#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3k9s s TYR 2 N 0.00 3.14 0.09 1.43 2.02 -1.26 -5.08 117.35 117.69 3k9s s TYR 2 Ca 0.00 1.59 0.03 0.00 -0.37 0.00 0.00 57.07 58.32 3k9s s TYR 2 Cb 0.00 -2.97 -0.04 0.00 -0.40 0.00 0.00 41.96 38.56 3k9s s TYR 2 CO 0.00 -0.51 -0.08 -0.08 -1.57 0.00 0.00 175.55 173.31 3k9s s THR 3 N -2.08 0.77 -0.05 -0.71 -1.32 -1.26 -4.96 115.64 106.03 3k9s s THR 3 Ca 0.65 -1.67 -0.30 0.00 -1.21 0.00 0.00 61.69 59.16 3k9s s THR 3 Cb -0.13 -1.36 -0.05 0.00 -1.51 0.00 0.00 72.50 69.45 3k9s s THR 3 CO 0.17 -0.66 1.44 -0.22 -2.21 0.00 0.00 174.62 173.15 3k9s s LEU 4 N -2.54 4.29 0.40 9.08 2.96 -1.26 -4.98 118.68 126.62 3k9s s LEU 4 Ca 0.05 2.06 -0.24 0.00 -0.22 0.00 0.00 54.13 55.78 3k9s s LEU 4 Cb -0.01 -3.55 -0.09 0.00 0.50 0.00 0.00 46.19 43.05 3k9s s LEU 4 CO -0.02 -0.79 1.10 -2.16 -1.32 0.00 0.00 176.35 173.16 3k9s s PRO 5 N 3.10 4.11 0.36 0.98 0.04 -1.26 -4.99 135.00 137.34 3k9s s PRO 5 Ca 0.65 1.65 -0.28 0.00 0.04 0.00 0.00 61.00 63.05 3k9s s PRO 5 Cb -0.30 -2.60 -0.12 0.00 0.04 0.00 0.00 34.50 31.53 3k9s s PRO 5 CO 0.25 -0.22 1.35 -1.13 0.04 0.00 0.00 177.00 177.28 3k9s n SER 6 N -0.01 3.05 -4.78 6.66 3.41 -1.26 -5.00 113.62 115.68 3k9s n SER 6 Ca 0.05 1.21 -0.34 0.00 -0.26 0.00 0.00 58.87 59.53 3k9s n SER 6 Cb 0.48 -1.52 0.01 0.00 -0.26 0.00 0.00 64.21 62.92 3k9s n SER 6 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 3k9s s LEU 7 N -1.36 3.60 -0.01 1.04 1.43 -1.26 -4.95 118.68 117.17 3k9s s LEU 7 Ca 0.55 2.02 0.02 0.00 -1.03 0.00 0.00 54.13 55.69 3k9s s LEU 7 Cb -0.54 -4.56 0.08 0.00 0.03 0.00 0.00 46.19 41.20 3k9s s LEU 7 CO 0.62 -1.28 0.99 -0.81 0.23 0.00 0.00 176.35 176.10 3k9s n PRO 8 N -1.76 1.25 -3.76 1.29 -0.05 -1.26 -4.88 135.00 125.83 3k9s n PRO 8 Ca 0.10 -0.33 -0.02 0.00 -0.05 0.00 0.00 63.50 63.21 3k9s n PRO 8 Cb 0.52 -1.17 -0.00 0.00 -0.05 0.00 0.00 33.50 32.80 3k9s n PRO 8 CO 0.00 0.00 0.00 1.52 -0.05 0.00 0.00 175.50 176.97 3k9s s TYR 9 N -1.75 -0.06 0.77 0.54 -0.85 -1.26 -5.17 117.35 109.57 3k9s s TYR 9 Ca 0.06 -0.22 -0.11 0.00 -0.52 0.00 0.00 57.07 56.28 3k9s s TYR 9 Cb 0.03 0.63 0.05 0.00 0.38 0.00 0.00 41.96 43.06 3k9s s TYR 9 CO 0.04 -0.70 1.09 0.00 -1.52 0.00 0.00 175.55 174.46 3k9s s ALA 10 N -2.78 2.40 0.21 9.51 0.00 -1.26 -4.94 121.76 124.90 3k9s s ALA 10 Ca 0.16 -0.18 0.35 0.00 0.00 0.00 0.00 51.96 52.28 3k9s s ALA 10 Cb -0.00 -3.11 1.75 0.00 0.00 0.00 0.00 23.12 21.76 3k9s s ALA 10 CO 0.01 -1.57 2.05 1.88 0.00 0.00 0.00 175.76 178.13 3k9s h TYR 11 N -0.98 0.00 -0.60 0.00 0.05 -1.96 -1.48 116.97 112.00 3k9s h TYR 11 Ca -0.46 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.32 3k9s h TYR 11 Cb 1.26 0.00 0.00 0.00 1.01 0.00 0.00 36.73 39.00 3k9s h TYR 11 CO 0.49 0.00 0.00 -0.40 -1.05 0.00 0.00 178.16 177.20 3k9s n ASP 12 N -2.80 3.63 0.25 3.88 5.75 -1.26 -4.10 116.55 121.90 3k9s n ASP 12 Ca -0.01 -2.00 0.17 0.00 -0.01 0.00 0.00 54.79 52.94 3k9s n ASP 12 Cb 0.13 -0.40 0.75 0.00 -1.03 0.00 0.00 41.12 40.57 3k9s n ASP 12 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3k9s h ALA 13 N 3.63 1.00 -0.33 2.12 0.00 -1.63 -2.49 119.26 121.56 3k9s h ALA 13 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3k9s h ALA 13 Cb 0.91 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.70 3k9s h ALA 13 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 179.25 180.53 3k9s n LEU 14 N -2.83 2.92 -4.75 0.00 4.77 -1.26 -4.74 117.00 111.11 3k9s n LEU 14 Ca -0.00 -1.72 -0.36 0.00 -0.03 0.00 0.00 56.01 53.90 3k9s n LEU 14 Cb 0.22 -0.22 0.04 0.00 -2.33 0.00 0.00 43.42 41.13 3k9s n LEU 14 CO 0.22 0.69 0.84 -1.61 -1.33 0.00 0.00 177.39 176.20 3k9s s GLU 15 N -1.06 2.88 -0.29 3.23 0.41 -0.94 -0.87 118.70 122.06 3k9s s GLU 15 Ca 0.26 1.83 0.04 0.00 -0.41 0.00 0.00 54.97 56.69 3k9s s GLU 15 Cb 0.15 -1.92 0.49 0.00 -1.78 0.00 0.00 34.13 31.07 3k9s s GLU 15 CO 0.20 -1.28 1.61 -0.35 -0.49 0.00 0.00 175.26 174.95 3k9s n PRO 16 N -1.70 2.18 -0.09 0.39 -0.04 -1.26 -4.91 135.00 129.56 3k9s n PRO 16 Ca 0.14 -2.14 -0.10 0.00 -0.04 0.00 0.00 63.50 61.36 3k9s n PRO 16 Cb 0.50 -1.87 -0.03 0.00 -0.04 0.00 0.00 33.50 32.06 3k9s n PRO 16 CO 0.00 0.00 0.00 0.72 -0.04 0.00 0.00 175.50 176.18 3k9s n HIS 17 N -0.49 0.04 -3.81 0.54 8.25 -0.05 -4.88 115.22 114.81 3k9s n HIS 17 Ca 0.39 0.02 -0.36 0.00 -0.26 0.00 0.00 57.72 57.50 3k9s n HIS 17 Cb 1.27 -0.53 -0.07 0.00 1.12 0.00 0.00 29.99 31.78 3k9s n HIS 17 CO 0.00 0.00 0.00 -0.06 0.64 0.00 0.00 176.34 176.92 3k9s s PHE 18 N -2.87 3.53 0.33 4.41 0.08 -0.90 -4.98 117.98 117.58 3k9s s PHE 18 Ca -0.29 0.46 -0.26 0.00 0.12 0.00 0.00 56.93 56.96 3k9s s PHE 18 Cb 0.04 -2.04 -0.10 0.00 -0.57 0.00 0.00 43.02 40.36 3k9s s PHE 18 CO 0.43 0.56 0.96 0.16 -0.10 0.00 0.00 175.22 177.23 3k9s s ASP 19 N -0.48 7.28 0.28 1.36 -4.77 -1.26 -3.35 116.67 115.73 3k9s s ASP 19 Ca 0.13 1.88 -0.02 0.00 -3.30 0.00 0.00 52.55 51.23 3k9s s ASP 19 Cb -0.12 -2.58 0.38 0.00 -1.09 0.00 0.00 42.92 39.51 3k9s s ASP 19 CO 0.02 -0.11 1.85 0.07 0.70 0.00 0.00 175.17 177.69 3k9s h LYS 20 N 3.15 0.93 0.04 2.11 2.10 -1.93 -1.54 116.57 121.44 3k9s h LYS 20 Ca -0.47 -0.16 0.01 0.00 -2.00 0.00 0.00 60.65 58.03 3k9s h LYS 20 Cb 1.20 -0.16 -0.01 0.00 -0.90 0.00 0.00 32.23 32.36 3k9s h LYS 20 CO 0.65 0.77 -0.07 0.37 -2.00 0.00 0.00 179.45 179.17 3k9s h GLN 21 N 0.91 -0.13 -0.18 0.07 4.15 -1.94 -1.17 115.11 116.83 3k9s h GLN 21 Ca 0.21 0.01 0.03 0.00 0.77 0.00 0.00 58.65 59.67 3k9s h GLN 21 Cb 0.20 0.03 -0.03 0.00 0.21 0.00 0.00 27.48 27.89 3k9s h GLN 21 CO -0.02 -0.09 0.02 1.15 -1.93 0.00 0.00 178.83 177.96 3k9s h THR 22 N -0.14 0.90 -0.81 2.39 2.02 -1.90 -1.58 112.91 113.79 3k9s h THR 22 Ca 0.01 -0.03 0.11 0.00 0.77 0.00 0.00 66.41 67.28 3k9s h THR 22 Cb 0.15 0.81 -0.08 0.00 -1.74 0.00 0.00 68.15 67.28 3k9s h THR 22 CO -0.04 0.02 0.44 0.24 0.37 0.00 0.00 175.52 176.54 3k9s h MET 23 N 0.08 0.68 -0.20 6.66 2.86 -0.95 0.45 114.93 124.51 3k9s h MET 23 Ca 0.08 -0.04 -0.11 0.00 -2.06 0.00 0.00 59.70 57.57 3k9s h MET 23 Cb 0.09 -0.15 -0.00 0.00 0.06 0.00 0.00 31.60 31.60 3k9s h MET 23 CO -0.13 0.45 -0.32 1.49 1.06 0.00 0.00 176.91 179.46 3k9s h GLU 24 N 0.70 0.56 -0.34 1.72 4.81 -1.01 -1.94 114.58 119.08 3k9s h GLU 24 Ca 0.41 -0.34 -0.08 0.00 -0.13 0.00 0.00 59.36 59.22 3k9s h GLU 24 Cb 0.46 0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.87 3k9s h GLU 24 CO -0.29 0.95 -0.11 0.82 -0.73 0.00 0.00 179.01 179.65 3k9s h ILE 25 N 0.23 1.28 -0.82 2.32 2.04 -0.82 0.02 117.51 121.76 3k9s h ILE 25 Ca 0.02 -1.18 0.00 0.00 1.00 0.00 0.00 64.86 64.69 3k9s h ILE 25 Cb 0.90 1.35 -0.04 0.00 -0.74 0.00 0.00 36.82 38.29 3k9s h ILE 25 CO 0.07 0.39 0.52 -0.74 0.00 0.00 0.00 178.15 178.39 3k9s h HIS 26 N 0.45 1.05 0.09 1.37 2.76 -0.11 0.05 115.15 120.81 3k9s h HIS 26 Ca 0.08 0.01 -0.00 0.00 -2.20 0.00 0.00 60.37 58.26 3k9s h HIS 26 Cb 0.62 -0.35 0.00 0.00 1.55 0.00 0.00 27.41 29.23 3k9s h HIS 26 CO 0.05 0.68 -0.04 1.25 -1.30 0.00 0.00 177.93 178.57 3k9s h HIS 27 N 1.12 -0.11 0.00 5.26 -0.00 -1.28 -0.67 115.15 119.47 3k9s h HIS 27 Ca 0.30 -0.00 0.00 0.00 -0.00 0.00 0.00 60.37 60.66 3k9s h HIS 27 Cb -0.09 0.04 0.00 0.00 -0.00 0.00 0.00 27.41 27.36 3k9s h HIS 27 CO -0.01 0.20 0.00 1.79 -0.00 0.00 0.00 177.93 179.91 3k9s h THR 28 N -0.99 0.00 0.00 6.26 1.35 -0.99 -2.77 112.91 115.77 3k9s h THR 28 Ca -0.01 -0.52 -0.01 0.00 -0.55 0.00 0.00 66.41 65.31 3k9s h THR 28 Cb 0.37 1.47 -0.00 0.00 -1.73 0.00 0.00 68.15 68.26 3k9s h THR 28 CO 0.02 0.00 -0.37 0.29 -0.25 0.00 0.00 175.52 175.22 3k9s n LYS 29 N -2.46 0.14 0.39 4.72 4.76 -0.02 -4.45 118.16 121.24 3k9s n LYS 29 Ca 0.04 0.05 -0.17 0.00 -2.87 0.00 0.00 58.31 55.37 3k9s n LYS 29 Cb 0.40 -0.74 -0.08 0.00 -1.84 0.00 0.00 35.03 32.77 3k9s n LYS 29 CO 0.00 0.00 0.00 0.45 -1.37 0.00 0.00 177.40 176.48 3k9s h HIS 30 N -0.25 -0.92 -0.39 2.13 3.86 -1.34 -1.28 115.15 116.96 3k9s h HIS 30 Ca -0.02 -0.02 0.01 0.00 -1.16 0.00 0.00 60.37 59.18 3k9s h HIS 30 Cb 0.34 0.31 -0.02 0.00 1.06 0.00 0.00 27.41 29.10 3k9s h HIS 30 CO -0.10 -0.55 0.24 1.25 0.86 0.00 0.00 177.93 179.63 3k9s h HIS 31 N -1.17 0.46 -0.92 2.45 -0.00 -1.16 -2.04 115.15 112.78 3k9s h HIS 31 Ca -0.10 0.01 0.15 0.00 -0.00 0.00 0.00 60.37 60.43 3k9s h HIS 31 Cb 0.78 -0.15 -0.09 0.00 -0.00 0.00 0.00 27.41 27.95 3k9s h HIS 31 CO -0.00 0.28 0.52 0.37 -0.00 0.00 0.00 177.93 179.10 3k9s h GLN 32 N 0.50 0.72 -0.39 5.26 5.75 -1.52 -2.09 115.11 123.34 3k9s h GLN 32 Ca 0.15 -0.04 -0.10 0.00 -0.15 0.00 0.00 58.65 58.51 3k9s h GLN 32 Cb -0.03 -0.16 -0.02 0.00 1.07 0.00 0.00 27.48 28.34 3k9s h GLN 32 CO -0.05 0.48 -0.16 1.15 -2.65 0.00 0.00 178.83 177.60 3k9s h THR 33 N 0.74 1.26 -0.54 2.39 2.02 -0.51 -0.82 112.91 117.44 3k9s h THR 33 Ca 0.50 -1.22 -0.01 0.00 0.77 0.00 0.00 66.41 66.45 3k9s h THR 33 Cb 0.67 1.14 -0.03 0.00 -1.74 0.00 0.00 68.15 68.19 3k9s h THR 33 CO -0.34 0.41 0.30 1.88 0.37 0.00 0.00 175.52 178.14 3k9s h TYR 34 N 0.64 0.74 0.00 3.16 0.05 -1.03 -0.09 116.97 120.45 3k9s h TYR 34 Ca 0.10 -0.01 0.03 0.00 0.05 0.00 0.00 58.73 58.89 3k9s h TYR 34 Cb 0.63 -0.24 -0.03 0.00 1.01 0.00 0.00 36.73 38.10 3k9s h TYR 34 CO 0.03 0.54 -0.18 0.28 -1.05 0.00 0.00 178.16 177.78 3k9s h VAL 35 N 0.73 0.57 -0.42 -2.88 2.07 -1.01 -0.92 116.25 114.40 3k9s h VAL 35 Ca 0.19 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.72 3k9s h VAL 35 Cb 0.03 0.57 -0.02 0.00 -1.52 0.00 0.00 31.29 30.36 3k9s h VAL 35 CO -0.03 0.00 0.27 0.78 0.02 0.00 0.00 177.57 178.61 3k9s h ASN 36 N -0.29 0.48 -0.37 0.57 2.35 -0.88 -0.58 115.58 116.86 3k9s h ASN 36 Ca 0.06 -0.02 -0.11 0.00 -0.55 0.00 0.00 56.30 55.67 3k9s h ASN 36 Cb 0.36 -0.12 -0.02 0.00 0.05 0.00 0.00 38.32 38.60 3k9s h ASN 36 CO -0.17 0.36 -0.17 0.78 -1.65 0.00 0.00 177.43 176.58 3k9s h ASN 37 N 0.56 0.85 -0.34 5.81 2.35 -0.92 -1.12 115.58 122.77 3k9s h ASN 37 Ca 0.15 -0.29 -0.10 0.00 -0.55 0.00 0.00 56.30 55.51 3k9s h ASN 37 Cb -0.05 -0.23 -0.01 0.00 0.05 0.00 0.00 38.32 38.08 3k9s h ASN 37 CO -0.03 1.01 -0.20 0.00 -1.65 0.00 0.00 177.43 176.56 3k9s h ALA 38 N 1.06 0.48 -0.82 -0.83 0.00 -0.89 -1.83 119.26 116.42 3k9s h ALA 38 Ca 0.11 -0.36 -0.02 0.00 0.00 0.00 0.00 54.91 54.64 3k9s h ALA 38 Cb 0.69 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 18.33 3k9s h ALA 38 CO 0.05 0.43 0.44 -0.91 0.00 0.00 0.00 179.25 179.26 3k9s h ASN 39 N 0.51 1.03 -0.55 0.00 2.35 -0.96 0.44 115.58 118.40 3k9s h ASN 39 Ca 0.07 -0.09 -0.02 0.00 -0.55 0.00 0.00 56.30 55.71 3k9s h ASN 39 Cb 0.75 -0.26 -0.03 0.00 0.05 0.00 0.00 38.32 38.83 3k9s h ASN 39 CO 0.06 0.83 0.25 0.00 -1.65 0.00 0.00 177.43 176.92 3k9s h ALA 40 N 1.33 0.71 -0.06 -0.83 0.00 -1.05 -1.87 119.26 117.50 3k9s h ALA 40 Ca 0.29 -0.14 -0.10 0.00 0.00 0.00 0.00 54.91 54.97 3k9s h ALA 40 Cb 0.04 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 3k9s h ALA 40 CO -0.05 0.29 -0.41 0.00 0.00 0.00 0.00 179.25 179.08 3k9s h ALA 41 N 1.09 1.20 -0.01 0.00 0.00 -0.67 -3.14 119.26 117.74 3k9s h ALA 41 Ca 0.19 -0.40 0.00 0.00 0.00 0.00 0.00 54.91 54.70 3k9s h ALA 41 Cb 0.14 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.85 3k9s h ALA 41 CO -0.02 0.56 -0.15 1.28 0.00 0.00 0.00 179.25 180.92 3k9s n LEU 42 N -4.03 0.88 -0.11 0.00 4.77 0.08 -4.16 117.00 114.42 3k9s n LEU 42 Ca -0.02 -0.20 -0.06 0.00 -0.03 0.00 0.00 56.01 55.71 3k9s n LEU 42 Cb 0.46 -0.12 0.02 0.00 -2.33 0.00 0.00 43.42 41.46 3k9s n LEU 42 CO 0.41 0.16 0.92 -0.08 -1.33 0.00 0.00 177.39 177.47 3k9s h GLU 43 N 1.14 0.23 0.00 3.23 4.57 -1.30 -1.82 114.58 120.63 3k9s h GLU 43 Ca 0.00 -0.01 0.00 0.00 -1.18 0.00 0.00 59.36 58.17 3k9s h GLU 43 Cb 0.43 -0.05 0.00 0.00 -0.16 0.00 0.00 28.75 28.97 3k9s h GLU 43 CO 0.00 0.15 0.00 -1.13 -1.18 0.00 0.00 179.01 176.85 3k9s n SER 44 N -5.05 0.00 -3.26 1.04 3.41 -1.26 -4.32 113.62 104.18 3k9s n SER 44 Ca 0.02 -0.90 -0.26 0.00 -0.26 0.00 0.00 58.87 57.47 3k9s n SER 44 Cb 0.15 0.00 -0.07 0.00 -0.26 0.00 0.00 64.21 64.03 3k9s n SER 44 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 3k9s n LEU 45 N -0.99 3.35 0.24 1.04 4.77 -0.68 -4.94 117.00 119.78 3k9s n LEU 45 Ca 0.21 -5.39 0.18 0.00 -0.03 0.00 0.00 56.01 50.98 3k9s n LEU 45 Cb 0.10 -0.40 0.88 0.00 -2.33 0.00 0.00 43.42 41.67 3k9s n LEU 45 CO 0.16 2.15 1.15 1.55 -1.33 0.00 0.00 177.39 181.07 3k9s h PRO 46 N 3.78 0.00 0.00 3.23 0.13 -1.75 0.29 132.00 137.68 3k9s h PRO 46 Ca 0.16 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 65.24 3k9s h PRO 46 Cb 0.66 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.79 3k9s h PRO 46 CO 0.77 0.00 -0.23 1.05 -0.23 0.00 0.00 178.00 179.36 3k9s h GLU 47 N 0.00 0.00 0.00 0.86 9.09 -1.92 -3.29 114.58 119.32 3k9s h GLU 47 Ca 0.06 0.00 -0.16 0.00 0.05 0.00 0.00 59.36 59.31 3k9s h GLU 47 Cb 0.46 0.00 -0.03 0.00 -1.65 0.00 0.00 28.75 27.53 3k9s h GLU 47 CO -0.00 0.23 -2.01 1.19 0.05 0.00 0.00 179.01 178.47 3k9s n PHE 48 N -3.28 0.00 0.07 2.06 3.72 -0.06 -4.66 117.46 115.30 3k9s n PHE 48 Ca 0.01 0.00 0.20 0.00 -0.05 0.00 0.00 57.45 57.61 3k9s n PHE 48 Cb 0.50 -0.64 0.74 0.00 -0.94 0.00 0.00 39.48 39.14 3k9s n PHE 48 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3k9s h ALA 49 N 1.25 2.24 0.00 4.37 0.00 -1.20 -3.03 119.26 122.89 3k9s h ALA 49 Ca -0.24 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.66 3k9s h ALA 49 Cb 1.47 0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.29 3k9s h ALA 49 CO 0.01 -0.59 -1.39 0.27 0.00 0.00 0.00 179.25 177.55 3k9s n ASN 50 N -4.04 0.53 -4.79 0.00 2.04 -1.26 -4.43 115.26 103.31 3k9s n ASN 50 Ca 0.07 -0.42 -0.34 0.00 -0.44 0.00 0.00 54.58 53.46 3k9s n ASN 50 Cb 0.56 1.33 0.01 0.00 -2.53 0.00 0.00 39.78 39.15 3k9s n ASN 50 CO 0.00 0.00 0.00 -0.76 -0.44 0.00 0.00 177.26 176.06 3k9s s LEU 51 N -3.82 3.60 0.51 -4.53 1.43 -1.15 -4.93 118.68 109.79 3k9s s LEU 51 Ca 0.01 1.96 -0.22 0.00 -1.03 0.00 0.00 54.13 54.85 3k9s s LEU 51 Cb 0.15 -4.55 -0.08 0.00 0.03 0.00 0.00 46.19 41.74 3k9s s LEU 51 CO 0.87 -1.20 1.02 -2.65 0.23 0.00 0.00 176.35 174.62 3k9s n PRO 52 N -1.73 1.22 0.12 1.29 -0.02 -1.26 -4.78 135.00 129.85 3k9s n PRO 52 Ca 0.10 0.45 0.03 0.00 -2.02 0.00 0.00 63.50 62.06 3k9s n PRO 52 Cb 0.52 -2.15 0.40 0.00 -0.02 0.00 0.00 33.50 32.25 3k9s n PRO 52 CO 0.00 0.00 0.00 -0.24 1.98 0.00 0.00 175.50 177.24 3k9s h VAL 53 N 1.11 1.17 0.00 -1.45 3.04 -1.96 -0.57 116.25 117.60 3k9s h VAL 53 Ca -0.47 -0.73 -0.01 0.00 -1.01 0.00 0.00 66.70 64.48 3k9s h VAL 53 Cb 1.34 1.19 -0.00 0.00 -2.01 0.00 0.00 31.29 31.81 3k9s h VAL 53 CO 0.54 0.23 -0.05 -0.33 -1.01 0.00 0.00 177.57 176.95 3k9s h GLU 54 N 0.22 0.00 0.12 4.17 3.07 -1.92 -2.49 114.58 117.74 3k9s h GLU 54 Ca 0.05 0.00 -0.27 0.00 -0.50 0.00 0.00 59.36 58.64 3k9s h GLU 54 Cb 0.35 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.26 3k9s h GLU 54 CO 0.02 0.05 -1.34 1.49 -1.40 0.00 0.00 179.01 177.83 3k9s h GLU 55 N 0.00 0.25 -0.96 2.33 4.81 -1.48 -3.36 114.58 116.16 3k9s h GLU 55 Ca -0.00 -0.43 0.11 0.00 -0.13 0.00 0.00 59.36 58.91 3k9s h GLU 55 Cb 0.13 0.16 -0.08 0.00 0.63 0.00 0.00 28.75 29.59 3k9s h GLU 55 CO 0.01 1.21 0.59 1.25 -0.73 0.00 0.00 179.01 181.34 3k9s h LEU 56 N -0.31 0.88 0.00 1.64 5.85 -0.93 -1.44 115.31 121.00 3k9s h LEU 56 Ca -0.28 0.04 0.00 0.00 0.84 0.00 0.00 57.88 58.48 3k9s h LEU 56 Cb 1.75 -0.13 0.00 0.00 0.37 0.00 0.00 40.66 42.64 3k9s h LEU 56 CO 0.07 0.48 0.00 2.30 -0.34 0.00 0.00 178.44 180.96 3k9s n ILE 57 N -4.64 0.15 1.24 4.05 -5.35 -0.98 -1.14 119.36 112.71 3k9s n ILE 57 Ca 0.17 0.04 0.13 0.00 -0.27 0.00 0.00 62.75 62.82 3k9s n ILE 57 Cb 0.32 -0.65 0.31 0.00 -1.74 0.00 0.00 39.64 37.88 3k9s n ILE 57 CO 0.00 0.00 0.00 0.35 -1.76 0.00 0.00 176.55 175.14 3k9s n THR 58 N -1.18 0.00 -1.56 7.28 -2.24 -0.54 -4.16 114.28 111.88 3k9s n THR 58 Ca 0.14 -0.26 0.07 0.00 -2.27 0.00 0.00 64.05 61.73 3k9s n THR 58 Cb 0.15 0.77 0.14 0.00 -2.10 0.00 0.00 70.33 69.29 3k9s n THR 58 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 3k9s n LYS 59 N 0.08 1.09 -0.12 -0.78 5.02 -0.29 -4.82 118.16 118.34 3k9s n LYS 59 Ca 0.14 -2.60 0.02 0.00 -2.02 0.00 0.00 58.31 53.85 3k9s n LYS 59 Cb 0.42 -1.24 0.32 0.00 -0.02 0.00 0.00 35.03 34.51 3k9s n LYS 59 CO 0.00 0.00 0.00 -0.07 -0.52 0.00 0.00 177.40 176.81 3k9s h LEU 60 N 0.51 0.69 -2.28 -0.35 3.38 -1.74 -1.01 115.31 114.50 3k9s h LEU 60 Ca -0.03 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.92 3k9s h LEU 60 Cb 1.16 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 41.73 3k9s h LEU 60 CO 0.01 0.50 0.00 -2.24 0.09 0.00 0.00 178.44 176.80 3k9s h ASP 61 N 0.82 0.00 1.01 -0.43 -0.00 -1.93 -2.25 116.42 113.64 3k9s h ASP 61 Ca 0.22 0.00 0.00 0.00 -0.00 0.00 0.00 57.03 57.25 3k9s h ASP 61 Cb -0.09 0.00 0.00 0.00 -0.00 0.00 0.00 39.33 39.24 3k9s h ASP 61 CO -0.05 0.00 -0.54 1.56 -0.00 0.00 0.00 179.24 180.22 3k9s h GLN 62 N 0.00 0.00 -7.25 4.15 4.20 -1.57 -3.47 115.11 111.17 3k9s h GLN 62 Ca 0.00 0.00 -0.50 0.00 0.06 0.00 0.00 58.65 58.21 3k9s h GLN 62 Cb 0.07 0.00 0.09 0.00 0.30 0.00 0.00 27.48 27.94 3k9s h GLN 62 CO 0.00 0.00 0.37 -0.51 -0.67 0.00 0.00 178.83 178.02 3k9s s LEU 63 N -4.44 3.32 0.35 1.46 1.43 -0.85 -4.98 118.68 114.97 3k9s s LEU 63 Ca 0.06 1.81 -0.26 0.00 -1.03 0.00 0.00 54.13 54.72 3k9s s LEU 63 Cb 0.13 -4.53 -0.13 0.00 0.03 0.00 0.00 46.19 41.69 3k9s s LEU 63 CO 0.71 -1.47 0.88 -2.65 0.23 0.00 0.00 176.35 174.05 3k9s n PRO 64 N -2.60 1.11 0.20 1.29 -0.02 -1.26 -4.78 135.00 128.94 3k9s n PRO 64 Ca 0.09 0.39 0.09 0.00 -2.02 0.00 0.00 63.50 62.05 3k9s n PRO 64 Cb 0.53 -1.79 0.62 0.00 -0.02 0.00 0.00 33.50 32.84 3k9s n PRO 64 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3k9s h ALA 65 N 1.54 2.02 -0.00 3.55 0.00 -1.95 0.33 119.26 124.74 3k9s h ALA 65 Ca -0.41 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.50 3k9s h ALA 65 Cb 1.36 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.13 3k9s h ALA 65 CO 0.57 -0.04 -0.03 -0.40 0.00 0.00 0.00 179.25 179.35 3k9s n ASP 66 N -4.52 0.22 -0.00 0.00 3.85 -1.26 -3.04 116.55 111.80 3k9s n ASP 66 Ca -0.01 -0.61 0.06 0.00 -0.71 0.00 0.00 54.79 53.53 3k9s n ASP 66 Cb 0.14 -0.12 -0.09 0.00 -1.35 0.00 0.00 41.12 39.71 3k9s n ASP 66 CO 0.00 0.00 0.00 0.29 -1.01 0.00 0.00 177.20 176.48 3k9s n LYS 67 N -1.02 1.64 -0.17 0.11 4.76 0.06 -4.76 118.16 118.77 3k9s n LYS 67 Ca 0.18 -0.06 -0.09 0.00 -2.87 0.00 0.00 58.31 55.47 3k9s n LYS 67 Cb 0.22 -1.21 -0.03 0.00 -1.84 0.00 0.00 35.03 32.16 3k9s n LYS 67 CO 0.00 0.00 0.00 0.87 -1.37 0.00 0.00 177.40 176.90 3k9s h LYS 68 N 0.00 -0.25 -0.17 1.97 1.79 -1.35 -2.71 116.57 115.84 3k9s h LYS 68 Ca 0.00 0.02 -0.12 0.00 -2.18 0.00 0.00 60.65 58.37 3k9s h LYS 68 Cb 0.45 0.06 0.00 0.00 -1.58 0.00 0.00 32.23 31.16 3k9s h LYS 68 CO 0.00 -0.17 -0.37 1.15 -1.08 0.00 0.00 179.45 178.98 3k9s h THR 69 N -0.26 1.34 -0.37 -0.16 2.02 -1.86 -0.50 112.91 113.13 3k9s h THR 69 Ca 0.17 -1.62 -0.07 0.00 0.77 0.00 0.00 66.41 65.66 3k9s h THR 69 Cb 0.57 1.95 -0.02 0.00 -1.74 0.00 0.00 68.15 68.91 3k9s h THR 69 CO -0.64 0.49 -0.05 1.62 0.37 0.00 0.00 175.52 177.31 3k9s h VAL 70 N 0.20 1.23 0.12 3.16 3.04 -1.86 -0.74 116.25 121.40 3k9s h VAL 70 Ca 0.00 -0.96 -0.29 0.00 -1.01 0.00 0.00 66.70 64.45 3k9s h VAL 70 Cb 0.97 1.01 -0.00 0.00 -2.01 0.00 0.00 31.29 31.26 3k9s h VAL 70 CO 0.08 0.32 -1.36 -0.07 -1.01 0.00 0.00 177.57 175.53 3k9s h LEU 71 N 0.56 0.40 -0.42 3.16 3.38 -1.46 -0.99 115.31 119.94 3k9s h LEU 71 Ca 0.11 -0.48 0.09 0.00 0.09 0.00 0.00 57.88 57.69 3k9s h LEU 71 Cb 0.44 -0.13 -0.08 0.00 0.09 0.00 0.00 40.66 40.98 3k9s h LEU 71 CO 0.02 1.39 -0.13 -0.09 0.09 0.00 0.00 178.44 179.72 3k9s h ARG 72 N 0.07 -0.03 -0.15 1.13 2.43 -0.83 0.22 114.38 117.22 3k9s h ARG 72 Ca -0.18 0.00 -0.05 0.00 -0.81 0.00 0.00 59.98 58.94 3k9s h ARG 72 Cb 1.99 0.01 -0.00 0.00 -0.42 0.00 0.00 29.97 31.54 3k9s h ARG 72 CO 0.18 -0.02 -0.09 -0.91 -1.51 0.00 0.00 179.97 177.63 3k9s h ASN 73 N -0.03 0.35 0.22 -3.80 2.35 -1.11 -1.94 115.58 111.62 3k9s h ASN 73 Ca 0.20 -0.43 -0.35 0.00 -0.55 0.00 0.00 56.30 55.18 3k9s h ASN 73 Cb 0.34 -0.10 -0.02 0.00 0.05 0.00 0.00 38.32 38.59 3k9s h ASN 73 CO -0.45 0.70 -1.91 0.59 -1.65 0.00 0.00 177.43 174.71 3k9s n ASN 74 N -4.61 1.83 0.02 5.81 3.02 -0.38 -1.53 115.26 119.41 3k9s n ASN 74 Ca -0.06 0.27 -0.08 0.00 -0.03 0.00 0.00 54.58 54.68 3k9s n ASN 74 Cb 0.32 -0.68 0.08 0.00 -0.61 0.00 0.00 39.78 38.88 3k9s n ASN 74 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3k9s h ALA 75 N 0.30 0.75 -0.27 5.41 0.00 -0.73 -1.05 119.26 123.68 3k9s h ALA 75 Ca -0.39 -0.51 0.04 0.00 0.00 0.00 0.00 54.91 54.06 3k9s h ALA 75 Cb 2.03 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 19.70 3k9s h ALA 75 CO 0.09 0.69 0.03 0.78 0.00 0.00 0.00 179.25 180.84 3k9s h GLY 76 N 1.13 0.28 1.27 0.00 0.00 -1.21 -0.22 103.07 104.33 3k9s h GLY 76 Ca 0.01 0.00 -0.04 0.00 0.00 0.00 0.00 47.33 47.30 3k9s h GLY 76 CO 0.10 -0.03 0.21 -1.33 0.00 0.00 0.00 176.54 175.48 3k9s h GLY 77 N 0.12 1.00 0.95 4.60 0.00 -1.04 0.26 103.07 108.95 3k9s h GLY 77 Ca 0.13 -0.55 -0.10 0.00 0.00 0.00 0.00 47.33 46.81 3k9s h GLY 77 CO -0.19 