#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hy5 n GLN 24 N 0.00 -6.68 -3.72 5.31 6.02 -1.26 -5.01 117.38 112.05 3hy5 n GLN 24 Ca 0.00 0.75 -0.24 0.00 -0.01 0.00 0.00 57.00 57.50 3hy5 n GLN 24 Cb 0.00 -5.53 -0.17 0.00 1.02 0.00 0.00 30.24 25.56 3hy5 n GLN 24 CO 0.00 0.00 0.00 -1.17 -1.01 0.00 0.00 177.06 174.88 3hy5 s LEU 25 N -6.36 0.58 0.27 1.08 2.96 -1.26 -5.14 118.68 110.81 3hy5 s LEU 25 Ca 0.32 -0.30 -0.15 0.00 -0.22 0.00 0.00 54.13 53.78 3hy5 s LEU 25 Cb -0.14 -0.38 -0.08 0.00 0.50 0.00 0.00 46.19 46.09 3hy5 s LEU 25 CO 0.65 -0.26 0.69 0.42 -1.32 0.00 0.00 176.35 176.54 3hy5 s THR 26 N 2.02 4.70 0.51 3.68 -4.23 -1.26 -4.85 115.64 116.20 3hy5 s THR 26 Ca 0.03 0.96 0.38 0.00 -1.18 0.00 0.00 61.69 61.88 3hy5 s THR 26 Cb -0.14 -3.69 0.59 0.00 1.34 0.00 0.00 72.50 70.60 3hy5 s THR 26 CO -0.06 -0.03 1.67 0.00 -0.54 0.00 0.00 174.62 175.66 3hy5 h THR 27 N 2.24 0.19 -0.11 3.99 1.03 -1.81 0.81 112.91 119.26 3hy5 h THR 27 Ca -0.48 -0.02 -0.20 0.00 -0.01 0.00 0.00 66.41 65.70 3hy5 h THR 27 Cb 1.18 0.13 0.00 0.00 -1.07 0.00 0.00 68.15 68.39 3hy5 h THR 27 CO 0.66 0.01 -0.74 0.50 -0.01 0.00 0.00 175.52 175.94 3hy5 h LYS 28 N 0.06 0.57 0.00 0.00 3.64 -1.87 -3.35 116.57 115.61 3hy5 h LYS 28 Ca 0.78 -0.46 0.00 0.00 -1.27 0.00 0.00 60.65 59.70 3hy5 h LYS 28 Cb 2.83 0.09 0.00 0.00 -0.41 0.00 0.00 32.23 34.74 3hy5 h LYS 28 CO -0.16 1.08 0.63 -0.44 -2.27 0.00 0.00 179.45 178.29 3hy5 h ASP 29 N 0.39 0.00 -2.61 4.20 5.19 -1.21 -3.41 116.42 118.97 3hy5 h ASP 29 Ca -0.04 0.00 -0.55 0.00 -0.62 0.00 0.00 57.03 55.82 3hy5 h ASP 29 Cb 1.33 0.00 -0.03 0.00 0.18 0.00 0.00 39.33 40.81 3hy5 h ASP 29 CO 0.14 0.00 -0.48 -1.00 -3.12 0.00 0.00 179.24 174.78 3hy5 s HIS 30 N -3.33 3.46 0.34 4.55 3.76 -1.26 -4.80 115.29 118.00 3hy5 s HIS 30 Ca -0.01 0.12 -0.06 0.00 -0.15 0.00 0.00 55.06 54.97 3hy5 s HIS 30 Cb 0.02 -1.66 0.08 0.00 1.11 0.00 0.00 32.58 32.13 3hy5 s HIS 30 CO 0.06 0.52 0.27 0.41 -0.85 0.00 0.00 174.74 175.15 3hy5 n GLY 31 N -0.43 -2.87 3.78 -2.22 0.00 -1.26 -4.97 105.19 97.22 3hy5 n GLY 31 Ca -0.07 -1.40 -0.37 0.00 0.00 0.00 0.00 46.02 44.18 3hy5 n GLY 31 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 3hy5 s PRO 32 N -3.62 4.58 0.85 1.61 0.02 -1.26 -4.79 135.00 132.40 3hy5 s PRO 32 Ca 0.18 1.35 -0.11 0.00 0.02 0.00 0.00 61.00 62.44 3hy5 s PRO 32 Cb -0.02 -2.82 0.10 0.00 0.02 0.00 0.00 34.50 31.78 3hy5 s PRO 32 CO 0.14 0.27 1.10 0.08 -0.33 0.00 0.00 177.00 178.26 3hy5 s VAL 33 N -1.59 2.89 0.00 3.83 1.01 -1.26 -4.36 120.40 120.91 3hy5 s VAL 33 Ca 0.50 0.29 0.00 0.00 0.00 0.00 0.00 61.98 62.77 3hy5 s VAL 33 Cb -0.19 -2.70 0.00 0.00 0.00 0.00 0.00 36.38 33.49 3hy5 s VAL 33 CO 0.24 -0.38 0.00 0.49 0.00 0.00 0.00 175.10 175.46 3hy5 n PHE 34 N -3.79 0.00 -1.72 5.22 3.72 -1.26 -4.92 117.46 114.71 3hy5 n PHE 34 Ca 0.08 0.00 -0.42 0.00 -0.05 0.00 0.00 57.45 57.06 3hy5 n PHE 34 Cb 0.54 0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 39.05 3hy5 n PHE 34 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3hy5 n GLY 35 N 0.00 1.51 3.57 1.37 0.00 -1.26 -4.92 105.19 105.46 3hy5 n GLY 35 Ca 0.00 0.60 -0.46 0.00 0.00 0.00 0.00 46.02 46.16 3hy5 n GLY 35 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3hy5 n PRO 36 N 3.74 1.19 -1.09 1.61 -0.02 -1.26 -4.88 135.00 134.29 3hy5 n PRO 36 Ca 0.15 0.42 -0.34 0.00 -2.02 0.00 0.00 63.50 61.71 3hy5 n PRO 36 Cb 0.35 -1.78 0.12 0.00 -0.02 0.00 0.00 33.50 32.16 3hy5 n PRO 36 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3hy5 n SER 38 N -2.43 1.02 -4.17 0.00 7.64 -1.26 -4.99 113.62 109.43 3hy5 n SER 38 Ca 0.12 0.06 -0.22 0.00 1.01 0.00 0.00 58.87 59.84 3hy5 n SER 38 Cb 0.51 -0.19 -0.09 0.00 -1.01 0.00 0.00 64.21 63.43 3hy5 n SER 38 CO 0.00 0.00 0.00 -1.58 -3.01 0.00 0.00 175.04 170.45 3hy5 s GLN 39 N -2.13 1.74 -0.18 1.43 0.74 -1.26 -5.06 119.66 114.95 3hy5 s GLN 39 Ca -0.09 -2.02 0.16 0.00 0.05 0.00 0.00 55.36 53.45 3hy5 s GLN 39 Cb 0.03 -0.50 0.63 0.00 1.10 0.00 0.00 33.01 34.27 3hy5 s GLN 39 CO 0.13 -0.39 1.54 1.28 -0.55 0.00 0.00 175.29 177.29 3hy5 n LEU 40 N -0.74 4.52 0.00 3.68 4.77 -1.26 -4.97 117.00 123.00 3hy5 n LEU 40 Ca -0.03 -2.86 0.00 0.00 -0.03 0.00 0.00 56.01 53.09 3hy5 n LEU 40 Cb 0.65 -0.57 0.00 0.00 -2.33 0.00 0.00 43.42 41.17 3hy5 n LEU 40 CO 0.37 0.68 0.00 -0.81 -1.33 0.00 0.00 177.39 176.30 3hy5 n PRO 41 N 0.10 0.30 -1.71 3.23 -0.04 -1.26 -3.73 135.00 131.90 3hy5 n PRO 41 Ca 0.23 0.00 -0.09 0.00 -0.04 0.00 0.00 63.50 63.61 3hy5 n PRO 41 Cb 0.96 0.00 -0.02 0.00 -0.04 0.00 0.00 33.50 34.40 3hy5 n PRO 41 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 3hy5 n ARG 42 N -0.61 -0.64 -0.64 0.54 1.74 -1.26 -3.72 116.66 112.07 3hy5 n ARG 42 Ca 0.00 0.61 0.00 0.00 -0.77 0.00 0.00 57.85 57.69 3hy5 n ARG 42 Cb 0.00 -4.53 0.00 0.00 -1.02 0.00 0.00 32.46 26.91 3hy5 n ARG 42 CO 0.00 0.00 0.00 -2.39 -1.52 0.00 0.00 177.63 173.72 3hy5 n HIS 43 N -3.38 0.00 -0.09 -1.55 1.44 -1.26 -4.75 115.22 105.62 3hy5 n HIS 43 Ca -0.09 0.00 -0.01 0.00 -2.01 0.00 0.00 57.72 55.61 3hy5 n HIS 43 Cb 0.43 -1.54 0.25 0.00 0.12 0.00 0.00 29.99 29.25 3hy5 n HIS 43 CO 0.00 0.00 0.00 1.79 -2.81 0.00 0.00 176.34 175.32 3hy5 h THR 44 N 0.00 1.20 -0.88 0.61 1.35 -1.74 -1.88 112.91 111.56 3hy5 h THR 44 Ca 0.00 -0.70 0.09 0.00 -0.55 0.00 0.00 66.41 65.25 3hy5 h THR 44 Cb 0.50 0.68 -0.06 0.00 -1.73 0.00 0.00 68.15 67.53 3hy5 h THR 44 CO 0.00 0.26 0.57 0.25 -0.25 0.00 0.00 175.52 176.35 3hy5 h LEU 45 N 0.71 0.80 -0.43 3.87 5.85 -1.81 0.59 115.31 124.89 3hy5 h LEU 45 Ca 0.16 0.02 -0.15 0.00 0.84 0.00 0.00 57.88 58.76 3hy5 h LEU 45 Cb 0.23 -0.15 -0.01 0.00 0.37 0.00 0.00 40.66 41.10 3hy5 h LEU 45 CO -0.01 0.47 -0.31 -0.61 -0.34 0.00 0.00 178.44 177.64 3hy5 h GLN 46 N 0.88 0.97 -0.39 1.25 4.15 -1.70 -1.91 115.11 118.36 3hy5 h GLN 46 Ca 0.41 -0.47 0.06 0.00 0.77 0.00 0.00 58.65 59.42 3hy5 h GLN 46 Cb 0.39 -0.00 -0.06 0.00 0.21 0.00 0.00 27.48 28.02 3hy5 h GLN 46 CO -0.17 1.14 0.06 -0.22 -1.93 0.00 0.00 178.83 177.71 3hy5 h LYS 47 N 0.80 0.18 -0.69 1.69 3.64 -0.31 -0.72 116.57 121.17 3hy5 h LYS 47 Ca 0.08 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.45 3hy5 h LYS 47 Cb 0.91 -0.04 -0.03 0.00 -0.41 0.00 0.00 32.23 32.65 3hy5 h LYS 47 CO 0.08 0.12 0.44 0.00 -2.27 0.00 0.00 179.45 177.82 3hy5 h ALA 48 N 1.31 0.87 -0.38 5.00 0.00 -0.90 0.15 119.26 125.31 3hy5 h ALA 48 Ca 0.19 -0.06 0.11 0.00 0.00 0.00 0.00 54.91 55.15 3hy5 h ALA 48 Cb 0.24 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 3hy5 h ALA 48 CO -0.26 0.32 0.33 0.87 0.00 0.00 0.00 179.25 180.51 3hy5 h LYS 49 N 0.93 0.00 -0.02 0.00 1.57 -0.47 0.46 116.57 119.05 3hy5 h LYS 49 Ca 0.25 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.03 3hy5 h LYS 49 Cb -0.07 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.24 3hy5 h LYS 49 CO -0.05 0.00 0.00 -0.25 -0.57 0.00 0.00 179.45 178.58 3hy5 n ASP 50 N -4.05 0.44 -1.58 0.86 8.00 0.03 -1.19 116.55 119.06 3hy5 n ASP 50 Ca 0.06 -1.26 -0.01 0.00 0.71 0.00 0.00 54.79 54.29 3hy5 n ASP 50 Cb 0.51 -0.01 0.28 0.00 -0.02 0.00 0.00 41.12 41.89 3hy5 n ASP 50 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 3hy5 n GLU 51 N -0.60 3.28 -0.81 -1.24 1.02 0.16 -4.90 120.64 117.56 3hy5 n GLU 51 Ca 0.20 -3.05 0.00 0.00 -0.02 0.00 0.00 57.16 54.29 3hy5 n GLU 51 Cb 0.17 -2.06 0.00 0.00 -0.02 0.00 0.00 31.44 29.52 3hy5 n GLU 51 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 3hy5 n LEU 52 N -0.37 0.00 -4.77 -4.62 4.77 -0.33 -4.55 117.00 107.14 3hy5 n LEU 52 Ca 0.34 0.00 -0.39 0.00 -0.03 0.00 0.00 56.01 55.93 3hy5 n LEU 52 Cb 1.20 -0.40 -0.02 0.00 -2.33 0.00 0.00 43.42 41.87 3hy5 n LEU 52 CO 0.32 0.00 0.86 0.21 -1.33 0.00 0.00 177.39 177.45 3hy5 s ASN 53 N -2.40 6.68 -0.09 -1.43 3.84 -0.88 -4.95 114.94 115.70 3hy5 s ASN 53 Ca 0.00 2.40 0.01 0.00 0.21 0.00 0.00 52.86 55.47 3hy5 s ASN 53 Cb 0.00 -2.62 0.02 0.00 -0.55 0.00 0.00 41.25 38.10 3hy5 s ASN 53 CO 0.00 -0.57 -0.09 -1.61 -2.79 0.00 0.00 177.10 172.03 3hy5 s GLU 54 N -2.08 1.59 0.46 0.43 2.02 -1.26 -4.24 118.70 115.62 3hy5 s GLU 54 Ca 0.54 -0.32 0.26 0.00 0.02 0.00 0.00 54.97 55.47 3hy5 s GLU 54 Cb -0.33 -1.51 0.94 0.00 0.10 0.00 0.00 34.13 33.34 3hy5 s GLU 54 CO 0.42 -0.15 1.83 -0.09 0.02 0.00 0.00 175.26 177.28 3hy5 h ARG 55 N 7.70 0.00 0.01 1.61 2.43 -1.96 -3.34 114.38 120.83 3hy5 h ARG 55 Ca -0.31 0.00 -0.00 0.00 -0.81 0.00 0.00 59.98 58.86 3hy5 h ARG 55 Cb 1.15 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.70 3hy5 h ARG 55 CO 0.44 0.15 -0.01 1.05 -1.51 0.00 0.00 179.97 180.09 3hy5 h GLU 56 N 0.00 -0.02 0.00 0.20 9.09 -2.04 -3.44 114.58 118.37 3hy5 h GLU 56 Ca -0.00 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.41 3hy5 h GLU 56 Cb 0.74 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.84 3hy5 h GLU 56 CO 0.02 -0.01 -0.01 0.39 0.05 0.00 0.00 179.01 179.45 3hy5 n GLU 57 N -3.53 5.13 0.05 1.06 1.02 -1.26 -4.87 120.64 118.23 3hy5 n GLU 57 Ca -0.00 0.00 -0.04 0.00 -0.02 0.00 0.00 57.16 57.10 3hy5 n GLU 57 Cb 0.01 -0.38 -0.02 0.00 -0.02 0.00 0.00 31.44 31.03 3hy5 n GLU 57 CO 0.00 0.00 0.00 1.79 1.18 0.00 0.00 177.13 180.10 3hy5 h THR 58 N 0.00 0.02 -0.89 2.62 1.35 -1.86 -3.33 112.91 110.82 3hy5 h THR 58 Ca 0.00 -0.84 0.20 0.00 -0.55 0.00 0.00 66.41 65.22 3hy5 h THR 58 Cb 0.00 0.03 -0.17 0.00 -1.73 0.00 0.00 68.15 66.28 3hy5 h THR 58 CO 0.00 0.00 -0.13 0.03 -0.25 0.00 0.00 175.52 175.17 3hy5 h ARG 59 N -1.06 0.02 -0.38 4.72 3.08 -1.88 0.31 114.38 119.18 3hy5 h ARG 59 Ca -0.02 -0.00 -0.00 0.00 0.07 0.00 0.00 59.98 60.02 3hy5 h ARG 59 Cb 0.19 -0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.21 3hy5 h ARG 59 