#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ieb n PRO 4 N 0.00 -3.59 -4.19 1.64 -0.02 -1.23 -4.95 135.00 122.65 3ieb n PRO 4 Ca 0.00 -0.96 -0.23 0.00 -2.02 0.00 0.00 63.50 60.28 3ieb n PRO 4 Cb 0.00 -1.31 -0.17 0.00 -0.02 0.00 0.00 33.50 32.00 3ieb n PRO 4 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 3ieb s ILE 6 N -1.76 0.84 -0.05 4.25 -1.09 -1.26 -4.88 121.20 117.24 3ieb s ILE 6 Ca 0.44 -0.25 0.04 0.00 -2.23 0.00 0.00 60.65 58.65 3ieb s ILE 6 Cb -0.08 -0.83 -0.00 0.00 -1.58 0.00 0.00 42.46 39.96 3ieb s ILE 6 CO 0.37 0.31 -0.19 -1.58 -1.23 0.00 0.00 174.94 172.62 3ieb s GLN 7 N 1.15 2.01 -0.14 2.79 0.74 -0.30 -1.02 119.66 124.89 3ieb s GLN 7 Ca -0.06 -0.67 -0.04 0.00 0.05 0.00 0.00 55.36 54.63 3ieb s GLN 7 Cb -0.14 -1.71 -0.03 0.00 1.10 0.00 0.00 33.01 32.22 3ieb s GLN 7 CO -0.01 0.25 0.00 -1.50 -0.55 0.00 0.00 175.29 173.48 3ieb s ILE 8 N 0.06 4.29 -0.27 -2.34 2.07 -0.70 -1.38 121.20 122.92 3ieb s ILE 8 Ca -0.06 -0.23 -0.16 0.00 -1.41 0.00 0.00 60.65 58.79 3ieb s ILE 8 Cb -0.13 -2.86 -0.03 0.00 0.13 0.00 0.00 42.46 39.57 3ieb s ILE 8 CO 0.03 0.53 0.42 0.00 -1.91 0.00 0.00 174.94 174.01 3ieb s ALA 9 N -0.11 3.57 -0.39 1.50 0.00 -0.25 -1.16 121.76 124.92 3ieb s ALA 9 Ca 0.04 -0.77 -0.20 0.00 0.00 0.00 0.00 51.96 51.03 3ieb s ALA 9 Cb -0.13 -2.78 0.01 0.00 0.00 0.00 0.00 23.12 20.22 3ieb s ALA 9 CO 0.02 -0.72 0.63 -0.51 0.00 0.00 0.00 175.76 175.18 3ieb s LEU 10 N 2.16 4.35 -0.16 0.00 1.43 -0.11 -4.56 118.68 121.78 3ieb s LEU 10 Ca 0.17 -0.04 0.16 0.00 -1.03 0.00 0.00 54.13 53.39 3ieb s LEU 10 Cb -0.16 -2.75 0.36 0.00 0.03 0.00 0.00 46.19 43.67 3ieb s LEU 10 CO 0.10 -0.65 1.21 0.47 0.23 0.00 0.00 176.35 177.71 3ieb n ASP 11 N 6.11 2.36 -4.73 2.29 8.00 -1.26 -1.18 116.55 128.13 3ieb n ASP 11 Ca -0.02 -3.33 -0.36 0.00 0.71 0.00 0.00 54.79 51.80 3ieb n ASP 11 Cb 0.48 -0.48 0.07 0.00 -0.02 0.00 0.00 41.12 41.18 3ieb n ASP 11 CO 0.00 0.00 0.00 -1.10 -0.39 0.00 0.00 177.20 175.71 3ieb s GLN 12 N -2.99 2.44 0.00 -1.24 1.11 -1.26 -4.62 119.66 113.10 3ieb s GLN 12 Ca 0.35 1.89 0.17 0.00 0.01 0.00 0.00 55.36 57.79 3ieb s GLN 12 Cb 0.32 -1.85 0.49 0.00 -1.01 0.00 0.00 33.01 30.95 3ieb s GLN 12 CO 0.01 -1.64 1.40 0.25 0.01 0.00 0.00 175.29 175.33 3ieb n THR 13 N -2.21 0.62 -3.71 -0.19 -2.24 -1.26 -3.60 114.28 101.69 3ieb n THR 13 Ca 0.14 -0.66 -0.14 0.00 -2.27 0.00 0.00 64.05 61.12 3ieb n THR 13 Cb 0.49 0.41 -0.08 0.00 -2.10 0.00 0.00 70.33 69.05 3ieb n THR 13 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 3ieb s ASN 14 N -1.11 -0.29 0.29 3.42 4.22 -1.26 -4.87 114.94 115.34 3ieb s ASN 14 Ca 0.35 0.22 0.07 0.00 -2.14 0.00 0.00 52.86 51.36 3ieb s ASN 14 Cb 0.18 0.36 0.44 0.00 1.28 0.00 0.00 41.25 43.52 3ieb s ASN 14 CO 0.25 -0.49 1.69 0.25 -2.04 0.00 0.00 177.10 176.76 3ieb h LEU 15 N 3.67 0.23 0.01 3.54 5.85 -1.93 -2.73 115.31 123.94 3ieb h LEU 15 Ca -0.29 -0.10 0.00 0.00 0.84 0.00 0.00 57.88 58.33 3ieb h LEU 15 Cb 1.17 -0.06 -0.00 0.00 0.37 0.00 0.00 40.66 42.13 3ieb h LEU 15 CO 0.40 0.64 -0.01 0.74 -0.34 0.00 0.00 178.44 179.87 3ieb h THR 16 N 0.18 0.97 -0.61 1.05 2.02 -1.99 0.18 112.91 114.71 3ieb h THR 16 Ca 0.01 0.00 -0.04 0.00 0.77 0.00 0.00 66.41 67.16 3ieb h THR 16 Cb 0.85 0.97 -0.03 0.00 -1.74 0.00 0.00 68.15 68.20 3ieb h THR 16 CO 0.07 0.00 0.24 0.44 0.37 0.00 0.00 175.52 176.64 3ieb h ASP 17 N -0.02 0.85 -0.17 4.18 3.32 -1.98 -2.46 116.42 120.13 3ieb h ASP 17 Ca 0.00 -0.17 -0.00 0.00 0.02 0.00 0.00 57.03 56.88 3ieb h ASP 17 Cb 0.03 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 39.35 3ieb h ASP 17 CO -0.01 0.79 0.10 0.00 -1.72 0.00 0.00 179.24 178.40 3ieb h ALA 18 N 1.09 0.22 -0.43 3.45 0.00 -1.13 -1.17 119.26 121.30 3ieb h ALA 18 Ca 0.20 -0.06 -0.05 0.00 0.00 0.00 0.00 54.91 55.01 3ieb h ALA 18 Cb 0.21 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 17.91 3ieb h ALA 18 CO -0.02 -0.25 0.07 -0.39 0.00 0.00 0.00 179.25 178.67 3ieb h VAL 19 N 0.18 1.20 -0.37 0.00 -1.51 -0.58 -0.34 116.25 114.83 3ieb h VAL 19 Ca 0.06 -0.76 -0.03 0.00 -1.23 0.00 0.00 66.70 64.74 3ieb h VAL 19 Cb 0.07 0.80 -0.02 0.00 -2.13 0.00 0.00 31.29 30.01 3ieb h VAL 19 CO -0.01 0.27 0.10 0.00 -1.23 0.00 0.00 177.57 176.70 3ieb h ALA 20 N 1.45 0.49 -0.19 5.19 0.00 -1.15 -1.33 119.26 123.71 3ieb h ALA 20 Ca 0.14 -0.18 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 3ieb h ALA 20 Cb 0.29 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 3ieb h ALA 20 CO 0.00 0.15 0.07 0.28 0.00 0.00 0.00 179.25 179.75 3ieb h VAL 21 N 0.45 1.17 -0.55 0.00 2.07 -0.93 -1.72 116.25 116.73 3ieb h VAL 21 Ca 0.12 -0.51 0.10 0.00 0.82 0.00 0.00 66.70 67.23 3ieb h VAL 21 Cb 0.29 1.15 -0.08 0.00 -1.52 0.00 0.00 31.29 31.13 3ieb h VAL 21 CO -0.00 0.16 0.09 0.00 0.02 0.00 0.00 177.57 177.85 3ieb h ALA 22 N 0.91 0.62 -0.85 1.67 0.00 -0.95 -1.52 119.26 119.14 3ieb h ALA 22 Ca 0.06 0.13 -0.00 0.00 0.00 0.00 0.00 54.91 55.10 3ieb h ALA 22 Cb 0.19 0.18 -0.04 0.00 0.00 0.00 0.00 17.79 18.12 3ieb h ALA 22 CO -0.00 -0.32 0.53 1.03 0.00 0.00 0.00 179.25 180.48 3ieb h SER 23 N 0.22 1.01 0.48 0.00 0.87 -1.04 0.74 113.55 115.83 3ieb h SER 23 Ca 0.29 -0.05 -0.11 0.00 -1.23 0.00 0.00 61.79 60.68 3ieb h SER 23 Cb 0.42 -0.25 -0.02 0.00 -0.44 0.00 0.00 62.40 62.11 3ieb h SER 23 CO -0.39 0.77 -0.52 0.78 -0.53 0.00 0.00 176.83 176.94 3ieb h ASN 24 N 1.17 0.06 0.00 6.23 -0.26 -0.45 -3.28 115.58 119.05 3ieb h ASN 24 Ca 0.31 -0.03 0.00 0.00 -0.56 0.00 0.00 56.30 56.02 3ieb h ASN 24 Cb -0.07 -0.02 0.00 0.00 -1.06 0.00 0.00 38.32 37.17 3ieb h ASN 24 CO -0.06 0.57 -0.98 1.33 -1.06 0.00 0.00 177.43 177.23 3ieb n VAL 25 N -3.92 0.00 -0.24 2.81 0.24 -0.65 -4.65 118.33 111.91 3ieb n VAL 25 Ca -0.02 -0.11 0.11 0.00 -2.04 0.00 0.00 64.34 62.29 3ieb n VAL 25 Cb 0.54 0.90 0.38 0.00 -1.47 0.00 0.00 33.84 34.19 3ieb n VAL 25 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3ieb h ALA 26 N 2.51 1.83 0.00 2.33 0.00 -0.92 -0.82 119.26 124.19 3ieb h ALA 26 Ca 0.00 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.92 3ieb h ALA 26 Cb 0.48 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.14 3ieb h ALA 26 CO 0.00 -0.04 0.00 -1.13 0.00 0.00 0.00 179.25 178.08 3ieb n SER 27 N -4.53 0.32 0.00 0.00 3.41 -1.26 -3.32 113.62 108.23 3ieb n SER 27 Ca 0.16 0.55 0.00 0.00 -0.26 0.00 0.00 58.87 59.32 3ieb n SER 27 Cb 0.42 -0.63 0.00 0.00 -0.26 0.00 0.00 64.21 63.74 3ieb n SER 27 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3ieb n TYR 28 N -1.83 0.00 -4.92 7.33 0.18 -0.37 -5.04 117.16 112.52 3ieb n TYR 28 Ca 0.04 -0.16 -0.32 0.00 1.88 0.00 0.00 57.90 59.34 3ieb n TYR 28 Cb 0.28 -0.02 -0.13 0.00 -0.38 0.00 0.00 39.34 39.09 3ieb n TYR 28 CO 0.00 0.00 0.00 0.08 -2.08 0.00 0.00 176.86 174.86 3ieb s VAL 29 N -0.32 2.95 -0.05 -3.48 1.01 -0.86 -4.96 120.40 114.69 3ieb s VAL 29 Ca 0.00 -0.79 0.03 0.00 0.00 0.00 0.00 61.98 61.22 3ieb s VAL 29 Cb 0.00 -2.15 -0.25 0.00 0.00 0.00 0.00 36.38 33.98 3ieb s VAL 29 CO 0.00 0.57 0.65 0.44 0.00 0.00 0.00 175.10 176.76 