#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3huu n THR 20 N 0.00 0.13 -3.18 0.58 -2.24 -1.26 -4.96 114.28 103.35 3huu n THR 20 Ca 0.00 -0.24 -0.23 0.00 -2.27 0.00 0.00 64.05 61.31 3huu n THR 20 Cb 0.00 0.29 0.04 0.00 -2.10 0.00 0.00 70.33 68.56 3huu n THR 20 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 3huu n LEU 21 N -1.93 -2.70 -4.11 3.22 4.77 -1.26 -4.86 117.00 110.13 3huu n LEU 21 Ca 0.02 -0.35 -0.26 0.00 -0.03 0.00 0.00 56.01 55.38 3huu n LEU 21 Cb 0.44 -2.90 -0.16 0.00 -2.33 0.00 0.00 43.42 38.46 3huu n LEU 21 CO 0.41 0.30 -0.50 -0.89 -1.33 0.00 0.00 177.39 175.39 3huu s THR 22 N -3.19 1.40 -0.16 -5.08 2.01 -1.26 -0.49 115.64 108.88 3huu s THR 22 Ca 0.37 -0.68 -0.07 0.00 0.31 0.00 0.00 61.69 61.62 3huu s THR 22 Cb -0.17 -1.22 -0.04 0.00 0.01 0.00 0.00 72.50 71.08 3huu s THR 22 CO 0.46 0.41 0.08 -0.63 -0.69 0.00 0.00 174.62 174.25 3huu s ILE 23 N 0.19 4.97 -0.05 1.82 -1.09 -0.24 -1.02 121.20 125.77 3huu s ILE 23 Ca -0.07 0.02 -0.17 0.00 -2.23 0.00 0.00 60.65 58.20 3huu s ILE 23 Cb -0.13 -3.21 -0.05 0.00 -1.58 0.00 0.00 42.46 37.49 3huu s ILE 23 CO 0.03 0.51 0.46 -0.83 -1.23 0.00 0.00 174.94 173.88 3huu s GLY 24 N -0.07 2.46 -0.30 6.18 0.00 0.27 -2.18 107.32 113.67 3huu s GLY 24 Ca 0.07 -0.17 -0.05 0.00 0.00 0.00 0.00 44.72 44.57 3huu s GLY 24 CO 0.01 0.50 0.04 1.08 0.00 0.00 0.00 173.10 174.73 3huu s LEU 25 N -0.22 3.88 -0.43 0.66 1.43 0.18 -0.83 118.68 123.36 3huu s LEU 25 Ca 0.25 -1.00 -0.18 0.00 -1.03 0.00 0.00 54.13 52.18 3huu s LEU 25 Cb -0.16 -1.80 0.02 0.00 0.03 0.00 0.00 46.19 44.28 3huu s LEU 25 CO 0.12 -0.24 0.46 -0.63 0.23 0.00 0.00 176.35 176.30 3huu s ILE 26 N 1.38 5.06 0.21 -0.59 1.01 -0.19 -1.74 121.20 126.34 3huu s ILE 26 Ca -0.01 -0.31 -0.10 0.00 0.00 0.00 0.00 60.65 60.23 3huu s ILE 26 Cb -0.18 -4.06 -0.07 0.00 0.01 0.00 0.00 42.46 38.15 3huu s ILE 26 CO 0.01 -0.45 0.54 -1.10 0.00 0.00 0.00 174.94 173.94 3huu s GLN 27 N 2.22 3.83 0.46 2.79 -0.21 -1.26 -1.17 119.66 126.31 3huu s GLN 27 Ca 0.13 0.31 0.18 0.00 0.02 0.00 0.00 55.36 56.00 3huu s GLN 27 Cb -0.17 -2.70 1.09 0.00 1.00 0.00 0.00 33.01 32.23 3huu s GLN 27 CO 0.14 0.35 1.99 1.57 -2.12 0.00 0.00 175.29 177.22 3huu h LYS 28 N 2.75 0.00 -1.59 2.91 2.10 -1.94 -3.45 116.57 117.35 3huu h LYS 28 Ca -0.47 0.00 0.11 0.00 -2.00 0.00 0.00 60.65 58.29 3huu h LYS 28 Cb 1.17 0.00 -0.22 0.00 -0.90 0.00 0.00 32.23 32.28 3huu h LYS 28 CO 0.68 0.19 0.59 0.45 -2.00 0.00 0.00 179.45 179.37 3huu s SER 29 N -6.75 -0.33 0.00 7.07 0.15 -1.26 -4.69 113.70 107.89 3huu s SER 29 Ca -0.03 0.31 0.23 0.00 0.70 0.00 0.00 55.95 57.15 3huu s SER 29 Cb 0.15 0.28 0.46 0.00 -1.71 0.00 0.00 66.02 65.19 3huu s SER 29 CO 0.67 -0.34 1.42 -1.54 1.20 0.00 0.00 173.24 174.65 3huu n SER 30 N 0.57 3.22 -4.70 5.45 3.41 -0.64 -4.31 113.62 116.61 3huu n SER 30 Ca -0.09 -1.96 -0.40 0.00 -0.26 0.00 0.00 58.87 56.16 3huu n SER 30 Cb 0.58 -0.22 0.02 0.00 -0.26 0.00 0.00 64.21 64.34 3huu n SER 30 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3huu n ALA 31 N 1.34 1.22 -0.33 7.33 0.00 -1.26 -4.49 120.51 124.33 3huu n ALA 31 Ca 0.19 0.20 0.06 0.00 0.00 0.00 0.00 53.44 53.88 3huu n ALA 31 Cb 0.57 -2.27 0.15 0.00 0.00 0.00 0.00 19.45 17.90 3huu n ALA 31 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 3huu h PRO 32 N 1.72 0.01 0.00 0.00 0.11 -1.98 0.13 132.00 131.99 3huu h PRO 32 Ca -0.49 -0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.60 3huu h PRO 32 Cb 1.31 -0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.41 3huu h PRO 32 CO 0.58 0.00 -0.10 1.05 -0.21 0.00 0.00 178.00 179.33 3huu h GLU 33 N 0.01 0.00 0.00 1.05 -0.00 -1.98 -1.99 114.58 111.66 3huu h GLU 33 Ca 0.46 0.00 -0.11 0.00 -0.00 0.00 0.00 59.36 59.71 3huu h GLU 33 Cb 0.75 0.00 -0.02 0.00 -0.00 0.00 0.00 28.75 29.49 3huu h GLU 33 CO -0.94 0.10 -0.88 -0.89 -0.00 0.00 0.00 179.01 176.40 3huu n ILE 34 N -3.85 1.47 0.22 -1.06 2.08 0.31 -4.18 119.36 114.36 3huu n ILE 34 Ca -0.02 0.10 0.07 0.00 0.56 0.00 0.00 62.75 63.46 3huu n ILE 34 Cb 0.19 -2.23 0.52 0.00 -0.75 0.00 0.00 39.64 37.38 3huu n ILE 34 CO 0.00 0.00 0.00 0.08 0.56 0.00 0.00 176.55 177.19 3huu h ARG 35 N -1.00 0.00 -0.00 0.38 0.11 -1.19 -2.53 114.38 110.15 3huu h ARG 35 Ca -0.17 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.91 3huu h ARG 35 Cb 0.88 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.96 3huu h ARG 35 CO -0.10 0.24 -0.01 1.04 0.10 0.00 0.00 179.97 181.23 3huu n GLN 36 N -3.89 0.58 -1.91 0.08 6.02 -0.75 -4.68 117.38 112.83 3huu n GLN 36 Ca -0.02 -0.03 -0.42 0.00 -0.01 0.00 0.00 57.00 56.52 3huu n GLN 36 Cb 0.33 -1.50 -0.03 0.00 1.02 0.00 0.00 30.24 30.06 3huu n GLN 36 CO 0.00 0.00 0.00 1.21 -1.01 0.00 0.00 177.06 177.26 3huu s ASN 37 N -2.45 6.59 0.60 1.08 3.84 -0.95 -4.86 114.94 118.80 3huu s ASN 37 Ca 0.32 2.46 0.34 0.00 0.21 0.00 0.00 52.86 56.20 3huu s ASN 37 Cb 0.21 -2.55 1.87 0.00 -0.55 0.00 0.00 41.25 40.23 3huu s ASN 37 CO 0.45 -0.92 2.05 1.55 -2.79 0.00 0.00 177.10 177.43 3huu h PRO 38 N 8.93 0.00 -0.75 0.43 0.13 -1.90 0.11 132.00 138.95 3huu h PRO 38 Ca -0.43 0.00 0.04 0.00 -0.87 0.00 0.00 66.00 64.74 3huu h PRO 38 Cb 1.20 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.29 3huu h PRO 38 CO 0.94 0.00 0.49 0.35 -0.23 0.00 0.00 178.00 179.55 3huu h PHE 39 N 0.00 0.86 -0.18 1.56 3.57 -1.94 -0.97 116.94 119.85 3huu h PHE 39 Ca 0.00 0.02 -0.03 0.00 3.53 0.00 0.00 57.97 61.49 3huu h PHE 39 Cb 0.29 -0.29 -0.01 0.00 2.79 0.00 0.00 35.95 38.73 3huu h PHE 39 CO 0.00 0.49 -0.02 -0.91 -2.23 0.00 0.00 178.31 175.64 3huu h ASN 40 N 0.88 0.32 -0.50 0.41 2.35 -1.08 -1.51 115.58 116.45 3huu h ASN 40 Ca 0.30 -0.34 -0.07 0.00 -0.55 0.00 0.00 56.30 55.64 3huu h ASN 40 Cb 0.10 -0.09 -0.02 0.00 0.05 0.00 0.00 38.32 38.36 3huu h ASN 40 CO -0.09 0.58 0.05 0.77 -1.65 0.00 0.00 177.43 177.09 3huu h SER 41 N 0.05 0.86 0.04 5.81 4.64 -1.56 -2.06 113.55 121.33 3huu h SER 41 Ca 0.05 -0.20 -0.00 0.00 -0.47 0.00 0.00 61.79 61.17 3huu h SER 41 Cb 0.43 -0.23 0.00 0.00 -0.31 0.00 0.00 62.40 62.29 3huu h SER 41 CO 0.01 0.89 -0.02 0.44 -0.87 0.00 0.00 176.83 177.28 3huu h ASP 42 N 0.84 -0.04 -0.77 4.97 3.32 -1.10 -1.15 116.42 122.49 3huu h ASP 42 Ca 0.17 -0.27 -0.01 0.00 0.02 0.00 0.00 57.03 56.94 3huu h ASP 42 Cb 0.43 0.01 -0.04 0.00 0.22 0.00 0.00 39.33 39.95 3huu h ASP 42 CO 0.01 0.25 0.44 1.62 -1.72 0.00 0.00 179.24 179.84 3huu h VAL 43 N -0.33 1.23 -0.78 -1.35 3.04 -1.26 -2.12 116.25 114.67 3huu h VAL 43 Ca -0.01 -0.53 -0.03 0.00 -1.01 0.00 0.00 66.70 65.12 3huu h VAL 43 Cb 0.31 0.18 -0.04 0.00 -2.01 0.00 0.00 31.29 29.73 3huu h VAL 43 CO 0.01 0.24 0.38 0.25 -1.01 0.00 0.00 177.57 177.44 3huu h LEU 44 N 1.06 1.01 -1.23 3.16 5.85 -1.32 -0.52 115.31 123.32 3huu h LEU 44 Ca 0.27 -0.12 -0.06 0.00 0.84 0.00 0.00 57.88 58.82 3huu h LEU 44 Cb 0.00 -0.26 -0.02 0.00 0.37 0.00 0.00 40.66 40.76 3huu h LEU 44 CO -0.05 0.85 -0.07 -1.13 -0.34 0.00 0.00 178.44 177.71 3huu h ASN 45 N 1.11 0.42 -0.19 1.25 -1.24 -0.79 -0.32 115.58 115.82 3huu h ASN 45 Ca 0.27 -0.09 -0.09 0.00 0.71 0.00 0.00 56.30 57.10 3huu h ASN 45 Cb 0.11 -0.11 -0.00 0.00 0.73 0.00 0.00 38.32 39.05 3huu h ASN 45 CO -0.03 0.54 -0.22 1.23 -1.29 0.00 0.00 177.43 177.65 3huu h GLY 46 N 0.84 0.53 1.00 1.57 0.00 -0.64 -2.22 103.07 104.15 3huu h GLY 46 Ca 0.09 -0.56 -0.01 0.00 0.00 0.00 0.00 47.33 46.85 3huu h GLY 46 CO 0.02 0.51 0.41 -2.22 0.00 0.00 0.00 176.54 175.25 3huu h ILE 47 N 0.15 1.21 -0.46 2.60 2.04 -0.84 -2.53 117.51 119.68 3huu h ILE 47 Ca 0.03 -0.48 -0.06 0.00 1.00 0.00 0.00 64.86 65.35 3huu h ILE 47 Cb 0.78 0.26 -0.02 0.00 -0.74 0.00 0.00 36.82 37.10 3huu h ILE 47 CO 0.05 0.22 0.05 0.78 0.00 0.00 0.00 178.15 179.25 3huu h ASN 48 N 0.95 0.68 -0.20 1.72 4.21 -1.02 0.78 115.58 122.70 3huu h ASN 48 Ca 0.25 -0.14 -0.06 0.00 1.21 0.00 0.00 56.30 57.56 3huu h ASN 48 Cb -0.00 -0.18 -0.02 0.00 -1.12 0.00 0.00 38.32 37.00 3huu h ASN 48 CO -0.04 0.72 -0.04 1.56 -1.29 0.00 0.00 177.43 178.33 3huu h GLN 49 N 0.69 0.52 0.02 0.81 4.20 -0.98 -1.67 115.11 118.70 3huu h GLN 49 Ca 0.15 -0.12 -0.02 0.00 0.06 0.00 0.00 58.65 58.71 3huu h GLN 49 Cb 0.35 -0.07 0.00 0.00 0.30 0.00 0.00 27.48 28.07 3huu h GLN 49 CO 0.01 0.58 -0.10 0.00 -0.67 0.00 0.00 178.83 178.65 3huu h ALA 50 N 1.46 -0.01 -0.67 3.87 0.00 -1.11 -3.32 119.26 119.49 3huu h ALA 50 Ca 0.10 -0.51 -0.00 0.00 0.00 0.00 0.00 54.91 54.50 3huu h ALA 50 Cb 0.39 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.16 3huu h ALA 50 CO 0.02 0.04 0.42 0.00 0.00 0.00 0.00 179.25 179.72 3huu h ASN 52 N 0.91 0.48 0.93 0.00 2.35 -1.45 0.12 115.58 118.92 3huu h ASN 52 Ca 0.24 -0.06 -0.02 0.00 -0.55 0.00 0.00 56.30 55.91 3huu h ASN 52 Cb -0.05 -0.12 -0.00 0.00 0.05 0.00 0.00 38.32 38.19 3huu h ASN 52 CO -0.05 0.40 -0.09 -0.37 -1.65 0.00 0.00 177.43 175.67 3huu h VAL 53 N 0.52 0.23 -0.19 2.81 -1.51 -1.64 -2.78 116.25 113.68 3huu h VAL 53 Ca 0.14 -0.72 0.00 0.00 -1.23 0.00 0.00 66.70 64.90 3huu h VAL 53 Cb 0.01 1.58 0.00 0.00 -2.13 0.00 0.00 31.29 30.75 