#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1byf s TYR 3 N 0.00 0.65 -0.18 1.24 1.51 -1.26 -1.68 117.35 117.63 1byf s TYR 3 Ca 0.00 -1.02 -0.02 0.00 -1.01 0.00 0.00 57.07 55.03 1byf s TYR 3 Cb 0.00 0.20 -0.01 0.00 -0.11 0.00 0.00 41.96 42.04 1byf s TYR 3 CO 0.00 -1.19 -0.10 -1.21 -1.11 0.00 0.00 175.55 171.94 1byf s GLU 4 N -3.17 3.32 -0.12 -0.62 2.02 0.08 -4.89 118.70 115.31 1byf s GLU 4 Ca 0.25 -0.68 0.02 0.00 0.02 0.00 0.00 54.97 54.58 1byf s GLU 4 Cb -0.02 -2.78 0.01 0.00 0.10 0.00 0.00 34.13 31.44 1byf s GLU 4 CO 0.15 -0.03 -0.19 0.42 0.02 0.00 0.00 175.26 175.63 1byf s ILE 5 N 0.99 1.75 -0.15 -1.63 -1.09 -1.26 -1.11 121.20 118.70 1byf s ILE 5 Ca -0.01 -0.80 -0.00 0.00 -2.23 0.00 0.00 60.65 57.60 1byf s ILE 5 Cb -0.15 -1.57 -0.01 0.00 -1.58 0.00 0.00 42.46 39.15 1byf s ILE 5 CO -0.01 0.49 -0.13 -0.22 -1.23 0.00 0.00 174.94 173.84 1byf s LEU 6 N 0.85 2.64 -0.11 2.97 2.96 0.11 -4.97 118.68 123.13 1byf s LEU 6 Ca -0.08 -0.39 -0.00 0.00 -0.22 0.00 0.00 54.13 53.43 1byf s LEU 6 Cb -0.15 -1.60 -0.02 0.00 0.50 0.00 0.00 46.19 44.91 1byf s LEU 6 CO -0.01 0.11 -0.09 -0.36 -1.32 0.00 0.00 176.35 174.69 1byf s PHE 7 N 0.65 2.90 -0.04 5.38 0.40 -1.26 -0.67 117.98 125.34 1byf s PHE 7 Ca -0.07 -0.29 0.03 0.00 -0.60 0.00 0.00 56.93 56.00 1byf s PHE 7 Cb -0.15 -1.81 0.01 0.00 0.51 0.00 0.00 43.02 41.57 1byf s PHE 7 CO 0.02 0.05 -0.12 0.45 0.70 0.00 0.00 175.22 176.33 1byf s SER 8 N -0.12 1.60 0.00 1.36 0.15 0.08 -5.00 113.70 111.78 1byf s SER 8 Ca 0.01 -0.26 0.23 0.00 0.70 0.00 0.00 55.95 56.63 1byf s SER 8 Cb -0.13 -0.55 1.05 0.00 -1.71 0.00 0.00 66.02 64.67 1byf s SER 8 CO 0.03 0.07 1.76 0.47 1.20 0.00 0.00 173.24 176.77 1byf n ASP 9 N 3.46 0.00 -4.72 5.45 8.00 -1.26 -2.81 116.55 124.67 1byf n ASP 9 Ca -0.20 0.35 -0.42 0.00 0.71 0.00 0.00 54.79 55.23 1byf n ASP 9 Cb 0.53 -0.44 -0.03 0.00 -0.02 0.00 0.00 41.12 41.16 1byf n ASP 9 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 1byf s GLU 10 N -2.88 4.37 0.11 -1.24 0.41 -1.26 -4.87 118.70 113.33 1byf s GLU 10 Ca 0.14 2.02 0.03 0.00 -0.41 0.00 0.00 54.97 56.75 1byf s GLU 10 Cb 0.15 -3.24 -0.04 0.00 -1.78 0.00 0.00 34.13 29.22 1byf s GLU 10 CO 0.41 -0.33 0.15 0.95 -0.49 0.00 0.00 175.26 175.94 1byf s THR 11 N 0.69 4.82 0.28 3.63 -4.23 -1.26 -3.89 115.64 115.68 1byf s THR 11 Ca 0.60 -0.75 -0.21 0.00 -1.18 0.00 0.00 61.69 60.16 1byf s THR 11 Cb -0.36 -3.39 0.03 0.00 1.34 0.00 0.00 72.50 70.13 1byf s THR 11 CO 0.33 0.04 0.74 -0.04 -0.54 0.00 0.00 174.62 175.16 1byf s MET 12 N -2.71 1.79 0.87 3.99 -1.94 -0.36 -4.77 119.30 116.18 1byf s MET 12 Ca 0.32 -1.01 -0.13 0.00 -1.71 0.00 0.00 55.69 53.15 1byf s MET 12 Cb -0.12 0.60 0.13 0.00 2.01 0.00 0.00 34.83 37.45 1byf s MET 12 CO 0.25 -0.82 1.23 0.54 -0.01 0.00 0.00 175.02 176.20 1byf s ASN 13 N -2.94 3.91 0.14 3.03 2.20 -1.25 -0.69 114.94 119.33 1byf s ASN 13 Ca 0.12 0.52 -0.17 0.00 -0.94 0.00 0.00 52.86 52.38 1byf s ASN 13 Cb -0.06 -0.82 -0.01 0.00 -2.00 0.00 0.00 41.25 38.36 1byf s ASN 13 CO 0.07 -2.25 1.77 0.22 -2.94 0.00 0.00 177.10 173.97 1byf h TYR 14 N -1.28 0.46 -0.19 1.54 3.20 -1.67 -0.95 116.97 118.07 1byf h TYR 14 Ca -0.45 -0.00 0.01 0.00 3.14 0.00 0.00 58.73 61.43 1byf h TYR 14 Cb 1.29 -0.15 -0.01 0.00 1.54 0.00 0.00 36.73 39.39 1byf h TYR 14 CO -0.34 0.33 0.10 0.00 -1.64 0.00 0.00 178.16 176.61 1byf h ALA 15 N 1.09 0.23 -0.26 1.82 0.00 -1.94 -2.12 119.26 118.07 1byf h ALA 15 Ca 0.12 0.00 -0.03 0.00 0.00 0.00 0.00 54.91 55.01 1byf h ALA 15 Cb 0.01 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 1byf h ALA 15 CO -0.02 -0.32 0.04 -0.44 0.00 0.00 0.00 179.25 178.51 1byf h ASP 16 N 0.21 0.34 -0.63 0.00 3.32 -1.90 -1.76 116.42 116.00 1byf h ASP 16 Ca 0.08 -0.04 -0.06 0.00 0.02 0.00 0.00 57.03 57.03 1byf h ASP 16 Cb 0.01 -0.09 -0.03 0.00 0.22 0.00 0.00 39.33 39.45 1byf h ASP 16 CO -0.05 0.37 0.16 0.00 -1.72 0.00 0.00 179.24 178.00 1byf h ALA 17 N 1.68 0.84 -0.11 3.45 0.00 -0.64 0.10 119.26 124.58 1byf h ALA 17 Ca 0.09 