3ieb h ASP 30 N 5.30 0.21 -3.40 3.32 3.32 -1.37 -3.45 116.42 120.34 3ieb h ASP 30 Ca -0.46 -0.41 -0.53 0.00 0.02 0.00 0.00 57.03 55.65 3ieb h ASP 30 Cb 1.15 -0.07 -0.33 0.00 0.22 0.00 0.00 39.33 40.30 3ieb h ASP 30 CO 0.50 1.36 -0.82 -0.69 -1.72 0.00 0.00 179.24 177.86 3ieb s VAL 31 N -2.60 1.25 -0.19 -1.35 1.01 -0.83 -3.62 120.40 114.08 3ieb s VAL 31 Ca -0.11 -0.54 -0.04 0.00 0.00 0.00 0.00 61.98 61.29 3ieb s VAL 31 Cb 0.07 -1.13 -0.02 0.00 0.00 0.00 0.00 36.38 35.30 3ieb s VAL 31 CO 0.81 0.38 -0.03 -0.63 0.00 0.00 0.00 175.10 175.64 3ieb s ILE 32 N 0.64 3.71 -0.13 2.22 1.01 -0.38 -1.73 121.20 126.55 3ieb s ILE 32 Ca -0.15 -0.40 -0.00 0.00 0.00 0.00 0.00 60.65 60.10 3ieb s ILE 32 Cb -0.16 -2.66 -0.01 0.00 0.01 0.00 0.00 42.46 39.63 3ieb s ILE 32 CO 0.04 0.45 -0.13 -0.70 0.00 0.00 0.00 174.94 174.60 3ieb s GLU 33 N 0.95 3.36 -0.57 2.79 2.12 -0.31 -1.11 118.70 125.93 3ieb s GLU 33 Ca 0.00 -0.69 -0.26 0.00 0.36 0.00 0.00 54.97 54.38 3ieb s GLU 33 Cb -0.14 -2.62 0.03 0.00 0.26 0.00 0.00 34.13 31.66 3ieb s GLU 33 CO 0.01 0.23 1.09 0.08 -0.54 0.00 0.00 175.26 176.12 3ieb s VAL 34 N 0.32 4.17 0.83 3.70 1.01 0.52 -0.93 120.40 130.01 3ieb s VAL 34 Ca -0.11 0.62 -0.11 0.00 0.00 0.00 0.00 61.98 62.39 3ieb s VAL 34 Cb -0.16 -4.65 0.09 0.00 0.00 0.00 0.00 36.38 31.66 3ieb s VAL 34 CO 0.06 -1.26 1.10 -0.83 0.00 0.00 0.00 175.10 174.17 3ieb s GLY 35 N 2.93 1.67 0.32 4.51 0.00 -0.33 -1.41 107.32 115.02 3ieb s GLY 35 Ca 0.37 0.27 0.01 0.00 0.00 0.00 0.00 44.72 45.37 3ieb s GLY 35 CO 0.22 0.66 1.95 -0.84 0.00 0.00 0.00 173.10 175.10 3ieb h THR 36 N -1.38 1.19 -0.10 0.90 2.02 -1.83 0.35 112.91 114.06 3ieb h THR 36 Ca -0.45 -0.46 0.04 0.00 0.77 0.00 0.00 66.41 66.31 3ieb h THR 36 Cb 1.25 0.34 -0.05 0.00 -1.74 0.00 0.00 68.15 67.95 3ieb h THR 36 CO 0.50 0.21 -0.17 0.40 0.37 0.00 0.00 175.52 176.82 3ieb h ILE 37 N 0.87 0.56 -0.37 3.11 2.04 -1.88 0.64 117.51 122.47 3ieb h ILE 37 Ca 0.22 0.00 -0.14 0.00 1.00 0.00 0.00 64.86 65.94 3ieb h ILE 37 Cb 0.01 0.56 -0.01 0.00 -0.74 0.00 0.00 36.82 36.64 3ieb h ILE 37 CO -0.04 0.00 -0.34 0.25 0.00 0.00 0.00 178.15 178.03 3ieb h LEU 38 N -0.23 0.88 -0.65 1.44 5.85 -1.46 -0.80 115.31 120.33 3ieb h LEU 38 Ca 0.09 -0.38 -0.00 0.00 0.84 0.00 0.00 57.88 58.43 3ieb h LEU 38 Cb 0.36 -0.25 -0.03 0.00 0.37 0.00 0.00 40.66 41.11 3ieb h LEU 38 CO -0.24 1.13 0.40 0.00 -0.34 0.00 0.00 178.44 179.40 3ieb h ALA 39 N 0.92 0.83 -0.03 1.25 0.00 -0.65 -1.24 119.26 120.34 3ieb h ALA 39 Ca 0.07 -0.07 -0.18 0.00 0.00 0.00 0.00 54.91 54.73 3ieb h ALA 39 Cb 0.89 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.41 3ieb h ALA 39 CO 0.08 0.30 -0.77 0.74 0.00 0.00 0.00 179.25 179.60 3ieb h PHE 40 N 0.89 0.32 -0.18 0.00 0.04 -0.80 0.24 116.94 117.45 3ieb h PHE 40 Ca 0.24 -0.16 -0.01 0.00 2.80 0.00 0.00 57.97 60.84 3ieb h PHE 40 Cb -0.04 -0.04 -0.01 0.00 2.20 0.00 0.00 35.95 38.05 3ieb h PHE 40 CO -0.02 0.91 0.09 0.00 -0.60 0.00 0.00 178.31 178.69 3ieb h ALA 41 N 1.04 0.23 0.00 2.45 0.00 -0.73 -3.37 119.26 118.89 3ieb h ALA 41 Ca -0.03 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.80 3ieb h ALA 41 Cb 1.35 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.07 3ieb h ALA 41 CO 0.12 -0.20 -0.62 0.39 0.00 0.00 0.00 179.25 178.93 3ieb n GLU 42 N -4.88 3.33 0.00 0.00 -0.58 -0.50 -5.07 120.64 112.95 3ieb n GLU 42 Ca -0.04 -0.02 0.00 0.00 -0.42 0.00 0.00 57.16 56.68 3ieb n GLU 42 Cb 0.10 -0.89 0.00 0.00 -0.57 0.00 0.00 31.44 30.08 3ieb n GLU 42 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3ieb n GLY 43 N 1.54 1.65 4.47 0.62 0.00 0.85 -4.35 105.19 109.98 3ieb n GLY 43 Ca 0.00 0.15 0.00 0.00 0.00 0.00 0.00 46.02 46.17 3ieb n GLY 43 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 3ieb n LYS 45 N 0.00 0.00 -0.30 1.61 3.00 -1.26 -4.21 118.16 117.01 3ieb n LYS 45 Ca 0.00 0.00 -0.04 0.00 -0.00 0.00 0.00 58.31 58.27 3ieb n LYS 45 Cb 0.00 -0.77 0.07 0.00 0.00 0.00 0.00 35.03 34.33 3ieb n LYS 45 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 3ieb h ALA 46 N 0.00 1.03 -0.09 3.14 0.00 -1.92 0.11 119.26 121.52 3ieb h ALA 46 Ca 0.00 -0.09 -0.04 0.00 0.00 0.00 0.00 54.91 54.77 3ieb h ALA 46 Cb 0.00 -0.32 -0.00 0.00 0.00 0.00 0.00 17.79 17.46 3ieb h ALA 46 CO 0.00 0.49 -0.12 0.28 0.00 0.00 0.00 179.25 179.90 3ieb h VAL 47 N 1.10 1.38 -0.25 0.00 2.07 -1.90 -2.15 116.25 116.50 3ieb h VAL 47 Ca 0.29 -1.32 -0.12 0.00 0.82 0.00 0.00 66.70 66.37 3ieb h VAL 47 Cb -0.04 2.04 -0.01 0.00 -1.52 0.00 0.00 31.29 31.75 3ieb h VAL 47 CO -0.05 0.37 -0.34 0.77 0.02 0.00 0.00 177.57 178.33 3ieb h SER 48 N -0.19 0.55 -0.07 0.57 4.64 -1.51 -0.36 113.55 117.18 3ieb h SER 48 Ca 0.01 -0.22 -0.00 0.00 -0.47 0.00 0.00 61.79 61.11 3ieb h SER 48 Cb 0.66 -0.15 -0.00 0.00 -0.31 0.00 0.00 62.40 62.59 3ieb h SER 48 CO 0.03 0.85 0.04 0.74 -0.87 0.00 0.00 176.83 177.63 3ieb h THR 49 N 0.45 1.04 -0.30 2.95 2.02 -0.97 -1.28 112.91 116.82 3ieb h THR 49 Ca 0.05 -0.11 -0.09 0.00 0.77 0.00 0.00 66.41 67.04 3ieb h THR 49 Cb 0.81 0.99 -0.02 0.00 -1.74 0.00 0.00 68.15 68.20 3ieb h THR 49 CO 0.07 0.04 -0.18 -0.07 0.37 0.00 0.00 175.52 175.74 3ieb h LEU 50 N 0.07 0.53 0.06 2.58 3.38 -1.16 -0.65 115.31 120.12 3ieb h LEU 50 Ca 0.03 -0.16 0.01 0.00 0.09 0.00 0.00 57.88 57.85 3ieb h LEU 50 Cb 0.02 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 40.61 3ieb h LEU 50 CO -0.01 0.73 -0.11 -0.09 0.09 0.00 0.00 178.44 179.05 3ieb h ARG 51 N 0.49 -0.22 -0.52 1.13 9.65 -0.96 0.91 114.38 124.86 3ieb h ARG 51 Ca 0.08 0.01 0.09 0.00 -1.10 0.00 0.00 59.98 59.06 3ieb h ARG 51 Cb 0.59 0.05 -0.07 0.00 -1.39 0.00 0.00 29.97 29.15 3ieb h ARG 51 CO 0.04 -0.14 0.12 1.25 2.80 0.00 0.00 179.97 184.04 3ieb h HIS 52 N -0.22 0.20 0.00 2.20 2.76 -0.91 -2.67 115.15 116.51 3ieb h HIS 52 Ca 0.02 0.03 -0.15 0.00 -2.20 0.00 0.00 60.37 58.08 3ieb h HIS 52 Cb 0.25 -0.01 -0.02 0.00 1.55 0.00 0.00 27.41 29.17 3ieb h HIS 52 CO -0.15 0.01 -0.70 -0.91 -1.30 0.00 0.00 177.93 174.89 3ieb h ASN 53 N 0.27 0.00 -2.10 3.26 2.35 -0.88 -3.38 115.58 115.10 3ieb h ASN 53 Ca 0.26 0.00 -0.58 0.00 -0.55 0.00 0.00 56.30 55.44 3ieb h ASN 53 Cb 0.34 0.00 -0.40 0.00 0.05 0.00 0.00 38.32 38.31 3ieb h ASN 53 CO -0.32 0.70 -0.93 1.41 -1.65 0.00 0.00 177.43 176.64 3ieb n HIS 54 N -3.59 0.96 0.38 1.19 8.25 0.29 -4.96 115.22 117.75 3ieb n HIS 54 Ca -0.00 -3.76 0.14 0.00 -0.26 0.00 0.00 57.72 53.84 3ieb n HIS 54 Cb 0.71 -0.40 0.50 0.00 1.12 0.00 0.00 29.99 31.93 3ieb n HIS 54 CO 0.00 0.00 0.00 -1.00 0.64 0.00 0.00 176.34 175.98 3ieb h PRO 55 N 4.16 0.00 -0.16 -0.41 0.13 -1.69 -2.53 132.00 131.50 3ieb h PRO 55 Ca 0.12 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.25 3ieb h PRO 55 Cb 0.81 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.94 3ieb h PRO 55 CO 0.58 0.00 0.00 0.09 -0.23 0.00 0.00 178.00 178.44 3ieb n ASN 56 N -2.60 3.04 -4.87 1.44 3.02 -1.26 -4.97 115.26 109.06 3ieb n ASN 56 Ca 0.02 -1.96 -0.33 0.00 -0.03 0.00 0.00 54.58 52.28 3ieb n ASN 56 Cb 0.32 -0.09 -0.05 0.00 -0.61 