CO 0.04 0.01 0.23 0.93 -1.07 0.00 0.00 179.97 180.12 3hy5 h GLU 60 N 0.02 0.51 -0.06 0.04 5.08 -1.92 -3.14 114.58 115.11 3hy5 h GLU 60 Ca 0.46 -0.04 -0.07 0.00 -1.00 0.00 0.00 59.36 58.71 3hy5 h GLU 60 Cb 0.78 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 29.93 3hy5 h GLU 60 CO -0.88 0.37 -0.22 0.93 -1.00 0.00 0.00 179.01 178.21 3hy5 h GLU 61 N 0.50 0.26 -0.71 2.33 5.08 -1.12 -3.26 114.58 117.66 3hy5 h GLU 61 Ca 0.14 -0.19 0.08 0.00 -1.00 0.00 0.00 59.36 58.39 3hy5 h GLU 61 Cb -0.01 0.04 -0.11 0.00 0.50 0.00 0.00 28.75 29.16 3hy5 h GLU 61 CO -0.03 0.82 -0.52 0.00 -1.00 0.00 0.00 179.01 178.28 3hy5 h ALA 62 N 0.43 -0.50 -0.73 3.43 0.00 -1.07 0.40 119.26 121.23 3hy5 h ALA 62 Ca -0.01 0.09 0.14 0.00 0.00 0.00 0.00 54.91 55.13 3hy5 h ALA 62 Cb 0.85 1.16 -0.09 0.00 0.00 0.00 0.00 17.79 19.71 3hy5 h ALA 62 CO 0.05 -0.93 0.27 0.28 0.00 0.00 0.00 179.25 178.91 3hy5 h VAL 63 N -0.18 0.65 0.65 0.00 2.07 -1.65 0.22 116.25 118.01 3hy5 h VAL 63 Ca 0.15 -0.14 -0.02 0.00 0.82 0.00 0.00 66.70 67.51 3hy5 h VAL 63 Cb 0.52 0.21 -0.01 0.00 -1.52 0.00 0.00 31.29 30.49 3hy5 h VAL 63 CO -0.77 0.07 -0.48 -0.09 0.02 0.00 0.00 177.57 176.32 3hy5 h ARG 64 N 0.40 -1.05 -0.77 1.57 2.43 -0.75 -1.98 114.38 114.24 3hy5 h ARG 64 Ca 0.40 0.07 0.17 0.00 -0.81 0.00 0.00 59.98 59.81 3hy5 h ARG 64 Cb 0.61 0.24 -0.14 0.00 -0.42 0.00 0.00 29.97 30.26 3hy5 h ARG 64 CO -0.41 -0.70 -0.10 0.93 -1.51 0.00 0.00 179.97 178.18 3hy5 h GLU 65 N -1.09 0.04 0.15 0.20 5.08 0.75 0.17 114.58 119.87 3hy5 h GLU 65 Ca -0.08 -0.00 0.02 0.00 -1.00 0.00 0.00 59.36 58.29 3hy5 h GLU 65 Cb 0.90 -0.01 -0.04 0.00 0.50 0.00 0.00 28.75 30.11 3hy5 h GLU 65 CO 0.03 0.03 -0.31 1.25 -1.00 0.00 0.00 179.01 179.01 3hy5 h LEU 66 N 0.04 -0.88 -1.27 1.33 5.85 -0.34 0.36 115.31 120.40 3hy5 h LEU 66 Ca 0.39 0.10 -0.00 0.00 0.84 0.00 0.00 57.88 59.21 3hy5 h LEU 66 Cb 0.66 0.33 -0.03 0.00 0.37 0.00 0.00 40.66 41.98 3hy5 h LEU 66 CO -0.74 -0.40 0.39 -0.61 -0.34 0.00 0.00 178.44 176.74 3hy5 h GLN 67 N -0.55 0.89 -0.67 1.25 4.15 -0.51 1.46 115.11 121.13 3hy5 h GLN 67 Ca 0.02 -0.08 -0.01 0.00 0.77 0.00 0.00 58.65 59.36 3hy5 h GLN 67 Cb 0.57 -0.19 -0.03 0.00 0.21 0.00 0.00 27.48 28.03 3hy5 h GLN 67 CO -0.16 0.63 0.37 1.49 -1.93 0.00 0.00 178.83 179.23 3hy5 h GLU 68 N 0.91 0.92 0.07 1.69 4.81 0.01 -1.45 114.58 121.54 3hy5 h GLU 68 Ca 0.24 -0.09 -0.23 0.00 -0.13 0.00 0.00 59.36 59.14 3hy5 h GLU 68 Cb -0.03 -0.19 0.02 0.00 0.63 0.00 0.00 28.75 29.18 3hy5 h GLU 68 CO -0.04 0.67 -0.96 1.98 -0.73 0.00 0.00 179.01 179.93 3hy5 h MET 69 N 0.93 0.52 -0.10 1.92 4.05 0.21 -2.31 114.93 120.15 3hy5 h MET 69 Ca 0.24 -0.66 0.04 0.00 -0.28 0.00 0.00 59.70 59.04 3hy5 h MET 69 Cb 0.01 0.21 -0.06 0.00 -0.80 0.00 0.00 31.60 30.96 3hy5 h MET 69 CO -0.04 1.27 -0.43 0.28 0.23 0.00 0.00 176.91 178.22 3hy5 h VAL 70 N 0.07 0.13 -0.16 -5.77 2.07 0.22 -1.27 116.25 111.54 3hy5 h VAL 70 Ca -0.14 0.00 -0.21 0.00 0.82 0.00 0.00 66.70 67.17 3hy5 h VAL 70 Cb 1.67 0.13 0.01 0.00 -1.52 0.00 0.00 31.29 31.58 3hy5 h VAL 70 CO 0.19 0.00 -0.74 1.56 0.02 0.00 0.00 177.57 178.59 3hy5 h GLN 71 N -0.52 0.75 -0.30 1.57 1.08 -1.40 -2.60 115.11 113.69 3hy5 h GLN 71 Ca 0.07 -0.59 0.07 0.00 -1.45 0.00 0.00 58.65 56.74 3hy5 h GLN 71 Cb 0.64 0.12 -0.07 0.00 -0.05 0.00 0.00 27.48 28.12 3hy5 h GLN 71 CO -0.38 1.21 -0.13 0.00 -0.95 0.00 0.00 178.83 178.57 3hy5 h ALA 72 N 0.63 0.11 0.00 3.87 0.00 -1.26 0.34 119.26 122.95 3hy5 h ALA 72 Ca -0.04 0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.98 3hy5 h ALA 72 Cb 1.36 0.34 0.00 0.00 0.00 0.00 0.00 17.79 19.48 3hy5 h ALA 72 CO 0.15 -0.53 0.00 1.96 0.00 0.00 0.00 179.25 180.83 3hy5 h GLN 73 N -0.09 0.00 0.00 0.00 1.08 -1.22 -1.79 115.11 113.09 3hy5 h GLN 73 Ca 0.16 0.00 -0.07 0.00 -1.45 0.00 0.00 58.65 57.28 3hy5 h GLN 73 Cb 0.32 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.74 3hy5 h GLN 73 CO -0.36 0.00 -0.84 0.00 -0.95 0.00 0.00 178.83 176.68 3hy5 h ALA 74 N 2.17 0.67 0.00 3.87 0.00 -0.64 -3.28 119.26 122.06 3hy5 h ALA 74 Ca 0.00 -0.35 0.00 0.00 0.00 0.00 0.00 54.91 54.56 3hy5 h ALA 74 Cb 0.46 0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.32 3hy5 h ALA 74 CO 0.00 0.41 0.00 0.00 0.00 0.00 0.00 179.25 179.66 3hy5 n ALA 75 N -2.24 2.03 0.58 0.00 0.00 1.00 -2.10 120.51 119.78 3hy5 n ALA 75 Ca -0.02 -0.09 0.12 0.00 0.00 0.00 0.00 53.44 53.45 3hy5 n ALA 75 Cb 0.67 -1.32 0.26 0.00 0.00 0.00 0.00 19.45 19.07 3hy5 n ALA 75 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 3hy5 n SER 76 N -1.29 0.76 0.00 0.00 3.41 -1.23 -4.94 113.62 110.33 3hy5 n SER 76 Ca 0.09 0.31 0.00 0.00 -0.26 0.00 0.00 58.87 59.01 3hy5 n SER 76 Cb 0.16 -0.23 0.00 0.00 -0.26 0.00 0.00 64.21 63.88 3hy5 n SER 76 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3hy5 n GLY 77 N 1.32 0.73 3.75 5.00 0.00 -0.89 -5.04 105.19 110.06 3hy5 n GLY 77 Ca 0.04 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.65 3hy5 n GLY 77 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3hy5 s GLU 78 N -0.56 4.28 0.12 1.61 -6.30 -1.26 -4.93 118.70 111.65 3hy5 s GLU 78 Ca 0.00 2.28 -0.24 0.00 -2.50 0.00 0.00 54.97 54.51 3hy5 s GLU 78 Cb 0.00 -3.11 -0.06 0.00 0.00 0.00 0.00 34.13 30.95 3hy5 s GLU 78 CO 0.00 -0.40 1.67 1.49 0.02 0.00 0.00 175.26 178.04 3hy5 h GLU 79 N 4.98 -0.24 0.78 4.30 4.81 -1.96 -2.32 114.58 124.92 3hy5 h GLU 79 Ca -0.46 0.02 -0.04 0.00 -0.13 0.00 0.00 59.36 58.75 3hy5 h GLU 79 Cb 1.22 0.06 0.01 0.00 0.63 0.00 0.00 28.75 30.66 3hy5 h GLU 79 CO 0.77 -0.16 -0.37 1.25 -0.73 0.00 0.00 179.01 179.76 3hy5 h LEU 80 N -0.25 -0.89 -1.99 1.64 5.85 -1.98 -0.24 115.31 117.45 3hy5 h LEU 80 Ca 0.06 0.03 0.35 0.00 0.84 0.00 0.00 57.88 59.16 3hy5 h LEU 80 Cb 0.33 0.23 -0.05 0.00 0.37 0.00 0.00 40.66 41.54 3hy5 h LEU 80 CO -0.16 -0.55 0.87 0.00 -0.34 0.00 0.00 178.44 178.26 3hy5 h ALA 81 N -1.35 3.14 0.12 1.25 0.00 -1.86 0.44 119.26 121.00 3hy5 h ALA 81 Ca -0.11 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.76 3hy5 h ALA 81 Cb 0.80 0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.68 3hy5 h ALA 81 CO 0.18 -1.49 -0.06 0.28 0.00 0.00 0.00 179.25 178.16 3hy5 h VAL 82 N 0.00 1.05 -0.76 0.00 2.07 -1.10 -2.40 116.25 115.11 3hy5 h VAL 82 Ca 0.57 -1.19 0.17 0.00 0.82 0.00 0.00 66.70 67.07 3hy5 h VAL 82 Cb 2.31 1.74 -0.13 0.00 -1.52 0.00 0.00 31.29 33.69 3hy5 h VAL 82 CO -0.01 0.26 0.01 0.00 0.02 0.00 0.00 177.57 177.86 3hy5 h ALA 83 N -0.07 0.79 0.24 1.67 0.00 0.16 0.48 119.26 122.55 3hy5 h ALA 83 Ca -0.02 0.24 0.01 0.00 0.00 0.00 0.00 54.91 55.14 3hy5 h ALA 83 Cb 0.55 0.42 -0.04 0.00 0.00 0.00 0.00 17.79 18.72 3hy5 h ALA 83 CO 0.03 -0.42 -0.45 0.28 0.00 0.00 0.00 179.25 178.68 3hy5 h VAL 84 N 0.10 0.11 -1.03 0.00 2.07 -1.03 -1.62 116.25 114.86 3hy5 h VAL 84 Ca 0.42 0.00 0.25 0.00 0.82 0.00 0.00 66.70 68.19 3hy5 h VAL 84 Cb 0.73 0.11 -0.10 0.00 -1.52 0.00 0.00 31.29 30.52 3hy5 h VAL 84 CO -0.67 0.00 0.64 0.00 0.02 0.00 0.00 177.57 177.57 3hy5 h ALA 85 N -0.41 2.07 0.02 1.67 0.00 -0.42 -0.20 119.26 121.99 3hy5 h ALA 85 Ca -0.01 0.08 -0.00 0.00 0.00 0.00 0.00 54.91 54.98 3hy5 h ALA 85 Cb 0.74 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.54 3hy5 h ALA 85 CO -0.18 -0.49 -0.01 1.49 0.00 0.00 0.00 179.25 180.06 3hy5 h GLU 86 N 0.47 -0.02 -0.50 0.00 4.81 -0.85 -2.60 114.58 115.89 3hy5 h GLU 86 Ca 0.61 0.00 -0.03 0.00 -0.13 0.00 0.00 59.36 59.81 3hy5 h GLU 86 Cb 1.38 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 30.74 3hy5 h GLU 86 CO -0.35 0.52 0.19 0.00 -0.73 0.00 0.00 179.01 178.63 3hy5 h ARG 87 N -0.58 0.72 -0.65 1.92 2.47 -0.19 -2.79 114.38 115.28 3hy5 h ARG 87 Ca -0.00 -0.11 0.00 0.00 -1.26 0.00 0.00 59.98 58.61 3hy5 h ARG 87 Cb 0.55 -0.13 0.00 0.00 -1.65 0.00 0.00 29.97 28.74 3hy5 h ARG 87 CO 0.00 0.61 0.00 1.33 0.56 0.00 0.00 179.97 182.47 3hy5 n VAL 88 N -4.34 0.89 0.29 2.04 0.24 -0.23 -4.48 118.33 112.75 3hy5 n VAL 88 Ca 0.04 -0.95 0.18 0.00 -2.04 0.00 0.00 64.34 61.57 3hy5 n VAL 88 Cb 0.17 0.61 0.98 0.00 -1.47 0.00 0.00 33.84 34.13 3hy5 n VAL 88 CO 0.00 0.00 0.00 0.06 -2.14 0.00 0.00 176.83 174.75 3hy5 h GLN 89 N 4.26 0.00 -2.31 7.34 3.07 -1.17 -3.17 115.11 123.12 3hy5 h GLN 89 Ca 0.00 0.00 -0.59 0.00 0.09 0.00 0.00 58.65 58.15 3hy5 h GLN 89 Cb 0.98 0.00 -0.40 0.00 0.08 0.00 0.00 27.48 28.14 3hy5 h GLN 89 CO 0.00 0.00 -0.81 0.39 0.09 0.00 0.00 178.83 178.50 3hy5 n GLU 90 N -3.51 1.47 -4.19 0.06 1.02 -1.26 -5.07 120.64 109.16 3hy5 n GLU 90 Ca -0.02 -3.95 -0.18 0.00 -0.02 0.00 0.00 57.16 52.99 3hy5 n GLU 90 Cb 0.17 -1.84 -0.16 0.00 -0.02 0.00 0.00 31.44 29.59 3hy5 n GLU 90 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 3hy5 s LYS 91 N -1.50 0.68 1.22 3.49 -0.14 -1.20 -5.15 119.74 117.15 3hy5 s LYS 91 Ca 0.35 -0.15 -0.14 0.00 -1.36 0.00 0.00 55.97 54.66 3hy5 s LYS 91 Cb 0.11 -0.69 0.31 0.00 -1.68 0.00 0.00 37.83 35.87 3hy5 s LYS 91 CO -0.10 0.01 1.01 0.16 -0.76 0.00 0.00 175.35 175.67 3hy5 s ASP 92 N 0.48 0.52 0.27 2.83 1.47 -1.26 -4.91 116.67 116.08 3hy5 s ASP 92 Ca -0.06 1.37 0.08 0.00 1.18 0.00 0.00 52.55 55.12 3hy5 s ASP 92 Cb -0.10 -2.11 0.36 0.00 -0.34 0.00 0.00 42.92 40.74 3hy5 s ASP 92 CO -0.00 -4.46 1.62 0.77 0.68 0.00 0.00 175.17 173.78 3hy5 h SER 93 N -2.80 0.10 -0.46 2.11 4.64 -2.01 -2.91 113.55 112.22 3hy5 h SER 93 Ca -0.60 -0.06 -0.01 0.00 -0.47 0.00 0.00 61.79 60.66 3hy5 h SER 93 Cb 1.34 -0.03 -0.02 0.00 -0.31 0.00 0.00 62.40 63.38 3hy5 h SER 93 CO 0.48 0.66 0.26 1.23 -0.87 0.00 0.00 176.83 178.58 3hy5 h GLY 94 N 1.62 0.71 0.13 -0.77 0.00 -1.99 -2.26 103.07 100.51 3hy5 h GLY 94 Ca -0.00 -0.30 0.00 0.00 0.00 0.00 0.00 47.33 47.03 3hy5 h GLY 94 CO 0.08 0.29 -0.28 -2.75 0.00 0.00 0.00 176.54 173.88 3hy5 h PHE 95 N 0.67 -0.80 -0.35 5.60 3.57 -1.86 -2.47 116.94 121.30 3hy5 h PHE 95 Ca 0.17 0.02 0.09 0.00 3.53 0.00 0.00 57.97 61.78 3hy5 h PHE 95 Cb 0.02 0.33 -0.02 0.00 2.79 0.00 0.00 35.95 39.08 3hy5 h PHE 95 CO 0.00 -0.33 0.24 0.74 -2.23 0.00 0.00 178.31 176.74 3hy5 h PHE 96 N -0.45 0.07 -0.28 0.41 0.04 -1.59 0.13 116.94 115.28 3hy5 h PHE 96 Ca -0.01 0.00 -0.03 0.00 2.80 0.00 0.00 57.97 60.73 3hy5 h PHE 96 Cb 0.42 -0.02 -0.02 0.00 2.20 0.00 0.00 35.95 38.53 3hy5 h PHE 96 CO -0.31 0.04 0.05 -0.07 -0.60 0.00 0.00 178.31 177.41 3hy5 h LEU 97 N 0.07 0.37 -0.89 1.54 3.38 -1.06 -1.97 115.31 116.74 3hy5 h LEU 97 Ca 0.16 -0.05 0.05 0.00 0.09 0.00 0.00 57.88 58.13 3hy5 h LEU 97 Cb 0.55 -0.09 -0.06 0.00 0.09 0.00 0.00 40.66 41.15 3hy5 h LEU 97 CO -0.01 0.39 0.57 0.03 0.09 0.00 0.00 178.44 179.51 3hy5 h ARG 98 N 0.40 1.05 -0.14 1.13 3.08 -0.30 0.22 114.38 119.82 3hy5 h ARG 98 Ca 0.09 -0.06 -0.21 0.00 0.07 0.00 0.00 59.98 59.87 3hy5 h ARG 98 Cb 0.19 -0.24 0.00 0.00 0.08 0.00 0.00 29.97 30.01 3hy5 h ARG 98 CO -0.00 0.69 -0.75 0.74 -1.07 0.00 0.00 179.97 179.58 3hy5 h PHE 99 N 1.08 0.91 -0.19 3.04 0.04 -1.48 -2.67 116.94 117.67 3hy5 h PHE 99 Ca 0.37 -0.39 -0.01 0.00 2.80 0.00 0.00 57.97 60.74 3hy5 h PHE 99 Cb 0.07 -0.14 -0.01 0.00 2.20 0.00 0.00 35.95 38.07 3hy5 h PHE 99 CO -0.02 1.20 0.09 0.82 -0.60 0.00 0.00 178.31 179.80 3hy5 h ILE 100 N 0.47 1.13 -0.77 -0.55 5.03 -0.77 -2.72 117.51 119.32 3hy5 h ILE 100 Ca -0.04 -0.37 -0.00 0.00 -0.12 0.00 0.00 64.86 64.33 3hy5 h ILE 100 Cb 1.36 1.03 -0.04 0.00 -3.03 0.00 0.00 36.82 36.14 3hy5 h ILE 100 CO 0.15 0.12 0.46 0.03 -0.68 0.00 0.00 178.15 178.23 3hy5 h ARG 101 N 0.17 1.04 0.00 2.37 3.08 -0.61 -1.66 114.38 118.77 3hy5 h ARG 101 Ca 0.06 -0.09 -0.08 0.00 0.07 0.00 0.00 59.98 59.94 3hy5 h ARG 101 Cb 0.11 -0.22 -0.01 0.00 0.08 0.00 0.00 29.97 29.93 3hy5 h ARG 101 CO -0.01 0.73 -0.37 0.00 -1.07 0.00 0.00 179.97 179.25 3hy5 h ALA 102 N 1.45 0.93 -0.86 0.04 0.00 -1.36 -3.18 119.26 116.28 3hy5 h ALA 102 Ca 0.28 -0.34 -0.52 0.00 0.00 0.00 0.00 54.91 54.33 3hy5 h ALA 102 Cb -0.04 -0.06 -0.28 0.00 0.00 0.00 0.00 17.79 17.41 3hy5 h ALA 102 CO -0.05 0.47 0.48 0.54 0.00 0.00 0.00 179.25 180.68 3hy5 n ARG 103 N -3.45 2.44 -2.29 0.00 5.12 -1.04 -4.92 116.66 112.53 3hy5 n ARG 103 Ca 0.00 -3.24 -0.15 0.00 -1.93 0.00 0.00 57.85 52.53 3hy5 n ARG 103 Cb 0.54 -2.16 -0.01 0.00 -1.16 0.00 0.00 32.46 29.66 3hy5 n ARG 103 CO 0.00 0.00 0.00 1.63 -1.93 0.00 0.00 177.63 177.33 3hy5 n LYS 104 N -1.03 -1.96 -1.13 5.56 4.76 -1.20 -1.22 118.16 121.94 3hy5 n LYS 104 Ca 0.55 0.75 -0.04 0.00 -2.87 0.00 0.00 58.31 56.69 3hy5 n LYS 104 Cb 1.16 -5.32 -0.02 0.00 -1.84 0.00 0.00 35.03 29.01 3hy5 n LYS 104 CO 0.00 0.00 0.00 1.19 -1.37 0.00 0.00 177.40 177.22 3hy5 n PHE 105 N -3.36 0.00 -2.94 2.13 3.72 -0.65 -4.76 117.46 111.60 3hy5 n PHE 105 Ca -0.17 0.00 -0.43 0.00 -0.05 0.00 0.00 57.45 56.79 3hy5 n PHE 105 Cb 0.62 -1.16 -0.05 0.00 -0.94 0.00 0.00 39.48 37.95 3hy5 n PHE 105 CO 0.00 0.00 0.00 1.21 -0.05 0.00 0.00 176.76 177.92 3hy5 s ASN 106 N -2.61 6.28 0.17 4.37 3.84 -0.36 -4.94 114.94 121.68 3hy5 s ASN 106 Ca 0.00 -0.62 -0.19 0.00 0.21 0.00 0.00 52.86 52.27 3hy5 s ASN 106 Cb 0.00 -2.39 0.09 0.00 -0.55 0.00 0.00 41.25 38.40 3hy5 s ASN 106 CO 0.00 -1.16 1.65 0.58 -2.79 0.00 0.00 177.10 175.38 3hy5 h VAL 107 N 5.97 0.50 0.34 -5.21 2.07 -1.94 0.59 116.25 118.57 3hy5 h VAL 107 Ca -0.27 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.25 3hy5 h VAL 107 Cb 1.08 0.50 -0.03 0.00 -1.52 0.00 0.00 31.29 31.31 3hy5 h VAL 107 CO 1.06 0.00 -0.52 1.23 0.02 0.00 0.00 177.57 179.36 3hy5 h GLY 108 N -0.09 -1.22 0.27 2.17 0.00 -1.97 0.43 103.07 102.66 3hy5 h GLY 108 Ca 0.18 0.62 0.10 0.00 0.00 0.00 0.00 47.33 48.23 3hy5 h GLY 108 CO -0.43 -0.33 0.10 3.21 0.00 0.00 0.00 176.54 179.09 3hy5 h ARG 109 N -0.91 0.22 -0.55 4.80 2.47 -1.83 -0.80 114.38 117.78 3hy5 h ARG 109 Ca -0.04 -0.01 0.10 0.00 -1.26 0.00 0.00 59.98 58.77 3hy5 h ARG 109 Cb 0.83 -0.05 -0.08 0.00 -1.65 0.00 0.00 29.97 29.03 3hy5 h ARG 109 CO -0.16 0.15 0.12 0.00 0.56 0.00 0.00 179.97 180.64 3hy5 h ALA 110 N 1.43 0.65 -0.70 0.04 0.00 0.89 -0.58 119.26 120.99 3hy5 h ALA 110 Ca 0.27 0.11 -0.01 0.00 0.00 0.00 0.00 54.91 55.29 3hy5 h ALA 110 Cb 0.39 0.15 -0.03 0.00 0.00 0.00 0.00 17.79 18.29 3hy5 h ALA 110 CO -0.37 -0.30 0.39 -0.92 0.00 0.00 0.00 179.25 178.06 3hy5 h TYR 111 N 0.26 0.95 -0.84 0.00 3.20 0.88 -2.24 116.97 119.18 3hy5 h TYR 111 Ca 0.28 -0.02 0.03 0.00 3.14 0.00 0.00 58.73 62.17 3hy5 h TYR 111 Cb 0.40 -0.31 -0.05 0.00 1.54 0.00 0.00 36.73 38.32 3hy5 h TYR 111 CO -0.23 0.67 0.55 0.93 -1.64 0.00 0.00 178.16 178.44 3hy5 h GLU 112 N 0.96 1.02 -0.50 1.82 4.39 0.21 0.27 114.58 122.74 3hy5 h GLU 112 Ca 0.25 -0.06 -0.04 0.00 0.34 0.00 0.00 59.36 59.84 3hy5 h GLU 112 Cb 0.03 -0.23 -0.02 0.00 -0.10 0.00 0.00 28.75 28.42 3hy5 h GLU 112 CO -0.04 0.67 0.13 1.25 -1.16 0.00 0.00 179.01 179.86 3hy5 h LEU 113 N 1.05 0.70 -0.76 1.33 6.46 -0.72 -1.01 115.31 122.37 3hy5 h LEU 113 Ca 0.33 -0.11 -0.08 0.00 -0.12 0.00 0.00 57.88 57.90 3hy5 h LEU 113 Cb 0.02 -0.18 -0.02 0.00 -0.73 0.00 0.00 40.66 39.74 3hy5 h LEU 113 CO -0.10 0.69 0.05 0.25 -0.62 0.00 0.00 178.44 178.72 3hy5 h LEU 114 N 0.74 0.96 0.46 2.25 5.85 -0.45 0.20 115.31 125.31 3hy5 h LEU 114 Ca 0.17 -0.24 -0.02 0.00 0.84 0.00 0.00 57.88 58.62 3hy5 h LEU 114 Cb 0.26 -0.26 0.00 0.00 0.37 0.00 0.00 40.66 41.04 3hy5 h LEU 114 CO -0.00 0.99 -0.22 0.03 -0.34 0.00 0.00 178.44 178.89 3hy5 h ARG 115 N 0.93 -0.59 -0.11 1.25 3.08 -0.44 -2.12 114.38 116.38 3hy5 h ARG 115 Ca 0.18 0.04 -0.03 0.00 0.07 0.00 0.00 59.98 60.24 3hy5 h ARG 115 Cb 0.47 0.13 -0.01 0.00 0.08 0.00 0.00 29.97 30.64 3hy5 h ARG 115 CO 0.02 -0.35 -0.09 0.78 -1.07 0.00 0.00 179.97 179.26 3hy5 h GLY 116 N -0.69 0.17 0.99 0.04 0.00 -1.15 -0.45 103.07 101.98 3hy5 h GLY 116 Ca -0.06 -0.09 -0.03 0.00 0.00 0.00 0.00 47.33 47.15 3hy5 h GLY 116 CO 0.10 0.08 -0.28 -1.82 0.00 0.00 0.00 176.54 174.63 3hy5 h TYR 117 N 0.15 -0.73 -0.38 5.60 3.20 -0.40 -1.51 116.97 122.90 3hy5 h TYR 117 Ca 0.03 -0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.89 3hy5 h TYR 117 Cb 0.26 0.24 -0.02 0.00 1.54 0.00 0.00 36.73 38.76 3hy5 h TYR 117 CO 0.00 -0.45 0.24 0.28 -1.64 0.00 0.00 178.16 176.59 3hy5 h VAL 118 N -0.77 1.11 -1.01 1.81 2.07 -1.21 -2.91 116.25 115.35 3hy5 h VAL 118 Ca -0.08 -0.24 0.23 0.00 0.82 0.00 0.00 66.70 67.43 3hy5 h VAL 118 Cb 0.60 0.60 -0.11 0.00 -1.52 0.00 0.00 31.29 30.86 3hy5 h VAL 118 CO 0.12 0.11 0.61 -1.13 0.02 0.00 0.00 177.57 177.31 3hy5 h ASN 119 N 0.50 0.66 -0.05 0.57 -1.24 -0.89 -1.70 115.58 113.43 3hy5 h ASN 119 Ca 0.14 0.11 -0.00 0.00 0.71 0.00 0.00 56.30 57.26 3hy5 h ASN 119 Cb -0.02 0.00 -0.00 0.00 0.73 0.00 0.00 38.32 39.03 3hy5 h ASN 119 CO -0.03 0.16 0.03 0.15 -1.29 0.00 0.00 177.43 176.45 3hy5 h PHE 120 N 0.60 0.07 -0.78 0.67 3.57 -1.06 -0.52 116.94 119.48 3hy5 h PHE 120 Ca 0.61 0.00 0.08 0.00 3.53 0.00 0.00 57.97 62.19 3hy5 h PHE 120 Cb 1.17 -0.02 -0.05 0.00 2.79 0.00 0.00 35.95 39.84 3hy5 h PHE 120 CO -0.00 0.07 0.51 0.00 -2.23 0.00 0.00 178.31 176.66 3hy5 h ARG 121 N 0.04 0.74 -0.16 1.11 3.08 -1.38 -0.77 114.38 117.05 3hy5 h ARG 121 Ca 0.02 -0.04 -0.06 0.00 0.07 0.00 0.00 59.98 59.96 3hy5 h ARG 121 Cb 0.02 -0.17 -0.00 0.00 0.08 0.00 0.00 29.97 29.90 3hy5 h ARG 121 CO -0.00 0.49 -0.15 -0.07 -1.07 0.00 0.00 179.97 179.17 3hy5 h LEU 122 N 0.76 0.41 -1.60 3.04 3.38 -1.04 -2.96 115.31 117.30 3hy5 h LEU 122 Ca 0.35 -0.47 -0.01 0.00 0.09 0.00 0.00 57.88 57.84 3hy5 h LEU 122 Cb 0.37 -0.11 -0.00 0.00 0.09 0.00 0.00 40.66 41.01 3hy5 h LEU 122 CO -0.13 0.80 -0.05 1.56 0.09 0.00 0.00 178.44 180.71 3hy5 h GLN 123 N 0.02 0.00 -2.86 1.13 4.20 -0.76 -3.36 115.11 113.48 3hy5 h GLN 123 Ca 0.03 0.00 -0.61 0.00 0.06 0.00 0.00 58.65 58.13 3hy5 h GLN 123 Cb 0.68 0.00 -0.40 0.00 0.30 0.00 0.00 27.48 28.06 3hy5 h GLN 123 CO 0.04 0.05 -0.76 0.71 -0.67 0.00 0.00 178.83 178.19 3hy5 s TYR 124 N -3.76 2.00 0.05 2.96 2.02 -0.33 -4.97 117.35 115.32 3hy5 s TYR 124 Ca 0.00 -2.51 -0.20 0.00 -0.37 0.00 0.00 57.07 53.99 3hy5 s TYR 124 Cb 0.10 -1.78 -0.13 0.00 -0.40 0.00 0.00 41.96 39.75 3hy5 s TYR 124 CO 0.55 -0.75 1.40 -1.00 -1.57 0.00 0.00 175.55 174.17 3hy5 h PRO 125 N 6.32 0.34 -0.88 -1.71 0.13 -1.71 -3.32 132.00 131.16 3hy5 h PRO 125 Ca 0.07 -0.15 0.22 0.00 -0.87 0.00 0.00 66.00 65.27 3hy5 h PRO 125 Cb 0.90 -0.01 -0.05 0.00 0.13 0.00 0.00 31.00 31.97 3hy5 h PRO 125 CO 0.49 0.66 0.60 1.05 -0.23 0.00 0.00 178.00 180.58 3hy5 h GLU 126 N 0.01 0.22 -0.00 0.86 9.09 -1.93 -0.84 114.58 121.99 3hy5 h GLU 126 Ca 0.03 -0.01 0.00 0.00 0.05 0.00 0.00 59.36 59.43 3hy5 h GLU 126 Cb 0.57 -0.05 0.00 0.00 -1.65 0.00 0.00 28.75 27.62 3hy5 h GLU 126 CO 0.03 0.15 -0.00 1.28 0.05 0.00 0.00 179.01 180.51 3hy5 n LEU 127 N -4.42 0.30 0.00 3.06 4.77 -1.25 -4.08 117.00 115.38 3hy5 n LEU 127 Ca 0.19 -0.08 0.00 0.00 -0.03 0.00 0.00 56.01 56.08 3hy5 n LEU 127 Cb 0.80 -0.02 0.00 0.00 -2.33 0.00 0.00 43.42 41.87 3hy5 n LEU 127 CO 0.34 0.05 0.00 0.49 -1.33 0.00 0.00 177.39 176.94 3hy5 n PHE 128 N -0.79 0.00 0.00 -1.77 3.72 -0.47 -4.81 117.46 113.34 3hy5 n PHE 128 Ca 0.22 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.62 3hy5 n PHE 128 Cb 0.17 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.71 3hy5 n PHE 128 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 176.76 176.46 3hy5 n ASP 129 N 0.00 0.00 -1.01 4.37 9.92 -0.44 -4.28 116.55 125.11 3hy5 n ASP 129 Ca 0.00 0.43 0.03 0.00 -0.53 0.00 0.00 54.79 54.72 3hy5 n ASP 129 Cb 0.00 -0.47 0.16 