#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1huz n LEU 11 N 0.00 1.26 -2.53 1.09 7.94 -1.26 -4.68 117.00 118.82 1huz n LEU 11 Ca 0.00 -0.05 -0.16 0.00 -1.11 0.00 0.00 56.01 54.69 1huz n LEU 11 Cb 0.00 -0.08 0.02 0.00 0.53 0.00 0.00 43.42 43.89 1huz n LEU 11 CO 0.00 0.59 0.05 0.59 -1.11 0.00 0.00 177.39 177.51 1huz n ASN 12 N -2.81 3.14 -0.11 1.96 4.13 -1.26 -4.77 115.26 115.53 1huz n ASN 12 Ca -0.31 -3.13 -0.05 0.00 1.68 0.00 0.00 54.58 52.77 1huz n ASN 12 Cb 0.97 -0.47 0.02 0.00 -1.54 0.00 0.00 39.78 38.76 1huz n ASN 12 CO 0.00 0.00 0.00 1.23 0.28 0.00 0.00 177.26 178.77 1huz h GLY 13 N 2.68 0.36 1.25 7.41 0.00 -1.98 -2.49 103.07 110.31 1huz h GLY 13 Ca 0.11 0.05 0.08 0.00 0.00 0.00 0.00 47.33 47.56 1huz h GLY 13 CO 0.62 -0.09 0.33 -1.33 0.00 0.00 0.00 176.54 176.06 1huz h GLY 14 N 0.09 0.42 1.15 4.60 0.00 -1.99 0.55 103.07 107.90 1huz h GLY 14 Ca 0.18 -0.13 -0.28 0.00 0.00 0.00 0.00 47.33 47.10 1huz h GLY 14 CO -0.31 0.09 -1.17 -2.22 0.00 0.00 0.00 176.54 172.93 1huz h ILE 15 N 0.32 1.31 0.32 2.60 2.04 -1.91 -2.83 117.51 119.37 1huz h ILE 15 Ca 0.22 -2.43 -0.02 0.00 1.00 0.00 0.00 64.86 63.63 1huz h ILE 15 Cb 0.43 2.72 0.00 0.00 -0.74 0.00 0.00 36.82 39.24 1huz h ILE 15 CO -0.05 0.73 -0.15 0.71 0.00 0.00 0.00 178.15 179.39 1huz h THR 16 N 0.20 0.71 -0.87 -0.27 1.35 -0.97 -1.65 112.91 111.41 1huz h THR 16 Ca -0.18 -0.42 0.20 0.00 -0.55 0.00 0.00 66.41 65.47 1huz h THR 16 Cb 1.85 0.93 -0.12 0.00 -1.73 0.00 0.00 68.15 69.08 1huz h THR 16 CO 0.22 0.08 0.37 0.44 -0.25 0.00 0.00 175.52 176.39 1huz h ASP 17 N -0.66 0.33 -0.34 5.36 3.32 -1.03 0.23 116.42 123.62 1huz h ASP 17 Ca -0.04 0.14 -0.01 0.00 0.02 0.00 0.00 57.03 57.14 1huz h ASP 17 Cb 0.46 0.12 -0.02 0.00 0.22 0.00 0.00 39.33 40.12 1huz h ASP 17 CO 0.07 0.03 0.17 -0.03 -1.72 0.00 0.00 179.24 177.76 1huz h MET 18 N 0.42 0.49 -0.10 3.56 4.05 -1.29 -0.35 114.93 121.71 1huz h MET 18 Ca 0.52 -0.07 -0.11 0.00 -0.28 0.00 0.00 59.70 59.77 1huz h MET 18 Cb 0.95 -0.09 -0.01 0.00 -0.80 0.00 0.00 31.60 31.64 1huz h MET 18 CO -0.50 0.45 -0.42 -0.07 0.23 0.00 0.00 176.91 176.60 1huz h LEU 19 N 0.42 0.23 -0.26 3.39 3.38 -0.09 -1.55 115.31 120.84 1huz h LEU 19 Ca 0.12 -0.10 -0.20 0.00 0.09 0.00 0.00 57.88 57.79 1huz h LEU 19 Cb 0.12 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 40.80 1huz h LEU 19 CO -0.02 0.63 -0.67 0.58 0.09 0.00 0.00 178.44 179.06 1huz h VAL 20 N 0.19 1.29 -0.63 1.22 2.07 -0.81 -0.35 116.25 119.22 1huz h VAL 20 Ca 0.02 -1.88 -0.07 0.00 0.82 0.00 0.00 66.70 65.59 1huz h VAL 20 Cb 0.82 1.84 -0.03 0.00 -1.52 0.00 0.00 31.29 32.40 1huz h VAL 20 CO 0.06 0.60 0.12 -0.08 0.02 0.00 0.00 177.57 178.29 1huz h GLU 21 N 0.56 1.04 0.00 1.57 4.81 -0.85 -1.60 114.58 120.11 1huz h GLU 21 Ca -0.02 -0.27 -0.08 0.00 -0.13 0.00 0.00 59.36 58.86 1huz h GLU 21 Cb 1.28 -0.13 -0.01 0.00 0.63 0.00 0.00 28.75 30.52 1huz h GLU 21 CO 0.14 0.96 -0.38 -0.07 -0.73 0.00 0.00 179.01 178.93 1huz h LEU 22 N 0.95 0.00 -0.13 1.64 3.38 -1.19 -2.74 115.31 117.23 1huz h LEU 22 Ca 0.20 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 58.12 1huz h LEU 22 Cb 0.41 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.16 1huz h LEU 22 CO 0.01 0.38 -0.11 0.00 0.09 0.00 0.00 178.44 178.81 1huz h ALA 23 N 1.62 0.19 -0.92 1.53 0.00 -0.39 -2.75 119.26 118.54 1huz h ALA 23 Ca -0.00 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.61 1huz h ALA 23 Cb 0.74 -0.04 -0.05 0.00 0.00 0.00 0.00 17.79 18.45 1huz h ALA 23 CO 0.05 0.04 0.59 -0.91 0.00 0.00 0.00 179.25 179.02 1huz h ASN 24 N -0.07 1.07 -0.02 0.00 2.35 -1.21 -1.82 115.58 115.88 1huz h ASN 24 Ca 0.02 -0.04 -0.04 0.00 -0.55 0.00 0.00 56.30 55.70 1huz h ASN 24 Cb 0.62 -0.27 -0.01 0.00 0.05 0.00 0.00 38.32 38.71 1huz h ASN 24 CO 0.03 0.79 -0.07 0.15 -1.65 0.00 0.00 177.43 176.67 1huz h PHE 25 N 1.25 0.24 0.00 1.19 3.57 -1.43 0.18 116.94 121.95 1huz h PHE 25 Ca 0.33 -0.02 -0.11 0.00 3.53 0.00 0.00 57.97 61.71 1huz h PHE 25 Cb -0.12 -0.07 -0.02 0.00 2.79 0.00 0.00 35.95 38.53 1huz h PHE 25 CO 0.00 0.31 -0.60 0.93 -2.23 0.00 0.00 178.31 176.72 1huz h GLU 26 N 0.23 0.00 0.00 1.11 4.39 -1.05 -1.38 114.58 117.88 1huz h GLU 26 Ca 0.05 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.75 1huz h GLU 26 Cb 0.28 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.93 1huz h GLU 26 CO 0.01 0.46 -0.26 -0.22 -1.16 0.00 0.00 179.01 177.84 1huz h LYS 27 N 0.00 0.00 -0.05 2.33 3.64 -0.92 0.67 116.57 122.24 1huz h LYS 27 Ca -0.02 0.00 -0.10 0.00 -1.27 0.00 0.00 60.65 59.26 1huz h LYS 27 Cb 1.40 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 33.20 1huz h LYS 27 CO 0.06 0.00 -0.42 -0.91 -2.27 0.00 0.00 179.45 175.91 1huz h ASN 28 N -0.86 0.11 0.00 4.20 2.35 -0.79 -3.01 115.58 117.59 1huz h ASN 28 Ca 0.00 -0.05 -0.07 0.00 -0.55 0.00 0.00 56.30 55.64 1huz h ASN 28 Cb 0.26 -0.03 -0.01 0.00 0.05 0.00 0.00 38.32 38.59 1huz h ASN 28 CO 0.00 0.52 -0.87 0.52 -1.65 0.00 0.00 177.43 175.95 1huz n VAL 29 N -4.03 1.21 1.05 2.81 0.31 -0.57 -4.69 118.33 114.43 1huz n VAL 29 Ca -0.02 0.14 0.13 0.00 -0.01 0.00 0.00 64.34 64.58 1huz n VAL 29 Cb 0.46 -1.90 0.39 0.00 -0.91 0.00 0.00 33.84 31.88 1huz n VAL 29 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97 1huz n SER 30 N -3.90 0.40 -2.87 4.52 3.41 -0.93 -4.92 113.62 109.33 1huz n SER 30 Ca -0.13 -0.12 -0.20 0.00 -0.26 0.00 0.00 58.87 58.16 1huz n SER 30 Cb 0.39 0.01 0.01 0.00 -0.26 0.00 0.00 64.21 64.36 1huz n SER 30 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1huz n GLN 31 N -1.40 -3.48 -3.10 4.33 6.02 0.60 -4.92 117.38 115.44 1huz n GLN 31 Ca 0.07 0.78 -0.45 0.00 -0.01 0.00 0.00 57.00 57.39 1huz n GLN 31 Cb 0.33 -5.52 -0.03 0.00 1.02 0.00 0.00 30.24 26.04 1huz n GLN 31 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1huz s ALA 32 N -3.00 3.59 0.27 -1.58 0.00 0.20 -4.92 121.76 116.33 1huz s ALA 32 Ca 0.21 -2.75 -0.03 0.00 0.00 0.00 0.00 51.96 49.38 1huz s ALA 32 Cb -0.10 -3.73 0.37 0.00 0.00 0.00 0.00 23.12 19.66 1huz s ALA 32 CO 0.26 -2.57 1.94 0.97 0.00 0.00 0.00 175.76 176.35 1huz h ILE 33 N 5.54 1.20 -0.32 0.00 6.09 -1.92 -2.35 117.51 125.76 1huz h ILE 33 Ca -0.01 -0.42 -0.12 0.00 -1.37 0.00 0.00 64.86 62.94 1huz h ILE 33 Cb 1.05 -0.13 -0.01 0.00 0.47 0.00 0.00 36.82 38.19 1huz h ILE 33 CO 1.00 0.22 -0.31 0.45 -3.07 0.00 0.00 178.15 176.44 1huz h HIS 34 N 1.23 0.79 -0.19 2.19 3.86 -1.95 -1.13 115.15 119.95 1huz h HIS 34 Ca 0.36 -0.20 -0.07 0.00 -1.16 0.00 0.00 60.37 59.30 1huz h HIS 34 Cb -0.07 -0.18 -0.00 0.00 1.06 0.00 0.00 27.41 28.22 1huz h HIS 34 CO -0.00 0.91 -0.15 0.87 0.86 0.00 0.00 177.93 180.42 1huz h LYS 35 N 0.58 0.44 -0.63 2.45 1.57 -1.92 -1.20 116.57 117.86 1huz h LYS 35 Ca 0.07 -0.22 0.11 0.00 -1.87 0.00 0.00 60.65 58.74 1huz h LYS 35 Cb 0.82 0.00 -0.08 0.00 0.08 0.00 0.00 32.23 33.04 1huz h LYS 35 CO 0.07 0.77 0.18 -0.92 -0.57 0.00 0.00 179.45 178.98 1huz h TYR 36 N 0.11 0.30 -0.03 -1.35 3.20 -1.25 0.01 116.97 117.96 1huz h TYR 36 Ca 0.04 0.03 -0.00 0.00 3.14 0.00 0.00 58.73 61.94 1huz h TYR 36 Cb 0.67 -0.04 -0.00 0.00 1.54 0.00 0.00 36.73 38.91 1huz h TYR 36 CO 0.08 0.02 0.01 -0.91 -1.64 0.00 0.00 178.16 175.71 1huz h ASN 37 N 0.32 0.04 0.30 -2.11 2.35 -1.11 -2.37 115.58 113.00 1huz h ASN 37 Ca 0.33 -0.18 0.00 0.00 -0.55 0.00 0.00 56.30 55.90 1huz h ASN 37 Cb 0.47 -0.01 -0.03 0.00 0.05 0.00 0.00 38.32 38.80 1huz h ASN 37 CO -0.38 0.21 -0.46 0.00 -1.65 0.00 0.00 177.43 175.15 1huz h ALA 38 N 0.83 -0.93 -0.89 -0.83 0.00 -0.28 0.14 119.26 117.31 1huz h ALA 38 Ca 0.01 -0.13 0.19 0.00 0.00 0.00 0.00 54.91 54.98 1huz h ALA 38 Cb 0.18 0.71 -0.07 0.00 0.00 0.00 0.00 17.79 18.61 1huz h ALA 38 CO -0.00 -1.08 0.59 1.88 0.00 0.00 0.00 179.25 180.64 1huz h TYR 39 N -0.81 0.59 -0.06 0.00 0.99 -1.03 0.13 116.97 116.78 1huz h TYR 39 Ca -0.02 0.02 -0.06 0.00 2.00 0.00 0.00 58.73 60.67 1huz h TYR 39 Cb 0.76 -0.18 0.00 0.00 1.00 0.00 0.00 36.73 38.31 1huz h TYR 39 CO -0.31 0.17 -0.20 0.00 -0.00 0.00 0.00 178.16 177.81 1huz h ARG 40 N 0.45 0.24 -0.23 4.88 2.47 -0.85 -1.94 114.38 119.40 1huz h ARG 40 Ca 0.46 -0.18 -0.00 0.00 -1.26 0.00 0.00 59.98 59.00 1huz h ARG 40 Cb 1.08 0.03 -0.01 0.00 -1.65 0.00 0.00 29.97 29.42 1huz h ARG 40 CO -0.18 0.81 0.14 -0.22 0.56 0.00 0.00 179.97 181.07 1huz h LYS 41 N -0.28 0.32 -0.42 0.04 3.64 0.26 -2.05 116.57 118.09 1huz h LYS 41 Ca -0.01 -0.03 0.02 0.00 -1.27 0.00 0.00 60.65 59.36 1huz h LYS 41 Cb 0.83 -0.07 -0.03 0.00 -0.41 0.00 0.00 32.23 32.56 1huz h LYS 41 CO 0.04 0.27 0.25 0.00 -2.27 0.00 0.00 179.45 177.74 1huz h ALA 42 N 1.03 0.53 -0.14 5.00 0.00 -0.86 0.26 119.26 125.08 1huz h ALA 42 Ca 0.08 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.99 1huz h ALA 42 Cb 0.03 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 1huz h ALA 42 CO -0.01 -0.08 0.09 0.00 0.00 0.00 0.00 179.25 179.24 1huz h ALA 43 N 1.18 0.18 -0.92 0.00 0.00 -1.26 0.27 119.26 118.71 1huz h ALA 43 Ca 0.16 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.07 1huz h ALA 43 Cb 0.00 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 17.70 1huz h ALA 43 CO -0.07 -0.34 0.58 1.03 0.00 0.00 0.00 179.25 180.44 1huz h SER 44 N 0.18 1.08 -0.31 0.00 0.87 -1.05 -0.77 113.55 113.55 1huz h SER 44 Ca 0.05 -0.05 -0.10 0.00 -1.23 0.00 0.00 61.79 60.47 1huz h SER 44 Cb -0.01 -0.27 -0.01 0.00 -0.44 0.00 0.00 62.40 61.67 1huz h SER 44 CO -0.02 0.81 -0.18 0.58 -0.53 0.00 0.00 176.83 177.49 1huz h VAL 45 N 1.26 1.29 -0.02 2.23 2.07 -0.13 -3.23 116.25 119.73 1huz h VAL 45 Ca 0.33 -1.31 -0.07 0.00 0.82 0.00 0.00 66.70 66.48 1huz h VAL 45 Cb -0.10 1.48 -0.01 0.00 -1.52 0.00 0.00 31.29 31.14 1huz h VAL 45 CO -0.07 0.42 -0.33 0.40 0.02 0.00 0.00 177.57 178.02 1huz h ILE 46 N 0.42 1.24 0.00 4.57 2.04 0.03 -2.75 117.51 123.06 1huz h ILE 46 Ca 0.06 -1.15 0.00 0.00 1.00 0.00 0.00 64.86 64.78 1huz h ILE 46 Cb 0.72 1.60 0.00 0.00 -0.74 0.00 0.00 36.82 38.40 1huz h ILE 46 CO 0.05 0.33 0.00 0.00 0.00 0.00 0.00 178.15 178.53 1huz h ALA 47 N 1.65 1.00 -0.01 1.87 0.00 -1.17 -2.76 119.26 119.84 1huz h ALA 47 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1huz h ALA 47 Cb 0.59 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.38 1huz h ALA 47 CO 0.04 0.00 -0.67 1.63 0.00 0.00 0.00 179.25 180.25 1huz n LYS 48 N -2.67 0.62 -2.30 0.00 5.02 -1.05 -4.93 118.16 112.83 1huz n LYS 48 Ca 0.03 -0.49 -0.42 0.00 -2.02 0.00 0.00 58.31 55.41 1huz n LYS 48 Cb 0.36 -1.49 -0.03 0.00 -0.02 0.00 0.00 35.03 33.85 1huz n LYS 48 CO 0.00 0.00 0.00 -0.47 -0.52 0.00 0.00 177.40 176.41 1huz s TYR 49 N -2.72 3.35 -2.01 2.13 5.04 -1.04 -4.96 117.35 117.14 1huz s TYR 49 Ca 0.14 1.24 0.30 0.00 -2.44 0.00 0.00 57.07 56.31 1huz s TYR 49 Cb 0.17 -3.52 1.54 0.00 0.35 0.00 0.00 41.96 40.50 1huz s TYR 49 CO 0.70 -1.65 2.03 -0.35 -1.34 0.00 0.00 175.55 174.94 1huz n PRO 50 N 3.22 1.06 -4.34 4.97 -0.04 -1.26 -4.91 135.00 133.70 1huz n PRO 50 Ca 0.08 -0.28 -0.23 0.00 -0.04 0.00 0.00 63.50 63.03 1huz n PRO 50 Cb 0.44 -1.49 -0.08 0.00 -0.04 0.00 0.00 33.50 32.33 1huz n PRO 50 CO 0.00 0.00 0.00 -1.01 -0.04 0.00 0.00 175.50 174.45 1huz s HIS 51 N -2.13 2.58 -0.32 0.54 3.76 -1.26 -5.08 115.29 113.37 1huz s HIS 51 Ca 0.40 -0.27 -0.27 0.00 -0.15 0.00 0.00 55.06 54.78 1huz s HIS 51 Cb 0.21 -1.17 0.01 0.00 1.11 0.00 0.00 32.58 32.74 1huz s HIS 51 CO 0.39 0.63 0.97 0.21 -0.85 0.00 0.00 174.74 176.09 1huz s LYS 52 N -3.64 4.00 0.15 1.40 2.20 -1.26 -4.83 119.74 117.75 1huz s LYS 52 Ca 0.31 0.85 -0.31 0.00 -0.36 0.00 0.00 55.97 56.46 1huz s LYS 52 Cb -0.06 -3.74 -0.10 0.00 -1.51 0.00 0.00 37.83 32.42 1huz s LYS 52 CO 0.19 -0.84 1.57 0.42 -0.36 0.00 0.00 175.35 176.32 1huz s ILE 53 N 3.42 2.73 -0.16 5.43 1.01 -1.26 -4.95 121.20 127.42 1huz s ILE 53 Ca 0.40 0.49 0.02 0.00 0.00 0.00 0.00 60.65 61.56 1huz s ILE 53 Cb -0.13 -3.31 0.00 0.00 0.01 0.00 0.00 42.46 39.04 1huz s ILE 53 CO 0.15 0.03 0.40 0.29 0.00 0.00 0.00 174.94 175.82 1huz n LYS 54 N 4.18 1.43 -3.70 2.79 5.02 -1.26 -5.05 118.16 121.57 1huz n LYS 54 Ca 0.14 -0.42 -0.10 0.00 -2.02 0.00 0.00 58.31 55.91 1huz n LYS 54 Cb 0.39 -0.89 -0.04 0.00 -0.02 0.00 0.00 35.03 34.47 1huz n LYS 54 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 1huz s SER 55 N -0.44 -0.27 0.34 4.39 1.04 -1.26 -5.01 113.70 112.50 1huz s SER 55 Ca 0.01 -0.42 0.19 0.00 0.48 0.00 0.00 55.95 56.22 1huz s SER 55 Cb 0.01 0.55 0.17 0.00 0.10 0.00 0.00 66.02 66.85 1huz s SER 55 CO 0.03 -0.99 1.47 1.23 0.98 0.00 0.00 173.24 175.96 1huz h GLY 56 N 2.24 0.00 1.06 7.32 0.00 -1.84 -3.02 103.07 108.83 1huz h GLY 56 Ca -0.31 0.00 -0.09 0.00 0.00 0.00 0.00 47.33 46.93 1huz h GLY 56 CO 0.40 0.00 0.02 0.00 0.00 0.00 0.00 176.54 176.96 1huz h ALA 57 N 1.74 0.79 -0.03 3.60 0.00 -1.96 0.43 119.26 123.82 1huz h ALA 57 Ca -0.01 -0.30 -0.01 0.00 0.00 0.00 0.00 54.91 54.59 1huz h ALA 57 Cb 1.21 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 18.78 1huz h ALA 57 CO 0.03 0.61 -0.02 1.49 0.00 0.00 0.00 179.25 181.36 1huz h GLU 58 N 0.92 0.08 -0.87 0.00 4.81 -1.96 -3.14 114.58 114.41 1huz h GLU 58 Ca 0.17 -0.04 0.10 0.00 -0.13 0.00 0.00 59.36 59.46 1huz h GLU 58 Cb 0.53 -0.00 -0.06 0.00 0.63 0.00 0.00 28.75 29.85 1huz h GLU 58 CO 0.03 0.50 0.57 0.00 -0.73 0.00 0.00 179.01 179.37 1huz h ALA 59 N 0.58 1.65 0.00 2.92 0.00 -1.45 -1.95 119.26 121.00 1huz h ALA 59 Ca 0.01 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1huz h ALA 59 Cb 0.48 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.07 1huz h ALA 59 CO 0.01 0.17 0.00 -0.22 0.00 0.00 0.00 179.25 179.21 1huz h LYS 60 N 0.86 0.00 0.00 0.00 3.64 -0.86 -1.93 116.57 118.29 1huz h LYS 60 Ca 0.40 0.00 -0.08 0.00 -1.27 0.00 0.00 60.65 59.70 1huz h LYS 60 Cb 0.41 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.21 1huz h LYS 60 CO -0.17 0.00 -0.39 0.87 -2.27 0.00 0.00 179.45 177.49 1huz h LYS 61 N 0.00 0.00 -7.12 1.90 1.57 -1.39 -3.44 116.57 108.09 1huz h LYS 61 Ca 0.00 0.00 -0.51 0.00 -1.87 0.00 0.00 60.65 58.27 1huz h LYS 61 Cb 0.10 0.00 0.09 0.00 0.08 0.00 0.00 32.23 32.51 1huz h LYS 61 CO 0.00 0.39 0.43 -0.51 -0.57 0.00 0.00 179.45 179.19 1huz s LEU 62 N -7.77 3.63 0.18 2.94 1.02 -0.73 -5.00 118.68 112.95 1huz s LEU 62 Ca -0.02 2.20 -0.30 0.00 0.02 0.00 0.00 54.13 56.03 1huz s LEU 62 Cb 0.13 -4.58 -0.08 0.00 0.02 0.00 0.00 46.19 41.69 1huz s LEU 62 CO 0.71 -1.45 1.03 -2.16 0.02 0.00 0.00 176.35 174.50 1huz s PRO 63 N -3.50 4.68 0.00 1.29 0.04 -1.26 -3.27 135.00 132.97 1huz s PRO 63 Ca 0.73 1.61 0.00 0.00 0.04 0.00 0.00 61.00 63.38 1huz s PRO 63 Cb -0.25 -3.30 0.00 0.00 0.04 0.00 0.00 34.50 30.99 1huz s PRO 63 CO 0.32 0.21 0.00 0.41 0.04 0.00 0.00 177.00 177.98 1huz n GLY 64 N 1.91 3.34 3.35 0.56 0.00 -1.26 -4.83 105.19 108.26 1huz n GLY 64 Ca 0.01 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.67 1huz n GLY 64 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1huz s VAL 65 N -2.69 3.84 0.00 1.61 0.11 -1.20 -4.50 120.40 117.56 1huz s VAL 65 Ca 0.00 -0.59 0.00 0.00 -2.93 0.00 0.00 61.98 58.46 1huz s VAL 65 Cb 0.00 -2.91 0.00 0.00 -1.53 0.00 0.00 36.38 31.94 1huz s VAL 65 CO 0.00 0.19 0.00 0.61 -3.33 0.00 0.00 175.10 172.57 1huz n GLY 66 N 4.85 5.14 0.18 6.54 0.00 -1.26 -4.53 105.19 116.11 1huz n GLY 66 Ca -0.16 -1.94 -0.08 0.00 0.00 0.00 0.00 46.02 43.84 1huz n GLY 66 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1huz h THR 67 N 0.00 1.14 -0.24 2.61 1.03 -1.97 -0.83 112.91 114.65 1huz h THR 67 Ca 0.00 -0.34 -0.07 0.00 -0.01 0.00 0.00 66.41 65.99 1huz h THR 67 Cb 0.00 0.66 -0.01 0.00 -1.07 0.00 0.00 68.15 67.73 1huz h THR 67 CO 0.00 0.14 -0.15 0.11 -0.01 0.00 0.00 175.52 175.61 1huz h LYS 68 N 0.50 0.41 0.02 0.00 1.79 -1.99 -0.27 116.57 117.04 1huz h LYS 68 Ca 0.14 -0.12 -0.22 0.00 -2.18 0.00 0.00 60.65 58.27 1huz h LYS 68 Cb 0.03 -0.04 -0.02 0.00 -1.58 0.00 0.00 32.23 30.62 1huz h LYS 68 CO -0.02 0.56 -1.02 0.82 -1.08 0.00 0.00 179.45 178.71 1huz h ILE 69 N 0.38 1.65 -0.23 1.86 2.04 -1.92 -3.04 117.51 118.25 1huz h ILE 69 Ca 0.07 -3.23 -0.15 0.00 1.00 0.00 0.00 64.86 62.55 1huz h ILE 69 Cb 0.50 2.80 0.00 0.00 -0.74 0.00 0.00 36.82 39.38 1huz h ILE 69 CO 0.03 0.93 -0.45 0.00 0.00 0.00 0.00 178.15 178.66 1huz h ALA 70 N 0.94 0.37 -0.33 1.87 0.00 -0.80 -0.50 119.26 120.81 1huz h ALA 70 Ca -0.04 -0.47 0.06 0.00 0.00 0.00 0.00 54.91 54.47 1huz h ALA 70 Cb 1.75 -0.06 -0.06 0.00 0.00 0.00 0.00 17.79 19.42 1huz h ALA 70 CO 0.14 0.50 -0.07 0.93 0.00 0.00 0.00 179.25 180.76 1huz h GLU 71 N 0.43 0.02 -0.47 0.00 5.08 -1.12 0.39 114.58 118.91 1huz h GLU 71 Ca 0.01 -0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.36 1huz h GLU 71 Cb 1.05 -0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.27 1huz h GLU 71 CO 0.10 0.01 0.27 0.87 -1.00 0.00 0.00 179.01 179.26 1huz h LYS 72 N 0.02 0.65 -0.39 2.33 1.57 -1.39 -0.60 116.57 118.76 1huz h LYS 72 Ca 0.16 -0.07 -0.01 0.00 -1.87 0.00 0.00 60.65 58.85 1huz h LYS 72 Cb 0.24 -0.13 -0.02 0.00 0.08 0.00 0.00 32.23 32.40 1huz h LYS 72 CO -0.32 0.50 0.18 0.82 -0.57 0.00 0.00 179.45 180.05 1huz h ILE 73 N 0.62 1.14 0.73 1.86 2.04 -0.51 -0.42 117.51 122.97 1huz h ILE 73 Ca 0.17 -0.40 -0.04 0.00 1.00 0.00 0.00 64.86 65.59 1huz h ILE 73 Cb 0.03 0.65 0.01 0.00 -0.74 0.00 0.00 36.82 36.77 1huz h ILE 73 CO -0.03 0.16 -0.35 0.44 0.00 0.00 0.00 178.15 178.37 1huz h ASP 74 N 0.54 -0.83 -0.91 1.72 3.32 0.74 -1.43 116.42 119.57 1huz h ASP 74 Ca 0.14 0.00 0.13 0.00 0.02 0.00 0.00 57.03 57.32 1huz h ASP 74 Cb 0.07 0.21 -0.07 0.00 0.22 0.00 0.00 39.33 39.76 1huz h ASP 74 CO -0.02 -0.49 0.58 -0.08 -1.72 0.00 0.00 179.24 177.52 1huz h GLU 75 N -1.15 0.76 -0.27 3.56 4.81 -1.00 -1.40 114.58 119.88 1huz h GLU 75 Ca -0.10 -0.05 -0.04 0.00 -0.13 0.00 0.00 59.36 59.05 1huz h GLU 75 Cb 0.77 -0.17 -0.01 0.00 0.63 0.00 0.00 28.75 29.97 1huz h GLU 75 CO 0.16 0.50 0.03 0.35 -0.73 0.00 0.00 179.01 179.32 1huz h PHE 76 N 0.78 0.49 -0.45 0.92 3.57 -0.91 -2.58 116.94 118.76 1huz h PHE 76 Ca 0.45 -0.07 -0.03 0.00 3.53 0.00 0.00 57.97 61.85 1huz h PHE 76 Cb 0.63 -0.13 -0.02 0.00 2.79 0.00 0.00 35.95 39.21 1huz h PHE 76 CO -0.00 0.58 0.17 -0.07 -2.23 0.00 0.00 178.31 176.76 1huz h LEU 77 N 0.26 0.62 -0.75 0.59 -0.00 -0.50 0.10 115.31 115.63 1huz h LEU 77 Ca 0.08 -0.17 -0.11 0.00 -0.00 0.00 0.00 57.88 57.68 1huz h LEU 77 Cb 0.36 -0.16 -0.01 0.00 -0.00 0.00 0.00 40.66 40.85 1huz h LEU 77 CO 0.01 0.62 -0.21 0.00 -0.00 0.00 0.00 178.44 178.86 1huz h ALA 78 N 1.02 0.93 -0.00 1.53 0.00 -1.32 -3.36 119.26 118.06 1huz h ALA 78 Ca 0.15 -0.36 0.00 0.00 0.00 0.00 0.00 54.91 54.70 1huz h ALA 78 Cb 0.20 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.84 1huz h ALA 78 CO -0.01 0.61 -0.15 0.25 0.00 0.00 0.00 179.25 179.96 1huz n THR 79 N -4.12 0.00 -0.97 0.00 -2.24 -0.97 -5.01 114.28 100.97 1huz n THR 79 Ca 0.00 -0.43 0.00 0.00 -2.27 0.00 0.00 64.05 61.36 1huz n THR 79 Cb 0.42 1.05 0.00 0.00 -2.10 0.00 0.00 70.33 69.70 1huz n THR 79 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1huz n GLY 80 N 0.80 0.75 3.16 3.38 0.00 0.35 -4.97 105.19 108.65 1huz n GLY 80 Ca 0.02 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.95 1huz n GLY 80 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1huz n LYS 81 N -2.20 0.87 -4.03 1.61 2.85 -1.22 -5.02 118.16 111.02 1huz n LYS 81 Ca 0.00 -2.09 -0.26 0.00 -1.05 0.00 0.00 58.31 54.92 1huz n LYS 81 Cb 0.02 2.39 -0.17 0.00 -0.65 0.00 0.00 35.03 36.62 1huz n LYS 81 CO 0.00 0.00 0.00 -1.17 -0.05 0.00 0.00 177.40 176.18 1huz s LEU 82 N 0.00 1.22 0.19 -5.58 2.96 -1.26 -3.35 118.68 112.86 1huz s LEU 82 Ca 0.17 -0.27 -0.09 0.00 -0.22 0.00 0.00 54.13 53.72 1huz s LEU 82 Cb -0.03 -0.78 0.10 0.00 0.50 0.00 0.00 46.19 45.98 1huz s LEU 82 CO 0.13 -0.09 1.70 0.03 -1.32 0.00 0.00 176.35 176.79 1huz h ARG 83 N 7.91 1.07 -0.91 1.98 3.08 -1.98 -2.50 114.38 123.03 1huz h ARG 83 Ca -0.30 -0.26 0.12 0.00 0.07 0.00 0.00 59.98 59.61 1huz h ARG 83 Cb 1.14 -0.14 -0.07 0.00 0.08 0.00 0.00 29.97 30.98 1huz h ARG 83 CO 0.41 0.96 0.58 -0.22 -1.07 0.00 0.00 179.97 180.64 1huz h LYS 84 N 1.00 0.80 0.15 0.04 3.64 -1.99 -2.17 116.57 118.05 1huz h LYS 84 Ca 0.21 -0.05 -0.30 0.00 -1.27 0.00 0.00 60.65 59.25 1huz h LYS 84 Cb 0.37 -0.18 0.01 0.00 -0.41 0.00 0.00 32.23 32.02 1huz h LYS 84 CO 0.00 0.53 -1.36 1.25 -2.27 0.00 0.00 179.45 177.61 1huz h LEU 85 N 0.83 0.51 -1.20 5.20 5.85 -1.95 -2.04 115.31 122.51 1huz h LEU 85 Ca 0.44 -0.58 -0.08 0.00 0.84 0.00 0.00 57.88 58.51 1huz h LEU 85 Cb 0.55 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 41.40 1huz h LEU 85 CO -0.21 1.46 -0.39 -0.33 -0.34 0.00 0.00 178.44 178.63 1huz h GLU 86 N 0.09 0.00 0.04 1.25 4.39 -1.24 0.75 114.58 119.85 1huz h GLU 86 Ca -0.18 0.00 -0.22 0.00 0.34 0.00 0.00 59.36 59.29 1huz h GLU 86 Cb 2.03 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 30.66 1huz h GLU 86 CO 0.21 0.39 -1.01 0.87 -1.16 0.00 0.00 179.01 178.31 1huz h LYS 87 N 0.00 0.16 -0.31 2.33 1.57 -1.41 -2.27 116.57 116.64 1huz h LYS 87 Ca -0.00 -0.22 -0.06 0.00 -1.87 0.00 0.00 60.65 58.49 1huz h LYS 87 Cb 0.72 0.08 -0.01 0.00 0.08 0.00 0.00 32.23 33.10 1huz h LYS 87 CO 0.05 1.04 -0.06 0.82 -0.57 0.00 0.00 179.45 180.73 1huz h ILE 88 N 0.07 1.28 0.00 1.86 2.04 -0.81 -1.04 117.51 120.91 1huz h ILE 88 Ca -0.06 -1.07 -0.02 0.00 1.00 0.00 0.00 64.86 64.70 1huz h ILE 88 Cb 1.70 1.35 -0.00 0.00 -0.74 0.00 0.00 36.82 39.13 1huz h ILE 88 CO 0.15 0.35 -0.12 0.03 0.00 0.00 0.00 178.15 178.56 1huz h ARG 89 N 0.36 0.00 0.00 2.37 3.08 -0.87 -2.81 114.38 116.50 1huz h ARG 89 Ca 0.08 0.00 -0.02 0.00 0.07 0.00 0.00 59.98 60.11 1huz h ARG 89 Cb 0.53 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.58 1huz h ARG 89 CO 0.03 0.12 -0.87 1.96 -1.07 0.00 0.00 179.97 180.14 1huz h GLN 90 N 0.00 0.00 -6.22 0.04 4.20 -0.86 -3.46 115.11 108.80 1huz h GLN 90 Ca -0.00 0.00 -0.57 0.00 0.06 0.00 0.00 58.65 58.14 1huz h GLN 90 Cb 0.28 0.00 -0.04 0.00 0.30 0.00 0.00 27.48 28.02 1huz h GLN 90 CO 0.02 0.05 0.95 0.34 -0.67 0.00 0.00 178.83 179.52 1huz s ASP 91 N -5.59 6.80 0.29 1.46 -1.08 -0.44 -4.94 116.67 113.16 1huz s ASP 91 Ca 0.01 1.58 0.01 0.00 -0.52 0.00 0.00 52.55 53.62 1huz s ASP 91 