#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ii0 n VAL 16 N 0.00 2.08 0.08 0.52 0.24 -1.26 -4.69 118.33 115.30 3ii0 n VAL 16 Ca 0.00 -2.57 -0.13 0.00 -2.04 0.00 0.00 64.34 59.61 3ii0 n VAL 16 Cb 0.00 -0.25 -0.07 0.00 -1.47 0.00 0.00 33.84 32.05 3ii0 n VAL 16 CO 0.00 0.00 0.00 0.25 -2.14 0.00 0.00 176.83 174.94 3ii0 h LEU 17 N 0.56 -0.10 -1.35 1.34 5.85 -2.01 -2.42 115.31 117.18 3ii0 h LEU 17 Ca 0.02 -0.01 0.01 0.00 0.84 0.00 0.00 57.88 58.75 3ii0 h LEU 17 Cb 1.09 0.03 -0.03 0.00 0.37 0.00 0.00 40.66 42.12 3ii0 h LEU 17 CO 0.05 -0.06 0.45 -0.37 -0.34 0.00 0.00 178.44 178.17 3ii0 h VAL 18 N -0.13 1.15 -0.01 1.05 -1.51 -1.99 0.37 116.25 115.18 3ii0 h VAL 18 Ca -0.01 -0.30 -0.16 0.00 -1.23 0.00 0.00 66.70 65.00 3ii0 h VAL 18 Cb 0.10 0.19 -0.02 0.00 -2.13 0.00 0.00 31.29 29.43 3ii0 h VAL 18 CO 0.02 0.16 -0.73 -0.26 -1.23 0.00 0.00 177.57 175.53 3ii0 h PHE 19 N 0.89 0.08 -0.42 5.19 0.05 -1.91 -0.27 116.94 120.55 3ii0 h PHE 19 Ca 0.26 -0.04 -0.14 0.00 3.82 0.00 0.00 57.97 61.87 3ii0 h PHE 19 Cb -0.05 -0.01 -0.01 0.00 2.00 0.00 0.00 35.95 37.88 3ii0 h PHE 19 CO -0.00 0.76 -0.26 -0.22 -0.18 0.00 0.00 178.31 178.41 3ii0 h LYS 20 N 0.04 0.93 -0.58 1.51 1.63 -0.83 -1.69 116.57 117.57 3ii0 h LYS 20 Ca -0.01 -0.43 0.08 0.00 -0.85 0.00 0.00 60.65 59.43 3ii0 h LYS 20 Cb 1.29 -0.01 -0.06 0.00 -0.60 0.00 0.00 32.23 32.84 3ii0 h LYS 20 CO 0.10 1.09 0.24 -0.07 -3.45 0.00 0.00 179.45 177.36 3ii0 h LEU 21 N 0.76 0.27 -0.66 5.20 3.38 -0.45 0.23 115.31 124.04 3ii0 h LEU 21 Ca 0.09 0.06 -0.02 0.00 0.09 0.00 0.00 57.88 58.10 3ii0 h LEU 21 Cb 0.84 0.03 -0.03 0.00 0.09 0.00 0.00 40.66 41.59 3ii0 h LEU 21 CO 0.07 0.17 0.34 0.74 0.09 0.00 0.00 178.44 179.86 3ii0 h THR 22 N 0.44 1.21 -0.64 0.22 2.02 -0.85 -1.69 112.91 113.62 3ii0 h THR 22 Ca 0.28 -0.57 -0.02 0.00 0.77 0.00 0.00 66.41 66.88 3ii0 h THR 22 Cb 0.31 0.38 -0.03 0.00 -1.74 0.00 0.00 68.15 67.07 3ii0 h THR 22 CO -0.26 0.24 0.33 0.00 0.37 0.00 0.00 175.52 176.20 3ii0 h ALA 23 N 1.16 0.82 -0.68 6.16 0.00 -0.65 -0.86 119.26 125.22 3ii0 h ALA 23 Ca 0.23 -0.12 -0.05 0.00 0.00 0.00 0.00 54.91 54.97 3ii0 h ALA 23 Cb 0.07 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.58 3ii0 h ALA 23 CO -0.03 0.36 0.22 -0.44 0.00 0.00 0.00 179.25 179.36 3ii0 h ASP 24 N 0.88 0.98 -0.63 0.00 3.32 -0.82 -2.72 116.42 117.44 3ii0 h ASP 24 Ca 0.22 -0.20 -0.01 0.00 0.02 0.00 0.00 57.03 57.06 3ii0 h ASP 24 Cb 0.07 -0.26 -0.03 0.00 0.22 0.00 0.00 39.33 39.34 3ii0 h ASP 24 CO -0.03 0.93 0.36 0.15 -1.72 0.00 0.00 179.24 178.92 3ii0 h PHE 25 N 0.99 0.85 -0.63 4.55 3.57 -0.81 -2.07 116.94 123.39 3ii0 h PHE 25 Ca 0.22 -0.01 -0.04 0.00 3.53 0.00 0.00 57.97 61.66 3ii0 h PHE 25 Cb 0.29 -0.28 -0.03 0.00 2.79 0.00 0.00 35.95 38.73 3ii0 h PHE 25 CO 0.02 0.60 0.23 0.00 -2.23 0.00 0.00 178.31 176.93 3ii0 h ARG 26 N 0.86 0.95 0.00 1.11 3.08 -0.93 -2.77 114.38 116.68 3ii0 h ARG 26 Ca 0.22 -0.19 -0.01 0.00 0.07 0.00 0.00 59.98 60.08 3ii0 h ARG 26 Cb 0.01 -0.15 -0.00 0.00 0.08 0.00 0.00 29.97 29.92 3ii0 h ARG 26 CO -0.04 0.82 -0.05 0.93 -1.07 0.00 0.00 179.97 180.56 3ii0 h GLU 27 N 0.89 0.00 -6.38 0.04 3.07 -1.40 -3.45 114.58 107.35 3ii0 h GLU 27 Ca 0.21 0.00 -0.54 0.00 -0.50 0.00 0.00 59.36 58.53 3ii0 h GLU 27 Cb 0.24 0.00 0.01 0.00 -0.84 0.00 0.00 28.75 28.16 3ii0 h GLU 27 CO -0.01 0.05 1.07 0.34 -1.40 0.00 0.00 179.01 179.06 3ii0 s ASP 28 N -5.93 6.59 0.21 1.42 -1.08 -0.79 -4.92 116.67 112.17 3ii0 s ASP 28 Ca 0.03 2.46 0.26 0.00 -0.52 0.00 0.00 52.55 54.77 3ii0 s ASP 28 Cb 0.08 -2.55 0.71 0.00 -1.46 0.00 0.00 42.92 39.71 3ii0 s ASP 28 CO 0.60 -0.93 1.70 1.55 0.52 0.00 0.00 175.17 178.60 3ii0 h PRO 29 N 9.09 0.00 -6.65 4.34 0.13 -1.88 -3.47 132.00 133.56 3ii0 h PRO 29 Ca -0.43 0.00 -0.52 0.00 -0.87 0.00 0.00 66.00 64.18 3ii0 h PRO 29 Cb 1.20 0.00 0.06 0.00 0.13 0.00 0.00 31.00 32.39 3ii0 h PRO 29 CO 0.94 0.00 1.03 0.34 -0.23 0.00 0.00 178.00 180.07 3ii0 s ASP 30 N -4.56 6.38 0.36 1.44 -1.08 -1.26 -4.89 116.67 113.05 3ii0 s ASP 30 Ca 0.10 2.86 0.27 0.00 -0.52 0.00 0.00 52.55 55.26 3ii0 s ASP 30 Cb 0.12 -2.60 1.08 0.00 -1.46 0.00 0.00 42.92 40.06 3ii0 s ASP 30 CO 0.62 -0.98 1.80 1.55 0.52 0.00 0.00 175.17 178.68 3ii0 h PRO 31 N 6.97 0.00 -0.00 4.34 0.13 -2.01 -2.90 132.00 138.53 3ii0 h PRO 31 Ca -0.43 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.70 3ii0 h PRO 31 Cb 1.20 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.33 3ii0 h PRO 31 CO 0.96 0.00 -0.03 0.54 -0.23 0.00 0.00 178.00 179.23 3ii0 n ARG 32 N -2.54 0.83 -1.89 0.86 1.74 -1.26 -4.98 116.66 109.42 3ii0 n ARG 32 Ca 0.02 -0.17 -0.39 0.00 -0.77 0.00 0.00 57.85 56.54 3ii0 n ARG 32 Cb 0.28 -1.50 0.02 0.00 -1.02 0.00 0.00 32.46 30.24 3ii0 n ARG 32 CO 0.00 0.00 0.00 -1.59 -1.52 0.00 0.00 177.63 174.52 3ii0 s LYS 33 N -2.29 3.63 -0.03 5.56 -2.85 -1.10 -4.87 119.74 117.81 3ii0 s LYS 33 Ca 0.36 2.27 0.01 0.00 -1.00 0.00 0.00 55.97 57.61 3ii0 s LYS 33 Cb 0.21 -2.57 0.02 0.00 -2.06 0.00 0.00 37.83 33.43 3ii0 s LYS 33 CO 0.42 -0.81 -0.01 0.08 0.10 0.00 0.00 175.35 175.14 3ii0 s VAL 34 N -1.26 0.24 -0.51 1.79 1.01 -0.07 -5.00 120.40 116.60 3ii0 s VAL 34 Ca 0.63 0.02 -0.18 0.00 0.00 0.00 0.00 61.98 62.45 3ii0 s VAL 34 Cb -0.41 -0.31 0.07 0.00 0.00 0.00 0.00 36.38 35.74 3ii0 s VAL 34 CO 0.51 0.15 0.54 0.21 0.00 0.00 0.00 175.10 176.51 3ii0 s ASN 35 N 0.86 6.19 -0.25 3.32 3.84 -1.26 -0.59 114.94 127.05 3ii0 s ASN 35 Ca -0.09 -1.17 0.13 0.00 0.21 0.00 0.00 52.86 51.93 3ii0 s ASN 35 Cb -0.12 -2.25 0.55 0.00 -0.55 0.00 0.00 41.25 38.88 3ii0 s ASN 35 CO -0.01 -0.83 1.50 0.18 -2.79 0.00 0.00 177.10 175.15 3ii0 n LEU 36 N 5.79 4.31 0.00 3.21 4.77 0.13 -4.72 117.00 