0.00 -0.64 0.00 0.00 41.12 40.17 3hy5 n ASP 129 CO 0.00 0.00 0.00 -1.54 0.13 0.00 0.00 177.20 175.79 3hy5 n SER 130 N -1.96 2.77 -4.66 -2.24 3.41 -1.26 -4.95 113.62 104.73 3hy5 n SER 130 Ca 0.00 -2.34 -0.47 0.00 -0.26 0.00 0.00 58.87 55.80 3hy5 n SER 130 Cb 0.00 -0.54 -0.04 0.00 -0.26 0.00 0.00 64.21 63.37 3hy5 n SER 130 CO 0.00 0.00 0.00 -0.11 -0.16 0.00 0.00 175.04 174.77 3hy5 n LEU 131 N 0.26 2.90 -4.17 1.04 7.94 -1.26 -4.98 117.00 118.74 3hy5 n LEU 131 Ca 0.11 1.08 -0.34 0.00 -1.11 0.00 0.00 56.01 55.75 3hy5 n LEU 131 Cb 0.59 -1.39 -0.15 0.00 0.53 0.00 0.00 43.42 43.01 3hy5 n LEU 131 CO 0.12 -0.38 -0.45 -0.55 -1.11 0.00 0.00 177.39 175.02 3hy5 s SER 132 N 1.11 3.94 0.54 1.96 0.15 -1.26 -4.99 113.70 115.16 3hy5 s SER 132 Ca 0.81 -0.83 0.35 0.00 0.70 0.00 0.00 55.95 56.98 3hy5 s SER 132 Cb -0.72 -1.59 1.53 0.00 -1.71 0.00 0.00 66.02 63.52 3hy5 s SER 132 CO 0.40 -0.08 1.84 -0.65 1.20 0.00 0.00 173.24 175.95 3hy5 h PRO 133 N 7.96 0.00 0.17 5.44 0.11 -2.00 0.25 132.00 143.94 3hy5 h PRO 133 Ca -0.36 -0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.74 3hy5 h PRO 133 Cb 1.11 -0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.22 3hy5 h PRO 133 CO 0.58 0.00 -0.08 1.49 -0.21 0.00 0.00 178.00 179.78 3hy5 h GLU 134 N 0.00 -0.22 -0.90 1.05 4.81 -2.00 -3.01 114.58 114.31 3hy5 h GLU 134 Ca 0.51 0.01 0.08 0.00 -0.13 0.00 0.00 59.36 59.84 3hy5 h GLU 134 Cb 2.06 0.05 -0.06 0.00 0.63 0.00 0.00 28.75 31.43 3hy5 h GLU 134 CO -0.01 0.20 0.58 0.00 -0.73 0.00 0.00 179.01 179.05 3hy5 h ALA 135 N -0.13 1.57 -0.07 2.92 0.00 -0.98 -2.48 119.26 120.08 3hy5 h ALA 135 Ca -0.02 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 3hy5 h ALA 135 Cb 0.52 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 18.07 3hy5 h ALA 135 CO 0.04 0.27 0.01 0.28 0.00 0.00 0.00 179.25 179.85 3hy5 h VAL 136 N 0.96 1.22 -1.00 0.00 2.07 -1.22 -2.88 116.25 115.39 3hy5 h VAL 136 Ca 0.40 -0.67 0.20 0.00 0.82 0.00 0.00 66.70 67.45 3hy5 h VAL 136 Cb 0.30 1.53 -0.10 0.00 -1.52 0.00 0.00 31.29 31.49 3hy5 h VAL 136 CO -0.16 0.19 0.61 -0.09 0.02 0.00 0.00 177.57 178.14 3hy5 h ARG 137 N -0.12 0.67 -0.39 1.57 2.43 -1.31 0.95 114.38 118.19 3hy5 h ARG 137 Ca 0.02 -0.04 0.06 0.00 -0.81 0.00 0.00 59.98 59.22 3hy5 h ARG 137 Cb 0.29 -0.15 -0.06 0.00 -0.42 0.00 0.00 29.97 29.63 3hy5 h ARG 137 CO 0.00 0.45 0.05 0.00 -1.51 0.00 0.00 179.97 178.96 3hy5 h THR 139 N 0.17 1.21 -0.14 0.00 2.02 -0.79 -1.16 112.91 114.22 3hy5 h THR 139 Ca 0.19 -0.68 -0.07 0.00 0.77 0.00 0.00 66.41 66.62 3hy5 h THR 139 Cb 0.24 1.23 -0.01 0.00 -1.74 0.00 0.00 68.15 67.87 3hy5 h THR 139 CO -0.27 0.21 -0.21 0.40 0.37 0.00 0.00 175.52 176.02 3hy5 h ILE 140 N 0.18 1.22 -0.06 3.11 2.04 -1.03 -0.16 117.51 122.80 3hy5 h ILE 140 Ca 0.07 -1.01 -0.14 0.00 1.00 0.00 0.00 64.86 64.78 3hy5 h ILE 140 Cb 0.28 1.35 -0.01 0.00 -0.74 0.00 0.00 36.82 37.70 3hy5 h ILE 140 CO 0.00 0.31 -0.58 -0.33 0.00 0.00 0.00 178.15 177.55 3hy5 h GLU 141 N 0.22 0.21 0.00 2.37 5.08 -0.85 -2.60 114.58 119.01 3hy5 h GLU 141 Ca 0.04 -0.14 -0.00 0.00 -1.00 0.00 0.00 59.36 58.26 3hy5 h GLU 141 Cb 0.51 0.02 -0.00 0.00 0.50 0.00 0.00 28.75 29.77 3hy5 h GLU 141 CO 0.03 0.73 -0.02 0.00 -1.00 0.00 0.00 179.01 178.76 3hy5 h ALA 142 N 1.24 1.19 0.00 3.43 0.00 0.27 -3.36 119.26 122.02 3hy5 h ALA 142 Ca -0.00 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.89 3hy5 h ALA 142 Cb 1.07 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.86 3hy5 h ALA 142 CO 0.09 0.02 0.00 0.41 0.00 0.00 0.00 179.25 179.77 3hy5 n GLY 143 N -0.97 0.90 3.08 0.00 0.00 -0.90 -4.94 105.19 102.35 3hy5 n GLY 143 Ca -0.02 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.67 3hy5 n GLY 143 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3hy5 s TYR 144 N -2.00 3.45 0.58 1.61 2.02 -1.15 -2.41 117.35 119.45 3hy5 s TYR 144 Ca 0.00 -2.45 -0.04 0.00 -0.37 0.00 0.00 57.07 54.21 3hy5 s TYR 144 Cb 0.00 -2.39 0.12 0.00 -0.40 0.00 0.00 41.96 39.29 3hy5 s TYR 144 CO 0.00 -0.89 0.79 -0.35 -1.57 0.00 0.00 175.55 173.52 3hy5 n PRO 145 N 4.43 -0.25 -3.59 -1.71 -0.05 -1.26 -4.24 135.00 128.33 3hy5 n PRO 145 Ca -0.07 -1.77 -0.19 0.00 -0.05 0.00 0.00 63.50 61.42 3hy5 n PRO 145 Cb 0.42 -0.64 -0.01 0.00 -0.05 0.00 0.00 33.50 33.22 3hy5 n PRO 145 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 175.50 175.65 3hy5 s GLY 146 N -4.57 1.54 -0.15 0.55 0.00 0.22 -4.87 107.32 100.04 3hy5 s GLY 146 Ca 0.49 -1.43 -0.04 0.00 0.00 0.00 0.00 44.72 43.74 3hy5 s GLY 146 CO 0.33 -1.37 0.13 0.14 0.00 0.00 0.00 173.10 172.33 3hy5 s VAL 147 N -2.15 -0.18 0.11 1.40 1.01 -1.26 -0.34 120.40 118.98 3hy5 s VAL 147 Ca 0.43 0.01 -0.36 0.00 0.00 0.00 0.00 61.98 62.06 3hy5 s VAL 147 Cb -0.09 -0.50 -0.16 0.00 0.00 0.00 0.00 36.38 35.63 3hy5 s VAL 147 CO 0.30 -0.13 1.39 0.18 0.00 0.00 0.00 175.10 176.84 3hy5 n LEU 148 N 5.30 1.99 0.00 3.92 4.77 0.21 -4.79 117.00 128.40 3hy5 n LEU 148 Ca -0.06 1.11 0.07 0.00 -0.03 0.00 0.00 56.01 57.10 3hy5 n LEU 148 Cb 0.49 -1.25 0.34 0.00 -2.33 0.00 0.00 43.42 40.68 3hy5 n LEU 148 CO 0.08 -0.88 0.68 -1.54 -1.33 0.00 0.00 177.39 174.40 3hy5 n SER 149 N 2.69 0.00 -4.32 -1.43 3.41 -1.26 -4.63 113.62 108.07 3hy5 n SER 149 Ca 0.18 0.08 -0.20 0.00 -0.26 0.00 0.00 58.87 58.66 3hy5 n SER 149 Cb 0.22 -0.28 -0.11 0.00 -0.26 0.00 0.00 64.21 63.78 3hy5 n SER 149 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 3hy5 s SER 150 N -2.55 2.57 0.38 4.04 0.15 -1.26 -4.35 113.70 112.67 3hy5 s SER 150 Ca 0.13 -0.90 -0.05 0.00 0.70 0.00 0.00 55.95 55.83 3hy5 s SER 150 Cb 0.09 -0.14 -0.05 0.00 -1.71 0.00 0.00 66.02 64.22 3hy5 s SER 150 CO 0.21 -0.09 0.66 -0.13 1.20 0.00 0.00 173.24 175.09 3hy5 s ARG 151 N -3.03 3.60 0.28 5.44 0.52 -1.26 -4.21 118.95 120.29 3hy5 s ARG 151 Ca 0.17 0.08 -0.05 0.00 -0.52 0.00 0.00 55.73 55.41 3hy5 s ARG 151 Cb -0.04 -2.52 0.07 0.00 0.52 0.00 0.00 34.95 32.97 3hy5 s ARG 151 CO 0.06 0.03 0.30 -0.40 0.02 0.00 0.00 175.30 175.31 3hy5 n ASP 152 N -1.57 -0.76 0.00 0.23 5.68 -1.03 -4.81 116.55 114.29 3hy5 n ASP 152 Ca -0.01 -0.84 0.07 0.00 -0.50 0.00 0.00 54.79 53.50 3hy5 n ASP 152 Cb 0.55 -0.25 0.39 0.00 -1.14 0.00 0.00 41.12 40.66 3hy5 n ASP 152 CO 0.00 0.00 0.00 2.29 -1.33 0.00 0.00 177.20 178.16 3hy5 n LYS 153 N -2.09 0.35 -0.00 0.11 2.85 -1.26 -2.08 118.16 116.04 3hy5 n LYS 153 Ca 0.04 0.05 0.06 0.00 -1.05 0.00 0.00 58.31 57.42 3hy5 n LYS 153 Cb 0.15 -1.50 -0.09 0.00 -0.65 0.00 0.00 35.03 32.94 3hy5 n LYS 153 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 177.40 178.01 3hy5 n TYR 154 N -1.09 0.00 -0.46 5.58 4.01 -1.26 -4.59 117.16 119.34 3hy5 n TYR 154 Ca 0.09 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.83 3hy5 n TYR 154 Cb 0.07 -0.10 0.00 0.00 -0.31 0.00 0.00 39.34 38.99 3hy5 n TYR 154 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3hy5 n GLY 155 N 1.45 1.16 3.76 2.72 0.00 -0.88 -4.86 105.19 108.53 3hy5 n GLY 155 Ca 0.01 -0.31 -0.36 0.00 0.00 0.00 0.00 46.02 45.36 3hy5 n GLY 155 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3hy5 s ARG 156 N -1.28 3.39 -0.07 1.61 0.52 -1.26 -4.61 118.95 117.27 3hy5 s ARG 156 Ca 0.00 -0.27 -0.29 0.00 -0.52 0.00 0.00 55.73 54.65 3hy5 s ARG 156 Cb 0.00 -3.06 -0.07 0.00 0.52 0.00 0.00 34.95 32.34 3hy5 s ARG 156 CO 0.00 0.65 1.89 0.08 0.02 0.00 0.00 175.30 177.94 3hy5 s VAL 157 N -0.70 3.24 -0.50 3.52 1.01 -1.07 -2.45 120.40 123.45 3hy5 s VAL 157 Ca 0.12 0.29 -0.20 0.00 0.00 0.00 0.00 61.98 62.19 3hy5 s VAL 157 Cb -0.12 -3.22 0.05 0.00 0.00 0.00 0.00 36.38 33.10 3hy5 s VAL 157 CO 0.03 -0.06 0.68 -0.69 0.00 0.00 0.00 175.10 175.05 3hy5 s VAL 158 N 5.13 4.79 0.31 2.92 1.01 -1.26 -1.81 120.40 131.48 3hy5 s VAL 158 Ca 0.85 -0.27 -0.09 0.00 0.00 0.00 0.00 61.98 62.46 3hy5 s VAL 158 Cb -0.36 -4.32 -0.07 0.00 0.00 0.00 0.00 36.38 31.63 3hy5 s VAL 158 CO 0.36 -0.83 0.64 -0.04 0.00 0.00 0.00 175.10 175.23 3hy5 s MET 159 N 2.88 3.78 0.06 2.72 -1.94 -0.38 -0.62 119.30 125.80 3hy5 s MET 159 Ca 0.19 0.32 0.05 0.00 -1.71 0.00 0.00 55.69 54.53 3hy5 s MET 159 Cb -0.17 -2.54 -0.03 0.00 2.01 0.00 0.00 34.83 34.10 3hy5 s MET 159 CO 0.14 0.17 -0.14 -0.51 -0.01 0.00 0.00 175.02 174.67 3hy5 s LEU 160 N -3.33 2.25 -0.12 -0.03 1.43 0.53 -0.52 118.68 118.90 3hy5 s LEU 160 Ca 0.49 -0.57 -0.07 0.00 -1.03 0.00 0.00 54.13 52.95 3hy5 s LEU 160 Cb -0.11 -0.52 0.05 0.00 0.03 0.00 0.00 46.19 45.64 3hy5 s LEU 160 CO 0.26 -0.05 0.29 0.12 0.23 0.00 0.00 176.35 177.19 3hy5 s PHE 161 N -1.16 -0.39 -0.31 0.29 5.36 -0.89 0.72 117.98 121.61 3hy5 s PHE 161 Ca -0.01 0.90 0.03 0.00 -0.96 0.00 0.00 56.93 56.88 3hy5 s PHE 161 Cb -0.09 0.11 0.08 0.00 -0.34 0.00 0.00 43.02 42.77 3hy5 s PHE 161 CO 0.02 -0.25 -0.01 1.21 -1.46 0.00 0.00 175.22 174.73 3hy5 s ASN 162 N 1.15 4.67 0.39 6.13 3.84 -1.26 -0.94 114.94 128.92 3hy5 s ASN 162 Ca -0.08 -1.82 0.21 0.00 0.21 0.00 0.00 52.86 51.38 3hy5 s ASN 162 Cb -0.09 -1.61 0.54 0.00 -0.55 0.00 0.00 41.25 39.54 3hy5 s ASN 162 CO -0.08 -0.31 1.66 -0.29 -2.79 0.00 0.00 177.10 175.29 3hy5 h ILE 163 N 6.66 0.55 -1.96 -5.21 2.10 -1.91 -3.43 117.51 114.29 3hy5 h ILE 163 Ca -0.11 -1.47 -0.64 0.00 1.08 0.00 0.00 64.86 63.73 3hy5 h ILE 163 Cb 1.03 2.03 0.06 0.00 -1.09 0.00 0.00 36.82 38.85 3hy5 h ILE 163 CO 0.50 0.27 0.55 1.21 -1.08 0.00 0.00 178.15 179.61 3hy5 n GLU 164 N -3.27 1.53 -0.85 2.19 2.13 -1.26 -0.32 120.64 120.78 3hy5 n GLU 164 Ca 0.01 0.55 0.00 0.00 0.66 0.00 0.00 57.16 58.38 3hy5 n GLU 164 Cb 0.55 -2.22 0.00 0.00 0.27 0.00 0.00 31.44 30.04 3hy5 n GLU 164 CO 0.00 0.00 0.00 0.09 -0.41 0.00 0.00 177.13 176.81 3hy5 n ASN 165 N 2.72 -1.66 -4.77 4.31 3.02 -1.26 -4.96 115.26 112.66 3hy5 n