0.00 0.00 39.78 39.35 3ieb n ASN 56 CO 0.00 0.00 0.00 -1.00 -2.62 0.00 0.00 177.26 173.64 3ieb s HIS 57 N -1.82 3.51 0.19 3.10 3.76 -0.96 -5.04 115.29 118.03 3ieb s HIS 57 Ca 0.32 0.89 -0.32 0.00 -0.15 0.00 0.00 55.06 55.81 3ieb s HIS 57 Cb 0.21 -2.25 -0.11 0.00 1.11 0.00 0.00 32.58 31.54 3ieb s HIS 57 CO 0.31 0.37 1.63 0.42 -0.85 0.00 0.00 174.74 176.62 3ieb s ILE 58 N -1.63 2.36 -0.08 0.60 1.01 -1.24 -4.94 121.20 117.28 3ieb s ILE 58 Ca 0.42 0.26 0.04 0.00 0.00 0.00 0.00 60.65 61.37 3ieb s ILE 58 Cb -0.13 -3.17 -0.00 0.00 0.01 0.00 0.00 42.46 39.18 3ieb s ILE 58 CO 0.20 0.02 -0.22 -0.22 0.00 0.00 0.00 174.94 174.72 3ieb s LEU 59 N 1.10 2.02 -0.10 2.97 2.96 -1.26 -1.25 118.68 125.12 3ieb s LEU 59 Ca 0.72 -0.50 -0.01 0.00 -0.22 0.00 0.00 54.13 54.11 3ieb s LEU 59 Cb -0.46 -1.30 -0.03 0.00 0.50 0.00 0.00 46.19 44.90 3ieb s LEU 59 CO 0.32 0.16 -0.05 -0.69 -1.32 0.00 0.00 176.35 174.77 3ieb s VAL 60 N 0.26 3.87 -0.35 1.68 1.01 -0.26 -0.50 120.40 126.10 3ieb s VAL 60 Ca -0.14 -0.40 -0.07 0.00 0.00 0.00 0.00 61.98 61.37 3ieb s VAL 60 Cb -0.16 -2.63 0.05 0.00 0.00 0.00 0.00 36.38 33.63 3ieb s VAL 60 CO 0.07 0.56 0.13 0.00 0.00 0.00 0.00 175.10 175.86 3ieb s ASP 62 N 1.51 7.11 0.00 0.00 2.15 -0.50 -2.26 116.67 124.69 3ieb s ASP 62 Ca -0.01 1.33 0.00 0.00 0.43 0.00 0.00 52.55 54.30 3ieb s ASP 62 Cb -0.20 -2.44 0.00 0.00 -0.30 0.00 0.00 42.92 39.98 3ieb s ASP 62 CO 0.02 -0.01 0.00 0.29 -0.17 0.00 0.00 175.17 175.30 3ieb n LYS 64 N 3.09 0.00 -1.68 4.34 5.02 -1.06 -3.18 118.16 124.68 3ieb n LYS 64 Ca -0.03 0.00 -0.46 0.00 -2.02 0.00 0.00 58.31 55.81 3ieb n LYS 64 Cb 0.51 0.00 -0.04 0.00 -0.02 0.00 0.00 35.03 35.48 3ieb n LYS 64 CO 0.00 0.00 0.00 2.41 -0.52 0.00 0.00 177.40 179.29 3ieb n THR 65 N 0.00 0.44 -0.03 -0.18 -1.04 -1.03 -3.79 114.28 108.65 3ieb n THR 65 Ca 0.00 -0.08 -0.01 0.00 -2.04 0.00 0.00 64.05 61.93 3ieb n THR 65 Cb 0.00 -1.92 -0.07 0.00 -1.82 0.00 0.00 70.33 66.52 3ieb n THR 65 CO 0.00 0.00 0.00 0.41 -0.64 0.00 0.00 175.07 174.84 3ieb n THR 66 N 4.73 0.36 -3.89 12.58 -1.04 -1.26 -1.18 114.28 124.59 3ieb n THR 66 Ca 0.20 -0.32 -0.09 0.00 -2.04 0.00 0.00 64.05 61.80 3ieb n THR 66 Cb 0.33 -0.33 -0.01 0.00 -1.82 0.00 0.00 70.33 68.49 3ieb n THR 66 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 3ieb s ASP 67 N -3.70 0.01 -1.23 8.00 -1.08 -1.26 -4.29 116.67 113.11 3ieb s ASP 67 Ca -0.04 -0.97 -0.08 0.00 -0.52 0.00 0.00 52.55 50.94 3ieb s ASP 67 Cb 0.04 0.74 0.01 0.00 -1.46 0.00 0.00 42.92 42.25 3ieb s ASP 67 CO 0.38 -1.44 1.00 0.61 0.52 0.00 0.00 175.17 176.25 3ieb n GLY 68 N -0.49 -0.38 0.06 2.66 0.00 -1.26 -4.88 105.19 100.90 3ieb n GLY 68 Ca -0.05 0.14 -0.12 0.00 0.00 0.00 0.00 46.02 46.00 3ieb n GLY 68 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 3ieb h GLY 69 N -2.29 0.09 0.24 -0.02 0.00 -1.93 -0.64 103.07 98.51 3ieb h GLY 69 Ca -0.50 -0.04 0.08 0.00 0.00 0.00 0.00 47.33 46.86 3ieb h GLY 69 CO 0.50 0.04 -0.05 0.00 0.00 0.00 0.00 176.54 177.03 3ieb h ALA 70 N 0.89 0.34 -0.03 3.60 0.00 -1.85 -0.09 119.26 122.12 3ieb h ALA 70 Ca 0.02 0.14 -0.02 0.00 0.00 0.00 0.00 54.91 55.05 3ieb h ALA 70 Cb 0.13 0.26 0.00 0.00 0.00 0.00 0.00 17.79 18.18 3ieb h ALA 70 CO -0.00 -0.42 -0.07 0.82 0.00 0.00 0.00 179.25 179.58 3ieb h ILE 71 N 0.05 1.46 -0.85 0.00 2.04 -1.94 -2.77 117.51 115.50 3ieb h ILE 71 Ca 0.21 -1.45 -0.01 0.00 1.00 0.00 0.00 64.86 64.60 3ieb h ILE 71 Cb 0.31 2.36 -0.04 0.00 -0.74 0.00 0.00 36.82 38.71 3ieb h ILE 71 CO -0.39 0.39 0.48 -0.07 0.00 0.00 0.00 178.15 178.57 3ieb h LEU 72 N -0.46 1.05 -0.20 1.44 3.38 -1.04 -3.01 115.31 116.46 3ieb h LEU 72 Ca -0.00 -0.09 -0.01 0.00 0.09 0.00 0.00 57.88 57.88 3ieb h LEU 72 Cb 0.67 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 41.15 3ieb h LEU 72 CO 0.02 0.83 0.10 0.28 0.09 0.00 0.00 178.44 179.75 3ieb h SER 73 N 1.18 0.26 0.00 -0.43 0.02 -1.07 -1.90 113.55 111.61 3ieb h SER 73 Ca 0.30 -0.12 0.00 0.00 -0.84 0.00 0.00 61.79 61.13 3ieb h SER 73 Cb -0.00 -0.07 0.00 0.00 0.14 0.00 0.00 62.40 62.47 3ieb h SER 73 CO -0.05 0.31 0.00 -1.14 -1.14 0.00 0.00 176.83 174.81 3ieb n ARG 74 N -4.86 0.15 0.00 3.45 0.63 -1.05 -1.32 116.66 113.66 3ieb n ARG 74 Ca -0.04 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.89 3ieb n ARG 74 Cb 0.10 -1.43 0.00 0.00 0.45 0.00 0.00 32.46 31.58 3ieb n ARG 74 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 3ieb n ALA 76 N 1.09 0.00 -0.24 5.13 0.00 -0.72 -0.77 120.51 125.01 3ieb n ALA 76 Ca 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 53.44 53.37 3ieb n ALA 76 Cb 0.07 0.00 0.04 0.00 0.00 0.00 0.00 19.45 19.56 3ieb n ALA 76 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 177.50 178.24 3ieb h PHE 77 N 0.00 1.00 -0.12 0.00 0.04 -1.43 -1.10 116.94 115.33 3ieb h PHE 77 Ca 0.00 -0.07 -0.04 0.00 2.80 0.00 0.00 57.97 60.66 3ieb h PHE 77 Cb 0.00 -0.30 -0.01 0.00 2.20 0.00 0.00 35.95 37.84 3ieb h PHE 77 CO 0.00 0.78 -0.12 0.93 -0.60 0.00 0.00 178.31 179.29 3ieb h GLU 78 N 0.93 0.18 0.00 1.51 5.08 -1.19 -1.40 114.58 119.69 3ieb h GLU 78 Ca 0.22 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.54 3ieb h GLU 78 Cb 0.19 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.41 3ieb h GLU 78 CO -0.02 0.32 0.00 0.00 -1.00 0.00 0.00 179.01 178.31 3ieb h ALA 79 N 1.70 1.00 0.00 3.43 0.00 -1.71 -3.47 119.26 120.22 3ieb h ALA 79 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.95 3ieb h ALA 79 Cb 0.33 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.12 3ieb h ALA 79 CO 0.02 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.68 3ieb n GLY 80 N 0.44 1.20 3.77 0.00 0.00 -0.53 -3.23 105.19 106.85 3ieb n GLY 80 Ca 0.03 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.64 3ieb n GLY 80 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ieb s ALA 81 N -2.00 3.49 -0.12 4.61 0.00 -0.45 -4.83 121.76 122.46 3ieb s ALA 81 Ca 0.00 1.37 -0.12 0.00 0.00 0.00 0.00 51.96 53.21 3ieb s ALA 81 Cb 0.00 -3.53 -0.26 0.00 0.00 0.00 0.00 23.12 19.33 3ieb s ALA 81 CO 0.00 -0.82 0.44 -0.44 0.00 0.00 0.00 175.76 174.94 3ieb h ASP 82 N 3.13 0.38 -4.33 0.00 3.32 -1.12 -3.40 116.42 114.39 3ieb h ASP 82 Ca -0.50 -0.86 -0.63 0.00 0.02 0.00 0.00 57.03 55.06 3ieb h ASP 82 Cb 1.23 -0.12 -0.27 0.00 0.22 0.00 0.00 39.33 40.39 3ieb h ASP 82 CO 0.64 1.74 -0.86 0.26 -1.72 0.00 0.00 179.24 179.30 3ieb s TRP 83 N -2.51 2.00 0.13 4.55 0.51 -0.85 -1.45 118.94 121.31 3ieb s TRP 83 Ca -0.22 -0.39 0.06 0.00 -2.12 0.00 0.00 56.10 53.44 3ieb s TRP 83 Cb 0.06 -1.22 -0.04 0.00 -0.81 0.00 0.00 33.47 31.46 3ieb s TRP 83 CO 0.76 0.07 -0.14 0.96 -0.51 0.00 0.00 176.95 178.09 3ieb s ILE 84 N -0.74 1.36 0.02 2.03 -4.36 -0.45 -0.85 121.20 118.21 3ieb s ILE 84 Ca 0.09 -1.76 0.01 0.00 -0.26 0.00 0.00 60.65 58.73 3ieb s ILE 84 Cb -0.09 -1.58 -0.04 0.00 1.25 0.00 0.00 42.46 42.00 3ieb s ILE 84 CO 0.01 -0.43 0.07 0.42 0.24 0.00 0.00 174.94 175.25 3ieb s THR 85 N -2.22 4.60 -0.04 8.37 -4.23 -0.96 -0.52 115.64 120.65 3ieb s THR 85 Ca 0.10 -0.53 