0.51 -0.19 0.84 0.00 0.00 0.00 176.54 177.52 3k9s h HIS 78 N 0.90 0.79 0.23 5.60 6.17 -0.82 -2.01 115.15 126.02 3k9s h HIS 78 Ca 0.21 -0.21 -0.00 0.00 0.71 0.00 0.00 60.37 61.07 3k9s h HIS 78 Cb 0.24 -0.18 -0.01 0.00 2.52 0.00 0.00 27.41 29.98 3k9s h HIS 78 CO 0.02 0.92 -0.16 0.00 0.71 0.00 0.00 177.93 179.42 3k9s h ALA 79 N 0.75 -0.37 -0.49 5.26 0.00 -0.69 -2.18 119.26 121.54 3k9s h ALA 79 Ca 0.07 -0.07 -0.03 0.00 0.00 0.00 0.00 54.91 54.88 3k9s h ALA 79 Cb 0.73 0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.70 3k9s h ALA 79 CO 0.05 -0.72 0.18 -0.91 0.00 0.00 0.00 179.25 177.86 3k9s h ASN 80 N -0.39 0.69 0.20 0.00 2.35 -0.89 -2.27 115.58 115.27 3k9s h ASN 80 Ca -0.02 -0.18 -0.18 0.00 -0.55 0.00 0.00 56.30 55.38 3k9s h ASN 80 Cb 0.33 -0.18 -0.01 0.00 0.05 0.00 0.00 38.32 38.52 3k9s h ASN 80 CO 0.01 0.69 -0.68 0.45 -1.65 0.00 0.00 177.43 176.25 3k9s h HIS 81 N 0.66 0.58 -0.55 1.19 3.86 -1.38 0.23 115.15 119.75 3k9s h HIS 81 Ca 0.16 -0.24 0.06 0.00 -1.16 0.00 0.00 60.37 59.19 3k9s h HIS 81 Cb 0.22 -0.10 -0.05 0.00 1.06 0.00 0.00 27.41 28.54 3k9s h HIS 81 CO 0.01 0.98 0.25 0.77 0.86 0.00 0.00 177.93 180.80 3k9s h SER 82 N 0.31 0.33 -0.22 2.45 0.02 -1.25 0.13 113.55 115.32 3k9s h SER 82 Ca -0.02 0.04 -0.03 0.00 -0.84 0.00 0.00 61.79 60.95 3k9s h SER 82 Cb 1.24 -0.01 -0.01 0.00 0.14 0.00 0.00 62.40 63.76 3k9s h SER 82 CO 0.12 0.22 0.03 0.25 -1.14 0.00 0.00 176.83 176.31 3k9s h LEU 83 N 0.48 0.35 -0.40 5.07 6.46 -1.15 -3.18 115.31 122.93 3k9s h LEU 83 Ca 0.25 -0.27 0.07 0.00 -0.12 0.00 0.00 57.88 57.82 3k9s h LEU 83 Cb 0.21 -0.09 -0.07 0.00 -0.73 0.00 0.00 40.66 39.98 3k9s h LEU 83 CO -0.21 0.53 0.00 0.15 -0.62 0.00 0.00 178.44 178.29 3k9s h PHE 84 N 0.16 -0.02 -0.77 1.25 3.57 -0.33 -0.03 116.94 120.77 3k9s h PHE 84 Ca 0.07 0.03 -0.00 0.00 3.53 0.00 0.00 57.97 61.59 3k9s h PHE 84 Cb 0.33 0.07 -0.04 0.00 2.79 0.00 0.00 35.95 39.10 3k9s h PHE 84 CO 0.02 -0.08 0.47 -1.49 -2.23 0.00 0.00 178.31 175.01 3k9s h TRP 85 N 0.11 1.01 0.00 0.41 -0.00 -1.02 -1.59 115.95 114.87 3k9s h TRP 85 Ca 0.20 0.00 0.00 0.00 -0.00 0.00 0.00 58.89 59.09 3k9s h TRP 85 Cb 0.28 -0.33 0.00 0.00 -0.00 0.00 0.00 29.16 29.11 3k9s h TRP 85 CO -0.27 0.67 0.00 0.87 -0.00 0.00 0.00 178.44 179.71 3k9s h LYS 86 N 1.05 0.00 -0.54 0.49 1.57 -1.42 -3.06 116.57 114.66 3k9s h LYS 86 Ca 0.28 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.06 3k9s h LYS 86 Cb -0.05 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.26 3k9s h LYS 86 CO -0.05 0.00 0.00 0.41 -0.57 0.00 0.00 179.45 179.24 3k9s n GLY 87 N 0.58 1.56 3.18 3.86 0.00 -0.07 -4.80 105.19 109.50 3k9s n GLY 87 Ca 0.03 -0.55 -0.28 0.00 0.00 0.00 0.00 46.02 45.21 3k9s n GLY 87 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3k9s s LEU 88 N -1.17 1.96 -0.28 0.99 1.43 -1.14 -1.03 118.68 119.45 3k9s s LEU 88 Ca 0.34 -0.43 -0.23 0.00 -1.03 0.00 0.00 54.13 52.79 3k9s s LEU 88 Cb 0.19 -1.14 0.13 0.00 0.03 0.00 0.00 46.19 45.40 3k9s s LEU 88 CO 0.20 0.17 1.01 -0.75 0.23 0.00 0.00 176.35 177.21 3k9s s LYS 89 N 0.07 0.48 0.51 1.70 2.20 0.27 -4.72 119.74 120.25 3k9s s LYS 89 Ca -0.07 0.63 -0.13 0.00 -0.36 0.00 0.00 55.97 56.05 3k9s s LYS 89 Cb -0.13 0.20 -0.06 0.00 -1.51 0.00 0.00 37.83 36.33 3k9s s LYS 89 CO 0.04 -0.07 0.92 0.15 -0.36 0.00 0.00 175.35 176.03 3k9s s LYS 90 N 0.52 3.79 0.00 4.03 1.02 -1.26 -4.17 119.74 123.67 3k9s s LYS 90 Ca 0.00 0.72 0.00 0.00 0.02 0.00 0.00 55.97 56.71 3k9s s LYS 90 Cb -0.05 -2.21 0.00 0.00 -0.52 0.00 0.00 37.83 35.05 3k9s s LYS 90 CO -0.09 -0.27 0.00 0.41 -0.92 0.00 0.00 175.35 174.49 3k9s n GLY 91 N -1.81 0.47 3.93 -3.33 0.00 -1.26 -5.05 105.19 98.14 3k9s n GLY 91 Ca 0.05 -0.30 -0.25 0.00 0.00 0.00 0.00 46.02 45.52 3k9s n GLY 91 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3k9s s THR 92 N -2.00 5.11 -0.09 2.61 -4.23 -1.26 -5.10 115.64 110.67 3k9s s THR 92 Ca 0.00 -0.36 0.02 0.00 -1.18 0.00 0.00 61.69 60.17 3k9s s THR 92 Cb 0.00 -3.82 0.01 0.00 1.34 0.00 0.00 72.50 70.03 3k9s s THR 92 CO 0.00 -0.46 -0.14 -0.89 -0.54 0.00 0.00 174.62 172.58 3k9s s THR 93 N -2.21 1.39 0.04 3.99 2.01 -1.26 -4.88 115.64 114.72 3k9s s THR 93 Ca 0.40 -0.60 -0.30 0.00 0.31 0.00 0.00 61.69 61.50 3k9s s THR 93 Cb -0.10 -1.27 -0.07 0.00 0.01 0.00 0.00 72.50 71.07 3k9s s THR 93 CO 0.34 0.42 1.58 -0.22 -0.69 0.00 0.00 174.62 176.05 3k9s s LEU 94 N 0.87 4.35 0.33 4.42 2.96 -1.26 -4.81 118.68 125.54 3k9s s LEU 94 Ca -0.10 2.37 -0.18 0.00 -0.22 0.00 0.00 54.13 56.00 3k9s s LEU 94 Cb -0.15 -3.56 0.05 0.00 0.50 0.00 0.00 46.19 43.03 3k9s s LEU 94 CO 0.01 -0.84 0.81 0.00 -1.32 0.00 0.00 176.35 175.00 3k9s s GLN 95 N 2.66 2.01 3.76 1.98 -2.07 -1.26 -4.93 119.66 121.81 3k9s s GLN 95 Ca 0.71 -1.25 0.00 0.00 -1.82 0.00 0.00 55.36 53.00 3k9s s GLN 95 Cb -0.37 0.59 0.00 0.00 -1.09 0.00 0.00 33.01 32.14 3k9s s GLN 95 CO 0.30 -0.94 0.00 0.41 -1.32 0.00 0.00 175.29 173.75 3k9s n GLY 96 N -0.53 0.64 0.20 2.60 0.00 -1.26 -2.84 105.19 103.99 3k9s n GLY 96 Ca -0.07 -0.76 -0.07 0.00 0.00 0.00 0.00 46.02 45.12 3k9s n GLY 96 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3k9s h ASP 97 N 8.72 0.52 -0.84 1.61 3.45 -1.99 -1.63 116.42 126.27 3k9s h ASP 97 Ca 0.00 -0.01 0.06 0.00 0.43 0.00 0.00 57.03 57.51 3k9s h ASP 97 Cb 0.00 -0.13 -0.06 0.00 -0.56 0.00 0.00 39.33 38.58 3k9s h ASP 97 CO 0.00 0.38 0.52 0.25 -1.57 0.00 0.00 179.24 178.81 3k9s h LEU 98 N 0.62 0.81 -0.35 1.55 5.85 -1.93 0.37 115.31 122.23 3k9s h LEU 98 Ca 0.17 0.02 -0.09 0.00 0.84 0.00 0.00 57.88 58.82 3k9s h LEU 98 Cb -0.06 -0.15 -0.01 0.00 0.37 0.00 0.00 40.66 40.81 3k9s h LEU 98 CO -0.05 0.52 -0.12 0.50 -0.34 0.00 0.00 178.44 178.96 3k9s h LYS 99 N 0.95 0.71 -0.39 1.25 3.64 -1.28 -0.85 116.57 120.60 3k9s h LYS 99 Ca 0.36 -0.28 -0.04 0.00 -1.27 0.00 0.00 60.65 59.42 3k9s h LYS 99 Cb 0.16 -0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 31.93 3k9s h LYS 99 CO -0.17 0.88 0.09 0.00 -2.27 0.00 0.00 179.45 177.98 3k9s h ALA 100 N 0.81 1.43 -0.42 5.00 0.00 -0.85 -1.38 119.26 123.85 3k9s h ALA 100 Ca 0.09 -0.16 -0.15 0.00 0.00 0.00 0.00 54.91 54.68 3k9s h ALA 100 Cb 0.64 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.25 3k9s h ALA 100 CO 0.04 0.42 -0.33 0.00 0.00 0.00 0.00 179.25 179.37 3k9s h ALA 101 N 1.54 0.60 -0.21 0.00 0.00 -0.31 -1.40 119.26 119.48 3k9s h ALA 101 Ca 0.13 -0.44 -0.01 0.00 0.00 0.00 0.00 54.91 54.59 3k9s h ALA 101 Cb 0.23 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 3k9s h ALA 101 CO -0.00 0.67 0.09 0.82 0.00 0.00 0.00 179.25 180.83 3k9s h ILE 102 N 0.80 1.15 -0.93 0.00 2.04 -0.64 -0.34 117.51 119.59 3k9s h ILE 102 Ca 0.08 -0.45 -0.01 0.00 1.00 0.00 0.00 64.86 65.48 3k9s h ILE 102 Cb 0.93 1.07 -0.04 0.00 -0.74 0.00 0.00 36.82 38.03 3k9s h ILE 102 CO 0.09 0.15 0.55 -0.33 0.00 0.00 0.00 178.15 178.60 3k9s h GLU 103 N 0.19 1.28 -0.39 2.37 5.08 -1.24 0.20 114.58 122.08 3k9s h GLU 103 Ca 0.07 -0.13 -0.05 0.00 -1.00 0.00 0.00 59.36 58.25 3k9s h GLU 103 Cb 0.15 -0.26 -0.01 0.00 0.50 0.00 0.00 