#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 0.48 -0.25 1.24 1.51 -1.26 -1.15 117.35 117.92 1byf s TYR 3 Ca 0.00 -0.83 -0.04 0.00 -1.01 0.00 0.00 57.07 55.19 1byf s TYR 3 Cb 0.00 0.15 0.01 0.00 -0.11 0.00 0.00 41.96 42.00 1byf s TYR 3 CO 0.00 -1.02 -0.02 -1.21 -1.11 0.00 0.00 175.55 172.20 1byf s GLU 4 N -3.83 3.13 -0.14 -0.62 2.02 -0.47 -4.89 118.70 113.90 1byf s GLU 4 Ca 0.24 -0.80 0.02 0.00 0.02 0.00 0.00 54.97 54.45 1byf s GLU 4 Cb -0.00 -3.10 0.00 0.00 0.10 0.00 0.00 34.13 31.13 1byf s GLU 4 CO 0.11 -0.33 -0.19 0.42 0.02 0.00 0.00 175.26 175.29 1byf s ILE 5 N 1.44 2.35 -0.17 -1.63 -1.09 -1.26 -1.14 121.20 119.69 1byf s ILE 5 Ca 0.03 -0.89 -0.02 0.00 -2.23 0.00 0.00 60.65 57.55 1byf s ILE 5 Cb -0.16 -1.96 -0.01 0.00 -1.58 0.00 0.00 42.46 38.76 1byf s ILE 5 CO -0.02 0.54 -0.10 -0.22 -1.23 0.00 0.00 174.94 173.90 1byf s LEU 6 N 0.73 2.74 -0.12 2.97 2.96 0.03 -4.97 118.68 123.01 1byf s LEU 6 Ca -0.08 -0.38 -0.02 0.00 -0.22 0.00 0.00 54.13 53.43 1byf s LEU 6 Cb -0.16 -1.65 -0.03 0.00 0.50 0.00 0.00 46.19 44.85 1byf s LEU 6 CO 0.01 0.08 -0.05 -0.36 -1.32 0.00 0.00 176.35 174.70 1byf s PHE 7 N 0.87 2.99 -0.05 5.38 0.40 -1.26 -0.60 117.98 125.70 1byf s PHE 7 Ca -0.03 -0.21 0.04 0.00 -0.60 0.00 0.00 56.93 56.13 1byf s PHE 7 Cb -0.15 -1.87 0.00 0.00 0.51 0.00 0.00 43.02 41.51 1byf s PHE 7 CO 0.00 0.08 -0.16 0.45 0.70 0.00 0.00 175.22 176.30 1byf s SER 8 N -0.05 2.11 0.09 1.36 0.15 0.21 -5.00 113.70 112.56 1byf s SER 8 Ca 0.01 -0.35 0.25 0.00 0.70 0.00 0.00 55.95 56.55 1byf s SER 8 Cb -0.13 -0.73 0.97 0.00 -1.71 0.00 0.00 66.02 64.42 1byf s SER 8 CO 0.03 0.12 1.77 0.47 1.20 0.00 0.00 173.24 176.82 1byf n ASP 9 N 3.37 0.29 -4.74 5.45 8.00 -1.26 -2.88 116.55 124.77 1byf n ASP 9 Ca -0.19 0.54 -0.41 0.00 0.71 0.00 0.00 54.79 55.44 1byf n ASP 9 Cb 0.53 -0.61 -0.05 0.00 -0.02 0.00 0.00 41.12 40.97 1byf n ASP 9 CO 0.00 0.00 0.00 -0.70 -0.39 0.00 0.00 177.20 176.11 1byf s GLU 10 N -3.07 4.71 0.11 -1.24 2.56 -1.26 -4.85 118.70 115.66 1byf s GLU 10 Ca 0.10 1.59 0.02 0.00 0.00 0.00 0.00 54.97 56.68 1byf s GLU 10 Cb 0.14 -3.29 -0.04 0.00 2.00 0.00 0.00 34.13 32.94 1byf s GLU 10 CO 0.47 0.27 0.23 0.95 -0.56 0.00 0.00 175.26 176.62 1byf s THR 11 N -0.59 5.25 0.17 -1.70 -4.23 -1.26 -3.97 115.64 109.31 1byf s THR 11 Ca 0.45 -0.59 -0.24 0.00 -1.18 0.00 0.00 61.69 60.13 1byf s THR 11 Cb -0.27 -3.63 0.06 0.00 1.34 0.00 0.00 72.50 69.99 1byf s THR 11 CO 0.33 0.02 0.88 0.00 -0.54 0.00 0.00 174.62 175.31 1byf s MET 12 N -2.87 1.29 1.07 3.99 0.23 -0.35 -4.78 119.30 117.88 1byf s MET 12 Ca 0.34 -0.69 -0.17 0.00 -1.03 0.00 0.00 55.69 54.15 1byf s MET 12 Cb -0.12 0.46 0.23 0.00 -1.53 0.00 0.00 34.83 33.87 1byf s MET 12 CO 0.28 -0.59 1.20 0.54 -2.03 0.00 0.00 175.02 174.41 1byf s ASN 13 N -2.88 2.14 0.11 -1.18 2.20 -1.25 -1.40 114.94 112.67 1byf s ASN 13 Ca 0.11 0.54 -0.18 0.00 -0.94 0.00 0.00 52.86 52.39 1byf s ASN 13 Cb -0.02 -0.76 -0.05 0.00 -2.00 0.00 0.00 41.25 38.42 1byf s ASN 13 CO 0.01 -3.36 1.64 0.22 -2.94 0.00 0.00 177.10 172.67 1byf h TYR 14 N -2.06 0.47 -0.06 1.54 3.20 -1.67 -0.83 116.97 117.55 1byf h TYR 14 Ca -0.46 -0.04 0.01 0.00 3.14 0.00 0.00 58.73 61.39 1byf h TYR 14 Cb 1.28 -0.14 -0.01 0.00 1.54 0.00 0.00 36.73 39.39 1byf h TYR 14 CO -1.40 0.47 -0.02 0.00 -1.64 0.00 0.00 178.16 175.57 1byf h ALA 15 N 0.95 0.04 -0.08 1.82 0.00 -1.94 -2.14 119.26 117.90 1byf h ALA 15 Ca 0.10 0.03 -0.04 0.00 0.00 0.00 0.00 54.91 54.99 1byf h ALA 15 Cb 0.21 0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 1byf h ALA 15 CO -0.01 -0.50 -0.14 -0.44 0.00 0.00 0.00 179.25 178.17 1byf h ASP 16 N -0.01 0.12 -0.66 0.00 3.32 -1.90 -1.79 116.42 115.50 1byf h ASP 16 Ca 0.03 -0.02 -0.04 0.00 0.02 0.00 0.00 57.03 57.03 1byf h ASP 16 Cb 0.06 -0.03 -0.03 0.00 0.22 0.00 0.00 39.33 39.55 1byf h ASP 16 CO -0.07 0.28 0.27 0.00 -1.72 0.00 0.00 179.24 178.00 1byf h ALA 17 N 1.74 0.86 -0.04 3.45 0.00 -0.66 0.16 119.26 124.77 1byf h ALA 17 Ca 0.03 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.77 1byf h ALA 17 Cb 0.33 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 17.86 1byf h ALA 17 CO 0.02 0.46 0.02 0.78 0.00 0.00 0.00 179.25 180.54 1byf h GLY 18 N 0.93 0.05 1.96 0.00 0.00 -0.71 -1.84 103.07 103.45 1byf h GLY 18 Ca 0.22 -0.02 -0.11 0.00 0.00 0.00 0.00 47.33 47.42 1byf h GLY 18 CO -0.02 0.02 -0.50 -0.91 0.00 0.00 0.00 176.54 175.13 1byf h THR 19 N 0.04 1.36 -0.23 4.70 1.35 -1.26 -0.95 112.91 117.91 1byf h THR 19 Ca 0.01 -1.71 0.01 0.00 -0.55 0.00 0.00 66.41 64.17 1byf h THR 19 Cb 0.01 1.90 -0.02 0.00 -1.73 0.00 0.00 68.15 68.31 1byf h THR 19 CO -0.00 0.49 0.13 0.22 -0.25 0.00 0.00 175.52 176.11 1byf h TYR 20 N 0.04 0.24 -0.31 4.73 5.03 -0.37 0.00 116.97 126.33 1byf h TYR 20 Ca -0.00 0.01 -0.05 0.00 2.58 0.00 0.00 58.73 61.27 1byf h TYR 20 Cb 0.89 -0.08 -0.01 0.00 1.55 0.00 0.00 36.73 39.09 1byf h TYR 20 CO 0.00 0.14 -0.00 0.00 -1.32 0.00 0.00 178.16 176.98 1byf h GLN 22 N 0.34 1.05 0.00 0.00 1.08 -0.91 -0.34 115.11 116.33 1byf h GLN 22 Ca 0.09 -0.06 0.00 0.00 -1.45 0.00 0.00 58.65 57.22 1byf h GLN 22 Cb 0.45 -0.24 0.00 0.00 -0.05 0.00 0.00 27.48 27.64 1byf h GLN 22 CO 0.02 0.70 0.00 0.66 -0.95 0.00 0.00 178.83 179.25 1byf h SER 23 N 1.08 0.00 -0.49 1.46 4.64 -0.97 -1.55 113.55 117.72 1byf h SER 23 Ca 0.36 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.68 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 -2.30 2.55 -1.07 4.77 1.74 -0.33 -4.93 116.66 117.09 1byf n ARG 24 Ca 0.01 -2.38 -0.02 0.00 -0.77 0.00 0.00 57.85 54.69 1byf n ARG 24 Cb 0.16 -1.51 -0.01 0.00 -1.02 0.00 0.00 32.46 30.08 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 1.47 0.56 1.80 -0.13 0.00 -0.58 -5.02 105.19 103.28 1byf n GLY 25 Ca 0.20 -0.89 -0.15 0.00 0.00 0.00 0.00 46.02 45.18 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 -2.89 1.10 -4.04 1.61 2.81 -0.29 -4.92 117.12 110.50 1byf n MET 26 Ca -0.02 -1.84 -0.11 0.00 -1.81 0.00 0.00 57.70 53.92 1byf n MET 26 Cb 0.08 0.71 -0.11 0.00 -0.71 0.00 0.00 33.22 33.19 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 -2.50 0.43 0.16 3.04 0.00 -0.29 -2.75 121.76 119.84 1byf s ALA 27 Ca 0.05 -0.77 -0.34 0.00 0.00 0.00 0.00 51.96 50.90 1byf s ALA 27 Cb 0.00 0.11 -0.14 0.00 0.00 0.00 0.00 23.12 23.09 1byf s ALA 27 CO 0.03 -0.11 1.54 -0.11 0.00 0.00 0.00 175.76 177.12 1byf n LEU 28 N 1.32 2.97 -4.57 0.00 7.94 -1.26 0.16 117.00 123.57 1byf n LEU 28 Ca -0.22 1.09 -0.58 0.00 -1.11 0.00 0.00 56.01 55.19 1byf n LEU 28 Cb 0.56 -1.41 -0.08 0.00 0.53 0.00 0.00 43.42 43.02 1byf n LEU 28 CO 0.21 -0.37 0.77 0.55 -1.11 0.00 0.00 177.39 177.44 1byf n VAL 29 N 3.19 0.02 0.00 1.96 3.14 -0.01 -4.15 118.33 122.48 1byf n VAL 29 Ca 0.17 -0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.54 1byf n VAL 29 Cb 0.28 -0.33 0.00 0.00 -1.06 0.00 0.00 33.84 32.73 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 2.29 0.00 -0.10 6.55 3.41 -1.26 0.61 113.62 125.12 1byf n SER 30 Ca 0.21 0.00 0.11 0.00 -0.26 0.00 0.00 58.87 58.93 1byf n SER 30 Cb 0.09 0.03 0.47 0.00 -0.26 0.00 0.00 64.21 64.55 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 0.42 0.11 4.04 4.64 -1.95 0.45 113.55 121.27 1byf h SER 31 Ca 0.00 0.01 -0.02 0.00 -0.47 0.00 0.00 61.79 61.31 1byf h SER 31 Cb 0.00 -0.08 -0.00 0.00 -0.31 0.00 0.00 62.40 62.01 1byf h SER 31 CO 0.00 0.26 -0.08 0.00 -0.87 0.00 0.00 176.83 176.13 1byf h ALA 32 N 1.68 1.71 0.00 5.18 0.00 -1.94 -1.10 119.26 124.79 1byf h ALA 32 Ca 0.28 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.12 1byf h ALA 32 Cb 0.49 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.26 1byf h ALA 32 CO -0.08 0.11 0.00 0.52 0.00 0.00 0.00 179.25 179.79 1byf h MET 33 N 0.00 