ASN 165 Ca 0.17 0.00 -0.40 0.00 -0.03 0.00 0.00 54.58 54.32 3hy5 n ASN 165 Cb 0.24 -1.46 -0.02 0.00 -0.61 0.00 0.00 39.78 37.93 3hy5 n ASN 165 CO 0.00 0.00 0.00 0.86 -2.62 0.00 0.00 177.26 175.50 3hy5 s TRP 166 N -2.19 3.16 -0.28 3.10 -0.00 0.56 -5.01 118.94 118.27 3hy5 s TRP 166 Ca 0.00 1.51 -0.01 0.00 -0.00 0.00 0.00 56.10 57.60 3hy5 s TRP 166 Cb 0.00 -3.53 0.09 0.00 -0.00 0.00 0.00 33.47 30.03 3hy5 s TRP 166 CO 0.00 -1.46 0.07 -0.65 -0.00 0.00 0.00 176.95 174.91 3hy5 s GLN 167 N -1.85 0.80 0.64 5.86 -0.21 -1.26 -5.01 119.66 118.63 3hy5 s GLN 167 Ca 0.50 -0.97 0.30 0.00 0.02 0.00 0.00 55.36 55.21 3hy5 s GLN 167 Cb -0.36 -2.09 1.60 0.00 1.00 0.00 0.00 33.01 33.16 3hy5 s GLN 167 CO 0.47 -0.89 1.93 0.66 -2.12 0.00 0.00 175.29 175.34 3hy5 h SER 168 N 8.09 0.00 1.10 5.90 4.64 -1.96 0.19 113.55 131.52 3hy5 h SER 168 Ca -0.14 0.00 -0.15 0.00 -0.47 0.00 0.00 61.79 61.02 3hy5 h SER 168 Cb 1.04 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.11 3hy5 h SER 168 CO 0.44 0.00 -0.73 0.06 -0.87 0.00 0.00 176.83 175.73 3hy5 h GLN 169 N 0.00 0.00 0.05 4.77 -0.00 -2.00 -3.33 115.11 114.60 3hy5 h GLN 169 Ca 0.06 0.00 -0.10 0.00 -0.00 0.00 0.00 58.65 58.61 3hy5 h GLN 169 Cb 0.78 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.26 3hy5 h GLN 169 CO -0.00 0.73 -0.50 0.93 -0.00 0.00 0.00 178.83 179.99 3hy5 h GLU 170 N 0.00 0.11 -4.86 0.06 5.08 -1.06 -3.44 114.58 110.47 3hy5 h GLU 170 Ca -0.01 -0.19 -0.65 0.00 -1.00 0.00 0.00 59.36 57.51 3hy5 h GLU 170 Cb 1.48 0.07 -0.36 0.00 0.50 0.00 0.00 28.75 30.44 3hy5 h GLU 170 CO 0.10 1.09 -0.83 0.42 -1.00 0.00 0.00 179.01 178.78 3hy5 s ILE 171 N -2.32 1.92 0.44 3.13 1.01 -1.03 -5.11 121.20 119.24 3hy5 s ILE 171 Ca -0.18 -1.05 -0.24 0.00 0.00 0.00 0.00 60.65 59.18 3hy5 s ILE 171 Cb -0.00 -1.85 -0.08 0.00 0.01 0.00 0.00 42.46 40.54 3hy5 s ILE 171 CO 0.73 0.34 1.18 0.42 0.00 0.00 0.00 174.94 177.60 3hy5 s THR 172 N 1.30 3.08 0.57 2.92 -4.23 -1.25 -4.40 115.64 113.63 3hy5 s THR 172 Ca 0.01 0.84 0.27 0.00 -1.18 0.00 0.00 61.69 61.63 3hy5 s THR 172 Cb -0.15 -3.44 0.37 0.00 1.34 0.00 0.00 72.50 70.62 3hy5 s THR 172 CO -0.10 0.02 2.03 0.15 -0.54 0.00 0.00 174.62 176.18 3hy5 h PHE 173 N 2.22 0.00 0.18 3.99 3.57 -1.98 -1.48 116.94 123.44 3hy5 h PHE 173 Ca -0.49 0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.00 3hy5 h PHE 173 Cb 1.24 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.99 3hy5 h PHE 173 CO 0.54 0.00 -0.09 -0.44 -2.23 0.00 0.00 178.31 176.09 3hy5 h ASP 174 N 0.00 -0.20 -0.96 0.41 3.32 -1.98 -2.39 116.42 114.62 3hy5 h ASP 174 Ca 0.16 -0.29 0.18 0.00 0.02 0.00 0.00 57.03 57.10 3hy5 h ASP 174 Cb 0.77 0.05 -0.10 0.00 0.22 0.00 0.00 39.33 40.27 3hy5 h ASP 174 CO -0.00 0.22 0.55 -0.33 -1.72 0.00 0.00 179.24 177.96 3hy5 h GLU 175 N -0.67 0.70 -0.49 3.56 5.08 -1.66 0.16 114.58 121.26 3hy5 h GLU 175 Ca -0.02 -0.04 -0.06 0.00 -1.00 0.00 0.00 59.36 58.24 3hy5 h GLU 175 Cb 0.48 -0.16 -0.02 0.00 0.50 0.00 0.00 28.75 29.55 3hy5 h GLU 175 CO 0.04 0.46 0.07 0.82 -1.00 0.00 0.00 179.01 179.41 3hy5 h ILE 176 N 0.72 1.23 -0.08 3.13 2.04 -1.34 -1.43 117.51 121.78 3hy5 h ILE 176 Ca 0.54 -0.86 -0.12 0.00 1.00 0.00 0.00 64.86 65.42 3hy5 h ILE 176 Cb 0.81 0.77 0.01 0.00 -0.74 0.00 0.00 36.82 37.67 3hy5 h ILE 176 CO -0.38 0.31 -0.44 -0.07 0.00 0.00 0.00 178.15 177.58 3hy5 h LEU 177 N 0.74 0.52 -0.92 1.44 3.38 -0.36 -2.36 115.31 117.75 3hy5 h LEU 177 Ca 0.16 -0.66 0.16 0.00 0.09 0.00 0.00 57.88 57.63 3hy5 h LEU 177 Cb 0.34 -0.15 -0.10 0.00 0.09 0.00 0.00 40.66 40.84 3hy5 h LEU 177 CO 0.01 1.10 0.51 1.56 0.09 0.00 0.00 178.44 181.70 3hy5 h GLN 178 N -0.02 0.67 -0.17 1.13 4.20 -0.64 0.18 115.11 120.46 3hy5 h GLN 178 Ca -0.03 -0.04 0.02 0.00 0.06 0.00 0.00 58.65 58.65 3hy5 h GLN 178 Cb 1.09 -0.15 -0.02 0.00 0.30 0.00 0.00 27.48 28.70 3hy5 h GLN 178 CO 0.09 0.45 0.06 0.00 -0.67 0.00 0.00 178.83 178.75 3hy5 h ALA 179 N 1.59 0.18 -0.44 3.87 0.00 -1.18 -1.08 119.26 122.19 3hy5 h ALA 179 Ca 0.51 0.02 0.09 0.00 0.00 0.00 0.00 54.91 55.52 3hy5 h ALA 179 Cb 0.74 0.00 -0.08 0.00 0.00 0.00 0.00 17.79 18.45 3hy5 h ALA 179 CO -0.37 -0.38 -0.04 1.88 0.00 0.00 0.00 179.25 180.35 3hy5 h TYR 180 N 0.14 -0.11 -0.30 0.00 0.05 -0.37 -0.07 116.97 116.33 3hy5 h TYR 180 Ca 0.07 0.04 0.03 0.00 0.05 0.00 0.00 58.73 58.92 3hy5 h TYR 180 Cb 0.04 0.11 -0.03 0.00 1.01 0.00 0.00 36.73 37.86 3hy5 h TYR 180 CO -0.11 -0.13 0.09 0.00 -1.05 0.00 0.00 178.16 176.96 3hy5 h PHE 182 N 0.22 -0.62 -0.10 0.00 3.57 -0.83 -0.31 116.94 118.86 3hy5 h PHE 182 Ca 0.13 -0.01 0.03 0.00 3.53 0.00 0.00 57.97 61.65 3hy5 h PHE 182 Cb 0.11 0.21 -0.00 0.00 2.79 0.00 0.00 35.95 39.05 3hy5 h PHE 182 CO -0.14 -0.39 0.12 0.82 -2.23 0.00 0.00 178.31 176.49 3hy5 h ILE 183 N -0.68 0.46 0.00 1.41 2.04 -0.69 -0.54 117.51 119.52 3hy5 h ILE 183 Ca -0.07 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 65.79 3hy5 h ILE 183 Cb 0.52 0.91 -0.00 0.00 -0.74 0.00 0.00 36.82 37.50 3hy5 h ILE 183 CO 0.11 0.00 -0.01 -0.07 0.00 0.00 0.00 178.15 178.18 3hy5 h LEU 184 N 0.00 0.00 -0.93 1.44 3.38 -0.46 -2.17 115.31 116.56 3hy5 h LEU 184 Ca 0.05 -0.92 0.18 0.00 0.09 0.00 0.00 57.88 57.27 3hy5 h LEU 184 Cb 0.28 0.00 -0.10 0.00 0.09 0.00 0.00 40.66 40.92 3hy5 h LEU 184 CO -0.00 0.97 0.52 -0.33 0.09 0.00 0.00 178.44 179.69 3hy5 h GLU 185 N -1.00 0.65 0.24 1.13 4.39 -0.25 -0.34 114.58 119.39 3hy5 h GLU 185 Ca -0.00 -0.04 -0.01 0.00 0.34 0.00 0.00 59.36 59.65 3hy5 h GLU 185 Cb 0.93 -0.15 0.00 0.00 -0.10 0.00 0.00 28.75 29.44 3hy5 h GLU 185 CO -0.00 0.43 -0.11 0.87 -1.16 0.00 0.00 179.01 179.03 3hy5 h LYS 186 N 0.67 -0.31 -0.48 2.33 1.79 -1.23 -3.32 116.57 116.02 3hy5 h LYS 186 Ca 0.53 0.02 0.14 0.00 -2.18 0.00 0.00 60.65 59.16 3hy5 h LYS 186 Cb 0.82 0.07 -0.02 0.00 -1.58 0.00 0.00 32.23 31.52 3hy5 h LYS 186 CO -0.39 -0.20 0.42 -0.07 -1.08 0.00 0.00 179.45 178.13 3hy5 h LEU 187 N -0.71 0.00 0.00 2.94 3.38 -1.28 0.17 115.31 119.81 3hy5 h LEU 187 Ca -0.03 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.94 3hy5 h LEU 187 Cb 0.24 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.99 3hy5 h LEU 187 CO 0.05 0.00 0.00 0.18 0.09 0.00 0.00 178.44 178.76 3hy5 n LEU 188 N -4.00 0.00 0.07 1.67 4.77 -0.15 -1.86 117.00 117.50 3hy5 n LEU 188 Ca 0.09 0.32 0.09 0.00 -0.03 0.00 0.00 56.01 56.48 3hy5 n LEU 188 Cb 0.63 -0.32 0.40 0.00 -2.33 0.00 0.00 43.42 41.80 3hy5 n LEU 188 CO 0.32 -0.11 0.79 -0.62 -1.33 0.00 0.00 177.39 176.43 3hy5 n GLU 189 N -1.32 0.10 -3.43 3.23 1.02 0.60 -4.56 120.64 116.28 3hy5 n GLU 189 Ca 0.08 0.34 -0.44 0.00 -0.02 0.00 0.00 57.16 57.13 3hy5 n GLU 189 Cb 0.16 -1.69 -0.09 0.00 -0.02 0.00 0.00 31.44 29.80 3hy5 n GLU 189 CO 0.00 0.00 0.00 1.21 1.18 0.00 0.00 177.13 179.52 3hy5 s ASN 190 N -3.63 6.12 0.42 1.62 3.84 -0.77 -4.60 114.94 117.94 3hy5 s ASN 190 Ca 0.05 -1.08 0.17 0.00 0.21 0.00 0.00 52.86 52.22 3hy5 s ASN 190 Cb 0.09 -2.17 1.08 0.00 -0.55 0.00 0.00 41.25 39.70 3hy5 s ASN 190 CO 0.32 -0.53 1.86 -0.33 -2.79 0.00 0.00 177.10 175.63 3hy5 h GLU 191 N 8.68 0.40 0.17 0.43 5.08 -1.87 0.28 114.58 127.74 3hy5 h GLU 191 Ca -0.28 -0.02 0.01 0.00 -1.00 0.00 0.00 59.36 58.07 3hy5 h GLU 191 Cb 1.12 -0.09 -0.02 0.00 0.50 0.00 0.00 28.75 30.25 3hy5 h GLU 191 CO 0.79 0.26 -0.23 1.49 -1.00 0.00 0.00 179.01 180.33 3hy5 h GLU 192 N 0.41 -0.43 -0.65 2.33 4.81 -1.93 -1.97 114.58 117.14 3hy5 h GLU 192 Ca 0.45 0.03 0.10 0.00 -0.13 0.00 0.00 59.36 59.81 3hy5 h GLU 192 Cb 1.12 0.10 -0.07 0.00 0.63 0.00 0.00 28.75 30.53 3hy5 h GLU 192 CO -0.17 -0.29 0.27 1.15 -0.73 0.00 0.00 179.01 179.25 3hy5 h THR 193 N -0.45 0.78 -0.83 0.32 2.02 -1.26 -0.57 112.91 112.92 3hy5 h THR 193 Ca 0.01 -0.16 0.21 0.00 0.77 0.00 0.00 66.41 67.25 3hy5 h THR 193 Cb 0.45 0.27 -0.05 0.00 -1.74 0.00 0.00 68.15 67.08 3hy5 h THR 193 CO -0.09 0.09 0.57 1.56 0.37 0.00 0.00 175.52 178.02 3hy5 h GLN 194 N 0.47 0.18 0.00 6.66 4.20 -0.58 0.61 115.11 126.65 3hy5 h GLN 194 Ca 0.33 -0.01 -0.35 0.00 0.06 0.00 0.00 58.65 58.68 3hy5 h GLN 194 Cb 0.40 -0.04 -0.07 0.00 0.30 0.00 0.00 27.48 28.08 3hy5 h GLN 194 CO -0.31 0.12 -2.28 -0.89 -0.67 0.00 0.00 178.83 174.80 3hy5 n ILE 195 N -4.40 1.38 0.00 2.54 5.41 -0.43 -4.47 119.36 119.40 3hy5 n ILE 195 Ca 0.17 -0.84 -0.03 0.00 1.00 0.00 0.00 62.75 63.05 3hy5 n ILE 195 Cb 0.77 -0.52 -0.11 0.00 -0.71 0.00 0.00 39.64 39.07 3hy5 n ILE 195 CO 0.00 0.00 0.00 0.59 0.00 0.00 0.00 176.55 177.14 3hy5 n ASN 196 N -2.78 0.71 0.00 4.38 3.02 -0.35 -4.93 115.26 115.31 3hy5 n ASN 196 Ca -0.30 0.32 0.00 0.00 -0.03 0.00 0.00 54.58 54.57 3hy5 n ASN 196 Cb 1.13 0.32 0.00 0.00 -0.61 0.00 0.00 39.78 40.62 3hy5 n ASN 196 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3hy5 n GLY 197 N 1.47 -1.83 3.68 7.41 0.00 0.18 -4.64 105.19 111.46 3hy5 n GLY 197 Ca -0.14 -1.62 -0.29 0.00 0.00 0.00 0.00 46.02 43.97 3hy5 n GLY 197 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3hy5 s PHE 198 N 0.00 2.30 -0.30 1.61 0.08 0.34 -2.60 117.98 119.40 3hy5 s PHE 198 Ca 0.00 -0.76 -0.09 0.00 0.12 0.00 0.00 56.93 56.20 3hy5 s PHE 198 Cb 0.00 -1.74 0.14 0.00 -0.57 0.00 0.00 43.02 40.85 3hy5 s PHE 198 CO 0.00 0.34 0.66 0.00 -0.10 0.00 0.00 175.22 176.12 3hy5 s ILE 200 N 2.87 5.38 -0.15 0.00 1.01 -0.58 -1.25 121.20 128.48 3hy5 s ILE 200 Ca -0.01 0.17 -0.07 0.00 0.00 0.00 0.00 60.65 60.75 3hy5 s ILE 200 Cb -0.12 -3.42 -0.04 0.00 0.01 0.00 0.00 42.46 38.89 3hy5 s ILE 200 CO -0.19 0.49 0.08 -0.63 0.00 0.00 0.00 174.94 174.69 3hy5 s ILE 201 N -0.05 4.98 -0.31 2.92 -1.09 0.33 -0.84 121.20 127.14 3hy5 s ILE 201 Ca 0.10 0.02 0.03 0.00 -2.23 0.00 0.00 60.65 58.57 3hy5 s ILE 201 Cb -0.11 -3.20 0.09 0.00 -1.58 