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.77 1byf h ALA 17 Cb 0.18 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 1byf h ALA 17 CO -0.00 0.54 0.07 0.78 0.00 0.00 0.00 179.25 180.65 1byf h GLY 18 N 0.93 0.16 1.08 0.00 0.00 -0.70 -1.81 103.07 102.73 1byf h GLY 18 Ca 0.20 -0.06 -0.04 0.00 0.00 0.00 0.00 47.33 47.43 1byf h GLY 18 CO 0.00 0.06 0.34 -0.84 0.00 0.00 0.00 176.54 176.10 1byf h THR 19 N 0.15 1.26 -0.22 4.70 2.02 -1.28 -0.75 112.91 118.78 1byf h THR 19 Ca 0.04 -0.77 0.04 0.00 0.77 0.00 0.00 66.41 66.49 1byf h THR 19 Cb -0.01 0.28 -0.04 0.00 -1.74 0.00 0.00 68.15 66.64 1byf h THR 19 CO -0.01 0.32 -0.01 0.22 0.37 0.00 0.00 175.52 176.41 1byf h TYR 20 N 1.15 -0.03 -0.28 3.16 5.03 -0.48 -0.09 116.97 125.42 1byf h TYR 20 Ca 0.27 0.02 -0.07 0.00 2.58 0.00 0.00 58.73 61.53 1byf h TYR 20 Cb 0.18 0.05 -0.01 0.00 1.55 0.00 0.00 36.73 38.49 1byf h TYR 20 CO 0.02 -0.04 -0.10 0.00 -1.32 0.00 0.00 178.16 176.71 1byf h GLN 22 N 0.32 1.07 0.00 0.00 1.08 -0.88 -0.54 115.11 116.16 1byf h GLN 22 Ca 0.07 -0.06 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 1byf h GLN 22 Cb 0.60 -0.24 0.00 0.00 -0.05 0.00 0.00 27.48 27.79 1byf h GLN 22 CO 0.03 0.71 0.00 0.66 -0.95 0.00 0.00 178.83 179.28 1byf h SER 23 N 1.10 0.00 -0.51 1.46 4.64 -1.00 -1.48 113.55 117.76 1byf h SER 23 Ca 0.37 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.69 1byf h SER 23 Cb 0.05 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.14 1byf h SER 23 CO -0.13 0.00 0.00 0.54 -0.87 0.00 0.00 176.83 176.37 1byf n ARG 24 N -2.67 2.59 -1.09 4.77 1.74 -0.36 -4.93 116.66 116.70 1byf n ARG 24 Ca -0.01 -2.42 -0.03 0.00 -0.77 0.00 0.00 57.85 54.62 1byf n ARG 24 Cb 0.15 -1.53 -0.01 0.00 -1.02 0.00 0.00 32.46 30.04 1byf n ARG 24 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1byf n GLY 25 N 1.56 0.62 1.23 -0.13 0.00 -0.56 -5.02 105.19 102.89 1byf n GLY 25 Ca 0.21 -0.93 -0.10 0.00 0.00 0.00 0.00 46.02 45.20 1byf n GLY 25 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1byf n MET 26 N -2.91 1.17 -4.04 1.61 2.81 -0.36 -4.92 117.12 110.49 1byf n MET 26 Ca -0.03 -1.26 -0.10 0.00 -1.81 0.00 0.00 57.70 54.49 1byf n MET 26 Cb 0.10 0.51 -0.11 0.00 -0.71 0.00 0.00 33.22 33.02 1byf n MET 26 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1byf s ALA 27 N -2.35 0.40 0.18 3.04 0.00 -0.18 -2.80 121.76 120.03 1byf s ALA 27 Ca 0.04 -0.77 -0.33 0.00 0.00 0.00 0.00 51.96 50.89 1byf s ALA 27 Cb 0.00 0.12 -0.14 0.00 0.00 0.00 0.00 23.12 23.10 1byf s ALA 27 CO 0.03 -0.13 1.52 -0.11 0.00 0.00 0.00 175.76 177.07 1byf n LEU 28 N 1.29 3.03 -4.54 0.00 7.94 -1.26 0.16 117.00 123.61 1byf n LEU 28 Ca -0.22 1.10 -0.52 0.00 -1.11 0.00 0.00 56.01 55.26 1byf n LEU 28 Cb 0.56 -1.42 -0.06 0.00 0.53 0.00 0.00 43.42 43.04 1byf n LEU 28 CO 0.22 -0.37 0.66 0.55 -1.11 0.00 0.00 177.39 177.34 1byf n VAL 29 N 3.00 0.50 0.00 1.96 3.14 0.12 -4.15 118.33 122.90 1byf n VAL 29 Ca 0.16 -0.13 0.00 0.00 -2.96 0.00 0.00 64.34 61.41 1byf n VAL 29 Cb 0.29 -0.53 0.00 0.00 -1.06 0.00 0.00 33.84 32.54 1byf n VAL 29 CO 0.00 0.00 0.00 -1.54 -6.46 0.00 0.00 176.83 168.83 1byf n SER 30 N 2.02 0.00 0.05 6.55 3.41 -1.26 0.80 113.62 125.18 1byf n SER 30 Ca 0.18 0.00 0.09 0.00 -0.26 0.00 0.00 58.87 58.88 1byf n SER 30 Cb 0.19 0.07 0.54 0.00 -0.26 0.00 0.00 64.21 64.74 1byf n SER 30 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 1byf h SER 31 N 0.00 0.25 0.38 4.04 4.64 -1.95 0.18 113.55 121.10 1byf h SER 31 Ca 0.00 -0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.29 1byf h SER 31 Cb 0.00 -0.06 -0.00 0.00 -0.31 0.00 0.00 62.40 62.03 1byf h SER 31 CO 0.00 0.17 -0.14 0.00 -0.87 0.00 0.00 176.83 175.99 1byf h ALA 32 N 1.81 1.31 0.00 5.18 0.00 -1.95 -0.96 119.26 124.65 1byf h ALA 32 Ca 0.15 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1byf h ALA 32 Cb 0.24 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.01 1byf h ALA 32 CO -0.03 0.18 0.00 0.52 0.00 0.00 0.00 179.25 179.92 1byf h MET 33 N 0.00 