0.00 -0.02 0.00 2.86 -1.24 -2.73 114.93 113.81 1byf h MET 33 Ca -0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 1byf h MET 33 Cb 0.16 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.82 1byf h MET 33 CO 0.01 0.00 -0.34 0.54 1.06 0.00 0.00 176.91 178.18 1byf n ARG 34 N -2.68 1.28 -3.16 1.72 1.74 -0.44 -4.73 116.66 110.39 1byf n ARG 34 Ca 0.02 -0.99 -0.42 0.00 -0.77 0.00 0.00 57.85 55.70 1byf n ARG 34 Cb 0.34 -1.48 -0.07 0.00 -1.02 0.00 0.00 32.46 30.23 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 -2.40 6.39 0.32 0.55 -1.08 -1.04 -4.98 116.67 114.43 1byf s ASP 35 Ca 0.22 0.09 0.04 0.00 -0.52 0.00 0.00 52.55 52.38 1byf s ASP 35 Cb 0.19 -2.31 0.64 0.00 -1.46 0.00 0.00 42.92 39.98 1byf s ASP 35 CO 0.51 -0.55 1.88 0.77 0.52 0.00 0.00 175.17 178.30 1byf h SER 36 N 8.45 0.82 -0.01 -0.34 4.64 -1.88 0.23 113.55 125.47 1byf h SER 36 Ca -0.27 0.03 -0.02 0.00 -0.47 0.00 0.00 61.79 61.06 1byf h SER 36 Cb 1.12 -0.14 0.00 0.00 -0.31 0.00 0.00 62.40 63.07 1byf h SER 36 CO 0.81 0.46 -0.07 0.74 -0.87 0.00 0.00 176.83 177.91 1byf h THR 37 N 0.89 1.56 -0.46 2.95 2.02 -1.93 -3.16 112.91 114.77 1byf h THR 37 Ca 0.44 -1.73 -0.01 0.00 0.77 0.00 0.00 66.41 65.88 1byf h THR 37 Cb 0.46 2.69 -0.02 0.00 -1.74 0.00 0.00 68.15 69.54 1byf h THR 37 CO -0.20 0.46 0.26 0.24 0.37 0.00 0.00 175.52 176.65 1byf h MET 38 N -0.64 0.64 -0.45 6.66 2.86 -1.77 -2.68 114.93 119.56 1byf h MET 38 Ca -0.01 -0.07 -0.01 0.00 -2.06 0.00 0.00 59.70 57.56 1byf h MET 38 Cb 0.78 -0.13 -0.02 0.00 0.06 0.00 0.00 31.60 32.29 1byf h MET 38 CO 0.01 0.49 0.26 -0.24 1.06 0.00 0.00 176.91 178.49 1byf h VAL 39 N 0.61 1.14 -0.65 -2.22 3.04 -0.86 -0.35 116.25 116.96 1byf h VAL 39 Ca 0.16 -0.32 -0.05 0.00 -1.01 0.00 0.00 66.70 65.49 1byf h VAL 39 Cb 0.03 0.51 -0.03 0.00 -2.01 0.00 0.00 31.29 29.79 1byf h VAL 39 CO -0.03 0.14 0.22 0.50 -1.01 0.00 0.00 177.57 177.40 1byf h LYS 40 N 0.62 0.99 -0.33 4.17 3.64 -1.45 -0.24 116.57 123.97 1byf h LYS 40 Ca 0.16 -0.20 -0.11 0.00 -1.27 0.00 0.00 60.65 59.23 1byf h LYS 40 Cb -0.00 -0.15 -0.01 0.00 -0.41 0.00 0.00 32.23 31.66 1byf h LYS 40 CO -0.03 0.86 -0.22 0.00 -2.27 0.00 0.00 179.45 177.79 1byf h ALA 41 N 1.09 0.48 0.00 5.00 0.00 -1.06 -1.65 119.26 123.12 1byf h ALA 41 Ca 0.21 -0.37 0.01 0.00 0.00 0.00 0.00 54.91 54.76 1byf h ALA 41 Cb 0.26 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 1byf h ALA 41 CO -0.01 0.44 -0.05 0.82 0.00 0.00 0.00 179.25 180.45 1byf h ILE 42 N 0.51 0.87 0.00 0.00 2.04 -0.88 -2.23 117.51 117.82 1byf h ILE 42 Ca 0.07 0.00 -0.05 0.00 1.00 0.00 0.00 64.86 65.88 1byf h ILE 42 Cb 0.78 0.87 -0.01 0.00 -0.74 0.00 0.00 36.82 37.71 1byf h ILE 42 CO 0.06 0.00 -0.24 -0.07 0.00 0.00 0.00 178.15 177.90 1byf h LEU 43 N -0.09 0.00 -0.76 1.44 3.38 -1.02 -2.05 115.31 116.21 1byf h LEU 43 Ca 0.02 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 57.89 1byf h LEU 43 Cb 0.12 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.85 1byf h LEU 43 CO -0.05 0.24 -0.17 0.00 0.09 0.00 0.00 178.44 178.55 1byf h ALA 44 N 1.76 0.94 0.17 1.53 0.00 -0.80 0.16 119.26 123.01 1byf h ALA 44 Ca -0.00 -0.34 -0.01 0.00 0.00 0.00 0.00 54.91 54.56 1byf h ALA 44 Cb 0.49 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.12 1byf h ALA 44 CO 0.03 0.61 -0.08 0.35 0.00 0.00 0.00 179.25 180.17 1byf h PHE 45 N 0.68 -0.21 0.00 0.00 3.04 -0.85 -3.07 116.94 116.54 1byf h PHE 45 Ca 0.11 -0.00 -0.03 0.00 3.98 0.00 0.00 57.97 62.02 1byf h PHE 45 Cb 0.66 0.07 -0.00 0.00 2.56 0.00 0.00 35.95 39.23 1byf h PHE 45 CO 0.03 0.14 -0.15 1.79 -2.02 0.00 0.00 178.31 178.11 1byf h THR 46 N -0.59 0.91 -0.47 4.41 1.35 -1.31 -2.26 112.91 114.93 1byf h THR 46 Ca -0.02 -0.56 0.00 0.00 -0.55 0.00 0.00 66.41 65.28 1byf h THR 46 Cb 0.44 1.32 -0.02 0.00 -1.73 0.00 0.00 68.15 68.16 1byf h THR 46 CO 0.04 0.15 0.30 -0.08 -0.25 0.00 