0.00 0.00 0.00 46.02 45.82 2rii n GLY 176 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 2rii s TRP 177 N -2.93 2.06 -0.15 1.61 -0.00 -1.26 -5.15 118.94 113.12 2rii s TRP 177 Ca 0.00 -0.40 -0.08 0.00 -0.00 0.00 0.00 56.10 55.62 2rii s TRP 177 Cb 0.00 -1.11 0.05 0.00 -0.00 0.00 0.00 33.47 32.41 2rii s TRP 177 CO 0.00 0.29 0.37 0.21 -0.00 0.00 0.00 176.95 177.82 2rii s LYS 178 N -2.07 0.35 0.34 5.86 2.47 -1.26 -5.16 119.74 120.28 2rii s LYS 178 Ca 0.11 0.71 -0.11 0.00 -1.56 0.00 0.00 55.97 55.12 2rii s LYS 178 Cb -0.10 -0.03 -0.07 0.00 -1.46 0.00 0.00 37.83 36.17 2rii s LYS 178 CO 0.06 -0.15 0.71 -1.25 0.16 0.00 0.00 175.35 174.87 2rii s PRO 179 N 1.30 3.84 0.00 4.03 0.04 -1.26 -4.93 135.00 138.01 2rii s PRO 179 Ca -0.09 0.46 0.00 0.00 0.04 0.00 0.00 61.00 61.41 2rii s PRO 179 Cb -0.09 -2.47 0.00 0.00 0.04 0.00 0.00 34.50 31.99 2rii s PRO 179 CO -0.11 0.10 0.00 0.41 0.04 0.00 0.00 177.00 177.44 2rii n GLY 180 N -0.80 3.22 3.76 0.56 0.00 -1.26 -5.08 105.19 105.59 2rii n GLY 180 Ca 0.02 -0.09 -0.30 0.00 0.00 0.00 0.00 46.02 45.65 2rii n GLY 180 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2rii n SER 181 N 0.00 -0.95 -2.22 1.61 7.64 -1.26 -4.81 113.62 113.64 2rii n SER 181 Ca 0.00 -1.34 -0.19 0.00 1.01 0.00 0.00 58.87 58.35 2rii n SER 181 Cb 0.00 -1.03 -0.10 0.00 -1.01 0.00 0.00 64.21 62.07 2rii n SER 181 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 2rii n ASP 182 N -4.37 5.87 -0.05 6.43 9.92 -1.26 -4.90 116.55 128.20 2rii n ASP 182 Ca 0.16 -2.85 -0.06 0.00 -0.53 0.00 0.00 54.79 51.52 2rii n ASP 182 Cb 0.59 -1.31 -0.14 0.00 -0.64 0.00 0.00 41.12 39.62 2rii n ASP 182 CO 0.00 0.00 0.00 0.41 0.13 0.00 0.00 177.20 177.74 2rii n THR 183 N 1.62 1.30 -1.78 -3.53 -1.04 -1.26 -4.98 114.28 104.61 2rii n THR 183 Ca 0.44 -0.78 -0.40 0.00 -2.04 0.00 0.00 64.05 61.27 2rii n THR 183 Cb 0.72 -0.64 0.02 0.00 -1.82 0.00 0.00 70.33 68.62 2rii n THR 183 CO 0.00 0.00 0.00 -0.63 -0.64 0.00 0.00 175.07 173.80 2rii s ILE 184 N -2.68 2.03 -0.14 12.58 -1.09 -1.26 -5.01 121.20 125.62 2rii s ILE 184 Ca -0.07 0.03 -0.05 0.00 -2.23 0.00 0.00 60.65 58.33 2rii s ILE 184 Cb 0.08 -3.01 -0.03 0.00 -1.58 0.00 0.00 42.46 37.91 2rii s ILE 184 CO 0.83 0.00 0.02 -0.75 -1.23 0.00 0.00 174.94 173.82 2rii s LYS 185 N -2.51 3.56 0.00 2.79 2.20 -1.26 -5.04 119.74 119.48 2rii s LYS 185 Ca 0.62 -0.40 0.00 0.00 -0.36 0.00 0.00 55.97 55.83 2rii s LYS 185 Cb -0.44 -3.00 0.00 0.00 -1.51 0.00 0.00 37.83 32.88 2rii s LYS 185 CO 0.56 0.43 0.39 -2.30 -0.36 0.00 0.00 175.35 174.07