28.75 29.12 3k9s h GLU 103 CO -0.01 0.91 0.04 -0.09 -1.00 0.00 0.00 179.01 178.86 3k9s h ARG 104 N 1.29 0.65 0.00 2.33 2.43 -1.07 0.43 114.38 120.44 3k9s h ARG 104 Ca 0.33 -0.19 -0.14 0.00 -0.81 0.00 0.00 59.98 59.18 3k9s h ARG 104 Cb -0.03 -0.07 -0.02 0.00 -0.42 0.00 0.00 29.97 29.43 3k9s h ARG 104 CO -0.06 0.72 -0.94 -0.44 -1.51 0.00 0.00 179.97 177.74 3k9s h ASP 105 N 0.49 0.00 -0.00 -3.80 3.32 -0.72 -3.36 116.42 112.35 3k9s h ASP 105 Ca 0.11 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.16 3k9s h ASP 105 Cb 0.40 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.95 3k9s h ASP 105 CO 0.01 0.55 -0.05 0.49 -1.72 0.00 0.00 179.24 178.52 3k9s n PHE 106 N -3.07 0.00 0.00 4.55 3.72 0.69 -5.00 117.46 118.35 3k9s n PHE 106 Ca -0.03 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.37 3k9s n PHE 106 Cb 0.79 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.33 3k9s n PHE 106 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3k9s n GLY 107 N 0.75 2.97 3.55 1.37 0.00 0.15 -4.53 105.19 109.46 3k9s n GLY 107 Ca 0.01 -0.29 -0.08 0.00 0.00 0.00 0.00 46.02 45.66 3k9s n GLY 107 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3k9s s SER 108 N 0.61 -0.36 0.25 1.61 1.04 -1.17 -4.72 113.70 110.96 3k9s s SER 108 Ca 0.00 -0.10 0.03 0.00 0.48 0.00 0.00 55.95 56.36 3k9s s SER 108 Cb 0.00 0.45 0.29 0.00 0.10 0.00 0.00 66.02 66.86 3k9s s SER 108 CO 0.00 -0.76 1.60 0.58 0.98 0.00 0.00 173.24 175.64 3k9s h VAL 109 N 2.00 1.34 -0.09 5.02 2.07 -1.91 -2.67 116.25 122.01 3k9s h VAL 109 Ca -0.24 -1.75 -0.14 0.00 0.82 0.00 0.00 66.70 65.39 3k9s h VAL 109 Cb 1.25 1.80 -0.01 0.00 -1.52 0.00 0.00 31.29 32.81 3k9s h VAL 109 CO 0.31 0.53 -0.55 0.44 0.02 0.00 0.00 177.57 178.31 3k9s h ASP 110 N 0.26 0.30 -0.29 0.57 3.32 -1.96 -1.36 116.42 117.26 3k9s h ASP 110 Ca 0.01 -0.16 -0.18 0.00 0.02 0.00 0.00 57.03 56.72 3k9s h ASP 110 Cb 0.98 -0.09 0.00 0.00 0.22 0.00 0.00 39.33 40.45 3k9s h ASP 110 CO 0.08 0.80 -0.53 0.78 -1.72 0.00 0.00 179.24 178.65 3k9s h ASN 111 N 0.21 0.97 -0.09 6.45 2.35 -1.82 -1.41 115.58 122.24 3k9s h ASN 111 Ca 0.00 -0.53 0.03 0.00 -0.55 0.00 0.00 56.30 55.25 3k9s h ASN 111 Cb 1.04 -0.28 -0.03 0.00 0.05 0.00 0.00 38.32 39.11 3k9s h ASN 111 CO 0.09 1.32 -0.07 0.15 -1.65 0.00 0.00 177.43 177.26 3k9s h PHE 112 N 0.66 -0.18 -0.81 1.19 3.57 -1.32 -0.38 116.94 119.68 3k9s h PHE 112 Ca 0.02 0.01 0.02 0.00 3.53 0.00 0.00 57.97 61.55 3k9s h PHE 112 Cb 1.14 0.09 -0.04 0.00 2.79 0.00 0.00 35.95 39.93 3k9s h PHE 112 CO 0.07 -0.11 0.53 0.87 -2.23 0.00 0.00 178.31 177.44 3k9s h LYS 113 N -0.09 1.02 -0.60 1.11 1.57 -1.17 0.50 116.57 118.91 3k9s h LYS 113 Ca 0.06 -0.06 0.02 0.00 -1.87 0.00 0.00 60.65 58.80 3k9s h LYS 113 Cb 0.17 -0.23 -0.04 0.00 0.08 0.00 0.00 32.23 32.22 3k9s h LYS 113 CO -0.14 0.68 0.38 0.00 -0.57 0.00 0.00 179.45 179.79 3k9s h ALA 114 N 1.31 0.78 -0.26 3.86 0.00 -1.03 -0.32 119.26 123.61 3k9s h ALA 114 Ca 0.31 -0.02 -0.16 0.00 0.00 0.00 0.00 54.91 55.03 3k9s h ALA 114 Cb -0.07 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.52 3k9s h ALA 114 CO -0.09 0.13 -0.50 1.49 0.00 0.00 0.00 179.25 180.29 3k9s h GLU 115 N 0.75 0.71 -0.49 0.00 4.81 -0.16 -1.76 114.58 118.44 3k9s h GLU 115 Ca 0.24 -0.42 -0.08 0.00 -0.13 0.00 0.00 59.36 58.97 3k9s h GLU 115 Cb -0.01 0.04 -0.02 0.00 0.63 0.00 0.00 28.75 29.39 3k9s h GLU 115 CO -0.09 1.04 -0.02 0.35 -0.73 0.00 0.00 179.01 179.57 3k9s h PHE 116 N 0.56 0.96 -0.74 0.92 3.57 -0.85 -2.09 116.94 119.27 3k9s h PHE 116 Ca 0.02 -0.17 0.02 0.00 3.53 0.00 0.00 57.97 61.38 3k9s h PHE 116 Cb 1.06 -0.25 -0.04 0.00 2.79 0.00 0.00 35.95 39.51 3k9s h PHE 116 CO 0.05 0.91 0.48 0.93 -2.23 0.00 0.00 178.31 178.45 3k9s h GLU 117 N 0.73 0.92 -0.30 1.11 5.08 -0.90 0.93 114.58 122.15 3k9s h GLU 117 Ca 0.14 -0.06 -0.06 0.00 -1.00 0.00 0.00 59.36 58.38 3k9s h GLU 117 Cb 0.54 -0.21 -0.01 0.00 0.50 0.00 0.00 28.75 29.57 3k9s h GLU 117 CO 0.03 0.61 -0.06 -0.22 -1.00 0.00 0.00 179.01 178.36 3k9s h LYS 118 N 0.94 0.57 -0.68 2.33 3.64 -1.28 -0.65 116.57 121.44 3k9s h LYS 118 Ca 0.29 -0.21 0.01 0.00 -1.27 0.00 0.00 60.65 59.46 3k9s h LYS 118 Cb -0.03 -0.03 -0.03 0.00 -0.41 0.00 0.00 32.23 31.72 3k9s h LYS 118 CO -0.09 0.75 0.45 0.00 -2.27 0.00 0.00 179.45 178.29 3k9s h ALA 119 N 0.79 0.86 -0.70 5.00 0.00 -1.15 -0.37 119.26 123.70 3k9s h ALA 119 Ca 0.08 -0.05 -0.07 0.00 0.00 0.00 0.00 54.91 54.87 3k9s h ALA 119 Cb 0.54 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 18.03 3k9s h ALA 119 CO 0.03 0.29 0.15 0.00 0.00 0.00 0.00 179.25 179.71 3k9s h ALA 120 N 1.25 0.92 -0.26 0.00 0.00 -0.66 -2.87 119.26 117.64 3k9s h ALA 120 Ca 0.25 -0.26 -0.19 0.00 0.00 0.00 0.00 54.91 54.71 3k9s h ALA 120 Cb -0.11 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 17.42 3k9s h ALA 120 CO -0.05 0.67 -0.59 0.00 0.00 0.00 0.00 179.25 179.27 3k9s h ALA 121 N 1.07 0.42 -0.00 0.00 0.00 -0.78 -3.24 119.26 116.72 3k9s h ALA 121 Ca 0.22 -0.53 0.00 0.00 0.00 0.00 0.00 54.91 54.59 3k9s h ALA 121 Cb 0.40 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.13 3k9s h ALA 121 CO 0.01 0.67 -0.07 -1.13 0.00 0.00 0.00 179.25 178.72 3k9s n SER 122 N -4.00 0.30 -4.59 0.00 3.41 -0.18 -4.73 113.62 103.83 3k9s n SER 122 Ca -0.05 -0.47 -0.42 0.00 -0.26 0.00 0.00 58.87 57.67 3k9s n SER 122 Cb 0.65 -0.13 -0.03 0.00 -0.26 0.00 0.00 64.21 64.44 3k9s n SER 122 CO 0.00 0.00 0.00 -0.60 -0.16 0.00 0.00 175.04 174.28 3k9s s ARG 123 N -2.47 3.09 -0.20 4.33 6.06 -1.09 -4.93 118.95 123.73 3k9s s ARG 123 Ca 0.30 1.53 -0.21 0.00 -2.50 0.00 0.00 55.73 54.85 3k9s s ARG 123 Cb 0.20 -4.30 -0.02 0.00 0.06 0.00 0.00 34.95 30.88 3k9s s ARG 123 CO 0.46 -2.14 0.63 0.12 -2.50 0.00 0.00 175.30 171.87 3k9s s PHE 124 N 8.00 3.37 0.00 5.12 5.36 -1.26 -4.80 117.98 133.77 3k9s s PHE 124 Ca 0.86 0.92 0.00 0.00 -0.96 0.00 0.00 56.93 57.75 3k9s s PHE 124 Cb -0.24 -2.80 0.00 0.00 -0.34 0.00 0.00 43.02 39.64 3k9s s PHE 124 CO 0.32 -0.18 0.00 0.41 -1.46 0.00 0.00 175.22 174.31 3k9s n GLY 125 N 3.82 -0.24 3.84 13.12 0.00 -1.26 -4.93 105.19 119.53 3k9s n GLY 125 Ca -0.01 -1.32 -0.35 0.00 0.00 0.00 0.00 46.02 44.33 3k9s n GLY 125 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3k9s s SER 126 N -4.00 6.87 0.00 1.61 0.01 -1.26 -4.79 113.70 112.14 3k9s s SER 126 Ca 0.00 1.15 0.00 0.00 1.31 0.00 0.00 55.95 58.41 3k9s s SER 126 Cb 0.00 -2.32 0.00 0.00 0.21 0.00 0.00 66.02 63.91 3k9s s SER 126 CO 0.00 0.08 0.00 0.61 0.41 0.00 0.00 173.24 174.34 3k9s n GLY 127 N 0.75 -0.87 3.01 3.44 0.00 -1.26 -0.75 105.19 109.51 3k9s n GLY 127 Ca -0.04 -0.93 -0.12 0.00 0.00 0.00 0.00 46.02 44.92 3k9s n GLY 127 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 3k9s s TRP 128 N -3.00 0.48 -0.12 1.61 0.52 -0.73 -1.04 118.94 116.65 3k9s s TRP 128 Ca 0.00 -0.40 -0.02 0.00 0.02 0.00 0.00 56.10 55.70 3k9s s TRP 128 Cb 0.00 -0.30 -0.03 0.00 -1.15 0.00 0.00 33.47 31.99 3k9s s TRP 128 CO 0.00 -0.09 -0.05 0.00 0.02 0.00 0.00 176.95 176.83 3k9s s ALA 129 N -1.08 3.02 0.06 0.98 0.00 -0.52 -1.07 121.76 123.14 3k9s s ALA 129 Ca -0.09 -0.84 0.07 0.00 0.00 0.00 0.00 51.96 51.10 3k9s s ALA 129 Cb -0.08 -1.43 -0.03 0.00 0.00 0.00 0.00 23.12 21.58 3k9s s ALA 129 CO -0.00 0.38 -0.18 -1.58 0.00 0.00 0.00 175.76 174.37 3k9s s TRP 130 N -0.16 1.58 -0.27 0.00 0.52 0.70 -0.56 118.94 120.75 3k9s s TRP 130 Ca 0.03 -0.39 -0.12 0.00 0.02 0.00 0.00 56.10 55.64 3k9s s TRP 130 Cb -0.13 -0.92 -0.05 0.00 -1.15 0.00 0.00 33.47 31.23 3k9s s TRP 130 CO 0.03 0.10 0.22 -1.17 0.02 0.00 0.00 176.95 176.15 3k9s s LEU 131 N -1.41 4.03 0.10 2.99 2.96 -0.43 -2.25 118.68 124.68 3k9s s LEU 131 Ca 0.05 0.06 0.09 0.00 -0.22 0.00 0.00 54.13 54.10 3k9s s LEU 131 Cb -0.09 -2.18 -0.03 0.00 0.50 0.00 0.00 46.19 44.39 3k9s s LEU 131 CO 0.02 -0.06 -0.22 0.68 -1.32 0.00 0.00 176.35 175.45 3k9s s VAL 132 N 1.75 1.78 -0.14 1.68 -7.23 -0.19 0.22 120.40 118.28 3k9s s VAL 132 Ca 0.09 -1.55 -0.01 0.00 -1.81 0.00 0.00 61.98 58.70 3k9s s VAL 132 Cb -0.16 -1.61 -0.02 0.00 0.56 0.00 0.00 36.38 35.16 3k9s s VAL 132 CO 0.10 -0.02 -0.11 -0.22 -0.31 0.00 0.00 175.10 174.54 3k9s s LEU 133 N -1.88 2.80 -0.24 1.32 2.96 0.44 -1.41 118.68 122.67 3k9s s LEU 133 Ca 0.07 -0.31 -0.09 0.00 -0.22 0.00 0.00 54.13 53.59 3k9s s LEU 133 Cb -0.10 -1.64 0.10 0.00 0.50 0.00 0.00 46.19 45.05 3k9s s LEU 133 CO 0.04 0.15 0.52 -0.75 -1.32 0.00 0.00 176.35 175.00 3k9s s LYS 134 N 0.43 0.46 -0.90 1.98 2.20 -0.28 -0.94 119.74 122.68 3k9s s LYS 134 Ca -0.09 1.16 -0.04 0.00 -0.36 0.00 0.00 55.97 56.64 3k9s s LYS 134 Cb -0.16 0.43 0.00 0.00 -1.51 0.00 0.00 37.83 36.60 3k9s s LYS 134 CO 0.05 -0.21 0.78 0.41 -0.36 0.00 0.00 175.35 176.01 3k9s n GLY 135 N 5.12 -0.09 3.09 5.54 0.00 -1.26 -2.76 105.19 114.83 3k9s n GLY 135 Ca -0.13 -0.05 0.00 0.00 0.00 0.00 0.00 46.02 45.84 3k9s n GLY 135 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3k9s n ASP 136 N -1.90 -0.54 -4.11 1.61 10.43 -1.26 -5.00 116.55 115.79 3k9s n ASP 136 Ca -0.06 0.00 -0.19 0.00 2.57 0.00 0.00 54.79 57.11 3k9s n ASP 136 Cb 0.57 -0.68 -0.14 0.00 1.84 0.00 0.00 41.12 42.71 3k9s n ASP 136 CO 0.00 0.00 0.00 -0.54 -1.07 0.00 0.00 177.20 175.59 3k9s s LYS 137 N -0.27 0.87 0.22 -1.24 1.02 -1.11 -5.12 119.74 114.12 3k9s s LYS 137 Ca 0.00 -0.64 -0.20 0.00 0.02 0.00 0.00 55.97 55.15 3k9s s LYS 137 Cb 0.00 -0.85 -0.08 0.00 -0.52 0.00 0.00 37.83 36.38 3k9s s LYS 137 CO 0.00 0.22 0.73 -0.51 -0.92 0.00 0.00 175.35 174.87 3k9s s LEU 138 N -0.90 4.35 0.16 3.17 1.43 -1.26 -1.13 118.68 124.50 3k9s s LEU 138 Ca 0.01 1.44 -0.11 0.00 -1.03 0.00 0.00 54.13 54.44 3k9s s LEU 138 Cb -0.07 -3.60 0.00 0.00 0.03 0.00 0.00 46.19 42.56 3k9s s LEU 138 CO 0.01 0.03 0.32 0.00 0.23 0.00 0.00 176.35 176.94 3k9s s ALA 139 N -1.52 -0.28 -0.10 4.21 0.00 -0.50 -4.94 121.76 118.64 3k9s s ALA 139 Ca 0.43 -0.66 0.03 0.00 0.00 0.00 0.00 51.96 51.76 3k9s s ALA 139 Cb -0.17 0.79 -0.01 0.00 0.00 0.00 0.00 23.12 23.73 3k9s s ALA 139 CO 0.21 -0.66 -0.20 0.08 0.00 0.00 0.00 175.76 175.20 3k9s s VAL 140 N -3.92 2.49 0.16 0.00 1.01 -1.26 -1.02 120.40 117.86 3k9s s VAL 140 Ca 0.13 -0.88 -0.09 0.00 0.00 0.00 0.00 61.98 61.14 3k9s s VAL 140 Cb 0.03 -1.98 -0.01 0.00 0.00 0.00 0.00 36.38 34.42 3k9s s VAL 140 CO -0.03 0.55 0.29 0.54 0.00 0.00 0.00 175.10 176.45 3k9s s VAL 141 N 0.13 0.06 0.14 2.92 0.11 -0.95 -5.00 120.40 117.81 3k9s s VAL 141 Ca -0.10 -1.37 0.06 0.00 -2.93 0.00 0.00 61.98 57.64 3k9s s VAL 141 Cb -0.16 -1.83 -0.04 0.00 -1.53 0.00 0.00 36.38 32.82 3k9s s VAL 141 CO 0.06 -0.29 -0.12 -0.94 -3.33 0.00 0.00 175.10 170.47 3k9s s SER 142 N -2.96 1.97 0.15 3.54 1.04 -1.26 -0.21 113.70 115.97 3k9s s SER 142 Ca 0.17 -0.91 0.04 0.00 0.48 0.00 0.00 55.95 55.73 3k9s s SER 142 Cb 0.03 -0.05 -0.04 0.00 0.10 0.00 0.00 66.02 66.05 3k9s s SER 142 CO -0.00 -0.22 -0.08 0.42 0.98 0.00 0.00 173.24 174.34 3k9s s THR 143 N -2.68 1.08 0.09 2.02 -4.23 -0.23 -4.80 115.64 106.89 3k9s s THR 143 Ca 0.13 -2.04 -0.17 0.00 -1.18 0.00 0.00 61.69 58.43 3k9s s THR 143 Cb -0.02 -1.90 -0.07 0.00 1.34 0.00 0.00 72.50 71.86 3k9s s THR 143 CO 0.03 -0.70 0.55 0.00 -0.54 0.00 0.00 174.62 173.95 3k9s s ALA 144 N -3.39 3.60 0.00 3.99 0.00 -1.26 -1.78 121.76 122.92 3k9s s ALA 144 Ca 0.18 -0.04 0.00 0.00 0.00 0.00 0.00 51.96 52.10 3k9s s ALA 144 Cb 0.03 -2.58 0.00 0.00 0.00 0.00 0.00 23.12 20.58 3k9s s ALA 144 CO 0.01 0.42 0.00 0.09 0.00 0.00 0.00 175.76 176.29 3k9s n ASN 145 N 1.43 0.00 -1.38 0.00 3.02 0.07 -0.71 115.26 117.69 3k9s n ASN 145 Ca -0.09 0.00 0.01 0.00 -0.03 0.00 0.00 54.58 54.47 3k9s n ASN 145 Cb 0.51 0.00 0.27 0.00 -0.61 0.00 0.00 39.78 39.95 3k9s n ASN 145 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3k9s n GLN 146 N 14.00 3.08 -2.27 3.52 1.13 -1.26 -4.16 117.38 131.41 3k9s n GLN 146 Ca 0.00 -3.02 -0.37 0.00 -1.94 0.00 0.00 57.00 51.68 3k9s n GLN 146 Cb 0.00 -1.99 -0.01 0.00 0.11 0.00 0.00 30.24 28.35 3k9s n GLN 146 CO 0.00 0.00 0.00 -0.51 -1.44 0.00 0.00 177.06 175.11 3k9s s ASP 147 N -1.70 6.10 0.12 1.08 1.01 0.12 -4.26 116.67 119.14 3k9s s ASP 147 Ca 0.48 2.26 0.08 0.00 0.71 0.00 0.00 52.55 56.08 3k9s s ASP 147 Cb 0.39 -2.60 -0.04 0.00 1.01 0.00 0.00 42.92 41.69 3k9s s ASP 147 CO 0.09 -0.96 -0.18 -0.55 0.21 0.00 0.00 175.17 173.78 3k9s s SER 148 N -1.46 2.39 0.61 0.27 0.15 -1.26 -4.67 113.70 109.73 3k9s s SER 148 Ca 0.65 -0.75 0.35 0.00 0.70 0.00 0.00 55.95 56.91 3k9s s SER 148 Cb -0.27 -0.12 2.01 0.00 -1.71 0.00 0.00 66.02 65.93 3k9s s SER 148 CO 0.33 -0.02 2.28 -0.65 1.20 0.00 0.00 173.24 176.37 3k9s h PRO 149 N 3.76 0.00 0.00 5.44 0.11 -1.85 0.84 132.00 140.30 3k9s h PRO 149 Ca -0.43 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.68 3k9s h PRO 149 Cb 1.19 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.30 3k9s h PRO 149 CO 0.45 0.01 0.00 -0.07 -0.21 0.00 0.00 178.00 178.18 3k9s h LEU 150 N 0.00 0.00 -0.00 2.35 3.38 -1.88 -0.96 115.31 118.20 3k9s h LEU 150 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3k9s h LEU 150 Cb 0.05 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.80 3k9s h LEU 150 CO 0.00 0.00 0.00 0.23 0.09 0.00 0.00 178.44 178.76 3k9s n MET 151 N -2.55 0.02 0.00 1.13 2.81 0.29 -4.39 117.12 114.42 3k9s n MET 151 Ca -0.00 0.01 0.00 0.00 -1.81 0.00 0.00 57.70 55.90 3k9s n MET 151 Cb 0.14 -1.52 0.00 0.00 -0.71 0.00 0.00 33.22 31.14 3k9s n MET 151 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3k9s n GLY 152 N 1.48 -0.43 0.28 3.03 0.00 -0.36 -4.49 105.19 104.70 3k9s n GLY 152 Ca 0.07 -1.68 -0.10 0.00 0.00 0.00 0.00 46.02 44.31 3k9s n GLY 152 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 3k9s h GLU 153 N 0.00 0.99 -0.68 1.61 4.81 -1.73 -0.54 114.58 119.04 3k9s h GLU 153 Ca 0.00 -0.33 0.15 0.00 -0.13 0.00 0.00 59.36 59.05 3k9s h GLU 153 Cb 0.00 -0.08 -0.11 0.00 0.63 0.00 0.00 28.75 29.19 3k9s h GLU 153 CO 0.00 1.01 0.04 0.00 -0.73 0.00 0.00 179.01 179.33 3k9s h ALA 154 N 0.95 0.73 0.06 2.92 0.00 -1.87 -0.69 119.26 121.37 3k9s h ALA 154 Ca 0.15 0.20 -0.25 0.00 0.00 0.00 0.00 54.91 55.01 3k9s h ALA 154 Cb 0.58 