0.00 175.52 175.68 1byf h GLU 47 N 0.00 0.63 -0.28 4.72 4.22 -0.93 0.15 114.58 123.09 1byf h GLU 47 Ca -0.00 -0.05 -0.04 0.00 0.08 0.00 0.00 59.36 59.35 1byf h GLU 47 Cb 0.31 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.41 1byf h GLU 47 CO 0.02 0.44 0.03 0.28 -2.18 0.00 0.00 179.01 177.60 1byf h VAL 48 N 0.64 1.24 -0.54 0.32 2.07 -1.33 -3.11 116.25 115.54 1byf h VAL 48 Ca 0.17 -0.84 -0.03 0.00 0.82 0.00 0.00 66.70 66.82 1byf h VAL 48 Cb -0.04 1.24 -0.03 0.00 -1.52 0.00 0.00 31.29 30.95 1byf h VAL 48 CO -0.03 0.27 0.20 0.11 0.02 0.00 0.00 177.57 178.14 1byf h LYS 49 N 0.28 0.79 -3.42 1.57 1.79 -1.10 -3.47 116.57 113.02 1byf h LYS 49 Ca 0.08 -0.12 -0.36 0.00 -2.18 0.00 0.00 60.65 58.07 1byf h LYS 49 Cb 0.37 -0.14 0.03 0.00 -1.58 0.00 0.00 32.23 30.91 1byf h LYS 49 CO 0.01 0.66 -0.50 0.41 -1.08 0.00 0.00 179.45 178.95 1byf n GLY 50 N -1.04 -0.36 3.53 3.86 0.00 0.48 -5.01 105.19 106.65 1byf n GLY 50 Ca 0.04 -0.04 -0.25 0.00 0.00 0.00 0.00 46.02 45.77 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 -3.02 2.27 0.21 1.61 3.76 -1.26 -4.83 115.29 114.03 1byf s HIS 51 Ca 0.17 -0.65 -0.30 0.00 -0.15 0.00 0.00 55.06 54.12 1byf s HIS 51 Cb -0.07 -1.42 -0.08 0.00 1.11 0.00 0.00 32.58 32.12 1byf s HIS 51 CO 0.20 0.40 0.94 -0.51 -0.85 0.00 0.00 174.74 174.92 1byf s ASP 52 N -3.58 7.61 -0.00 1.40 1.01 -1.26 -4.21 116.67 117.63 1byf s ASP 52 Ca 0.33 1.91 0.03 0.00 0.71 0.00 0.00 52.55 55.53 1byf s ASP 52 Cb 0.06 -2.60 -0.01 0.00 1.01 0.00 0.00 42.92 41.38 1byf s ASP 52 CO 0.16 0.11 -0.10 -0.31 0.21 0.00 0.00 175.17 175.24 1byf s TYR 53 N -0.93 0.86 0.49 4.23 1.51 -0.56 -1.93 117.35 121.02 1byf s TYR 53 Ca 0.42 -0.18 -0.20 0.00 -1.01 0.00 0.00 57.07 56.09 1byf s TYR 53 Cb -0.25 -0.55 -0.08 0.00 -0.11 0.00 0.00 41.96 40.97 1byf s TYR 53 CO 0.31 -0.01 1.05 -1.58 -1.11 0.00 0.00 175.55 174.21 1byf s TRP 54 N -0.30 2.95 0.20 2.71 0.23 0.56 0.21 118.94 125.50 1byf s TRP 54 Ca 0.03 1.57 0.04 0.00 -2.03 0.00 0.00 56.10 55.72 1byf s TRP 54 Cb -0.04 -3.11 -0.05 0.00 0.03 0.00 0.00 33.47 30.30 1byf s TRP 54 CO -0.00 -0.95 -0.06 0.14 0.96 0.00 0.00 176.95 177.04 1byf s VAL 55 N -1.93 1.19 -1.41 4.03 -7.23 -0.85 -3.89 120.40 110.31 1byf s VAL 55 Ca 0.68 -2.07 -0.10 0.00 -1.81 0.00 0.00 61.98 58.68 1byf s VAL 55 Cb -0.18 -2.13 0.07 0.00 0.56 0.00 0.00 36.38 34.69 1byf s VAL 55 CO 0.21 -0.51 2.32 0.61 -0.31 0.00 0.00 175.10 177.43 1byf n GLY 56 N -0.34 4.68 3.13 2.32 0.00 0.20 -4.58 105.19 110.60 1byf n GLY 56 Ca -0.07 -1.83 -0.12 0.00 0.00 0.00 0.00 46.02 44.00 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 1.11 -0.47 0.18 4.61 0.00 -1.26 -0.35 121.76 125.58 1byf s ALA 57 Ca 0.51 0.14 -0.24 0.00 0.00 0.00 0.00 51.96 52.38 1byf s ALA 57 Cb 0.15 -0.01 0.06 0.00 0.00 0.00 0.00 23.12 23.32 1byf s ALA 57 CO -0.06 -0.19 0.96 0.16 0.00 0.00 0.00 175.76 176.63 1byf s ASP 58 N -1.00 -0.13 -0.04 0.00 1.47 -0.86 -1.43 116.67 114.69 1byf s ASP 58 Ca -0.11 -0.52 0.12 0.00 1.18 0.00 0.00 52.55 53.23 1byf s ASP 58 Cb -0.06 0.52 0.37 0.00 -0.34 0.00 0.00 42.92 43.41 1byf s ASP 58 CO 0.02 -0.98 1.30 -0.46 0.68 0.00 0.00 175.17 175.73 1byf n ASN 59 N -0.69 3.18 -0.28 2.11 6.94 -0.15 -0.77 115.26 125.61 1byf n ASN 59 Ca -0.05 -2.20 0.18 0.00 -0.02 0.00 0.00 54.58 52.48 1byf n ASN 59 Cb 0.60 -0.31 0.46 0.00 -2.36 0.00 0.00 39.78 38.18 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 2.09 0.51 0.25 -4.53 3.38 -1.88 0.36 115.31 115.49 1byf h LEU 60 Ca 0.00 0.06 -0.01 0.00 0.09 0.00 0.00 57.88 58.02 1byf h LEU 60 Cb 0.89 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.61 1byf h LEU 60 CO 0.05 0.19 -0.12 -0.61 0.09 0.00 0.00 178.44 178.04 1byf h GLN 61 N 0.51 -0.32 -0.01 1.13 4.15 -1.90 -3.39 115.11 115.28 1byf h GLN 61 Ca 0.51 0.02 0.00 0.00 0.77 0.00 0.00 58.65 59.95 1byf h GLN 61 Cb 1.12 0.07 0.00 0.00 0.21 0.00 