3huu h VAL 53 CO -0.03 0.08 0.00 0.54 -1.23 0.00 0.00 177.57 176.94 3huu n ARG 54 N -3.23 2.38 -2.31 5.19 1.74 -0.97 -4.98 116.66 114.47 3huu n ARG 54 Ca 0.00 -2.04 -0.03 0.00 -0.77 0.00 0.00 57.85 55.01 3huu n ARG 54 Cb 0.34 -1.48 0.00 0.00 -1.02 0.00 0.00 32.46 30.30 3huu n ARG 54 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3huu n GLY 55 N 1.41 0.48 3.43 -0.13 0.00 -0.36 -5.05 105.19 104.97 3huu n GLY 55 Ca 0.17 -0.68 -0.28 0.00 0.00 0.00 0.00 46.02 45.22 3huu n GLY 55 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3huu s TYR 56 N -2.53 2.38 0.56 1.61 1.51 0.27 -4.96 117.35 116.18 3huu s TYR 56 Ca 0.03 -0.34 0.06 0.00 -1.01 0.00 0.00 57.07 55.81 3huu s TYR 56 Cb -0.01 -1.25 0.05 0.00 -0.11 0.00 0.00 41.96 40.64 3huu s TYR 56 CO 0.04 0.40 0.47 -1.12 -1.11 0.00 0.00 175.55 174.23 3huu s SER 57 N -2.26 4.68 0.11 2.29 0.01 0.36 -4.08 113.70 114.80 3huu s SER 57 Ca 0.17 -1.22 -0.04 0.00 1.31 0.00 0.00 55.95 56.16 3huu s SER 57 Cb -0.10 0.48 -0.03 0.00 0.21 0.00 0.00 66.02 66.59 3huu s SER 57 CO 0.08 -1.18 0.11 0.28 0.41 0.00 0.00 173.24 172.94 3huu s THR 58 N -2.78 0.13 -0.11 1.44 -1.32 -1.26 -1.08 115.64 110.66 3huu s THR 58 Ca 0.37 -1.62 -0.10 0.00 -1.21 0.00 0.00 61.69 59.13 3huu s THR 58 Cb -0.03 -1.72 0.03 0.00 -1.51 0.00 0.00 72.50 69.27 3huu s THR 58 CO 0.23 -0.60 0.30 0.00 -2.21 0.00 0.00 174.62 172.34 3huu s ARG 59 N -3.96 0.35 0.06 7.08 1.70 -0.93 -4.90 118.95 118.35 3huu s ARG 59 Ca 0.14 0.42 0.08 0.00 -0.47 0.00 0.00 55.73 55.90 3huu s ARG 59 Cb 0.06 0.17 -0.03 0.00 -0.57 0.00 0.00 34.95 34.57 3huu s ARG 59 CO -0.04 -0.04 -0.18 1.41 -1.08 0.00 0.00 175.30 175.37 3huu s MET 60 N 0.19 2.00 0.71 3.89 1.75 -1.26 -0.64 119.30 125.93 3huu s MET 60 Ca -0.00 -1.03 -0.14 0.00 -1.25 0.00 0.00 55.69 53.27 3huu s MET 60 Cb -0.02 -2.17 0.03 0.00 2.84 0.00 0.00 34.83 35.50 3huu s MET 60 CO 0.00 0.52 1.12 0.95 -0.65 0.00 0.00 175.02 176.97 3huu s THR 61 N -0.99 3.04 0.00 10.11 -4.23 -0.71 -4.95 115.64 117.91 3huu s THR 61 Ca 0.16 0.44 0.00 0.00 -1.18 0.00 0.00 61.69 61.11 3huu s THR 61 Cb -0.11 -2.93 0.00 0.00 1.34 0.00 0.00 72.50 70.81 3huu s THR 61 CO 0.07 -0.34 0.31 0.55 -0.54 0.00 0.00 174.62 174.66 3huu n VAL 62 N -2.84 0.00 -2.01 2.29 3.14 -1.26 -4.77 118.33 112.88 3huu n VAL 62 Ca 0.11 -0.35 -0.37 0.00 -2.96 0.00 0.00 64.34 60.76 3huu n VAL 62 Cb 0.52 1.26 0.02 0.00 -1.06 0.00 0.00 33.84 34.58 3huu n VAL 62 CO 0.00 0.00 0.00 -0.44 -6.46 0.00 0.00 176.83 169.93 3huu s SER 63 N -0.09 5.57 0.00 6.55 0.01 -1.26 -4.47 113.70 120.01 3huu s SER 63 Ca 0.00 2.52 0.18 0.00 1.31 0.00 0.00 55.95 59.95 3huu s SER 63 Cb 0.00 -2.62 0.47 0.00 0.21 0.00 0.00 66.02 64.08 3huu s SER 63 CO 0.00 -1.34 1.39 -0.62 0.41 0.00 0.00 173.24 173.07 3huu n GLU 64 N -0.96 2.68 -3.59 12.44 1.02 -1.26 -1.62 120.64 129.34 3huu n GLU 64 Ca 0.10 -2.33 -0.16 0.00 -0.02 0.00 0.00 57.16 54.76 3huu n GLU 64 Cb 0.47 -1.43 -0.06 0.00 -0.02 0.00 0.00 31.44 30.40 3huu n GLU 64 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 3huu s ASN 65 N -1.05 -0.49 0.30 1.62 2.20 -1.26 -4.78 114.94 111.47 3huu s ASN 65 Ca 0.36 0.41 0.05 0.00 -0.94 0.00 0.00 52.86 52.74 3huu s ASN 65 Cb 0.19 0.48 0.69 0.00 -2.00 0.00 0.00 41.25 40.61 3huu s ASN 65 CO 0.26 -0.61 1.80 0.77 -2.94 0.00 0.00 177.10 176.37 3huu h SER 66 N 3.10 0.82 0.46 3.54 4.64 -1.93 -1.46 113.55 122.72 3huu h SER 66 Ca -0.29 0.08 -0.02 0.00 -0.47 0.00 0.00 61.79 61.09 3huu h SER 66 Cb 1.17 -0.07 0.00 0.00 -0.31 0.00 0.00 62.40 63.19 3huu h SER 66 CO 0.40 0.34 -0.23 1.23 -0.87 0.00 0.00 176.83 177.71 3huu h GLY 67 N 0.83 -0.65 1.44 -0.77 0.00 -1.99 -1.93 103.07 100.00 3huu h GLY 67 Ca 0.55 0.25 -0.04 0.00 0.00 0.00 0.00 47.33 48.09 3huu h GLY 67 CO -0.34 -0.24 0.13 -0.55 0.00 0.00 0.00 176.54 175.55 3huu h ASP 68 N -0.63 0.66 -0.57 0.19 3.32 -1.91 -2.83 116.42 114.65 3huu h ASP 68 Ca -0.06 -0.10 -0.04 0.00 0.02 0.00 0.00 57.03 56.84 3huu h ASP 68 Cb 0.48 -0.17 -0.03 0.00 0.22 0.00 0.00 39.33 39.84 3huu h ASP 68 CO 0.10 0.64 0.20 0.25 -1.72 0.00 0.00 179.24 178.71 3huu h LEU 69 N 0.70 0.85 0.28 1.55 5.85 -1.10 -0.55 115.31 122.89 3huu h LEU 69 Ca 0.16 -0.14 -0.01 0.00 0.84 0.00 0.00 57.88 58.74 3huu h LEU 69 Cb 0.23 -0.22 -0.01 0.00 0.37 0.00 0.00 40.66 41.04 3huu h LEU 69 CO -0.01 0.79 -0.18 0.22 -0.34 0.00 0.00 178.44 178.93 3huu h TYR 70 N 0.89 -0.47 -0.20 1.25 3.20 -1.09 -0.77 116.97 119.78 3huu h TYR 70 Ca 0.20 -0.00 -0.06 0.00 3.14 0.00 0.00 58.73 62.01 3huu h TYR 70 Cb 0.24 0.17 -0.01 0.00 1.54 0.00 0.00 36.73 38.67 3huu h TYR 70 CO 0.02 -0.28 -0.16 0.45 -1.64 0.00 0.00 178.16 176.55 3huu h HIS 71 N -0.45 0.35 -0.28 -3.82 3.86 -1.49 0.72 115.15 114.04 3huu h HIS 71 Ca -0.03 -0.05 -0.04 0.00 -1.16 0.00 0.00 60.37 59.09 3huu h HIS 71 Cb 0.38 -0.10 -0.01 0.00 1.06 0.00 0.00 27.41 28.74 3huu h HIS 71 CO -0.10 0.48 0.01 1.49 0.86 0.00 0.00 177.93 180.68 3huu h GLU 72 N 0.31 0.49 -0.41 2.45 4.81 -0.79 -0.30 114.58 121.14 3huu h GLU 72 Ca 0.06 -0.15 -0.14 0.00 -0.13 0.00 0.00 59.36 58.99 3huu h GLU 72 Cb 0.47 -0.05 -0.01 0.00 0.63 0.00 0.00 28.75 29.79 3huu h GLU 72 CO 0.03 0.63 -0.31 0.28 -0.73 0.00 0.00 179.01 178.92 3huu h VAL 73 N 0.28 1.27 -0.53 0.32 2.07 -0.90 -1.38 116.25 117.38 3huu h VAL 73 Ca 0.08 -1.47 0.04 0.00 0.82 0.00 0.00 66.70 66.17 3huu h VAL 73 Cb 0.41 1.32 -0.04 0.00 -1.52 0.00 0.00 31.29 31.45 3huu h VAL 73 CO 0.01 0.50 0.28 0.50 0.02 0.00 0.00 177.57 178.88 3huu h LYS 74 N 0.75 0.53 -0.79 1.57 3.64 -0.74 0.21 116.57 121.73 3huu h LYS 74 Ca 0.08 -0.03 -0.01 0.00 -1.27 0.00 0.00 60.65 59.42 3huu h LYS 74 Cb 0.89 -0.12 -0.04 0.00 -0.41 0.00 0.00 32.23 32.55 3huu h LYS 74 CO 0.08 0.35 0.47 1.15 -2.27 0.00 0.00 179.45 179.23 3huu h THR 75 N 0.54 1.23 -0.66 1.00 2.02 -0.85 -0.32 112.91 115.87 3huu h THR 75 Ca 0.23 -0.52 -0.04 0.00 0.77 0.00 0.00 66.41 66.85 3huu h THR 75 Cb 0.12 0.13 -0.03 0.00 -1.74 0.00 0.00 68.15 66.63 3huu h THR 75 CO -0.15 0.24 0.26 0.24 0.37 0.00 0.00 175.52 176.48 3huu h MET 76 N 1.09 0.97 -0.19 6.66 2.86 -0.33 -0.62 114.93 125.37 3huu h MET 76 Ca 0.28 -0.16 -0.04 0.00 -2.06 0.00 0.00 59.70 57.72 3huu h MET 76 Cb -0.02 -0.16 -0.01 0.00 0.06 0.00 0.00 31.60 31.47 3huu h MET 76 CO -0.05 0.79 -0.06 0.82 1.06 0.00 0.00 176.91 179.48 3huu h ILE 77 N 0.95 1.29 -0.18 -1.22 2.04 -0.30 -2.34 117.51 117.75 3huu h ILE 77 Ca 0.22 -1.05 -0.10 0.00 1.00 0.00 0.00 64.86 64.93 3huu h ILE 77 Cb 0.19 1.59 -0.01 0.00 -0.74 0.00 0.00 36.82 37.85 3huu h ILE 77 CO -0.02 0.32 -0.31 1.56 0.00 0.00 0.00 178.15 179.70 3huu h GLN 78 N 0.09 0.37 -0.00 2.37 4.20 -0.83 -2.30 115.11 119.00 3huu h GLN 78 Ca 0.05 -0.15 0.00 0.00 0.06 0.00 0.00 58.65 58.61 3huu h GLN 78 Cb 0.51 -0.02 0.00 0.00 0.30 0.00 0.00 27.48 28.27 3huu h GLN 78 CO 0.02 0.64 -0.05 0.43 -0.67 0.00 0.00 178.83 179.20 3huu n SER 79 N -4.10 0.33 -3.08 1.46 7.64 -0.26 -4.89 113.62 110.72 3huu n SER 79 Ca -0.01 -0.61 -0.22 0.00 1.01 0.00 0.00 58.87 59.04 3huu n SER 79 Cb 0.42 -0.11 0.01 0.00 -1.01 0.00 0.00 64.21 63.53 3huu n SER 79 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 3huu n LYS 80 N -0.97 -3.85 0.00 1.43 5.02 -0.87 -4.84 118.16 114.09 3huu n LYS 80 Ca 0.17 0.69 0.11 0.00 -2.02 0.00 0.00 58.31 57.26 3huu n LYS 80 Cb 0.24 -5.46 0.59 0.00 -0.02 0.00 0.00 35.03 30.39 3huu n LYS 80 CO 0.00 0.00 0.00 0.43 -0.52 0.00 0.00 177.40 177.31 3huu n SER 81 N -2.33 0.00 -3.90 4.39 7.64 -0.91 -4.81 113.62 113.70 3huu n SER 81 Ca -0.08 -0.23 -0.10 0.00 1.01 0.00 0.00 58.87 59.47 3huu n SER 81 Cb 0.59 -0.20 -0.09 0.00 -1.01 0.00 0.00 64.21 63.49 3huu n SER 81 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 3huu s VAL 82 N -2.40 0.11 -0.11 0.44 1.01 -1.26 -4.83 120.40 113.36 3huu s VAL 82 Ca 0.25 -0.95 0.13 0.00 0.00 0.00 0.00 61.98 61.41 3huu s VAL 82 Cb 0.15 -0.75 -0.24 0.00 0.00 0.00 0.00 36.38 35.55 3huu s VAL 82 CO 0.32 -0.52 0.39 0.47 0.00 0.00 0.00 175.10 175.75 3huu n ASP 83 N 0.97 0.68 -3.70 3.32 8.00 -0.19 -4.89 116.55 120.75 3huu n ASP 83 Ca -0.20 0.23 -0.08 0.00 0.71 0.00 0.00 54.79 55.44 3huu n ASP 83 Cb 0.58 0.26 -0.02 0.00 -0.02 0.00 0.00 41.12 41.91 3huu n ASP 83 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 3huu s GLY 84 N -5.34 -0.28 0.20 0.44 0.00 -1.25 -4.48 107.32 96.61 3huu s GLY 84 Ca -0.09 0.02 0.09 0.00 0.00 0.00 0.00 44.72 44.74 3huu s GLY 84 CO 0.81 0.01 -0.17 -1.36 0.00 0.00 0.00 173.10 172.40 3huu s PHE 85 N -3.80 1.84 -0.13 1.90 0.40 -0.07 -0.57 117.98 117.55 3huu s PHE 85 Ca 0.08 -0.49 0.01 0.00 -0.60 0.00 0.00 56.93 55.92 3huu s PHE 85 Cb -0.04 -0.87 0.02 0.00 0.51 0.00 0.00 43.02 42.64 3huu s PHE 85 CO -0.00 0.40 -0.14 0.42 0.70 0.00 0.00 175.22 176.59 3huu s ILE 86 N -2.51 1.51 -0.30 0.64 1.01 -0.01 -1.49 121.20 120.04 3huu s ILE 86 Ca 0.21 -0.62 -0.16 0.00 0.00 0.00 0.00 60.65 60.08 3huu s ILE 86 Cb -0.03 -1.40 -0.03 0.00 0.01 0.00 0.00 42.46 41.01 3huu s ILE 86 CO 0.08 0.45 0.41 -0.22 0.00 0.00 0.00 174.94 175.65 3huu s LEU 87 N 1.24 4.17 -0.04 2.97 2.96 0.21 -1.02 118.68 129.17 