0.00 -0.17 0.00 2.07 -1.29 -2.68 114.93 112.86 1byf h MET 33 Ca -0.00 0.00 0.00 0.00 -2.07 0.00 0.00 59.70 57.63 1byf h MET 33 Cb 0.37 0.00 0.00 0.00 -1.87 0.00 0.00 31.60 30.10 1byf h MET 33 CO 0.02 0.00 0.00 0.54 1.07 0.00 0.00 176.91 178.54 1byf n ARG 34 N -2.63 2.19 -3.50 1.72 1.74 -0.37 -4.71 116.66 111.09 1byf n ARG 34 Ca 0.02 -1.76 -0.39 0.00 -0.77 0.00 0.00 57.85 54.95 1byf n ARG 34 Cb 0.33 -1.47 -0.10 0.00 -1.02 0.00 0.00 32.46 30.20 1byf n ARG 34 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 1byf s ASP 35 N -1.76 6.10 0.26 0.55 -1.08 -1.02 -5.00 116.67 114.74 1byf s ASP 35 Ca 0.34 -0.13 -0.01 0.00 -0.52 0.00 0.00 52.55 52.23 1byf s ASP 35 Cb 0.21 -2.16 0.56 0.00 -1.46 0.00 0.00 42.92 40.07 1byf s ASP 35 CO 0.30 -0.19 1.71 0.77 0.52 0.00 0.00 175.17 178.29 1byf h SER 36 N 8.39 0.27 0.10 -0.34 4.64 -1.88 0.32 113.55 125.06 1byf h SER 36 Ca -0.32 0.13 -0.01 0.00 -0.47 0.00 0.00 61.79 61.12 1byf h SER 36 Cb 1.17 0.12 0.00 0.00 -0.31 0.00 0.00 62.40 63.37 1byf h SER 36 CO 0.62 0.05 -0.05 0.74 -0.87 0.00 0.00 176.83 177.32 1byf h THR 37 N 0.42 1.03 -0.97 2.95 2.02 -1.94 -3.27 112.91 113.14 1byf h THR 37 Ca 0.47 -1.34 0.00 0.00 0.77 0.00 0.00 66.41 66.32 1byf h THR 37 Cb 0.80 1.77 -0.05 0.00 -1.74 0.00 0.00 68.15 68.93 1byf h THR 37 CO -0.46 0.28 0.62 0.24 0.37 0.00 0.00 175.52 176.57 1byf h MET 38 N -0.85 1.30 -0.51 6.66 2.86 -1.76 -1.75 114.93 120.89 1byf h MET 38 Ca -0.01 -0.10 -0.05 0.00 -2.06 0.00 0.00 59.70 57.48 1byf h MET 38 Cb 0.57 -0.28 -0.02 0.00 0.06 0.00 0.00 31.60 31.92 1byf h MET 38 CO 0.02 0.88 0.12 -0.24 1.06 0.00 0.00 176.91 178.76 1byf h VAL 39 N 1.33 1.22 -0.27 -2.22 3.04 -0.88 0.25 116.25 118.73 1byf h VAL 39 Ca 0.35 -0.79 -0.16 0.00 -1.01 0.00 0.00 66.70 65.10 1byf h VAL 39 Cb -0.11 0.70 -0.01 0.00 -2.01 0.00 0.00 31.29 29.86 1byf h VAL 39 CO -0.07 0.29 -0.47 0.11 -1.01 0.00 0.00 177.57 176.42 1byf h LYS 40 N 0.76 0.71 -0.32 4.17 1.79 -1.52 0.24 116.57 122.39 1byf h LYS 40 Ca 0.17 -0.41 -0.05 0.00 -2.18 0.00 0.00 60.65 58.18 1byf h LYS 40 Cb 0.28 0.03 -0.01 0.00 -1.58 0.00 0.00 32.23 30.95 1byf h LYS 40 CO -0.00 1.03 0.02 0.00 -1.08 0.00 0.00 179.45 179.42 1byf h ALA 41 N 0.90 0.43 -0.17 3.86 0.00 -0.68 0.52 119.26 124.13 1byf h ALA 41 Ca 0.03 -0.22 0.01 0.00 0.00 0.00 0.00 54.91 54.73 1byf h ALA 41 Cb 1.03 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.68 1byf h ALA 41 CO 0.10 0.16 0.07 0.82 0.00 0.00 0.00 179.25 180.40 1byf h ILE 42 N 0.36 0.98 0.00 0.00 2.04 -0.37 -2.24 117.51 118.28 1byf h ILE 42 Ca 0.09 -0.06 -0.06 0.00 1.00 0.00 0.00 64.86 65.83 1byf h ILE 42 Cb 0.41 0.80 -0.01 0.00 -0.74 0.00 0.00 36.82 37.28 1byf h ILE 42 CO 0.01 0.03 -0.31 -0.07 0.00 0.00 0.00 178.15 177.81 1byf h LEU 43 N 0.16 0.00 -0.86 1.44 3.38 -0.41 -2.11 115.31 116.92 1byf h LEU 43 Ca 0.07 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 57.95 1byf h LEU 43 Cb 0.03 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.76 1byf h LEU 43 CO -0.06 0.31 -0.18 0.00 0.09 0.00 0.00 178.44 178.59 1byf h ALA 44 N 1.69 1.04 0.06 1.53 0.00 -0.37 -0.31 119.26 122.89 1byf h ALA 44 Ca -0.00 -0.33 -0.00 0.00 0.00 0.00 0.00 54.91 54.57 1byf h ALA 44 Cb 0.69 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.33 1byf h ALA 44 CO 0.04 0.58 -0.03 0.35 0.00 0.00 0.00 179.25 180.19 1byf h PHE 45 N 0.58 -0.07 0.00 0.00 3.04 -0.94 -3.08 116.94 116.46 1byf h PHE 45 Ca 0.09 -0.00 -0.05 0.00 3.98 0.00 0.00 57.97 61.99 1byf h PHE 45 Cb 0.63 0.02 -0.01 0.00 2.56 0.00 0.00 35.95 39.16 1byf h PHE 45 CO 0.03 0.37 -0.23 1.79 -2.02 0.00 0.00 178.31 178.24 1byf h THR 46 N -0.55 1.07 -0.59 4.41 1.35 -1.33 -2.31 112.91 114.97 1byf h THR 46 Ca -0.01 -0.82 0.01 0.00 -0.55 0.00 0.00 66.41 65.03 1byf h THR 46 Cb 0.48 1.46 -0.03 0.00 -1.73 0.00 0.00 68.15 68.32 1byf h THR 46 CO 0.01 0.23 0.39 -0.08 -0.25 0.00 0.00 175.52 175.82 1byf h GLU 47 N 0.00 0.78 -0.25 4.72 4.22 -1.03 0.18 114.58 123.20 1byf h GLU 47 Ca -0.00 -0.05 -0.03 0.00 0.08 0.00 