0.00 27.48 28.89 1byf h GLN 61 CO -0.24 -0.21 -0.61 -0.25 -1.93 0.00 0.00 178.83 175.59 1byf n ASP 62 N -3.97 1.46 -0.56 -0.69 8.00 -1.22 -5.09 116.55 114.48 1byf n ASP 62 Ca -0.04 -1.17 0.05 0.00 0.71 0.00 0.00 54.79 54.33 1byf n ASP 62 Cb 0.13 0.58 -0.01 0.00 -0.02 0.00 0.00 41.12 41.80 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 1.44 -1.88 7.00 0.44 0.00 0.13 -4.81 105.19 107.50 1byf n GLY 63 Ca 0.08 -1.31 0.00 0.00 0.00 0.00 0.00 46.02 44.79 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 -0.90 0.00 -1.38 4.61 0.00 -1.11 -1.05 120.51 120.67 1byf n ALA 64 Ca 0.00 0.00 -0.33 0.00 0.00 0.00 0.00 53.44 53.12 1byf n ALA 64 Cb 0.17 0.00 0.09 0.00 0.00 0.00 0.00 19.45 19.71 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 3.15 -2.64 0.00 4.01 -1.26 -4.70 117.16 129.72 1byf n TYR 65 Ca 0.00 -2.84 -0.42 0.00 -0.16 0.00 0.00 57.90 54.48 1byf n TYR 65 Cb 0.00 -1.30 0.01 0.00 -0.31 0.00 0.00 39.34 37.73 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 -0.93 6.46 -4.73 7.72 3.02 -0.22 -4.71 115.26 121.87 1byf n ASN 66 Ca 0.61 -3.35 -0.41 0.00 -0.03 0.00 0.00 54.58 51.39 1byf n ASN 66 Cb 0.79 -1.32 -0.03 0.00 -0.61 0.00 0.00 39.78 38.61 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 -2.06 3.34 -0.05 3.10 0.08 -1.26 -4.56 117.98 116.57 1byf s PHE 67 Ca 0.37 1.26 0.04 0.00 0.12 0.00 0.00 56.93 58.73 1byf s PHE 67 Cb 0.10 -3.53 -0.00 0.00 -0.57 0.00 0.00 43.02 39.02 1byf s PHE 67 CO 0.01 -1.64 -0.18 -0.51 -0.10 0.00 0.00 175.22 172.81 1byf s LEU 68 N 0.17 1.92 0.63 -0.37 1.43 0.05 -1.30 118.68 121.20 1byf s LEU 68 Ca 0.57 -0.37 -0.16 0.00 -1.03 0.00 0.00 54.13 53.14 1byf s LEU 68 Cb -0.34 -1.00 -0.01 0.00 0.03 0.00 0.00 46.19 44.86 1byf s LEU 68 CO 0.35 0.15 1.13 0.26 0.23 0.00 0.00 176.35 178.47 1byf s TRP 69 N 0.06 2.58 -0.68 0.29 0.52 0.12 -2.03 118.94 119.80 1byf s TRP 69 Ca -0.05 1.55 0.13 0.00 0.02 0.00 0.00 56.10 57.76 1byf s TRP 69 Cb -0.12 -3.24 0.63 0.00 -1.15 0.00 0.00 33.47 29.59 1byf s TRP 69 CO 0.03 -1.75 1.40 0.27 0.02 0.00 0.00 176.95 176.91 1byf n ASN 70 N -2.12 0.28 -1.35 2.95 2.04 0.53 -1.21 115.26 116.39 1byf n ASN 70 Ca 0.11 0.61 0.06 0.00 -0.44 0.00 0.00 54.58 54.92 1byf n ASN 70 Cb 0.51 -0.65 0.28 0.00 -2.53 0.00 0.00 39.78 37.39 1byf n ASN 70 CO 0.00 0.00 0.00 -0.90 -0.44 0.00 0.00 177.26 175.92 1byf n ASP 71 N -1.85 3.96 0.00 0.53 5.75 -1.26 -4.92 116.55 118.76 1byf n ASP 71 Ca 0.01 -2.45 0.00 0.00 -0.01 0.00 0.00 54.79 52.34 1byf n ASP 71 Cb 0.08 -0.54 0.00 0.00 -1.03 0.00 0.00 41.12 39.63 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 0.79 1.83 3.75 6.12 0.00 -0.35 -5.03 105.19 112.29 1byf n GLY 72 Ca 0.20 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.82 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 -2.85 4.18 0.40 1.61 1.01 -1.25 -4.78 120.40 118.71 1byf s VAL 73 Ca 0.00 2.05 -0.26 0.00 0.00 0.00 0.00 61.98 63.77 1byf s VAL 73 Cb 0.00 -4.31 -0.09 0.00 0.00 0.00 0.00 36.38 31.98 1byf s VAL 73 CO 0.00 0.47 1.26 -0.55 0.00 0.00 0.00 175.10 176.28 1byf s SER 74 N -0.95 6.42 -0.60 3.32 0.15 -1.26 0.11 113.70 120.88 1byf s SER 74 Ca 0.42 2.56 -0.09 0.00 0.70 0.00 0.00 55.95 59.54 1byf s SER 74 Cb -0.25 -2.63 0.16 0.00 -1.71 0.00 0.00 66.02 61.58 1byf s SER 74 CO 0.31 -0.77 0.48 -0.22 1.20 0.00 0.00 173.24 174.25 1byf s LEU 75 N -2.38 5.87 0.26 3.45 0.20 -0.42 -4.77 118.68 120.89 1byf s LEU 75 Ca 0.56 -2.34 -0.30 0.00 0.69 0.00 0.00 54.13 52.74 1byf s LEU 75 Cb -0.36 -2.03 -0.14 0.00 -0.43 0.00 0.00 46.19 43.23 1byf s LEU 75 CO 0.46 -0.59 1.23 -2.65 -0.29 0.00 0.00 176.35 174.51 1byf n PRO 76 N 4.33 1.72 0.30 0.98 -0.02 -1.26 -4.36 135.00 136.68 1byf n PRO 76 Ca 0.01 0.61 0.16 0.00 -2.02 0.00 0.00 63.50 62.25 1byf n PRO 76 Cb 0.41 -2.14 0.91 0.00 -0.02 0.00 0.00 33.50 32.67 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 