Cb 0.09 -2.54 0.43 0.00 -1.46 0.00 0.00 42.92 39.44 1huz s ASP 91 CO 0.77 -0.90 1.78 0.44 0.52 0.00 0.00 175.17 177.78 1huz h ASP 92 N 8.80 0.60 -0.28 -0.34 5.19 -1.88 -2.18 116.42 126.33 1huz h ASP 92 Ca -0.28 -0.15 -0.03 0.00 -0.62 0.00 0.00 57.03 55.95 1huz h ASP 92 Cb 1.11 -0.16 -0.01 0.00 0.18 0.00 0.00 39.33 40.45 1huz h ASP 92 CO 0.99 0.72 0.05 0.00 -3.12 0.00 0.00 179.24 177.88 1huz h THR 93 N 0.58 1.23 -0.34 0.35 1.03 -1.96 -1.95 112.91 111.86 1huz h THR 93 Ca 0.11 -0.78 0.04 0.00 -0.01 0.00 0.00 66.41 65.78 1huz h THR 93 Cb 0.48 1.21 -0.04 0.00 -1.07 0.00 0.00 68.15 68.73 1huz h THR 93 CO 0.03 0.25 0.09 0.28 -0.01 0.00 0.00 175.52 176.16 1huz h SER 94 N 0.27 0.06 0.11 0.00 0.02 -1.85 0.28 113.55 112.44 1huz h SER 94 Ca 0.08 0.05 -0.12 0.00 -0.84 0.00 0.00 61.79 60.96 1huz h SER 94 Cb 0.33 0.05 -0.01 0.00 0.14 0.00 0.00 62.40 62.91 1huz h SER 94 CO 0.00 0.07 -0.41 0.77 -1.14 0.00 0.00 176.83 176.13 1huz h SER 95 N 0.22 0.41 -0.03 3.07 4.64 -1.35 -1.22 113.55 119.29 1huz h SER 95 Ca 0.16 -0.18 -0.01 0.00 -0.47 0.00 0.00 61.79 61.29 1huz h SER 95 Cb 0.15 -0.12 -0.00 0.00 -0.31 0.00 0.00 62.40 62.13 1huz h SER 95 CO -0.19 0.78 -0.01 0.28 -0.87 0.00 0.00 176.83 176.82 1huz h SER 96 N 0.32 0.07 -0.98 4.97 0.02 -0.77 0.22 113.55 117.40 1huz h SER 96 Ca 0.03 -0.40 0.06 0.00 -0.84 0.00 0.00 61.79 60.64 1huz h SER 96 Cb 0.86 -0.02 -0.07 0.00 0.14 0.00 0.00 62.40 63.32 1huz h SER 96 CO 0.07 0.46 0.63 0.40 -1.14 0.00 0.00 176.83 177.25 1huz h ILE 97 N -0.32 1.09 -0.07 3.27 2.04 -0.43 -1.33 117.51 121.78 1huz h ILE 97 Ca 0.01 -0.40 -0.01 0.00 1.00 0.00 0.00 64.86 65.46 1huz h ILE 97 Cb 0.43 -0.17 -0.00 0.00 -0.74 0.00 0.00 36.82 36.34 1huz h ILE 97 CO 0.00 0.21 -0.00 -1.13 0.00 0.00 0.00 178.15 177.23 1huz h ASN 98 N 1.16 0.12 -0.73 1.72 -0.73 -1.14 -3.05 115.58 112.93 1huz h ASN 98 Ca 0.42 -0.33 -0.06 0.00 1.87 0.00 0.00 56.30 58.21 1huz h ASN 98 Cb 0.15 -0.03 -0.03 0.00 0.27 0.00 0.00 38.32 38.68 1huz h ASN 98 CO -0.17 0.42 0.24 0.15 -0.37 0.00 0.00 177.43 177.69 1huz h PHE 99 N -0.18 1.18 0.00 0.67 3.57 -0.37 -2.72 116.94 119.08 1huz h PHE 99 Ca 0.02 -0.12 -0.03 0.00 3.53 0.00 0.00 57.97 61.37 1huz h PHE 99 Cb 0.36 -0.34 -0.00 0.00 2.79 0.00 0.00 35.95 38.75 1huz h PHE 99 CO 0.04 0.93 -0.13 -0.07 -2.23 0.00 0.00 178.31 176.84 1huz h LEU 100 N 1.08 0.00 -2.00 0.59 3.38 -1.30 -1.01 115.31 116.06 1huz h LEU 100 Ca 0.24 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.21 1huz h LEU 100 Cb 0.30 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.05 1huz h LEU 100 CO -0.01 0.13 0.00 0.74 0.09 0.00 0.00 178.44 179.40 1huz h THR 101 N 0.00 0.00 0.00 0.22 2.02 -1.37 -2.00 112.91 111.78 1huz h THR 101 Ca -0.00 -0.31 0.00 0.00 0.77 0.00 0.00 66.41 66.86 1huz h THR 101 Cb 0.29 1.30 0.00 0.00 -1.74 0.00 0.00 68.15 68.00 1huz h THR 101 CO 0.02 0.00 0.00 0.03 0.37 0.00 0.00 175.52 175.94 1huz h ARG 102 N 0.00 0.00 -6.40 6.66 3.08 -1.25 -3.43 114.38 113.04 1huz h ARG 102 Ca 0.00 0.00 -0.54 0.00 0.07 0.00 0.00 59.98 59.51 1huz h ARG 102 Cb 0.32 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.35 1huz h ARG 102 CO 0.00 0.00 0.39 0.08 -1.07 0.00 0.00 179.97 179.37 1huz s VAL 103 N -3.73 4.84 -0.09 2.04 1.01 -0.75 -4.99 120.40 118.72 1huz s VAL 103 Ca 0.00 2.05 -0.30 0.00 0.00 0.00 0.00 61.98 63.73 1huz s VAL 103 Cb 0.10 -4.31 -0.04 0.00 0.00 0.00 0.00 36.38 32.13 1huz s VAL 103 CO 0.50 0.15 1.44 0.28 0.00 0.00 0.00 175.10 177.47 1huz s THR 104 N 1.09 3.91 0.00 3.92 -1.32 -1.26 -1.73 115.64 120.24 1huz s THR 104 Ca 0.52 1.13 0.00 0.00 -1.21 0.00 0.00 61.69 62.13 1huz s THR 104 Cb -0.21 -3.73 0.00 0.00 -1.51 0.00 0.00 72.50 67.05 1huz s THR 104 CO 0.27 -0.08 0.00 0.61 -2.21 0.00 0.00 174.62 173.21 1huz n GLY 105 N 3.83 0.65 3.66 6.08 0.00 -1.26 -4.06 105.19 114.08 1huz n GLY 105 Ca 0.15 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.78 1huz n GLY 105 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1huz s ILE 106 N -1.06 5.14 0.00 -0.61 1.01 -0.71 -4.83 121.20 120.14 1huz s ILE 106 Ca 0.00 0.84 0.00 0.00 0.00 0.00 0.00 60.65 61.49 1huz s ILE 106 Cb 0.00 -3.79 0.00 0.00 0.01 0.00 0.00 42.46 38.68 1huz s ILE 106 CO 0.00 0.19 0.00 0.61 0.00 0.00 0.00 174.94 175.74 1huz n GLY 107 N 3.99 4.48 0.19 6.18 0.00 -1.26 -4.56 105.19 114.21 1huz n GLY 107 Ca -0.06 -2.17 -0.03 0.00 0.00 0.00 0.00 46.02 43.75 1huz n GLY 107 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1huz h PRO 108 N 0.00 0.11 0.57 1.61 0.11 -1.89 -1.93 132.00 130.59 1huz h PRO 108 Ca 0.00 -0.01 -0.02 0.00 0.11 0.00 0.00 66.00 66.08 1huz h PRO 108 Cb 0.00 -0.02 -0.02 0.00 0.11 0.00 0.00 31.00 31.07 1huz h PRO 108 CO 0.00 0.07 -0.50 0.77 -0.21 0.00 0.00 178.00 178.13 1huz h SER 109 N 0.11 -1.34 -0.60 -2.05 0.02 -1.95 -1.11 113.55 106.63 1huz h SER 109 Ca 0.23 0.10 0.06 0.00 -0.84 0.00 0.00 61.79 61.34 1huz h SER 109 Cb 0.34 0.43 -0.04 0.00 0.14 0.00 0.00 62.40 63.27 1huz h SER 109 CO -0.38 -0.68 0.40 0.00 -1.14 0.00 0.00 176.83 175.02 1huz h ALA 110 N -0.99 1.82 -0.18 3.77 0.00 -1.94 -0.44 119.26 121.30 1huz h ALA 110 Ca -0.07 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 54.78 1huz h ALA 110 Cb 0.89 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.53 1huz h ALA 110 CO -0.02 0.09 -0.04 0.00 0.00 0.00 0.00 179.25 179.28 1huz h ALA 111 N 1.67 0.25 0.00 0.00 0.00 -1.21 -0.71 119.26 119.26 1huz h ALA 111 Ca 0.26 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1huz h ALA 111 Cb 0.28 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.01 1huz h ALA 111 CO -0.08 0.01 0.00 -0.09 0.00 0.00 0.00 179.25 179.09 1huz h ARG 112 N 0.06 0.00 0.16 0.00 2.43 -0.58 -1.78 114.38 114.66 1huz h ARG 112 Ca 0.05 0.00 -0.32 0.00 -0.81 0.00 0.00 59.98 58.89 1huz h ARG 112 Cb 0.48 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.03 1huz h ARG 112 CO 0.02 0.00 -1.64 0.87 -1.51 0.00 0.00 179.97 177.71 1huz h LYS 113 N 0.00 0.33 -0.07 0.20 1.57 -0.87 -2.98 116.57 114.75 1huz h LYS 113 Ca 0.00 -0.56 -0.01 0.00 -1.87 0.00 0.00 60.65 58.21 1huz h LYS 113 Cb 0.45 0.21 -0.00 0.00 0.08 0.00 0.00 32.23 32.96 1huz h LYS 113 CO 0.00 1.27 0.02 -0.07 -0.57 0.00 0.00 179.45 180.10 1huz h LEU 114 N -0.06 0.10 -0.56 2.94 3.38 -0.95 -2.07 115.31 118.09 1huz h LEU 114 Ca -0.34 -0.20 -0.00 0.00 0.09 0.00 0.00 57.88 57.43 1huz h LEU 114 Cb 1.96 -0.03 -0.03 0.00 0.09 0.00 0.00 40.66 42.66 1huz h LEU 114 CO 0.12 0.27 0.34 0.58 0.09 0.00 0.00 178.44 179.84 1huz h VAL 115 N -0.08 1.17 -0.32 1.22 2.07 -0.90 0.23 116.25 119.63 1huz h VAL 115 Ca 0.02 -0.38 0.09 0.00 0.82 0.00 0.00 66.70 67.26 1huz h VAL 115 Cb 0.21 0.41 -0.01 0.00 -1.52 0.00 0.00 31.29 30.38 1huz h VAL 115 CO -0.00 0.17 0.34 0.44 0.02 0.00 0.00 177.57 178.54 1huz h ASP 116 N 0.75 0.00 -0.66 0.57 3.32 -1.32 0.95 116.42 120.04 1huz h ASP 116 Ca 0.20 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.25 1huz h ASP 116 Cb -0.01 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.54 1huz h ASP 116 CO -0.04 0.00 0.00 -0.62 -1.72 0.00 0.00 179.24 176.86 1huz n GLU 117 N -3.78 3.07 -0.60 3.56 1.02 -0.53 -4.97 120.64 118.41 1huz n GLU 117 Ca 0.05 -2.68 0.00 0.00 -0.02 0.00 0.00 57.16 54.51 1huz n GLU 117 Cb 0.49 -1.65 0.00 0.00 -0.02 0.00 0.00 31.44 30.27 1huz n GLU 117 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1huz n GLY 118 N 1.32 0.79 3.66 0.62 0.00 0.33 -5.04 105.19 106.87 1huz n GLY 118 Ca 0.24 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.87 1huz n GLY 118 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1huz s ILE 119 N -3.02 5.13 0.00 -0.61 1.01 -0.04 -4.88 121.20 118.78 1huz s ILE 119 Ca 0.00 0.87 0.00 0.00 0.00 0.00 0.00 60.65 61.52 1huz s ILE 119 Cb 0.00 -3.81 0.00 0.00 0.01 0.00 0.00 42.46 38.66 1huz s ILE 119 CO 0.00 0.18 0.00 0.29 0.00 0.00 0.00 174.94 175.41 1huz n LYS 120 N 4.83 0.18 -2.98 2.79 5.02 -1.26 -2.31 118.16 124.43 1huz n LYS 120 Ca -0.06 0.00 -0.21 0.00 -2.02 0.00 0.00 58.31 56.02 1huz n LYS 120 Cb 0.50 -0.53 0.01 0.00 -0.02 0.00 0.00 35.03 35.00 1huz n LYS 120 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 1huz s THR 121 N -1.06 3.61 0.25 -0.18 2.01 -1.26 -4.76 115.64 114.25 1huz s THR 121 Ca 0.00 -0.66 0.01 0.00 0.31 0.00 0.00 61.69 61.36 1huz s THR 121 Cb 0.00 -3.32 0.01 0.00 0.01 0.00 0.00 72.50 69.21 1huz s THR 121 CO 0.00 -0.20 1.63 0.25 -0.69 0.00 0.00 174.62 175.61 1huz h LEU 122 N 0.42 0.47 -0.48 4.42 5.85 -2.00 -2.37 115.31 121.63 1huz h LEU 122 Ca -0.45 -0.20 -0.15 0.00 0.84 0.00 0.00 57.88 57.91 1huz h LEU 122 Cb 1.27 -0.13 -0.01 0.00 0.37 0.00 0.00 40.66 42.16 1huz h LEU 122 CO 0.54 0.83 -0.42 -0.08 -0.34 0.00 0.00 178.44 178.97 1huz h GLU 123 N 0.37 0.79 -0.55 1.25 4.81 -1.99 -2.11 114.58 117.15 1huz h GLU 123 Ca 0.03 -0.43 -0.04 0.00 -0.13 0.00 0.00 59.36 58.79 1huz h GLU 123 Cb 0.88 0.02 -0.02 0.00 0.63 0.00 0.00 28.75 30.25 1huz h GLU 123 CO 0.07 1.06 0.18 -0.44 -0.73 0.00 0.00 179.01 179.15 1huz h ASP 124 N 0.64 0.80 -0.97 1.04 3.32 -1.92 -2.25 116.42 117.08 1huz h ASP 124 Ca 0.05 -0.20 0.08 0.00 0.02 0.00 0.00 57.03 56.98 1huz h ASP 124 Cb 0.99 -0.21 -0.07 0.00 0.22 0.00 0.00 39.33 40.26 1huz h ASP 124 CO 0.09 0.79 0.63 0.25 -1.72 0.00 0.00 179.24 179.28 1huz h LEU 125 N 0.77 0.96 -0.40 1.55 5.85 -1.25 0.09 115.31 122.87 1huz h LEU 125 Ca 0.18 0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.92 1huz h LEU 125 Cb 0.27 -0.18 0.00 0.00 0.37 0.00 0.00 40.66 41.12 1huz h LEU 125 CO -0.01 0.58 0.00 0.54 -0.34 0.00 0.00 178.44 179.21 1huz n ARG 126 N -4.53 0.13 -0.15 1.25 1.74 -0.81 -1.22 116.66 113.07 1huz n ARG 126 Ca 0.16 0.33 0.10 0.00 -0.77 0.00 0.00 57.85 57.68 1huz n ARG 126 Cb 0.25 -1.74 0.18 0.00 -1.02 0.00 0.00 32.46 30.13 1huz n ARG 126 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 1huz n LYS 127 N -1.98 2.27 -1.81 5.56 5.02 -0.04 -4.52 118.16 122.65 1huz n LYS 127 Ca 0.03 -2.09 0.02 0.00 -2.02 0.00 0.00 58.31 54.25 1huz n LYS 127 Cb 0.23 -1.44 0.02 0.00 -0.02 0.00 0.00 35.03 33.83 1huz n LYS 127 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1huz n ASN 128 N 1.24 0.92 0.24 4.39 4.13 -0.35 -4.88 115.26 120.94 1huz n ASN 128 Ca 0.16 -2.01 0.12 0.00 1.68 0.00 0.00 54.58 54.53 1huz n ASN 128 Cb 0.54 -0.27 0.62 0.00 -1.54 0.00 0.00 39.78 39.13 1huz n ASN 128 CO 0.00 0.00 0.00 -0.33 0.28 0.00 0.00 177.26 177.21 1huz h GLU 129 N 1.31 0.00 0.00 3.52 5.08 -1.72 0.22 114.58 122.99 1huz h GLU 129 Ca -0.24 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.12 1huz h GLU 129 Cb 1.70 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.95 1huz h GLU 129 CO 0.08 0.00 0.00 -0.40 -1.00 0.00 0.00 179.01 177.69 1huz n ASP 130 N -2.46 0.34 0.02 1.42 5.68 -1.26 -1.40 116.55 118.89 1huz n ASP 130 Ca -0.02 0.60 0.10 0.00 -0.50 0.00 0.00 54.79 54.97 1huz n ASP 130 Cb 0.28 -0.66 -0.12 0.00 -1.14 0.00 0.00 41.12 39.48 1huz n ASP 130 CO 0.00 0.00 0.00 0.29 -1.33 0.00 0.00 177.20 176.16 1huz n LYS 131 N -1.89 0.65 -3.25 0.11 4.76 0.79 -4.94 118.16 114.39 1huz n LYS 131 Ca 0.02 -0.09 -0.39 0.00 -2.87 