130.48 3ii0 n LEU 36 Ca -0.09 -3.35 0.00 0.00 -0.03 0.00 0.00 56.01 52.54 3ii0 n LEU 36 Cb 0.44 -0.61 0.00 0.00 -2.33 0.00 0.00 43.42 40.92 3ii0 n LEU 36 CO 0.52 0.92 0.00 0.61 -1.33 0.00 0.00 177.39 178.11 3ii0 n GLY 37 N -0.74 1.24 3.63 -0.72 0.00 -0.93 -0.58 105.19 107.10 3ii0 n GLY 37 Ca 0.29 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.88 3ii0 n GLY 37 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 3ii0 n VAL 38 N 0.00 1.99 -1.86 1.61 3.14 -1.26 -4.13 118.33 117.82 3ii0 n VAL 38 Ca 0.00 -0.50 -0.40 0.00 -2.96 0.00 0.00 64.34 60.49 3ii0 n VAL 38 Cb 0.00 -1.21 -0.03 0.00 -1.06 0.00 0.00 33.84 31.54 3ii0 n VAL 38 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 3ii0 n GLY 39 N 1.06 2.73 3.05 7.55 0.00 -1.26 -4.78 105.19 113.54 3ii0 n GLY 39 Ca 0.08 -1.28 -0.27 0.00 0.00 0.00 0.00 46.02 44.55 3ii0 n GLY 39 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ii0 s ALA 40 N 5.64 1.49 0.36 4.61 0.00 -1.26 -5.00 121.76 127.60 3ii0 s ALA 40 Ca 0.56 -0.57 -0.28 0.00 0.00 0.00 0.00 51.96 51.67 3ii0 s ALA 40 Cb 0.08 -0.68 -0.11 0.00 0.00 0.00 0.00 23.12 22.42 3ii0 s ALA 40 CO 0.06 0.08 1.42 -0.47 0.00 0.00 0.00 175.76 176.84 3ii0 s TYR 41 N 0.73 2.77 0.06 0.00 5.04 -1.26 -4.62 117.35 120.07 3ii0 s TYR 41 Ca -0.13 1.26 0.05 0.00 -2.44 0.00 0.00 57.07 55.82 3ii0 s TYR 41 Cb -0.16 -3.89 -0.03 0.00 0.35 0.00 0.00 41.96 38.24 3ii0 s TYR 41 CO 0.03 -2.55 -0.15 1.03 -1.34 0.00 0.00 175.55 172.57 3ii0 s ARG 42 N -1.95 0.94 1.15 4.97 1.81 -1.06 -4.39 118.95 120.42 3ii0 s ARG 42 Ca 0.51 -0.87 -0.19 0.00 -1.72 0.00 0.00 55.73 53.47 3ii0 s ARG 42 Cb -0.44 -0.98 0.27 0.00 -0.45 0.00 0.00 34.95 33.35 3ii0 s ARG 42 CO 0.59 0.23 1.15 0.95 -0.68 0.00 0.00 175.30 177.55 3ii0 s THR 43 N -1.02 1.68 -0.70 0.02 -4.23 0.20 -4.84 115.64 106.76 3ii0 s THR 43 Ca 0.01 0.00 0.19 0.00 -1.18 0.00 0.00 61.69 60.71 3ii0 s THR 43 Cb -0.09 -2.60 0.18 0.00 1.34 0.00 0.00 72.50 71.34 3ii0 s THR 43 CO 0.02 0.00 1.58 -0.67 -0.54 0.00 0.00 174.62 175.01 3ii0 n ASP 44 N -4.55 0.36 -1.47 3.99 2.03 -1.26 -1.13 116.55 114.52 3ii0 n ASP 44 Ca 0.14 0.60 0.09 0.00 0.52 0.00 0.00 54.79 56.13 3ii0 n ASP 44 Cb 0.59 -0.67 0.34 0.00 -0.72 0.00 0.00 41.12 40.66 3ii0 n ASP 44 CO 0.00 0.00 0.00 0.47 -1.92 0.00 0.00 177.20 175.75 3ii0 n ASP 45 N -1.91 4.67 -2.41 1.67 8.00 -1.26 -4.33 116.55 120.98 3ii0 n ASP 45 Ca 0.02 -2.56 -0.14 0.00 0.71 0.00 0.00 54.79 52.82 3ii0 n ASP 45 Cb 0.19 -0.56 0.05 0.00 -0.02 0.00 0.00 41.12 40.77 3ii0 n ASP 45 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3ii0 s HIS 47 N -3.20 2.02 0.47 0.00 3.76 -1.26 -4.85 115.29 112.23 3ii0 s HIS 47 Ca 0.32 -0.44 -0.24 0.00 -0.15 0.00 0.00 55.06 54.55 3ii0 s HIS 47 Cb -0.14 -0.91 -0.08 0.00 1.11 0.00 0.00 32.58 32.56 3ii0 s HIS 47 CO 0.45 0.53 1.26 -2.30 -0.85 0.00 0.00 174.74 173.84 3ii0 n PRO 48 N -0.40 1.78 -3.98 8.40 -0.02 -1.26 -0.63 135.00 138.89 3ii0 n PRO 48 Ca -0.07 0.64 -0.33 0.00 -2.02 0.00 0.00 63.50 61.72 3ii0 n PRO 48 Cb 0.60 -2.41 -0.14 0.00 -0.02 0.00 0.00 33.50 31.52 3ii0 n PRO 48 CO 0.00 0.00 0.00 -0.46 1.98 0.00 0.00 175.50 177.02 3ii0 s TRP 49 N -1.25 3.45 -0.29 6.00 -0.00 -1.26 -4.76 118.94 120.83 3ii0 s TRP 49 Ca 0.65 -2.44 -0.29 0.00 -0.00 0.00 0.00 56.10 54.02 3ii0 s TRP 49 Cb -0.47 -2.42 0.01 0.00 -0.00 0.00 0.00 33.47 30.58 3ii0 s TRP 49 CO 0.55 -0.89 1.16 0.08 -0.00 0.00 0.00 176.95 177.84 3ii0 s VAL 50 N 1.08 4.39 0.29 5.86 1.01 -1.26 -4.89 120.40 126.88 3ii0 s VAL 50 Ca -0.00 1.61 -0.30 0.00 0.00 0.00 0.00 61.98 63.29 3ii0 s VAL 50 Cb -0.20 -4.29 -0.12 0.00 0.00 0.00 0.00 36.38 31.77 3ii0 s VAL 50 CO -0.05 -0.42 1.55 0.18 0.00 0.00 0.00 175.10 176.36 3ii0 n LEU 51 N 7.02 4.09 -0.30 3.92 4.32 -1.26 -4.80 117.00 129.99 3ii0 n LEU 51 Ca 0.13 1.15 0.13 0.00 -0.02 0.00 0.00 56.01 57.40 3ii0 n LEU 51 Cb 0.47 -1.56 0.28 0.00 -1.62 0.00 0.00 43.42 40.99 3ii0 n LEU 51 CO 0.59 0.00 0.91 -0.65 -1.22 0.00 0.00 177.39 177.02 3ii0 h PRO 52 N 4.56 0.15 -0.65 3.23 0.11 -1.98 0.82 132.00 138.24 3ii0 h PRO 52 Ca -0.47 -0.01 0.01 0.00 0.11 0.00 0.00 66.00 65.64 3ii0 h PRO 52 Cb 1.24 -0.03 -0.03 0.00 0.11 0.00 0.00 31.00 32.28 3ii0 h PRO 52 CO 0.78 0.10 0.43 -0.24 -0.21 0.00 0.00 178.00 178.86 3ii0 h VAL 53 N 0.16 1.16 -0.26 3.15 3.04 -1.91 -2.31 116.25 119.28 3ii0 h VAL 53 Ca 0.55 -0.30 -0.14 0.00 -1.01 0.00 0.00 66.70 65.80 3ii0 h VAL 53 Cb 1.11 0.21 -0.00 0.00 -2.01 0.00 0.00 31.29 30.60 3ii0 h VAL 53 CO -0.70 0.16 -0.39 0.58 -1.01 0.00 0.00 177.57 176.21 3ii0 h VAL 54 N 0.87 1.30 -0.79 1.51 2.07 -1.22 -1.27 116.25 118.72 3ii0 h VAL 54 Ca 0.24 -1.58 0.04 0.00 0.82 0.00 0.00 66.70 66.22 3ii0 h VAL 54 Cb -0.08 1.68 -0.05 0.00 -1.52 0.00 0.00 31.29 31.32 3ii0 h VAL 54 CO -0.05 0.50 0.50 0.11 0.02 0.00 0.00 177.57 178.65 3ii0 h LYS 55 N 0.46 0.92 -0.30 1.57 1.79 -0.99 -0.94 116.57 119.07 3ii0 h LYS 55 Ca 0.03 -0.06 -0.04 0.00 -2.18 0.00 0.00 60.65 58.40 3ii0 h LYS 55 Cb 0.98 -0.21 -0.01 0.00 -1.58 0.00 0.00 32.23 31.41 3ii0 h LYS 55 CO 0.09 0.61 0.02 -0.22 -1.08 0.00 0.00 179.45 178.87 3ii0 h LYS 56 N 0.95 0.52 -0.21 3.15 3.64 -1.33 -1.93 116.57 121.36 3ii0 h LYS 56 Ca 0.32 -0.16 -0.17 0.00 -1.27 0.00 0.00 60.65 59.37 3ii0 h LYS 56 Cb 0.05 -0.05 -0.00 0.00 -0.41 0.00 0.00 32.23 31.82 3ii0 h LYS 56 CO -0.13 0.65 -0.58 0.28 -2.27 0.00 0.00 179.45 177.40 3ii0 h VAL 57 N 0.32 1.31 -0.76 2.00 2.07 -1.09 -2.16 116.25 117.94 3ii0 h VAL 57 Ca 0.09 -1.81 0.08 0.00 0.82 0.00 0.00 66.70 65.87 3ii0 h VAL 57 Cb 0.40 1.77 -0.07 0.00 -1.52 0.00 0.00 31.29 31.88 3ii0 h VAL 57 CO 0.01 0.57 0.43 -0.33 0.02 0.00 0.00 177.57 178.27 3ii0 h GLU 58 N 0.49 0.73 -0.61 1.57 5.08 -1.14 0.05 