2.59 0.47 -0.51 3.45 2.02 -1.94 -1.56 112.91 117.42 1byf h THR 77 Ca -0.43 -0.12 0.00 0.00 0.77 0.00 0.00 66.41 66.63 1byf h THR 77 Cb 1.31 1.08 0.00 0.00 -1.74 0.00 0.00 68.15 68.79 1byf h THR 77 CO 0.68 0.02 0.00 -0.90 0.37 0.00 0.00 175.52 175.69 1byf n ASP 78 N -3.71 5.00 -4.72 4.18 5.75 -1.26 -4.65 116.55 117.14 1byf n ASP 78 Ca -0.03 -2.81 -0.39 0.00 -0.01 0.00 0.00 54.79 51.55 1byf n ASP 78 Cb 0.11 -0.61 0.04 0.00 -1.03 0.00 0.00 41.12 39.63 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 0.46 2.44 0.10 -1.12 2.88 -0.59 -4.88 113.62 112.91 1byf n SER 79 Ca 0.25 0.96 0.10 0.00 -1.33 0.00 0.00 58.87 58.86 1byf n SER 79 Cb 1.03 -1.55 0.44 0.00 -0.75 0.00 0.00 64.21 63.38 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 -0.91 0.47 0.26 -3.46 8.00 -1.26 -2.52 116.55 117.14 1byf n ASP 80 Ca 0.11 0.63 0.15 0.00 0.71 0.00 0.00 54.79 56.39 1byf n ASP 80 Cb 0.45 -0.72 0.64 0.00 -0.02 0.00 0.00 41.12 41.46 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 -9.92 0.64 3.38 -1.95 -3.45 115.31 104.01 1byf h LEU 81 Ca 0.00 0.00 -0.50 0.00 0.09 0.00 0.00 57.88 57.47 1byf h LEU 81 Cb 0.29 0.00 0.03 0.00 0.09 0.00 0.00 40.66 41.07 1byf h LEU 81 CO 0.00 0.06 0.46 0.26 0.09 0.00 0.00 178.44 179.31 1byf s TRP 82 N -3.69 3.26 0.82 1.13 0.52 -1.05 -0.42 118.94 119.52 1byf s TRP 82 Ca 0.01 1.62 -0.11 0.00 0.02 0.00 0.00 56.10 57.64 1byf s TRP 82 Cb 0.09 -3.26 0.09 0.00 -1.15 0.00 0.00 33.47 29.25 1byf s TRP 82 CO 0.57 -0.86 1.14 -1.12 0.02 0.00 0.00 176.95 176.70 1byf s SER 83 N -1.26 3.76 0.20 2.95 0.01 0.47 -4.69 113.70 115.13 1byf s SER 83 Ca 0.55 2.11 -0.33 0.00 1.31 0.00 0.00 55.95 59.59 1byf s SER 83 Cb -0.27 -2.56 -0.14 0.00 0.21 0.00 0.00 66.02 63.26 1byf s SER 83 CO 0.34 -2.54 1.40 -2.65 0.41 0.00 0.00 173.24 170.20 1byf n PRO 84 N -3.62 1.83 -1.85 12.44 -0.02 -1.26 -2.04 135.00 140.48 1byf n PRO 84 Ca 0.11 0.65 -0.15 0.00 -2.02 0.00 0.00 63.50 62.10 1byf n PRO 84 Cb 0.52 -2.31 -0.03 0.00 -0.02 0.00 0.00 33.50 31.66 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 2.44 -4.60 -4.23 2.55 3.02 -1.26 -5.01 115.26 108.17 1byf n ASN 85 Ca 0.14 0.17 -0.19 0.00 -0.03 0.00 0.00 54.58 54.68 1byf n ASN 85 Cb 0.29 -3.57 -0.11 0.00 -0.61 0.00 0.00 39.78 35.77 1byf n ASN 85 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 1byf s GLU 86 N -3.98 0.98 0.51 3.52 0.41 -0.86 -4.24 118.70 115.04 1byf s GLU 86 Ca 0.00 -1.15 -0.19 0.00 -0.41 0.00 0.00 54.97 53.21 1byf s GLU 86 Cb 0.00 -0.94 -0.07 0.00 -1.78 0.00 0.00 34.13 31.34 1byf s GLU 86 CO 0.00 0.19 1.06 -1.25 -0.49 0.00 0.00 175.26 174.77 1byf s PRO 87 N -2.33 3.65 0.00 0.39 0.04 -1.26 -4.60 135.00 130.88 1byf s PRO 87 Ca 0.06 1.37 0.00 0.00 0.04 0.00 0.00 61.00 62.47 1byf s PRO 87 Cb -0.07 -2.07 0.00 0.00 0.04 0.00 0.00 34.50 32.40 1byf s PRO 87 CO 0.03 -0.56 0.07 -1.13 0.04 0.00 0.00 177.00 175.45 1byf n SER 88 N -1.19 0.00 -4.84 6.66 3.41 -1.26 -5.05 113.62 111.35 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 5.58 0.01 4.04 -0.87 -1.26 -4.92 114.94 117.52 1byf s ASN 89 Ca 0.00 1.49 -0.35 0.00 -1.57 0.00 0.00 52.86 52.43 1byf s ASN 89 Cb 0.00 -2.41 -0.14 0.00 -0.02 0.00 0.00 41.25 38.69 1byf s ASN 89 CO 0.00 -1.30 1.69 -2.65 -2.57 0.00 0.00 177.10 172.27 1byf n PRO 90 N -3.03 1.94 0.32 -0.60 -0.02 -1.26 -4.82 135.00 127.53 1byf n PRO 90 Ca 0.07 0.70 0.19 0.00 -2.02 0.00 0.00 63.50 62.45 1byf n PRO 90 Cb 0.54 -2.48 1.03 0.00 -0.02 0.00 0.00 33.50 32.57 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 7.18 0.00 -0.00 -0.52 4.20 -1.91 -1.02 115.11 123.04 1byf h GLN 91 Ca -0.47 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.24 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 0.91 0.00 -0.09 -1.13 -0.67 0.00 0.00 178.83 177.85 1byf n SER 92 N -3.14 0.35 -4.89 1.46 3.41 -1.26 -2.75 113.62 106.80 1byf n SER 92 Ca -0.02 -0.47 -0.29 0.00 -0.26 0.00 0.00 58.87 57.83 1byf n SER 92 Cb 0.21 -0.12 0.02 0.00 -0.26 0.00 0.00 64.21 64.06 1byf n SER 92 CO 0.00 0.00 0.00 0.26 -0.16 0.00 0.00 175.04 175.14 1byf s TRP 93 N -2.50 3.48 -0.25 7.33 0.52 -0.39 -4.98 118.94 122.15 1byf s TRP 93 Ca 0.29 1.03 -0.26 0.00 0.02 0.00 0.00 56.10 57.17 1byf s TRP 93 Cb 0.20 -2.72 0.00 0.00 -1.15 0.00 0.00 33.47 29.80 1byf s TRP 93 CO 0.47 -0.75 0.92 -0.65 0.02 0.00 0.00 176.95 176.97 1byf s GLN 94 N -5.10 4.19 -0.07 4.98 -0.21 -1.26 -4.66 119.66 117.52 1byf s GLN 94 Ca 0.54 1.08 0.05 0.00 0.02 0.00 0.00 55.36 57.06 1byf s GLN 94 Cb -0.11 -3.66 -0.01 0.00 1.00 0.00 0.00 33.01 30.24 1byf s GLN 94 CO 0.50 -0.60 -0.23 -0.51 -2.12 0.00 0.00 175.29 172.33 1byf s LEU 95 N 3.04 2.16 0.20 2.90 1.43 -1.26 -4.23 118.68 122.93 1byf s LEU 95 Ca 0.39 -0.49 0.10 0.00 -1.03 0.00 0.00 54.13 53.10 1byf s LEU 95 Cb -0.15 -1.41 -0.04 0.00 0.03 0.00 0.00 46.19 44.62 1byf s LEU 95 CO 0.08 0.23 -0.12 0.00 0.23 0.00 0.00 176.35 176.77 1byf s VAL 97 N -1.86 3.61 0.29 0.00 1.01 -0.51 -0.78 120.40 122.17 1byf s VAL 97 Ca 0.25 -0.49 0.05 0.00 0.00 0.00 0.00 61.98 61.79 1byf s VAL 97 Cb -0.08 -2.50 -0.06 0.00 0.00 0.00 0.00 36.38 33.74 1byf s VAL 97 CO 0.15 0.56 -0.01 0.00 0.00 0.00 0.00 175.10 175.80 1byf s GLN 98 N -0.34 1.58 -0.46 2.72 -2.07 -0.41 -2.01 119.66 118.66 1byf s GLN 98 Ca 0.05 -1.83 -0.19 0.00 -1.82 0.00 0.00 55.36 51.56 1byf s GLN 98 Cb -0.12 -1.00 0.04 0.00 -1.09 0.00 0.00 33.01 30.84 1byf s GLN 98 CO 0.02 -0.07 0.59 0.42 -1.32 0.00 0.00 175.29 174.94 1byf s ILE 99 N -3.16 4.90 -0.12 3.63 1.01 0.13 -0.94 121.20 126.65 1byf s ILE 99 Ca 0.32 -0.25 -0.26 0.00 0.00 0.00 0.00 60.65 60.46 1byf s ILE 99 Cb 0.06 -4.21 -0.02 0.00 0.01 0.00 0.00 42.46 38.30 1byf s ILE 99 CO 0.13 -0.65 0.85 0.86 0.00 0.00 0.00 174.94 176.13 1byf s TRP 100 N 2.59 3.49 0.52 3.97 -0.00 -0.00 -1.50 118.94 128.01 1byf s TRP 100 Ca 0.17 1.36 0.21 0.00 -0.00 0.00 0.00 56.10 57.84 1byf s TRP 100 Cb -0.17 -3.01 1.31 0.00 -0.00 0.00 0.00 33.47 31.60 1byf s TRP 100 CO 0.15 -0.15 2.04 0.66 -0.00 0.00 0.00 176.95 179.65 1byf h SER 101 N 7.12 0.05 -0.80 5.86 4.64 -1.88 0.90 113.55 129.43 1byf h SER 101 Ca -0.33 0.00 0.08 0.00 -0.47 0.00 0.00 61.79 61.07 1byf h SER 101 Cb 1.16 -0.01 -0.05 0.00 -0.31 0.00 0.00 62.40 63.18 1byf h SER 101 CO 0.81 0.03 0.52 0.50 -0.87 0.00 0.00 176.83 177.82 1byf h LYS 102 N 0.05 0.78 0.00 4.77 3.64 -1.93 -3.27 116.57 120.61 1byf h LYS 102 Ca 0.17 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.51 1byf h LYS 102 Cb 0.62 -0.18 0.00 0.00 -0.41 0.00 0.00 32.23 32.27 1byf h LYS 102 CO -0.01 0.52 0.00 0.66 -2.27 0.00 0.00 179.45 178.35 1byf n TYR 103 N -4.50 0.00 -3.44 1.91 4.01 -0.68 -4.99 117.16 109.47 1byf n TYR 103 Ca 0.13 0.00 -0.25 0.00 -0.16 0.00 0.00 57.90 57.62 1byf n TYR 103 Cb 0.27 0.00 0.01 0.00 -0.31 0.00 0.00 39.34 39.31 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 -0.05 -4.29 -4.24 7.72 5.15 0.30 -4.94 115.26 114.92 1byf n ASN 104 Ca 0.00 -0.47 -0.13 0.00 -0.60 0.00 0.00 54.58 53.38 1byf n ASN 104 Cb 0.10 -3.50 -0.10 0.00 -0.53 0.00 0.00 39.78 35.74 1byf n ASN 104 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 1byf s LEU 105 N -6.69 1.43 0.64 1.20 1.43 -1.22 -4.88 118.68 110.58 1byf s LEU 105 Ca 0.45 -1.36 -0.17 0.00 -1.03 0.00 0.00 54.13 52.02 1byf s LEU 105 Cb -0.23 0.23 -0.01 0.00 0.03 0.00 0.00 46.19 46.21 1byf s LEU 105 CO 0.55 -0.78 1.15 -0.76 0.23 0.00 0.00 176.35 176.74 1byf s LEU 106 N -3.20 3.50 -0.15 1.79 1.43 0.44 -0.82 118.68 121.67 1byf s LEU 106 Ca 0.36 2.16 -0.23 0.00 -1.03 0.00 0.00 54.13 55.40 1byf s LEU 106 Cb 0.07 -4.57 0.06 0.00 0.03 0.00 0.00 46.19 41.78 1byf s LEU 106 CO 0.11 -1.65 0.58 -0.62 0.23 0.00 0.00 176.35 175.00 1byf s ASP 107 N -2.15 -0.57 -0.08 2.29 2.15 -0.12 -0.40 116.67 117.79 1byf s ASP 107 Ca 