0.00 0.00 58.31 54.98 1huz n LYS 131 Cb 0.17 -1.61 -0.06 0.00 -1.84 0.00 0.00 35.03 31.69 1huz n LYS 131 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 1huz s LEU 132 N -4.82 4.49 0.91 -0.35 1.43 -0.49 -5.08 118.68 114.77 1huz s LEU 132 Ca -0.06 1.24 -0.14 0.00 -1.03 0.00 0.00 54.13 54.14 1huz s LEU 132 Cb 0.12 -2.91 0.17 0.00 0.03 0.00 0.00 46.19 43.60 1huz s LEU 132 CO 0.87 0.22 1.26 0.54 0.23 0.00 0.00 176.35 179.47 1huz s ASN 133 N -0.82 3.53 0.16 2.29 2.20 -1.26 -4.76 114.94 116.29 1huz s ASN 133 Ca 0.30 0.33 -0.15 0.00 -0.94 0.00 0.00 52.86 52.39 1huz s ASN 133 Cb -0.19 -0.50 0.06 0.00 -2.00 0.00 0.00 41.25 38.62 1huz s ASN 133 CO 0.19 -2.47 1.78 -0.74 -2.94 0.00 0.00 177.10 172.91 1huz h HIS 134 N -1.41 0.36 -0.36 1.54 -0.00 -1.95 -0.99 115.15 112.33 1huz h HIS 134 Ca -0.44 0.02 0.05 0.00 -0.00 0.00 0.00 60.37 60.00 1huz h HIS 134 Cb 1.26 -0.10 -0.05 0.00 -0.00 0.00 0.00 27.41 28.52 1huz h HIS 134 CO -0.75 0.18 0.07 1.25 -0.00 0.00 0.00 177.93 178.68 1huz h HIS 135 N 0.39 0.11 -0.21 5.26 -0.00 -1.89 -1.67 115.15 117.15 1huz h HIS 135 Ca 0.17 0.02 -0.10 0.00 -0.00 0.00 0.00 60.37 60.47 1huz h HIS 135 Cb 0.09 0.00 -0.01 0.00 -0.00 0.00 0.00 27.41 27.49 1huz h HIS 135 CO -0.10 0.01 -0.29 1.96 -0.00 0.00 0.00 177.93 179.51 1huz h GLN 136 N 0.19 0.41 -0.27 5.26 4.20 -1.62 0.77 115.11 124.06 1huz h GLN 136 Ca 0.17 -0.16 -0.04 0.00 0.06 0.00 0.00 58.65 58.68 1huz h GLN 136 Cb 0.20 -0.02 -0.01 0.00 0.30 0.00 0.00 27.48 27.95 1huz h GLN 136 CO -0.23 0.66 0.01 0.00 -0.67 0.00 0.00 178.83 178.61 1huz h ARG 137 N 0.36 0.46 -0.43 1.46 2.47 -0.70 0.70 114.38 118.71 1huz h ARG 137 Ca 0.05 -0.14 -0.06 0.00 -1.26 0.00 0.00 59.98 58.57 1huz h ARG 137 Cb 0.69 -0.04 -0.02 0.00 -1.65 0.00 0.00 29.97 28.95 1huz h ARG 137 CO 0.05 0.61 0.02 0.82 0.56 0.00 0.00 179.97 182.04 1huz h ILE 138 N 0.25 1.26 0.00 2.04 2.04 -1.17 0.33 117.51 122.26 1huz h ILE 138 Ca 0.08 -0.98 -0.03 0.00 1.00 0.00 0.00 64.86 64.92 1huz h ILE 138 Cb 0.40 1.06 -0.00 0.00 -0.74 0.00 0.00 36.82 37.53 1huz h ILE 138 CO 0.01 0.34 -0.15 1.23 0.00 0.00 0.00 178.15 179.58 1huz h GLY 139 N 0.58 0.00 0.98 5.37 0.00 -0.73 -0.86 103.07 108.40 1huz h GLY 139 Ca 0.12 0.00 -0.20 0.00 0.00 0.00 0.00 47.33 47.26 1huz h GLY 139 CO 0.02 0.00 -0.74 -2.00 0.00 0.00 0.00 176.54 173.81 1huz h LEU 140 N 0.00 0.71 -0.10 3.11 5.85 -0.45 -2.45 115.31 121.99 1huz h LEU 140 Ca -0.00 -0.72 0.04 0.00 0.84 0.00 0.00 57.88 58.04 1huz h LEU 140 Cb 0.27 -0.22 -0.05 0.00 0.37 0.00 0.00 40.66 41.03 1huz h LEU 140 CO 0.02 1.33 -0.23 0.50 -0.34 0.00 0.00 178.44 179.72 1huz h LYS 141 N 0.16 -0.30 -0.83 1.25 3.64 0.95 -2.88 116.57 118.56 1huz h LYS 141 Ca -0.08 0.02 -0.52 0.00 -1.27 0.00 0.00 60.65 58.80 1huz h LYS 141 Cb 1.42 0.07 -0.28 0.00 -0.41 0.00 0.00 32.23 33.02 1huz h LYS 141 CO 0.15 -0.20 0.37 0.66 -2.27 0.00 0.00 179.45 178.16 1huz n TYR 142 N -5.36 2.70 -0.12 1.91 4.02 -0.48 -4.76 117.16 115.07 1huz n TYR 142 Ca -0.03 -2.33 -0.06 0.00 -0.01 0.00 0.00 57.90 55.47 1huz n TYR 142 Cb 0.27 -0.97 0.01 0.00 -0.02 0.00 0.00 39.34 38.63 1huz n TYR 142 CO 0.00 0.00 0.00 0.35 -1.01 0.00 0.00 176.86 176.20 1huz h PHE 143 N 1.58 -0.56 -0.59 -0.72 3.57 -1.21 0.14 116.94 119.15 1huz h PHE 143 Ca 0.50 0.05 -0.04 0.00 3.53 0.00 0.00 57.97 62.01 1huz h PHE 143 Cb 1.62 0.31 -0.03 0.00 2.79 0.00 0.00 35.95 40.64 1huz h PHE 143 CO 1.31 -0.30 0.20 0.93 -2.23 0.00 0.00 178.31 178.23 1huz h GLU 144 N -0.15 0.91 -0.26 1.11 3.07 -1.86 -2.78 114.58 114.62 1huz h GLU 144 Ca 0.19 -0.18 -0.14 0.00 -0.50 0.00 0.00 59.36 58.73 1huz h GLU 144 Cb 0.45 -0.14 -0.01 0.00 -0.84 0.00 0.00 28.75 28.21 1huz h GLU 144 CO -0.49 0.80 -0.42 -0.44 -1.40 0.00 0.00 179.01 177.06 1huz h ASP 145 N 0.83 0.69 0.48 1.42 5.19 -1.78 -2.56 116.42 120.69 1huz h ASP 145 Ca 0.19 -0.32 0.00 0.00 -0.62 0.00 0.00 57.03 56.28 1huz h ASP 145 Cb 0.25 -0.19 0.00 0.00 0.18 0.00 0.00 39.33 39.57 1huz h ASP 145 CO -0.01 1.02 0.00 -0.26 -3.12 0.00 0.00 179.24 176.87 1huz h PHE 146 N 0.52 0.00 0.21 4.55 -1.00 -0.46 -2.00 116.94 118.76 1huz h PHE 146 Ca 0.04 0.00 -0.32 0.00 2.81 0.00 0.00 57.97 60.50 1huz h PHE 146 Cb 0.95 0.00 0.03 0.00 3.61 0.00 0.00 35.95 40.54 1huz h PHE 146 CO 0.04 0.00 -1.44 0.93 -1.61 0.00 0.00 178.31 176.23 1huz h GLU 147 N 0.00 0.45 -6.83 1.51 4.39 -1.21 -3.46 114.58 109.43 1huz h GLU 147 Ca 0.00 -0.77 -0.53 0.00 0.34 0.00 0.00 59.36 58.40 1huz h GLU 147 Cb 0.24 0.29 0.09 0.00 -0.10 0.00 0.00 28.75 29.26 1huz h GLU 147 CO 0.00 1.36 0.86 0.15 -1.16 0.00 0.00 179.01 180.22 1huz s LYS 148 N -2.62 4.13 0.30 2.33 1.02 -0.75 -5.01 119.74 119.14 1huz s LYS 148 Ca -0.08 2.56 -0.12 0.00 0.02 0.00 0.00 55.97 58.35 1huz s LYS 148 Cb 0.05 -3.01 -0.08 0.00 -0.52 0.00 0.00 37.83 34.27 1huz s LYS 148 CO 0.92 -0.60 0.67 1.03 -0.92 0.00 0.00 175.35 176.46 1huz s ARG 149 N -0.85 3.89 -0.28 1.68 0.52 -1.26 -4.96 118.95 117.69 1huz s ARG 149 Ca 0.61 0.48 -0.18 0.00 -0.52 0.00 0.00 55.73 56.12 1huz s ARG 149 Cb -0.47 -2.50 -0.02 0.00 0.52 0.00 0.00 34.95 32.47 1huz s ARG 149 CO 0.51 0.18 0.51 0.42 0.02 0.00 0.00 175.30 176.94 1huz s ILE 150 N -2.00 5.06 0.52 1.52 1.01 0.15 -4.90 121.20 122.56 1huz s ILE 150 Ca 0.51 0.78 -0.21 0.00 0.00 0.00 0.00 60.65 61.73 1huz s ILE 150 Cb -0.11 -3.85 -0.06 0.00 0.01 0.00 0.00 42.46 38.46 1huz s ILE 150 CO 0.21 0.03 1.22 -2.84 0.00 0.00 0.00 174.94 173.57 1huz s PRO 151 N 2.33 3.38 0.58 2.79 0.02 -1.26 -0.44 135.00 142.39 1huz s PRO 151 Ca 0.21 1.89 0.28 0.00 0.02 0.00 0.00 61.00 63.40 1huz s PRO 151 Cb -0.16 -2.22 1.62 0.00 0.02 0.00 0.00 34.50 33.76 1huz s PRO 151 CO 0.10 -0.90 2.08 -0.09 -0.33 0.00 0.00 177.00 177.86 1huz h ARG 152 N 1.54 0.00 -0.18 5.54 2.43 -0.68 -0.21 114.38 122.83 1huz h ARG 152 Ca -0.50 0.00 -0.19 0.00 -0.81 0.00 0.00 59.98 58.48 1huz h ARG 152 Cb 1.27 0.00 0.01 0.00 -0.42 0.00 0.00 29.97 30.83 1huz h ARG 152 CO 0.58 0.00 -0.63 0.93 -1.51 0.00 0.00 179.97 179.34 1huz h GLU 153 N 0.00 0.74 -0.26 0.20 5.08 -1.90 -1.45 114.58 116.98 1huz h GLU 153 Ca 0.10 -0.56 -0.04 0.00 -1.00 0.00 0.00 59.36 57.86 1huz h GLU 153 Cb 0.56 0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.90 1huz h GLU 153 CO -0.00 1.18 -0.03 0.93 -1.00 0.00 0.00 179.01 180.08 1huz h GLU 154 N 0.45 0.41 -0.43 2.33 5.08 -1.44 -3.05 114.58 117.93 1huz h GLU 154 Ca -0.03 -0.08 -0.13 0.00 -1.00 0.00 0.00 59.36 58.12 1huz h GLU 154 Cb 1.26 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 30.44 1huz h GLU 154 CO 0.13 0.46 -0.22 0.52 -1.00 0.00 0.00 179.01 178.91 1huz h MET 155 N 0.39 0.91 -0.06 2.33 2.86 -0.92 -2.48 114.93 117.97 1huz h MET 155 Ca 0.08 -0.40 -0.09 0.00 -2.06 0.00 0.00 59.70 57.23 1huz h MET 155 Cb 0.31 -0.02 -0.01 0.00 0.06 0.00 0.00 31.60 31.94 1huz h MET 155 CO 0.01 1.06 -0.38 -0.07 1.06 0.00 0.00 176.91 178.59 1huz h LEU 156 N 0.74 0.13 -0.23 1.22 3.38 -1.20 -0.56 115.31 118.78 1huz h LEU 156 Ca 0.10 -0.05 -0.12 0.00 0.09 0.00 0.00 57.88 57.90 1huz h LEU 156 Cb 0.79 -0.04 -0.00 0.00 0.09 0.00 0.00 40.66 41.50 1huz h LEU 156 CO 0.07 0.50 -0.31 1.56 0.09 0.00 0.00 178.44 180.35 1huz h GLN 157 N 0.11 0.62 -0.22 1.13 4.20 -1.44 -2.54 115.11 116.97 1huz h GLN 157 Ca 0.01 -0.36 -0.07 0.00 0.06 0.00 0.00 58.65 58.29 1huz h GLN 157 Cb 0.73 0.03 -0.01 0.00 0.30 0.00 0.00 27.48 28.52 1huz h GLN 157 CO 0.05 0.97 -0.18 0.52 -0.67 0.00 0.00 178.83 179.52 1huz h MET 158 N 0.32 0.38 -0.41 1.46 2.86 -1.21 -2.42 114.93 115.92 1huz h MET 158 Ca 0.03 -0.11 -0.10 0.00 -2.06 0.00 0.00 59.70 57.45 1huz h MET 158 Cb 0.89 -0.04 -0.01 0.00 0.06 0.00 0.00 31.60 32.50 1huz h MET 158 CO 0.07 0.55 -0.16 0.37 1.06 0.00 0.00 176.91 178.81 1huz h GLN 159 N 0.35 0.82 -0.61 1.72 4.15 -0.97 -1.97 115.11 118.61 1huz h GLN 159 Ca 0.06 -0.34 -0.02 0.00 0.77 0.00 0.00 58.65 59.12 1huz h GLN 159 Cb 0.52 -0.03 -0.03 0.00 0.21 0.00 0.00 27.48 28.15 1huz h GLN 159 CO 0.03 0.97 0.32 -0.44 -1.93 0.00 0.00 178.83 177.78 1huz h ASP 160 N 0.64 0.78 -0.80 -0.69 3.32 -1.18 -0.27 116.42 118.22 1huz h ASP 160 Ca 0.10 -0.11 -0.00 0.00 0.02 0.00 0.00 57.03 57.04 1huz h ASP 160 Cb 0.70 -0.20 -0.04 0.00 0.22 0.00 0.00 39.33 40.01 1huz h ASP 160 CO 0.05 0.66 0.50 0.40 -1.72 0.00 0.00 179.24 179.13 1huz h ILE 161 N 0.83 1.22 0.19 0.35 2.04 -1.26 -0.32 117.51 120.56 1huz h ILE 161 Ca 0.21 -0.46 -0.01 0.00 1.00 0.00 0.00 64.86 65.61 1huz h ILE 161 Cb 0.07 0.07 0.00 0.00 -0.74 0.00 0.00 36.82 36.23 1huz h ILE 161 CO -0.03 0.22 -0.09 0.58 0.00 0.00 0.00 178.15 178.83 1huz h VAL 162 N 1.10 0.74 -0.52 1.67 2.07 -0.68 -2.70 116.25 117.94 1huz h VAL 162 Ca 0.29 -1.04 0.04 0.00 0.82 0.00 0.00 66.70 66.82 1huz h VAL 162 Cb -0.07 1.24 -0.04 0.00 -1.52 0.00 0.00 31.29 30.90 1huz h VAL 162 CO -0.06 0.19 0.27 -0.07 0.02 0.00 0.00 177.57 177.92 1huz h LEU 163 N -0.88 0.40 0.05 2.57 3.38 -1.02 -0.30 115.31 119.51 1huz h LEU 163 Ca -0.03 0.02 -0.00 0.00 0.09 0.00 0.00 57.88 57.97 1huz h LEU 163 Cb 0.51 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.21 1huz h LEU 163 CO 0.04 0.27 -0.02 0.78 0.09 0.00 0.00 178.44 179.61 1huz h ASN 164 N 0.53 -0.05 -0.72 -0.43 4.21 -1.16 -2.59 115.58 115.37 1huz h ASN 164 Ca 0.22 -0.06 -0.07 0.00 1.21 0.00 0.00 56.30 57.61 1huz h ASN 164 Cb 0.12 0.01 -0.03 0.00 -1.12 0.00 0.00 38.32 37.30 1huz h ASN 164 CO -0.15 0.02 0.19 -0.33 -1.29 0.00 0.00 177.43 175.88 1huz h GLU 165 N -0.12 1.14 -0.86 0.81 4.39 -1.36 -2.65 114.58 115.92 1huz h GLU 165 Ca -0.01 -0.26 0.10 0.00 0.34 0.00 0.00 59.36 59.53 1huz h GLU 165 Cb 0.11 -0.15 -0.08 0.00 -0.10 0.00 0.00 28.75 28.53 1huz h GLU 165 CO 0.01 0.99 0.51 0.28 -1.16 0.00 0.00 179.01 179.64 1huz h VAL 166 N 1.08 0.91 0.07 3.13 2.07 -0.90 -2.31 116.25 120.29 1huz h VAL 166 Ca 0.23 -0.29 -0.28 0.00 0.82 0.00 0.00 66.70 67.17 1huz h VAL 166 Cb 0.35 0.00 0.03 0.00 -1.52 0.00 0.00 31.29 30.15 1huz h VAL 166 CO -0.00 0.15 -1.16 0.07 0.02 0.00 0.00 177.57 176.66 1huz h LYS 167 N 0.84 0.65 -1.01 1.57 2.10 -1.37 -2.84 116.57 116.51 1huz h LYS 167 Ca 0.42 -0.79 0.25 0.00 -2.00 0.00 0.00 60.65 58.53 1huz h LYS 167 Cb 0.38 0.25 -0.12 0.00 -0.90 0.00 0.00 32.23 31.84 1huz h LYS 167 CO -0.25 1.35 0.61 0.87 -2.00 0.00 0.00 179.45 180.03 1huz h LYS 168 N 0.33 0.53 0.21 0.07 1.57 -1.06 0.06 116.57 118.26 1huz h LYS 168 Ca -0.16 -0.03 -0.01 0.00 -1.87 0.00 0.00 60.65 58.58 1huz h LYS 168 Cb 1.82 -0.12 0.00 0.00 0.08 0.00 0.00 32.23 34.01 1huz h LYS 168 CO 0.22 0.35 -0.10 1.25 -0.57 0.00 0.00 179.45 180.60 1huz h LEU 169 N 0.54 -0.24 -6.35 2.94 5.85 -1.47 -3.45 115.31 113.14 1huz h LEU 169 Ca 0.64 -0.29 -0.04 0.00 0.84 0.00 0.00 57.88 59.03 1huz h LEU 169 Cb 1.29 0.06 -0.26 0.00 0.37 0.00 0.00 40.66 42.13 1huz h LEU 169 CO -0.45 0.28 -0.38 -0.62 -0.34 0.00 0.00 178.44 176.93 1huz s ASP 170 N -5.36 -0.48 0.27 1.25 -1.08 -0.07 -5.03 116.67 106.17 1huz s ASP 170 Ca -0.12 0.59 0.18 0.00 -0.52 0.00 0.00 52.55 52.67 1huz s ASP 170 Cb 0.01 1.59 0.98 0.00 -1.46 0.00 0.00 42.92 44.03 1huz s ASP 170 CO 0.46 -0.28 1.54 -2.65 0.52 0.00 0.00 175.17 174.77 1huz n PRO 171 N 5.40 0.12 -0.00 4.34 -0.02 -0.73 -1.59 135.00 142.51 1huz n PRO 171 Ca -0.03 0.61 0.15 0.00 -2.02 0.00 0.00 63.50 62.21 1huz n PRO 171 Cb 0.50 -1.90 0.85 0.00 -0.02 0.00 0.00 33.50 32.94 1huz n PRO 171 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 1huz n GLU 172 N -2.13 1.02 -3.09 -0.52 -0.58 -1.26 -4.80 120.64 109.28 1huz n GLU 172 Ca -0.01 -0.04 -0.39 0.00 -0.42 0.00 0.00 57.16 56.30 1huz n GLU 172 Cb 0.04 -1.46 -0.05 0.00 -0.57 0.00 0.00 31.44 29.41 1huz n GLU 172 CO 0.00 0.00 0.00 0.71 -0.48 0.00 0.00 177.13 177.36 1huz s TYR 173 N -2.00 3.61 -0.22 -0.32 4.12 -0.62 -4.27 117.35 117.64 1huz s TYR 173 Ca 0.43 1.24 0.02 0.00 0.02 0.00 0.00 57.07 58.78 1huz s TYR 173 Cb 0.20 -2.75 0.04 0.00 -1.52 0.00 0.00 41.96 37.93 1huz s TYR 173 CO 0.34 0.16 -0.15 0.42 0.02 0.00 0.00 175.55 176.33 1huz s ILE 174 N 0.52 2.12 -0.14 2.71 1.01 -0.51 -4.72 121.20 122.19 1huz s ILE 174 Ca 0.36 -1.32 -0.01 0.00 0.00 0.00 0.00 60.65 59.68 1huz s ILE 174 Cb -0.18 -2.09 -0.02 0.00 0.01 0.00 0.00 42.46 40.19 1huz s ILE 174 CO 0.18 0.23 -0.10 0.00 0.00 0.00 0.00 174.94 175.25 1huz s ALA 175 N 1.19 2.73 -0.11 9.38 0.00 -1.26 -1.63 121.76 132.07 1huz s ALA 175 Ca -0.03 -0.87 -0.00 0.00 0.00 0.00 0.00 51.96 51.06 1huz s ALA 175 Cb -0.17 -1.31 0.02 0.00 0.00 0.00 0.00 23.12 21.67 1huz s ALA 175 CO -0.09 0.25 -0.07 0.99 0.00 0.00 0.00 175.76 176.84 1huz s THR 176 N 0.33 0.98 -0.40 0.00 2.01 0.06 -4.93 115.64 113.69 1huz s THR 176 Ca -0.09 -0.27 -0.26 0.00 0.31 0.00 0.00 61.69 61.38 1huz s THR 176 Cb -0.15 -1.00 0.02 0.00 0.01 0.00 0.00 72.50 71.37 1huz s THR 176 CO 0.05 0.36 0.94 0.54 -0.69 0.00 0.00 174.62 175.81 1huz s VAL 177 N 1.62 4.53 0.00 3.82 0.11 -1.26 0.16 120.40 129.38 1huz s VAL 177 Ca 0.03 1.06 0.00 0.00 -2.93 0.00 0.00 61.98 60.14 1huz s VAL 177 Cb -0.13 -4.38 0.00 0.00 -1.53 0.00 0.00 36.38 30.34 1huz s VAL 177 CO -0.07 -0.65 0.00 0.00 -3.33 0.00 0.00 175.10 171.05 1huz n GLY 179 N 5.00 1.22 0.02 0.00 0.00 0.12 -2.24 105.19 109.30 1huz n GLY 179 Ca 0.00 -0.71 0.15 0.00 0.00 0.00 0.00 46.02 45.46 1huz n GLY 179 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1huz n SER 180 N 1.03 0.07 -0.01 1.61 3.41 -1.26 -3.74 113.62 114.73 1huz n SER 180 Ca 0.00 -0.33 -0.09 0.00 -0.26 0.00 0.00 58.87 58.19 1huz n SER 180 Cb 0.00 -0.21 -0.07 0.00 -0.26 0.00 0.00 64.21 63.66 1huz n SER 180 CO 0.00 0.00 0.00 0.15 -0.16 0.00 0.00 175.04 175.03 1huz h PHE 181 N 0.08 -0.10 0.00 7.33 3.57 -1.75 -2.61 116.94 123.46 1huz h PHE 181 Ca 0.00 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.50 1huz h PHE 181 Cb 0.25 0.03 0.00 0.00 2.79 0.00 0.00 35.95 39.02 1huz h PHE 181 CO 0.00 0.39 0.00 -2.13 -2.23 0.00 0.00 178.31 174.34 1huz n ARG 182 N -4.80 0.02 -0.05 1.11 0.63 -1.17 -1.06 116.66 111.34 1huz n ARG 182 Ca -0.06 0.42 0.12 0.00 -0.92 0.00 0.00 57.85 57.41 1huz n ARG 182 Cb 0.26 -1.56 0.26 0.00 0.45 0.00 0.00 32.46 31.87 1huz n ARG 182 CO 0.00 0.00 0.00 0.54 -2.51 0.00 0.00 177.63 175.66 1huz n ARG 183 N -1.61 2.12 -2.06 -0.14 1.74 -1.20 -4.42 116.66 111.09 1huz n ARG 183 Ca 0.01 -1.65 -0.03 0.00 -0.77 0.00 0.00 57.85 55.41 1huz n ARG 183 Cb 0.08 -1.47 0.01 0.00 -1.02 0.00 0.00 32.46 30.06 1huz n ARG 183 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1huz n GLY 184 N 1.31 -0.08 3.45 -0.13 0.00 -0.22 -3.58 105.19 105.94 1huz n GLY 184 Ca 0.17 0.01 -0.28 0.00 0.00 0.00 0.00 46.02 45.92 1huz n GLY 184 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1huz s ALA 185 N -3.08 2.59 -0.48 4.61 0.00 -0.99 -5.02 121.76 119.39 1huz s ALA 185 Ca 0.10 -1.47 0.24 0.00 0.00 0.00 0.00 51.96 50.82 1huz s ALA 185 Cb -0.01 -0.50 0.39 0.00 0.00 0.00 0.00 23.12 23.00 1huz s ALA 185 CO 0.25 0.52 1.56 0.93 0.00 0.00 0.00 175.76 179.02 1huz h GLU 186 N 3.55 0.00 -2.67 0.00 3.07 -1.95 -3.44 114.58 113.14 1huz h GLU 186 Ca -0.49 0.00 -0.10 0.00 -0.50 0.00 0.00 59.36 58.27 1huz h GLU 186 Cb 1.18 0.00 -0.21 0.00 -0.84 0.00 0.00 28.75 28.88 1huz h GLU 186 CO 0.45 0.00 -0.14 -1.54 -1.40 0.00 0.00 179.01 176.39 1huz s SER 187 N -5.68 -0.39 0.11 1.42 1.04 -1.26 0.05 113.70 108.98 1huz s SER 187 Ca 0.07 0.50 0.04 0.00 0.48 0.00 0.00 55.95 57.05 1huz s SER 187 Cb 0.07 0.57 -0.04 0.00 0.10 0.00 0.00 66.02 66.73 1huz s SER 187 CO 0.67 -0.39 -0.11 -0.94 0.98 0.00 0.00 173.24 173.45 1huz s SER 188 N -0.79 1.65 0.21 7.02 1.04 0.41 -4.90 113.70 118.35 1huz s SER 188 Ca -0.09 -0.84 0.01 0.00 0.48 0.00 0.00 55.95 55.52 1huz s SER 188 Cb -0.03 -0.02 0.17 0.00 0.10 0.00 0.00 66.02 66.24 1huz s SER 188 CO 0.04 -0.24 1.52 1.23 0.98 0.00 0.00 173.24 176.77 1huz h GLY 189 N 3.44 0.39 -0.92 7.32 0.00 -1.93 0.43 103.07 111.80 1huz h GLY 189 Ca -0.38 -0.49 -0.01 0.00 0.00 0.00 0.00 47.33 46.45 1huz h GLY 189 CO 0.54 0.44 0.27 2.09 0.00 0.00 0.00 176.54 179.88 1huz n ASP 190 N -3.89 -2.03 -4.42 0.19 5.75 -1.26 -4.67 116.55 106.22 1huz n ASP 190 Ca -0.03 -2.38 -0.36 0.00 -0.01 0.00 0.00 54.79 52.01 1huz n ASP 190 Cb 0.63 3.37 -0.13 0.00 -1.03 0.00 0.00 41.12 43.97 1huz n ASP 190 CO 0.00 0.00 0.00 -0.32 -0.11 0.00 0.00 177.20 176.77 1huz s MET 191 N -2.08 3.60 -0.26 0.11 -2.45 -0.82 -4.87 119.30 112.54 1huz s MET 191 Ca 0.15 -0.50 -0.04 0.00 -1.25 0.00 0.00 55.69 54.04 1huz s MET 191 Cb -0.04 -3.26 0.01 0.00 1.25 0.00 0.00 34.83 32.79 1huz s MET 191 CO 0.10 -0.18 -0.00 -0.51 1.05 0.00 0.00 175.02 175.48 1huz s ASP 192 N 1.57 4.62 -0.20 1.11 -0.00 -1.26 -0.62 116.67 121.90 1huz s ASP 192 Ca 0.06 -0.64 0.01 0.00 -0.00 0.00 0.00 52.55 51.98 1huz s ASP 192 Cb -0.15 -1.77 0.04 0.00 -0.00 0.00 0.00 42.92 41.04 1huz s ASP 192 CO 0.02 -0.11 -0.12 0.54 -0.00 0.00 0.00 175.17 175.50 1huz s VAL 193 N 1.44 1.76 0.10 -1.27 0.11 -0.12 0.21 120.40 122.63 1huz s VAL 193 Ca 0.03 -1.04 -0.30 0.00 -2.93 0.00 0.00 61.98 57.74 1huz s VAL 193 Cb -0.16 -1.78 -0.06 0.00 -1.53 0.00 0.00 36.38 32.85 1huz s VAL 193 CO -0.01 0.22 1.05 -0.22 -3.33 0.00 0.00 175.10 172.81 1huz s LEU 194 N 1.35 4.45 -0.01 2.54 2.96 0.12 -1.74 118.68 128.36 1huz s LEU 194 Ca -0.01 1.90 0.06 0.00 -0.22 0.00 0.00 54.13 55.86 1huz s LEU 194 Cb -0.16 -3.59 -0.02 0.00 0.50 0.00 0.00 46.19 42.93 1huz s LEU 194 CO -0.09 -0.22 -0.20 -0.22 -1.32 0.00 0.00 176.35 174.31 1huz s LEU 195 N 0.26 2.05 0.02 -0.68 2.96 0.12 -0.76 118.68 122.65 1huz s LEU 195 Ca 0.51 -0.37 -0.05 0.00 -0.22 0.00 0.00 54.13 53.99 1huz s LEU 195 Cb -0.26 -1.01 -0.01 0.00 0.50 0.00 0.00 46.19 45.41 1huz s LEU 195 CO 0.31 0.24 0.08 0.28 -1.32 0.00 0.00 176.35 175.94 1huz s THR 196 N -0.49 0.11 -0.23 3.68 -1.32 -0.64 -1.55 115.64 115.20 1huz s THR 196 Ca 0.08 -0.92 -0.17 0.00 -1.21 0.00 0.00 61.69 59.46 1huz s THR 196 Cb -0.08 -0.61 0.07 0.00 -1.51 0.00 0.00 72.50 70.37 1huz s THR 196 CO -0.01 -0.51 0.59 -2.28 -2.21 0.00 0.00 174.62 170.21 1huz s HIS 197 N -1.94 -0.78 0.57 9.09 2.46 -1.26 -1.42 115.29 122.01 1huz s HIS 197 Ca -0.11 1.71 0.30 0.00 0.47 0.00 0.00 55.06 57.44 1huz s HIS 197 Cb -0.05 0.36 1.66 0.00 -0.13 0.00 0.00 32.58 34.42 1huz s HIS 197 CO -0.02 -0.39 1.92 -1.00 -2.47 0.00 0.00 174.74 172.79 1huz h PRO 198 N 6.15 0.00 -0.01 2.88 0.13 -1.99 -1.29 132.00 137.87 1huz h PRO 198 Ca -0.30 0.00 -0.13 0.00 -0.87 0.00 0.00 66.00 64.69 1huz h PRO 198 Cb 1.19 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.30 1huz h PRO 198 CO 0.17 0.00 -0.62 -0.91 -0.23 0.00 0.00 178.00 176.41 1huz h ASN 199 N 0.00 0.04 -3.60 1.44 2.35 -1.96 -3.41 115.58 110.44 1huz h ASN 199 Ca 0.00 -0.02 -0.63 0.00 -0.55 0.00 0.00 56.30 55.10 1huz h ASN 199 Cb 0.53 -0.01 -0.14 0.00 0.05 0.00 0.00 38.32 38.75 1huz h ASN 199 CO 0.00 0.65 -0.03 0.12 -1.65 0.00 0.00 177.43 176.52 1huz s PHE 200 N -3.63 3.23 0.07 1.19 5.99 -0.49 -4.94 117.98 119.40 1huz s PHE 200 Ca -0.02 0.49 -0.11 0.00 0.00 0.00 0.00 56.93 57.29 1huz s PHE 200 Cb 0.13 -2.79 0.01 0.00 0.00 0.00 0.00 43.02 40.37 1huz s PHE 200 CO 0.77 -0.37 0.24 0.99 -0.00 0.00 0.00 175.22 176.86 1huz s THR 201 N 2.34 0.11 0.33 0.12 2.01 -1.26 -1.87 115.64 117.42 1huz s THR 201 Ca 0.20 -0.91 0.01 0.00 0.31 0.00 0.00 61.69 61.31 1huz s THR 201 Cb -0.15 -1.11 0.27 0.00 0.01 0.00 0.00 72.50 71.52 1huz s THR 201 CO 0.11 -0.50 1.97 0.77 -0.69 0.00 0.00 174.62 176.28 1huz h SER 202 N 3.00 0.81 -0.33 3.53 4.64 -1.95 -2.36 113.55 120.88 1huz h SER 202 Ca -0.33 -0.01 -0.05 0.00 -0.47 0.00 0.00 61.79 60.93 1huz h SER 202 Cb 1.20 -0.19 -0.03 0.00 -0.31 0.00 0.00 62.40 63.07 1huz h SER 202 CO 0.51 0.56 0.06 -1.84 -0.87 0.00 0.00 176.83 175.25 1huz n GLU 203 N -4.45 2.73 -4.20 4.77 -0.00 -1.26 -4.90 120.64 113.33 1huz n GLU 203 Ca 0.09 -1.59 -0.24 0.00 -0.00 0.00 0.00 57.16 55.42 1huz n GLU 203 Cb 0.10 -1.84 -0.07 0.00 -0.00 0.00 0.00 31.44 29.63 1huz n GLU 203 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.13 175.59 1huz s SER 204 N -0.35 4.41 -0.42 -1.84 1.04 -0.89 -5.02 113.70 110.63 1huz s SER 204 Ca 0.28 -0.95 -0.06 0.00 0.48 0.00 0.00 55.95 55.70 1huz s SER 204 Cb 0.22 -0.58 -0.12 0.00 0.10 0.00 0.00 66.02 65.64 1huz s SER 204 CO 0.08 -0.35 3.21 -1.54 0.98 0.00 0.00 173.24 175.61 1huz n SER 205 N -1.10 6.22 -0.70 7.02 3.41 -1.26 -4.89 113.62 122.31 1huz n SER 205 Ca -0.03 -2.76 0.00 0.00 -0.26 0.00 0.00 58.87 55.83 1huz n SER 205 Cb 0.63 -1.38 -0.00 0.00 -0.26 0.00 0.00 64.21 63.20 1huz n SER 205 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1huz n LYS 206 N 2.08 -0.01 0.00 4.33 4.76 -1.26 -4.97 118.16 123.09 1huz n LYS 206 Ca 0.50 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.95 1huz n LYS 206 Cb 0.68 -0.01 0.00 0.00 -1.84 0.00 0.00 35.03 33.86 1huz n LYS 206 CO 0.00 0.00 0.00 0.94 -1.37 0.00 0.00 177.40 176.97 1huz n GLN 207 N -1.40 0.00 0.06 1.97 7.27 -1.26 -4.93 117.38 119.09 1huz n GLN 207 Ca 0.00 0.00 -0.11 0.00 0.07 0.00 0.00 57.00 56.96 1huz n GLN 207 Cb 0.00 0.00 -0.00 0.00 2.41 0.00 0.00 30.24 32.65 1huz n GLN 207 CO 0.00 0.00 0.00 -1.00 0.07 0.00 0.00 177.06 176.13 1huz h PRO 208 N 0.00 0.39 -0.01 3.69 0.13 -1.93 -3.26 132.00 131.00 1huz h PRO 208 Ca 0.00 -0.36 0.00 0.00 -0.87 0.00 0.00 66.00 64.77 1huz h PRO 208 Cb 0.00 0.09 -0.00 0.00 0.13 0.00 0.00 31.00 31.22 1huz h PRO 208 CO 0.00 1.02 0.03 -0.22 -0.23 0.00 0.00 178.00 178.59 1huz h LYS 209 N 0.25 0.00 -0.34 0.86 3.64 -1.97 -2.81 116.57 116.21 1huz h LYS 209 Ca -0.05 0.00 -0.07 0.00 -1.27 0.00 0.00 60.65 59.26 1huz h LYS 209 Cb 1.42 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 33.22 1huz h LYS 209 CO 0.14 0.00 -0.08 -0.07 -2.27 0.00 0.00 179.45 177.17 1huz h LEU 210 N 0.00 0.54 0.10 5.20 3.38 -1.92 -2.11 115.31 120.50 1huz h LEU 210 Ca 0.01 -0.13 -0.33 0.00 0.09 0.00 0.00 57.88 57.51 1huz h LEU 210 Cb 0.06 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 40.64 1huz h LEU 210 CO -0.00 0.67 -1.78 0.25 0.09 0.00 0.00 178.44 177.67 1huz h LEU 211 N 0.53 0.33 -0.39 1.67 5.85 -1.73 -3.36 115.31 118.21 1huz h LEU 211 Ca 0.10 -0.62 0.04 0.00 0.84 0.00 0.00 57.88 58.25 1huz h LEU 211 Cb 0.46 -0.11 -0.04 0.00 0.37 0.00 0.00 40.66 41.34 1huz h LEU 211 CO 0.02 1.54 0.15 0.45 -0.34 0.00 0.00 178.44 180.26 1huz h HIS 212 N 0.06 0.26 -0.49 