3huu s LEU 87 Ca -0.01 0.16 0.02 0.00 -0.22 0.00 0.00 54.13 54.08 3huu s LEU 87 Cb -0.14 -2.46 0.13 0.00 0.50 0.00 0.00 46.19 44.22 3huu s LEU 87 CO -0.06 -0.27 0.70 0.18 -1.32 0.00 0.00 176.35 175.58 3huu n LEU 88 N 5.43 1.72 -3.81 -0.68 4.77 -0.32 -0.83 117.00 123.29 3huu n LEU 88 Ca -0.08 -0.87 -0.05 0.00 -0.03 0.00 0.00 56.01 54.99 3huu n LEU 88 Cb 0.50 -0.52 -0.00 0.00 -2.33 0.00 0.00 43.42 41.07 3huu n LEU 88 CO 0.39 0.31 0.66 -0.72 -1.33 0.00 0.00 177.39 176.70 3huu s TYR 89 N -1.29 -0.05 -0.01 -1.77 -0.85 -1.24 -4.84 117.35 107.29 3huu s TYR 89 Ca 0.09 -0.37 0.01 0.00 -0.52 0.00 0.00 57.07 56.27 3huu s TYR 89 Cb 0.07 0.70 0.01 0.00 0.38 0.00 0.00 41.96 43.11 3huu s TYR 89 CO 0.03 -1.06 -0.01 0.45 -1.52 0.00 0.00 175.55 173.43 3huu s SER 90 N -3.06 0.28 -0.12 -0.18 0.15 -1.26 -4.59 113.70 104.92 3huu s SER 90 Ca 0.15 -0.03 -0.06 0.00 0.70 0.00 0.00 55.95 56.71 3huu s SER 90 Cb -0.03 -0.08 0.05 0.00 -1.71 0.00 0.00 66.02 64.25 3huu s SER 90 CO 0.05 -0.02 0.27 -0.22 1.20 0.00 0.00 173.24 174.53 3huu s LEU 91 N 0.29 0.27 0.36 3.45 2.96 -1.26 -2.08 118.68 122.67 3huu s LEU 91 Ca -0.03 0.58 -0.28 0.00 -0.22 0.00 0.00 54.13 54.18 3huu s LEU 91 Cb -0.05 0.81 -0.10 0.00 0.50 0.00 0.00 46.19 47.35 3huu s LEU 91 CO -0.01 -0.18 1.35 -1.59 -1.32 0.00 0.00 176.35 174.61 3huu s LYS 92 N 1.40 4.23 -1.55 1.98 -2.85 -1.26 -2.53 119.74 119.16 3huu s LYS 92 Ca -0.08 2.30 -0.05 0.00 -1.00 0.00 0.00 55.97 57.14 3huu s LYS 92 Cb -0.10 -2.99 0.01 0.00 -2.06 0.00 0.00 37.83 32.68 3huu s LYS 92 CO -0.09 -0.33 0.53 -0.25 0.10 0.00 0.00 175.35 175.31 3huu n ASP 93 N 0.60 -5.87 -4.67 0.03 8.00 -1.26 -4.93 116.55 108.45 3huu n ASP 93 Ca 0.01 -0.26 -0.42 0.00 0.71 0.00 0.00 54.79 54.82 3huu n ASP 93 Cb 0.41 -4.77 -0.03 0.00 -0.02 0.00 0.00 41.12 36.72 3huu n ASP 93 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 3huu s ASP 94 N -2.63 6.75 0.43 -2.24 2.15 -1.05 -4.90 116.67 115.18 3huu s ASP 94 Ca 0.28 2.14 0.09 0.00 0.43 0.00 0.00 52.55 55.49 3huu s ASP 94 Cb -0.13 -2.54 0.92 0.00 -0.30 0.00 0.00 42.92 40.88 3huu s ASP 94 CO 0.35 -0.85 2.07 -0.65 -0.17 0.00 0.00 175.17 175.92 3huu h PRO 95 N 8.83 0.46 -0.69 4.34 0.11 -1.91 -2.53 132.00 140.61 3huu h PRO 95 Ca -0.37 -0.03 0.03 0.00 0.11 0.00 0.00 66.00 65.74 3huu h PRO 95 Cb 1.17 -0.10 -0.04 0.00 0.11 0.00 0.00 31.00 32.13 3huu h PRO 95 CO 0.94 0.30 0.42 0.82 -0.21 0.00 0.00 178.00 180.28 3huu h ILE 96 N 0.47 1.08 -0.34 4.15 1.08 -1.96 -0.63 117.51 121.36 3huu h ILE 96 Ca 0.13 -0.28 -0.09 0.00 -0.39 0.00 0.00 64.86 64.23 3huu h ILE 96 Cb -0.03 0.18 -0.02 0.00 -3.07 0.00 0.00 36.82 33.89 3huu h ILE 96 CO -0.03 0.15 -0.15 -0.33 -0.69 0.00 0.00 178.15 177.10 3huu h GLU 97 N 0.83 0.62 -0.33 2.37 5.08 -1.86 -1.14 114.58 120.15 3huu h GLU 97 Ca 0.28 -0.20 -0.02 0.00 -1.00 0.00 0.00 59.36 58.42 3huu h GLU 97 Cb 0.03 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.22 3huu h GLU 97 CO -0.11 0.74 0.12 0.45 -1.00 0.00 0.00 179.01 179.21 3huu h HIS 98 N 0.56 0.51 -0.02 4.33 3.86 -1.27 -1.77 115.15 121.35 3huu h HIS 98 Ca 0.09 -0.04 0.03 0.00 -1.16 0.00 0.00 60.37 59.29 3huu h HIS 98 Cb 0.58 -0.15 -0.04 0.00 1.06 0.00 0.00 27.41 28.86 3huu h HIS 98 CO 0.02 0.49 -0.19 1.25 0.86 0.00 0.00 177.93 180.36 3huu h LEU 99 N 0.38 -0.56 -1.20 2.43 5.85 -0.70 0.87 115.31 122.38 3huu h LEU 99 Ca 0.11 0.08 0.02 0.00 0.84 0.00 0.00 57.88 58.93 3huu h LEU 99 Cb 0.20 0.24 -0.04 0.00 0.37 0.00 0.00 40.66 41.42 3huu h LEU 99 CO -0.01 -0.25 0.55 -0.07 -0.34 0.00 0.00 178.44 178.32 3huu h LEU 100 N -0.30 0.92 -0.29 2.25 3.38 -1.16 -1.95 115.31 118.16 3huu h LEU 100 Ca 0.06 -0.02 -0.20 0.00 0.09 0.00 0.00 57.88 57.82 3huu h LEU 100 Cb 0.38 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.90 3huu h LEU 100 CO -0.19 0.66 -0.87 0.78 0.09 0.00 0.00 178.44 178.91 3huu h ASN 101 N 1.09 0.28 -0.43 -0.43 2.35 -0.87 -1.68 115.58 115.89 3huu h ASN 101 Ca 0.31 -0.23 -0.08 0.00 -0.55 0.00 0.00 56.30 55.76 3huu h ASN 101 Cb -0.07 -0.09 -0.02 0.00 0.05 0.00 0.00 38.32 38.19 3huu h ASN 101 CO -0.08 1.02 0.00 -0.33 -1.65 0.00 0.00 177.43 176.39 3huu h GLU 102 N 0.12 0.83 -0.49 0.81 4.39 -0.34 -2.48 114.58 117.43 3huu h GLU 102 Ca -0.04 -0.23 0.00 0.00 0.34 0.00 0.00 59.36 59.43 3huu h GLU 102 Cb 1.49 -0.09 0.00 0.00 -0.10 0.00 0.00 28.75 30.05 3huu h GLU 102 CO 0.13 0.83 0.00 1.19 -1.16 0.00 0.00 179.01 180.01 3huu n PHE 103 N -4.21 0.65 -4.18 4.33 3.01 -0.78 -4.96 117.46 111.32 3huu n PHE 103 Ca 0.03 -0.32 -0.29 0.00 1.01 0.00 0.00 57.45 57.87 3huu n PHE 103 Cb 0.31 0.00 -0.07 0.00 -0.01 0.00 0.00 39.48 39.71 3huu n PHE 103 CO 0.00 0.00 0.00 1.63 1.01 0.00 0.00 176.76 179.40 3huu n LYS 104 N 0.98 -1.85 -3.70 -1.08 5.02 -0.74 -4.95 118.16 111.83 3huu n LYS 104 Ca 0.17 0.21 -0.37 0.00 -2.02 0.00 0.00 58.31 56.30 3huu n LYS 104 Cb 0.43 -3.96 -0.06 0.00 -0.02 0.00 0.00 35.03 31.42 3huu n LYS 104 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 3huu s VAL 105 N -4.21 5.34 0.23 -0.18 0.11 -0.71 -5.04 120.40 115.94 3huu s VAL 105 Ca 0.01 0.43 -0.30 0.00 -2.93 0.00 0.00 61.98 59.19 3huu s VAL 105 Cb -0.01 -3.53 -0.10 0.00 -1.53 0.00 0.00 36.38 31.21 3huu s VAL 105 CO 0.96 0.55 1.50 -2.84 -3.33 0.00 0.00 175.10 171.94 3huu s PRO 106 N -0.63 4.23 0.17 1.54 0.02 -1.26 -4.80 135.00 134.27 3huu s PRO 106 Ca 0.17 2.36 -0.16 0.00 0.02 0.00 0.00 61.00 63.38 3huu s PRO 106 Cb -0.13 -3.11 0.03 0.00 0.02 0.00 0.00 34.50 31.31 3huu s PRO 106 CO 0.06 -0.50 0.46 1.52 -0.33 0.00 0.00 177.00 178.21 3huu s TYR 107 N 0.31 -0.12 0.04 6.54 -0.85 -1.26 -0.90 117.35 121.12 3huu s TYR 107 Ca 0.63 -0.21 -0.01 0.00 -0.52 0.00 0.00 57.07 56.96 3huu s TYR 107 Cb -0.43 0.31 -0.03 0.00 0.38 0.00 0.00 41.96 42.19 3huu s TYR 107 CO 0.41 -0.82 -0.03 -1.17 -1.52 0.00 0.00 175.55 172.41 3huu s LEU 108 N -2.85 2.40 -0.08 -3.49 0.20 -0.56 -4.18 118.68 110.12 3huu s LEU 108 Ca 0.07 -0.82 0.03 0.00 0.69 0.00 0.00 54.13 54.10 3huu s LEU 108 Cb 0.00 0.16 -0.02 0.00 -0.43 0.00 0.00 46.19 45.91 3huu s LEU 108 CO -0.06 -0.49 -0.16 -0.63 -0.29 0.00 0.00 176.35 174.72 3huu s ILE 109 N -3.02 2.87 -0.77 6.68 1.01 -0.54 -0.62 121.20 126.82 3huu s ILE 109 Ca -0.01 -0.76 -0.15 0.00 0.00 0.00 0.00 60.65 59.73 3huu s ILE 109 Cb 0.01 -2.14 0.20 0.00 0.01 0.00 0.00 42.46 40.54 3huu s ILE 109 CO -0.07 0.56 0.73 -0.69 0.00 0.00 0.00 174.94 175.47 3huu s VAL 110 N -0.23 5.50 -5.00 2.92 1.01 -0.01 -0.58 120.40 124.00 3huu s VAL 110 Ca 0.00 -2.23 0.00 0.00 0.00 0.00 0.00 61.98 59.75 3huu s VAL 110 Cb -0.13 -4.45 0.00 0.00 0.00 0.00 0.00 36.38 31.80 3huu s VAL 110 CO 0.03 -1.01 0.00 0.61 0.00 0.00 0.00 175.10 174.73 3huu n GLY 111 N 4.29 0.28 3.78 4.51 0.00 0.43 -3.66 105.19 114.82 3huu n GLY 111 Ca 0.08 -1.60 -0.39 0.00 0.00 0.00 0.00 46.02 44.11 3huu n GLY 111 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3huu s LYS 112 N -2.00 4.34 -0.26 1.61 2.20 -1.26 -4.08 119.74 120.29 3huu s LYS 112 Ca 0.00 0.84 -0.24 0.00 -0.36 0.00 0.00 55.97 56.21 3huu s LYS 112 Cb 0.00 -3.30 -0.00 0.00 -1.51 0.00 0.00 37.83 33.01 3huu s LYS 112 CO 0.00 0.47 0.81 0.45 -0.36 0.00 0.00 175.35 176.72 3huu s SER 113 N -0.58 6.78 -0.00 1.43 0.15 -1.26 -4.78 113.70 115.44 3huu s SER 113 Ca 0.32 0.94 0.02 0.00 0.70 0.00 0.00 55.95 57.93 3huu s SER 113 Cb -0.20 -2.43 -0.03 0.00 -1.71 0.00 0.00 66.02 61.66 3huu s SER 113 CO 0.20 -0.54 0.05 0.18 1.20 0.00 0.00 173.24 174.33 3huu n LEU 114 N 6.06 0.01 -0.10 3.45 4.77 -1.26 -4.88 117.00 125.05 3huu n LEU 114 Ca 0.05 -0.08 -0.13 0.00 -0.03 0.00 0.00 56.01 55.82 3huu n LEU 114 Cb 0.48 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.47 3huu n LEU 114 CO 0.48 0.00 -1.15 0.59 -1.33 0.00 0.00 177.39 175.98 3huu n ASN 115 N -1.49 2.18 -4.39 -1.43 3.02 -1.26 -4.89 115.26 107.00 3huu n ASN 115 Ca -0.00 -0.09 -0.29 0.00 -0.03 0.00 0.00 54.58 54.16 3huu n ASN 115 Cb 0.05 -0.14 -0.13 0.00 -0.61 0.00 0.00 39.78 38.95 3huu n ASN 115 CO 0.00 0.00 0.00 -0.31 -2.62 0.00 0.00 177.26 174.33 3huu s TYR 116 N -2.41 2.35 0.42 3.10 1.51 -1.26 -5.06 117.35 116.00 3huu s TYR 116 Ca -0.25 -0.37 -0.22 0.00 -1.01 0.00 0.00 57.07 55.22 3huu s TYR 116 Cb 0.07 -1.30 -0.10 0.00 -0.11 0.00 0.00 41.96 40.52 3huu s TYR 116 CO 0.51 0.29 1.00 -2.00 -1.11 0.00 0.00 175.55 174.24 3huu s GLU 117 N -1.85 4.14 -1.60 -0.62 2.12 -1.26 -4.11 118.70 115.52 3huu s GLU 117 Ca 0.14 1.32 -0.09 0.00 0.36 0.00 0.00 54.97 56.70 3huu s GLU 117 Cb -0.10 -2.33 0.08 0.00 0.26 0.00 0.00 34.13 32.04 3huu s GLU 117 CO 0.06 -0.13 0.44 0.27 -0.54 0.00 0.00 175.26 175.36 3huu n ASN 118 N -0.42 -1.08 -4.84 -1.70 0.23 -1.26 -4.97 115.26 101.22 3huu n ASN 118 Ca 0.06 -1.11 -0.37 0.00 -0.53 0.00 0.00 54.58 52.63 3huu n ASN 118 Cb 0.52 -2.38 -0.06 0.00 -2.08 0.00 0.00 39.78 35.78 3huu n ASN 118 CO 0.00 0.00 0.00 -0.63 -0.93 0.00 0.00 177.26 175.70 3huu s ILE 119 N -3.77 5.00 0.08 1.53 -1.09 -1.26 -4.08 121.20 117.61 3huu s ILE 119 Ca 0.34 0.78 -0.31 0.00 -2.23 0.00 0.00 60.65 59.23 3huu s ILE 119 Cb -0.19 -3.71 -0.07 0.00 -1.58 0.00 0.00 42.46 36.91 3huu s ILE 119 CO 0.95 0.47 1.36 -0.63 -1.23 0.00 0.00 174.94 175.86 3huu s ILE 120 N -1.20 3.51 0.01 2.92 1.01 -1.25 -4.77 121.20 121.42 3huu s ILE 120 Ca 0.28 1.06 0.02 0.00 0.00 0.00 0.00 60.65 62.00 3huu s ILE 120 Cb -0.16 -3.68 -0.01 0.00 0.01 0.00 0.00 42.46 38.62 3huu s ILE 120 CO 0.16 0.07 -0.05 -1.38 0.00 0.00 0.00 174.94 173.73 3huu s HIS 121 N 1.33 0.45 -0.14 3.97 -3.43 -1.21 -1.46 115.29 114.81 3huu s HIS 121 Ca 0.63 -0.17 0.02 0.00 -0.80 0.00 0.00 55.06 54.75 3huu s HIS 121 Cb -0.35 -0.29 0.01 0.00 -1.43 0.00 0.00 32.58 30.53 3huu s HIS 121 CO 0.29 -0.03 -0.21 0.42 -2.00 0.00 0.00 174.74 173.22 3huu s ILE 122 N -0.39 1.99 0.33 -5.38 1.01 0.25 -1.47 121.20 117.53 3huu s ILE 122 Ca -0.01 -0.93 -0.17 0.00 0.00 0.00 0.00 60.65 59.54 3huu s ILE 122 Cb -0.04 -1.77 0.03 0.00 0.01 0.00 0.00 42.46 40.70 3huu s ILE 122 CO -0.00 0.53 0.72 -0.62 0.00 0.00 0.00 174.94 175.58 3huu s ASP 123 N 0.89 -0.08 0.36 3.58 2.15 -0.42 -0.43 116.67 122.73 3huu s ASP 123 Ca -0.06 -0.90 0.07 0.00 0.43 0.00 0.00 52.55 52.09 3huu s ASP 123 Cb -0.15 0.77 -0.01 0.00 -0.30 0.00 0.00 42.92 43.23 3huu s ASP 123 CO -0.03 -1.48 0.48 0.20 -0.17 0.00 0.00 175.17 174.17 3huu s ASN 124 N -3.01 5.82 -0.88 -0.34 0.01 -1.26 -0.40 114.94 114.88 3huu s ASN 124 Ca 0.15 -0.28 -0.19 0.00 -0.71 0.00 0.00 52.86 51.83 3huu s ASN 124 Cb -0.05 -1.05 0.13 0.00 0.41 0.00 0.00 41.25 40.69 3huu s ASN 124 CO 0.10 -0.51 1.06 -0.62 -1.51 0.00 0.00 177.10 175.61 3huu s ASP 125 N -4.20 6.59 0.48 -1.22 -1.08 -1.26 -4.86 116.67 111.11 3huu s ASP 125 Ca 0.47 -2.00 0.24 0.00 -0.52 0.00 0.00 52.55 50.74 3huu s ASP 125 Cb -0.09 -2.38 1.20 0.00 -1.46 0.00 0.00 42.92 40.19 3huu s ASP 125 CO 0.31 -1.05 1.98 0.78 0.52 0.00 0.00 175.17 177.71 3huu h ASN 126 N 8.81 0.00 -0.18 -0.34 2.35 -1.94 0.70 115.58 124.98 3huu h ASN 126 Ca 0.10 0.00 -0.04 0.00 -0.55 0.00 0.00 56.30 55.80 3huu h ASN 126 Cb 1.03 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 39.40 3huu h ASN 126 CO 1.08 0.19 -0.05 0.40 -1.65 0.00 0.00 177.43 177.39 3huu h ILE 127 N 0.00 1.29 -0.41 2.81 2.04 -1.89 -2.39 117.51 118.95 3huu h ILE 127 Ca -0.00 -1.05 -0.10 0.00 1.00 0.00 0.00 64.86 64.71 3huu h ILE 127 Cb 0.47 1.62 -0.02 0.00 -0.74 0.00 0.00 36.82 38.16 3huu h ILE 127 CO 0.02 0.31 -0.15 -0.78 0.00 0.00 0.00 178.15 177.56 3huu h ASP 128 N 0.05 0.76 -0.74 1.72 3.58 -1.79 -1.62 116.42 118.39 3huu h ASP 128 Ca 0.04 -0.24 0.00 0.00 0.42 0.00 0.00 57.03 57.25 3huu h ASP 128 Cb 0.51 -0.21 -0.04 0.00 1.72 0.00 0.00 39.33 41.31 3huu h ASP 128 CO 0.02 0.92 0.46 0.00 -2.88 0.00 0.00 179.24 177.76 3huu h ALA 129 N 1.15 0.94 -0.00 -0.78 0.00 -0.80 0.51 119.26 120.27 3huu h ALA 129 Ca 0.11 -0.07 -0.18 0.00 0.00 0.00 0.00 54.91 54.76 3huu h ALA 129 Cb 0.63 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 18.11 3huu h ALA 129 CO 0.04 0.39 -0.83 0.00 0.00 0.00 0.00 179.25 178.85 3huu h ALA 130 N 1.25 0.60 -0.19 0.00 0.00 -1.32 -2.23 119.26 117.36 3huu h ALA 130 Ca 0.27 -0.71 -0.01 0.00 0.00 0.00 0.00 54.91 54.46 3huu h ALA 130 Cb -0.07 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.62 3huu h ALA 130 CO -0.05 0.92 0.09 -0.92 0.00 0.00 0.00 179.25 179.28 3huu h TYR 131 N 0.08 0.28 -0.26 0.00 3.20 -0.79 -1.47 116.97 118.01 3huu h TYR 131 Ca -0.03 -0.02 -0.07 0.00 3.14 0.00 0.00 58.73 61.75 3huu h TYR 131 Cb 1.44 -0.08 -0.01 0.00 1.54 0.00 0.00 36.73 39.61 3huu h TYR 131 CO 0.02 0.30 -0.16 1.96 -1.64 0.00 0.00 178.16 178.64 3huu h GLN 132 N 0.17 0.45 -0.25 1.82 1.08 -0.88 -0.84 115.11 116.66 3huu h GLN 132 Ca 0.06 -0.14 -0.09 0.00 -1.45 0.00 0.00 58.65 57.04 3huu h GLN 132 Cb 0.13 -0.04 -0.00 0.00 -0.05 0.00 0.00 27.48 27.51 3huu h GLN 132 CO -0.01 0.60 -0.19 1.25 -0.95 0.00 0.00 178.83 179.53 3huu h LEU 133 N 0.41 0.59 -0.82 1.46 5.85 -1.15 -1.45 115.31 120.21 3huu h LEU 133 Ca 0.07 -0.45 -0.03 0.00 0.84 0.00 0.00 57.88 58.31 3huu h LEU 133 Cb 0.52 -0.17 -0.04 0.00 0.37 0.00 0.00 40.66 41.35 3huu h LEU 133 CO 0.03 0.92 0.38 0.74 -0.34 0.00 0.00 178.44 180.17 3huu h THR 134 N 0.28 1.26 -0.57 1.05 2.02 -1.11 -1.62 112.91 114.21 3huu h THR 134 Ca 0.05 -0.74 -0.00 0.00 0.77 0.00 0.00 66.41 66.48 3huu h THR 134 Cb 0.73 0.23 -0.03 0.00 -1.74 0.00 0.00 68.15 67.34 3huu h THR 134 CO 0.05 0.31 0.35 -0.61 0.37 0.00 0.00 175.52 175.99 3huu h GLN 135 N 1.16 0.77 -0.78 6.66 4.15 -1.04 0.15 115.11 126.18 3huu h GLN 135 Ca 0.28 -0.06 0.00 0.00 0.77 0.00 0.00 58.65 59.64 3huu h GLN 135 Cb 0.14 -0.16 -0.04 0.00 0.21 0.00 0.00 27.48 27.63 3huu h GLN 135 CO -0.03 0.54 0.51 -0.92 -1.93 0.00 0.00 178.83 177.00 3huu h TYR 136 N 0.77 0.99 -0.36 3.99 3.20 -0.74 -0.20 116.97 124.62 3huu h TYR 136 Ca 0.20 0.02 -0.14 0.00 3.14 0.00 0.00 58.73 61.95 3huu h TYR 136 Cb -0.03 -0.33 -0.01 0.00 1.54 0.00 0.00 36.73 37.90 3huu h TYR 136 CO -0.03 0.63 -0.33 -0.07 -1.64 0.00 0.00 178.16 176.72 3huu h LEU 137 N 1.06 0.85 -0.86 2.82 3.38 -0.89 -2.78 115.31 118.87 3huu h LEU 137 Ca 0.28 -0.36 -0.02 0.00 0.09 0.00 0.00 57.88 57.87 3huu h LEU 137 Cb -0.10 -0.24 -0.04 0.00 0.09 0.00 0.00 40.66 40.37 3huu h LEU 137 CO -0.06 1.10 0.46 0.22 0.09 0.00 0.00 178.44 180.25 3huu h TYR 138 N 0.68 1.20 0.00 1.13 3.20 -0.14 -2.13 116.97 120.90 3huu h TYR 138 Ca 0.07 -0.04 0.00 0.00 3.14 0.00 0.00 58.73 61.90 3huu h TYR 138 Cb 0.88 -0.38 0.00 0.00 1.54 0.00 0.00 36.73 38.77 3huu h TYR 138 CO 0.05 0.84 0.00 0.45 -1.64 0.00 0.00 178.16 177.86 3huu h HIS 139 N 1.21 0.00 0.00 -3.82 3.86 -0.85 -1.65 115.15 113.90 3huu h HIS 139 Ca 0.30 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.51 3huu h HIS 139 Cb 0.05 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.52 3huu h HIS 139 CO 0.01 0.00 -0.09 1.28 0.86 0.00 0.00 177.93 179.99 3huu n LEU 140 N -2.98 0.80 0.00 2.43 4.77 -0.85 -4.90 117.00 116.28 3huu n LEU 140 Ca 0.00 0.53 0.00 0.00 -0.03 0.00 0.00 56.01 56.51 3huu n LEU 140 Cb 0.27 -0.30 0.00 0.00 -2.33 0.00 0.00 43.42 41.07 3huu n LEU 140 CO 0.26 -0.16 0.00 0.61 -1.33 0.00 0.00 177.39 176.76 3huu n GLY 141 N 1.31 1.02 3.75 -0.72 0.00 -0.62 -4.44 105.19 105.50 3huu n GLY 141 Ca 0.05 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.66 3huu n GLY 141 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3huu s HIS 142 N -1.99 3.45 0.00 1.61 3.76 -0.90 -4.91 115.29 116.31 3huu s HIS 142 Ca 0.00 1.54 0.00 0.00 -0.15 0.00 0.00 55.06 56.45 3huu s HIS 142 Cb 0.00 -3.40 0.00 0.00 1.11 0.00 0.00 32.58 30.29 3huu s HIS 142 CO 0.00 -1.00 0.00 0.54 -0.85 0.00 0.00 174.74 173.43 3huu n ARG 143 N 1.79 3.09 -3.81 1.40 5.12 -1.26 -4.34 116.66 118.66 3huu n ARG 143 Ca 0.02 0.00 -0.32 0.00 -1.93 0.00 0.00 57.85 55.61 3huu n ARG 143 Cb 0.44 -0.70 -0.11 0.00 -1.16 0.00 0.00 32.46 30.94 3huu n ARG 143 CO 0.00 0.00 0.00 -1.01 -1.93 0.00 0.00 177.63 174.69 3huu s HIS 144 N -0.94 3.50 -0.17 -1.55 3.76 -1.26 -4.27 115.29 114.36 3huu s HIS 144 Ca 0.00 -3.07 -0.06 0.00 -0.15 0.00 0.00 55.06 51.78 3huu s HIS 144 Cb 0.00 -2.98 -0.04 0.00 1.11 0.00 0.00 32.58 30.67 3huu s HIS 144 CO 0.00 -0.71 0.02 0.42 -0.85 0.00 0.00 174.74 173.62 3huu s ILE 145 N -0.79 4.46 -0.13 0.60 1.01 -1.26 -1.41 121.20 123.68 3huu s ILE 145 Ca 0.21 -0.15 -0.02 0.00 0.00 0.00 0.00 60.65 60.69 3huu s ILE 145 Cb -0.15 -2.99 -0.02 0.00 0.01 0.00 0.00 42.46 39.31 3huu s ILE 145 CO -0.08 0.48 -0.07 -0.22 0.00 0.00 0.00 174.94 175.05 3huu s LEU 146 N 0.34 3.08 -0.24 2.97 2.96 -0.85 -4.19 118.68 122.74 3huu s LEU 146 Ca 0.01 -0.16 -0.07 0.00 -0.22 0.00 0.00 54.13 53.68 3huu s LEU 146 Cb -0.13 -1.71 -0.03 0.00 0.50 0.00 0.00 46.19 44.82 3huu s LEU 146 CO 0.01 0.21 0.05 0.12 -1.32 0.00 0.00 176.35 175.42 3huu s PHE 147 N 0.12 3.07 -0.28 5.38 5.36 -0.45 0.16 117.98 131.34 3huu s PHE 147 Ca -0.03 -0.50 -0.11 0.00 -0.96 0.00 0.00 56.93 55.33 3huu s PHE 147 Cb -0.14 -2.22 -0.05 0.00 -0.34 0.00 0.00 43.02 40.27 3huu s PHE 147 CO 0.03 -0.38 0.20 -0.51 -1.46 0.00 0.00 175.22 173.11 3huu s LEU 148 N 1.59 4.02 -0.16 6.12 1.43 0.17 -0.75 118.68 131.10 3huu s LEU 148 Ca 0.06 0.02 -0.07 0.00 -1.03 0.00 0.00 54.13 53.11 3huu s LEU 148 Cb -0.15 -2.14 -0.04 0.00 0.03 0.00 0.00 46.19 43.89 3huu s LEU 148 CO 0.03 -0.06 0.07 -1.58 0.23 0.00 0.00 176.35 175.04 3huu s GLN 149 N 1.77 3.80 0.34 1.70 0.74 0.21 -1.27 119.66 126.96 3huu s GLN 149 Ca 0.08 -0.31 -0.27 0.00 0.05 0.00 0.00 55.36 54.90 3huu s GLN 149 Cb -0.16 -3.17 -0.09 0.00 1.10 0.00 0.00 33.01 30.68 3huu s GLN 149 CO 0.11 0.40 1.13 -1.83 -0.55 0.00 0.00 175.29 174.54 3huu s GLU 150 N 0.03 4.38 1.13 1.67 -1.05 -1.26 -0.87 118.70 122.72 3huu s GLU 150 Ca 0.06 1.80 -0.15 0.00 -0.15 0.00 0.00 54.97 56.53 3huu s GLU 150 Cb -0.12 -2.93 0.20 0.00 -0.44 0.00 0.00 34.13 30.84 3huu s GLU 150 CO 0.01 -0.02 0.60 0.45 0.95 0.00 0.00 175.26 177.24 3huu n SER 151 N 0.64 -1.90 0.00 0.83 2.88 -1.12 -4.82 113.62 110.12 3huu n SER 151 Ca 0.01 -0.09 0.00 0.00 -1.33 0.00 0.00 58.87 57.47 3huu n SER 151 Cb 0.46 -1.15 0.00 0.00 -0.75 0.00 0.00 64.21 62.76 3huu n SER 151 