0.00 59.36 59.36 1byf h GLU 47 Cb 0.44 -0.18 -0.01 0.00 0.50 0.00 0.00 28.75 29.50 1byf h GLU 47 CO 0.03 0.52 0.05 0.28 -2.18 0.00 0.00 179.01 177.71 1byf h VAL 48 N 0.80 1.22 -0.43 0.32 2.07 -1.35 -3.00 116.25 115.88 1byf h VAL 48 Ca 0.22 -0.72 -0.03 0.00 0.82 0.00 0.00 66.70 66.99 1byf h VAL 48 Cb -0.09 1.22 -0.02 0.00 -1.52 0.00 0.00 31.29 30.88 1byf h VAL 48 CO -0.05 0.23 0.15 0.11 0.02 0.00 0.00 177.57 178.03 1byf h LYS 49 N 0.22 0.62 -3.04 1.57 1.79 -1.09 -3.46 116.57 113.19 1byf h LYS 49 Ca 0.08 -0.09 -0.38 0.00 -2.18 0.00 0.00 60.65 58.07 1byf h LYS 49 Cb 0.29 -0.11 -0.00 0.00 -1.58 0.00 0.00 32.23 30.83 1byf h LYS 49 CO 0.00 0.54 -0.51 0.41 -1.08 0.00 0.00 179.45 178.81 1byf n GLY 50 N -1.10 -0.43 3.52 3.86 0.00 0.60 -5.00 105.19 106.64 1byf n GLY 50 Ca 0.03 -0.05 -0.24 0.00 0.00 0.00 0.00 46.02 45.76 1byf n GLY 50 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1byf s HIS 51 N -3.00 2.23 0.25 1.61 3.76 -1.26 -4.83 115.29 114.06 1byf s HIS 51 Ca 0.06 -0.73 -0.27 0.00 -0.15 0.00 0.00 55.06 53.96 1byf s HIS 51 Cb -0.02 -1.45 -0.09 0.00 1.11 0.00 0.00 32.58 32.13 1byf s HIS 51 CO 0.07 0.31 0.90 -0.51 -0.85 0.00 0.00 174.74 174.66 1byf s ASP 52 N -3.58 7.46 0.00 1.40 1.01 -1.26 -4.27 116.67 117.44 1byf s ASP 52 Ca 0.34 1.82 0.02 0.00 0.71 0.00 0.00 52.55 55.44 1byf s ASP 52 Cb 0.07 -2.57 -0.01 0.00 1.01 0.00 0.00 42.92 41.43 1byf s ASP 52 CO 0.16 0.09 -0.07 -0.31 0.21 0.00 0.00 175.17 175.25 1byf s TYR 53 N -1.34 0.62 0.47 4.23 1.51 -0.72 -1.91 117.35 120.21 1byf s TYR 53 Ca 0.43 -0.18 -0.20 0.00 -1.01 0.00 0.00 57.07 56.11 1byf s TYR 53 Cb -0.22 -0.39 -0.09 0.00 -0.11 0.00 0.00 41.96 41.14 1byf s TYR 53 CO 0.28 -0.02 1.01 -1.58 -1.11 0.00 0.00 175.55 174.13 1byf s TRP 54 N -0.37 3.10 0.21 2.71 0.52 0.51 0.50 118.94 126.10 1byf s TRP 54 Ca 0.01 1.58 0.05 0.00 0.02 0.00 0.00 56.10 57.76 1byf s TRP 54 Cb -0.04 -3.00 -0.05 0.00 -1.15 0.00 0.00 33.47 29.23 1byf s TRP 54 CO -0.00 -0.62 -0.07 0.14 0.02 0.00 0.00 176.95 176.42 1byf s VAL 55 N -2.06 1.31 -1.53 4.03 -7.23 -0.86 -3.96 120.40 110.09 1byf s VAL 55 Ca 0.65 -2.09 -0.09 0.00 -1.81 0.00 0.00 61.98 58.64 1byf s VAL 55 Cb -0.14 -2.14 -0.02 0.00 0.56 0.00 0.00 36.38 34.64 1byf s VAL 55 CO 0.18 -0.51 2.72 0.61 -0.31 0.00 0.00 175.10 177.80 1byf n GLY 56 N -0.36 4.53 3.04 2.32 0.00 0.24 -4.57 105.19 110.38 1byf n GLY 56 Ca -0.07 -1.67 -0.11 0.00 0.00 0.00 0.00 46.02 44.17 1byf n GLY 56 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1byf s ALA 57 N 1.34 -0.21 0.21 4.61 0.00 -1.26 -0.11 121.76 126.34 1byf s ALA 57 Ca 0.63 -0.08 -0.22 0.00 0.00 0.00 0.00 51.96 52.28 1byf s ALA 57 Cb 0.18 0.02 0.06 0.00 0.00 0.00 0.00 23.12 23.38 1byf s ALA 57 CO -0.07 -0.15 0.92 0.16 0.00 0.00 0.00 175.76 176.62 1byf s ASP 58 N -0.93 -0.12 -0.12 0.00 1.47 -0.74 -1.43 116.67 114.81 1byf s ASP 58 Ca -0.10 -0.60 0.15 0.00 1.18 0.00 0.00 52.55 53.18 1byf s ASP 58 Cb -0.06 0.58 0.51 0.00 -0.34 0.00 0.00 42.92 43.61 1byf s ASP 58 CO 0.01 -1.10 1.42 -0.46 0.68 0.00 0.00 175.17 175.71 1byf n ASN 59 N -0.77 3.83 0.24 2.11 6.94 0.02 -0.62 115.26 127.01 1byf n ASN 59 Ca -0.05 -2.66 0.07 0.00 -0.02 0.00 0.00 54.58 51.92 1byf n ASN 59 Cb 0.60 -0.47 0.57 0.00 -2.36 0.00 0.00 39.78 38.12 1byf n ASN 59 CO 0.00 0.00 0.00 -0.07 -1.03 0.00 0.00 177.26 176.16 1byf h LEU 60 N 2.26 0.00 0.00 -4.53 3.38 -1.88 0.38 115.31 114.93 1byf h LEU 60 Ca 0.00 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.95 1byf h LEU 60 Cb 1.28 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.02 1byf h LEU 60 CO 0.18 0.12 -0.15 -0.61 0.09 0.00 0.00 178.44 178.06 1byf h GLN 61 N 0.00 0.00 -0.02 1.13 4.15 -1.90 -3.41 115.11 115.07 1byf h GLN 61 Ca -0.00 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.42 1byf h GLN 61 Cb 0.22 0.00 0.00 0.00 0.21 0.00 0.00 27.48 27.91 1byf h GLN 61 CO 0.02 0.50 -0.41 -0.25 -1.93 0.00 0.00 178.83 176.76 1byf n ASP 62 N -4.67 2.02 -0.87 -0.69 8.00 -1.23 -5.10 116.55 114.01 1byf n ASP 62 