0.01 0.00 -1.18 0.00 0.00 61.69 60.09 3ieb s THR 85 Cb -0.04 -3.13 0.02 0.00 1.34 0.00 0.00 72.50 70.69 3ieb s THR 85 CO 0.03 0.29 -0.05 -0.69 -0.54 0.00 0.00 174.62 173.67 3ieb s VAL 86 N -1.23 0.53 0.30 2.29 1.01 0.13 -2.46 120.40 120.96 3ieb s VAL 86 Ca 0.24 -0.15 -0.29 0.00 0.00 0.00 0.00 61.98 61.78 3ieb s VAL 86 Cb -0.12 -0.54 -0.10 0.00 0.00 0.00 0.00 36.38 35.62 3ieb s VAL 86 CO 0.16 0.21 1.35 -0.55 0.00 0.00 0.00 175.10 176.27 3ieb s SER 87 N 0.74 6.74 0.60 3.32 0.15 -0.32 -0.59 113.70 124.34 3ieb s SER 87 Ca -0.10 2.67 0.28 0.00 0.70 0.00 0.00 55.95 59.51 3ieb s SER 87 Cb -0.13 -2.64 1.42 0.00 -1.71 0.00 0.00 66.02 62.96 3ieb s SER 87 CO 0.00 -0.59 1.82 0.00 1.20 0.00 0.00 173.24 175.68 3ieb h ALA 88 N 3.96 2.14 -0.00 5.45 0.00 -1.59 -0.78 119.26 128.44 3ieb h ALA 88 Ca -0.48 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.42 3ieb h ALA 88 Cb 1.22 0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.05 3ieb h ALA 88 CO 0.70 -0.77 -0.14 0.00 0.00 0.00 0.00 179.25 179.03 3ieb n ALA 89 N -2.26 2.73 -1.74 0.00 0.00 -1.26 -4.84 120.51 113.15 3ieb n ALA 89 Ca 0.08 -0.21 -0.39 0.00 0.00 0.00 0.00 53.44 52.92 3ieb n ALA 89 Cb 0.72 -1.36 0.03 0.00 0.00 0.00 0.00 19.45 18.84 3ieb n ALA 89 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3ieb n ALA 90 N -1.32 1.62 -1.76 0.00 0.00 -0.30 -4.96 120.51 113.79 3ieb n ALA 90 Ca 0.10 0.19 -0.37 0.00 0.00 0.00 0.00 53.44 53.35 3ieb n ALA 90 Cb 0.31 -2.34 0.02 0.00 0.00 0.00 0.00 19.45 17.43 3ieb n ALA 90 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 3ieb s HIS 91 N -1.25 2.58 0.55 0.00 5.65 -1.26 -4.78 115.29 116.78 3ieb s HIS 91 Ca 0.66 1.48 0.25 0.00 0.25 0.00 0.00 55.06 57.71 3ieb s HIS 91 Cb -0.44 -3.52 1.45 0.00 -1.18 0.00 0.00 32.58 28.88 3ieb s HIS 91 CO 0.53 -2.08 2.03 0.97 -0.65 0.00 0.00 174.74 175.54 3ieb h ILE 92 N 1.49 0.67 -0.28 0.89 6.09 -1.94 0.56 117.51 124.99 3ieb h ILE 92 Ca -0.50 0.00 -0.13 0.00 -1.37 0.00 0.00 64.86 62.85 3ieb h ILE 92 Cb 1.28 0.78 -0.01 0.00 0.47 0.00 0.00 36.82 39.33 3ieb h ILE 92 CO 0.58 0.00 -0.38 0.00 -3.07 0.00 0.00 178.15 175.28 3ieb h ALA 93 N 1.75 0.82 -0.29 0.18 0.00 -1.99 0.61 119.26 120.34 3ieb h ALA 93 Ca 0.18 -0.43 -0.06 0.00 0.00 0.00 0.00 54.91 54.60 3ieb h ALA 93 Cb 0.79 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.46 3ieb h ALA 93 CO -0.00 0.65 -0.06 1.15 0.00 0.00 0.00 179.25 180.98 3ieb h THR 94 N 0.53 1.28 -0.83 0.00 2.02 -1.28 -1.27 112.91 113.35 3ieb h THR 94 Ca 0.05 -1.08 0.01 0.00 0.77 0.00 0.00 66.41 66.16 3ieb h THR 94 Cb 0.90 1.39 -0.04 0.00 -1.74 0.00 0.00 68.15 68.65 3ieb h THR 94 CO 0.08 0.35 0.55 0.40 0.37 0.00 0.00 175.52 177.27 3ieb h ILE 95 N 0.33 1.21 -0.63 3.11 2.04 -1.02 -0.99 117.51 121.56 3ieb h ILE 95 Ca 0.08 -0.38 -0.06 0.00 1.00 0.00 0.00 64.86 65.49 3ieb h ILE 95 Cb 0.54 -0.01 -0.03 0.00 -0.74 0.00 0.00 36.82 36.58 3ieb h ILE 95 CO 0.03 0.20 0.14 0.00 0.00 0.00 0.00 178.15 178.52 3ieb h ALA 96 N 1.31 1.06 -0.56 1.87 0.00 -0.75 -1.37 119.26 120.81 3ieb h ALA 96 Ca 0.31 -0.24 -0.07 0.00 0.00 0.00 0.00 54.91 54.91 3ieb h ALA 96 Cb -0.12 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.40 3ieb h ALA 96 CO -0.07 0.62 0.05 0.00 0.00 0.00 0.00 179.25 179.84 3ieb h ALA 97 N 1.20 1.03 -0.35 0.00 0.00 -0.50 -0.98 119.26 119.65 3ieb h ALA 97 Ca 0.20 -0.27 -0.09 0.00 0.00 0.00 0.00 54.91 54.75 3ieb h ALA 97 Cb 0.36 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 3ieb h ALA 97 CO 0.00 0.61 -0.14 0.00 0.00 0.00 0.00 179.25 179.72 3ieb h LYS 99 N 0.51 0.79 -0.33 0.00 1.63 -1.08 -0.07 116.57 118.02 3ieb h LYS 99 Ca 0.08 -0.10 -0.01 0.00 -0.85 0.00 0.00 60.65 59.77 3ieb h LYS 99 Cb 0.67 -0.15 -0.02 0.00 -0.60 0.00 0.00 32.23 32.13 3ieb h LYS 99 CO 0.05 0.62 0.16 -0.22 -3.45 0.00 0.00 179.45 176.60 3ieb h LYS 100 N 0.79 0.47 -0.28 1.90 3.64 -1.10 -0.12 116.57 121.87 3ieb h LYS 100 Ca 0.20 -0.07 -0.04 0.00 -1.27 0.00 0.00 60.65 59.47 3ieb h LYS 100 Cb 0.09 -0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 31.81 3ieb h LYS 100 CO -0.03 0.43 0.02 0.28 -2.27 0.00 0.00 179.45 177.88 3ieb h VAL 101 N 0.39 1.25 -0.49 2.00 2.07 -1.28 -1.95 116.25 118.24 3ieb h VAL 101 Ca 0.11 -0.87 0.06 0.00 0.82 0.00 0.00 66.70 66.82 3ieb h VAL 101 Cb 0.11 1.27 -0.05 0.00 -1.52 0.00 0.00 31.29 31.10 3ieb h VAL 101 CO -0.01 0.28 0.19 0.00 0.02 0.00 0.00 177.57 178.05 3ieb h ALA 102 N 0.84 0.61 -0.60 1.67 0.00 -0.84 -1.08 119.26 119.85 3ieb h ALA 102 Ca 0.08 0.06 -0.10 0.00 0.00 0.00 0.00 54.91 54.95 3ieb h ALA 102 Cb 0.39 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.18 3ieb h ALA 102 CO 0.01 -0.19 -0.00 -0.44 0.00 0.00 0.00 179.25 178.62 3ieb h ASP 103 N 0.38 1.03 -0.95 0.00 3.32 -0.89 0.46 116.42 119.77 3ieb h ASP 103 Ca 0.23 -0.29 0.09 0.00 0.02 0.00 0.00 57.03 57.08 3ieb h ASP 103 Cb 0.23 -0.28 -0.07 0.00 0.22 0.00 0.00 39.33 39.43 3ieb h ASP 103 CO -0.22 1.08 0.61 -0.33 -1.72 0.00 0.00 179.24 178.66 3ieb h GLU 104 N 0.96 0.98 -0.62 3.56 5.08 -0.61 -3.06 114.58 120.87 3ieb h GLU 104 Ca 0.17 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.47 3ieb h GLU 104 Cb 0.55 -0.22 0.00 0.00 0.50 0.00 0.00 28.75 29.58 3ieb h GLU 104 CO 0.03 0.65 0.00 1.28 -1.00 0.00 0.00 179.01 179.97 3ieb n LEU 105 N -4.53 3.71 -3.61 1.33 4.77 -0.48 -4.94 117.00 113.25 3ieb n LEU 105 Ca 0.16 -2.03 -0.26 0.00 -0.03 0.00 0.00 56.01 53.85 3ieb n LEU 105 Cb 0.27 -0.42 0.04 0.00 -2.33 0.00 0.00 43.42 40.98 3ieb n LEU 105 CO 0.31 0.91 0.12 0.59 -1.33 0.00 0.00 177.39 177.99 3ieb n ASN 106 N 1.30 -5.50 -1.36 -1.43 5.03 -0.44 -5.01 115.26 107.85 3ieb n ASN 106 Ca 0.21 -0.58 0.00 0.00 0.87 0.00 0.00 54.58 55.08 3ieb n ASN 106 Cb 0.58 -4.38 0.00 0.00 -1.02 0.00 0.00 39.78 34.96 3ieb n ASN 106 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 3ieb n GLY 107 N -1.73 3.31 3.00 7.41 0.00 0.02 -5.03 105.19 112.17 3ieb n GLY 107 Ca 0.00 -2.12 -0.10 0.00 0.00 0.00 0.00 46.02 43.80 3ieb n GLY 107 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3ieb s GLU 108 N -0.66 0.29 -0.08 1.61 2.02 -0.53 -4.47 118.70 116.87 3ieb s GLU 108 Ca 0.00 -0.40 -0.08 0.00 0.02 0.00 0.00 54.97 54.51 3ieb s GLU 108 Cb 0.00 0.11 -0.04 0.00 0.10 0.00 0.00 34.13 34.30 3ieb s GLU 108 CO 0.00 -0.05 0.20 0.42 0.02 0.00 0.00 175.26 175.85 3ieb s ILE 109 N -1.08 5.40 -0.05 -1.63 -1.09 -1.26 -1.34 121.20 120.15 3ieb s ILE 109 Ca -0.12 0.31 0.04 0.00 -2.23 0.00 0.00 60.65 58.65 3ieb s ILE 109 Cb -0.07 -3.48 -0.00 0.00 -1.58 0.00 0.00 42.46 37.33 3ieb s ILE 109 CO -0.00 0.58 -0.16 -1.10 -1.23 0.00 0.00 174.94 173.02 3ieb s GLN 110 N -1.14 1.77 -0.23 2.79 -0.21 0.32 -4.28 119.66 118.68 3ieb s GLN 110 Ca 0.18 -0.57 -0.18 0.00 0.02 0.00 0.00 55.36 54.81 3ieb s GLN 110 Cb -0.13 -1.52 -0.03 0.00 1.00 0.00 0.00 33.01 32.33 3ieb s GLN 110 CO 0.07 0.21 0.50 0.42 -2.12 0.00 0.00 175.29 174.37 3ieb s ILE 111 N 0.14 5.11 -0.41 1.08 -1.09 -0.72 -0.70 121.20 124.61 3ieb s ILE 111 Ca -0.06 0.88 -0.24 0.00 -2.23 0.00 0.00 60.65 59.00 3ieb