114.58 120.75 3ii0 h GLU 58 Ca 0.00 -0.04 -0.03 0.00 -1.00 0.00 0.00 59.36 58.29 3ii0 h GLU 58 Cb 1.15 -0.16 -0.03 0.00 0.50 0.00 0.00 28.75 30.20 3ii0 h GLU 58 CO 0.11 0.48 0.26 1.96 -1.00 0.00 0.00 179.01 180.82 3ii0 h GLN 59 N 0.75 0.90 -0.76 2.33 1.08 -1.16 -0.24 115.11 118.00 3ii0 h GLN 59 Ca 0.36 -0.15 -0.02 0.00 -1.45 0.00 0.00 58.65 57.39 3ii0 h GLN 59 Cb 0.29 -0.15 -0.04 0.00 -0.05 0.00 0.00 27.48 27.53 3ii0 h GLN 59 CO -0.22 0.75 0.41 0.87 -0.95 0.00 0.00 178.83 179.69 3ii0 h LYS 60 N 0.84 1.06 -0.48 1.46 1.57 -0.77 -1.62 116.57 118.63 3ii0 h LYS 60 Ca 0.20 -0.12 -0.10 0.00 -1.87 0.00 0.00 60.65 58.76 3ii0 h LYS 60 Cb 0.18 -0.21 -0.02 0.00 0.08 0.00 0.00 32.23 32.26 3ii0 h LYS 60 CO -0.02 0.78 -0.10 0.82 -0.57 0.00 0.00 179.45 180.36 3ii0 h ILE 61 N 1.06 1.27 0.00 1.86 2.04 -0.74 -2.49 117.51 120.52 3ii0 h ILE 61 Ca 0.27 -1.23 -0.03 0.00 1.00 0.00 0.00 64.86 64.87 3ii0 h ILE 61 Cb 0.04 1.07 -0.00 0.00 -0.74 0.00 0.00 36.82 37.18 3ii0 h ILE 61 CO -0.04 0.42 -0.15 0.00 0.00 0.00 0.00 178.15 178.39 3ii0 h ALA 62 N 0.89 1.12 -0.02 1.87 0.00 -0.58 -2.41 119.26 120.14 3ii0 h ALA 62 Ca 0.12 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.90 3ii0 h ALA 62 Cb 0.65 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.42 3ii0 h ALA 62 CO 0.04 0.18 -0.28 0.09 0.00 0.00 0.00 179.25 179.29 3ii0 n ASN 63 N -3.44 2.21 -4.38 0.00 3.02 -0.65 -4.86 115.26 107.16 3ii0 n ASN 63 Ca -0.01 -1.61 -0.44 0.00 -0.03 0.00 0.00 54.58 52.49 3ii0 n ASN 63 Cb 0.32 0.27 -0.05 0.00 -0.61 0.00 0.00 39.78 39.71 3ii0 n ASN 63 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 3ii0 s ASP 64 N -2.30 6.18 0.00 6.41 2.15 -0.91 -4.90 116.67 123.31 3ii0 s ASP 64 Ca 0.23 -1.37 0.30 0.00 0.43 0.00 0.00 52.55 52.15 3ii0 s ASP 64 Cb 0.19 -2.31 1.56 0.00 -0.30 0.00 0.00 42.92 42.06 3ii0 s ASP 64 CO 0.47 -1.13 2.06 0.59 -0.17 0.00 0.00 175.17 176.99 3ii0 n ASN 65 N 6.43 0.08 0.00 -0.34 3.02 -1.26 -2.80 115.26 120.38 3ii0 n ASN 65 Ca -0.09 -0.38 0.13 0.00 -0.03 0.00 0.00 54.58 54.21 3ii0 n ASN 65 Cb 0.43 -0.20 0.60 0.00 -0.61 0.00 0.00 39.78 40.00 3ii0 n ASN 65 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 3ii0 n SER 66 N -1.17 0.00 -4.72 6.41 3.41 -1.26 -4.86 113.62 111.43 3ii0 n SER 66 Ca 0.16 0.42 -0.42 0.00 -0.26 0.00 0.00 58.87 58.78 3ii0 n SER 66 Cb 0.22 -0.47 -0.03 0.00 -0.26 0.00 0.00 64.21 63.67 3ii0 n SER 66 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 3ii0 s LEU 67 N -2.95 4.41 0.00 1.04 1.43 -1.12 -5.06 118.68 116.43 3ii0 s LEU 67 Ca 0.15 1.85 0.02 0.00 -1.03 0.00 0.00 54.13 55.11 3ii0 s LEU 67 Cb 0.18 -3.58 0.02 0.00 0.03 0.00 0.00 46.19 42.84 3ii0 s LEU 67 CO 0.49 -0.29 0.16 -0.46 0.23 0.00 0.00 176.35 176.48 3ii0 n ASN 68 N 3.53 2.61 -0.43 2.29 0.23 -1.26 -5.07 115.26 117.17 3ii0 n ASN 68 Ca 0.06 -2.48 0.06 0.00 -0.53 0.00 0.00 54.58 51.69 3ii0 n ASN 68 Cb 0.49 0.11 0.14 0.00 -2.08 0.00 0.00 39.78 38.43 3ii0 n ASN 68 CO 0.00 0.00 0.00 1.41 -0.93 0.00 0.00 177.26 177.74 3ii0 n HIS 69 N -1.19 0.38 -1.87 -2.53 8.25 -1.26 -5.05 115.22 111.96 3ii0 n HIS 69 Ca -0.08 -0.72 -0.36 0.00 -0.26 0.00 0.00 57.72 56.30 3ii0 n HIS 69 Cb 0.46 -0.14 0.05 0.00 1.12 0.00 0.00 29.99 31.48 3ii0 n HIS 69 CO 0.00 0.00 0.00 -1.21 0.64 0.00 0.00 176.34 175.77 3ii0 s GLU 70 N -1.93 2.75 0.21 -0.41 0.41 -1.26 -4.87 118.70 113.59 3ii0 s GLU 70 Ca 0.25 1.92 -0.32 0.00 -0.41 0.00 0.00 54.97 56.41 3ii0 s GLU 70 Cb 0.19 -1.89 -0.15 0.00 -1.78 0.00 0.00 34.13 30.50 3ii0 s GLU 70 CO 0.07 -1.41 1.24 0.66 -0.49 0.00 0.00 175.26 175.34 3ii0 n TYR 71 N -1.79 1.63 -1.38 1.61 4.01 -1.26 -4.97 117.16 115.01 3ii0 n TYR 71 Ca 0.15 0.59 -0.30 0.00 -0.16 0.00 0.00 57.90 58.17 3ii0 n TYR 71 Cb 0.49 -2.35 0.10 0.00 -0.31 0.00 0.00 39.34 37.27 3ii0 n TYR 71 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 3ii0 s LEU 72 N 0.42 2.73 0.74 7.72 1.43 -1.26 -5.01 118.68 125.44 3ii0 s LEU 72 Ca 0.70 1.56 -0.16 0.00 -1.03 0.00 0.00 54.13 55.20 3ii0 s LEU 72 Cb -0.76 -4.19 0.01 0.00 0.03 0.00 0.00 46.19 41.27 3ii0 s LEU 72 CO 0.52 -2.07 0.89 -2.65 0.23 0.00 0.00 176.35 173.28 3ii0 n PRO 73 N -3.52 0.41 -0.23 1.29 -0.02 -1.26 -4.83 135.00 126.83 3ii0 n PRO 73 Ca 0.08 0.19 0.04 0.00 -2.02 0.00 0.00 63.50 61.79 3ii0 n PRO 73 Cb 0.55 -2.16 0.15 0.00 -0.02 0.00 0.00 33.50 32.01 3ii0 n PRO 73 CO 0.00 0.00 0.00 0.82 1.98 0.00 0.00 175.50 178.30 3ii0 h ILE 74 N -0.39 0.48 0.00 4.25 2.04 -1.95 0.27 117.51 122.21 3ii0 h ILE 74 Ca -0.47 -0.06 0.00 0.00 1.00 0.00 0.00 64.86 65.33 3ii0 h ILE 74 Cb 1.33 0.28 0.00 0.00 -0.74 0.00 0.00 36.82 37.69 3ii0 h ILE 74 CO 0.46 0.03 -0.03 0.18 0.00 0.00 0.00 178.15 178.79 3ii0 n LEU 75 N -5.23 0.14 0.00 1.44 4.77 -1.26 -4.26 117.00 112.60 3ii0 n LEU 75 Ca 0.12 0.48 0.00 0.00 -0.03 0.00 0.00 56.01 56.58 3ii0 n LEU 75 Cb 0.42 -0.46 0.00 0.00 -2.33 0.00 0.00 43.42 41.05 3ii0 n LEU 75 CO 0.11 -0.02 0.00 0.61 -1.33 0.00 0.00 177.39 176.76 3ii0 n GLY 76 N 1.47 -1.26 3.65 -0.72 0.00 0.95 -1.04 105.19 108.25 3ii0 n GLY 76 Ca 0.07 -2.14 -0.43 0.00 0.00 0.00 0.00 46.02 43.52 3ii0 n GLY 76 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3ii0 s LEU 77 N 0.00 4.19 0.19 0.99 2.96 -1.26 -4.33 118.68 121.41 3ii0 s LEU 77 Ca 0.00 1.96 -0.12 0.00 -0.22 0.00 0.00 54.13 55.75 3ii0 s LEU 77 Cb 0.00 -3.53 0.15 0.00 0.50 0.00 0.00 46.19 43.30 3ii0 s LEU 77 CO 0.00 -0.97 1.80 0.00 -1.32 0.00 0.00 176.35 175.86 3ii0 h ALA 78 N 9.52 0.71 -0.33 5.97 0.00 -1.98 -0.81 119.26 132.33 3ii0 h ALA 78 Ca -0.35 0.01 -0.12 0.00 0.00 0.00 0.00 54.91 54.45 3ii0 h ALA 78 Cb 1.15 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.82 3ii0 h ALA 78 CO 0.97 -0.02 -0.29 