0.00 0.00 42.46 37.65 3hy5 s ILE 201 CO -0.00 0.53 0.02 -1.61 -1.23 0.00 0.00 174.94 172.65 3hy5 s GLU 202 N -0.27 1.57 -1.23 2.79 0.41 0.94 -2.09 118.70 120.82 3hy5 s GLU 202 Ca 0.09 -1.64 -0.17 0.00 -0.41 0.00 0.00 54.97 52.84 3hy5 s GLU 202 Cb -0.12 -2.99 0.10 0.00 -1.78 0.00 0.00 34.13 29.34 3hy5 s GLU 202 CO 0.01 -0.85 1.59 1.21 -0.49 0.00 0.00 175.26 176.74 3hy5 s ASN 203 N 1.04 6.86 -0.33 -0.19 2.47 -0.12 -1.51 114.94 123.16 3hy5 s ASN 203 Ca 0.06 -2.48 -0.04 0.00 0.42 0.00 0.00 52.86 50.82 3hy5 s ASN 203 Cb -0.19 -2.52 0.01 0.00 -1.45 0.00 0.00 41.25 37.10 3hy5 s ASN 203 CO -0.09 -1.08 2.84 0.49 -3.72 0.00 0.00 177.10 175.54 3hy5 n PHE 204 N 7.58 1.21 0.12 0.43 0.99 -0.82 -2.75 117.46 124.22 3hy5 n PHE 204 Ca 0.43 -1.83 -0.24 0.00 -0.00 0.00 0.00 57.45 55.81 3hy5 n PHE 204 Cb 0.46 -1.35 -0.15 0.00 -1.00 0.00 0.00 39.48 37.43 3hy5 n PHE 204 CO 0.00 0.00 0.00 -0.22 -0.00 0.00 0.00 176.76 176.54 3hy5 h LYS 205 N 2.76 0.47 -0.34 -1.08 1.63 -1.68 -3.16 116.57 115.16 3hy5 h LYS 205 Ca 0.33 -0.80 0.00 0.00 -0.85 0.00 0.00 60.65 59.32 3hy5 h LYS 205 Cb 0.92 0.30 0.00 0.00 -0.60 0.00 0.00 32.23 32.85 3hy5 h LYS 205 CO 0.70 1.38 0.00 0.41 -3.45 0.00 0.00 179.45 178.49 3hy5 n GLY 206 N 1.76 0.80 3.67 5.01 0.00 -1.26 -4.93 105.19 110.24 3hy5 n GLY 206 Ca -0.19 -0.46 -0.44 0.00 0.00 0.00 0.00 46.02 44.93 3hy5 n GLY 206 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 3hy5 n PHE 207 N 0.65 2.47 -4.14 1.61 7.35 -1.25 -4.51 117.46 119.64 3hy5 n PHE 207 Ca 0.15 -0.29 -0.24 0.00 -0.76 0.00 0.00 57.45 56.31 3hy5 n PHE 207 Cb 0.36 -2.77 -0.06 0.00 0.35 0.00 0.00 39.48 37.36 3hy5 n PHE 207 CO 0.00 0.00 0.00 0.95 -0.76 0.00 0.00 176.76 176.95 3hy5 s THR 208 N 4.38 4.20 0.42 -2.13 -4.23 -1.26 -4.82 115.64 112.19 3hy5 s THR 208 Ca 0.90 -1.37 0.11 0.00 -1.18 0.00 0.00 61.69 60.15 3hy5 s THR 208 Cb -0.50 -3.19 0.18 0.00 1.34 0.00 0.00 72.50 70.33 3hy5 s THR 208 CO 0.45 -0.23 1.97 0.24 -0.54 0.00 0.00 174.62 176.51 3hy5 h MET 209 N 2.08 0.19 0.00 3.99 0.00 -1.99 0.41 114.93 119.60 3hy5 h MET 209 Ca -0.47 -0.03 -0.04 0.00 0.00 0.00 0.00 59.70 59.15 3hy5 h MET 209 Cb 1.22 -0.03 -0.01 0.00 0.00 0.00 0.00 31.60 32.78 3hy5 h MET 209 CO 0.61 0.29 -0.20 0.37 0.00 0.00 0.00 176.91 177.98 3hy5 h GLN 210 N 0.18 0.00 0.21 1.72 4.15 -1.99 -2.38 115.11 117.00 3hy5 h GLN 210 Ca 0.04 0.00 -0.32 0.00 0.77 0.00 0.00 58.65 59.14 3hy5 h GLN 210 Cb 0.29 0.00 0.03 0.00 0.21 0.00 0.00 27.48 28.00 3hy5 h GLN 210 CO 0.02 0.20 -1.46 1.96 -1.93 0.00 0.00 178.83 177.61 3hy5 h GLN 211 N 0.00 0.45 -0.37 1.69 4.20 -1.53 -3.18 115.11 116.36 3hy5 h GLN 211 Ca -0.00 -0.76 0.06 0.00 0.06 0.00 0.00 58.65 58.00 3hy5 h GLN 211 Cb 0.37 0.28 -0.05 0.00 0.30 0.00 0.00 27.48 28.38 3hy5 h GLN 211 CO 0.03 1.37 0.06 0.00 -0.67 0.00 0.00 178.83 179.61 3hy5 h ALA 212 N 0.11 0.39 0.00 3.87 0.00 -0.65 -1.41 119.26 121.57 3hy5 h ALA 212 Ca -0.27 0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.72 3hy5 h ALA 212 Cb 2.05 0.11 0.00 0.00 0.00 0.00 0.00 17.79 19.95 3hy5 h ALA 212 CO 0.22 -0.34 0.00 0.00 0.00 0.00 0.00 179.25 179.12 3hy5 n ALA 213 N -2.44 2.09 0.12 0.00 0.00 -0.93 -2.92 120.51 116.44 3hy5 n ALA 213 Ca 0.02 -0.02 0.05 0.00 0.00 0.00 0.00 53.44 53.49 3hy5 n ALA 213 Cb 0.17 -1.42 0.23 0.00 0.00 0.00 0.00 19.45 18.43 3hy5 n ALA 213 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 3hy5 n SER 214 N -1.97 3.32 -4.42 0.00 3.41 -0.54 -4.83 113.62 108.60 3hy5 n SER 214 Ca 0.05 -2.35 -0.38 0.00 -0.26 0.00 0.00 58.87 55.92 3hy5 n SER 214 Cb 0.33 -0.50 -0.12 0.00 -0.26 0.00 0.00 64.21 63.67 3hy5 n SER 214 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 3hy5 s LEU 215 N -1.42 4.11 -0.10 1.04 1.43 -1.15 -5.03 118.68 117.57 3hy5 s LEU 215 Ca 0.32 -0.60 -0.30 0.00 -1.03 0.00 0.00 54.13 52.53 3hy5 s LEU 215 Cb 0.22 -1.98 -0.03 0.00 0.03 0.00 0.00 46.19 44.43 3hy5 s LEU 215 CO 0.14 -0.21 1.26 -0.13 0.23 0.00 0.00 176.35 177.64 3hy5 s ARG 216 N 1.59 4.29 0.41 1.70 0.52 -1.26 -4.90 118.95 121.29 3hy5 s ARG 216 Ca 0.04 1.71 0.13 0.00 -0.52 0.00 0.00 55.73 57.09 3hy5 s ARG 216 Cb -0.17 -3.66 0.97 0.00 0.52 0.00 0.00 34.95 32.61 3hy5 s ARG 216 CO 0.06 -0.58 1.92 1.15 0.02 0.00 0.00 175.30 177.87 3hy5 h THR 217 N 5.22 0.85 -0.89 0.02 2.02 -1.99 0.15 112.91 118.29 3hy5 h THR 217 Ca -0.31 -0.17 0.08 0.00 0.77 0.00 0.00 66.41 66.77 3hy5 h THR 217 Cb 1.14 0.29 -0.06 0.00 -1.74 0.00 0.00 68.15 67.78 3hy5 h THR 217 CO 0.92 0.09 0.57 0.77 0.37 0.00 0.00 175.52 178.25 3hy5 h SER 218 N 0.51 0.84 -0.10 4.18 4.64 -2.00 -1.74 113.55 119.88 3hy5 h SER 218 Ca 0.36 0.01 -0.08 0.00 -0.47 0.00 0.00 61.79 61.61 3hy5 h SER 218 Cb 0.70 -0.16 0.00 0.00 -0.31 0.00 0.00 62.40 62.63 3hy5 h SER 218 CO -0.13 0.52 -0.27 0.44 -0.87 0.00 0.00 176.83 176.52 3hy5 h ASP 219 N 0.94 0.40 -0.88 4.97 3.32 -1.12 -2.93 116.42 121.13 3hy5 h ASP 219 Ca 0.39 -0.60 0.13 0.00 0.02 0.00 0.00 57.03 56.98 3hy5 h ASP 219 Cb 0.30 -0.12 -0.09 0.00 0.22 0.00 0.00 39.33 39.64 3hy5 h ASP 219 CO -0.16 0.93 0.50 -0.07 -1.72 0.00 0.00 179.24 178.72 3hy5 h LEU 220 N -0.10 0.67 -1.01 1.55 3.38 -0.92 0.13 115.31 119.01 3hy5 h LEU 220 Ca -0.01 0.07 -0.02 0.00 0.09 0.00 0.00 57.88 58.01 3hy5 h LEU 220 Cb 0.88 -0.05 -0.04 0.00 0.09 0.00 0.00 40.66 41.55 3hy5 h LEU 220 CO 0.06 0.32 0.42 0.03 0.09 0.00 0.00 178.44 179.36 3hy5 h ARG 221 N 0.75 1.12 -0.15 1.13 3.08 -1.35 -0.12 114.38 118.84 3hy5 h ARG 221 Ca 0.46 -0.14 0.04 0.00 0.07 0.00 0.00 59.98 60.41 3hy5 h ARG 221 Cb 0.56 -0.22 -0.04 0.00 0.08 0.00 0.00 29.97 30.36 3hy5 h ARG 221 CO -0.31 0.83 -0.09 -0.22 -1.07 0.00 0.00 179.97 179.11 3hy5 h LYS 222 N 1.12 -0.08 0.51 0.04 3.64 -0.58 0.44 116.57 121.66 3hy5 h LYS 222 Ca 0.28 0.01 -0.02 0.00 -1.27 0.00 0.00 60.65 59.64 3hy5 h LYS 222 Cb 0.06 0.02 0.00 0.00 -0.41 0.00 0.00 32.23 31.89 3hy5 h LYS 222 CO -0.04 -0.05 -0.29 1.98 -2.27 0.00 0.00 179.45 178.77 3hy5 h MET 223 N -0.08 -0.72 -0.97 1.90 4.05 -0.89 -1.80 114.93 116.42 3hy5 h MET 223 Ca 0.09 0.05 0.22 0.00 -0.28 0.00 0.00 59.70 59.78 3hy5 h MET 223 Cb 0.21 0.16 -0.18 0.00 -0.80 0.00 0.00 31.60 30.99 3hy5 h MET 223 CO -0.20 -0.48 -0.14 0.28 0.23 0.00 0.00 176.91 176.59 3hy5 h VAL 224 N -0.75 0.03 -0.06 -5.77 2.07 -0.85 0.29 116.25 111.21 3hy5 h VAL 224 Ca -0.07 -0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.48 3hy5 h VAL 224 Cb 0.59 0.03 -0.04 0.00 -1.52 0.00 0.00 31.29 30.35 3hy5 h VAL 224 CO 0.08 0.00 -0.18 0.44 0.02 0.00 0.00 177.57 177.94 3hy5 h ASP 225 N 0.01 -0.54 -0.74 0.57 5.19 0.08 0.89 116.42 121.87 3hy5 h ASP 225 Ca 0.51 0.09 0.15 0.00 -0.62 0.00 0.00 57.03 57.15 3hy5 h ASP 225 Cb 0.89 0.24 -0.14 0.00 0.18 0.00 0.00 39.33 40.50 3hy5 h ASP 225 CO -0.97 -0.23 -0.19 -0.03 -3.12 0.00 0.00 179.24 174.70 3hy5 h MET 226 N -0.26 -0.00 -0.02 3.56 1.85 0.42 -0.27 114.93 120.21 3hy5 h MET 226 Ca 0.08 0.00 -0.06 0.00 -0.61 0.00 0.00 59.70 59.11 3hy5 h MET 226 Cb 0.36 0.00 -0.01 0.00 0.43 0.00 0.00 31.60 32.39 3hy5 h MET 226 CO -0.22 -0.00 -0.26 -0.07 -0.40 0.00 0.00 176.91 175.96 3hy5 h LEU 227 N -0.00 0.02 -8.60 3.39 4.07 -0.02 -3.30 115.31 110.87 3hy5 h LEU 227 Ca 0.35 -0.01 -0.65 0.00 0.08 0.00 0.00 57.88 57.66 3hy5 h LEU 227 Cb 0.54 -0.01 -0.25 0.00 1.08 0.00 0.00 40.66 42.03 3hy5 h LEU 227 CO -0.76 0.28 -0.70 -1.10 -1.08 0.00 0.00 178.44 175.08 3hy5 s GLN 228 N -4.46 3.51 -1.61 1.13 -0.21 0.16 -4.72 119.66 113.46 3hy5 s GLN 228 Ca -0.04 -0.58 -0.18 0.00 0.02 0.00 0.00 55.36 54.59 3hy5 s GLN 228 Cb 0.15 -2.98 0.15 0.00 1.00 0.00 0.00 33.01 31.33 3hy5 s GLN 228 CO 0.71 -0.01 0.71 -0.25 -2.12 0.00 0.00 175.29 174.33 3hy5 n ASP 229 N 4.28 -3.16 0.07 5.90 8.00 -1.26 -4.75 116.55 125.63 3hy5 n ASP 229 Ca -0.18 -0.90 0.00 0.00 0.71 0.00 0.00 54.79 54.42 3hy5 n ASP 229 Cb 0.52 -2.61 0.00 0.00 -0.02 0.00 0.00 41.12 39.01 3hy5 n ASP 229 CO 0.00 0.00 0.00 -0.24 -0.39 0.00 0.00 177.20 176.57 3hy5 n SER 230 N -2.54 0.79 -4.86 -2.24 2.88 -1.26 -4.16 113.62 102.23 3hy5 n SER 230 Ca 0.07 0.23 -0.31 0.00 -1.33 0.00 0.00 58.87 57.53 3hy5 n SER 230 Cb 0.49 -0.15 -0.05 0.00 -0.75 0.00 0.00 64.21 63.75 3hy5 n SER 230 CO 0.00 0.00 0.00 -0.36 -1.23 0.00 0.00 175.04 173.45 3hy5 s PHE 231 N -2.00 3.40 -0.46 0.66 0.08 -1.24 -3.75 117.98 114.67 3hy5 s PHE 231 Ca 0.00 0.20 -0.06 0.00 0.12 0.00 0.00 56.93 57.19 3hy5 s PHE 231 Cb 0.00 -1.72 -0.18 0.00 -0.57 0.00 0.00 43.02 40.55 3hy5 s PHE 231 CO 0.00 0.57 3.03 -2.30 -0.10 0.00 0.00 175.22 176.42 3hy5 n PRO 232 N 0.47 2.20 -4.45 0.24 -0.02 -1.26 -4.85 135.00 127.33 3hy5 n PRO 232 Ca -0.07 -1.22 -0.25 0.00 -2.02 0.00 0.00 63.50 59.94 3hy5 n PRO 232 Cb 0.51 -2.18 -0.10 0.00 -0.02 0.00 0.00 33.50 31.71 3hy5 n PRO 232 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3hy5 s ALA 233 N 1.70 2.70 -0.61 3.55 0.00 -1.26 -4.74 121.76 123.11 3hy5 s ALA 233 Ca 0.58 -1.79 -0.08 0.00 0.00 0.00 0.00 51.96 50.68 3hy5 s ALA 233 Cb 0.24 -0.31 0.16 0.00 0.00 0.00 0.00 23.12 23.20 3hy5 s ALA 233 CO -0.02 0.33 0.47 1.03 0.00 0.00 0.00 175.76 177.58 3hy5 s ARG 234 N -3.23 2.76 -0.52 0.00 0.52 -1.26 -5.02 118.95 112.20 3hy5 s ARG 234 Ca 0.27 -2.18 -0.27 0.00 -0.52 0.00 0.00 55.73 53.02 3hy5 s ARG 234 Cb -0.06 -3.98 0.03 0.00 0.52 0.00 0.00 34.95 31.46 3hy5 s ARG 234 CO 0.13 -1.21 1.09 -0.06 0.02 0.00 0.00 175.30 175.27 3hy5 s PHE 235 N 0.61 2.75 -0.09 -0.53 0.08 -1.26 -0.51 117.98 119.03 3hy5 s PHE 235 Ca 0.12 0.43 0.22 0.00 0.12 0.00 0.00 56.93 57.82 3hy5 s PHE 235 Cb -0.20 -4.33 -0.26 0.00 -0.57 0.00 0.00 43.02 37.66 3hy5 s PHE 235 CO -0.04 -1.37 0.61 1.63 -0.10 0.00 0.00 175.22 175.96 3hy5 n LYS 236 N 7.88 0.64 -3.64 0.44 4.76 -0.90 -4.96 