s ILE 111 Cb -0.12 -3.82 0.02 0.00 -1.58 0.00 0.00 42.46 36.96 3ieb s ILE 111 CO 0.03 0.15 0.83 -1.61 -1.23 0.00 0.00 174.94 173.11 3ieb s GLU 112 N 1.89 3.64 -0.70 2.79 0.41 0.25 0.65 118.70 127.62 3ieb s GLU 112 Ca 0.22 0.22 -0.26 0.00 -0.41 0.00 0.00 54.97 54.74 3ieb s GLU 112 Cb -0.15 -3.86 0.04 0.00 -1.78 0.00 0.00 34.13 28.37 3ieb s GLU 112 CO 0.09 -1.01 1.19 0.42 -0.49 0.00 0.00 175.26 175.47 3ieb s ILE 113 N 3.33 3.91 0.11 -1.63 1.01 -0.91 -1.69 121.20 125.33 3ieb s ILE 113 Ca 0.33 0.28 0.00 0.00 0.00 0.00 0.00 60.65 61.27 3ieb s ILE 113 Cb -0.12 -4.84 -0.04 0.00 0.01 0.00 0.00 42.46 37.47 3ieb s ILE 113 CO 0.20 -1.69 -0.01 -0.31 0.00 0.00 0.00 174.94 173.13 3ieb s TYR 114 N 5.23 0.88 0.00 3.97 2.02 -1.26 -4.71 117.35 123.48 3ieb s TYR 114 Ca 0.33 -1.05 0.00 0.00 -0.37 0.00 0.00 57.07 55.97 3ieb s TYR 114 Cb -0.10 -0.52 0.00 0.00 -0.40 0.00 0.00 41.96 40.94 3ieb s TYR 114 CO 0.15 -0.31 0.00 0.41 -1.57 0.00 0.00 175.55 174.23 3ieb n GLY 115 N -0.07 -1.87 2.41 0.71 0.00 -1.26 -4.26 105.19 100.86 3ieb n GLY 115 Ca -0.10 -1.65 -0.38 0.00 0.00 0.00 0.00 46.02 43.90 3ieb n GLY 115 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3ieb n ASN 116 N 0.46 8.13 -4.82 1.61 5.03 -1.26 -4.97 115.26 119.44 3ieb n ASN 116 Ca 0.00 -2.95 -0.32 0.00 0.87 0.00 0.00 54.58 52.18 3ieb n ASN 116 Cb 0.00 -1.42 0.03 0.00 -1.02 0.00 0.00 39.78 37.37 3ieb n ASN 116 CO 0.00 0.00 0.00 -1.66 -1.83 0.00 0.00 177.26 173.77 3ieb s TRP 117 N -0.11 3.11 0.00 3.10 1.48 -1.26 -5.13 118.94 120.13 3ieb s TRP 117 Ca 0.60 1.45 0.00 0.00 -1.06 0.00 0.00 56.10 57.09 3ieb s TRP 117 Cb 0.20 -2.92 0.00 0.00 -1.16 0.00 0.00 33.47 29.59 3ieb s TRP 117 CO -0.09 -1.11 0.00 0.25 -4.06 0.00 0.00 176.95 171.94 3ieb n THR 118 N -2.59 0.00 0.00 0.66 -2.24 -1.26 -5.03 114.28 103.82 3ieb n THR 118 Ca 0.08 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.86 3ieb n THR 118 Cb 0.53 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.76 3ieb n THR 118 CO 0.00 0.00 0.00 1.67 -0.57 0.00 0.00 175.07 176.17 3ieb n GLN 120 N 0.00 0.00 -0.27 -0.78 7.27 -1.26 -1.85 117.38 120.48 3ieb n GLN 120 Ca 0.00 0.00 -0.05 0.00 0.07 0.00 0.00 57.00 57.02 3ieb n GLN 120 Cb 0.00 0.00 0.06 0.00 2.41 0.00 0.00 30.24 32.71 3ieb n GLN 120 CO 0.00 0.00 0.00 -0.44 0.07 0.00 0.00 177.06 176.69 3ieb h ASP 121 N 0.00 0.90 -0.68 1.69 3.32 -1.99 -1.64 116.42 118.01 3ieb h ASP 121 Ca 0.00 -0.05 -0.05 0.00 0.02 0.00 0.00 57.03 56.94 3ieb h ASP 121 Cb 0.00 -0.23 -0.03 0.00 0.22 0.00 0.00 39.33 39.30 3ieb h ASP 121 CO 0.00 0.69 0.21 0.00 -1.72 0.00 0.00 179.24 178.42 3ieb h ALA 122 N 1.25 0.89 -0.57 3.45 0.00 -1.80 -1.37 119.26 121.11 3ieb h ALA 122 Ca 0.27 -0.22 -0.05 0.00 0.00 0.00 0.00 54.91 54.92 3ieb h ALA 122 Cb -0.06 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.44 3ieb h ALA 122 CO -0.05 0.57 0.16 0.87 0.00 0.00 0.00 179.25 180.80 3ieb h LYS 123 N 1.00 0.87 -0.54 0.00 1.57 -1.78 -1.56 116.57 116.13 3ieb h LYS 123 Ca 0.22 -0.17 -0.05 0.00 -1.87 0.00 0.00 60.65 58.78 3ieb h LYS 123 Cb 0.30 -0.13 -0.02 0.00 0.08 0.00 0.00 32.23 32.45 3ieb h LYS 123 CO -0.01 0.76 0.12 0.00 -0.57 0.00 0.00 179.45 179.76 3ieb h ALA 124 N 1.33 1.20 -0.19 3.86 0.00 -0.46 0.04 119.26 125.04 3ieb h ALA 124 Ca 0.19 -0.21 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 3ieb h ALA 124 Cb 0.27 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 3ieb h ALA 124 CO -0.01 0.55 0.08 -1.49 0.00 0.00 0.00 179.25 178.39 3ieb h TRP 125 N 0.80 0.27 -0.89 0.00 6.55 -0.85 -2.76 115.95 119.07 3ieb h TRP 125 Ca 0.17 -0.02 -0.01 0.00 0.95 0.00 0.00 58.89 59.98 3ieb h TRP 125 Cb 0.31 -0.08 -0.04 0.00 -0.86 0.00 0.00 29.16 28.48 3ieb h TRP 125 CO 0.02 0.30 0.50 0.28 -1.05 0.00 0.00 178.44 178.49 3ieb h VAL 126 N 0.16 1.26 0.00 1.49 2.07 -1.04 -1.10 116.25 119.09 3ieb h VAL 126 Ca 0.06 -0.62 -0.00 0.00 0.82 0.00 0.00 66.70 66.97 3ieb h VAL 126 Cb 0.14 0.03 -0.00 0.00 -1.52 0.00 0.00 31.29 29.94 3ieb h VAL 126 CO -0.01 0.28 -0.01 0.44 0.02 0.00 0.00 177.57 178.30 3ieb h ASP 127 N 1.25 0.00 0.43 0.57 3.32 -0.81 0.15 116.42 121.32 3ieb h ASP 127 Ca 0.32 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.37 3ieb h ASP 127 Cb 0.01 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.56 3ieb h ASP 127 CO -0.05 0.01 0.00 0.18 -1.72 0.00 0.00 179.24 177.66 3ieb n LEU 128 N -4.18 0.00 0.00 1.55 4.77 -0.46 -4.89 117.00 113.78 3ieb n LEU 128 Ca -0.03 0.23 0.00 0.00 -0.03 0.00 0.00 56.01 56.18 3ieb n LEU 128 Cb 0.09 -0.23 0.00 0.00 -2.33 0.00 0.00 43.42 40.96 3ieb n LEU 128 CO 0.31 -0.01 0.00 0.61 -1.33 0.00 0.00 177.39 176.97 3ieb n GLY 129 N 1.11 0.69 3.71 -0.72 0.00 0.04 -5.04 105.19 104.98 3ieb n GLY 129 Ca 0.16 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.75 3ieb n GLY 129 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3ieb s ILE 130 N -2.10 4.75 -0.01 -0.61 1.01 -0.93 -4.94 121.20 118.36 3ieb s ILE 130 Ca 0.00 1.98 0.02 0.00 0.00 0.00 0.00 60.65 62.64 3ieb s ILE 130 Cb 0.00 -4.27 0.03 0.00 0.01 0.00 0.00 42.46 38.23 3ieb s ILE 130 CO 0.00 0.12 0.93 0.35 0.00 0.00 0.00 174.94 176.34 3ieb n THR 131 N 4.03 0.89 -4.67 2.92 -2.24 -1.26 -4.02 114.28 109.93 3ieb n THR 131 Ca 0.07 -0.93 -0.23 0.00 -2.27 0.00 0.00 64.05 60.69 3ieb n THR 131 Cb 0.50 0.51 -0.15 0.00 -2.10 0.00 0.00 70.33 69.10 3ieb n THR 131 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 3ieb s GLN 132 N -0.99 1.24 -0.04 -0.78 -0.21 -1.26 0.00 119.66 117.63 3ieb s GLN 132 Ca 0.03 -0.63 -0.18 0.00 0.02 0.00 0.00 55.36 54.60 3ieb s GLN 132 Cb 0.03 -1.22 0.03 0.00 1.00 0.00 0.00 33.01 32.85 3ieb s GLN 132 CO 0.00 0.33 0.40 0.00 -2.12 0.00 0.00 175.29 173.90 3ieb s ALA 133 N -0.48 -1.02 -0.27 6.09 0.00 -1.13 -1.75 121.76 123.19 3ieb s ALA 133 Ca 0.06 0.63 -0.09 0.00 0.00 0.00 0.00 51.96 52.56 3ieb s ALA 133 Cb -0.07 -0.02 -0.03 0.00 0.00 0.00 0.00 23.12 23.00 3ieb s ALA 133 CO -0.00 -0.28 0.12 0.42 0.00 0.00 0.00 175.76 176.02 3ieb s ILE 134 N -1.13 4.68 -0.30 0.00 -1.09 0.21 -0.93 121.20 122.63 3ieb s ILE 134 Ca -0.12 -0.11 -0.04 0.00 -2.23 0.00 0.00 60.65 58.15 3ieb s ILE 134 Cb -0.04 -3.24 0.04 0.00 -1.58 0.00 0.00 42.46 37.64 3ieb s ILE 134 CO 0.05 0.26 0.04 -0.47 -1.23 0.00 0.00 174.94 173.59 3ieb s TYR 135 N 1.66 3.21 0.02 3.97 5.04 -0.09 -2.14 117.35 129.01 3ieb s TYR 135 Ca 0.06 -1.52 -0.18 0.00 -2.44 0.00 0.00 57.07 53.00 3ieb s TYR 135 Cb -0.16 -2.18 -0.06 0.00 0.35 0.00 0.00 41.96 39.91 3ieb s TYR 135 CO 0.06 -0.73 0.50 -1.01 -1.34 0.00 0.00 175.55 173.03 3ieb s HIS 136 N 1.36 3.74 0.21 4.97 3.76 -1.26 -2.25 115.29 125.81 3ieb s HIS 136 Ca -0.02 1.12 -0.32 0.00 -0.15 0.00 0.00 55.06 55.70 3ieb s HIS 136 Cb -0.19 -2.43 -0.14 0.00 1.11 0.00 0.00 32.58 30.93 3ieb s HIS 136 CO 0.00 0.56 1.31 -2.13 -0.85 0.00 0.00 174.74 173.63 3ieb n ARG 137 N 2.01 1.68 -1.64 1.40 0.63 -0.16 -4.78 116.66 115.81 3ieb n ARG 137 Ca -0.11 0.60 -0.47 0.00 -0.92 0.00 0.00 57.85 56.95 3ieb n ARG 137 Cb 0.51 -2.20 -0.04 0.00 0.45 0.00 0.00 32.46 