1.49 0.00 0.00 0.00 179.25 181.40 3ii0 h GLU 79 N 0.58 0.70 -0.09 0.00 4.81 -1.99 -1.30 114.58 117.28 3ii0 h GLU 79 Ca 0.23 -0.30 -0.00 0.00 -0.13 0.00 0.00 59.36 59.16 3ii0 h GLU 79 Cb 0.10 -0.02 -0.00 0.00 0.63 0.00 0.00 28.75 29.46 3ii0 h GLU 79 CO -0.14 0.90 0.04 0.35 -0.73 0.00 0.00 179.01 179.44 3ii0 h PHE 80 N 0.60 0.14 -0.41 0.92 3.57 -1.72 -0.43 116.94 119.60 3ii0 h PHE 80 Ca 0.07 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.57 3ii0 h PHE 80 Cb 0.79 -0.04 -0.02 0.00 2.79 0.00 0.00 35.95 39.47 3ii0 h PHE 80 CO 0.04 0.21 0.27 0.00 -2.23 0.00 0.00 178.31 176.59 3ii0 h ARG 81 N 0.03 0.54 -0.12 1.11 3.08 -0.85 0.27 114.38 118.43 3ii0 h ARG 81 Ca 0.03 -0.03 -0.00 0.00 0.07 0.00 0.00 59.98 60.04 3ii0 h ARG 81 Cb 0.12 -0.12 -0.01 0.00 0.08 0.00 0.00 29.97 30.05 3ii0 h ARG 81 CO -0.00 0.36 0.06 0.77 -1.07 0.00 0.00 179.97 180.09 3ii0 h SER 82 N 0.55 0.16 -0.90 7.04 0.02 -1.24 -2.18 113.55 117.00 3ii0 h SER 82 Ca 0.15 -0.11 0.08 0.00 -0.84 0.00 0.00 61.79 61.07 3ii0 h SER 82 Cb -0.06 -0.04 -0.07 0.00 0.14 0.00 0.00 62.40 62.37 3ii0 h SER 82 CO -0.03 0.22 0.56 0.00 -1.14 0.00 0.00 176.83 176.43 3ii0 h ALA 84 N 1.44 0.18 -0.50 0.00 0.00 -0.77 -1.79 119.26 117.82 3ii0 h ALA 84 Ca 0.41 -0.30 -0.05 0.00 0.00 0.00 0.00 54.91 54.96 3ii0 h ALA 84 Cb 0.26 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 17.99 3ii0 h ALA 84 CO -0.20 0.03 0.09 0.77 0.00 0.00 0.00 179.25 179.93 3ii0 h SER 85 N -0.10 0.73 -0.56 0.00 0.02 -1.27 -2.22 113.55 110.15 3ii0 h SER 85 Ca 0.02 -0.14 0.00 0.00 -0.84 0.00 0.00 61.79 60.83 3ii0 h SER 85 Cb 0.63 -0.19 -0.03 0.00 0.14 0.00 0.00 62.40 62.95 3ii0 h SER 85 CO 0.03 0.74 0.35 -0.09 -1.14 0.00 0.00 176.83 176.72 3ii0 h ARG 86 N 0.74 0.75 -0.79 3.45 2.43 -1.07 -0.39 114.38 119.50 3ii0 h ARG 86 Ca 0.16 -0.06 0.10 0.00 -0.81 0.00 0.00 59.98 59.37 3ii0 h ARG 86 Cb 0.33 -0.16 -0.07 0.00 -0.42 0.00 0.00 29.97 29.64 3ii0 h ARG 86 CO 0.00 0.52 0.43 1.25 -1.51 0.00 0.00 179.97 180.66 3ii0 h LEU 87 N 0.76 0.59 0.02 3.80 5.85 -0.80 0.41 115.31 125.93 3ii0 h LEU 87 Ca 0.20 0.05 -0.00 0.00 0.84 0.00 0.00 57.88 58.98 3ii0 h LEU 87 Cb -0.05 -0.05 0.00 0.00 0.37 0.00 0.00 40.66 40.93 3ii0 h LEU 87 CO -0.04 0.33 -0.01 0.00 -0.34 0.00 0.00 178.44 178.38 3ii0 h ALA 88 N 1.45 -0.03 0.00 1.25 0.00 -1.02 -3.37 119.26 117.54 3ii0 h ALA 88 Ca 0.39 -0.20 -0.02 0.00 0.00 0.00 0.00 54.91 55.08 3ii0 h ALA 88 Cb 0.38 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.18 3ii0 h ALA 88 CO -0.26 -0.32 -1.34 1.28 0.00 0.00 0.00 179.25 178.61 3ii0 n LEU 89 N -4.92 0.60 0.00 0.00 4.77 -0.19 -4.65 117.00 112.61 3ii0 n LEU 89 Ca -0.08 0.23 0.00 0.00 -0.03 0.00 0.00 56.01 56.13 3ii0 n LEU 89 Cb 0.21 -0.02 0.00 0.00 -2.33 0.00 0.00 43.42 41.28 3ii0 n LEU 89 CO 0.33 -0.10 0.00 0.61 -1.33 0.00 0.00 177.39 176.91 3ii0 n GLY 90 N 1.23 1.22 0.30 -0.72 0.00 0.14 -4.43 105.19 102.94 3ii0 n GLY 90 Ca -0.03 -1.58 0.08 0.00 0.00 0.00 0.00 46.02 44.50 3ii0 n GLY 90 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3ii0 h ASP 91 N 0.00 0.20 -0.67 1.61 3.45 -1.95 -2.39 116.42 116.69 3ii0 h ASP 91 Ca 0.00 -0.00 -0.11 0.00 0.43 0.00 0.00 57.03 57.34 3ii0 h ASP 91 Cb 0.00 -0.05 -0.07 0.00 -0.56 0.00 0.00 39.33 38.65 3ii0 h ASP 91 CO 0.00 0.14 0.14 -0.90 -1.57 0.00 0.00 179.24 177.06 3ii0 n ASP 92 N -4.50 5.33 -4.74 6.45 5.75 -1.26 -4.96 116.55 118.62 3ii0 n ASP 92 Ca 0.02 -3.09 -0.42 0.00 -0.01 0.00 0.00 54.79 51.29 3ii0 n ASP 92 Cb 0.15 -0.72 -0.02 0.00 -1.03 0.00 0.00 41.12 39.50 3ii0 n ASP 92 CO 0.00 0.00 0.00 -0.55 -0.11 0.00 0.00 177.20 176.54 3ii0 s SER 93 N -0.90 6.37 0.50 -1.12 0.15 -0.90 -4.86 113.70 112.93 3ii0 s SER 93 Ca 0.55 2.93 0.18 0.00 0.70 0.00 0.00 55.95 60.31 3ii0 s SER 93 Cb 0.43 -2.62 1.24 0.00 -1.71 0.00 0.00 66.02 63.35 3ii0 s SER 93 CO 0.15 -0.94 2.09 -0.65 1.20 0.00 0.00 173.24 175.09 3ii0 h PRO 94 N 5.46 0.00 -0.58 5.44 0.11 -1.91 -2.49 132.00 138.02 3ii0 h PRO 94 Ca -0.46 0.00 -0.09 0.00 0.11 0.00 0.00 66.00 65.56 3ii0 h PRO 94 Cb 1.21 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.30 3ii0 h PRO 94 CO 0.85 0.08 -0.01 0.00 -0.21 0.00 0.00 178.00 178.71 3ii0 h ALA 95 N 1.92 0.89 -0.15 -0.75 0.00 -1.96 0.76 119.26 119.97 3ii0 h ALA 95 Ca -0.00 -0.31 -0.01 0.00 0.00 0.00 0.00 54.91 54.60 3ii0 h ALA 95 Cb 0.15 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 3ii0 h ALA 95 CO 0.01 0.65 0.07 -0.07 0.00 0.00 0.00 179.25 179.91 3ii0 h LEU 96 N 0.93 0.21 -1.15 0.00 3.38 -1.85 -2.15 115.31 114.68 3ii0 h LEU 96 Ca 0.17 -0.15 0.03 0.00 0.09 0.00 0.00 57.88 58.02 3ii0 h LEU 96 Cb 0.55 -0.05 -0.05 0.00 0.09 0.00 0.00 40.66 41.19 3ii0 h LEU 96 CO 0.03 0.30 0.58 0.11 0.09 0.00 0.00 178.44 179.55 3ii0 h LYS 97 N 0.10 1.08 -0.21 1.13 1.57 -1.01 -1.36 116.57 117.88 3ii0 h LYS 97 Ca 0.05 -0.07 0.00 0.00 -1.87 0.00 0.00 60.65 58.77 3ii0 h LYS 97 Cb 0.15 -0.24 0.00 0.00 0.08 0.00 0.00 32.23 32.22 3ii0 h LYS 97 CO -0.01 0.72 0.00 0.39 -0.57 0.00 0.00 179.45 179.98 3ii0 n GLU 98 N -4.44 1.53 -3.66 3.15 1.02 0.22 -4.92 120.64 113.54 3ii0 n GLU 98 Ca 0.11 -0.82 -0.27 0.00 -0.02 0.00 0.00 57.16 56.16 3ii0 n GLU 98 Cb 0.09 -1.23 0.03 0.00 -0.02 0.00 0.00 31.44 30.31 3ii0 n GLU 98 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 3ii0 n LYS 99 N 0.13 -5.38 -1.44 3.49 4.01 -0.51 -4.53 118.16 113.93 3ii0 n LYS 99 Ca 0.10 0.65 -0.18 0.00 -0.51 0.00 0.00 58.31 58.37 3ii0 n LYS 99 Cb 0.21 -5.53 0.10 0.00 -0.51 0.00 0.00 35.03 29.30 3ii0 n LYS 99 CO 0.00 0.00 0.00 2.89 -1.11 0.00 0.00 177.40 179.18 3ii0 n ARG 100 N -4.48 2.78 -4.34 1.97 1.85 -0.84 -3.90 116.66 109.70 3ii0 n ARG 100 Ca 0.01 -3.68 -0.20 0.00 -1.00 0.00 