118.16 122.38 3hy5 n LYS 236 Ca 0.08 -0.12 -0.03 0.00 -2.87 0.00 0.00 58.31 55.36 3hy5 n LYS 236 Cb 0.49 -1.59 -0.07 0.00 -1.84 0.00 0.00 35.03 32.02 3hy5 n LYS 236 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 3hy5 s ALA 237 N -3.48 -2.23 -0.16 7.82 0.00 -1.26 -4.87 121.76 117.59 3hy5 s ALA 237 Ca -0.06 2.17 -0.02 0.00 0.00 0.00 0.00 51.96 54.05 3hy5 s ALA 237 Cb 0.13 -1.67 -0.02 0.00 0.00 0.00 0.00 23.12 21.56 3hy5 s ALA 237 CO 0.88 -0.33 -0.08 0.42 0.00 0.00 0.00 175.76 176.65 3hy5 s ILE 238 N 1.21 3.43 -0.07 0.00 1.01 -0.59 -1.53 121.20 124.66 3hy5 s ILE 238 Ca -0.08 -0.51 0.03 0.00 0.00 0.00 0.00 60.65 60.09 3hy5 s ILE 238 Cb -0.04 -2.49 -0.02 0.00 0.01 0.00 0.00 42.46 39.92 3hy5 s ILE 238 CO -0.14 0.49 -0.14 -1.00 0.00 0.00 0.00 174.94 174.15 3hy5 s HIS 239 N 0.59 2.73 -0.01 3.97 3.76 -0.02 0.18 115.29 126.48 3hy5 s HIS 239 Ca -0.05 -0.33 0.07 0.00 -0.15 0.00 0.00 55.06 54.61 3hy5 s HIS 239 Cb -0.15 -1.69 -0.02 0.00 1.11 0.00 0.00 32.58 31.82 3hy5 s HIS 239 CO 0.03 0.05 -0.22 -0.06 -0.85 0.00 0.00 174.74 173.69 3hy5 s PHE 240 N -0.38 2.44 0.01 1.40 0.08 0.58 -0.04 117.98 122.07 3hy5 s PHE 240 Ca 0.04 -0.35 0.01 0.00 0.12 0.00 0.00 56.93 56.76 3hy5 s PHE 240 Cb -0.12 -1.50 -0.01 0.00 -0.57 0.00 0.00 43.02 40.81 3hy5 s PHE 240 CO 0.02 0.08 -0.05 0.96 -0.10 0.00 0.00 175.22 176.13 3hy5 s ILE 241 N -0.72 0.36 -1.97 0.64 -4.36 -0.57 -2.41 121.20 112.16 3hy5 s ILE 241 Ca 0.11 -0.55 0.00 0.00 -0.26 0.00 0.00 60.65 59.95 3hy5 s ILE 241 Cb -0.10 -0.37 0.00 0.00 1.25 0.00 0.00 42.46 43.24 3hy5 s ILE 241 CO 0.01 -0.14 0.00 1.41 0.24 0.00 0.00 174.94 176.46 3hy5 n HIS 242 N 2.32 -0.04 -1.92 1.37 8.25 -0.66 -1.94 115.22 122.59 3hy5 n HIS 242 Ca -0.17 0.00 -0.38 0.00 -0.26 0.00 0.00 57.72 56.91 3hy5 n HIS 242 Cb 0.57 -3.20 0.03 0.00 1.12 0.00 0.00 29.99 28.50 3hy5 n HIS 242 CO 0.00 0.00 0.00 1.14 0.64 0.00 0.00 176.34 178.12 3hy5 s GLN 243 N -3.66 3.32 0.95 -0.41 0.00 -1.19 -3.94 119.66 114.73 3hy5 s GLN 243 Ca 0.00 2.10 -0.12 0.00 -0.00 0.00 0.00 55.36 57.33 3hy5 s GLN 243 Cb 0.00 -2.30 0.16 0.00 0.00 0.00 0.00 33.01 30.87 3hy5 s GLN 243 CO 0.00 -1.00 1.11 -2.14 0.00 0.00 0.00 175.29 173.26 3hy5 s PRO 244 N -2.85 0.82 0.00 9.60 0.02 -1.26 -4.91 135.00 136.42 3hy5 s PRO 244 Ca 0.69 0.43 0.11 0.00 0.02 0.00 0.00 61.00 62.25 3hy5 s PRO 244 Cb -0.37 -1.79 0.52 0.00 0.02 0.00 0.00 34.50 32.88 3hy5 s PRO 244 CO 0.44 -2.44 1.25 -2.67 -0.33 0.00 0.00 177.00 173.24 3hy5 n TRP 245 N -3.96 0.00 0.10 6.54 4.27 -1.26 -1.91 117.44 121.21 3hy5 n TRP 245 Ca 0.06 0.00 0.09 0.00 -3.89 0.00 0.00 57.50 53.76 3hy5 n TRP 245 Cb 0.58 -0.32 0.18 0.00 -1.36 0.00 0.00 31.31 30.39 3hy5 n TRP 245 CO 0.00 0.00 0.00 2.48 -2.29 0.00 0.00 177.69 177.88 3hy5 n TYR 246 N -1.32 0.47 0.25 -2.67 0.18 -1.26 -4.33 117.16 108.48 3hy5 n TYR 246 Ca 0.05 -0.32 0.08 0.00 1.88 0.00 0.00 57.90 59.59 3hy5 n TYR 246 Cb 0.09 -0.01 0.61 0.00 -0.38 0.00 0.00 39.34 39.66 3hy5 n TYR 246 CO 0.00 0.00 0.00 0.35 -2.08 0.00 0.00 176.86 175.13 3hy5 h PHE 247 N 3.37 0.00 -0.72 -3.48 3.57 -1.73 -1.34 116.94 116.61 3hy5 h PHE 247 Ca 0.00 0.00 0.05 0.00 3.53 0.00 0.00 57.97 61.55 3hy5 h PHE 247 Cb 0.83 0.00 -0.04 0.00 2.79 0.00 0.00 35.95 39.53 3hy5 h PHE 247 CO 0.24 0.07 0.47 1.15 -2.23 0.00 0.00 178.31 178.01 3hy5 h THR 248 N 0.00 1.06 -0.89 4.41 2.02 -1.81 0.16 112.91 117.86 3hy5 h THR 248 Ca -0.00 -0.28 -0.02 0.00 0.77 0.00 0.00 66.41 66.88 3hy5 h THR 248 Cb 0.12 0.18 -0.04 0.00 -1.74 0.00 0.00 68.15 66.67 3hy5 h THR 248 CO 0.01 0.15 0.48 0.74 0.37 0.00 0.00 175.52 177.27 3hy5 h THR 249 N 0.81 1.26 0.01 3.16 2.02 -1.55 -0.61 112.91 118.02 3hy5 h THR 249 Ca 0.30 -0.66 -0.22 0.00 0.77 0.00 0.00 66.41 66.60 3hy5 h THR 249 Cb 0.16 0.06 -0.03 0.00 -1.74 0.00 0.00 68.15 66.60 3hy5 h THR 249 CO -0.09 0.30 -1.09 0.74 0.37 0.00 0.00 175.52 175.74 3hy5 h THR 250 N 1.26 1.61 -0.28 3.16 2.02 -1.26 -3.20 112.91 116.21 3hy5 h THR 250 Ca 0.31 -3.32 -0.05 0.00 0.77 0.00 0.00 66.41 64.12 3hy5 h THR 250 Cb 0.04 2.81 -0.01 0.00 -1.74 0.00 0.00 68.15 69.25 3hy5 h THR 250 CO -0.05 0.92 -0.03 0.22 0.37 0.00 0.00 175.52 176.95 3hy5 h TYR 251 N 0.01 0.58 0.00 3.16 3.20 -0.56 -3.04 116.97 120.31 3hy5 h TYR 251 Ca -0.05 -0.11 -0.00 0.00 3.14 0.00 0.00 58.73 61.71 3hy5 h TYR 251 Cb 1.81 -0.15 -0.00 0.00 1.54 0.00 0.00 36.73 39.93 3hy5 h TYR 251 CO 0.00 0.70 -0.00 -0.91 -1.64 0.00 0.00 178.16 176.31 3hy5 h ASN 252 N 0.30 0.00 0.06 -2.11 2.35 -1.16 0.43 115.58 115.45 3hy5 h ASN 252 Ca 0.08 0.00 -0.27 0.00 -0.55 0.00 0.00 56.30 55.55 3hy5 h ASN 252 Cb 0.49 0.00 0.03 0.00 0.05 0.00 0.00 38.32 38.88 3hy5 h ASN 252 CO 0.02 0.00 -1.11 0.58 -1.65 0.00 0.00 177.43 175.27 3hy5 h VAL 253 N 0.00 1.29 0.00 2.81 2.07 -1.52 -3.33 116.25 117.57 3hy5 h VAL 253 Ca -0.00 -2.35 -0.20 0.00 0.82 0.00 0.00 66.70 64.97 3hy5 h VAL 253 Cb 0.20 2.57 -0.03 0.00 -1.52 0.00 0.00 31.29 32.51 3hy5 h VAL 253 CO 0.00 0.72 -1.17 0.58 0.02 0.00 0.00 177.57 177.72 3hy5 h VAL 254 N 0.29 1.06 -1.05 2.57 2.07 -1.32 -3.38 116.25 116.48 3hy5 h VAL 254 Ca -0.16 -2.69 0.28 0.00 0.82 0.00 0.00 66.70 64.95 3hy5 h VAL 254 Cb 1.78 2.48 -0.10 0.00 -1.52 0.00 0.00 31.29 33.93 3hy5 h VAL 254 CO 0.22 0.60 0.67 0.50 0.02 0.00 0.00 177.57 179.58 3hy5 h LYS 255 N 0.00 0.39 -0.24 1.57 3.64 -0.28 0.29 116.57 121.94 3hy5 h LYS 255 Ca -0.11 -0.02 -0.06 0.00 -1.27 0.00 0.00 60.65 59.18 3hy5 h LYS 255 Cb 1.71 -0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 33.43 3hy5 h LYS 255 CO 0.09 0.26 -0.11 -1.35 -2.27 0.00 0.00 179.45 176.06 3hy5 h PRO 256 N 0.40 0.40 -0.42 1.90 0.11 -1.76 -3.18 132.00 129.45 3hy5 h PRO 256 Ca 0.63 -0.10 -0.15 0.00 0.11 0.00 0.00 66.00 66.49 3hy5 h PRO 256 Cb 1.55 -0.05 -0.01 0.00 0.11 0.00 0.00 31.00 32.60 3hy5 h PRO 256 CO -0.35 0.52 -0.32 0.74 -0.21 0.00 0.00 178.00 178.37 3hy5 h PHE 257 N 0.37 1.11 -2.78 0.65 0.04 -0.69 -3.44 116.94 112.20 3hy5 h PHE 257 Ca 0.07 -0.31 -0.55 0.00 2.80 0.00 0.00 57.97 59.99 3hy5 h PHE 257 Cb 0.43 -0.24 -0.00 0.00 2.20 0.00 0.00 35.95 38.33 3hy5 h PHE 257 CO 0.01 1.13 0.95 -0.51 -0.60 0.00 0.00 178.31 179.29 3hy5 s LEU 258 N -8.94 4.31 0.90 1.54 1.43 -1.17 -5.00 118.68 111.75 3hy5 s LEU 258 Ca -0.11 2.16 -0.11 0.00 -1.03 0.00 0.00 54.13 55.05 3hy5 s LEU 258 Cb 0.12 -3.55 0.14 0.00 0.03 0.00 0.00 46.19 42.93 3hy5 s LEU 258 CO 0.88 -0.81 1.16 -0.54 0.23 0.00 0.00 176.35 177.26 3hy5 s LYS 259 N 3.07 1.08 0.18 1.70 1.02 -1.26 -4.70 119.74 120.83 3hy5 s LYS 259 Ca 0.67 1.60 -0.15 0.00 0.02 0.00 0.00 55.97 58.11 3hy5 s LYS 259 Cb -0.32 -1.73 0.15 0.00 -0.52 0.00 0.00 37.83 35.41 3hy5 s LYS 259 CO 0.27 -2.60 1.66 0.66 -0.92 0.00 0.00 175.35 174.42 3hy5 h SER 260 N -1.74 -0.41 -0.59 2.83 4.64 -1.98 -1.90 113.55 114.41 3hy5 h SER 260 Ca -0.44 0.14 0.12 0.00 -0.47 0.00 0.00 61.79 61.14 3hy5 h SER 260 Cb 1.27 0.28 -0.11 0.00 -0.31 0.00 0.00 62.40 63.54 3hy5 h SER 260 CO 0.42 -0.15 -0.13 0.50 -0.87 0.00 0.00 176.83 176.60 3hy5 h LYS 261 N 0.02 0.01 -0.22 4.77 3.64 -2.00 -1.40 116.57 121.40 3hy5 h LYS 261 Ca 0.24 -0.00 -0.10 0.00 -1.27 0.00 0.00 60.65 59.51 3hy5 h LYS 261 Cb 0.36 -0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 32.18 3hy5 h LYS 261 CO -0.48 0.01 -0.27 1.25 -2.27 0.00 0.00 179.45 177.69 3hy5 h LEU 262 N 0.01 0.61 -0.25 5.20 5.85 -1.78 -3.23 115.31 121.72 3hy5 h LEU 262 Ca 0.29 -0.50 0.06 0.00 0.84 0.00 0.00 57.88 58.57 3hy5 h LEU 262 Cb 0.44 -0.17 -0.06 0.00 0.37 0.00 0.00 40.66 41.23 3hy5 h LEU 262 CO -0.60 0.99 -0.18 -0.07 -0.34 0.00 0.00 178.44 178.24 3hy5 h LEU 263 N 0.25 -0.59 -0.18 2.25 3.38 -0.73 0.10 115.31 119.79 3hy5 h LEU 263 Ca 0.03 0.12 0.00 0.00 0.09 0.00 0.00 57.88 58.12 3hy5 h LEU 263 Cb 0.84 0.30 0.00 0.00 0.09 0.00 0.00 40.66 41.88 3hy5 h LEU 263 CO 0.06 -0.22 0.06 -0.62 0.09 0.00 0.00 178.44 177.82 3hy5 n GLU 264 N -5.34 0.02 0.00 1.13 1.02 -0.59 -0.58 120.64 116.30 3hy5 n GLU 264 Ca -0.01 0.47 0.08 0.00 -0.02 0.00 0.00 57.16 57.67 3hy5 n GLU 264 Cb 0.25 -1.62 -0.08 0.00 -0.02 0.00 0.00 31.44 29.97 3hy5 n GLU 264 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 3hy5 n ARG 265 N -1.55 1.78 -2.58 3.49 1.74 0.32 -4.92 116.66 114.94 3hy5 n ARG 265 Ca -0.00 -0.12 -0.42 0.00 -0.77 0.00 0.00 57.85 56.54 3hy5 n ARG 265 Cb 0.07 -1.25 -0.03 0.00 -1.02 0.00 0.00 32.46 30.23 3hy5 n ARG 265 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 3hy5 s VAL 266 N -2.41 4.36 -0.16 1.55 1.01 0.25 -1.55 120.40 123.46 3hy5 s VAL 266 Ca 0.07 1.78 -0.01 0.00 0.00 0.00 0.00 61.98 63.82 3hy5 s VAL 266 Cb 0.12 -4.14 0.04 0.00 0.00 0.00 0.00 36.38 32.40 3hy5 s VAL 266 CO 0.61 0.19 -0.04 -0.36 0.00 0.00 0.00 175.10 175.50 3hy5 s PHE 267 N 0.67 1.53 -0.36 5.22 0.08 0.13 -4.94 117.98 120.31 3hy5 s PHE 267 Ca 0.53 -0.97 -0.10 0.00 0.12 0.00 0.00 56.93 56.52 3hy5 s PHE 267 Cb -0.26 -1.23 0.03 0.00 -0.57 0.00 0.00 43.02 40.99 3hy5 s PHE 267 CO 0.30 -0.59 0.17 0.08 -0.10 0.00 0.00 175.22 175.08 3hy5 s VAL 268 N 1.69 4.34 -0.30 -0.44 1.01 -1.26 -0.31 120.40 125.13 3hy5 s VAL 268 Ca 0.01 -0.91 0.23 0.00 0.00 0.00 0.00 61.98 61.31 3hy5 s VAL 268 Cb -0.15 -3.42 -0.07 0.00 0.00 0.00 0.00 36.38 32.74 3hy5 s VAL 268 CO -0.07 -0.20 0.97 1.41 0.00 0.00 0.00 175.10 177.21 3hy5 n HIS 269 N 4.94 0.66 0.00 5.22 -0.00 -1.01 -4.99 115.22 120.04 3hy5 n HIS 269 Ca -0.12 0.19 0.00 0.00 -0.00 0.00 0.00 57.72 57.79 3hy5 n HIS 269 Cb 0.46 -0.77 0.00 0.00 -0.00 0.00 0.00 29.99 29.68 3hy5 n HIS 269 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 3hy5 n GLY 270 N 1.24 2.01 0.00 -1.41 0.00 -1.26 -2.52 105.19 103.25 3hy5 n GLY 270 Ca -0.00 0.12 0.00 0.00 0.00 0.00 0.00 46.02 46.14 3hy5 