1.25 3.86 -1.49 -1.49 115.15 117.11 1huz h HIS 212 Ca -0.34 0.02 0.10 0.00 -1.16 0.00 0.00 60.37 58.99 1huz h HIS 212 Cb 2.03 -0.06 -0.09 0.00 1.06 0.00 0.00 27.41 30.35 1huz h HIS 212 CO 0.06 0.11 -0.10 0.00 0.86 0.00 0.00 177.93 178.86 1huz h ARG 213 N 0.31 0.02 -0.26 2.45 3.08 -1.54 0.32 114.38 118.76 1huz h ARG 213 Ca 0.18 -0.00 -0.02 0.00 0.07 0.00 0.00 59.98 60.21 1huz h ARG 213 Cb 0.14 -0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.18 1huz h ARG 213 CO -0.17 0.01 0.09 0.28 -1.07 0.00 0.00 179.97 179.11 1huz h VAL 214 N 0.02 1.19 0.08 2.04 2.07 -1.61 -0.50 116.25 119.53 1huz h VAL 214 Ca 0.24 -0.59 -0.00 0.00 0.82 0.00 0.00 66.70 67.17 1huz h VAL 214 Cb 0.36 1.08 -0.00 0.00 -1.52 0.00 0.00 31.29 31.21 1huz h VAL 214 CO -0.49 0.19 -0.04 0.58 0.02 0.00 0.00 177.57 177.84 1huz h VAL 215 N 0.27 0.91 -0.76 2.57 2.07 -0.33 0.18 116.25 121.15 1huz h VAL 215 Ca 0.09 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.61 1huz h VAL 215 Cb 0.21 0.91 -0.04 0.00 -1.52 0.00 0.00 31.29 30.85 1huz h VAL 215 CO -0.00 0.00 0.48 -0.33 0.02 0.00 0.00 177.57 177.74 1huz h GLU 216 N -0.12 1.01 0.49 1.57 5.08 -0.35 0.50 114.58 122.76 1huz h GLU 216 Ca -0.01 -0.07 -0.02 0.00 -1.00 0.00 0.00 59.36 58.25 1huz h GLU 216 Cb 0.09 -0.22 0.00 0.00 0.50 0.00 0.00 28.75 29.13 1huz h GLU 216 CO 0.01 0.69 -0.24 0.37 -1.00 0.00 0.00 179.01 178.84 1huz h GLN 217 N 1.04 -0.64 0.00 2.33 5.75 -0.61 -0.73 115.11 122.24 1huz h GLN 217 Ca 0.28 0.04 -0.02 0.00 -0.15 0.00 0.00 58.65 58.80 1huz h GLN 217 Cb -0.08 0.15 -0.00 0.00 1.07 0.00 0.00 27.48 28.61 1huz h GLN 217 CO -0.06 -0.41 -0.11 -0.07 -2.65 0.00 0.00 178.83 175.54 1huz h LEU 218 N -0.69 0.00 -0.59 -2.39 3.38 -0.68 -1.79 115.31 112.55 1huz h LEU 218 Ca -0.07 0.00 -0.14 0.00 0.09 0.00 0.00 57.88 57.76 1huz h LEU 218 Cb 0.52 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.26 1huz h LEU 218 CO 0.11 0.11 -0.37 -0.61 0.09 0.00 0.00 178.44 177.76 1huz h GLN 219 N 0.00 0.71 0.00 1.13 4.15 -0.30 0.13 115.11 120.93 1huz h GLN 219 Ca -0.00 -0.36 -0.09 0.00 0.77 0.00 0.00 58.65 58.97 1huz h GLN 219 Cb 0.30 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 27.98 1huz h GLN 219 CO 0.01 0.97 -0.45 -0.22 -1.93 0.00 0.00 178.83 177.22 1huz h LYS 220 N 0.59 0.00 -0.35 1.69 3.64 -0.25 -2.09 116.57 119.80 1huz h LYS 220 Ca 0.05 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.43 1huz h LYS 220 Cb 0.91 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.73 1huz h LYS 220 CO 0.08 0.45 0.00 0.28 -2.27 0.00 0.00 179.45 177.99 1huz n VAL 221 N -3.82 0.45 -2.64 2.00 0.31 -1.13 -4.88 118.33 108.62 1huz n VAL 221 Ca -0.01 -0.39 -0.19 0.00 -0.01 0.00 0.00 64.34 63.74 1huz n VAL 221 Cb 0.50 0.11 0.01 0.00 -0.91 0.00 0.00 33.84 33.55 1huz n VAL 221 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 1huz n ARG 222 N 0.30 -2.93 -0.06 5.55 5.12 -0.78 -4.93 116.66 118.93 1huz n ARG 222 Ca 0.09 0.85 -0.04 0.00 -1.93 0.00 0.00 57.85 56.82 1huz n ARG 222 Cb 0.28 -5.44 -0.01 0.00 -1.16 0.00 0.00 32.46 26.13 1huz n ARG 222 CO 0.00 0.00 0.00 0.34 -1.93 0.00 0.00 177.63 176.04 1huz n PHE 223 N -4.20 0.82 -2.64 -1.55 7.35 0.41 -4.67 117.46 112.98 1huz n PHE 223 Ca -0.16 0.35 -0.43 0.00 -0.76 0.00 0.00 57.45 56.46 1huz n PHE 223 Cb 0.64 -0.71 -0.02 0.00 0.35 0.00 0.00 39.48 39.73 1huz n PHE 223 CO 0.00 0.00 0.00 0.42 -0.76 0.00 0.00 176.76 176.42 1huz s ILE 224 N -2.13 4.64 -0.27 -2.13 1.01 -0.92 -0.95 121.20 120.45 1huz s ILE 224 Ca -0.14 1.97 -0.04 0.00 0.00 0.00 0.00 60.65 62.44 1huz s ILE 224 Cb 0.02 -4.30 -0.15 0.00 0.01 0.00 0.00 42.46 38.04 1huz s ILE 224 CO 0.20 -0.21 -0.27 0.35 0.00 0.00 0.00 174.94 175.02 1huz n THR 225 N 5.38 1.51 -4.40 2.92 -2.24 0.15 -4.43 114.28 113.18 1huz n THR 225 Ca 0.12 -0.50 -0.20 0.00 -2.27 0.00 0.00 64.05 61.21 1huz n THR 225 Cb 0.46 -1.61 -0.10 0.00 -2.10 0.00 0.00 70.33 66.98 1huz n THR 225 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 1huz s ASP 226 N -6.91 2.17 -0.07 3.42 1.01 -1.20 -4.97 116.67 110.12 1huz s ASP 226 Ca -0.36 -1.30 0.01 0.00 0.71 0.00 0.00 52.55 51.61 1huz s ASP 226 Cb 0.11 -0.05 0.02 0.00 1.01 0.00 0.00 42.92 44.01 1huz s ASP 226 CO 0.56 -0.54 -0.06 -0.89 0.21 0.00 0.00 175.17 174.44 1huz s THR 227 N -3.32 0.77 -0.22 -1.27 2.01 -1.26 -1.51 115.64 110.83 1huz s THR 227 Ca 0.33 -0.21 -0.18 0.00 0.31 0.00 0.00 61.69 61.94 1huz s THR 227 Cb 0.07 -0.78 -0.17 0.00 0.01 0.00 0.00 72.50 71.63 1huz s THR 227 CO 0.13 0.29 0.05 0.18 -0.69 0.00 0.00 174.62 174.58 1huz n LEU 228 N 4.32 1.97 -3.78 4.42 4.77 -0.10 -4.85 117.00 123.74 1huz n LEU 228 Ca -0.19 0.37 -0.11 0.00 -0.03 0.00 0.00 56.01 56.05 1huz n LEU 228 Cb 0.51 -0.93 -0.07 0.00 -2.33 0.00 0.00 43.42 40.59 1huz n LEU 228 CO 0.21 0.42 -0.01 -0.94 -1.33 0.00 0.00 177.39 175.73 1huz s SER 229 N -7.05 -0.06 -0.23 -1.43 1.04 -0.70 -4.57 113.70 100.70 1huz s SER 229 Ca -0.31 -0.30 -0.23 0.00 0.48 0.00 0.00 55.95 55.58 1huz s SER 229 Cb 0.09 0.35 0.06 0.00 0.10 0.00 0.00 66.02 66.62 1huz s SER 229 CO 0.57 -0.63 0.66 -0.75 0.98 0.00 0.00 173.24 174.08 1huz s LYS 230 N -2.79 0.79 0.00 4.02 2.20 -1.26 -1.69 119.74 121.02 1huz s LYS 230 Ca -0.03 0.86 0.00 0.00 -0.36 0.00 0.00 55.97 56.43 1huz s LYS 230 Cb -0.00 0.39 0.00 0.00 -1.51 0.00 0.00 37.83 36.71 1huz s LYS 230 CO -0.05 -0.11 0.00 0.41 -0.36 0.00 0.00 175.35 175.24 1huz n GLY 231 N 2.57 1.80 0.46 5.54 0.00 -0.29 -4.99 105.19 110.28 1huz n GLY 231 Ca -0.14 -0.91 -0.15 0.00 0.00 0.00 0.00 46.02 44.81 1huz n GLY 231 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1huz h GLU 232 N 0.00 -0.67 0.00 1.61 5.08 -1.95 -3.30 114.58 115.35 1huz h GLU 232 Ca 0.00 0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.41 1huz h GLU 232 Cb 0.00 0.15 0.00 0.00 0.50 0.00 0.00 28.75 29.40 1huz h GLU 232 CO 0.00 -0.45 -1.29 0.25 -1.00 0.00 0.00 179.01 176.52 1huz n THR 233 N -5.48 0.00 -4.62 1.13 -2.24 -1.26 -4.52 114.28 97.29 1huz n THR 233 Ca -0.08 -0.22 -0.23 0.00 -2.27 0.00 0.00 64.05 61.25 1huz n THR 233 Cb 0.40 0.61 -0.16 0.00 -2.10 0.00 0.00 70.33 69.08 1huz n THR 233 CO 0.00 0.00 0.00 -0.75 -0.57 0.00 0.00 175.07 173.75 1huz s LYS 234 N -2.98 1.39 0.01 -0.78 2.20 -1.24 -0.22 119.74 118.11 1huz s LYS 234 Ca 0.01 -0.46 0.06 0.00 -0.36 0.00 0.00 55.97 55.22 1huz s LYS 234 Cb 0.13 -1.24 -0.02 0.00 -1.51 0.00 0.00 37.83 35.19 1huz s LYS 234 CO 0.77 0.18 -0.20 0.12 -0.36 0.00 0.00 175.35 175.86 1huz s PHE 235 N 0.12 1.77 -0.15 4.03 5.36 0.45 -1.13 117.98 128.42 1huz s PHE 235 Ca -0.03 -0.35 -0.04 0.00 -0.96 0.00 0.00 56.93 55.54 1huz s PHE 235 Cb -0.10 -1.11 0.07 0.00 -0.34 0.00 0.00 43.02 41.54 1huz s PHE 235 CO 0.01 0.02 0.14 1.41 -1.46 0.00 0.00 175.22 175.34 1huz s MET 236 N -0.75 0.08 0.00 10.12 -2.45 -0.68 -0.45 119.30 125.17 1huz s MET 236 Ca 0.07 0.14 0.00 0.00 -1.25 0.00 0.00 55.69 54.66 1huz s MET 236 Cb -0.08 -1.29 0.00 0.00 1.25 0.00 0.00 34.83 34.71 1huz s MET 236 CO 0.00 -0.58 0.00 0.41 1.05 0.00 0.00 175.02 175.90 1huz n GLY 237 N 5.30 3.62 3.09 2.11 0.00 -0.34 -0.92 105.19 118.05 1huz n GLY 237 Ca -0.06 -0.66 -0.16 0.00 0.00 0.00 0.00 46.02 45.14 1huz n GLY 237 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1huz s VAL 238 N -1.24 0.80 0.19 1.61 1.01 -0.57 -1.49 120.40 120.72 1huz s VAL 238 Ca 0.00 -0.98 -0.01 0.00 0.00 0.00 0.00 61.98 60.99 1huz s VAL 238 Cb 0.00 -0.78 -0.04 0.00 0.00 0.00 0.00 36.38 35.56 1huz s VAL 238 CO 0.00 -0.17 0.11 0.00 0.00 0.00 0.00 175.10 175.04 1huz s GLN 240 N -4.12 0.98 0.23 0.00 0.74 -0.12 -1.38 119.66 115.98 1huz s GLN 240 Ca 0.36 0.45 -0.08 0.00 0.05 0.00 0.00 55.36 56.14 1huz s GLN 240 Cb 0.07 0.47 -0.07 0.00 1.10 0.00 0.00 33.01 34.58 1huz s GLN 240 CO 0.10 -0.26 0.53 -0.51 -0.55 0.00 0.00 175.29 174.60 1huz s LEU 241 N -0.75 4.16 0.67 3.68 1.43 -1.26 -4.63 118.68 121.98 1huz s LEU 241 Ca -0.08 0.85 -0.17 0.00 -1.03 0.00 0.00 54.13 53.71 1huz s LEU 241 Cb -0.02 -3.62 0.01 0.00 0.03 0.00 0.00 46.19 42.59 1huz s LEU 241 CO 0.07 -0.07 1.25 -2.84 0.23 0.00 0.00 176.35 174.99 1huz s PRO 242 N -2.89 2.44 -0.16 1.29 0.02 -1.26 -4.21 135.00 130.22 1huz s PRO 242 Ca 0.46 1.91 -0.28 0.00 0.02 0.00 0.00 61.00 63.11 1huz s PRO 242 Cb -0.11 -1.85 0.08 0.00 0.02 0.00 0.00 34.50 32.63 1huz s PRO 242 CO 0.23 -1.65 0.73 0.45 -0.33 0.00 0.00 177.00 176.43 1huz s SER 243 N -1.67 -0.67 0.00 2.53 0.15 -1.26 -4.82 113.70 107.96 1huz s SER 243 Ca 0.79 1.02 0.00 0.00 0.70 0.00 0.00 55.95 58.45 1huz s SER 243 Cb -0.33 0.93 0.00 0.00 -1.71 0.00 0.00 66.02 64.91 1huz s SER 243 CO 0.41 -0.42 0.00 -0.62 1.20 0.00 0.00 173.24 173.81 1huz n GLU 244 N 1.71 0.00 -3.66 5.44 1.02 -1.26 -4.88 120.64 119.01 1huz n GLU 244 Ca -0.16 0.00 -0.27 0.00 -0.02 0.00 0.00 57.16 56.71 1huz n GLU 244 Cb 0.56 -0.30 -0.11 0.00 -0.02 0.00 0.00 31.44 31.57 1huz n GLU 244 CO 0.00 0.00 0.00 -1.71 1.18 0.00 0.00 177.13 176.60 1huz n ASN 245 N -2.07 1.53 -3.80 1.62 5.15 -1.26 -5.08 115.26 111.35 1huz n ASN 245 Ca 0.00 -2.86 -0.12 0.00 -0.60 0.00 0.00 54.58 50.99 1huz n ASN 245 Cb 0.00 -0.67 -0.10 0.00 -0.53 0.00 0.00 39.78 38.49 1huz n ASN 245 CO 0.00 0.00 0.00 -1.81 1.40 0.00 0.00 177.26 176.85 1huz s ASP 246 N -0.86 -0.15 0.45 1.20 -0.00 -1.26 -5.15 116.67 110.90 1huz s ASP 246 Ca 0.29 0.12 -0.11 0.00 -0.00 0.00 0.00 52.55 52.85 1huz s ASP 246 Cb 0.00 0.34 -0.06 0.00 -0.00 0.00 0.00 42.92 43.20 1huz s ASP 246 CO -0.18 -0.33 0.83 -1.61 -0.00 0.00 0.00 175.17 173.88 1huz s GLU 247 N -0.96 3.76 -1.04 8.23 8.01 -1.26 -4.29 118.70 131.15 1huz s GLU 247 Ca -0.10 0.53 -0.05 0.00 0.01 0.00 0.00 54.97 55.36 1huz s GLU 247 Cb -0.05 -2.32 -0.06 0.00 -4.31 0.00 0.00 34.13 27.39 1huz s GLU 247 CO 0.02 -0.14 0.91 0.09 0.01 0.00 0.00 175.26 176.15 1huz n ASN 248 N -1.60 -5.80 -4.33 -0.19 3.02 -1.26 -4.97 115.26 100.13 1huz n ASN 248 Ca 0.03 -0.68 -0.32 0.00 -0.03 0.00 0.00 54.58 53.59 1huz n ASN 248 Cb 0.54 -5.07 0.19 0.00 -0.61 0.00 0.00 39.78 34.83 1huz n ASN 248 CO 0.00 0.00 0.00 -1.84 -2.62 0.00 0.00 177.26 172.80 1huz n GLU 249 N -3.32 -1.68 -1.84 3.52 0.28 -1.26 -4.82 120.64 111.53 1huz n GLU 249 Ca -0.10 -0.47 -0.42 0.00 -0.16 0.00 0.00 57.16 56.01 1huz n GLU 249 Cb 0.62 -1.81 -0.02 0.00 1.43 0.00 0.00 31.44 31.66 1huz n GLU 249 CO 0.00 0.00 0.00 0.71 -0.16 0.00 0.00 177.13 177.68 1huz s TYR 250 N -2.28 2.92 0.57 -1.84 1.51 -1.26 -4.92 117.35 112.05 1huz s TYR 250 Ca 0.59 0.64 -0.20 0.00 -1.01 0.00 0.00 57.07 57.09 1huz s TYR 250 Cb -0.15 -4.02 -0.05 0.00 -0.11 0.00 0.00 41.96 37.63 1huz s TYR 250 CO 0.66 -3.63 1.06 -0.35 -1.11 0.00 0.00 175.55 172.18 1huz n PRO 251 N 3.22 1.10 -2.42 -1.71 -0.04 -1.26 -4.71 135.00 129.18 1huz n PRO 251 Ca 0.12 0.42 -0.41 0.00 -0.04 0.00 0.00 63.50 63.58 1huz n PRO 251 Cb 0.37 -2.25 -0.04 0.00 -0.04 0.00 0.00 33.50 31.55 1huz n PRO 251 CO 0.00 0.00 0.00 -1.01 -0.04 0.00 0.00 175.50 174.45 1huz s HIS 252 N -1.44 3.47 0.20 0.54 3.76 -1.26 -4.73 115.29 115.84 1huz s HIS 252 Ca 0.74 1.47 0.08 0.00 -0.15 0.00 0.00 55.06 57.20 1huz s HIS 252 Cb -0.43 -3.38 -0.04 0.00 1.11 0.00 0.00 32.58 29.83 