0.00 57.85 52.98 3ii0 n ARG 100 Cb 0.54 -2.09 -0.16 0.00 -1.05 0.00 0.00 32.46 29.71 3ii0 n ARG 100 CO 0.00 0.00 0.00 0.08 -0.01 0.00 0.00 177.63 177.70 3ii0 s VAL 101 N -4.14 0.72 0.25 8.89 1.01 -1.26 -1.04 120.40 124.83 3ii0 s VAL 101 Ca 0.50 -0.30 0.08 0.00 0.00 0.00 0.00 61.98 62.26 3ii0 s VAL 101 Cb 0.42 -0.67 -0.05 0.00 0.00 0.00 0.00 36.38 36.08 3ii0 s VAL 101 CO 0.01 0.24 -0.13 -0.83 0.00 0.00 0.00 175.10 174.39 3ii0 s GLY 102 N 0.38 1.68 -0.06 4.51 0.00 -0.12 -4.97 107.32 108.73 3ii0 s GLY 102 Ca -0.06 -1.80 -0.02 0.00 0.00 0.00 0.00 44.72 42.84 3ii0 s GLY 102 CO 0.01 -1.84 0.13 -0.32 0.00 0.00 0.00 173.10 171.07 3ii0 s GLY 103 N -3.41 0.01 -0.26 0.20 0.00 -1.26 -0.58 107.32 102.02 3ii0 s GLY 103 Ca 0.27 0.59 -0.03 0.00 0.00 0.00 0.00 44.72 45.56 3ii0 s GLY 103 CO 0.11 1.05 -0.04 0.14 0.00 0.00 0.00 173.10 174.36 3ii0 s VAL 104 N 1.34 3.07 0.24 1.40 1.01 -0.15 -4.93 120.40 122.37 3ii0 s VAL 104 Ca -0.07 -0.97 -0.30 0.00 0.00 0.00 0.00 61.98 60.64 3ii0 s VAL 104 Cb -0.12 -2.57 -0.10 0.00 0.00 0.00 0.00 36.38 33.59 3ii0 s VAL 104 CO -0.05 0.17 1.45 -1.58 0.00 0.00 0.00 175.10 175.09 3ii0 s GLN 105 N 1.36 4.26 0.19 2.72 0.74 -0.21 -0.44 119.66 128.29 3ii0 s GLN 105 Ca 0.01 2.30 0.01 0.00 0.05 0.00 0.00 55.36 57.72 3ii0 s GLN 105 Cb -0.17 -3.12 -0.05 0.00 1.10 0.00 0.00 33.01 30.78 3ii0 s GLN 105 CO -0.03 -0.44 0.06 -1.54 -0.55 0.00 0.00 175.29 172.79 3ii0 s SER 106 N 0.46 0.87 -1.29 6.67 1.04 -0.22 -4.77 113.70 116.47 3ii0 s SER 106 Ca 0.61 -1.28 -0.18 0.00 0.48 0.00 0.00 55.95 55.58 3ii0 s SER 106 Cb -0.42 0.20 0.08 0.00 0.10 0.00 0.00 66.02 65.98 3ii0 s SER 106 CO 0.42 -0.69 1.71 -0.76 0.98 0.00 0.00 173.24 174.90 3ii0 s LEU 107 N -3.19 3.93 0.00 2.42 2.01 -1.26 -1.70 118.68 120.89 3ii0 s LEU 107 Ca 0.30 -2.48 0.00 0.00 0.01 0.00 0.00 54.13 51.97 3ii0 s LEU 107 Cb 0.07 -2.57 0.00 0.00 0.01 0.00 0.00 46.19 43.70 3ii0 s LEU 107 CO 0.08 -1.14 0.00 0.61 1.01 0.00 0.00 176.35 176.90 3ii0 n GLY 108 N 5.32 -1.62 0.36 -3.19 0.00 -1.08 -1.40 105.19 103.58 3ii0 n GLY 108 Ca 0.48 -1.20 0.10 0.00 0.00 0.00 0.00 46.02 45.40 3ii0 n GLY 108 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 3ii0 h GLY 109 N -0.40 0.87 0.93 -0.02 0.00 -1.78 -2.47 103.07 100.19 3ii0 h GLY 109 Ca 0.01 -0.25 -0.05 0.00 0.00 0.00 0.00 47.33 47.03 3ii0 h GLY 109 CO 0.00 0.15 0.03 -0.84 0.00 0.00 0.00 176.54 175.88 3ii0 h THR 110 N 0.61 1.25 -0.59 4.70 2.02 -1.92 -1.71 112.91 117.27 3ii0 h THR 110 Ca 0.33 -0.93 -0.05 0.00 0.77 0.00 0.00 66.41 66.53 3ii0 h THR 110 Cb 0.49 1.10 -0.03 0.00 -1.74 0.00 0.00 68.15 67.98 3ii0 h THR 110 CO -0.12 0.32 0.15 1.23 0.37 0.00 0.00 175.52 177.47 3ii0 h GLY 111 N 0.49 0.97 1.01 2.16 0.00 -0.96 -1.08 103.07 105.66 3ii0 h GLY 111 Ca 0.11 -0.56 -0.04 0.00 0.00 0.00 0.00 47.33 46.84 3ii0 h GLY 111 CO 0.01 0.53 0.22 0.00 0.00 0.00 0.00 176.54 177.30 3ii0 h ALA 112 N 1.30 0.80 -0.54 3.60 0.00 -1.10 -0.60 119.26 122.72 3ii0 h ALA 112 Ca 0.19 -0.19 -0.10 0.00 0.00 0.00 0.00 54.91 54.81 3ii0 h ALA 112 Cb 0.29 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 3ii0 h ALA 112 CO -0.00 0.45 -0.08 -0.07 0.00 0.00 0.00 179.25 179.54 3ii0 h LEU 113 N 0.87 0.98 -0.14 0.00 3.38 -1.06 -1.22 115.31 118.11 3ii0 h LEU 113 Ca 0.20 -0.30 -0.06 0.00 0.09 0.00 0.00 57.88 57.81 3ii0 h LEU 113 Cb 0.25 -0.26 -0.00 0.00 0.09 0.00 0.00 40.66 40.73 3ii0 h LEU 113 CO -0.01 1.07 -0.13 -0.09 0.09 0.00 0.00 178.44 179.37 3ii0 h ARG 114 N 0.88 0.34 -0.69 1.13 9.65 -0.98 -0.26 114.38 124.46 3ii0 h ARG 114 Ca 0.15 -0.18 0.01 0.00 -1.10 0.00 0.00 59.98 58.86 3ii0 h ARG 114 Cb 0.62 0.00 -0.04 0.00 -1.39 0.00 0.00 29.97 29.17 3ii0 h ARG 114 CO 0.04 0.72 0.46 0.82 2.80 0.00 0.00 179.97 184.81 3ii0 h ILE 115 N -0.03 1.17 -0.84 1.20 1.08 -1.03 0.59 117.51 119.65 3ii0 h ILE 115 Ca 0.02 -0.32 -0.03 0.00 -0.39 0.00 0.00 64.86 64.14 3ii0 h ILE 115 Cb 0.65 0.16 -0.04 0.00 -3.07 0.00 0.00 36.82 34.52 3ii0 h ILE 115 CO 0.03 0.17 0.40 1.23 -0.69 0.00 0.00 178.15 179.30 3ii0 h GLY 116 N 0.93 1.29 0.81 5.37 0.00 -1.16 -0.34 103.07 109.97 3ii0 h GLY 116 Ca 0.26 -0.64 -0.00 0.00 0.00 0.00 0.00 47.33 46.94 3ii0 h GLY 116 CO -0.06 0.61 0.02 0.00 0.00 0.00 0.00 176.54 177.10 3ii0 h ALA 117 N 1.22 0.07 -0.54 3.60 0.00 -0.36 -1.93 119.26 121.31 3ii0 h ALA 117 Ca 0.29 -0.11 -0.00 0.00 0.00 0.00 0.00 54.91 55.08 3ii0 h ALA 117 Cb 0.12 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 17.86 3ii0 h ALA 117 CO -0.04 -0.32 0.33 -0.44 0.00 0.00 0.00 179.25 178.78 3ii0 h ASP 118 N -0.12 0.64 -0.01 0.00 3.32 -0.61 -1.11 116.42 118.53 3ii0 h ASP 118 Ca 0.02 -0.03 -0.00 0.00 0.02 0.00 0.00 57.03 57.03 3ii0 h ASP 118 Cb 0.21 -0.16 -0.00 0.00 0.22 0.00 0.00 39.33 39.60 3ii0 h ASP 118 CO -0.00 0.50 0.01 0.15 -1.72 0.00 0.00 179.24 178.17 3ii0 h PHE 119 N 0.75 0.02 -0.77 4.55 3.04 -0.86 -2.82 116.94 120.84 3ii0 h PHE 119 Ca 0.20 -0.00 -0.05 0.00 3.98 0.00 0.00 57.97 62.10 3ii0 h PHE 119 Cb -0.03 -0.01 -0.03 0.00 2.56 0.00 0.00 35.95 38.44 3ii0 h PHE 119 CO 0.00 0.17 0.30 -0.07 -2.02 0.00 0.00 178.31 176.69 3ii0 h LEU 120 N -0.13 1.07 -1.73 0.59 3.38 -0.95 0.25 115.31 117.78 3ii0 h LEU 120 Ca 0.00 -0.17 0.00 0.00 0.09 0.00 0.00 57.88 57.80 3ii0 h LEU 120 Cb 0.16 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 40.63 3ii0 h LEU 120 CO -0.00 0.96 0.00 0.00 0.09 0.00 0.00 178.44 179.49 3ii0 h ALA 121 N 1.19 1.00 0.00 1.53 0.00 -1.17 -2.59 119.26 119.22 3ii0 h ALA 121 Ca 0.26 0.00 -0.26 0.00 0.00 0.00 0.00 54.91 54.90 3ii0 h ALA 121 Cb 0.23 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 17.97 3ii0 h ALA 121 CO -0.02 0.00 -1.98 -2.13 0.00 0.00 0.00 179.25 175.12 