31.19 3ieb n ARG 137 CO 0.00 0.00 0.00 0.45 -2.51 0.00 0.00 177.63 175.57 3ieb n SER 138 N 2.13 2.34 -0.20 6.15 2.88 -1.26 -4.82 113.62 120.85 3ieb n SER 138 Ca 0.13 1.12 -0.02 0.00 -1.33 0.00 0.00 58.87 58.78 3ieb n SER 138 Cb 0.29 -1.34 0.19 0.00 -0.75 0.00 0.00 64.21 62.60 3ieb n SER 138 CO 0.00 0.00 0.00 -0.09 -1.23 0.00 0.00 175.04 173.72 3ieb h ARG 139 N 4.48 0.97 -0.48 -1.46 9.65 -1.99 -1.18 114.38 124.37 3ieb h ARG 139 Ca -0.45 -0.13 0.01 0.00 -1.10 0.00 0.00 59.98 58.32 3ieb h ARG 139 Cb 1.29 -0.18 -0.03 0.00 -1.39 0.00 0.00 29.97 29.66 3ieb h ARG 139 CO 0.78 0.75 0.31 -0.44 2.80 0.00 0.00 179.97 184.16 3ieb h ASP 140 N 0.97 0.52 -0.67 -3.80 3.32 -1.99 0.47 116.42 115.24 3ieb h ASP 140 Ca 0.24 -0.01 -0.01 0.00 0.02 0.00 0.00 57.03 57.28 3ieb h ASP 140 Cb 0.09 -0.12 -0.03 0.00 0.22 0.00 0.00 39.33 39.48 3ieb h ASP 140 CO -0.03 0.37 0.39 0.00 -1.72 0.00 0.00 179.24 178.25 3ieb h ALA 141 N 1.19 0.85 0.14 3.45 0.00 -1.81 -1.84 119.26 121.25 3ieb h ALA 141 Ca 0.19 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 3ieb h ALA 141 Cb -0.03 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 17.49 3ieb h ALA 141 CO -0.06 0.34 -0.07 1.49 0.00 0.00 0.00 179.25 180.95 3ieb h GLU 142 N 0.91 -0.18 -0.00 0.00 4.81 -0.85 -0.78 114.58 118.48 3ieb h GLU 142 Ca 0.24 0.01 -0.01 0.00 -0.13 0.00 0.00 59.36 59.47 3ieb h GLU 142 Cb -0.01 0.04 -0.00 0.00 0.63 0.00 0.00 28.75 29.41 3ieb h GLU 142 CO -0.04 -0.09 -0.07 -0.07 -0.73 0.00 0.00 179.01 178.01 3ieb h LEU 143 N -0.22 0.00 0.00 1.64 3.38 -0.75 -2.22 115.31 117.15 3ieb h LEU 143 Ca -0.02 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.95 3ieb h LEU 143 Cb 0.17 -0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.92 3ieb h LEU 143 CO 0.03 0.07 -0.70 0.00 0.09 0.00 0.00 178.44 177.94 3ieb n ALA 144 N -2.53 3.23 -1.96 1.53 0.00 -0.71 -4.96 120.51 115.13 3ieb n ALA 144 Ca -0.03 -0.32 -0.01 0.00 0.00 0.00 0.00 53.44 53.08 3ieb n ALA 144 Cb 0.15 -1.10 -0.00 0.00 0.00 0.00 0.00 19.45 18.50 3ieb n ALA 144 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3ieb n GLY 145 N 1.39 0.33 1.29 0.00 0.00 -0.58 -4.99 105.19 102.63 3ieb n GLY 145 Ca 0.04 -0.85 0.08 0.00 0.00 0.00 0.00 46.02 45.29 3ieb n GLY 145 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 3ieb n ILE 146 N -3.93 2.22 -4.48 -0.61 -5.35 -0.40 -5.04 119.36 101.77 3ieb n ILE 146 Ca -0.02 -1.53 0.00 0.00 -0.27 0.00 0.00 62.75 60.94 3ieb n ILE 146 Cb 0.48 -0.12 0.00 0.00 -1.74 0.00 0.00 39.64 38.26 3ieb n ILE 146 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3ieb n GLY 147 N 0.23 0.50 3.68 3.28 0.00 -1.26 -4.56 105.19 107.07 3ieb n GLY 147 Ca 0.23 -0.83 -0.37 0.00 0.00 0.00 0.00 46.02 45.04 3ieb n GLY 147 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 3ieb s TRP 148 N 0.00 3.39 0.35 1.61 0.52 -1.26 -4.68 118.94 118.87 3ieb s TRP 148 Ca 0.00 0.55 0.03 0.00 0.02 0.00 0.00 56.10 56.69 3ieb s TRP 148 Cb 0.00 -2.43 -0.02 0.00 -1.15 0.00 0.00 33.47 29.87 3ieb s TRP 148 CO 0.00 0.07 0.53 0.95 0.02 0.00 0.00 176.95 178.52 3ieb s THR 149 N 1.03 4.59 0.37 2.01 -4.23 -1.26 -4.99 115.64 113.16 3ieb s THR 149 Ca 0.16 -0.69 0.08 0.00 -1.18 0.00 0.00 61.69 60.06 3ieb s THR 149 Cb -0.14 -3.65 0.30 0.00 1.34 0.00 0.00 72.50 70.35 3ieb s THR 149 CO 0.06 -0.36 1.95 0.74 -0.54 0.00 0.00 174.62 176.47 3ieb h THR 150 N 0.76 0.97 -0.37 3.99 2.02 -1.97 -2.30 112.91 116.01 3ieb h THR 150 Ca -0.48 -0.23 -0.03 0.00 0.77 0.00 0.00 66.41 66.44 3ieb h THR 150 Cb 1.24 0.22 -0.02 0.00 -1.74 0.00 0.00 68.15 67.86 3ieb h THR 150 CO 0.58 0.12 0.13 -0.78 0.37 0.00 0.00 175.52 175.94 3ieb h ASP 151 N 0.68 0.53 -0.11 4.18 3.58 -1.99 -0.50 116.42 122.80 3ieb h ASP 151 Ca 0.33 -0.19 0.02 0.00 0.42 0.00 0.00 57.03 57.61 3ieb h ASP 151 Cb 0.39 -0.14 -0.02 0.00 1.72 0.00 0.00 39.33 41.28 3ieb h ASP 151 CO -0.12 0.58 -0.02 0.44 -2.88 0.00 0.00 179.24 177.25 3ieb h ASP 152 N 0.45 -0.09 -0.60 2.28 3.32 -1.86 -0.70 116.42 119.23 3ieb h ASP 152 Ca 0.12 0.03 -0.00 0.00 0.02 0.00 0.00 57.03 57.20 3ieb h ASP 152 Cb 0.23 0.06 -0.03 0.00 0.22 0.00 0.00 39.33 39.82 3ieb h ASP 152 CO -0.01 -0.03 0.37 -0.07 -1.72 0.00 0.00 179.24 177.79 3ieb h LEU 153 N 0.01 0.71 -0.06 1.55 3.38 -1.35 -2.79 115.31 116.76 3ieb h LEU 153 Ca 0.05 -0.05 0.02 0.00 0.09 0.00 0.00 57.88 57.99 3ieb h LEU 153 Cb 0.07 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.63 3ieb h LEU 153 CO -0.10 0.54 -0.04 0.44 0.09 0.00 0.00 178.44 179.37 3ieb h ASP 154 N 0.81 -0.11 0.00 -0.43 5.19 -0.91 0.57 116.42 121.54 3ieb h ASP 154 Ca 0.22 0.03 0.00 0.00 -0.62 0.00 0.00 57.03 56.65 3ieb h ASP 154 Cb -0.05 0.06 0.00 0.00 0.18 0.00 0.00 39.33 39.53 3ieb h ASP 154 CO -0.04 -0.05 0.00 0.29 -3.12 0.00 0.00 179.24 176.32 3ieb n LYS 155 N -5.15 0.00 0.00 3.56 5.02 -0.28 -1.37 118.16 119.93 3ieb n LYS 155 Ca -0.05 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.24 3ieb n LYS 155 Cb 0.08 -1.04 0.00 0.00 -0.02 0.00 0.00 35.03 34.05 3ieb n LYS 155 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 3ieb n ARG 157 N 0.57 0.00 -0.10 1.97 1.74 0.19 -1.15 116.66 119.87 3ieb n ARG 157 Ca 0.00 0.00 -0.11 0.00 -0.77 0.00 0.00 57.85 56.97 3ieb n ARG 157 Cb 0.00 0.00 -0.03 0.00 -1.02 0.00 0.00 32.46 31.41 3ieb n ARG 157 CO 0.00 0.00 0.00 1.96 -1.52 0.00 0.00 177.63 178.07 3ieb h GLN 158 N 0.00 0.55 -0.41 5.56 4.20 -1.48 -0.99 115.11 122.55 3ieb h GLN 158 Ca 0.00 -0.19 0.01 0.00 0.06 0.00 0.00 58.65 58.53 3ieb h GLN 158 Cb 0.00 -0.04 -0.02 0.00 0.30 0.00 0.00 27.48 27.71 3ieb h GLN 158 CO 0.00 0.71 0.26 -0.07 -0.67 0.00 0.00 178.83 179.06 3ieb h LEU 159 N 0.34 0.45 -0.86 1.46 3.38 -1.41 -2.28 115.31 116.38 3ieb h LEU 159 Ca 0.08 -0.01 0.07 0.00 0.09 0.00 0.00 57.88 58.12 3ieb h LEU 159 Cb 0.48 -0.11 -0.07 0.00 0.09 0.00 0.00 40.66 41.05 3ieb h LEU 159 CO 0.02 0.32 0.53 -1.28 0.09 0.00 0.00 178.44 178.12 3ieb h SER 160 N 0.54 0.81 0.65 -0.43 0.87 -1.66 -0.97 113.55 113.36 3ieb h SER 160 Ca 0.15 0.03 -0.02 0.00 -1.23 0.00 0.00 61.79 60.72 3ieb h SER 160 Cb -0.05 -0.14 -0.00 0.00 -0.44 0.00 0.00 62.40 61.77 3ieb h SER 160 CO -0.04 0.50 -0.10 0.00 -0.53 0.00 0.00 176.83 176.66 3ieb h ALA 161 N 1.43 1.10 0.00 6.23 0.00 -0.80 -1.08 119.26 126.13 3ieb h ALA 161 Ca 0.39 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.21 3ieb h ALA 161 Cb 0.24 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.01 3ieb h ALA 161 CO -0.20 0.12 0.00 1.28 0.00 0.00 0.00 179.25 180.46 3ieb n LEU 162 N -3.35 0.00 0.00 0.00 4.77 -0.41 -4.89 117.00 113.11 3ieb n LEU 162 Ca -0.01 0.22 0.00 0.00 -0.03 0.00 0.00 56.01 56.20 3ieb n LEU 162 Cb 0.29 -0.22 0.00 0.00 -2.33 0.00 0.00 43.42 41.15 3ieb n LEU 162 CO 0.29 -0.05 0.00 0.61 -1.33 0.00 0.00 177.39 176.91 3ieb n GLY 163 N 0.72 0.86 3.71 -0.72 0.00 -0.41 -4.98 105.19 104.36 3ieb n GLY 163 Ca 0.13 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.75 3ieb n GLY 163 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3ieb s ILE 164 N -2.06 5.05 -0.34 -0.61 1.01 -0.92 -4.81 121.20 118.52 3ieb s ILE 164 Ca 0.00 1.37 -0.19 0.00 0.00 0.00 0.00 60.65 61.84 3ieb s ILE 164 Cb 0.00 -4.01 -0.00 0.00 0.01 0.00 0.00 42.46 38.45 3ieb s ILE 164 CO 0.00 0.24 0.55 -1.61 0.00 0.00 0.00 174.94 174.12 3ieb s GLU 165 N 0.95 3.70 0.33 2.79 2.02 0.10 -3.93 118.70 124.67 3ieb s GLU 165 Ca 0.35 -0.03 -0.15 0.00 0.02 0.00 0.00 54.97 55.17 3ieb s GLU 165 Cb -0.17 -3.79 -0.09 0.00 0.10 0.00 0.00 34.13 30.18 3ieb s GLU 165 CO 0.16 -0.63 0.75 -0.51 0.02 0.00 0.00 175.26 175.05 3ieb s LEU 166 N 2.48 4.03 -0.23 1.80 1.43 -0.03 -2.85 118.68 125.31 3ieb s LEU 166 Ca 0.21 1.28 -0.07 0.00 -1.03 0.00 0.00 54.13 54.52 3ieb s LEU 166 Cb -0.15 -4.09 -0.03 0.00 0.03 0.00 0.00 46.19 41.95 3ieb s LEU 166 CO 0.13 -0.23 0.05 -0.44 0.23 0.00 0.00 176.35 176.09 3ieb s SER 167 N -2.36 5.08 -0.14 2.29 0.01 -0.10 -0.23 113.70 118.25 3ieb s SER 167 Ca 0.54 -0.19 -0.04 0.00 1.31 0.00 0.00 55.95 57.57 3ieb s SER 167 Cb -0.10 -1.90 -0.03 0.00 0.21 0.00 0.00 66.02 64.19 3ieb s SER 167 CO 0.19 0.00 0.01 -0.63 0.41 0.00 0.00 173.24 173.22 3ieb s ILE 168 N 1.40 4.39 0.04 1.44 1.01 -0.52 -0.92 121.20 128.04 3ieb s ILE 168 Ca 0.05 -0.20 -0.14 0.00 0.00 0.00 0.00 60.65 60.36 3ieb s ILE 168 Cb -0.15 -2.91 0.02 0.00 0.01 0.00 0.00 42.46 39.43 3ieb s ILE 168 CO 0.03 0.53 0.31 0.28 0.00 0.00 0.00 174.94 176.09 3ieb s THR 169 N -0.17 0.08 0.00 2.92 -1.32 -0.96 -1.68 115.64 114.52 3ieb s THR 169 Ca 0.05 -0.65 0.00 0.00 -1.21 0.00 0.00 61.69 59.89 3ieb s THR 169 Cb -0.12 -0.93 0.00 0.00 -1.51 0.00 0.00 72.50 69.94 3ieb s THR 169 CO 0.02 -0.36 0.00 0.61 -2.21 0.00 0.00 174.62 172.68 3ieb n GLY 170 N 0.60 1.05 2.38 6.08 0.00 -1.26 -0.99 105.19 113.04 3ieb n GLY 170 Ca -0.19 -0.32 -0.16 0.00 0.00 0.00 0.00 46.02 45.35 3ieb n GLY 170 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3ieb n GLY 171 N 0.00 0.52 3.69 -0.02 0.00 -1.26 -4.78 105.19 103.34 3ieb n GLY 171 Ca 0.00 -0.22 -0.42 0.00 0.00 0.00 0.00 46.02 45.38 3ieb n GLY 171 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3ieb s ILE 172 N -2.72 2.51 0.13 -0.61 -1.09 -1.26 -5.00 121.20 113.15 3ieb s ILE 172 Ca 0.00 0.04 0.04 0.00 -2.23 0.00 0.00 60.65 58.49 3ieb s ILE 172 Cb 0.00 -3.02 -0.04 0.00 -1.58 0.00 0.00 42.46 37.81 3ieb s ILE 172 CO 0.00 0.00 -0.09 0.68 -1.23 0.00 0.00 174.94 174.30 3ieb s VAL 173 N 2.70 1.00 0.44 2.92 -7.23 -1.26 -4.96 120.40 114.01 3ieb s VAL 173 Ca 0.81 -1.97 0.18 0.00 -1.81 0.00 0.00 61.98 59.18 3ieb s VAL 173 Cb -0.46 -1.74 0.37 0.00 0.56 0.00 0.00 36.38 35.11 3ieb s VAL 173 CO 0.36 -0.76 1.91 -0.65 -0.31 0.00 0.00 175.10 175.65 3ieb h PRO 174 N 2.94 0.36 0.00 4.82 0.11 -1.91 -1.08 132.00 137.23 3ieb h PRO 174 Ca -0.36 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 65.71 3ieb h PRO 174 Cb 1.18 -0.08 -0.00 0.00 0.11 0.00 0.00 31.00 32.21 3ieb h PRO 174 CO 0.62 0.23 -0.05 0.93 -0.21 0.00 0.00 178.00 179.53 3ieb h GLU 175 N 0.37 0.00 0.00 1.05 3.07 -1.97 -2.73 114.58 114.37 3ieb h GLU 175 Ca 0.39 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.25 3ieb h GLU 175 Cb 0.99 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.90 3ieb h GLU 175 CO -0.12 0.05 -0.74 -0.44 -1.40 0.00 0.00 179.01 176.36 3ieb h ASP 176 N 0.00 0.00 -0.76 1.42 3.32 -1.59 -3.40 116.42 115.40 3ieb h ASP 176 Ca -0.00 -0.19 0.05 0.00 0.02 0.00 0.00 57.03 56.91 3ieb h ASP 176 Cb 0.29 0.00 -0.05 0.00 0.22 0.00 0.00 39.33 39.80 3ieb h ASP 176 CO 0.01 0.09 0.50 0.40 -1.72 0.00 0.00 179.24 178.52 3ieb h ILE 177 N 0.00 1.09 -0.10 0.35 1.08 -1.52 -1.58 117.51 116.82 3ieb h ILE 177 Ca 0.00 -0.31 0.03 0.00 -0.39 0.00 0.00 64.86 64.19 3ieb h ILE 177 Cb 0.80 0.12 -0.00 0.00 -3.07 0.00 0.00 36.82 34.66 3ieb h ILE 177 CO 0.00 0.16 0.10 0.10 -0.69 0.00 0.00 178.15 177.82 3ieb h TYR 178 N 0.89 0.00 -0.35 1.37 -0.00 -1.81 -1.93 116.97 115.14 3ieb h TYR 178 Ca 0.31 0.00 0.10 0.00 0.00 0.00 0.00 58.73 59.14 3ieb h TYR 178 Cb 0.12 0.00 -0.01 0.00 0.00 0.00 0.00 36.73 36.84 3ieb h TYR 178 CO -0.00 0.00 0.25 -0.07 -0.00 0.00 0.00 178.16 178.34 3ieb h LEU 179 N 0.00 0.01 -2.49 0.10 3.38 -1.60 -2.68 115.31 112.03 3ieb h LEU 179 Ca 0.05 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.02 3ieb h LEU 179 Cb 0.24 -0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.99 3ieb h LEU 179 CO -0.00 0.01 0.00 0.49 0.09 0.00 0.00 178.44 179.03 3ieb n PHE 180 N -4.44 0.82 -1.66 1.13 3.72 -0.73 -4.97 117.46 111.34 3ieb n PHE 180 Ca 0.05 -0.41 -0.44 0.00 -0.05 0.00 0.00 57.45 56.61 3ieb n PHE 180 Cb 0.42 0.00 -0.02 0.00 -0.94 0.00 0.00 39.48 38.94 3ieb n PHE 180 CO 0.00 0.00 0.00 -1.91 -0.05 0.00 0.00 176.76 174.80 3ieb n GLU 181 N 1.51 1.89 0.00 -1.08 2.13 -1.02 -1.59 120.64 122.49 3ieb n GLU 181 Ca 0.22 0.67 0.00 0.00 0.66 0.00 0.00 57.16 58.71 3ieb n GLU 181 Cb 0.59 -2.22 0.00 0.00 0.27 0.00 0.00 31.44 30.08 3ieb n GLU 181 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 3ieb n GLY 182 N 1.29 2.24 3.74 8.31 0.00 -1.26 -5.03 105.19 114.47 3ieb n GLY 182 Ca 0.08 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.72 3ieb n GLY 182 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3ieb s ILE 183 N -2.66 5.12 -0.13 -0.61 1.01 -0.62 -5.02 121.20 118.29 3ieb s ILE 183 Ca 0.00 1.02 -0.29 0.00 0.00 0.00 0.00 60.65 61.37 3ieb s ILE 183 Cb 0.00 -3.84 -0.04 0.00 0.01 0.00 0.00 42.46 38.59 3ieb s ILE 183 CO 0.00 0.36 1.64 -0.54 0.00 0.00 0.00 174.94 176.40 3ieb s LYS 184 N 0.36 3.99 -0.13 2.79 1.02 -1.26 -4.96 119.74 121.56 3ieb s LYS 184 Ca 0.27 1.94 -0.00 0.00 0.02 0.00 0.00 55.97 58.20 3ieb s LYS 184 Cb -0.16 -4.01 0.03 0.00 -0.52 0.00 0.00 37.83 33.17 3ieb s LYS 184 CO 0.12 -1.07 -0.08 0.99 -0.92 0.00 0.00 175.35 174.39 3ieb s THR 185 N 4.63 1.11 -0.09 2.17 2.01 -1.26 -0.85 115.64 123.36 3ieb s THR 185 Ca 0.73 -0.39 -0.27 0.00 0.31 0.00 0.00 61.69 62.07 3ieb s THR 185 Cb -0.29 -1.14 -0.25 0.00 0.01 0.00 0.00 72.50 70.82 3ieb s THR 185 CO 0.29 0.34 0.91 0.50 -0.69 0.00 0.00 174.62 175.96 3ieb h LYS 186 N 8.15 0.08 -3.77 4.92 1.63 -0.83 -3.27 116.57 123.48 3ieb h LYS 186 Ca -0.30 -0.11 -0.08 0.00 -0.85 0.00 0.00 60.65 59.31 3ieb h LYS 186 Cb 1.13 0.04 -0.14 0.00 -0.60 0.00 0.00 32.23 32.66 3ieb h LYS 186 CO 0.42 0.95 -0.33 0.95 -3.45 0.00 0.00 179.45 177.99 3ieb s THR 187 N -2.70 0.13 -0.14 1.00 -4.23 -1.21 -4.36 115.64 104.12 3ieb s THR 187 Ca -0.17 -1.14 -0.03 0.00 -1.18 0.00 0.00 61.69 59.17 3ieb s THR 187 Cb -0.01 -1.39 -0.03 0.00 1.34 0.00 0.00 72.50 72.42 3ieb s THR 187 CO 0.72 -0.57 -0.05 -0.36 -0.54 0.00 0.00 174.62 173.82 3ieb s PHE 188 N -3.87 3.00 -0.14 3.99 0.40 -1.26 -1.44 117.98 118.66 3ieb s PHE 188 Ca 0.06 -0.29 -0.03 0.00 -0.60 0.00 0.00 56.93 56.07 3ieb s PHE 188 Cb 0.04 -1.91 -0.03 0.00 0.51 0.00 0.00 43.02 41.63 3ieb s PHE 188 CO -0.10 -0.00 -0.03 0.42 0.70 0.00 0.00 175.22 176.21 3ieb s ILE 189 N 0.20 3.99 0.29 0.64 1.01 -0.67 -1.15 121.20 125.51 3ieb s ILE 189 Ca -0.03 -0.34 0.03 0.00 0.00 0.00 0.00 60.65 60.32 3ieb s ILE 189 Cb -0.14 -2.72 -0.04 0.00 0.01 0.00 0.00 42.46 39.57 3ieb s ILE 189 CO 0.03 0.52 0.18 0.00 0.00 0.00 0.00 174.94 175.67 3ieb s ALA 190 N 0.03 1.84 0.00 9.38 0.00 -0.48 -4.43 121.76 128.09 3ieb s ALA 190 Ca 0.01 -1.80 0.00 0.00 0.00 0.00 0.00 51.96 50.17 3ieb s ALA 190 Cb -0.13 1.24 0.00 0.00 0.00 0.00 0.00 23.12 24.23 3ieb s ALA 190 CO 0.02 -0.55 0.00 0.41 0.00 0.00 0.00 175.76 175.65 3ieb n GLY 191 N -0.55 1.00 0.29 0.00 0.00 -1.26 -1.09 105.19 103.58 3ieb n GLY 191 Ca 0.02 0.00 0.19 0.00 0.00 0.00 0.00 46.02 46.23 3ieb n GLY 191 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 3ieb h ARG 192 N 0.00 0.00 -0.09 1.61 3.08 -1.96 -1.25 114.38 115.78 3ieb h ARG 192 Ca 0.00 0.00 0.03 0.00 0.07 0.00 0.00 59.98 60.08 3ieb h ARG 192 Cb 0.00 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.05 3ieb h ARG 192 CO 0.00 0.00 0.24 0.00 -1.07 0.00 0.00 179.97 179.14 3ieb h ALA 193 N 2.01 1.46 -0.01 0.04 0.00 -1.99 -0.32 119.26 120.44 3ieb h ALA 193 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3ieb h ALA 193 Cb 0.30 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.09 3ieb h ALA 193 CO 0.00 -0.28 -0.18 1.28 0.00 0.00 0.00 179.25 180.07 3ieb n LEU 194 N -3.25 1.58 0.00 0.00 4.77 -0.47 -4.13 117.00 115.50 3ieb n LEU 194 Ca -0.00 -0.51 -0.04 0.00 -0.03 0.00 0.00 56.01 55.43 3ieb n LEU 194 Cb 0.32 -0.05 -0.00 0.00 -2.33 0.00 0.00 43.42 41.36 3ieb n LEU 194 CO 0.20 0.28 -0.01 0.00 -1.33 0.00 0.00 177.39 176.53 3ieb n ALA 195 N -0.05 0.08 -0.61 -1.18 0.00 -0.13 -4.31 120.51 114.32 3ieb n ALA 195 Ca 0.14 -0.30 0.00 0.00 0.00 0.00 0.00 53.44 53.28 3ieb n ALA 195 Cb 0.40 0.14 0.00 0.00 0.00 0.00 0.00 19.45 19.99 3ieb n ALA 195 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3ieb n GLY 196 N 4.17 -1.20 0.36 0.00 0.00 -1.26 -2.17 105.19 105.08 3ieb n GLY 196 Ca -0.02 -1.14 0.09 0.00 0.00 0.00 0.00 46.02 44.95 3ieb n GLY 196 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ieb h ALA 197 N -0.61 1.56 -0.02 4.61 0.00 -1.98 -2.77 119.26 120.05 3ieb h ALA 197 Ca 0.00 0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.95 3ieb h ALA 197 Cb 0.00 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 17.62 3ieb h ALA 197 CO 0.00 0.14 -0.14 0.39 0.00 0.00 0.00 179.25 179.65 3ieb n GLU 198 N -4.67 1.78 -0.17 0.00 4.71 -1.26 -4.57 120.64 116.47 3ieb n GLU 198 Ca 0.20 -1.50 -0.05 0.00 -0.01 0.00 0.00 57.16 55.80 3ieb n GLU 198 Cb 0.42 -1.41 0.04 0.00 -1.01 0.00 0.00 31.44 29.48 3ieb n GLU 198 CO 0.00 0.00 0.00 0.78 0.09 0.00 0.00 177.13 178.00 3ieb h GLY 199 N 4.23 0.72 0.93 0.62 0.00 -1.13 -0.17 103.07 108.27 3ieb h GLY 199 Ca 0.00 -0.21 -0.03 0.00 0.00 0.00 0.00 47.33 47.08 3ieb h GLY 199 CO 0.00 0.17 0.11 -1.61 0.00 0.00 0.00 176.54 175.21 3ieb h GLN 200 N 0.57 0.62 -0.82 4.80 4.15 -1.79 -0.22 115.11 122.43 3ieb h GLN 200 Ca 0.21 -0.14 -0.04 0.00 0.77 0.00 0.00 58.65 59.45 3ieb h GLN 200 Cb 0.06 -0.09 -0.04 0.00 0.21 0.00 0.00 27.48 27.63 3ieb h GLN 200 CO -0.11 0.63 0.36 0.37 -1.93 0.00 0.00 178.83 178.15 3ieb h GLN 201 N 0.49 1.20 -0.27 1.69 4.15 -1.83 -1.18 115.11 119.35 3ieb h GLN 201 Ca 0.12 -0.20 -0.01 0.00 0.77 0.00 0.00 58.65 59.33 3ieb h GLN 201 Cb 0.28 -0.20 -0.01 0.00 0.21 0.00 0.00 27.48 27.76 3ieb h GLN 201 CO -0.00 0.94 0.12 1.15 -1.93 0.00 0.00 178.83 179.11 3ieb h THR 202 N 1.17 1.16 -0.56 2.39 2.02 -0.67 -0.36 112.91 118.07 3ieb h THR 202 Ca 0.28 -0.49 0.07 0.00 0.77 0.00 0.00 66.41 67.04 3ieb h THR 202 Cb 0.17 0.99 -0.06 0.00 -1.74 0.00 0.00 68.15 67.50 3ieb h THR 202 CO -0.03 0.17 0.23 0.00 0.37 0.00 0.00 175.52 176.26 3ieb h ALA 203 N 0.97 0.71 -0.78 6.16 0.00 -0.72 0.75 119.26 126.35 3ieb h ALA 203 Ca 0.09 0.06 -0.05 0.00 0.00 0.00 0.00 54.91 55.01 3ieb h ALA 203 Cb 0.16 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 17.93 3ieb h ALA 203 CO -0.01 -0.16 0.28 0.00 0.00 0.00 0.00 179.25 179.36 3ieb h ALA 204 N 1.36 1.01 -0.48 0.00 0.00 -0.99 -0.99 119.26 119.18 3ieb h ALA 204 Ca 0.27 -0.21 -0.11 0.00 0.00 0.00 0.00 54.91 54.86 3ieb h ALA 204 Cb 0.28 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 3ieb h ALA 204 CO -0.25 0.67 -0.11 0.00 0.00 0.00 0.00 179.25 179.55 3ieb h ALA 205 N 1.15 0.66 -0.31 0.00 0.00 -0.46 -0.40 119.26 119.89 3ieb h ALA 205 Ca 0.25 -0.34 0.03 0.00 0.00 0.00 0.00 54.91 54.85 3ieb h ALA 205 Cb 0.26 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 17.85 3ieb h ALA 205 CO -0.02 0.57 0.13 -0.07 0.00 0.00 0.00 179.25 179.86 3ieb h LEU 206 N 0.77 0.16 -0.88 0.00 3.38 -0.58 -2.63 115.31 115.53 3ieb h LEU 206 Ca 0.12 0.03 -0.06 0.00 0.09 0.00 0.00 57.88 58.06 3ieb h LEU 206 Cb 0.67 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.39 3ieb h LEU 206 CO 0.05 0.13 0.17 0.03 0.09 0.00 0.00 178.44 178.91 3ieb h ARG 207 N 0.27 0.99 -0.97 1.13 3.08 -0.95 -0.03 114.38 117.91 3ieb h ARG 207 Ca 0.14 -0.21 0.05 0.00 0.07 0.00 0.00 59.98 60.02 3ieb h ARG 207 Cb 0.09 -0.14 -0.06 0.00 0.08 0.00 0.00 29.97 29.93 3ieb h ARG 207 CO -0.12 0.87 0.63 1.49 -1.07 0.00 0.00 179.97 181.77 3ieb h GLU 208 N 0.95 1.17 -0.05 0.04 4.81 -0.94 0.23 114.58 120.78 3ieb h GLU 208 Ca 0.21 -0.07 -0.20 0.00 -0.13 0.00 0.00 59.36 59.16 3ieb h GLU 208 Cb 0.32 -0.26 0.01 0.00 0.63 0.00 0.00 28.75 29.45 3ieb h GLU 208 CO -0.00 0.77 -0.76 1.96 -0.73 0.00 0.00 179.01 180.25 3ieb h GLN 209 N 1.20 0.61 -0.96 1.92 1.08 -1.01 -3.04 115.11 114.91 3ieb h GLN 209 Ca 0.40 -0.58 0.10 0.00 -1.45 0.00 0.00 58.65 57.12 3ieb h GLN 209 Cb 0.06 0.15 -0.08 0.00 -0.05 0.00 0.00 27.48 27.56 3ieb h GLN 209 CO -0.14 1.20 0.59 0.82 -0.95 0.00 0.00 178.83 180.35 3ieb h ILE 210 N 0.24 0.94 0.00 2.54 2.04 -0.69 -0.98 117.51 121.60 3ieb h ILE 210 Ca -0.08 -0.33 -0.02 0.00 1.00 0.00 0.00 64.86 65.43 3ieb h ILE 210 Cb 1.42 -0.12 -0.00 0.00 -0.74 0.00 0.00 36.82 37.38 3ieb h ILE 210 CO 0.15 0.18 -0.09 0.44 0.00 0.00 0.00 178.15 178.83 3ieb h ASP 211 N 0.97 0.00 0.72 1.72 3.32 -0.85 -0.58 116.42 121.73 3ieb h ASP 211 Ca 0.46 0.00 -0.12 0.00 0.02 0.00 0.00 57.03 57.40 3ieb h ASP 211 Cb 0.40 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.94 3ieb h ASP 211 CO -0.25 0.09 -0.55 0.03 -1.72 0.00 0.00 179.24 176.84 3ieb h ARG 212 N 0.00 0.00 0.00 3.56 3.08 -1.11 -3.38 114.38 116.53 3ieb h ARG 212 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 3ieb h ARG 212 Cb 0.40 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.45 3ieb h ARG 212 CO 0.01 0.55 -0.72 1.19 -1.07 0.00 0.00 179.97 179.94 3ieb n PHE 213 N -3.69 0.00 -4.38 3.04 3.72 -0.67 -4.93 117.46 110.55 3ieb n PHE 213 Ca -0.01 0.00 -0.33 0.00 -0.05 0.00 0.00 57.45 57.06 3ieb n PHE 213 Cb 0.60 -0.04 -0.16 0.00 -0.94 0.00 0.00 39.48 38.94 3ieb n PHE 213 CO 0.00 0.00 0.00 -1.58 -0.05 0.00 0.00 176.76 175.13 3ieb s TRP 214 N -1.82 2.75 0.00 1.38 0.51 -0.31 -4.65 118.94 116.79 3ieb s TRP 214 Ca -0.00 -1.42 0.00 0.00 -2.12 0.00 0.00 56.10 52.56 3ieb s TRP 214 Cb 0.02 -1.88 0.00 0.00 -0.81 0.00 0.00 33.47 30.80 3ieb s TRP 214 CO 0.12 -0.68 0.00 -2.30 -0.51 0.00 0.00 176.95 173.59