Ca -0.08 -1.51 0.12 0.00 0.71 0.00 0.00 54.79 54.03 1byf n ASP 62 Cb 0.28 0.44 -0.03 0.00 -0.02 0.00 0.00 41.12 41.79 1byf n ASP 62 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1byf n GLY 63 N 1.36 -1.69 7.00 0.44 0.00 0.14 -4.77 105.19 107.66 1byf n GLY 63 Ca 0.09 -1.31 0.00 0.00 0.00 0.00 0.00 46.02 44.80 1byf n GLY 63 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1byf n ALA 64 N -1.85 0.00 -1.51 4.61 0.00 -1.19 -1.18 120.51 119.40 1byf n ALA 64 Ca 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 53.44 53.12 1byf n ALA 64 Cb 0.40 0.00 0.06 0.00 0.00 0.00 0.00 19.45 19.91 1byf n ALA 64 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1byf n TYR 65 N 14.00 3.11 -2.64 0.00 4.01 -1.26 -4.71 117.16 129.68 1byf n TYR 65 Ca 0.00 -2.83 -0.42 0.00 -0.16 0.00 0.00 57.90 54.49 1byf n TYR 65 Cb 0.00 -1.17 0.01 0.00 -0.31 0.00 0.00 39.34 37.87 1byf n TYR 65 CO 0.00 0.00 0.00 0.09 -0.46 0.00 0.00 176.86 176.49 1byf n ASN 66 N -0.86 6.69 -4.74 7.72 3.02 -0.32 -4.71 115.26 122.06 1byf n ASN 66 Ca 0.58 -3.40 -0.41 0.00 -0.03 0.00 0.00 54.58 51.31 1byf n ASN 66 Cb 0.74 -1.29 -0.03 0.00 -0.61 0.00 0.00 39.78 38.59 1byf n ASN 66 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 1byf s PHE 67 N -2.43 3.18 -0.04 3.10 0.08 -1.26 -4.55 117.98 116.06 1byf s PHE 67 Ca 0.38 1.10 0.04 0.00 0.12 0.00 0.00 56.93 58.56 1byf s PHE 67 Cb 0.12 -3.69 -0.00 0.00 -0.57 0.00 0.00 43.02 38.87 1byf s PHE 67 CO -0.00 -2.25 -0.14 -0.51 -0.10 0.00 0.00 175.22 172.21 1byf s LEU 68 N 0.06 1.88 0.59 -0.37 1.43 0.21 -1.50 118.68 120.97 1byf s LEU 68 Ca 0.59 -0.29 -0.18 0.00 -1.03 0.00 0.00 54.13 53.22 1byf s LEU 68 Cb -0.38 -0.82 -0.03 0.00 0.03 0.00 0.00 46.19 44.98 1byf s LEU 68 CO 0.38 0.12 1.13 0.26 0.23 0.00 0.00 176.35 178.47 1byf s TRP 69 N 0.07 2.63 0.29 0.29 0.52 0.81 -1.79 118.94 121.77 1byf s TRP 69 Ca -0.03 1.55 0.32 0.00 0.02 0.00 0.00 56.10 57.96 1byf s TRP 69 Cb -0.10 -3.25 1.76 0.00 -1.15 0.00 0.00 33.47 30.73 1byf s TRP 69 CO 0.01 -1.66 1.99 -0.91 0.02 0.00 0.00 176.95 176.40 1byf h ASN 70 N 0.71 0.00 -0.41 2.95 2.35 -0.82 -1.03 115.58 119.33 1byf h ASN 70 Ca -0.49 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.26 1byf h ASN 70 Cb 1.26 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.63 1byf h ASN 70 CO 0.56 0.00 0.00 -0.90 -1.65 0.00 0.00 177.43 175.44 1byf n ASP 71 N -2.68 3.56 0.00 5.81 5.75 -1.26 -4.91 116.55 122.82 1byf n ASP 71 Ca -0.02 -2.40 0.00 0.00 -0.01 0.00 0.00 54.79 52.36 1byf n ASP 71 Cb 0.10 -0.52 0.00 0.00 -1.03 0.00 0.00 41.12 39.67 1byf n ASP 71 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1byf n GLY 72 N 0.70 1.80 3.76 6.12 0.00 -0.39 -5.03 105.19 112.15 1byf n GLY 72 Ca 0.17 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.79 1byf n GLY 72 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1byf s VAL 73 N -3.09 4.20 0.33 1.61 1.01 -1.25 -4.80 120.40 118.41 1byf s VAL 73 Ca 0.00 1.97 -0.28 0.00 0.00 0.00 0.00 61.98 63.66 1byf s VAL 73 Cb 0.00 -4.27 -0.10 0.00 0.00 0.00 0.00 36.38 32.01 1byf s VAL 73 CO 0.00 0.49 1.23 -0.55 0.00 0.00 0.00 175.10 176.27 1byf s SER 74 N -1.05 6.88 -0.60 3.32 0.15 -1.26 -0.14 113.70 120.99 1byf s SER 74 Ca 0.40 2.53 -0.11 0.00 0.70 0.00 0.00 55.95 59.47 1byf s SER 74 Cb -0.25 -2.64 0.15 0.00 -1.71 0.00 0.00 66.02 61.58 1byf s SER 74 CO 0.30 -0.44 0.51 -0.22 1.20 0.00 0.00 173.24 174.58 1byf s LEU 75 N -1.79 6.03 0.22 3.45 0.20 -0.57 -4.80 118.68 121.43 1byf s LEU 75 Ca 0.49 -2.23 -0.31 0.00 0.69 0.00 0.00 54.13 52.76 1byf s LEU 75 Cb -0.36 -2.09 -0.14 0.00 -0.43 0.00 0.00 46.19 43.16 1byf s LEU 75 CO 0.48 -0.65 1.25 -2.65 -0.29 0.00 0.00 176.35 174.49 1byf n PRO 76 N 4.53 1.59 0.31 0.98 -0.02 -1.26 -4.37 135.00 136.76 1byf n PRO 76 Ca -0.01 0.57 0.17 0.00 -2.02 0.00 0.00 63.50 62.21 1byf n PRO 76 Cb 0.42 -2.12 0.98 0.00 -0.02 0.00 0.00 33.50 32.76 1byf n PRO 76 CO 0.00 0.00 0.00 1.15 1.98 0.00 0.00 175.50 178.63 1byf h THR 77 N 2.74 0.36 -0.58 3.45 2.02 -1.94 -1.20 112.91 117.76 1byf h THR 77 Ca -0.44 -0.09 0.00 0.00 0.77 0.00 0.00 66.41 66.65 1byf h THR 77 Cb 1.31 1.06 0.00 0.00 -1.74 0.00 0.00 68.15 68.79 1byf h THR 77 CO 0.71 0.02 0.00 -0.90 0.37 0.00 0.00 175.52 175.72 1byf n ASP 78 N -3.56 4.97 -4.74 4.18 5.75 -1.26 -4.65 116.55 117.24 1byf n ASP 78 Ca -0.03 -2.64 -0.40 0.00 -0.01 0.00 0.00 54.79 51.71 1byf n ASP 78 Cb 0.11 -0.60 0.02 0.00 -1.03 0.00 0.00 41.12 39.62 1byf n ASP 78 CO 0.00 0.00 0.00 -0.24 -0.11 0.00 0.00 177.20 176.85 1byf n SER 79 N 0.81 2.87 0.00 -1.12 2.88 -0.45 -4.85 113.62 113.75 1byf n SER 79 Ca 0.26 1.07 0.05 0.00 -1.33 0.00 0.00 58.87 58.92 1byf n SER 79 Cb 0.98 -1.56 0.22 0.00 -0.75 0.00 0.00 64.21 63.10 1byf n SER 79 CO 0.00 0.00 0.00 0.47 -1.23 0.00 0.00 175.04 174.28 1byf n ASP 80 N -0.32 0.00 0.16 -3.46 8.00 -1.26 -2.63 116.55 117.04 1byf n ASP 80 Ca 0.07 0.47 0.01 0.00 0.71 0.00 0.00 54.79 56.05 1byf n ASP 80 Cb 0.42 -0.49 0.24 0.00 -0.02 0.00 0.00 41.12 41.28 1byf n ASP 80 CO 0.00 0.00 0.00 -0.07 -0.39 0.00 0.00 177.20 176.74 1byf h LEU 81 N 0.00 0.00 -9.97 0.64 3.38 -1.95 -3.45 115.31 103.96 1byf h LEU 81 Ca 0.00 0.00 -0.52 0.00 0.09 0.00 0.00 57.88 57.45 1byf h LEU 81 Cb 0.17 0.00 0.08 0.00 0.09 0.00 0.00 40.66 41.00 1byf h LEU 81 CO 0.00 0.52 0.56 0.26 0.09 0.00 0.00 178.44 179.87 1byf s TRP 82 N -3.76 2.80 0.87 1.13 0.52 -1.08 -1.01 118.94 118.41 1byf s TRP 82 Ca -0.01 1.46 -0.11 0.00 0.02 0.00 0.00 56.10 57.46 1byf s TRP 82 Cb 0.13 -3.57 0.12 0.00 -1.15 0.00 0.00 33.47 29.00 1byf s TRP 82 CO 0.74 -1.92 1.11 -1.12 0.02 0.00 0.00 176.95 175.77 1byf s SER 83 N -1.00 3.50 0.21 2.95 0.01 0.52 -4.69 113.70 115.20 1byf s SER 83 Ca 0.61 1.86 -0.32 0.00 1.31 0.00 0.00 55.95 59.40 1byf s SER 83 Cb -0.35 -2.45 -0.13 0.00 0.21 0.00 0.00 66.02 63.30 1byf s SER 83 CO 0.43 -2.68 1.53 -2.65 0.41 0.00 0.00 173.24 170.28 1byf n PRO 84 N -3.94 2.22 -2.01 12.44 -0.02 -1.26 -2.11 135.00 140.32 1byf n PRO 84 Ca 0.09 0.80 -0.15 0.00 -2.02 0.00 0.00 63.50 62.22 1byf n PRO 84 Cb 0.53 -2.53 -0.03 0.00 -0.02 0.00 0.00 33.50 31.46 1byf n PRO 84 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 1byf n ASN 85 N 2.81 -4.58 -4.21 2.55 5.03 -1.26 -5.01 115.26 110.59 1byf n ASN 85 Ca 0.14 0.11 -0.18 0.00 0.87 0.00 0.00 54.58 55.52 1byf n ASN 85 Cb 0.31 -3.62 -0.11 0.00 -1.02 0.00 0.00 39.78 35.34 1byf n ASN 85 CO 0.00 0.00 0.00 -1.61 -1.83 0.00 0.00 177.26 173.82 1byf s GLU 86 N -4.26 0.92 0.53 3.52 0.41 -0.90 -4.25 118.70 114.68 1byf s GLU 86 Ca 0.00 -1.12 -0.19 0.00 -0.41 0.00 0.00 54.97 53.25 1byf s GLU 86 Cb 0.00 -0.83 -0.06 0.00 -1.78 0.00 0.00 34.13 31.46 1byf s GLU 86 CO 0.00 0.17 1.07 -1.25 -0.49 0.00 0.00 175.26 174.76 1byf s PRO 87 N -2.34 3.53 0.00 0.39 0.04 -1.26 -4.59 135.00 130.77 1byf s PRO 87 Ca 0.04 1.42 0.00 0.00 0.04 0.00 0.00 61.00 62.50 1byf s PRO 87 Cb -0.06 -2.05 0.00 0.00 0.04 0.00 0.00 34.50 32.43 1byf s PRO 87 CO 0.02 -0.67 0.11 -1.13 0.04 0.00 0.00 177.00 175.37 1byf n SER 88 N -1.32 0.00 -4.83 6.66 3.41 -1.26 -5.05 113.62 111.23 1byf n SER 88 Ca 0.10 -1.00 -0.31 0.00 -0.26 0.00 0.00 58.87 57.40 1byf n SER 88 Cb 0.52 0.00 0.04 0.00 -0.26 0.00 0.00 64.21 64.51 1byf n SER 88 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 175.04 175.08 1byf s ASN 89 N 0.00 5.54 0.17 4.04 -0.87 -1.26 -4.94 114.94 117.61 1byf s ASN 89 Ca 0.00 1.59 -0.33 0.00 -1.57 0.00 0.00 52.86 52.55 1byf s ASN 89 Cb 0.00 -2.49 -0.14 0.00 -0.02 0.00 0.00 41.25 38.60 1byf s ASN 89 CO 0.00 -1.34 1.48 -2.65 -2.57 0.00 0.00 177.10 172.02 1byf n PRO 90 N -3.03 1.93 0.16 -0.60 -0.02 -1.26 -4.85 135.00 127.33 1byf n PRO 90 Ca 0.07 0.69 0.12 0.00 -2.02 0.00 0.00 63.50 62.37 1byf n PRO 90 Cb 0.54 -2.40 0.56 0.00 -0.02 0.00 0.00 33.50 32.18 1byf n PRO 90 CO 0.00 0.00 0.00 1.96 1.98 0.00 0.00 175.50 179.44 1byf h GLN 91 N 5.14 0.00 0.00 -0.52 4.20 -1.92 -2.50 115.11 119.50 1byf h GLN 91 Ca -0.45 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.26 1byf h GLN 91 Cb 1.28 