3ii0 n ARG 122 N -2.69 0.42 0.00 0.00 3.00 -0.69 -3.23 116.66 113.47 3ii0 n ARG 122 Ca -0.01 0.11 0.01 0.00 -0.00 0.00 0.00 57.85 57.96 3ii0 n ARG 122 Cb 0.15 -1.32 -0.00 0.00 0.00 0.00 0.00 32.46 31.29 3ii0 n ARG 122 CO 0.00 0.00 0.00 0.91 0.00 0.00 0.00 177.63 178.54 3ii0 n TRP 123 N -3.11 0.00 -4.38 -0.14 7.02 -0.01 -0.34 117.44 116.49 3ii0 n TRP 123 Ca -0.31 0.00 -0.35 0.00 -1.02 0.00 0.00 57.50 55.82 3ii0 n TRP 123 Cb 0.81 0.00 -0.10 0.00 -2.42 0.00 0.00 31.31 29.60 3ii0 n TRP 123 CO 0.00 0.00 0.00 -0.47 -2.02 0.00 0.00 177.69 175.20 3ii0 s TYR 124 N -0.58 3.13 -1.29 -5.99 5.04 -0.98 -4.45 117.35 112.23 3ii0 s TYR 124 Ca 0.01 0.11 -0.05 0.00 -2.44 0.00 0.00 57.07 54.70 3ii0 s TYR 124 Cb 0.01 -1.82 0.01 0.00 0.35 0.00 0.00 41.96 40.51 3ii0 s TYR 124 CO 0.03 0.37 0.66 -1.71 -1.34 0.00 0.00 175.55 173.56 3ii0 n ASN 125 N 2.41 -5.56 0.00 4.32 5.15 -1.26 -4.62 115.26 115.70 3ii0 n ASN 125 Ca -0.18 -0.30 0.00 0.00 -0.60 0.00 0.00 54.58 53.49 3ii0 n ASN 125 Cb 0.53 -4.34 0.00 0.00 -0.53 0.00 0.00 39.78 35.44 3ii0 n ASN 125 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 3ii0 n GLY 126 N -1.52 -0.62 3.45 8.20 0.00 -1.26 -4.80 105.19 108.64 3ii0 n GLY 126 Ca -0.07 -2.17 -0.35 0.00 0.00 0.00 0.00 46.02 43.43 3ii0 n GLY 126 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3ii0 s THR 127 N 0.00 3.99 -1.49 2.61 2.01 -1.26 -4.29 115.64 117.21 3ii0 s THR 127 Ca 0.00 -0.30 -0.08 0.00 0.31 0.00 0.00 61.69 61.62 3ii0 s THR 127 Cb 0.00 -2.81 0.06 0.00 0.01 0.00 0.00 72.50 69.76 3ii0 s THR 127 CO 0.00 0.42 0.71 0.59 -0.69 0.00 0.00 174.62 175.66 3ii0 n ASN 128 N 4.26 -2.39 -4.45 3.53 5.03 0.54 -4.91 115.26 116.87 3ii0 n ASN 128 Ca -0.17 -0.91 -0.43 0.00 0.87 0.00 0.00 54.58 53.94 3ii0 n ASN 128 Cb 0.52 -3.43 -0.05 0.00 -1.02 0.00 0.00 39.78 35.81 3ii0 n ASN 128 CO 0.00 0.00 0.00 0.21 -1.83 0.00 0.00 177.26 175.64 3ii0 s ASN 129 N -3.84 6.22 0.00 6.41 3.84 -1.20 -4.87 114.94 121.50 3ii0 s ASN 129 Ca 0.35 -0.94 0.25 0.00 0.21 0.00 0.00 52.86 52.73 3ii0 s ASN 129 Cb -0.18 -2.37 0.79 0.00 -0.55 0.00 0.00 41.25 38.94 3ii0 s ASN 129 CO 0.87 -1.20 1.59 0.29 -2.79 0.00 0.00 177.10 175.86 3ii0 n LYS 130 N 7.01 1.84 0.01 0.43 4.76 -1.26 -4.17 118.16 126.78 3ii0 n LYS 130 Ca -0.05 -1.24 0.11 0.00 -2.87 0.00 0.00 58.31 54.26 3ii0 n LYS 130 Cb 0.45 -1.45 0.01 0.00 -1.84 0.00 0.00 35.03 32.20 3ii0 n LYS 130 CO 0.00 0.00 0.00 0.09 -1.37 0.00 0.00 177.40 176.12 3ii0 n ASN 131 N 0.49 0.65 -4.67 4.39 3.02 -1.26 -1.37 115.26 116.51 3ii0 n ASN 131 Ca 0.17 -0.38 -0.49 0.00 -0.03 0.00 0.00 54.58 53.85 3ii0 n ASN 131 Cb 0.40 0.83 -0.05 0.00 -0.61 0.00 0.00 39.78 40.35 3ii0 n ASN 131 CO 0.00 0.00 0.00 0.41 -2.62 0.00 0.00 177.26 175.05 3ii0 n THR 132 N -1.81 0.53 -1.75 3.41 -1.04 -1.26 -4.72 114.28 107.63 3ii0 n THR 132 Ca 0.03 -0.12 -0.42 0.00 -2.04 0.00 0.00 64.05 61.50 3ii0 n THR 132 Cb 0.41 -1.81 -0.01 0.00 -1.82 0.00 0.00 70.33 67.10 3ii0 n THR 132 CO 0.00 0.00 0.00 -2.65 -0.64 0.00 0.00 175.07 171.78 3ii0 n PRO 133 N 6.68 2.58 -4.13 -2.82 -0.02 -1.26 -4.72 135.00 131.31 3ii0 n PRO 133 Ca 0.24 0.91 -0.34 0.00 -2.02 0.00 0.00 63.50 62.29 3ii0 n PRO 133 Cb 0.28 -2.62 -0.14 0.00 -0.02 0.00 0.00 33.50 30.99 3ii0 n PRO 133 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 3ii0 s VAL 134 N -0.83 3.15 -0.22 -1.45 1.01 -0.82 -1.67 120.40 119.56 3ii0 s VAL 134 Ca 0.56 -0.58 -0.08 0.00 0.00 0.00 0.00 61.98 61.88 3ii0 s VAL 134 Cb -0.50 -2.40 -0.04 0.00 0.00 0.00 0.00 36.38 33.44 3ii0 s VAL 134 CO 0.60 0.46 0.09 -0.31 0.00 0.00 0.00 175.10 175.94 3ii0 s TYR 135 N 1.19 3.20 0.31 5.22 1.51 0.16 0.08 117.35 129.02 3ii0 s TYR 135 Ca 0.02 -0.05 0.10 0.00 -1.01 0.00 0.00 57.07 56.13 3ii0 s TYR 135 Cb -0.14 -2.18 -0.05 0.00 -0.11 0.00 0.00 41.96 39.47 3ii0 s TYR 135 CO -0.03 -0.05 -0.09 0.14 -1.11 0.00 0.00 175.55 174.42 3ii0 s VAL 136 N 0.98 2.55 0.54 0.71 -7.23 -0.06 -1.37 120.40 116.51 3ii0 s VAL 136 Ca 0.05 -2.18 -0.19 0.00 -1.81 0.00 0.00 61.98 57.85 3ii0 s VAL 136 Cb -0.14 -2.60 -0.06 0.00 0.56 0.00 0.00 36.38 34.14 3ii0 s VAL 136 CO 0.03 -0.28 1.10 -0.94 -0.31 0.00 0.00 175.10 174.70 3ii0 s SER 137 N -3.61 5.86 -0.41 4.85 1.04 -1.26 -1.00 113.70 119.17 3ii0 s SER 137 Ca 0.32 2.07 -0.11 0.00 0.48 0.00 0.00 55.95 58.71 3ii0 s SER 137 Cb -0.01 -2.57 0.06 0.00 0.10 0.00 0.00 66.02 63.59 3ii0 s SER 137 CO 0.17 -1.12 0.26 -0.55 0.98 0.00 0.00 173.24 172.99 3ii0 s SER 138 N -1.96 5.78 0.88 7.02 0.15 -0.25 -2.85 113.70 122.47 3ii0 s SER 138 Ca 0.70 -1.25 -0.10 0.00 0.70 0.00 0.00 55.95 56.00 3ii0 s SER 138 Cb -0.21 -2.04 0.18 0.00 -1.71 0.00 0.00 66.02 62.24 3ii0 s SER 138 CO 0.27 -0.50 1.21 -2.16 1.20 0.00 0.00 173.24 173.26 3ii0 s PRO 139 N 1.52 0.94 0.33 5.44 0.04 -1.26 -1.44 135.00 140.57 3ii0 s PRO 139 Ca 0.03 -0.74 -0.03 0.00 0.04 0.00 0.00 61.00 60.30 3ii0 s PRO 139 Cb -0.22 -2.03 0.01 0.00 0.04 0.00 0.00 34.50 32.31 3ii0 s PRO 139 CO 0.05 -2.10 0.48 -2.37 0.04 0.00 0.00 177.00 173.10 3ii0 n THR 140 N -3.44 0.00 -1.78 1.26 5.66 -1.13 -4.64 114.28 110.21 3ii0 n THR 140 Ca 0.16 -1.55 -0.41 0.00 -3.05 0.00 0.00 64.05 59.20 3ii0 n THR 140 Cb 0.60 1.00 -0.01 0.00 -1.55 0.00 0.00 70.33 70.36 3ii0 n THR 140 CO 0.00 0.00 0.00 0.86 -3.05 0.00 0.00 175.07 172.88 3ii0 s TRP 141 N -3.06 2.74 0.46 1.09 -0.00 -1.01 -4.61 118.94 114.55 3ii0 s TRP 141 Ca 0.25 0.80 0.20 0.00 -0.00 0.00 0.00 56.10 57.35 3ii0 s TRP 141 Cb -0.01 -4.07 1.19 0.00 -0.00 0.00 0.00 33.47 30.57 3ii0 s TRP 141 CO 0.18 -3.58 1.93 1.05 -0.00 0.00 0.00 176.95 176.53 3ii0 h GLU 142 N 4.75 0.26 -0.01 5.86 4.11 -1.93 -2.61 114.58 125.01 3ii0 h GLU 142 Ca -0.47 -0.02 0.00 0.00 0.07 0.00 