n GLY 270 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3hy5 n ASP 271 N 10.74 0.52 -4.46 1.61 9.92 -1.26 -1.65 116.55 131.96 3hy5 n ASP 271 Ca 0.00 -0.84 -0.44 0.00 -0.53 0.00 0.00 54.79 52.98 3hy5 n ASP 271 Cb 0.00 0.16 -0.02 0.00 -0.64 0.00 0.00 41.12 40.62 3hy5 n ASP 271 CO 0.00 0.00 0.00 -0.62 0.13 0.00 0.00 177.20 176.71 3hy5 s ASP 272 N -0.16 6.71 -0.09 -2.24 2.15 -1.05 -4.83 116.67 117.15 3hy5 s ASP 272 Ca 0.00 -2.20 0.09 0.00 0.43 0.00 0.00 52.55 50.86 3hy5 s ASP 272 Cb 0.00 -2.41 0.41 0.00 -0.30 0.00 0.00 42.92 40.62 3hy5 s ASP 272 CO 0.00 -1.03 1.19 0.18 -0.17 0.00 0.00 175.17 175.34 3hy5 n LEU 273 N 6.55 3.14 0.00 -1.34 4.77 -1.26 -3.97 117.00 124.88 3hy5 n LEU 273 Ca 0.28 -1.59 0.10 0.00 -0.03 0.00 0.00 56.01 54.77 3hy5 n LEU 273 Cb 0.48 -0.51 0.50 0.00 -2.33 0.00 0.00 43.42 41.55 3hy5 n LEU 273 CO 0.54 0.47 0.81 -1.54 -1.33 0.00 0.00 177.39 176.33 3hy5 n SER 274 N 0.41 0.00 0.00 -1.43 3.41 -1.26 -1.47 113.62 113.28 3hy5 n SER 274 Ca 0.14 0.01 0.00 0.00 -0.26 0.00 0.00 58.87 58.76 3hy5 n SER 274 Cb 0.64 -0.29 0.00 0.00 -0.26 0.00 0.00 64.21 64.30 3hy5 n SER 274 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3hy5 n GLY 275 N 0.40 0.20 0.13 5.00 0.00 -1.25 -4.74 105.19 104.92 3hy5 n GLY 275 Ca 0.09 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.89 3hy5 n GLY 275 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 3hy5 n PHE 276 N -0.64 1.06 0.43 1.61 7.35 -0.79 -4.25 117.46 122.23 3hy5 n PHE 276 Ca 0.00 0.30 0.10 0.00 -0.76 0.00 0.00 57.45 57.09 3hy5 n PHE 276 Cb 0.00 -1.13 0.43 0.00 0.35 0.00 0.00 39.48 39.14 3hy5 n PHE 276 CO 0.00 0.00 0.00 0.66 -0.76 0.00 0.00 176.76 176.66 3hy5 n TYR 277 N -3.84 0.55 0.02 -5.13 4.01 -0.54 -1.61 117.16 110.62 3hy5 n TYR 277 Ca -0.34 0.22 -0.10 0.00 -0.16 0.00 0.00 57.90 57.52 3hy5 n TYR 277 Cb 0.91 -0.85 0.04 0.00 -0.31 0.00 0.00 39.34 39.13 3hy5 n TYR 277 CO 0.00 0.00 0.00 1.96 -0.46 0.00 0.00 176.86 178.36 3hy5 h GLN 278 N 0.00 0.51 0.11 -0.72 7.50 -1.82 -3.30 115.11 117.39 3hy5 h GLN 278 Ca 0.00 -0.36 -0.15 0.00 0.50 0.00 0.00 58.65 58.64 3hy5 h GLN 278 Cb 0.33 0.06 0.01 0.00 0.05 0.00 0.00 27.48 27.93 3hy5 h GLN 278 CO 0.00 0.97 -0.67 0.93 -1.50 0.00 0.00 178.83 178.56 3hy5 h GLU 279 N 0.38 0.22 -5.06 1.46 4.39 -1.52 -3.45 114.58 111.00 3hy5 h GLU 279 Ca -0.01 -0.38 -0.67 0.00 0.34 0.00 0.00 59.36 58.64 3hy5 h GLU 279 Cb 1.18 0.14 -0.34 0.00 -0.10 0.00 0.00 28.75 29.63 3hy5 h GLU 279 CO 0.11 1.18 -0.85 0.42 -1.16 0.00 0.00 179.01 178.72 3hy5 s ILE 280 N -2.38 2.15 -0.10 3.13 -1.09 -0.63 -4.51 121.20 117.76 3hy5 s ILE 280 Ca -0.15 -0.91 -0.29 0.00 -2.23 0.00 0.00 60.65 57.06 3hy5 s ILE 280 Cb 0.00 -1.90 -0.04 0.00 -1.58 0.00 0.00 42.46 38.94 3hy5 s ILE 280 CO 0.79 0.53 1.58 -0.62 -1.23 0.00 0.00 174.94 176.00 3hy5 s ASP 281 N 1.28 6.66 0.56 3.58 2.15 -1.25 -4.14 116.67 125.51 3hy5 s ASP 281 Ca 0.05 2.03 0.31 0.00 0.43 0.00 0.00 52.55 55.36 3hy5 s ASP 281 Cb -0.13 -2.53 1.46 0.00 -0.30 0.00 0.00 42.92 41.41 3hy5 s ASP 281 CO -0.12 -0.96 1.84 -0.08 -0.17 0.00 0.00 175.17 175.68 3hy5 h GLU 282 N 9.56 0.00 -0.10 4.34 4.81 -1.94 -1.81 114.58 129.43 3hy5 h GLU 282 Ca -0.36 0.00 -0.03 0.00 -0.13 0.00 0.00 59.36 58.84 3hy5 h GLU 282 Cb 1.16 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.53 3hy5 h GLU 282 CO 0.97 0.00 -0.09 -0.97 -0.73 0.00 0.00 179.01 178.18 3hy5 h ASN 283 N 0.00 0.14 -0.26 1.04 -1.24 -1.95 -2.60 115.58 110.71 3hy5 h ASN 283 Ca 0.38 -0.02 0.00 0.00 0.71 0.00 0.00 56.30 57.37 3hy5 h ASN 283 Cb 1.69 -0.04 0.00 0.00 0.73 0.00 0.00 38.32 40.70 3hy5 h ASN 283 CO -0.00 0.26 0.00 2.30 -1.29 0.00 0.00 177.43 178.70 3hy5 n ILE 284 N -4.35 0.32 -3.73 2.57 -5.35 -0.68 -4.47 119.36 103.68 3hy5 n ILE 284 Ca -0.01 -0.62 -0.37 0.00 -0.27 0.00 0.00 62.75 61.48 3hy5 n ILE 284 Cb 0.22 1.04 -0.06 0.00 -1.74 0.00 0.00 39.64 39.10 3hy5 n ILE 284 CO 0.00 0.00 0.00 -0.76 -1.76 0.00 0.00 176.55 174.03 3hy5 s LEU 285 N -1.66 4.38 0.97 7.28 1.43 -1.00 -4.91 118.68 125.19 3hy5 s LEU 285 Ca 0.35 0.59 -0.11 0.00 -1.03 0.00 0.00 54.13 53.94 3hy5 s LEU 285 Cb 0.21 -2.25 0.18 0.00 0.03 0.00 0.00 46.19 44.36 3hy5 s LEU 285 CO 0.31 0.34 1.11 -2.84 0.23 0.00 0.00 176.35 175.50 3hy5 s PRO 286 N -0.78 0.57 0.51 1.29 0.02 -1.26 -1.26 135.00 134.10 3hy5 s PRO 286 Ca 0.17 1.35 0.17 0.00 0.02 0.00 0.00 61.00 62.70 3hy5 s PRO 286 Cb -0.13 -1.69 1.24 0.00 0.02 0.00 0.00 34.50 33.94 3hy5 s PRO 286 CO 0.06 -2.87 2.10 0.66 -0.33 0.00 0.00 177.00 176.63 3hy5 h SER 287 N -2.03 0.06 -0.74 2.53 4.64 0.01 -1.39 113.55 116.62 3hy5 h SER 287 Ca -0.48 -0.00 0.19 0.00 -0.47 0.00 0.00 61.79 61.03 3hy5 h SER 287 Cb 1.28 -0.01 -0.04 0.00 -0.31 0.00 0.00 62.40 63.32 3hy5 h SER 287 CO 0.44 0.04 0.52 0.44 -0.87 0.00 0.00 176.83 177.40 3hy5 h ASP 288 N 0.07 0.18 -0.26 4.97 3.32 -1.87 -1.94 116.42 120.89 3hy5 h ASP 288 Ca 0.07 0.01 -0.16 0.00 0.02 0.00 0.00 57.03 56.98 3hy5 h ASP 288 Cb 0.21 -0.02 -0.11 0.00 0.22 0.00 0.00 39.33 39.63 3hy5 h ASP 288 CO -0.01 0.08 -0.35 0.49 -1.72 0.00 0.00 179.24 177.74 3hy5 n PHE 289 N -4.40 0.87 -0.89 4.55 3.72 -0.77 -4.93 117.46 115.61 3hy5 n PHE 289 Ca 0.15 -1.68 0.00 0.00 -0.05 0.00 0.00 57.45 55.86 3hy5 n PHE 289 Cb 0.69 -0.39 0.00 0.00 -0.94 0.00 0.00 39.48 38.84 3hy5 n PHE 289 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3hy5 n GLY 290 N -1.06 0.60 2.36 1.37 0.00 -0.73 -4.90 105.19 102.83 3hy5 n GLY 290 Ca 0.29 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 46.18 3hy5 n GLY 290 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hy5 n GLY 291 N -2.78 0.92 0.14 -0.02 0.00 -0.60 -4.97 105.19 97.88 3hy5 n GLY 291 Ca 0.00 -2.03 -0.23 0.00 0.00 0.00 0.00 46.02 43.76 3hy5 n GLY 291 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 3hy5 h THR 292 N -0.42 1.00 -3.60 2.61 1.35 -1.15 -3.32 112.91 109.39 3hy5 h THR 292 Ca -0.19 -2.56 -0.53 0.00 -0.55 0.00 0.00 66.41 62.57 3hy5 h THR 292 Cb 0.75 2.81 0.21 0.00 -1.73 0.00 0.00 68.15 70.18 3hy5 h THR 292 CO 0.22 0.85 -0.34 0.18 -0.25 0.00 0.00 175.52 176.18 3hy5 n LEU 293 N -3.60 0.93 -4.70 3.87 4.77 -0.38 -4.58 117.00 113.29 3hy5 n LEU 293 Ca -0.23 0.40 -0.35 0.00 -0.03 0.00 0.00 56.01 55.80 3hy5 n LEU 293 Cb 1.08 -1.28 0.10 0.00 -2.33 0.00 0.00 43.42 40.99 3hy5 n LEU 293 CO 0.53 -3.15 0.82 -2.65 -1.33 0.00 0.00 177.39 171.61 3hy5 n PRO 294 N -2.15 0.61 -1.61 3.23 -0.02 -1.26 0.56 135.00 134.36 3hy5 n PRO 294 Ca 0.09 0.28 -0.48 0.00 -2.02 0.00 0.00 63.50 61.36 3hy5 n PRO 294 Cb 0.53 -2.47 -0.04 0.00 -0.02 0.00 0.00 33.50 31.50 3hy5 n PRO 294 CO 0.00 0.00 0.00 1.17 1.98 0.00 0.00 175.50 178.65 3hy5 n LYS 295 N -2.60 1.42 -1.50 -0.52 4.81 -1.26 -3.83 118.16 114.68 3hy5 n LYS 295 Ca 0.15 0.51 -0.51 0.00 -0.87 0.00 0.00 58.31 57.58 3hy5 n LYS 295 Cb 0.49 -2.07 -0.05 0.00 0.02 0.00 0.00 35.03 33.43 3hy5 n LYS 295 CO 0.00 0.00 0.00 0.98 1.17 0.00 0.00 177.40 179.55 3hy5 n TYR 296 N 1.75 0.50 -3.91 5.64 9.36 -1.26 -4.94 117.16 124.30 3hy5 n TYR 296 Ca 0.14 0.89 -0.35 0.00 3.32 0.00 0.00 57.90 61.90 3hy5 n TYR 296 Cb 0.26 -2.11 -0.14 0.00 -0.63 0.00 0.00 39.34 36.72 3hy5 n TYR 296 CO 0.00 0.00 0.00 0.34 0.22 0.00 0.00 176.86 177.42 3hy5 s ASP 297 N -0.37 4.49 0.11 2.98 2.15 -1.26 -4.99 116.67 119.78 3hy5 s ASP 297 Ca 0.74 -0.76 -0.04 0.00 0.43 0.00 0.00 52.55 52.93 3hy5 s ASP 297 Cb -0.99 -1.72 -0.16 0.00 -0.30 0.00 0.00 42.92 39.75 3hy5 s ASP 297 CO 0.55 -0.12 1.25 1.23 -0.17 0.00 0.00 175.17 177.91 3hy5 h GLY 298 N 8.08 0.38 0.98 2.66 0.00 -1.85 -3.26 103.07 110.05 3hy5 h GLY 298 Ca -0.34 -0.76 0.01 0.00 0.00 0.00 0.00 47.33 46.24 3hy5 h GLY 298 CO 0.59 0.67 0.24 0.50 0.00 0.00 0.00 176.54 178.54 3hy5 h LYS 299 N 0.16 0.48 0.49 4.80 1.57 -1.84 -0.76 116.57 121.47 3hy5 h LYS 299 Ca -0.10 -0.03 -0.01 0.00 -1.87 0.00 0.00 60.65 58.64 3hy5 h LYS 299 Cb 1.72 -0.11 -0.02 0.00 0.08 0.00 0.00 32.23 33.90 3hy5 h LYS 299 CO 0.18 0.32 -0.48 0.00 -0.57 0.00 0.00 179.45 178.90 3hy5 h ALA 300 N 1.15 -1.14 0.02 3.86 0.00 -1.97 -1.99 119.26 119.19 3hy5 h ALA 300 Ca 0.14 -0.18 0.03 0.00 0.00 0.00 0.00 54.91 54.90 3hy5 h ALA 300 Cb -0.04 0.70 -0.05 0.00 0.00 0.00 0.00 17.79 18.40 3hy5 h ALA 300 CO -0.04 -1.17 -0.42 0.28 0.00 0.00 0.00 179.25 177.91 3hy5 h VAL 301 N -0.97 0.16 -0.89 0.00 2.07 -1.58 -2.55 116.25 112.48 3hy5 h VAL 301 Ca -0.06 0.00 0.21 0.00 0.82 0.00 0.00 66.70 67.67 3hy5 h VAL 301 Cb 0.83 0.16 -0.12 0.00 -1.52 0.00 0.00 31.29 30.64 3hy5 h VAL 301 CO -0.05 0.00 0.41 0.00 0.02 0.00 0.00 177.57 177.95 3hy5 h ALA 302 N -0.05 1.42 -0.26 1.67 0.00 -1.07 -1.33 119.26 119.64 3hy5 h ALA 302 Ca 0.04 0.15 0.01 0.00 0.00 0.00 0.00 54.91 55.10 3hy5 h ALA 302 Cb 0.65 0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.54 3hy5 h ALA 302 CO -0.30 -0.30 0.16 1.49 0.00 0.00 0.00 179.25 180.31 3hy5 h GLU 303 N 0.45 0.32 -0.10 0.00 4.81 -0.94 -1.16 114.58 117.97 3hy5 h GLU 303 Ca 0.55 -0.02 0.02 0.00 -0.13 0.00 0.00 59.36 59.77 3hy5 h GLU 303 Cb 1.00 -0.07 -0.00 0.00 0.63 0.00 0.00 28.75 30.30 3hy5 h GLU 303 CO -0.50 0.21 0.07 1.96 -0.73 0.00 0.00 179.01 180.02 3hy5 h GLN 304 N 0.33 0.05 -0.45 1.92 4.20 -1.12 -0.25 115.11 119.80 3hy5 h GLN 304 Ca 0.10 -0.00 -0.07 0.00 0.06 0.00 0.00 58.65 58.73 3hy5 h GLN 304 Cb -0.02 -0.01 -0.02 0.00 0.30 0.00 0.00 27.48 27.73 3hy5 h GLN 304 CO -0.03 0.04 0.01 -0.07 -0.67 0.00 0.00 178.83 178.10 3hy5 h LEU 305 N 0.06 0.77 0.00 1.46 4.07 -0.74 -3.49 115.31 117.43 3hy5 h LEU 305 Ca 0.04 -0.30 0.00 0.00 0.08 0.00 0.00 57.88 57.70 3hy5 h LEU 305 Cb 0.10 -0.21 0.00 0.00 1.08 0.00 0.00 40.66 41.63 3hy5 h LEU 305 CO -0.00 0.89 0.00 2.22 -1.08 0.00 0.00 178.44 180.46