1huz s HIS 252 CO 0.48 -1.03 -0.03 1.03 -0.85 0.00 0.00 174.74 174.34 1huz s ARG 253 N -0.19 2.28 0.02 1.40 1.81 -0.48 -4.32 118.95 119.47 1huz s ARG 253 Ca 0.52 -1.25 -0.19 0.00 -1.72 0.00 0.00 55.73 53.09 1huz s ARG 253 Cb -0.31 -2.24 -0.06 0.00 -0.45 0.00 0.00 34.95 31.88 1huz s ARG 253 CO 0.36 0.42 0.56 1.03 -0.68 0.00 0.00 175.30 176.99 1huz s ARG 254 N -3.14 4.24 -0.04 3.54 1.81 -1.26 -1.10 118.95 123.00 1huz s ARG 254 Ca 0.28 0.69 -0.01 0.00 -1.72 0.00 0.00 55.73 54.98 1huz s ARG 254 Cb -0.08 -3.29 0.03 0.00 -0.45 0.00 0.00 34.95 31.15 1huz s ARG 254 CO 0.18 0.50 0.02 -1.50 -0.68 0.00 0.00 175.30 173.81 1huz s ILE 255 N -0.60 0.12 -0.15 1.52 2.07 -0.55 -1.95 121.20 121.66 1huz s ILE 255 Ca 0.29 0.19 -0.03 0.00 -1.41 0.00 0.00 60.65 59.70 1huz s ILE 255 Cb -0.18 -0.28 -0.02 0.00 0.13 0.00 0.00 42.46 42.11 1huz s ILE 255 CO 0.17 0.17 -0.06 -1.81 -1.91 0.00 0.00 174.94 171.50 1huz s ASP 256 N 1.50 4.53 -0.02 4.50 1.01 0.21 -1.20 116.67 127.20 1huz s ASP 256 Ca -0.03 -0.21 0.05 0.00 0.71 0.00 0.00 52.55 53.08 1huz s ASP 256 Cb -0.13 -1.73 -0.01 0.00 1.01 0.00 0.00 42.92 42.06 1huz s ASP 256 CO -0.03 0.15 -0.18 -0.63 0.21 0.00 0.00 175.17 174.70 1huz s ILE 257 N 0.44 1.42 -0.03 0.77 1.01 0.40 -0.94 121.20 124.27 1huz s ILE 257 Ca -0.05 -0.76 0.00 0.00 0.00 0.00 0.00 60.65 59.84 1huz s ILE 257 Cb -0.15 -1.19 0.03 0.00 0.01 0.00 0.00 42.46 41.16 1huz s ILE 257 CO 0.03 0.40 -0.01 -0.60 0.00 0.00 0.00 174.94 174.77 1huz s ARG 258 N -0.32 0.44 -0.36 2.79 6.06 -0.71 -0.41 118.95 126.43 1huz s ARG 258 Ca 0.05 0.04 -0.15 0.00 -2.50 0.00 0.00 55.73 53.16 1huz s ARG 258 Cb -0.08 -0.59 -0.00 0.00 0.06 0.00 0.00 34.95 34.34 1huz s ARG 258 CO -0.00 -0.13 0.34 -1.17 -2.50 0.00 0.00 175.30 171.83 1huz s LEU 259 N 1.04 4.61 0.15 -0.88 2.96 0.69 0.14 118.68 127.41 1huz s LEU 259 Ca -0.09 -0.44 0.06 0.00 -0.22 0.00 0.00 54.13 53.44 1huz s LEU 259 Cb -0.14 -2.27 -0.04 0.00 0.50 0.00 0.00 46.19 44.24 1huz s LEU 259 CO -0.01 -0.37 0.02 -0.63 -1.32 0.00 0.00 176.35 174.04 1huz s ILE 260 N 1.92 3.90 0.60 6.68 -1.09 -0.59 -4.73 121.20 127.89 1huz s ILE 260 Ca 0.10 -1.28 -0.19 0.00 -2.23 0.00 0.00 60.65 57.04 1huz s ILE 260 Cb -0.17 -2.94 -0.03 0.00 -1.58 0.00 0.00 42.46 37.74 1huz s ILE 260 CO 0.11 -0.06 1.26 -2.84 -1.23 0.00 0.00 174.94 172.18 1huz s PRO 261 N -2.83 2.89 0.16 2.79 0.02 -1.26 -4.58 135.00 132.19 1huz s PRO 261 Ca 0.28 1.97 -0.19 0.00 0.02 0.00 0.00 61.00 63.07 1huz s PRO 261 Cb -0.10 -1.97 0.07 0.00 0.02 0.00 0.00 34.50 32.52 1huz s PRO 261 CO 0.19 -1.31 1.65 -0.22 -0.33 0.00 0.00 177.00 176.99 1huz h LYS 262 N 0.91 -0.10 -0.70 5.54 1.63 -1.59 -1.97 116.57 120.30 1huz h LYS 262 Ca -0.51 0.01 0.00 0.00 -0.85 0.00 0.00 60.65 59.30 1huz h LYS 262 Cb 1.31 0.02 0.00 0.00 -0.60 0.00 0.00 32.23 32.96 1huz h LYS 262 CO 0.55 -0.06 0.00 -0.40 -3.45 0.00 0.00 179.45 176.08 1huz n ASP 263 N -5.33 0.70 -0.56 4.20 5.68 -1.26 -3.08 116.55 116.89 1huz n ASP 263 Ca 0.01 -1.84 0.00 0.00 -0.50 0.00 0.00 54.79 52.46 1huz n ASP 263 Cb 0.25 -0.35 0.00 0.00 -1.14 0.00 0.00 41.12 39.88 1huz n ASP 263 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1huz n GLN 264 N -0.09 0.01 -0.20 0.11 6.02 -0.75 -4.91 117.38 117.57 1huz n GLN 264 Ca 0.00 -1.08 0.14 0.00 -0.01 0.00 0.00 57.00 56.05 1huz n GLN 264 Cb 0.18 -0.48 0.46 0.00 1.02 0.00 0.00 30.24 31.41 1huz n GLN 264 CO 0.00 0.00 0.00 -0.92 -1.01 0.00 0.00 177.06 175.13 1huz h TYR 265 N 0.07 0.61 0.14 1.08 3.20 -1.45 -2.54 116.97 118.07 1huz h TYR 265 Ca -0.01 0.02 -0.01 0.00 3.14 0.00 0.00 58.73 61.87 1huz h TYR 265 Cb 1.43 -0.19 0.00 0.00 1.54 0.00 0.00 36.73 39.51 1huz h TYR 265 CO 0.10 0.23 -0.07 1.88 -1.64 0.00 0.00 178.16 178.67 1huz h TYR 266 N 0.52 -0.18 -0.22 -3.82 -1.99 -1.91 -0.45 116.97 108.93 1huz h TYR 266 Ca 0.39 -0.00 0.01 0.00 2.00 0.00 0.00 58.73 61.13 1huz h TYR 266 Cb 0.78 0.06 -0.01 0.00 2.00 0.00 0.00 36.73 39.56 1huz h TYR 266 CO -0.00 0.12 0.15 0.00 -0.00 0.00 0.00 178.16 178.42 1huz h GLY 268 N 0.28 0.80 1.79 0.00 0.00 -0.90 -1.86 103.07 103.19 1huz h GLY 268 Ca 0.08 -0.55 -0.15 0.00 0.00 0.00 0.00 47.33 46.71 1huz h GLY 268 CO -0.02 0.51 -0.64 -0.39 0.00 0.00 0.00 176.54 176.00 1huz h VAL 269 N 0.59 1.41 -0.08 4.60 -1.51 -0.68 -1.49 116.25 119.10 1huz h VAL 269 Ca 0.13 -2.09 -0.00 0.00 -1.23 0.00 0.00 66.70 63.51 1huz h VAL 269 Cb 0.42 2.08 -0.00 0.00 -2.13 0.00 0.00 31.29 31.66 1huz h VAL 269 CO 0.01 0.61 0.05 0.25 -1.23 0.00 0.00 177.57 177.26 1huz h LEU 270 N 0.15 0.10 0.02 4.19 5.85 -1.04 -2.21 115.31 122.36 1huz h LEU 270 Ca -0.01 -0.05 -0.00 0.00 0.84 0.00 0.00 57.88 58.65 1huz h LEU 270 Cb 1.16 -0.02 0.00 0.00 0.37 0.00 0.00 40.66 42.17 1huz h LEU 270 CO 0.10 0.12 -0.01 0.22 -0.34 0.00 0.00 178.44 178.53 1huz h TYR 271 N 0.06 -0.03 0.00 1.25 3.20 -1.37 -2.43 116.97 117.65 1huz h TYR 271 Ca 0.03 -0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.90 1huz h TYR 271 Cb 0.04 0.01 0.00 0.00 1.54 0.00 0.00 36.73 38.32 1huz h TYR 271 CO -0.06 0.34 0.00 0.34 -1.64 0.00 0.00 178.16 177.15 1huz n PHE 272 N -4.93 0.00 0.00 -3.82 -0.00 -0.56 -4.37 117.46 103.78 1huz n PHE 272 Ca -0.08 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.37 1huz n PHE 272 Cb 0.20 0.00 0.00 0.00 -0.00 0.00 0.00 39.48 39.68 1huz n PHE 272 CO 0.00 0.00 0.00 2.41 -0.00 0.00 0.00 176.76 179.17 1huz n THR 273 N -0.77 0.00 0.00 -2.13 -1.04 -0.83 0.13 114.28 109.63 1huz n THR 273 Ca 0.13 0.03 0.00 0.00 -2.04 0.00 0.00 64.05 62.17 1huz n THR 273 Cb 0.06 -0.78 0.00 0.00 -1.82 0.00 0.00 70.33 67.79 1huz n THR 273 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1huz n GLY 274 N 3.27 0.00 0.00 3.41 0.00 -0.92 -4.28 105.19 106.66 1huz n GLY 274 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1huz n GLY 274 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1huz n SER 275 N 0.00 0.00 -0.26 1.61 2.88 -1.26 -4.64 113.62 111.96 1huz n SER 275 Ca 0.00 0.00 0.18 0.00 -1.33 0.00 0.00 58.87 57.72 1huz n SER 275 Cb 0.00 0.00 0.47 0.00 -0.75 0.00 0.00 64.21 63.93 1huz n SER 275 CO 0.00 0.00 0.00 -2.24 -1.23 0.00 0.00 175.04 171.57 1huz h ASP 276 N 0.00 0.48 0.07 -3.46 2.03 -1.92 0.17 116.42 113.80 1huz h ASP 276 Ca 0.00 0.05 -0.00 0.00 -0.73 0.00 0.00 57.03 56.35 1huz h ASP 276 Cb 0.00 -0.04 0.00 0.00 -0.83 0.00 0.00 39.33 38.46 1huz h ASP 276 CO 0.00 0.19 -0.04 0.40 -1.03 0.00 0.00 179.24 178.77 1huz h ILE 277 N 0.48 1.20 -0.47 4.15 1.08 -1.94 -2.81 117.51 119.22 1huz h ILE 277 Ca 0.48 -1.36 0.08 0.00 -0.39 0.00 0.00 64.86 63.67 1huz h ILE 277 Cb 1.10 2.04 -0.07 0.00 -3.07 0.00 0.00 36.82 36.82 1huz h ILE 277 CO -0.21 0.32 0.08 0.15 -0.69 0.00 0.00 178.15 177.80 1huz h PHE 278 N -0.76 0.13 -0.83 1.37 3.57 -1.48 -1.18 116.94 117.76 1huz h PHE 278 Ca -0.01 0.03 -0.01 0.00 3.53 0.00 0.00 57.97 61.51 1huz h PHE 278 Cb 0.60 0.01 -0.04 0.00 2.79 0.00 0.00 35.95 39.31 1huz h PHE 278 CO 0.12 -0.01 0.47 -0.91 -2.23 0.00 0.00 178.31 175.75 1huz h ASN 279 N 0.22 1.03 0.08 0.41 2.35 -0.80 0.06 115.58 118.93 1huz h ASN 279 Ca 0.23 -0.08 -0.00 0.00 -0.55 0.00 0.00 56.30 55.90 1huz h ASN 279 Cb 0.31 -0.26 0.00 0.00 0.05 0.00 0.00 38.32 38.42 1huz h ASN 279 CO -0.31 0.82 -0.04 0.11 -1.65 0.00 0.00 177.43 176.35 1huz h LYS 280 N 1.16 -0.11 -0.70 0.81 6.56 -1.09 0.17 116.57 123.37 1huz h LYS 280 Ca 0.30 0.01 0.00 0.00 -1.06 0.00 0.00 60.65 59.90 1huz h LYS 280 Cb 0.01 0.02 -0.03 0.00 -0.57 0.00 0.00 32.23 31.66 1huz h LYS 280 CO -0.05 0.02 0.45 -0.91 -2.06 0.00 0.00 179.45 176.91 1huz h ASN 281 N -0.22 0.81 -0.10 0.86 2.35 -0.93 -1.89 115.58 116.45 1huz h ASN 281 Ca -0.01 -0.03 -0.09 0.00 -0.55 0.00 0.00 56.30 55.62 1huz h ASN 281 Cb 0.18 -0.20 0.00 0.00 0.05 0.00 0.00 38.32 38.35 1huz h ASN 281 CO 0.02 0.60 -0.29 -0.03 -1.65 0.00 0.00 177.43 176.08 1huz h MET 282 N 0.95 0.37 0.00 0.81 4.05 -0.70 -2.64 114.93 117.77 1huz h MET 282 Ca 0.25 -0.27 0.00 0.00 -0.28 0.00 0.00 59.70 59.41 1huz h MET 282 Cb -0.09 0.04 0.00 0.00 -0.80 0.00 0.00 31.60 30.75 1huz h MET 282 CO -0.05 0.89 0.00 0.54 0.23 0.00 0.00 176.91 178.51 1huz n ARG 283 N -4.44 0.20 -0.05 0.39 1.74 0.58 -1.56 116.66 113.52 1huz n ARG 283 Ca -0.08 0.46 -0.14 0.00 -0.77 0.00 0.00 57.85 57.32 1huz n ARG 283 Cb 0.47 -1.91 -0.12 0.00 -1.02 0.00 0.00 32.46 29.89 1huz n ARG 283 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1huz h ALA 284 N 2.23 -0.00 0.34 7.54 0.00 -1.25 -3.16 119.26 124.95 1huz h ALA 284 Ca 0.00 -0.42 -0.00 0.00 0.00 0.00 0.00 54.91 54.49 1huz h ALA 284 Cb 0.33 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.09 1huz h ALA 284 CO 0.00 -0.08 -0.51 0.45 0.00 0.00 0.00 179.25 179.12 1huz h HIS 285 N -0.86 -1.43 -0.69 0.00 3.86 -1.05 -2.28 115.15 112.72 1huz h HIS 285 Ca -0.00 0.02 0.14 0.00 -1.16 0.00 0.00 60.37 59.37 1huz h HIS 285 Cb 0.84 0.58 -0.13 0.00 1.06 0.00 0.00 27.41 29.76 1huz h HIS 285 CO 0.22 -0.63 -0.17 0.00 0.86 0.00 0.00 177.93 178.21 1huz n ALA 286 N -2.85 0.17 -0.13 2.45 0.00 -0.60 0.15 120.51 119.69 1huz n ALA 286 Ca -0.10 0.75 -0.07 0.00 0.00 0.00 0.00 53.44 54.02 1huz n ALA 286 Cb 0.43 -0.45 0.09 0.00 0.00 0.00 0.00 19.45 19.52 1huz n ALA 286 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 1huz h LEU 287 N 0.00 0.87 0.03 0.00 3.38 -1.10 0.51 115.31 118.99 1huz h LEU 287 Ca 0.33 -0.26 0.02 0.00 0.09 0.00 0.00 57.88 58.06 1huz h LEU 287 Cb 0.50 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 40.99 1huz h LEU 287 CO -0.71 0.97 -0.16 -0.08 0.09 0.00 0.00 178.44 178.56 1huz h GLU 288 N 0.80 -0.27 0.00 1.13 4.81 0.19 -2.27 114.58 118.98 1huz h GLU 288 Ca 0.14 0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.38 1huz h GLU 288 Cb 0.59 0.06 0.00 0.00 0.63 0.00 0.00 28.75 30.03 1huz h GLU 288 CO 0.04 -0.18 0.00 0.87 -0.73 0.00 0.00 179.01 179.01 1huz h LYS 289 N -0.28 0.00 -0.10 1.92 1.79 -0.97 -3.47 116.57 115.47 1huz h LYS 289 Ca 0.04 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.51 1huz h LYS 289 Cb 0.33 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.98 1huz h LYS 289 CO -0.13 0.00 0.00 0.41 -1.08 0.00 0.00 179.45 178.65 1huz n GLY 290 N 0.13 0.85 3.15 3.86 0.00 -0.45 -5.01 105.19 107.72 1huz n GLY 290 Ca 0.01 -0.05 -0.09 0.00 0.00 0.00 0.00 46.02 45.89 1huz n GLY 290 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1huz s PHE 291 N -1.80 0.81 -0.43 1.61 0.40 0.17 -0.37 117.98 118.36 1huz s PHE 291 Ca 0.00 -1.20 0.02 0.00 -0.60 0.00 0.00 56.93 55.15 1huz s PHE 291 Cb 0.00 -0.45 0.13 0.00 0.51 0.00 0.00 43.02 43.21 1huz s PHE 291 CO 0.00 -0.51 0.23 0.99 0.70 0.00 0.00 175.22 176.62 1huz s THR 292 N -4.03 1.45 0.22 0.64 2.01 0.12 -2.45 115.64 113.60 1huz s THR 292 Ca 0.22 -2.52 -0.30 0.00 0.31 0.00 0.00 61.69 59.41 1huz s THR 292 Cb 0.07 -2.02 -0.09 0.00 0.01 0.00 0.00 72.50 70.47 1huz s THR 292 CO 0.00 -0.87 1.24 -0.63 -0.69 0.00 0.00 174.62 173.67 1huz s ILE 293 N 0.41 3.32 0.22 1.82 1.01 -1.26 -3.37 121.20 123.36 1huz s ILE 293 Ca 0.17 1.16 0.03 0.00 0.00 0.00 0.00 60.65 62.01 1huz s ILE 293 Cb -0.24 -3.74 -0.01 0.00 0.01 0.00 0.00 42.46 38.48 