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3huu n GLY 152 N 1.39 1.58 0.48 0.46 0.00 -1.26 -4.84 105.19 103.00 3huu n GLY 152 Ca 0.03 -2.03 0.07 0.00 0.00 0.00 0.00 46.02 44.09 3huu n GLY 152 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 3huu n HIS 153 N 1.40 0.25 -2.08 1.61 8.25 -1.26 -4.99 115.22 118.40 3huu n HIS 153 Ca 0.00 -1.22 -0.40 0.00 -0.26 0.00 0.00 57.72 55.84 3huu n HIS 153 Cb 0.00 -0.24 -0.01 0.00 1.12 0.00 0.00 29.99 30.85 3huu n HIS 153 CO 0.00 0.00 0.00 0.71 0.64 0.00 0.00 176.34 177.69 3huu s TYR 154 N -3.03 2.94 0.29 4.41 1.51 -1.26 -4.46 117.35 117.74 3huu s TYR 154 Ca 0.37 1.40 0.03 0.00 -1.01 0.00 0.00 57.07 57.86 3huu s TYR 154 Cb 0.33 -3.69 0.64 0.00 -0.11 0.00 0.00 41.96 39.14 3huu s TYR 154 CO 0.00 -1.99 1.78 0.00 -1.11 0.00 0.00 175.55 174.23 3huu h ALA 155 N 3.09 1.52 -0.17 3.71 0.00 -1.81 -2.56 119.26 123.03 3huu h ALA 155 Ca -0.49 0.07 0.03 0.00 0.00 0.00 0.00 54.91 54.52 3huu h ALA 155 Cb 1.23 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.92 3huu h ALA 155 CO 0.64 -0.02 -0.00 -0.24 0.00 0.00 0.00 179.25 179.63 3huu h VAL 156 N 0.75 0.88 -0.37 0.00 3.04 -1.92 0.15 116.25 118.78 3huu h VAL 156 Ca 0.53 -0.02 -0.06 0.00 -1.01 0.00 0.00 66.70 66.14 3huu h VAL 156 Cb 0.76 0.82 -0.02 0.00 -2.01 0.00 0.00 31.29 30.84 3huu h VAL 156 CO -0.36 0.01 -0.04 0.74 -1.01 0.00 0.00 177.57 176.91 3huu h THR 157 N 0.05 1.22 -0.19 3.17 2.02 -1.87 -2.16 112.91 115.17 3huu h THR 157 Ca 0.08 -0.93 -0.06 0.00 0.77 0.00 0.00 66.41 66.27 3huu h THR 157 Cb 0.10 0.98 -0.00 0.00 -1.74 0.00 0.00 68.15 67.48 3huu h THR 157 CO -0.14 0.32 -0.10 -0.08 0.37 0.00 0.00 175.52 175.89 3huu h GLU 158 N 0.57 0.40 -0.36 6.66 4.22 -1.06 -2.71 114.58 122.30 3huu h GLU 158 Ca 0.11 -0.18 0.04 0.00 0.08 0.00 0.00 59.36 59.41 3huu h GLU 158 Cb 0.42 -0.01 -0.04 0.00 0.50 0.00 0.00 28.75 29.62 3huu h GLU 158 CO 0.02 0.71 0.14 -0.44 -2.18 0.00 0.00 179.01 177.26 3huu h ASP 159 N 0.09 0.16 -0.61 1.04 3.32 -0.43 -2.04 116.42 117.94 3huu h ASP 159 Ca 0.04 0.03 -0.05 0.00 0.02 0.00 0.00 57.03 57.08 3huu h ASP 159 Cb 0.60 0.01 -0.03 0.00 0.22 0.00 0.00 39.33 40.13 3huu h ASP 159 CO 0.03 0.13 0.20 0.03 -1.72 0.00 0.00 179.24 177.91 3huu h ARG 160 N 0.29 0.98 -0.56 3.56 3.08 -1.39 -1.45 114.38 118.89 3huu h ARG 160 Ca 0.16 -0.19 -0.09 0.00 0.07 0.00 0.00 59.98 59.93 3huu h ARG 160 Cb 0.12 -0.15 -0.02 0.00 0.08 0.00 0.00 29.97 30.00 3huu h ARG 160 CO -0.15 0.84 -0.01 0.66 -1.07 0.00 0.00 179.97 180.24 3huu h SER 161 N 0.95 0.95 -0.71 7.04 4.64 -1.26 -1.61 113.55 123.55 3huu h SER 161 Ca 0.21 -0.26 -0.04 0.00 -0.47 0.00 0.00 61.79 61.23 3huu h SER 161 Cb 0.27 -0.26 -0.03 0.00 -0.31 0.00 0.00 62.40 62.07 3huu h SER 161 CO -0.01 1.01 0.29 0.58 -0.87 0.00 0.00 176.83 177.83 3huu h VAL 162 N 0.90 1.25 -0.28 0.95 2.07 -0.92 0.10 116.25 120.32 3huu h VAL 162 Ca 0.16 -0.78 -0.15 0.00 0.82 0.00 0.00 66.70 66.75 3huu h VAL 162 Cb 0.53 0.38 -0.01 0.00 -1.52 0.00 0.00 31.29 30.67 3huu h VAL 162 CO 0.03 0.31 -0.45 1.23 0.02 0.00 0.00 177.57 178.71 3huu h GLY 163 N 1.11 0.78 0.76 2.17 0.00 -1.00 -0.02 103.07 106.87 3huu h GLY 163 Ca 0.24 -0.83 -0.00 0.00 0.00 0.00 0.00 47.33 46.74 3huu h GLY 163 CO -0.02 0.75 -0.02 -2.75 0.00 0.00 0.00 176.54 174.50 3huu h PHE 164 N 0.58 -0.05 -0.40 5.60 3.57 -1.03 -1.83 116.94 123.38 3huu h PHE 164 Ca 0.04 -0.00 -0.03 0.00 3.53 0.00 0.00 57.97 61.50 3huu h PHE 164 Cb 1.00 0.02 -0.02 0.00 2.79 0.00 0.00 35.95 39.74 3huu h PHE 164 CO 0.05 0.20 0.11 0.87 -2.23 0.00 0.00 178.31 177.30 3huu h LYS 165 N -0.30 0.59 -0.59 1.11 1.57 -0.94 -1.98 116.57 116.02 3huu h LYS 165 Ca -0.01 -0.10 -0.06 0.00 -1.87 0.00 0.00 60.65 58.62 3huu h LYS 165 Cb 0.27 -0.10 -0.02 0.00 0.08 0.00 0.00 32.23 32.46 3huu h LYS 165 CO 0.01 0.54 0.13 0.37 -0.57 0.00 0.00 179.45 179.92 3huu h GLN 166 N 0.58 0.96 0.15 3.15 4.15 -0.83 -1.83 115.11 121.45 3huu h GLN 166 Ca 0.14 -0.24 -0.01 0.00 0.77 0.00 0.00 58.65 59.31 3huu h GLN 166 Cb 0.21 -0.12 0.00 0.00 0.21 0.00 0.00 27.48 27.78 3huu h GLN 166 CO -0.00 0.89 -0.07 -0.92 -1.93 0.00 0.00 178.83 176.80 3huu h TYR 167 N 0.87 -0.19 -1.00 3.99 3.20 -0.87 -1.81 116.97 121.17 3huu h TYR 167 Ca 0.18 -0.00 0.19 0.00 3.14 0.00 0.00 58.73 62.24 3huu h TYR 167 Cb 0.38 0.06 -0.10 0.00 1.54 0.00 0.00 36.73 38.60 3huu h TYR 167 CO 0.03 0.12 0.61 0.00 -1.64 0.00 0.00 178.16 177.28 3huu h ASP 169 N 0.75 0.32 -0.95 0.00 1.82 -1.23 0.81 116.42 117.93 3huu h ASP 169 Ca 0.58 -0.30 0.09 0.00 -0.39 0.00 0.00 57.03 57.00 3huu h ASP 169 Cb 0.92 -0.08 -0.07 0.00 0.68 0.00 0.00 39.33 40.78 3huu h ASP 169 CO -0.37 0.54 0.61 0.44 -1.61 0.00 0.00 179.24 178.86 3huu h ASP 170 N 0.08 0.92 -0.53 2.28 3.32 -0.07 -2.46 116.42 119.95 3huu h ASP 170 Ca 0.05 0.02 0.00 0.00 0.02 0.00 0.00 57.03 57.12 3huu h ASP 170 Cb 0.38 -0.17 0.00 0.00 0.22 0.00 0.00 39.33 39.76 3huu h ASP 170 CO 0.01 0.55 0.00 1.33 -1.72 0.00 0.00 179.24 179.41 3huu n VAL 171 N -4.53 0.96 -3.44 -1.35 0.24 -0.54 -5.01 118.33 104.67 3huu n VAL 171 Ca 0.16 -0.98 -0.22 0.00 -2.04 0.00 0.00 64.34 61.26 3huu n VAL 171 Cb 0.26 0.53 0.06 0.00 -1.47 0.00 0.00 33.84 33.22 3huu n VAL 171 CO 0.00 0.00 0.00 0.29 -2.14 0.00 0.00 176.83 174.98 3huu n LYS 172 N 1.11 -2.12 -4.43 7.34 4.76 0.07 -5.04 118.16 119.86 3huu n LYS 172 Ca 0.18 0.70 -0.21 0.00 -2.87 0.00 0.00 58.31 56.11 3huu n LYS 172 Cb 0.53 -5.16 -0.10 0.00 -1.84 0.00 0.00 35.03 28.45 3huu n LYS 172 CO 0.00 0.00 0.00 0.96 -1.37 0.00 0.00 177.40 176.99 3huu s ILE 173 N -3.43 1.34 0.64 -0.18 -4.36 -0.02 -5.03 121.20 110.16 3huu s ILE 173 Ca 0.43 -2.04 -0.18 0.00 -0.26 0.00 0.00 60.65 58.60 3huu s ILE 173 Cb -0.10 -2.62 -0.01 0.00 1.25 0.00 0.00 42.46 40.98 3huu s ILE 173 CO 0.79 -0.15 1.24 -0.94 0.24 0.00 0.00 174.94 176.12 3huu s SER 174 N -3.45 4.79 -0.33 4.36 1.04 -1.26 -4.55 113.70 114.30 3huu s SER 174 Ca 0.33 2.47 0.11 0.00 0.48 0.00 0.00 55.95 59.34 3huu s SER 174 Cb 0.07 -2.60 0.46 0.00 0.10 0.00 0.00 66.02 64.04 3huu s SER 174 CO 0.13 -1.87 1.12 -0.46 0.98 0.00 0.00 173.24 173.15 3huu n ASN 175 N -1.91 3.81 -4.65 7.02 6.94 -1.26 -4.67 115.26 120.53 3huu n ASN 175 Ca 0.14 -3.29 -0.49 0.00 -0.02 0.00 0.00 54.58 50.92 3huu n ASN 175 Cb 0.49 -0.42 -0.05 0.00 -2.36 0.00 0.00 39.78 37.44 3huu n ASN 175 CO 0.00 0.00 0.00 0.47 -1.03 0.00 0.00 177.26 176.70 3huu n ASP 176 N -0.55 3.16 -3.91 0.53 9.92 -1.26 -4.93 116.55 119.52 3huu n ASP 176 Ca 0.31 0.87 -0.30 0.00 -0.53 0.00 0.00 54.79 55.15 3huu n ASP 176 Cb 0.83 -1.34 -0.16 0.00 -0.64 0.00 0.00 41.12 39.82 3huu n ASP 176 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 3huu s VAL 178 N 1.51 2.77 -0.25 0.00 1.01 0.07 -4.98 120.40 120.53 3huu s VAL 178 Ca -0.03 -0.79 -0.16 0.00 0.00 0.00 0.00 61.98 60.99 3huu s VAL 178 Cb -0.17 -2.10 -0.03 0.00 0.00 0.00 0.00 36.38 34.07 3huu s VAL 178 CO -0.07 0.56 0.42 -0.69 0.00 0.00 0.00 175.10 175.32 3huu s VAL 179 N -0.07 5.15 -0.34 2.92 1.01 -1.26 0.66 120.40 128.47 3huu s VAL 179 Ca -0.04 0.70 -0.13 0.00 0.00 0.00 0.00 61.98 62.52 3huu s VAL 179 Cb -0.14 -3.75 -0.02 0.00 0.00 0.00 0.00 36.38 32.48 3huu s VAL 179 CO 0.04 0.17 0.25 -0.63 0.00 0.00 0.00 175.10 174.92 3huu s ILE 180 N 1.90 5.28 -0.20 2.22 -1.09 -0.05 -4.94 121.20 124.32 3huu s ILE 180 Ca 0.18 -0.21 0.20 0.00 -2.23 0.00 0.00 60.65 58.60 3huu s ILE 180 Cb -0.15 -3.72 -0.03 0.00 -1.58 0.00 0.00 42.46 36.98 3huu s ILE 180 CO 0.09 -0.02 1.01 0.11 -1.23 0.00 0.00 174.94 174.90 3huu h LYS 181 N 8.49 0.00 -3.02 2.79 6.56 -1.94 -2.96 116.57 126.50 3huu h LYS 181 Ca -0.31 0.00 0.05 0.00 -1.06 0.00 0.00 60.65 59.33 3huu h LYS 181 Cb 1.16 0.00 -0.06 0.00 -0.57 0.00 0.00 32.23 32.75 3huu h LYS 181 CO 0.64 0.10 0.22 -1.54 -2.06 0.00 0.00 179.45 176.81 3huu s SER 182 N -5.56 -0.31 0.39 0.86 1.04 -1.26 -4.94 113.70 103.93 3huu s SER 182 Ca -0.01 -0.51 0.08 0.00 0.48 0.00 0.00 55.95 56.00 3huu s SER 182 Cb 0.09 0.70 0.80 0.00 0.10 0.00 0.00 66.02 67.71 3huu s SER 182 CO 0.79 -1.28 1.95 -0.03 0.98 0.00 0.00 173.24 175.66 3huu h MET 183 N 2.01 0.34 -0.10 4.02 1.85 -1.99 -1.24 114.93 119.81 3huu h MET 183 Ca -0.22 -0.06 -0.18 0.00 -0.61 0.00 0.00 59.70 58.64 3huu h MET 183 Cb 1.26 -0.06 -0.00 0.00 0.43 0.00 0.00 31.60 33.23 3huu h MET 183 CO 0.26 0.38 -0.68 -0.91 -0.40 0.00 0.00 176.91 175.56 3huu h ASN 184 N 0.33 0.51 0.14 1.39 2.35 -2.00 -2.13 115.58 116.17 3huu h ASN 184 Ca 0.08 -0.32 -0.08 0.00 -0.55 0.00 0.00 56.30 55.43 3huu h ASN 184 Cb 0.25 -0.15 -0.01 0.00 0.05 0.00 0.00 38.32 38.46 3huu h ASN 184 CO 0.01 1.04 -0.27 0.44 -1.65 0.00 0.00 177.43 177.00 3huu h ASP 185 N 0.31 0.23 -0.06 5.81 5.19 -1.72 -2.30 116.42 123.87 3huu h ASP 185 Ca -0.02 -0.07 -0.02 0.00 -0.62 0.00 0.00 57.03 56.30 3huu h ASP 185 Cb 1.25 -0.06 -0.00 0.00 0.18 0.00 0.00 39.33 40.69 3huu h ASP 185 CO 0.12 0.51 -0.04 0.25 -3.12 0.00 0.00 179.24 176.96 3huu h LEU 186 N 0.21 0.14 -0.38 1.55 6.46 -0.96 -1.87 115.31 120.45 3huu h LEU 186 Ca 0.03 -0.44 0.02 0.00 -0.12 0.00 0.00 57.88 57.36 3huu h LEU 186 Cb 0.60 -0.04 -0.03 0.00 -0.73 0.00 0.00 40.66 40.46 3huu h LEU 186 CO 0.04 0.56 0.22 0.03 -0.62 0.00 0.00 178.44 178.67 3huu h ARG 187 N -0.27 0.44 -0.30 1.25 3.08 -1.25 -2.06 114.38 115.27 3huu h ARG 187 Ca 0.01 -0.03 -0.05 0.00 0.07 0.00 0.00 59.98 59.98 3huu h ARG 187 Cb 0.51 -0.10 -0.02 0.00 0.08 0.00 0.00 29.97 30.44 3huu h ARG 187 CO 0.01 0.29 -0.05 -0.44 -1.07 0.00 0.00 179.97 178.71 3huu h ASP 188 N 0.45 0.45 0.67 7.04 3.32 -1.45 0.03 116.42 126.93 3huu h ASP 188 Ca 0.15 -0.09 0.00 0.00 0.02 0.00 0.00 57.03 57.11 3huu h ASP 188 Cb 0.01 -0.12 0.00 0.00 0.22 0.00 0.00 39.33 39.44 3huu h ASP 188 CO -0.07 0.55 0.00 0.15 -1.72 0.00 0.00 179.24 178.15 3huu h PHE 189 N 0.45 0.00 0.00 4.55 3.57 -0.70 -3.51 116.94 121.29 3huu h PHE 189 Ca 0.09 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.59 3huu h PHE 189 Cb 0.38 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.12 3huu h PHE 189 CO 0.01 0.00 0.00 -0.89 -2.23 0.00 0.00 178.31 175.20 3huu n ILE 190 N -2.32 0.00 0.00 1.41 5.41 -0.01 -5.08 119.36 118.77 3huu n ILE 190 Ca 0.02 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.77 3huu n ILE 190 Cb 0.22 0.00 0.00 0.00 -0.71 0.00 0.00 39.64 39.15 3huu n ILE 190 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 3huu n HIS 199 N 13.16 0.00 -2.08 1.39 -0.00 -1.26 -4.85 115.22 121.59 3huu n HIS 199 Ca 0.00 0.00 -0.33 0.00 -0.00 0.00 0.00 57.72 57.39 3huu n HIS 199 Cb 0.00 -0.23 0.01 0.00 -0.00 0.00 0.00 29.99 29.77 3huu n HIS 199 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 3huu s MET 200 N 0.00 3.35 0.84 -1.40 0.00 -1.26 -5.02 119.30 115.81 3huu s MET 200 Ca 0.00 1.21 -0.11 0.00 0.00 0.00 0.00 55.69 56.79 3huu s MET 200 Cb 0.00 -2.04 0.10 0.00 0.00 0.00 0.00 34.83 32.89 3huu s MET 200 CO 0.00 -0.79 1.14 -1.25 0.00 0.00 0.00 175.02 174.12 3huu s PRO 201 N -4.02 1.60 0.26 3.16 0.04 -1.26 -4.95 135.00 129.83 3huu s PRO 201 Ca 0.64 1.45 0.23 0.00 0.04 0.00 0.00 61.00 63.36 3huu s PRO 201 Cb -0.16 -1.80 0.12 0.00 0.04 0.00 0.00 34.50 32.70 3huu s PRO 201 CO 0.36 -2.18 1.22 0.66 0.04 0.00 0.00 177.00 177.10 3huu h SER 202 N -1.39 0.00 -4.54 6.66 4.64 -1.62 -3.46 113.55 113.84 3huu h SER 202 Ca -0.44 -0.01 -0.08 0.00 -0.47 0.00 0.00 61.79 60.79 3huu h SER 202 Cb 1.26 0.00 -0.21 0.00 -0.31 0.00 0.00 62.40 63.14 3huu h SER 202 CO 0.46 0.01 0.01 0.54 -0.87 0.00 0.00 176.83 176.98 3huu s VAL 203 N -3.31 0.01 -0.07 0.95 0.11 -1.24 -1.76 120.40 115.10 3huu s VAL 203 Ca 0.02 -0.09 0.04 0.00 -2.93 0.00 0.00 61.98 59.02 3huu s VAL 203 Cb 0.09 -0.85 0.00 0.00 -1.53 0.00 0.00 36.38 34.09 3huu s VAL 203 CO 0.75 -0.05 -0.20 -0.63 -3.33 0.00 0.00 175.10 171.64 3huu s ILE 204 N -0.57 1.74 -0.14 7.04 1.01 -0.21 -2.01 121.20 128.07 3huu s ILE 204 Ca -0.07 -0.86 -0.05 0.00 0.00 0.00 0.00 60.65 59.67 3huu s ILE 204 Cb -0.03 -1.51 -0.04 0.00 0.01 0.00 0.00 42.46 40.90 3huu s ILE 204 CO 0.05 0.49 0.05 -0.63 0.00 0.00 0.00 174.94 174.90 3huu s ILE 205 N 0.25 4.73 -0.07 2.92 1.01 0.12 -1.66 121.20 128.51 3huu s ILE 205 Ca -0.12 -0.07 0.03 0.00 0.00 0.00 0.00 60.65 60.48 3huu s ILE 205 Cb -0.15 -3.07 -0.02 0.00 0.01 0.00 0.00 42.46 39.22 3huu s ILE 205 CO 0.06 0.54 -0.13 0.42 0.00 0.00 0.00 174.94 175.82 3huu s THR 206 N -0.27 3.15 0.07 2.92 -4.23 -0.46 0.46 115.64 117.27 3huu s THR 206 Ca 0.08 -0.68 0.31 0.00 -1.18 0.00 0.00 61.69 60.22 3huu s THR 206 Cb -0.12 -2.26 0.33 0.00 1.34 0.00 0.00 72.50 71.79 3huu s THR 206 CO 0.02 0.58 1.95 0.77 -0.54 0.00 0.00 174.62 177.40 3huu h SER 207 N 5.56 0.00 -4.92 3.99 4.64 -1.52 -3.26 113.55 118.05 3huu h SER 207 Ca -0.43 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 60.88 3huu h SER 207 Cb 1.16 0.00 -0.14 0.00 -0.31 0.00 0.00 62.40 63.11 3huu h SER 207 CO 0.51 0.00 0.26 -0.62 -0.87 0.00 0.00 176.83 176.11 3huu s ASP 208 N -4.71 -0.55 0.32 4.97 2.15 -1.26 -4.49 116.67 113.09 3huu s ASP 208 Ca -0.01 0.17 0.03 0.00 0.43 0.00 0.00 52.55 53.17 3huu s ASP 208 Cb 0.09 0.55 0.63 0.00 -0.30 0.00 0.00 42.92 43.89 3huu s ASP 208 CO 0.36 -0.82 1.91 -0.37 -0.17 0.00 0.00 175.17 176.08 3huu h VAL 209 N 2.24 1.00 -0.41 1.11 -1.51 -1.87 -0.83 116.25 115.97 3huu h VAL 209 Ca -0.30 -0.31 -0.13 0.00 -1.23 0.00 0.00 66.70 64.73 3huu h VAL 209 Cb 1.26 0.01 -0.01 0.00 -2.13 0.00 0.00 31.29 30.42 3huu h VAL 209 CO 0.37 0.17 -0.24 0.24 -1.23 0.00 0.00 177.57 176.88 3huu h MET 210 N 0.91 0.89 -0.20 5.19 2.86 -1.94 0.62 114.93 123.27 3huu h MET 210 Ca 0.40 -0.41 -0.10 0.00 -2.06 0.00 0.00 59.70 57.53 3huu h MET 210 Cb 0.34 -0.02 -0.01 0.00 0.06 0.00 0.00 31.60 31.97 3huu h MET 210 CO -0.16 1.06 -0.32 1.25 1.06 0.00 0.00 176.91 179.79 3huu h LEU 211 N 0.71 0.41 -0.81 1.22 5.85 -1.92 -2.62 115.31 118.15 3huu h LEU 211 Ca 0.09 -0.15 -0.04 0.00 0.84 0.00 0.00 57.88 58.62 3huu h LEU 211 Cb 0.81 -0.11 -0.04 0.00 0.37 0.00 0.00 40.66 41.69 3huu h LEU 211 CO 0.07 0.72 0.36 -1.13 -0.34 0.00 0.00 178.44 178.12 3huu h ASN 212 N 0.35 1.08 -0.54 1.25 -1.24 -0.54 -1.57 115.58 114.37 3huu h ASN 212 Ca 0.04 -0.15 0.05 0.00 0.71 0.00 0.00 56.30 56.95 3huu h ASN 212 Cb 0.74 -0.28 -0.05 0.00 0.73 0.00 0.00 38.32 39.47 3huu h ASN 212 CO 0.06 0.93 0.28 0.24 -1.29 0.00 0.00 177.43 177.65 3huu h MET 213 N 1.16 0.52 -0.51 6.67 2.86 -0.52 -1.06 114.93 124.05 3huu h MET 213 Ca 0.27 -0.03 -0.04 0.00 -2.06 0.00 0.00 59.70 57.84 3huu h MET 213 Cb 0.16 -0.12 -0.02 0.00 0.06 0.00 0.00 31.60 31.68 3huu h MET 213 CO -0.03 0.35 0.14 1.96 1.06 0.00 0.00 176.91 180.38 3huu h GLN 214 N 0.54 0.76 -0.32 1.72 4.20 -1.27 -2.11 115.11 118.64 3huu h GLN 214 Ca 0.24 -0.14 -0.05 0.00 0.06 0.00 0.00 58.65 58.76 3huu h GLN 214 Cb 0.14 -0.12 -0.01 0.00 0.30 0.00 0.00 27.48 27.79 3huu h GLN 214 CO -0.16 0.68 0.00 1.25 -0.67 0.00 0.00 178.83 179.93 3huu h LEU 215 N 0.74 0.55 -1.41 1.46 5.85 -0.52 -2.12 115.31 119.85 3huu h LEU 215 Ca 0.17 -0.31 -0.04 0.00 0.84 0.00 0.00 57.88 58.54 3huu h LEU 215 Cb 0.25 -0.15 -0.01 0.00 0.37 0.00 0.00 40.66 41.12 3huu h LEU 215 CO -0.00 0.72 -0.04 -0.07 -0.34 0.00 0.00 178.44 178.71 3huu h LEU 216 N 0.36 0.31 -0.22 2.25 3.38 -0.94 -0.27 115.31 120.18 3huu h LEU 216 Ca 0.09 -0.05 -0.03 0.00 0.09 0.00 0.00 57.88 57.98 3huu h LEU 216 Cb 0.44 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 41.10 3huu h LEU 216 CO 0.02 0.40 0.01 -1.13 0.09 0.00 0.00 178.44 177.83 3huu h ASN 217 N 0.33 0.37 -0.47 -0.43 -0.73 -1.17 -1.94 115.58 111.54 3huu h ASN 217 Ca 0.07 -0.30 -0.08 0.00 1.87 0.00 0.00 56.30 57.86 3huu h ASN 217 Cb 0.28 -0.10 -0.02 0.00 0.27 0.00 0.00 38.32 38.76 3huu h ASN 217 CO 0.01 0.57 -0.04 0.58 -0.37 0.00 0.00 177.43 178.19 3huu h VAL 218 N 0.15 1.27 -0.75 2.57 2.07 -0.99 -1.16 116.25 119.42 3huu h VAL 218 Ca 0.06 -1.12 -0.03 0.00 0.82 0.00 0.00 66.70 66.44 3huu h VAL 218 Cb 0.38 1.05 -0.03 0.00 -1.52 0.00 0.00 31.29 31.16 3huu h VAL 218 CO 0.01 0.39 0.35 -0.07 0.02 0.00 0.00 177.57 178.27 3huu h LEU 219 N 0.70 0.97 -0.87 2.57 3.38 -1.04 -1.73 115.31 119.29 3huu h LEU 219 Ca 0.13 -0.11 -0.07 0.00 0.09 0.00 0.00 57.88 57.91 3huu h LEU 219 Cb 0.56 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 41.03 3huu h LEU 219 CO 0.03 0.83 0.04 0.22 0.09 0.00 0.00 178.44 179.65 3huu h TYR 220 N 1.06 0.94 -0.56 1.13 3.20 -1.07 0.15 116.97 121.82 3huu h TYR 220 Ca 0.26 -0.13 -0.03 0.00 3.14 0.00 0.00 58.73 61.98 3huu h TYR 220 Cb 0.12 -0.26 -0.02 0.00 1.54 0.00 0.00 36.73 38.10 3huu h TYR 220 CO 0.01 0.83 0.24 1.49 -1.64 0.00 0.00 178.16 179.09 3huu h GLU 221 N 0.83 0.82 -0.60 1.82 4.81 -0.46 -2.22 114.58 119.58 3huu h GLU 221 Ca 0.16 -0.14 0.00 0.00 -0.13 0.00 0.00 59.36 59.26 3huu h GLU 221 Cb 0.43 -0.14 0.00 0.00 0.63 0.00 0.00 28.75 29.67 3huu h GLU 221 CO 0.02 0.70 0.00 0.66 -0.73 0.00 0.00 179.01 179.65 3huu n TYR 222 N -4.52 0.81 -3.71 0.92 4.02 -0.72 -4.93 117.16 109.02 3huu n TYR 222 Ca 0.03 -0.32 -0.27 0.00 -0.01 0.00 0.00 57.90 57.33 3huu n TYR 222 Cb 0.15 -0.17 0.04 0.00 -0.02 0.00 0.00 39.34 39.34 3huu n TYR 222 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 176.86 176.89 3huu n GLN 223 N 0.46 -6.06 -3.29 -0.72 6.02 -0.66 -4.97 117.38 108.16 3huu n GLN 223 Ca 0.14 0.68 -0.43 0.00 -0.01 0.00 0.00 57.00 57.38 3huu n GLN 223 Cb 0.54 -5.61 -0.08 0.00 1.02 0.00 0.00 30.24 26.11 3huu n GLN 223 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 3huu s LEU 224 N -7.20 4.96 0.41 1.08 1.43 0.45 -5.00 118.68 114.81 3huu s LEU 224 Ca 0.60 -0.78 -0.24 0.00 -1.03 0.00 0.00 54.13 52.68 3huu s LEU 224 Cb -0.29 -2.39 -0.09 0.00 0.03 0.00 0.00 46.19 43.45 3huu s LEU 224 CO 0.74 -0.66 1.06 -0.60 0.23 0.00 0.00 176.35 177.12 3huu s ARG 225 N 2.21 4.09 -0.08 1.70 6.06 -1.26 -4.47 118.95 127.19 3huu s ARG 225 Ca 0.12 1.53 0.05 0.00 -2.50 0.00 0.00 55.73 54.93 3huu s ARG 225 Cb -0.18 -2.49 -0.01 0.00 0.06 0.00 0.00 34.95 32.33 3huu s ARG 225 CO 0.13 -0.22 -0.24 0.42 -2.50 0.00 0.00 175.30 172.90 3huu s ILE 226 N -1.67 2.14 -2.28 4.11 1.01 -1.26 -0.12 121.20 123.12 3huu s ILE 226 Ca 0.59 -1.02 0.28 0.00 0.00 0.00 0.00 60.65 60.51 3huu s