0.00 59.36 58.94 3ii0 h GLU 142 Cb 1.22 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 30.41 3ii0 h GLU 142 CO 0.79 0.17 -0.19 -1.71 0.07 0.00 0.00 179.01 178.14 3ii0 n ASN 143 N -4.44 0.90 0.21 3.06 5.15 -1.26 -3.99 115.26 114.89 3ii0 n ASN 143 Ca 0.14 -0.85 -0.14 0.00 -0.60 0.00 0.00 54.58 53.13 3ii0 n ASN 143 Cb 0.62 0.06 -0.08 0.00 -0.53 0.00 0.00 39.78 39.85 3ii0 n ASN 143 CO 0.00 0.00 0.00 0.45 1.40 0.00 0.00 177.26 179.11 3ii0 h HIS 144 N 1.11 -0.48 -0.40 1.20 3.86 -1.85 -0.35 115.15 118.24 3ii0 h HIS 144 Ca 0.00 -0.01 0.01 0.00 -1.16 0.00 0.00 60.37 59.20 3ii0 h HIS 144 Cb 0.46 0.16 -0.02 0.00 1.06 0.00 0.00 27.41 29.07 3ii0 h HIS 144 CO 0.00 -0.19 0.26 -0.91 0.86 0.00 0.00 177.93 177.95 3ii0 h ASN 145 N -0.74 0.45 -0.64 2.45 4.21 -1.78 -2.26 115.58 117.28 3ii0 h ASN 145 Ca -0.05 -0.01 -0.03 0.00 1.21 0.00 0.00 56.30 57.41 3ii0 h ASN 145 Cb 0.51 -0.11 -0.03 0.00 -1.12 0.00 0.00 38.32 37.57 3ii0 h ASN 145 CO 0.09 0.33 0.27 0.00 -1.29 0.00 0.00 177.43 176.83 3ii0 h ALA 146 N 1.15 0.83 -0.27 -0.83 0.00 -1.69 -0.56 119.26 117.89 3ii0 h ALA 146 Ca 0.15 -0.16 -0.03 0.00 0.00 0.00 0.00 54.91 54.86 3ii0 h ALA 146 Cb -0.06 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.47 3ii0 h ALA 146 CO -0.04 0.44 0.05 0.28 0.00 0.00 0.00 179.25 179.98 3ii0 h VAL 147 N 0.90 1.22 -0.20 0.00 2.07 -0.90 -1.17 116.25 118.18 3ii0 h VAL 147 Ca 0.22 -0.75 -0.12 0.00 0.82 0.00 0.00 66.70 66.86 3ii0 h VAL 147 Cb 0.18 1.20 -0.01 0.00 -1.52 0.00 0.00 31.29 31.14 3ii0 h VAL 147 CO -0.02 0.24 -0.39 -0.26 0.02 0.00 0.00 177.57 177.16 3ii0 h PHE 148 N 0.27 0.52 -0.86 1.57 -1.00 -1.23 -2.24 116.94 113.97 3ii0 h PHE 148 Ca 0.08 -0.14 -0.03 0.00 2.81 0.00 0.00 57.97 60.69 3ii0 h PHE 148 Cb 0.31 -0.12 -0.04 0.00 3.61 0.00 0.00 35.95 39.72 3ii0 h PHE 148 CO 0.02 0.77 0.43 0.77 -1.61 0.00 0.00 178.31 178.69 3ii0 h SER 149 N 0.37 1.11 -0.19 2.17 0.02 -1.00 -2.62 113.55 113.41 3ii0 h SER 149 Ca 0.04 -0.13 -0.01 0.00 -0.84 0.00 0.00 61.79 60.85 3ii0 h SER 149 Cb 0.85 -0.28 -0.01 0.00 0.14 0.00 0.00 62.40 63.09 3ii0 h SER 149 CO 0.07 0.92 0.09 0.00 -1.14 0.00 0.00 176.83 176.77 3ii0 h ALA 150 N 1.23 1.70 0.00 3.77 0.00 -0.88 -0.78 119.26 124.30 3ii0 h ALA 150 Ca 0.30 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.13 3ii0 h ALA 150 Cb 0.09 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.78 3ii0 h ALA 150 CO -0.04 0.24 0.00 0.00 0.00 0.00 0.00 179.25 179.45 3ii0 n ALA 151 N -2.49 1.94 0.00 0.00 0.00 -0.87 -4.89 120.51 114.20 3ii0 n ALA 151 Ca 0.01 0.03 0.00 0.00 0.00 0.00 0.00 53.44 53.48 3ii0 n ALA 151 Cb 0.13 -1.42 0.00 0.00 0.00 0.00 0.00 19.45 18.16 3ii0 n ALA 151 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3ii0 n GLY 152 N 0.59 0.94 3.70 0.00 0.00 -0.30 -4.84 105.19 105.28 3ii0 n GLY 152 Ca 0.04 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.64 3ii0 n GLY 152 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3ii0 s PHE 153 N -2.00 2.74 -0.33 1.61 0.08 -1.02 -4.80 117.98 114.26 3ii0 s PHE 153 Ca 0.00 0.54 0.23 0.00 0.12 0.00 0.00 56.93 57.82 3ii0 s PHE 153 Cb 0.00 -3.88 -0.06 0.00 -0.57 0.00 0.00 43.02 38.51 3ii0 s PHE 153 CO 0.00 -3.37 0.90 1.63 -0.10 0.00 0.00 175.22 174.28 3ii0 n LYS 154 N 4.96 0.49 -3.66 0.44 5.02 -0.47 -4.44 118.16 120.50 3ii0 n LYS 154 Ca 0.14 -0.00 -0.27 0.00 -2.02 0.00 0.00 58.31 56.16 3ii0 n LYS 154 Cb 0.41 -1.66 -0.11 0.00 -0.02 0.00 0.00 35.03 33.64 3ii0 n LYS 154 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 3ii0 n ASP 155 N -2.30 1.81 -4.71 4.39 -0.08 -1.26 -5.08 116.55 109.32 3ii0 n ASP 155 Ca -0.00 -2.93 -0.38 0.00 -1.51 0.00 0.00 54.79 49.97 3ii0 n ASP 155 Cb 0.51 -0.68 -0.07 0.00 2.34 0.00 0.00 41.12 43.23 3ii0 n ASP 155 CO 0.00 0.00 0.00 -0.63 0.12 0.00 0.00 177.20 176.69 3ii0 s ILE 156 N -1.04 5.22 0.23 5.18 1.01 -1.26 -1.95 121.20 128.58 3ii0 s ILE 156 Ca 0.29 0.80 0.06 0.00 0.00 0.00 0.00 60.65 61.80 3ii0 s ILE 156 Cb 0.01 -3.75 -0.05 0.00 0.01 0.00 0.00 42.46 38.68 3ii0 s ILE 156 CO -0.16 0.32 -0.06 -0.13 0.00 0.00 0.00 174.94 174.90 3ii0 s ARG 157 N 0.78 1.37 -0.06 2.79 0.52 0.11 -4.96 118.95 119.51 3ii0 s ARG 157 Ca 0.22 -1.67 0.00 0.00 -0.52 0.00 0.00 55.73 53.77 3ii0 s ARG 157 Cb -0.14 -0.91 -0.03 0.00 0.52 0.00 0.00 34.95 34.39 3ii0 s ARG 157 CO 0.08 0.03 -0.04 -1.12 0.02 0.00 0.00 175.30 174.28 3ii0 s SER 158 N -3.34 4.91 -0.07 0.23 0.01 -1.26 -0.89 113.70 113.29 3ii0 s SER 158 Ca 0.26 0.03 -0.04 0.00 1.31 0.00 0.00 55.95 57.51 3ii0 s SER 158 Cb 0.03 -1.28 -0.04 0.00 0.21 0.00 0.00 66.02 64.94 3ii0 s SER 158 CO 0.08 0.35 0.11 -0.72 0.41 0.00 0.00 173.24 173.47 3ii0 s TYR 159 N -0.89 3.43 0.33 2.43 -0.85 -0.17 -4.88 117.35 116.76 3ii0 s TYR 159 Ca 0.14 0.37 -0.29 0.00 -0.52 0.00 0.00 57.07 56.76 3ii0 s TYR 159 Cb -0.11 -1.85 -0.11 0.00 0.38 0.00 0.00 41.96 40.27 3ii0 s TYR 159 CO 0.03 0.63 1.56 1.03 -1.52 0.00 0.00 175.55 177.28 3ii0 s ARG 160 N -1.29 4.10 0.05 -3.49 0.52 -1.26 -1.09 118.95 116.49 3ii0 s ARG 160 Ca 0.18 2.60 0.00 0.00 -0.52 0.00 0.00 55.73 57.99 3ii0 s ARG 160 Cb -0.12 -2.99 0.00 0.00 0.52 0.00 0.00 34.95 32.36 3ii0 s ARG 160 CO 0.08 -0.61 0.00 0.98 0.02 0.00 0.00 175.30 175.77 3ii0 n TYR 161 N 1.40 -0.45 -2.53 -0.53 9.36 -1.21 -3.54 117.16 119.67 3ii0 n TYR 161 Ca 0.05 0.08 -0.42 0.00 3.32 0.00 0.00 57.90 60.92 3ii0 n TYR 161 Cb 0.38 0.52 -0.03 0.00 -0.63 0.00 0.00 39.34 39.59 3ii0 n TYR 161 CO 0.00 0.00 0.00 -0.46 0.22 0.00 0.00 176.86 176.62 3ii0 s TRP 162 N -1.16 3.23 -0.42 2.98 -0.00 -0.52 0.15 118.94 123.20 3ii0 s TRP 162 Ca 0.00 1.30 -0.12 0.00 -0.00 0.00 0.00 56.10 57.28 3ii0 s TRP 162 Cb 0.00 -3.36 0.05 0.00 -0.00 0.00 0.00 