1huz s ILE 293 CO -0.01 0.21 0.12 -3.20 0.00 0.00 0.00 174.94 172.05 1huz n ASN 294 N 2.13 0.50 -0.04 3.58 2.85 0.41 -4.94 115.26 119.75 1huz n ASN 294 Ca 0.04 -2.29 0.12 0.00 -0.11 0.00 0.00 54.58 52.34 1huz n ASN 294 Cb 0.44 0.76 0.24 0.00 1.24 0.00 0.00 39.78 42.46 1huz n ASN 294 CO 0.00 0.00 0.00 -1.84 -2.11 0.00 0.00 177.26 173.31 1huz n GLU 295 N -0.48 0.13 -0.02 1.20 0.00 -1.26 -4.43 120.64 115.78 1huz n GLU 295 Ca -0.00 -0.08 -0.04 0.00 0.00 0.00 0.00 57.16 57.04 1huz n GLU 295 Cb 0.36 -1.50 -0.01 0.00 0.00 0.00 0.00 31.44 30.29 1huz n GLU 295 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.13 177.79 1huz n TYR 296 N -1.37 0.00 -4.41 -1.84 0.53 -1.26 -2.17 117.16 106.64 1huz n TYR 296 Ca 0.06 0.00 -0.21 0.00 -1.02 0.00 0.00 57.90 56.73 1huz n TYR 296 Cb 0.34 -0.21 -0.09 0.00 -1.03 0.00 0.00 39.34 38.35 1huz n TYR 296 CO 0.00 0.00 0.00 0.95 -1.02 0.00 0.00 176.86 176.79 1huz s THR 297 N -2.17 0.53 -0.51 -0.72 -4.23 -1.26 -4.61 115.64 102.67 1huz s THR 297 Ca -0.12 -2.00 0.07 0.00 -1.18 0.00 0.00 61.69 58.46 1huz s THR 297 Cb 0.02 -2.49 0.29 0.00 1.34 0.00 0.00 72.50 71.65 1huz s THR 297 CO 0.18 0.00 0.72 0.00 -0.54 0.00 0.00 174.62 174.98 1huz n ILE 298 N -0.71 1.22 -2.81 2.99 0.13 -1.26 -0.45 119.36 118.47 1huz n ILE 298 Ca -0.02 -4.85 -0.33 0.00 -1.10 0.00 0.00 62.75 56.46 1huz n ILE 298 Cb 0.65 -1.61 -0.07 0.00 -0.84 0.00 0.00 39.64 37.78 1huz n ILE 298 CO 0.00 0.00 0.00 0.00 2.80 0.00 0.00 176.55 179.35 1huz s ARG 299 N -2.31 4.22 0.23 9.51 1.70 -1.22 -2.46 118.95 128.61 1huz s ARG 299 Ca 0.40 1.10 -0.08 0.00 -0.47 0.00 0.00 55.73 56.69 1huz s ARG 299 Cb 0.22 -2.18 -0.07 0.00 -0.57 0.00 0.00 34.95 32.34 1huz s ARG 299 CO -0.08 -0.03 0.53 -1.25 -1.08 0.00 0.00 175.30 173.39 1huz s PRO 300 N -3.20 3.75 -0.03 3.89 0.04 -1.26 0.13 135.00 138.32 1huz s PRO 300 Ca 0.62 0.19 -0.30 0.00 0.04 0.00 0.00 61.00 61.54 1huz s PRO 300 Cb -0.09 -2.67 -0.04 0.00 0.04 0.00 0.00 34.50 31.74 1huz s PRO 300 CO 0.14 0.32 1.28 -0.51 0.04 0.00 0.00 177.00 178.27 1huz s LEU 301 N -2.92 4.30 0.00 -3.56 1.02 0.50 -2.38 118.68 115.64 1huz s LEU 301 Ca 0.46 1.95 0.00 0.00 0.02 0.00 0.00 54.13 56.56 1huz s LEU 301 Cb -0.11 -3.56 0.00 0.00 0.02 0.00 0.00 46.19 42.54 1huz s LEU 301 CO 0.23 -0.63 0.00 0.61 0.02 0.00 0.00 176.35 176.58 1huz n GLY 302 N 3.47 0.66 0.00 -3.19 0.00 0.60 -4.84 105.19 101.90 1huz n GLY 302 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.14 1huz n GLY 302 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1huz n VAL 303 N 0.00 0.00 0.88 1.61 0.31 -1.24 -4.76 118.33 115.12 1huz n VAL 303 Ca 0.00 0.00 0.14 0.00 -0.01 0.00 0.00 64.34 64.47 1huz n VAL 303 Cb 0.00 0.00 0.55 0.00 -0.91 0.00 0.00 33.84 33.48 1huz n VAL 303 CO 0.00 0.00 0.00 0.41 -1.32 0.00 0.00 176.83 175.92 1huz n THR 304 N 0.00 0.20 -2.56 2.52 -1.04 -1.26 -4.54 114.28 107.60 1huz n THR 304 Ca 0.00 -0.08 -0.01 0.00 -2.04 0.00 0.00 64.05 61.92 1huz n THR 304 Cb 0.00 -0.54 0.03 0.00 -1.82 0.00 0.00 70.33 68.00 1huz n THR 304 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1huz n GLY 305 N 1.41 -0.32 3.03 3.41 0.00 -1.26 -5.16 105.19 106.30 1huz n GLY 305 Ca 0.06 -0.04 -0.13 0.00 0.00 0.00 0.00 46.02 45.92 1huz n GLY 305 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1huz s VAL 306 N 0.03 -0.04 -0.07 1.61 1.01 -1.26 -5.01 120.40 116.67 1huz s VAL 306 Ca 0.02 0.15 -0.08 0.00 0.00 0.00 0.00 61.98 62.07 1huz s VAL 306 Cb 0.10 -0.35 -0.05 0.00 0.00 0.00 0.00 36.38 36.09 1huz s VAL 306 CO -0.03 0.06 0.23 0.00 0.00 0.00 0.00 175.10 175.36 1huz s ALA 307 N 1.19 3.84 0.00 5.51 0.00 -1.26 0.22 121.76 131.26 1huz s ALA 307 Ca -0.09 -0.54 0.00 0.00 0.00 0.00 0.00 51.96 51.33 1huz s ALA 307 Cb -0.10 -2.08 0.00 0.00 0.00 0.00 0.00 23.12 20.94 1huz s ALA 307 CO -0.08 0.60 0.00 0.41 0.00 0.00 0.00 175.76 176.69 1huz n GLY 308 N 1.74 1.79 3.74 0.00 0.00 -1.00 -4.92 105.19 106.54 1huz n GLY 308 Ca -0.17 -0.92 -0.41 0.00 0.00 0.00 0.00 46.02 44.53 1huz n GLY 308 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1huz s GLU 309 N 4.53 4.62 0.27 1.61 0.41 -1.26 -4.71 118.70 124.16 1huz s GLU 309 Ca 0.00 1.68 -0.30 0.00 -0.41 0.00 0.00 54.97 55.94 1huz s GLU 309 Cb 0.00 -3.29 -0.10 0.00 -1.78 0.00 0.00 34.13 28.97 1huz s GLU 309 CO 0.00 0.11 1.33 -1.25 -0.49 0.00 0.00 175.26 174.96 1huz s PRO 310 N -0.37 4.36 0.56 0.39 0.04 -1.26 -4.27 135.00 134.44 1huz s PRO 310 Ca 0.49 2.17 -0.18 0.00 0.04 0.00 0.00 61.00 63.51 1huz s PRO 310 Cb -0.29 -3.12 -0.05 0.00 0.04 0.00 0.00 34.50 31.08 1huz s PRO 310 CO 0.34 -0.25 1.10 -0.51 0.04 0.00 0.00 177.00 177.73 1huz s LEU 311 N -0.87 3.66 -0.01 -3.56 2.01 -1.03 -4.93 118.68 113.95 1huz s LEU 311 Ca 0.54 2.07 -0.23 0.00 0.01 0.00 0.00 54.13 56.52 1huz s LEU 311 Cb -0.39 -4.57 -0.05 0.00 0.01 0.00 0.00 46.19 41.20 1huz s LEU 311 CO 0.45 -1.23 0.69 -2.84 1.01 0.00 0.00 176.35 174.43 1huz s PRO 312 N -3.52 4.43 0.17 1.29 0.02 -1.26 -4.67 135.00 131.46 1huz s PRO 312 Ca 0.70 0.91 0.10 0.00 0.02 0.00 0.00 61.00 62.72 1huz s PRO 312 Cb -0.21 -3.39 -0.04 0.00 0.02 0.00 0.00 34.50 30.88 1huz s PRO 312 CO 0.30 0.23 -0.22 0.14 -0.33 0.00 0.00 177.00 177.12 1huz s VAL 313 N 0.22 2.09 -0.00 3.83 -7.23 -1.26 -5.02 120.40 113.03 1huz s VAL 313 Ca 0.36 -1.95 0.06 0.00 -1.81 0.00 0.00 61.98 58.64 1huz s VAL 313 Cb -0.19 -1.97 0.10 0.00 0.56 0.00 0.00 36.38 34.88 1huz s VAL 313 CO 0.20 -0.19 1.04 0.47 -0.31 0.00 0.00 175.10 176.31 1huz n ASP 314 N 0.34 0.26 0.00 4.85 8.00 -1.26 -5.03 116.55 123.71 1huz n ASP 314 Ca -0.13 -2.02 0.00 0.00 0.71 0.00 0.00 54.79 53.35 1huz n ASP 314 Cb 0.56 -0.23 0.00 0.00 -0.02 0.00 0.00 41.12 41.44 1huz n ASP 314 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 1huz n SER 315 N 0.09 0.00 -0.16 -2.24 3.41 -1.26 -4.94 113.62 108.52 1huz n SER 315 Ca 0.02 0.00 -0.09 0.00 -0.26 0.00 0.00 58.87 58.53 1huz n SER 315 Cb 0.80 0.00 0.04 0.00 -0.26 0.00 0.00 64.21 64.79 1huz n SER 315 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 1huz h GLU 316 N 0.00 0.97 -0.67 4.33 5.08 -1.99 -2.43 114.58 119.87 1huz h GLU 316 Ca 0.00 -0.36 0.14 0.00 -1.00 0.00 0.00 59.36 58.15 1huz h GLU 316 Cb 0.00 -0.06 -0.12 0.00 0.50 0.00 0.00 28.75 29.07 1huz h GLU 316 CO 0.00 1.03 -0.02 1.96 -1.00 0.00 0.00 179.01 180.97 1huz h GLN 317 N 0.86 0.09 -0.95 2.33 7.50 -1.99 0.22 115.11 123.17 1huz h GLN 317 Ca 0.13 -0.01 0.16 0.00 0.50 0.00 0.00 58.65 59.44 1huz h GLN 317 Cb 0.67 -0.02 -0.08 0.00 0.05 0.00 0.00 27.48 28.10 1huz h GLN 317 CO 0.05 0.06 0.60 -0.44 -1.50 0.00 0.00 178.83 177.60 1huz h ASP 318 N 0.09 0.71 -0.12 1.46 5.19 -1.80 -2.06 116.42 119.89 1huz h ASP 318 Ca 0.35 0.06 -0.03 0.00 -0.62 0.00 0.00 57.03 56.79 1huz h ASP 318 Cb 0.59 -0.08 -0.00 0.00 0.18 0.00 0.00 39.33 40.02 1huz h ASP 318 CO -0.60 0.32 -0.06 0.40 -3.12 0.00 0.00 179.24 176.18 1huz h ILE 319 N 0.73 1.32 -0.15 0.35 2.04 -0.55 -3.15 117.51 118.11 1huz h ILE 319 Ca 0.50 -1.10 0.02 0.00 1.00 0.00 0.00 64.86 65.28 1huz h ILE 319 Cb 0.80 1.80 -0.02 0.00 -0.74 0.00 0.00 36.82 38.66 1huz h ILE 319 CO -0.26 0.32 0.01 -0.26 0.00 0.00 0.00 178.15 177.96 1huz h PHE 320 N -0.10 0.01 -0.49 1.37 -1.00 -1.05 -2.28 116.94 113.39 1huz h PHE 320 Ca 0.03 0.01 0.14 0.00 2.81 0.00 0.00 57.97 60.96 1huz h PHE 320 Cb 0.53 0.02 -0.02 0.00 3.61 0.00 0.00 35.95 40.08 1huz h PHE 320 CO 0.07 -0.01 0.38 -0.44 -1.61 0.00 0.00 178.31 176.70 1huz h ASP 321 N 0.06 0.00 -0.26 2.17 3.32 -1.43 0.19 116.42 120.47 1huz h ASP 321 Ca 0.07 0.00 -0.08 0.00 0.02 0.00 0.00 57.03 57.03 1huz h ASP 321 Cb 0.07 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.60 1huz h ASP 321 CO -0.10 0.00 -0.10 1.88 -1.72 0.00 0.00 179.24 179.19 1huz h TYR 322 N 0.00 0.71 -0.54 4.55 -1.99 -1.36 -2.58 116.97 115.76 1huz h TYR 322 Ca 0.23 -0.12 0.00 0.00 2.00 0.00 0.00 58.73 60.85 1huz h TYR 322 Cb 0.99 -0.19 0.00 0.00 2.00 0.00 0.00 36.73 39.54 1huz h TYR 322 CO 0.00 0.73 0.00 0.44 -0.00 0.00 0.00 178.16 179.33 1huz n ILE 323 N -4.18 1.46 -3.03 -2.88 -5.35 0.40 -5.02 119.36 100.75 1huz n ILE 323 Ca 0.01 -1.18 -0.15 0.00 -0.27 0.00 0.00 62.75 61.17 1huz n ILE 323 Cb 0.34 0.28 0.02 0.00 -1.74 0.00 0.00 39.64 38.53 1huz n ILE 323 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1huz n GLN 324 N 0.89 -2.19 -3.99 6.28 3.00 0.26 -4.96 117.38 116.66 1huz n GLN 324 Ca 0.21 1.89 -0.09 0.00 -0.01 0.00 0.00 57.00 59.01 1huz n GLN 324 Cb 0.70 -4.82 -0.11 0.00 0.00 0.00 0.00 30.24 26.01 1huz n GLN 324 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.06 175.48 1huz s TRP 325 N -2.40 0.30 -0.29 1.08 0.52 -1.10 -4.98 118.94 112.07 1huz s TRP 325 Ca 0.25 -0.61 -0.29 0.00 0.02 0.00 0.00 56.10 55.48 1huz s TRP 325 Cb -0.06 -0.22 -0.01 0.00 -1.15 0.00 0.00 33.47 32.03 1huz s TRP 325 CO 0.80 -0.24 1.58 -0.98 0.02 0.00 0.00 176.95 178.13 1huz s ARG 326 N -1.96 3.66 -0.49 4.98 1.70 -1.26 -4.50 118.95 121.08 1huz s ARG 326 Ca -0.11 1.42 -0.45 0.00 -0.47 0.00 0.00 55.73 56.12 1huz s ARG 326 Cb -0.06 -4.05 -0.19 0.00 -0.57 0.00 0.00 34.95 30.07 1huz s ARG 326 CO -0.03 -1.46 1.95 0.98 -1.08 0.00 0.00 175.30 175.66 1huz n TYR 327 N 8.85 1.40 -2.80 5.89 4.19 -1.26 -4.82 117.16 128.61 1huz n TYR 327 Ca 0.19 0.88 -0.43 0.00 3.31 0.00 0.00 57.90 61.85 1huz n TYR 327 Cb 0.46 -2.28 -0.04 0.00 0.49 0.00 0.00 39.34 37.97 1huz n TYR 327 CO 0.00 0.00 0.00 0.50 0.91 0.00 0.00 176.86 178.27 1huz s ARG 328 N 4.92 3.18 0.12 2.98 6.06 -1.26 -5.01 118.95 129.95 1huz s ARG 328 Ca 1.14 -0.59 -0.31 0.00 -2.50 0.00 0.00 55.73 53.47 1huz s ARG 328 Cb -1.47 -4.17 -0.10 0.00 0.06 0.00 0.00 34.95 29.26 1huz s ARG 328 CO 0.71 -1.79 1.75 -2.00 -2.50 0.00 0.00 175.30 171.48 1huz s GLU 329 N 4.31 4.16 0.06 5.12 2.12 -1.26 -4.79 118.70 128.41 1huz s GLU 329 Ca 0.26 2.51 -0.01 0.00 0.36 0.00 0.00 54.97 58.10 1huz s GLU 329 Cb -0.14 -3.49 0.11 0.00 0.26 0.00 0.00 34.13 30.86 1huz s GLU 329 CO 0.13 -0.79 0.30 -2.30 -0.54 0.00 0.00 175.26 172.07 1huz n PRO 330 N 5.31 -0.02 0.00 4.30 -0.02 -1.26 0.83 135.00 144.15 1huz n PRO 330 Ca 0.17 0.30 0.03 0.00 -2.02 0.00 0.00 63.50 61.97 1huz n PRO 330 Cb 0.38 -0.45 0.12 0.00 -0.02 0.00 0.00 33.50 33.53 1huz n PRO 330 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 1huz n LYS 331 N -4.22 0.00 -0.00 -0.52 4.01 -1.23 -1.53 118.16 114.67 1huz n LYS 331 Ca 0.04 0.42 0.11 0.00 -0.51 0.00 0.00 58.31 58.36 1huz n LYS 331 Cb 0.11 -1.51 -0.14 0.00 -0.51 0.00 0.00 35.03 32.98 1huz n LYS 331 CO 0.00 0.00 0.00 -0.25 -1.11 0.00 0.00 177.40 176.04 1huz n ASP 332 N -1.52 0.43 -1.58 4.39 9.92 0.24 -4.68 116.55 123.76 1huz n ASP 332 Ca 0.01 -0.42 0.00 0.00 -0.53 0.00 0.00 54.79 53.85 1huz n ASP 332 Cb 0.06 1.56 0.00 0.00 -0.64 0.00 0.00 41.12 42.10 1huz n ASP 332 CO 0.00 0.00 0.00 0.54 0.13 0.00 0.00 177.20 177.87 1huz n ARG 333 N -1.94 0.76 0.00 -1.24 1.74 -0.58 -5.00 116.66 110.40 1huz n ARG 333 Ca -0.01 0.00 0.10 0.00 -0.77 0.00 0.00 57.85 57.18 1huz n ARG 333 Cb 0.47 -1.12 0.09 0.00 -1.02 0.00 0.00 32.46 30.87 1huz n ARG 333 CO 0.00 0.00 0.00 0.43 -1.52 0.00 0.00 177.63 176.54