ILE 226 Cb -0.22 -1.80 0.51 0.00 0.01 0.00 0.00 42.46 40.96 3huu s ILE 226 CO 0.28 0.56 1.75 -0.81 0.00 0.00 0.00 174.94 176.72 3huu n PRO 227 N 3.21 1.41 -0.11 2.79 -0.04 -1.26 -4.78 135.00 136.23 3huu n PRO 227 Ca -0.18 -0.77 -0.13 0.00 -0.04 0.00 0.00 63.50 62.37 3huu n PRO 227 Cb 0.52 -1.48 -0.09 0.00 -0.04 0.00 0.00 33.50 32.41 3huu n PRO 227 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 3huu h GLU 228 N 1.89 -0.38 0.03 0.54 3.07 -1.95 -3.05 114.58 114.73 3huu h GLU 228 Ca 0.00 0.03 -0.26 0.00 -0.50 0.00 0.00 59.36 58.62 3huu h GLU 228 Cb 0.46 0.09 -0.03 0.00 -0.84 0.00 0.00 28.75 28.43 3huu h GLU 228 CO 0.00 -0.25 -1.39 -0.44 -1.40 0.00 0.00 179.01 175.53 3huu h ASP 229 N -0.40 0.10 -4.79 1.42 3.32 -0.88 -3.48 116.42 111.72 3huu h ASP 229 Ca 0.06 -0.14 -0.02 0.00 0.02 0.00 0.00 57.03 56.95 3huu h ASP 229 Cb 0.56 -0.03 -0.19 0.00 0.22 0.00 0.00 39.33 39.89 3huu h ASP 229 CO -0.53 1.12 0.29 -0.51 -1.72 0.00 0.00 179.24 177.89 3huu s ILE 230 N -2.65 0.00 0.26 0.35 2.07 -0.78 -4.96 121.20 115.50 3huu s ILE 230 Ca -0.04 0.00 0.08 0.00 -1.41 0.00 0.00 60.65 59.29 3huu s ILE 230 Cb 0.08 -1.00 -0.04 0.00 0.13 0.00 0.00 42.46 41.64 3huu s ILE 230 CO 0.83 0.00 0.10 -1.10 -1.91 0.00 0.00 174.94 172.86 3huu s GLN 231 N -1.53 2.63 0.05 3.50 -0.21 -0.72 -4.10 119.66 119.27 3huu s GLN 231 Ca -0.07 -1.23 -0.06 0.00 0.02 0.00 0.00 55.36 54.02 3huu s GLN 231 Cb -0.00 -2.37 -0.01 0.00 1.00 0.00 0.00 33.01 31.63 3huu s GLN 231 CO 0.05 0.38 0.12 0.95 -2.12 0.00 0.00 175.29 174.66 3huu s THR 232 N -2.23 0.14 0.00 -0.19 -4.23 -1.10 -1.04 115.64 106.99 3huu s THR 232 Ca 0.32 -1.15 -0.21 0.00 -1.18 0.00 0.00 61.69 59.47 3huu s THR 232 Cb -0.07 -1.06 0.04 0.00 1.34 0.00 0.00 72.50 72.75 3huu s THR 232 CO 0.23 -0.64 0.47 0.00 -0.54 0.00 0.00 174.62 174.14 3huu s ALA 233 N -3.01 -1.20 0.00 3.99 0.00 -0.66 -4.30 121.76 116.57 3huu s ALA 233 Ca -0.02 0.64 0.00 0.00 0.00 0.00 0.00 51.96 52.58 3huu s ALA 233 Cb 0.01 0.17 0.00 0.00 0.00 0.00 0.00 23.12 23.30 3huu s ALA 233 CO -0.06 -0.38 0.00 -2.37 0.00 0.00 0.00 175.76 172.95 3huu n THR 234 N 0.84 0.00 -4.25 0.00 5.66 -0.83 -1.36 114.28 114.35 3huu n THR 234 Ca -0.20 0.00 -0.29 0.00 -3.05 0.00 0.00 64.05 60.51 3huu n THR 234 Cb 0.58 0.00 -0.10 0.00 -1.55 0.00 0.00 70.33 69.26 3huu n THR 234 CO 0.00 0.00 0.00 -0.36 -3.05 0.00 0.00 175.07 171.66 3huu s PHE 235 N -3.69 2.68 -0.03 1.09 0.40 -1.23 -2.21 117.98 114.99 3huu s PHE 235 Ca 0.00 -0.19 -0.02 0.00 -0.60 0.00 0.00 56.93 56.12 3huu s PHE 235 Cb 0.00 -1.40 0.01 0.00 0.51 0.00 0.00 43.02 42.14 3huu s PHE 235 CO 0.00 0.42 0.04 -1.71 0.70 0.00 0.00 175.22 174.67 3huu n ASN 236 N 0.69 -1.89 -4.76 1.36 5.15 0.65 -3.43 115.26 113.02 3huu n ASN 236 Ca -0.14 0.23 -0.40 0.00 -0.60 0.00 0.00 54.58 53.67 3huu n ASN 236 Cb 0.53 -1.72 -0.04 0.00 -0.53 0.00 0.00 39.78 38.01 3huu n ASN 236 CO 0.00 0.00 0.00 -0.89 1.40 0.00 0.00 177.26 177.77 3huu s THR 237 N -0.14 3.57 0.12 -0.44 2.01 -1.02 -4.78 115.64 114.96 3huu s THR 237 Ca -0.04 1.52 -0.24 0.00 0.31 0.00 0.00 61.69 63.24 3huu s THR 237 Cb 0.00 -3.94 0.08 0.00 0.01 0.00 0.00 72.50 68.65 3huu s THR 237 CO 0.13 0.32 1.11 -1.54 -0.69 0.00 0.00 174.62 173.95 3huu n SER 238 N 1.02 -1.57 -0.26 3.53 3.41 -1.26 -4.91 113.62 113.59 3huu n SER 238 Ca -0.00 -1.70 0.10 0.00 -0.26 0.00 0.00 58.87 57.00 3huu n SER 238 Cb 0.46 2.52 0.35 0.00 -0.26 0.00 0.00 64.21 67.28 3huu n SER 238 CO 0.00 0.00 0.00 0.15 -0.16 0.00 0.00 175.04 175.03 3huu h PHE 239 N 1.99 0.84 -0.75 7.33 3.57 -1.98 -0.32 116.94 127.63 3huu h PHE 239 Ca -0.25 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.26 3huu h PHE 239 Cb 1.19 -0.27 -0.04 0.00 2.79 0.00 0.00 35.95 39.62 3huu h PHE 239 CO 0.00 0.36 0.44 -0.07 -2.23 0.00 0.00 178.31 176.80 3huu h LEU 240 N 0.75 0.91 0.09 0.59 3.38 -1.94 0.57 115.31 119.67 3huu h LEU 240 Ca 0.41 -0.08 -0.29 0.00 0.09 0.00 0.00 57.88 58.02 3huu h LEU 240 Cb 0.55 -0.23 0.02 0.00 0.09 0.00 0.00 40.66 41.09 3huu h LEU 240 CO -0.18 0.72 -1.24 0.71 0.09 0.00 0.00 178.44 178.55 3huu h THR 241 N 1.03 1.36 -0.05 0.22 1.35 -1.64 -1.97 112.91 113.20 3huu h THR 241 Ca 0.27 -2.65 -0.07 0.00 -0.55 0.00 0.00 66.41 63.41 3huu h THR 241 Cb -0.01 2.77 -0.01 0.00 -1.73 0.00 0.00 68.15 69.17 3huu h THR 241 CO -0.05 0.79 -0.28 -0.33 -0.25 0.00 0.00 175.52 175.41 3huu h GLU 242 N 0.20 0.08 -0.12 4.72 4.39 -0.92 0.11 114.58 123.02 3huu h GLU 242 Ca -0.17 -0.03 -0.02 0.00 0.34 0.00 0.00 59.36 59.48 3huu h GLU 242 Cb 1.92 -0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 30.55 3huu h GLU 242 CO 0.22 0.36 -0.07 0.09 -1.16 0.00 0.00 179.01 178.45 3huu n ASN 243 N -4.18 2.76 -3.72 1.42 3.02 0.18 -4.59 115.26 110.15 3huu n ASN 243 Ca -0.02 -3.25 -0.30 0.00 -0.03 0.00 0.00 54.58 50.98 3huu n ASN 243 Cb 0.35 -0.50 0.24 0.00 -0.61 0.00 0.00 39.78 39.25 3huu n ASN 243 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3huu s ALA 244 N -2.95 0.94 -0.52 5.41 0.00 -0.74 -4.88 121.76 119.01 3huu s ALA 244 Ca 0.37 -1.12 -0.00 0.00 0.00 0.00 0.00 51.96 51.21 3huu s ALA 244 Cb 0.33 -2.81 0.14 0.00 0.00 0.00 0.00 23.12 20.77 3huu s ALA 244 CO 0.03 -3.45 0.30 0.95 0.00 0.00 0.00 175.76 173.60 3huu s THR 245 N -3.24 3.18 0.42 0.00 -4.23 -1.26 -2.54 115.64 107.96 3huu s THR 245 Ca 0.73 -2.82 -0.03 0.00 -1.18 0.00 0.00 61.69 58.40 3huu s THR 245 Cb -0.06 -3.15 0.09 0.00 1.34 0.00 0.00 72.50 70.72 3huu s THR 245 CO 0.55 -0.79 0.57 -0.81 -0.54 0.00 0.00 174.62 173.60 3huu n PRO 246 N 3.68 -0.02 -1.68 3.99 -0.04 -1.26 -4.95 135.00 134.71 3huu n PRO 246 Ca 0.05 -1.32 -0.43 0.00 -0.04 0.00 0.00 63.50 61.76 3huu n PRO 246 Cb 0.37 -0.45 -0.01 0.00 -0.04 0.00 0.00 33.50 33.37 3huu n PRO 246 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 3huu n SER 247 N -3.09 2.66 -4.72 3.54 3.41 -1.05 -4.76 113.62 109.60 3huu n SER 247 Ca 0.09 1.19 -0.35 0.00 -0.26 0.00 0.00 58.87 59.53 3huu n SER 247 Cb 0.31 -1.46 -0.08 0.00 -0.26 0.00 0.00 64.21 62.72 3huu n SER 247 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 3huu s GLN 248 N -1.45 4.13 0.22 4.33 -1.52 0.36 -1.11 119.66 124.61 3huu s GLN 248 Ca 0.59 -0.23 -0.30 0.00 -1.95 0.00 0.00 55.36 53.46 3huu s GLN 248 Cb -0.60 -3.38 -0.09 0.00 -0.22 0.00 0.00 33.01 28.72 3huu s GLN 248 CO 0.59 0.32 1.39 0.99 -0.25 0.00 0.00 175.29 178.32 3huu s THR 249 N 0.30 2.92 0.21 -0.19 2.01 -1.26 -4.61 115.64 115.02 3huu s THR 249 Ca 0.08 0.75 -0.10 0.00 0.31 0.00 0.00 61.69 62.73 3huu s THR 249 Cb -0.11 -3.48 -0.01 0.00 0.01 0.00 0.00 72.50 68.91 3huu s THR 249 CO -0.01 0.11 0.37 -0.94 -0.69 0.00 0.00 174.62 173.45 3huu s SER 250 N 0.44 -0.03 -0.25 3.53 1.04 -0.15 -1.95 113.70 116.33 3huu s SER 250 Ca 0.59 -0.94 -0.12 0.00 0.48 0.00 0.00 55.95 55.96 3huu s SER 250 Cb -0.39 0.51 -0.05 0.00 0.10 0.00 0.00 66.02 66.19 3huu s SER 250 CO 0.40 -1.01 0.24 -0.69 0.98 0.00 0.00 173.24 173.16 3huu s VAL 251 N -4.01 5.29 -0.24 5.02 1.01 -0.94 0.37 120.40 126.90 3huu s VAL 251 Ca 0.22 0.33 -0.21 0.00 0.00 0.00 0.00 61.98 62.32 3huu s VAL 251 Cb 0.02 -3.58 -0.02 0.00 0.00 0.00 0.00 36.38 32.80 3huu s VAL 251 CO 0.05 0.28 0.67 0.21 0.00 0.00 0.00 175.10 176.32 3huu s ASN 252 N 1.29 6.65 0.00 3.32 2.47 0.24 -0.26 114.94 128.65 3huu s ASN 252 Ca 0.11 0.80 0.18 0.00 0.42 0.00 0.00 52.86 54.36 3huu s ASN 252 Cb -0.15 -2.36 0.49 0.00 -1.45 0.00 0.00 41.25 37.79 3huu s ASN 252 CO 0.07 -0.39 1.41 2.30 -3.72 0.00 0.00 177.10 176.77 3huu n ILE 253 N 5.15 0.97 -3.83 -5.21 -5.35 -1.26 -1.64 119.36 108.20 3huu n ILE 253 Ca 0.01 -0.99 -0.36 0.00 -0.27 0.00 0.00 62.75 61.14 3huu n ILE 253 Cb 0.49 0.52 0.03 0.00 -1.74 0.00 0.00 39.64 38.94 3huu n ILE 253 CO 0.00 0.00 0.00 0.59 -1.76 0.00 0.00 176.55 175.38 3huu n ASN 254 N 1.16 -4.68 0.25 7.28 3.02 -1.26 -4.81 115.26 116.22 3huu n ASN 254 Ca 0.19 -1.11 0.08 0.00 -0.03 0.00 0.00 54.58 53.71 3huu n ASN 254 Cb 0.54 -2.79 0.62 0.00 -0.61 0.00 0.00 39.78 37.53 3huu n ASN 254 CO 0.00 0.00 0.00 1.55 -2.62 0.00 0.00 177.26 176.19 3huu h PRO 255 N -2.14 0.00 -0.04 3.52 0.13 -1.94 -1.81 132.00 129.72 3huu h PRO 255 Ca -0.68 0.00 -0.09 0.00 -0.87 0.00 0.00 66.00 64.36 3huu h PRO 255 Cb 1.38 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.49 3huu h PRO 255 CO 0.50 0.10 -0.40 0.38 -0.23 0.00 0.00 178.00 178.35 3huu h ASP 256 N 0.00 0.08 0.34 1.44 2.03 -1.89 -0.52 116.42 117.90 3huu h ASP 256 Ca -0.00 -0.03 -0.21 0.00 -0.73 0.00 0.00 57.03 56.06 3huu h ASP 256 Cb 0.19 -0.02 -0.00 0.00 -0.83 0.00 0.00 39.33 38.66 3huu h ASP 256 CO 0.01 0.48 -0.86 0.58 -1.03 0.00 0.00 179.24 178.42 3huu h VAL 257 N 0.07 1.41 -0.64 4.15 2.07 -1.69 -1.34 116.25 120.28 3huu h VAL 257 Ca 0.01 -2.36 -0.06 0.00 0.82 0.00 0.00 66.70 65.11 3huu h VAL 257 Cb 0.74 2.31 -0.03 0.00 -1.52 0.00 0.00 31.29 32.79 3huu h VAL 257 CO 0.05 0.70 0.19 -0.07 0.02 0.00 0.00 177.57 178.46 3huu h LEU 258 N 0.23 0.95 -0.23 2.57 3.38 -0.97 -1.16 115.31 120.08 3huu h LEU 258 Ca -0.06 -0.22 -0.07 0.00 0.09 0.00 0.00 57.88 57.63 3huu h LEU 258 Cb 1.47 