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.06 1byf h GLN 91 CO 0.83 0.00 0.00 0.66 -0.67 0.00 0.00 178.83 179.65 1byf h SER 92 N 0.00 0.00 -4.29 1.46 4.64 -1.94 -3.13 113.55 110.29 1byf h SER 92 Ca 0.00 0.00 -0.50 0.00 -0.47 0.00 0.00 61.79 60.82 1byf h SER 92 Cb 0.21 0.00 0.05 0.00 -0.31 0.00 0.00 62.40 62.35 1byf h SER 92 CO 0.00 0.00 0.39 0.26 -0.87 0.00 0.00 176.83 176.61 1byf s TRP 93 N -3.16 3.60 -0.32 4.77 0.52 -0.95 -4.97 118.94 118.43 1byf s TRP 93 Ca 0.09 1.28 -0.28 0.00 0.02 0.00 0.00 56.10 57.21 1byf s TRP 93 Cb 0.11 -2.70 0.02 0.00 -1.15 0.00 0.00 33.47 29.74 1byf s TRP 93 CO 0.58 -0.62 1.04 -0.65 0.02 0.00 0.00 176.95 177.32 1byf s GLN 94 N -5.01 4.06 -0.08 4.98 -0.21 -1.26 -4.67 119.66 117.46 1byf s GLN 94 Ca 0.55 1.03 0.02 0.00 0.02 0.00 0.00 55.36 56.98 1byf s GLN 94 Cb -0.11 -3.73 -0.02 0.00 1.00 0.00 0.00 33.01 30.15 1byf s GLN 94 CO 0.51 -0.87 -0.15 -0.51 -2.12 0.00 0.00 175.29 172.15 1byf s LEU 95 N 3.56 2.64 0.23 2.90 1.43 -1.26 -4.24 118.68 123.94 1byf s LEU 95 Ca 0.44 -0.29 0.10 0.00 -1.03 0.00 0.00 54.13 53.34 1byf s LEU 95 Cb -0.12 -1.55 -0.04 0.00 0.03 0.00 0.00 46.19 44.50 1byf s LEU 95 CO 0.15 0.26 -0.07 0.00 0.23 0.00 0.00 176.35 176.91 1byf s VAL 97 N -2.05 3.37 0.28 0.00 1.01 -0.51 -0.82 120.40 121.67 1byf s VAL 97 Ca 0.28 -0.60 0.03 0.00 0.00 0.00 0.00 61.98 61.70 1byf s VAL 97 Cb -0.07 -2.36 -0.06 0.00 0.00 0.00 0.00 36.38 33.89 1byf s VAL 97 CO 0.17 0.58 0.03 0.00 0.00 0.00 0.00 175.10 175.88 1byf s GLN 98 N -0.57 1.50 -0.47 2.72 -2.07 -0.51 -2.03 119.66 118.23 1byf s GLN 98 Ca 0.08 -1.80 -0.18 0.00 -1.82 0.00 0.00 55.36 51.64 1byf s GLN 98 Cb -0.12 -0.70 0.04 0.00 -1.09 0.00 0.00 33.01 31.14 1byf s GLN 98 CO 0.02 -0.16 0.54 0.42 -1.32 0.00 0.00 175.29 174.79 1byf s ILE 99 N -3.39 4.97 -0.12 3.63 1.01 0.18 -1.07 121.20 126.41 1byf s ILE 99 Ca 0.33 -0.41 -0.27 0.00 0.00 0.00 0.00 60.65 60.30 1byf s ILE 99 Cb 0.07 -4.18 -0.02 0.00 0.01 0.00 0.00 42.46 38.34 1byf s ILE 99 CO 0.13 -0.63 0.91 0.86 0.00 0.00 0.00 174.94 176.20 1byf s TRP 100 N 2.40 3.49 0.59 3.97 -0.00 0.03 -1.76 118.94 127.66 1byf s TRP 100 Ca 0.14 1.44 0.29 0.00 -0.00 0.00 0.00 56.10 57.97 1byf s TRP 100 Cb -0.18 -3.08 1.76 0.00 -0.00 0.00 0.00 33.47 31.97 1byf s TRP 100 CO 0.13 -0.18 2.22 0.66 -0.00 0.00 0.00 176.95 179.78 1byf h SER 101 N 7.13 0.00 -0.71 5.86 4.64 -1.87 0.42 113.55 129.02 1byf h SER 101 Ca -0.32 0.00 0.05 0.00 -0.47 0.00 0.00 61.79 61.05 1byf h SER 101 Cb 1.15 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 63.19 1byf h SER 101 CO 0.83 0.00 0.42 0.50 -0.87 0.00 0.00 176.83 177.71 1byf h LYS 102 N 0.00 0.75 0.00 4.77 3.64 -1.93 -3.30 116.57 120.51 1byf h LYS 102 Ca 0.02 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.35 1byf h LYS 102 Cb 0.10 -0.17 0.00 0.00 -0.41 0.00 0.00 32.23 31.75 1byf h LYS 102 CO -0.00 0.50 -0.33 0.66 -2.27 0.00 0.00 179.45 178.01 1byf n TYR 103 N -4.73 0.00 -3.35 1.91 4.01 -0.99 -5.00 117.16 109.01 1byf n TYR 103 Ca 0.09 0.00 -0.18 0.00 -0.16 0.00 0.00 57.90 57.64 1byf n TYR 103 Cb 0.15 -0.01 0.07 0.00 -0.31 0.00 0.00 39.34 39.24 1byf n TYR 103 CO 0.00 0.00 0.00 -1.71 -0.46 0.00 0.00 176.86 174.69 1byf n ASN 104 N -1.17 -4.95 -4.14 7.72 4.05 0.14 -5.01 115.26 111.91 1byf n ASN 104 Ca 0.00 -0.45 -0.11 0.00 0.45 0.00 0.00 54.58 54.47 1byf n ASN 104 Cb 0.02 -4.20 -0.09 0.00 1.23 0.00 0.00 39.78 36.74 1byf n ASN 104 CO 0.00 0.00 0.00 -0.76 -3.05 0.00 0.00 177.26 173.45 1byf s LEU 105 N -6.02 1.28 0.63 1.20 1.43 -1.21 -4.90 118.68 111.08 1byf s LEU 105 Ca 0.39 -1.23 -0.17 0.00 -1.03 0.00 0.00 54.13 52.09 1byf s LEU 105 Cb -0.17 0.56 -0.02 0.00 0.03 0.00 0.00 46.19 46.59 1byf s LEU 105 CO 0.59 -0.83 1.15 -0.76 0.23 0.00 0.00 176.35 176.74 1byf s LEU 106 N -3.09 3.53 -0.12 1.79 1.43 -0.18 -0.79 118.68 121.25 1byf s LEU 106 Ca 0.30 2.20 -0.24 0.00 -1.03 0.00 0.00 54.13 55.36 1byf s LEU 106 Cb 0.06 -4.58 0.06 0.00 0.03 0.00 0.00 46.19 41.76 1byf s LEU 106 CO 0.07 -1.63 0.59 -0.62 0.23 0.00 