0.33 -0.02 0.00 0.00 0.00 0.00 17.79 18.69 3k9s h ALA 154 CO 0.03 -0.39 -1.34 0.82 0.00 0.00 0.00 179.25 178.38 3k9s h ILE 155 N 0.14 0.98 0.00 0.00 2.04 -1.75 -3.41 117.51 115.51 3k9s h ILE 155 Ca 0.37 -2.30 0.00 0.00 1.00 0.00 0.00 64.86 63.93 3k9s h ILE 155 Cb 0.62 2.54 0.00 0.00 -0.74 0.00 0.00 36.82 39.24 3k9s h ILE 155 CO -0.57 0.58 -1.19 -1.54 0.00 0.00 0.00 178.15 175.43 3k9s n SER 156 N -4.11 0.86 0.00 1.72 3.41 -0.22 -4.96 113.62 110.33 3k9s n SER 156 Ca -0.28 -0.56 0.00 0.00 -0.26 0.00 0.00 58.87 57.77 3k9s n SER 156 Cb 0.81 1.31 0.00 0.00 -0.26 0.00 0.00 64.21 66.06 3k9s n SER 156 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3k9s n GLY 157 N 1.44 1.88 3.35 5.00 0.00 -0.27 -4.65 105.19 111.93 3k9s n GLY 157 Ca 0.01 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.85 3k9s n GLY 157 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3k9s s ALA 158 N -3.16 1.87 0.19 4.61 0.00 -1.26 -4.91 121.76 119.11 3k9s s ALA 158 Ca 0.00 -1.89 -0.23 0.00 0.00 0.00 0.00 51.96 49.84 3k9s s ALA 158 Cb 0.00 0.87 0.05 0.00 0.00 0.00 0.00 23.12 24.04 3k9s s ALA 158 CO 0.00 -0.39 0.76 -1.54 0.00 0.00 0.00 175.76 174.58 3k9s s SER 159 N -3.35 -0.34 0.00 0.00 1.04 -1.26 -2.22 113.70 107.57 3k9s s SER 159 Ca 0.36 -0.33 0.00 0.00 0.48 0.00 0.00 55.95 56.46 3k9s s SER 159 Cb 0.08 0.61 0.00 0.00 0.10 0.00 0.00 66.02 66.80 3k9s s SER 159 CO 0.13 -1.07 0.00 0.61 0.98 0.00 0.00 173.24 173.89 3k9s n GLY 160 N -0.42 1.38 3.59 7.32 0.00 -1.26 -4.88 105.19 110.93 3k9s n GLY 160 Ca -0.08 -2.21 -0.41 0.00 0.00 0.00 0.00 46.02 43.32 3k9s n GLY 160 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 3k9s s PHE 161 N -1.42 3.22 0.19 1.61 5.36 -0.12 -4.15 117.98 122.67 3k9s s PHE 161 Ca 0.00 0.41 -0.31 0.00 -0.96 0.00 0.00 56.93 56.07 3k9s s PHE 161 Cb 0.00 -2.84 -0.09 0.00 -0.34 0.00 0.00 43.02 39.75 3k9s s PHE 161 CO 0.00 -0.42 1.42 -2.14 -1.46 0.00 0.00 175.22 172.62 3k9s s PRO 162 N 2.37 4.30 -0.22 10.12 0.02 -1.26 -0.42 135.00 149.91 3k9s s PRO 162 Ca 0.20 2.19 -0.05 0.00 0.02 0.00 0.00 61.00 63.36 3k9s s PRO 162 Cb -0.15 -3.17 -0.19 0.00 0.02 0.00 0.00 34.50 31.00 3k9s s PRO 162 CO 0.11 -0.42 -0.05 -0.89 -0.33 0.00 0.00 177.00 175.43 3k9s n ILE 163 N 3.12 1.58 -3.54 2.83 2.08 0.13 -4.90 119.36 120.67 3k9s n ILE 163 Ca 0.09 -0.51 -0.11 0.00 0.56 0.00 0.00 62.75 62.78 3k9s n ILE 163 Cb 0.41 -1.64 -0.03 0.00 -0.75 0.00 0.00 39.64 37.62 3k9s n ILE 163 CO 0.00 0.00 0.00 -0.32 0.56 0.00 0.00 176.55 176.79 3k9s s MET 164 N -2.51 1.19 0.10 0.38 -2.45 -1.13 -4.56 119.30 110.33 3k9s s MET 164 Ca -0.32 -0.60 -0.17 0.00 -1.25 0.00 0.00 55.69 53.35 3k9s s MET 164 Cb 0.09 0.53 0.04 0.00 1.25 0.00 0.00 34.83 36.74 3k9s s MET 164 CO 0.63 -0.50 0.41 0.20 1.05 0.00 0.00 175.02 176.81 3k9s s GLY 165 N -2.78 -0.29 -0.11 2.11 0.00 -1.26 -1.32 107.32 103.67 3k9s s GLY 165 Ca 0.02 0.07 0.01 0.00 0.00 0.00 0.00 44.72 44.82 3k9s s GLY 165 CO -0.12 -0.19 -0.13 -2.27 0.00 0.00 0.00 173.10 170.39 3k9s s LEU 166 N -2.59 1.59 -0.10 0.66 2.96 0.28 -4.89 118.68 116.58 3k9s s LEU 166 Ca 0.01 -0.40 -0.29 0.00 -0.22 0.00 0.00 54.13 53.22 3k9s s LEU 166 Cb 0.01 -1.02 -0.04 0.00 0.50 0.00 0.00 46.19 45.64 3k9s s LEU 166 CO -0.10 -0.03 1.54 -0.62 -1.32 0.00 0.00 176.35 175.83 3k9s s ASP 167 N 1.21 6.73 -0.10 3.68 -1.08 -1.26 -1.44 116.67 124.40 3k9s s ASP 167 Ca -0.03 2.03 0.14 0.00 -0.52 0.00 0.00 52.55 54.17 3k9s s ASP 167 Cb -0.14 -2.53 0.41 0.00 -1.46 0.00 0.00 42.92 39.19 3k9s s ASP 167 CO -0.04 -0.90 1.32 1.33 0.52 0.00 0.00 175.17 177.40 3k9s n VAL 168 N 5.52 1.75 -1.68 1.11 0.24 -0.21 -4.84 118.33 120.21 3k9s n VAL 168 Ca 0.16 -1.57 -0.40 0.00 -2.04 0.00 0.00 64.34 60.50 3k9s n VAL 168 Cb 0.44 0.04 0.03 0.00 -1.47 0.00 0.00 33.84 32.87 3k9s n VAL 168 CO 0.00 0.00 0.00 0.79 -2.14 0.00 0.00 176.83 175.48 3k9s n TRP 169 N -0.24 1.81 0.11 6.34 7.02 -1.18 -4.44 117.44 126.85 3k9s n TRP 169 Ca 0.16 0.48 0.04 0.00 -1.02 0.00 0.00 57.50 57.17 3k9s n TRP 169 Cb 0.68 -2.31 0.47 0.00 -2.42 0.00 0.00 31.31 27.73 3k9s n TRP 169 CO 0.00 0.00 0.00 0.93 -2.02 0.00 0.00 177.69 176.60 3k9s h GLU 170 N 1.58 0.29 -0.20 -0.99 5.08 -1.93 -1.52 114.58 116.89 3k9s h GLU 170 Ca -0.48 -0.03 0.06 0.00 -1.00 0.00 0.00 59.36 57.90 3k9s h GLU 170 Cb 1.31 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 30.50 3k9s h GLU 170 CO 0.57 0.27 0.31 1.12 -1.00 0.00 0.00 179.01 180.28 3k9s h HIS 171 N 0.29 0.00 0.00 4.33 2.07 -1.98 0.34 115.15 120.20 3k9s h HIS 171 Ca 0.07 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.59 3k9s h HIS 171 Cb 0.11 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.09 3k9s h HIS 171 CO 0.00 0.00 -0.07 0.00 -3.07 0.00 0.00 177.93 174.79 3k9s n ALA 172 N -2.19 2.39 -0.36 6.11 0.00 -0.57 -4.30 120.51 121.60 3k9s n ALA 172 Ca 0.02 -0.08 0.00 0.00 0.00 0.00 0.00 53.44 53.39 3k9s n ALA 172 Cb 0.43 -1.43 0.00 0.00 0.00 0.00 0.00 19.45 18.44 3k9s n ALA 172 CO 0.00 0.00 0.00 2.48 0.00 0.00 0.00 177.50 179.98 3k9s n TYR 173 N -2.00 0.00 0.04 0.00 0.18 -0.17 -4.93 117.16 110.28 3k9s n TYR 173 Ca 0.06 0.00 -0.04 0.00 1.88 0.00 0.00 57.90 59.80 3k9s n TYR 173 Cb 0.40 0.00 0.18 0.00 -0.38 0.00 0.00 39.34 39.54 3k9s n TYR 173 CO 0.00 0.00 0.00 -0.92 -2.08 0.00 0.00 176.86 173.86 3k9s h TYR 174 N 0.00 0.47 -0.22 -3.48 3.20 -0.61 0.36 116.97 116.68 3k9s h TYR 174 Ca 0.00 -0.12 0.00 0.00 3.14 0.00 0.00 58.73 61.75 3k9s h TYR 174 Cb 0.11 -0.10 -0.01 0.00 1.54 0.00 0.00 36.73 38.26 3k9s h TYR 174 CO 0.00 0.72 0.14 -0.07 -1.64 0.00 0.00 178.16 177.31 3k9s h LEU 175 N 0.34 0.24 0.00 2.82 3.38 -1.86 -0.89 115.31 119.33 3k9s h LEU 175 Ca 0.04 -0.00 -0.29 0.00 0.09 0.00 0.00 57.88 57.71 3k9s h LEU 175 Cb 0.81 -0.06 -0.05 0.00 0.09 0.00 0.00 40.66 41.46 3k9s h LEU 175 CO 0.07 0.17 -1.81 1.17 0.09 0.00 0.00 178.44 178.13 3k9s n LYS 176 N -4.95 0.64 -0.00 1.13 4.81 -1.21 -4.61 118.16 113.97 3k9s n LYS 176 Ca -0.03 0.22 0.04 0.00 -0.87 0.00 0.00 58.31 57.67 3k9s n LYS 176 Cb 0.03 -1.74 -0.04 0.00 0.02 0.00 0.00 35.03 33.30 3k9s n LYS 176 CO 0.00 0.00 0.00 1.19 1.17 0.00 0.00 177.40 179.76 3k9s n PHE 177 N -2.96 0.00 -0.01 5.64 3.01 0.11 -5.08 117.46 118.18 3k9s n PHE 177 Ca -0.19 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.27 3k9s n PHE 177 Cb 1.04 -0.01 0.00 0.00 -0.01 0.00 0.00 39.48 40.50 3k9s n PHE 177 CO 0.00 0.00 0.00 1.04 1.01 0.00 0.00 176.76 178.81 3k9s n GLN 178 N -1.21 0.00 0.00 -1.08 3.00 -0.34 -1.24 117.38 116.51 3k9s n GLN 178 Ca 0.01 0.00 0.07 0.00 -0.01 0.00 0.00 57.00 57.07 3k9s n GLN 178 Cb 0.12 0.00 0.33 0.00 0.00 0.00 0.00 30.24 30.69 3k9s n GLN 178 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.06 177.33 3k9s n ASN 179 N 1.09 0.00 -3.49 1.08 6.94 -1.26 -4.39 115.26 115.23 3k9s n ASN 179 Ca 0.00 0.27 -0.40 0.00 -0.02 0.00 0.00 54.58 54.43 3k9s n ASN 179 Cb 0.00 -0.38 -0.01 0.00 -2.36 0.00 0.00 39.78 37.03 3k9s n ASN 179 CO 0.00 0.00 0.00 0.54 -1.03 0.00 0.00 177.26 176.77 3k9s n ARG 180 N -1.38 3.98 -0.29 -3.83 1.74 -0.37 -4.75 