0.71 0.92 -0.17 0.00 0.43 0.00 0.00 52.55 54.44 1byf s ASP 107 Cb -0.24 0.91 -0.05 0.00 -0.30 0.00 0.00 42.92 43.24 1byf s ASP 107 CO 0.38 -0.35 0.47 1.51 -0.17 0.00 0.00 175.17 177.00 1byf s ASP 108 N -0.32 6.73 0.23 -0.34 -4.77 -1.26 -1.29 116.67 115.65 1byf s ASP 108 Ca -0.05 0.87 -0.01 0.00 -3.30 0.00 0.00 52.55 50.07 1byf s ASP 108 Cb -0.03 -2.28 -0.03 0.00 -1.09 0.00 0.00 42.92 39.48 1byf s ASP 108 CO 0.04 0.09 0.20 0.68 0.70 0.00 0.00 175.17 176.88 1byf s VAL 109 N 0.15 0.00 0.96 2.11 -7.23 0.04 -4.71 120.40 111.72 1byf s VAL 109 Ca 0.25 -1.93 -0.12 0.00 -1.81 0.00 0.00 61.98 58.37 1byf s VAL 109 Cb -0.16 -2.48 0.17 0.00 0.56 0.00 0.00 36.38 34.47 1byf s VAL 109 CO 0.11 0.00 1.09 -0.83 -0.31 0.00 0.00 175.10 175.16 1byf s GLY 110 N -3.19 1.59 0.00 2.32 0.00 -1.26 -0.52 107.32 106.27 1byf s GLY 110 Ca 0.38 -0.15 0.24 0.00 0.00 0.00 0.00 44.72 45.19 1byf s GLY 110 CO 0.15 0.40 1.49 0.00 0.00 0.00 0.00 173.10 175.15 1byf n GLY 112 N 1.28 -1.27 3.79 0.00 0.00 -1.26 -2.37 105.19 105.36 1byf n GLY 112 Ca 0.17 -0.35 -0.34 0.00 0.00 0.00 0.00 46.02 45.50 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 -3.36 2.46 -0.06 -0.02 0.00 -1.26 -4.65 107.32 100.44 1byf s GLY 113 Ca 0.07 0.65 -0.30 0.00 0.00 0.00 0.00 44.72 45.15 1byf s GLY 113 CO 0.74 0.99 1.00 0.00 0.00 0.00 0.00 173.10 175.83 1byf s ALA 114 N -2.01 3.30 0.11 3.20 0.00 -1.26 -3.94 121.76 121.16 1byf s ALA 114 Ca 0.69 0.45 -0.05 0.00 0.00 0.00 0.00 51.96 53.06 1byf s ALA 114 Cb -0.20 -3.40 -0.02 0.00 0.00 0.00 0.00 23.12 19.50 1byf s ALA 114 CO 0.27 -0.45 0.12 1.03 0.00 0.00 0.00 175.76 176.73 1byf s ARG 115 N 1.59 0.88 1.01 0.00 0.52 -0.50 -4.76 118.95 117.69 1byf s ARG 115 Ca 0.50 -1.21 -0.13 0.00 -0.52 0.00 0.00 55.73 54.37 1byf s ARG 115 Cb -0.20 0.29 0.19 0.00 0.52 0.00 0.00 34.95 35.75 1byf s ARG 115 CO 0.22 -0.26 1.11 1.03 0.02 0.00 0.00 175.30 177.42 1byf s ARG 116 N -3.95 0.36 -0.01 3.54 0.52 -0.81 -1.21 118.95 117.38 1byf s ARG 116 Ca 0.14 0.35 0.06 0.00 -0.52 0.00 0.00 55.73 55.75 1byf s ARG 116 Cb 0.06 -1.74 -0.02 0.00 0.52 0.00 0.00 34.95 33.77 1byf s ARG 116 CO -0.05 -2.74 -0.18 0.08 0.02 0.00 0.00 175.30 172.43 1byf s VAL 117 N -3.07 1.42 -0.11 3.52 1.01 -1.14 -0.32 120.40 121.71 1byf s VAL 117 Ca 0.66 -0.82 0.01 0.00 0.00 0.00 0.00 61.98 61.83 1byf s VAL 117 Cb -0.16 -1.19 0.02 0.00 0.00 0.00 0.00 36.38 35.04 1byf s VAL 117 CO 0.56 0.36 -0.12 -0.63 0.00 0.00 0.00 175.10 175.27 1byf s ILE 118 N -0.48 1.33 0.21 2.22 1.01 -1.25 -0.62 121.20 123.62 1byf s ILE 118 Ca 0.07 -0.52 0.10 0.00 0.00 0.00 0.00 60.65 60.30 1byf s ILE 118 Cb -0.07 -1.25 -0.04 0.00 0.01 0.00 0.00 42.46 41.10 1byf s ILE 118 CO -0.00 0.41 -0.11 0.00 0.00 0.00 0.00 174.94 175.24 1byf s GLU 120 N -3.08 1.04 -0.25 0.00 -1.05 0.12 -0.79 118.70 114.70 1byf s GLU 120 Ca 0.26 -1.48 -0.03 0.00 -0.15 0.00 0.00 54.97 53.58 1byf s GLU 120 Cb -0.08 -0.30 0.14 0.00 -0.44 0.00 0.00 34.13 33.45 1byf s GLU 120 CO 0.15 -0.08 0.42 0.21 0.95 0.00 0.00 175.26 176.92 1byf s LYS 121 N -3.87 0.39 0.32 -4.83 2.20 -0.30 -1.14 119.74 112.50 1byf s LYS 121 Ca 0.20 0.65 -0.29 0.00 -0.36 0.00 0.00 55.97 56.17 1byf s LYS 121 Cb 0.05 -0.25 -0.11 0.00 -1.51 0.00 0.00 37.83 36.02 1byf s LYS 121 CO 0.02 -0.62 1.58 -2.00 -0.36 0.00 0.00 175.35 173.97 1byf s GLU 122 N 2.61 4.11 0.47 4.03 2.12 -1.26 -1.37 118.70 129.40 1byf s GLU 122 Ca 0.13 2.60 -0.04 0.00 0.36 0.00 0.00 54.97 58.02 1byf s GLU 122 Cb -0.15 -3.00 -0.03 0.00 0.26 0.00 0.00 34.13 31.20 1byf s GLU 122 CO -0.17 -0.63 0.75 -0.51 -0.54 0.00 0.00 175.26 174.17 1byf s LEU 123 N -0.89 3.66 0.00 2.70 1.43 -0.30 -4.89 118.68 120.39 1byf s LEU 123 Ca 0.61 0.83 0.00 0.00 -1.03 0.00 0.00 54.13 54.54 1byf s LEU 123 Cb -0.48 -3.76 0.00 0.00 0.03 0.00 0.00 46.19 41.98 1byf s LEU 123 CO 0.52 -0.56 0.00 0.47 0.23 0.00 0.00 176.35 177.01