0.00 176.35 174.99 1byf s ASP 107 N -2.05 -0.57 -0.05 2.29 2.15 -0.24 -0.36 116.67 117.85 1byf s ASP 107 Ca 0.72 0.81 -0.17 0.00 0.43 0.00 0.00 52.55 54.35 1byf s ASP 107 Cb -0.25 0.79 -0.05 0.00 -0.30 0.00 0.00 42.92 43.10 1byf s ASP 107 CO 0.36 -0.42 0.46 1.51 -0.17 0.00 0.00 175.17 176.91 1byf s ASP 108 N -0.60 6.77 0.22 -0.34 -4.77 -1.26 -1.42 116.67 115.27 1byf s ASP 108 Ca -0.07 0.92 -0.02 0.00 -3.30 0.00 0.00 52.55 50.08 1byf s ASP 108 Cb -0.03 -2.28 -0.03 0.00 -1.09 0.00 0.00 42.92 39.49 1byf s ASP 108 CO 0.05 0.16 0.20 0.68 0.70 0.00 0.00 175.17 176.96 1byf s VAL 109 N -0.23 0.00 1.02 2.11 -7.23 -0.00 -4.72 120.40 111.34 1byf s VAL 109 Ca 0.25 -1.92 -0.12 0.00 -1.81 0.00 0.00 61.98 58.38 1byf s VAL 109 Cb -0.16 -2.47 0.20 0.00 0.56 0.00 0.00 36.38 34.51 1byf s VAL 109 CO 0.12 0.00 1.08 -0.83 -0.31 0.00 0.00 175.10 175.17 1byf s GLY 110 N -3.17 1.57 0.00 2.32 0.00 -1.26 -0.59 107.32 106.19 1byf s GLY 110 Ca 0.37 -0.31 0.23 0.00 0.00 0.00 0.00 44.72 45.01 1byf s GLY 110 CO 0.13 0.31 1.44 0.00 0.00 0.00 0.00 173.10 174.98 1byf n GLY 112 N 1.35 -1.12 3.79 0.00 0.00 -1.26 -2.31 105.19 105.64 1byf n GLY 112 Ca 0.17 -0.46 -0.34 0.00 0.00 0.00 0.00 46.02 45.39 1byf n GLY 112 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1byf s GLY 113 N -2.99 2.51 -0.07 -0.02 0.00 -1.26 -4.64 107.32 100.85 1byf s GLY 113 Ca 0.10 0.66 -0.30 0.00 0.00 0.00 0.00 44.72 45.18 1byf s GLY 113 CO 0.77 0.99 1.02 0.00 0.00 0.00 0.00 173.10 175.88 1byf s ALA 114 N -1.96 3.35 0.13 3.20 0.00 -1.26 -3.87 121.76 121.35 1byf s ALA 114 Ca 0.69 0.46 -0.07 0.00 0.00 0.00 0.00 51.96 53.04 1byf s ALA 114 Cb -0.19 -3.42 -0.02 0.00 0.00 0.00 0.00 23.12 19.50 1byf s ALA 114 CO 0.24 -0.51 0.20 1.03 0.00 0.00 0.00 175.76 176.72 1byf s ARG 115 N 1.73 1.00 1.00 0.00 0.52 0.13 -4.75 118.95 118.57 1byf s ARG 115 Ca 0.50 -1.18 -0.12 0.00 -0.52 0.00 0.00 55.73 54.41 1byf s ARG 115 Cb -0.20 0.33 0.19 0.00 0.52 0.00 0.00 34.95 35.79 1byf s ARG 115 CO 0.21 -0.33 1.09 1.03 0.02 0.00 0.00 175.30 177.32 1byf s ARG 116 N -3.96 0.44 0.02 3.54 0.52 -0.80 -1.22 118.95 117.49 1byf s ARG 116 Ca 0.15 0.53 0.06 0.00 -0.52 0.00 0.00 55.73 55.95 1byf s ARG 116 Cb 0.05 -1.74 -0.02 0.00 0.52 0.00 0.00 34.95 33.76 1byf s ARG 116 CO -0.03 -2.73 -0.18 0.08 0.02 0.00 0.00 175.30 172.46 1byf s VAL 117 N -2.96 1.46 -0.11 3.52 1.01 -1.12 -0.37 120.40 121.83 1byf s VAL 117 Ca 0.65 -0.97 -0.00 0.00 0.00 0.00 0.00 61.98 61.66 1byf s VAL 117 Cb -0.19 -1.25 0.02 0.00 0.00 0.00 0.00 36.38 34.97 1byf s VAL 117 CO 0.58 0.26 -0.08 -0.63 0.00 0.00 0.00 175.10 175.22 1byf s ILE 118 N -0.63 1.06 0.20 2.22 1.01 -1.25 -0.74 121.20 123.06 1byf s ILE 118 Ca 0.06 -0.32 0.09 0.00 0.00 0.00 0.00 60.65 60.49 1byf s ILE 118 Cb -0.08 -1.06 -0.04 0.00 0.01 0.00 0.00 42.46 41.29 1byf s ILE 118 CO 0.01 0.37 -0.09 0.00 0.00 0.00 0.00 174.94 175.23 1byf s GLU 120 N -3.02 1.01 -0.26 0.00 -1.05 0.12 -0.71 118.70 114.79 1byf s GLU 120 Ca 0.26 -1.44 -0.02 0.00 -0.15 0.00 0.00 54.97 53.62 1byf s GLU 120 Cb -0.08 -0.43 0.15 0.00 -0.44 0.00 0.00 34.13 33.33 1byf s GLU 120 CO 0.16 0.00 0.46 0.21 0.95 0.00 0.00 175.26 177.04 1byf s LYS 121 N -3.81 0.43 0.46 -4.83 2.20 -0.27 -1.02 119.74 112.90 1byf s LYS 121 Ca 0.17 0.74 -0.25 0.00 -0.36 0.00 0.00 55.97 56.27 1byf s LYS 121 Cb 0.04 -0.06 -0.08 0.00 -1.51 0.00 0.00 37.83 36.22 1byf s LYS 121 CO -0.00 -0.61 1.37 -2.00 -0.36 0.00 0.00 175.35 173.74 1byf s GLU 122 N 2.67 3.65 -0.14 4.03 2.12 -1.26 -0.75 118.70 129.02 1byf s GLU 122 Ca 0.15 2.28 0.01 0.00 0.36 0.00 0.00 54.97 57.77 1byf s GLU 122 Cb -0.15 -2.59 -0.00 0.00 0.26 0.00 0.00 34.13 31.65 1byf s GLU 122 CO -0.18 -0.80 -0.18 -0.51 -0.54 0.00 0.00 175.26 173.06 1byf s LEU 123 N -2.83 2.37 0.00 2.70 1.43 -0.68 -4.88 118.68 116.80 1byf s LEU 123 Ca 0.62 -0.50 0.13 0.00 -1.03 0.00 0.00 54.13 53.35 1byf s LEU 123 Cb -0.41 -1.52 0.10 0.00 0.03 0.00 0.00 46.19 44.39 1byf s LEU 123 CO 0.52 0.10 0.90 0.47 0.23 0.00 0.00 176.35 178.57