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 41.97 3huu h LEU 258 CO 0.15 0.91 -0.13 1.23 0.09 0.00 0.00 178.44 180.69 3huu h GLY 259 N 0.93 0.53 1.06 0.83 0.00 -0.99 -0.99 103.07 104.46 3huu h GLY 259 Ca 0.21 -0.49 -0.08 0.00 0.00 0.00 0.00 47.33 46.96 3huu h GLY 259 CO -0.00 0.45 0.09 -2.75 0.00 0.00 0.00 176.54 174.33 3huu h PHE 260 N 0.20 1.16 -0.49 5.60 3.57 -1.20 0.12 116.94 125.89 3huu h PHE 260 Ca 0.05 -0.17 -0.08 0.00 3.53 0.00 0.00 57.97 61.31 3huu h PHE 260 Cb 0.64 -0.32 -0.02 0.00 2.79 0.00 0.00 35.95 39.05 3huu h PHE 260 CO 0.07 0.98 0.01 1.15 -2.23 0.00 0.00 178.31 178.29 3huu h THR 261 N 1.00 1.26 -0.53 4.41 2.02 -1.19 -1.82 112.91 118.06 3huu h THR 261 Ca 0.20 -1.06 -0.07 0.00 0.77 0.00 0.00 66.41 66.25 3huu h THR 261 Cb 0.46 0.97 -0.02 0.00 -1.74 0.00 0.00 68.15 67.81 3huu h THR 261 CO 0.02 0.37 0.06 0.00 0.37 0.00 0.00 175.52 176.34 3huu h ALA 262 N 0.94 0.70 -0.22 6.16 0.00 -0.85 -0.99 119.26 125.00 3huu h ALA 262 Ca 0.14 -0.26 -0.02 0.00 0.00 0.00 0.00 54.91 54.78 3huu h ALA 262 Cb 0.50 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.08 3huu h ALA 262 CO 0.02 0.47 0.07 0.78 0.00 0.00 0.00 179.25 180.59 3huu h GLY 263 N 0.77 0.37 1.61 0.00 0.00 -0.68 -2.20 103.07 102.95 3huu h GLY 263 Ca 0.16 -0.22 -0.10 0.00 0.00 0.00 0.00 47.33 47.16 3huu h GLY 263 CO 0.02 0.21 -0.30 3.43 0.00 0.00 0.00 176.54 179.89 3huu h ASN 264 N 0.19 0.46 -0.23 0.19 2.35 -1.28 -2.92 115.58 114.33 3huu h ASN 264 Ca 0.07 -0.17 -0.20 0.00 -0.55 0.00 0.00 56.30 55.45 3huu h ASN 264 Cb 0.24 -0.13 0.01 0.00 0.05 0.00 0.00 38.32 38.49 3huu h ASN 264 CO -0.00 0.74 -0.65 0.74 -1.65 0.00 0.00 177.43 176.61 3huu h THR 265 N 0.39 1.27 -0.01 2.81 2.02 -1.08 -1.62 112.91 116.69 3huu h THR 265 Ca 0.05 -1.84 -0.11 0.00 0.77 0.00 0.00 66.41 65.28 3huu h THR 265 Cb 0.73 1.78 -0.01 0.00 -1.74 0.00 0.00 68.15 68.91 3huu h THR 265 CO 0.06 0.59 -0.50 -0.29 0.37 0.00 0.00 175.52 175.75 3huu h ILE 266 N 0.62 1.36 -0.42 3.11 2.10 -1.42 -1.44 117.51 121.41 3huu h ILE 266 Ca -0.02 -1.72 -0.15 0.00 1.08 0.00 0.00 64.86 64.05 3huu h ILE 266 Cb 1.27 1.92 -0.01 0.00 -1.09 0.00 0.00 36.82 38.91 3huu h ILE 266 CO 0.14 0.49 -0.32 0.40 -1.08 0.00 0.00 178.15 177.79 3huu h ILE 267 N 0.02 1.27 -0.76 2.19 2.04 -1.44 -1.58 117.51 119.25 3huu h ILE 267 Ca -0.00 -1.49 0.02 0.00 1.00 0.00 0.00 64.86 64.39 3huu h ILE 267 Cb 0.89 1.28 -0.04 0.00 -0.74 0.00 0.00 36.82 38.21 3huu h ILE 267 CO 0.07 0.50 0.50 0.44 0.00 0.00 0.00 178.15 179.66 3huu h ASP 268 N 0.80 0.84 -0.28 1.72 3.32 -0.77 -0.77 116.42 121.27 3huu h ASP 268 Ca 0.08 -0.02 -0.13 0.00 0.02 0.00 0.00 57.03 56.98 3huu h ASP 268 Cb 0.91 -0.20 -0.00 0.00 0.22 0.00 0.00 39.33 40.25 3huu h ASP 268 CO 0.08 0.60 -0.34 0.58 -1.72 0.00 0.00 179.24 178.44 3huu h VAL 269 N 0.98 1.30 0.00 -1.35 2.07 -1.02 -3.04 116.25 115.19 3huu h VAL 269 Ca 0.29 -1.52 -0.00 0.00 0.82 0.00 0.00 66.70 66.29 3huu h VAL 269 Cb -0.05 1.61 -0.00 0.00 -1.52 0.00 0.00 31.29 31.33 3huu h VAL 269 CO -0.07 0.49 -0.01 -0.07 0.02 0.00 0.00 177.57 177.92 3huu h LEU 270 N 0.48 0.00 -1.98 2.57 3.38 -0.65 -3.49 115.31 115.62 3huu h LEU 270 Ca 0.04 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.01 3huu h LEU 270 Cb 0.92 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.67 3huu h LEU 270 CO 0.08 0.01 0.00 0.54 0.09 0.00 0.00 178.44 179.17 3huu n ARG 271 N -3.12 2.35 -0.74 1.13 1.74 -0.36 -5.09 116.66 112.58 3huu n ARG 271 Ca -0.00 -1.98 0.00 0.00 -0.77 0.00 0.00 57.85 55.10 3huu n ARG 271 Cb 0.28 -1.47 0.00 0.00 -1.02 0.00 0.00 32.46 30.25 3huu n ARG 271 CO 0.00 0.00 0.00 -0.89 -1.52 0.00 0.00 177.63 175.22 3huu n ILE 275 N 1.37 -0.11 -3.84 0.55 5.41 -1.26 -4.94 119.36 116.54 3huu n ILE 275 Ca 0.15 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.90 3huu n ILE 275 Cb 0.60 -1.04 0.00 0.00 -0.71 0.00 0.00 39.64 38.49 3huu n ILE 275 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 176.55 175.01 3huu n SER 276 N -0.45 0.00 0.00 4.38 3.41 -1.26 -4.89 113.62 114.81 3huu n SER 276 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 3huu n SER 276 Cb 0.20 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.15 3huu n SER 276 CO 0.00 0.00 0.00 2.22 -0.16 0.00 0.00 175.04 177.10 3huu n PHE 277 N 7.56 0.00 -0.89 7.33 1.16 -1.26 -3.90 117.46 127.46 3huu n PHE 277 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 57.45 55.58 3huu n PHE 277 Cb 0.00 0.00 0.00 0.00 -1.61 0.00 0.00 39.48 37.87 3huu n PHE 277 CO 0.00 0.00 0.00 -2.13 -1.87 0.00 0.00 176.76 172.76 3huu n ARG 278 N 0.00 -2.56 -5.16 3.97 0.63 -1.26 -4.34 116.66 107.94 3huu n ARG 278 Ca 0.00 1.89 -0.32 0.00 -0.92 0.00 0.00 57.85 58.51 3huu n ARG 278 Cb 0.00 -2.12 -0.16 0.00 0.45 0.00 0.00 32.46 30.63 3huu n ARG 278 CO 0.00 0.00 0.00 -2.00 -2.51 0.00 0.00 177.63 173.12 3huu s GLU 279 N -4.47 2.53 -0.17 -0.14 2.12 -1.26 -3.28 118.70 114.03 3huu s GLU 279 Ca 0.00 -0.85 0.01 0.00 0.36 0.00 0.00 54.97 54.48 3huu s GLU 279 Cb 0.00 -2.22 0.03 0.00 0.26 0.00 0.00 34.13 32.20 3huu s GLU 279 CO 0.00 0.45 -0.14 0.15 -0.54 0.00 0.00 175.26 175.18 3huu s LYS 280 N -0.31 2.34 -0.15 4.30 1.02 -0.54 -5.01 119.74 121.38 3huu s LYS 280 Ca 0.01 -0.70 -0.06 0.00 0.02 0.00 0.00 55.97 55.24 3huu s LYS 280 Cb -0.13 -2.28 -0.04 0.00 -0.52 0.00 0.00 37.83 34.86 3huu s LYS 280 CO 0.02 -0.29 0.06 -0.51 -0.92 0.00 0.00 175.35 173.71 3huu s LEU 281 N 1.42 3.83 -0.14 3.17 1.43 -1.25 -1.30 118.68 125.84 3huu s LEU 281 Ca 0.03 0.14 -0.05 0.00 -1.03 0.00 0.00 54.13 53.22 3huu s LEU 281 Cb -0.14 -1.94 -0.04 0.00 0.03 0.00 0.00 46.19 44.10 3huu s LEU 281 CO -0.10 0.25 0.05 -0.63 0.23 0.00 0.00 176.35 176.15 3huu s ILE 282 N -0.09 4.73 0.89 -0.59 -1.09 0.46 -4.97 121.20 120.54 3huu s ILE 282 Ca 0.06 -0.07 -0.11 0.00 -2.23 0.00 0.00 60.65 58.30 3huu s ILE 282 Cb -0.12 -3.07 0.12 0.00 -1.58 0.00 0.00 42.46 37.81 3huu s ILE 282 CO 0.01 0.54 1.09 -0.94 -1.23 0.00 0.00 174.94 174.41 3huu s SER 283 N -0.30 3.57 0.10 3.58 1.04 -1.26 -4.20 113.70 116.23 3huu s SER 283 Ca 0.08 1.49 0.03 0.00 0.48 0.00 0.00 55.95 58.03 3huu s SER 283 Cb -0.12 -2.17 -0.04 0.00 0.10 0.00 0.00 66.02 63.79 3huu s SER 283 CO 0.02 -2.58 -0.09 0.42 0.98 0.00 0.00 173.24 171.99 3huu s THR 284 N -2.95 0.90 0.05 2.02 -4.23 -1.26 -4.47 115.64 105.70 3huu s THR 284 Ca 0.63 -1.76 0.00 0.00 -1.18 0.00 0.00 61.69 59.38 3huu s THR 284 Cb -0.18 -1.49 -0.03 0.00 1.34 0.00 0.00 72.50 72.14 3huu s THR 284 CO 0.57 -0.66 -0.04 -1.10 -0.54 0.00 0.00 174.62 172.84 3huu s GLN 285 N -3.17 0.57 -0.15 3.99 1.11 -0.65 -4.95 119.66 116.41 3huu s GLN 285 Ca 0.08 -1.03 -0.16 0.00 0.01 0.00 0.00 55.36 54.26 3huu s GLN 285 Cb -0.00 0.02 -0.04 0.00 -1.01 0.00 0.00 33.01 31.98 3huu s GLN 285 CO -0.01 -0.05 0.38 0.42 0.01 0.00 0.00 175.29 176.04 3huu s ILE 286 N -2.90 5.24 -0.30 1.08 -1.09 -1.26 0.82 121.20 122.78 3huu s ILE 286 Ca 0.00 0.73 -0.05 0.00 -2.23 0.00 0.00 60.65 59.10 3huu s ILE 286 Cb 0.01 -3.72 0.03 0.00 -1.58 0.00 0.00 42.46 37.19 3huu s ILE 286 CO -0.05 0.34 0.05 -0.69 -1.23 0.00 0.00 174.94 173.36 3huu s VAL 287 N 0.71 3.59 0.04 2.92 1.01 0.16 -4.93 120.40 123.90 3huu s VAL 287 Ca 0.20 -0.98 -0.27 0.00 0.00 0.00 0.00 61.98 60.93 3huu s VAL 287 Cb -0.14 -2.93 -0.05 0.00 0.00 0.00 0.00 36.38 33.26 3huu s VAL 287 CO 0.07 -0.01 0.87 -1.61 0.00 0.00 0.00 175.10 174.42 3huu s GLU 288 N 1.41 4.56 0.00 2.72 2.02 -1.26 -0.98 118.70 127.17 3huu s GLU 288 Ca -0.00 1.24 0.00 0.00 0.02 0.00 0.00 54.97 56.23 3huu s GLU 288 Cb -0.18 -3.40 0.00 0.00 0.10 0.00 0.00 34.13 30.64 3huu s GLU 288 CO 0.01 0.15 0.00 0.54 0.02 0.00 0.00 175.26 175.98 3huu n ARG 289 N 3.21 0.23 0.19 1.61 5.12 -1.26 -4.92 116.66 120.84 3huu n ARG 289 Ca 0.01 0.00 0.05 0.00 -1.93 0.00 0.00 57.85 55.98 3huu n ARG 289 Cb 0.50 0.00 0.47 0.00 -1.16 0.00 0.00 32.46 32.28 3huu n ARG 289 CO 0.00 0.00 0.00 0.28 -1.93 0.00 0.00 177.63 175.98 3huu h VAL 290 N 0.44 1.14 0.00 1.55 2.07 -1.89 -3.20 116.25 116.36 3huu h VAL 290 Ca 0.00 -0.63 0.00 0.00 0.82 0.00 0.00 66.70 66.89 3huu h VAL 290 Cb 0.00 1.26 0.00 0.00 -1.52 0.00 0.00 31.29 31.03 3huu h VAL 290 CO 0.00 0.19 0.00 0.77 0.02 0.00 0.00 177.57 178.55 3huu h SER 291 N 0.08 0.00 -3.70 0.57 4.64 -1.41 -3.39 113.55 110.35 3huu h SER 291 Ca 0.02 0.00 -0.51 0.00 -0.47 0.00 0.00 61.79 60.82 3huu h SER 291 Cb 0.31 0.00 -0.18 0.00 -0.31 0.00 0.00 62.40 62.22 3huu h SER 291 CO 0.02 0.00 -0.78 0.42 -0.87 0.00 0.00 176.83 175.62 3huu s THR 292 N -3.73 1.74 -0.03 2.95 -4.23 -1.21 -2.71 115.64 108.42 3huu s THR 292 Ca -0.01 -1.84 -0.30 0.00 -1.18 0.00 0.00 61.69 58.36 3huu s THR 292 Cb 0.10 -1.77 0.11 0.00 1.34 0.00 0.00 72.50 72.28 3huu s THR 292 CO 0.38 -0.30 0.96 0.28 -0.54 0.00 0.00 174.62 175.40 3huu s THR 293 N -1.95 0.00 -1.89 3.99 -1.32 -1.26 -4.80 115.64 108.41 3huu s THR 293 Ca 0.14 -0.05 0.00 0.00 -1.21 0.00 0.00 61.69 60.56 3huu s THR 293 Cb -0.06 -1.09 0.00 0.00 -1.51 0.00 0.00 72.50 69.83 3huu s THR 293 CO 0.06 0.00 0.47 0.29 -2.21 0.00 0.00 174.62 173.23