116.66 111.75 3k9s n ARG 180 Ca 0.05 -2.92 0.03 0.00 -0.77 0.00 0.00 57.85 54.25 3k9s n ARG 180 Cb 0.14 -2.79 0.24 0.00 -1.02 0.00 0.00 32.46 29.02 3k9s n ARG 180 CO 0.00 0.00 0.00 -0.09 -1.52 0.00 0.00 177.63 176.02 3k9s h ARG 181 N 5.02 1.01 -0.09 5.56 2.43 -1.83 -1.49 114.38 124.98 3k9s h ARG 181 Ca 0.72 -0.06 -0.02 0.00 -0.81 0.00 0.00 59.98 59.81 3k9s h ARG 181 Cb 0.37 -0.23 -0.01 0.00 -0.42 0.00 0.00 29.97 29.68 3k9s h ARG 181 CO 1.65 0.67 -0.02 -1.35 -1.51 0.00 0.00 179.97 179.41 3k9s h PRO 182 N 1.04 0.13 -0.51 0.20 0.11 -1.96 0.19 132.00 131.19 3k9s h PRO 182 Ca 0.37 -0.02 -0.06 0.00 0.11 0.00 0.00 66.00 66.41 3k9s h PRO 182 Cb 0.15 -0.03 -0.02 0.00 0.11 0.00 0.00 31.00 31.22 3k9s h PRO 182 CO -0.13 0.17 0.07 -0.44 -0.21 0.00 0.00 178.00 177.46 3k9s h ASP 183 N 0.13 0.82 -0.63 -2.05 3.32 -1.68 -1.16 116.42 115.18 3k9s h ASP 183 Ca 0.03 -0.27 -0.04 0.00 0.02 0.00 0.00 57.03 56.78 3k9s h ASP 183 Cb 0.13 -0.22 -0.03 0.00 0.22 0.00 0.00 39.33 39.44 3k9s h ASP 183 CO 0.00 0.88 0.25 0.22 -1.72 0.00 0.00 179.24 178.88 3k9s h TYR 184 N 0.74 0.95 -0.79 4.55 3.20 -0.89 -1.84 116.97 122.89 3k9s h TYR 184 Ca 0.15 -0.07 -0.04 0.00 3.14 0.00 0.00 58.73 61.92 3k9s h TYR 184 Cb 0.41 -0.29 -0.04 0.00 1.54 0.00 0.00 36.73 38.36 3k9s h TYR 184 CO 0.03 0.75 0.35 0.82 -1.64 0.00 0.00 178.16 178.47 3k9s h ILE 185 N 0.88 1.25 -0.24 1.81 2.04 -0.51 -1.85 117.51 120.90 3k9s h ILE 185 Ca 0.21 -0.76 -0.06 0.00 1.00 0.00 0.00 64.86 65.25 3k9s h ILE 185 Cb 0.20 0.29 -0.01 0.00 -0.74 0.00 0.00 36.82 36.56 3k9s h ILE 185 CO -0.02 0.31 -0.13 0.11 0.00 0.00 0.00 178.15 178.43 3k9s h LYS 186 N 1.12 0.39 0.00 2.37 1.79 -0.82 -2.43 116.57 119.00 3k9s h LYS 186 Ca 0.27 -0.10 -0.08 0.00 -2.18 0.00 0.00 60.65 58.55 3k9s h LYS 186 Cb 0.17 -0.05 -0.01 0.00 -1.58 0.00 0.00 32.23 30.76 3k9s h LYS 186 CO -0.03 0.52 -0.38 0.93 -1.08 0.00 0.00 179.45 179.42 3k9s h GLU 187 N 0.36 0.00 -0.95 3.15 4.39 -0.66 -2.72 114.58 118.15 3k9s h GLU 187 Ca 0.07 0.00 0.12 0.00 0.34 0.00 0.00 59.36 59.89 3k9s h GLU 187 Cb 0.45 0.00 -0.08 0.00 -0.10 0.00 0.00 28.75 29.03 3k9s h GLU 187 CO 0.03 0.38 0.61 0.35 -1.16 0.00 0.00 179.01 179.21 3k9s h PHE 188 N 0.00 1.03 -0.21 4.33 3.57 -0.84 -0.54 116.94 124.28 3k9s h PHE 188 Ca -0.00 0.03 0.06 0.00 3.53 0.00 0.00 57.97 61.59 3k9s h PHE 188 Cb 0.76 -0.33 -0.01 0.00 2.79 0.00 0.00 35.95 39.16 3k9s h PHE 188 CO 0.00 0.42 0.24 -1.49 -2.23 0.00 0.00 178.31 175.25 3k9s h TRP 189 N 0.90 0.00 0.00 0.41 -0.00 -1.55 0.10 115.95 115.82 3k9s h TRP 189 Ca 0.47 0.00 0.00 0.00 -0.00 0.00 0.00 58.89 59.36 3k9s h TRP 189 Cb 0.52 0.00 0.00 0.00 -0.00 0.00 0.00 29.16 29.68 3k9s h TRP 189 CO -0.00 0.00 -0.00 -0.91 -0.00 0.00 0.00 178.44 177.53 3k9s h ASN 190 N 0.00 0.00 0.00 -3.49 2.35 -1.25 -3.37 115.58 109.82 3k9s h ASN 190 Ca 0.10 -0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.85 3k9s h ASN 190 Cb 0.58 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.95 3k9s h ASN 190 CO -0.00 0.00 0.00 1.33 -1.65 0.00 0.00 177.43 177.11 3k9s n VAL 191 N -2.30 0.00 -1.96 2.81 0.24 0.14 -4.55 118.33 112.71 3k9s n VAL 191 Ca 0.05 -0.23 -0.42 0.00 -2.04 0.00 0.00 64.34 61.71 3k9s n VAL 191 Cb 0.44 1.34 -0.03 0.00 -1.47 0.00 0.00 33.84 34.12 3k9s n VAL 191 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 3k9s s VAL 192 N -0.17 2.68 -0.80 3.34 0.11 0.01 -0.57 120.40 125.00 3k9s s VAL 192 Ca 0.00 0.49 -0.23 0.00 -2.93 0.00 0.00 61.98 59.31 3k9s s VAL 192 Cb 0.00 -3.32 0.06 0.00 -1.53 0.00 0.00 36.38 31.60 3k9s s VAL 192 CO 0.00 0.04 1.18 0.21 -3.33 0.00 0.00 175.10 173.20 3k9s s ASN 193 N 1.04 6.31 0.49 3.54 3.04 -0.19 -4.53 114.94 124.63 3k9s s ASN 193 Ca 0.68 -1.09 0.27 0.00 0.04 0.00 0.00 52.86 52.76 3k9s s ASN 193 Cb -0.43 -2.49 1.19 0.00 -1.54 0.00 0.00 41.25 37.98 3k9s s ASN 193 CO 0.33 -1.51 1.94 -0.50 -3.04 0.00 0.00 177.10 174.31 3k9s h TRP 194 N 9.63 0.00 -0.27 0.43 4.06 -1.88 -2.12 115.95 125.81 3k9s h TRP 194 Ca -0.12 0.00 -0.06 0.00 2.06 0.00 0.00 58.89 60.77 3k9s h TRP 194 Cb 1.04 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 29.20 3k9s h TRP 194 CO 1.11 0.16 -0.07 -0.44 -3.56 0.00 0.00 178.44 175.64 3k9s h ASP 195 N 0.00 0.52 -0.25 -3.49 3.32 -1.89 0.64 116.42 115.26 3k9s h ASP 195 Ca -0.00 -0.37 -0.13 0.00 0.02 0.00 0.00 57.03 56.55 3k9s h ASP 195 Cb 0.57 -0.14 -0.01 0.00 0.22 0.00 0.00 39.33 39.97 3k9s h ASP 195 CO 0.02 0.76 -0.31 -0.08 -1.72 0.00 0.00 179.24 177.92 3k9s h GLU 196 N 0.26 0.76 -0.50 3.56 4.57 -1.84 -1.29 114.58 120.11 3k9s h GLU 196 Ca 0.07 -0.35 -0.04 0.00 -1.18 0.00 0.00 59.36 57.85 3k9s h GLU 196 Cb 0.54 -0.01 -0.02 0.00 -0.16 0.00 0.00 28.75 29.10 3k9s h GLU 196 CO 0.03 0.97 0.14 0.00 -1.18 0.00 0.00 179.01 178.97 3k9s h ALA 197 N 1.00 0.66 -0.51 2.92 0.00 -1.25 -0.99 119.26 121.08 3k9s h ALA 197 Ca 0.07 -0.20 0.07 0.00 0.00 0.00 0.00 54.91 54.85 3k9s h ALA 197 Cb 0.84 -0.19 -0.06 0.00 0.00 0.00 0.00 17.79 18.38 3k9s h ALA 197 CO 0.07 0.33 0.20 0.00 0.00 0.00 0.00 179.25 179.85 3k9s h ALA 198 N 1.00 0.64 -0.33 0.00 0.00 -0.76 0.25 119.26 120.06 3k9s h ALA 198 Ca 0.16 0.06 -0.01 0.00 0.00 0.00 0.00 54.91 55.12 3k9s h ALA 198 Cb 0.30 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.10 3k9s h ALA 198 CO -0.00 -0.19 0.17 0.00 0.00 0.00 0.00 179.25 179.22 3k9s h ALA 199 N 1.33 0.42 -0.66 0.00 0.00 -0.67 0.13 119.26 119.82 3k9s h ALA 199 Ca 0.25 -0.09 0.05 0.00 0.00 0.00 0.00 54.91 55.12 3k9s h ALA 199 Cb 0.25 -0.13 -0.05 0.00 0.00 0.00 0.00 17.79 17.86 3k9s h ALA 199 CO -0.24 -0.03 0.38 0.00 0.00 0.00 0.00 179.25 179.36 3k9s h ARG 200 N 0.40 0.70 -0.82 0.00 3.08 -1.01 -1.71 114.38 115.01 3k9s h ARG 200 Ca 0.11 -0.04 0.02 0.00 0.07 0.00 0.00 59.98 60.14 3k9s h ARG 200 Cb 0.09 -0.16 -0.04 0.00 0.08 0.00 0.00 29.97 29.94 3k9s h ARG 200 CO -0.02 0.46 0.54 0.35 -1.07 0.00 0.00 179.97 180.24 3k9s h PHE 201 N 0.72 1.02 -0.33 3.04 3.57 0.67 0.35 116.94 125.98 3k9s h PHE 201 Ca 0.28 0.02 -0.06 0.00 3.53 0.00 0.00 57.97 61.75 3k9s h PHE 201 Cb 0.12 -0.34 -0.01 0.00 2.79 0.00 0.00 35.95 38.51 3k9s h PHE 201 CO -0.07 0.62 -0.02 0.00 -2.23 0.00 0.00 178.31 176.61 3k9s h ALA 202 N 1.50 0.45 -0.17 2.41 0.00 -0.54 -3.30 119.26 119.61 3k9s h ALA 202 Ca 0.31 -0.26 -0.16 0.00 0.00 0.00 0.00 54.91 54.80 3k9s h ALA 202 Cb -0.07 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.61 3k9s h ALA 202 CO -0.08 0.23 -0.53 0.00 0.00 0.00 0.00 179.25 178.87 3k9s h ALA 203 N 0.84 0.30 0.00 0.00 0.00 -0.42 -3.46 119.26 116.51 3k9s h ALA 203 Ca 0.09 -0.51 0.00 0.00 0.00 0.00 0.00 54.91 54.49 3k9s h ALA 203 Cb 0.49 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.24 3k9s h ALA 203 CO 0.02 0.50 0.00 1.63 0.00 0.00 0.00 179.25 181.40 3k9s n LYS 204 N -4.14 0.00 0.00 0.00 5.02 0.12 -5.09 118.16 114.06 3k9s n LYS 204 Ca -0.07 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.22 3k9s n LYS 204 Cb 0.61 -2.30 0.00 0.00 -0.02 0.00 0.00 35.03 33.32 3k9s n LYS 204 CO 0.00 0.00 0.00 0.36 -0.52 0.00 0.00 177.40 177.24