33.47 30.16 3ii0 s TRP 162 CO 0.00 -1.03 0.28 0.34 -0.00 0.00 0.00 176.95 176.54 3ii0 s ASP 163 N 1.43 5.86 0.42 5.86 -1.08 -0.40 -4.80 116.67 123.96 3ii0 s ASP 163 Ca 0.53 -1.21 0.21 0.00 -0.52 0.00 0.00 52.55 51.56 3ii0 s ASP 163 Cb -0.22 -2.07 0.92 0.00 -1.46 0.00 0.00 42.92 40.09 3ii0 s ASP 163 CO 0.19 -0.50 1.84 0.00 0.52 0.00 0.00 175.17 177.22 3ii0 h ALA 164 N 8.53 1.11 0.50 3.66 0.00 -1.95 0.10 119.26 131.21 3ii0 h ALA 164 Ca -0.26 -0.26 -0.02 0.00 0.00 0.00 0.00 54.91 54.37 3ii0 h ALA 164 Cb 1.10 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.85 3ii0 h ALA 164 CO 0.75 0.35 -0.24 1.05 0.00 0.00 0.00 179.25 181.17 3ii0 h GLU 165 N 0.00 -0.64 -0.01 0.00 9.09 -1.96 -3.30 114.58 117.77 3ii0 h GLU 165 Ca -0.00 0.04 0.00 0.00 0.05 0.00 0.00 59.36 59.45 3ii0 h GLU 165 Cb 0.71 0.15 0.00 0.00 -1.65 0.00 0.00 28.75 27.95 3ii0 h GLU 165 CO 0.04 -0.36 -0.27 0.36 0.05 0.00 0.00 179.01 178.82 3ii0 n LYS 166 N -5.31 0.82 -4.14 1.06 2.85 -1.18 -4.96 118.16 107.30 3ii0 n LYS 166 Ca -0.11 -0.49 -0.31 0.00 -1.05 0.00 0.00 58.31 56.35 3ii0 n LYS 166 Cb 0.31 -1.49 -0.05 0.00 -0.65 0.00 0.00 35.03 33.14 3ii0 n LYS 166 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 177.40 177.89 3ii0 n ARG 167 N -0.66 -1.71 0.00 -1.58 1.74 0.35 -4.94 116.66 109.85 3ii0 n ARG 167 Ca 0.12 0.22 0.00 0.00 -0.77 0.00 0.00 57.85 57.41 3ii0 n ARG 167 Cb 0.35 -3.83 0.00 0.00 -1.02 0.00 0.00 32.46 27.96 3ii0 n ARG 167 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3ii0 n GLY 168 N -2.28 3.93 3.74 -0.13 0.00 -1.18 -5.00 105.19 104.27 3ii0 n GLY 168 Ca -0.29 -0.93 -0.39 0.00 0.00 0.00 0.00 46.02 44.41 3ii0 n GLY 168 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3ii0 s LEU 169 N 0.00 4.38 -1.22 0.99 2.96 -1.26 -1.27 118.68 123.25 3ii0 s LEU 169 Ca 0.00 1.20 -0.12 0.00 -0.22 0.00 0.00 54.13 54.98 3ii0 s LEU 169 Cb 0.00 -3.01 0.18 0.00 0.50 0.00 0.00 46.19 43.86 3ii0 s LEU 169 CO 0.00 0.01 1.52 -0.67 -1.32 0.00 0.00 176.35 175.89 3ii0 n ASP 170 N 3.15 5.24 -0.24 3.68 2.03 0.12 -4.82 116.55 125.71 3ii0 n ASP 170 Ca -0.04 -3.02 -0.06 0.00 0.52 0.00 0.00 54.79 52.19 3ii0 n ASP 170 Cb 0.51 -1.53 0.05 0.00 -0.72 0.00 0.00 41.12 39.42 3ii0 n ASP 170 CO 0.00 0.00 0.00 0.25 -1.92 0.00 0.00 177.20 175.53 3ii0 h LEU 171 N 9.05 0.87 -0.60 -2.67 5.85 -1.92 -1.31 115.31 124.57 3ii0 h LEU 171 Ca 0.33 -0.12 -0.03 0.00 0.84 0.00 0.00 57.88 58.89 3ii0 h LEU 171 Cb 0.81 -0.22 -0.03 0.00 0.37 0.00 0.00 40.66 41.59 3ii0 h LEU 171 CO 1.32 0.74 0.25 1.56 -0.34 0.00 0.00 178.44 181.97 3ii0 h GLN 172 N 0.93 0.89 -0.55 1.25 1.08 -1.97 -1.11 115.11 115.63 3ii0 h GLN 172 Ca 0.23 -0.16 0.03 0.00 -1.45 0.00 0.00 58.65 57.31 3ii0 h GLN 172 Cb 0.09 -0.15 -0.04 0.00 -0.05 0.00 0.00 27.48 27.34 3ii0 h GLN 172 CO -0.03 0.75 0.32 0.78 -0.95 0.00 0.00 178.83 179.71 3ii0 h GLY 173 N 0.83 0.77 0.96 3.46 0.00 -1.82 0.06 103.07 107.33 3ii0 h GLY 173 Ca 0.20 -0.24 -0.02 0.00 0.00 0.00 0.00 47.33 47.27 3ii0 h GLY 173 CO -0.02 0.20 -0.22 -2.75 0.00 0.00 0.00 176.54 173.75 3ii0 h PHE 174 N 0.64 -0.56 -0.50 5.60 3.57 -1.06 0.11 116.94 124.75 3ii0 h PHE 174 Ca 0.22 -0.01 0.01 0.00 3.53 0.00 0.00 57.97 61.71 3ii0 h PHE 174 Cb 0.04 0.18 -0.03 0.00 2.79 0.00 0.00 35.95 38.94 3ii0 h PHE 174 CO -0.07 -0.32 0.33 -0.07 -2.23 0.00 0.00 178.31 175.95 3ii0 h LEU 175 N -0.65 0.57 -0.73 0.59 3.38 -1.09 -1.17 115.31 116.21 3ii0 h LEU 175 Ca -0.06 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.90 3ii0 h LEU 175 Cb 0.49 -0.14 -0.04 0.00 0.09 0.00 0.00 40.66 41.06 3ii0 h LEU 175 CO 0.10 0.41 0.47 -1.13 0.09 0.00 0.00 178.44 178.38 3ii0 h ASN 176 N 0.67 0.86 -0.81 -0.43 -0.73 -0.76 0.12 115.58 114.50 3ii0 h ASN 176 Ca 0.18 -0.04 -0.03 0.00 1.87 0.00 0.00 56.30 58.29 3ii0 h ASN 176 Cb -0.07 -0.21 -0.04 0.00 0.27 0.00 0.00 38.32 38.27 3ii0 h ASN 176 CO -0.04 0.64 0.39 0.44 -0.37 0.00 0.00 177.43 178.49 3ii0 h ASP 177 N 0.99 1.05 -0.43 1.15 3.32 -0.49 -1.82 116.42 120.19 3ii0 h ASP 177 Ca 0.27 -0.13 -0.11 0.00 0.02 0.00 0.00 57.03 57.07 3ii0 h ASP 177 Cb -0.08 -0.27 -0.02 0.00 0.22 0.00 0.00 39.33 39.18 3ii0 h ASP 177 CO -0.05 0.89 -0.14 -0.07 -1.72 0.00 0.00 179.24 178.15 3ii0 h LEU 178 N 1.14 0.91 -1.31 1.55 3.38 -0.68 -2.48 115.31 117.82 3ii0 h LEU 178 Ca 0.28 -0.30 -0.01 0.00 0.09 0.00 0.00 57.88 57.93 3ii0 h LEU 178 Cb 0.11 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 40.59 3ii0 h LEU 178 CO -0.04 1.05 0.29 -0.33 0.09 0.00 0.00 178.44 179.50 3ii0 h GLU 179 N 0.81 0.76 -0.04 1.13 5.08 -0.46 -2.21 114.58 119.64 3ii0 h GLU 179 Ca 0.12 -0.08 0.00 0.00 -1.00 0.00 0.00 59.36 58.40 3ii0 h GLU 179 Cb 0.68 -0.15 0.00 0.00 0.50 0.00 0.00 28.75 29.77 3ii0 h GLU 179 CO 0.05 0.57 0.00 0.09 -1.00 0.00 0.00 179.01 178.72 3ii0 n ASN 180 N -4.39 1.14 -4.75 1.42 3.02 -0.71 -4.91 115.26 106.08 3ii0 n ASN 180 Ca 0.05 -1.44 -0.40 0.00 -0.03 0.00 0.00 54.58 52.76 3ii0 n ASN 180 Cb 0.11 -0.02 -0.05 0.00 -0.61 0.00 0.00 39.78 39.21 3ii0 n ASN 180 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3ii0 s ALA 181 N -1.96 3.38 0.54 5.41 0.00 -0.83 -5.00 121.76 123.31 3ii0 s ALA 181 Ca 0.38 0.81 -0.21 0.00 0.00 0.00 0.00 51.96 52.93 3ii0 s ALA 181 Cb 0.20 -3.29 -0.06 0.00 0.00 0.00 0.00 23.12 19.97 3ii0 s ALA 181 CO 0.32 -0.05 1.18 -2.30 0.00 0.00 0.00 175.76 174.92 3ii0 n PRO 182 N 1.35 1.41 -1.62 0.00 -0.02 -1.26 -4.91 135.00 129.94 3ii0 n PRO 182 Ca -0.01 0.52 -0.39 0.00 -2.02 0.00 0.00 63.50 61.60 3ii0 n PRO 182 Cb 0.46 -2.36 0.04 0.00 -0.02 0.00 0.00 33.50 31.61 3ii0 n PRO 182 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 3ii0 n GLU 183 N -0.79 1.12 -0.82 -0.52 1.02 -1.26 -2.10 120.64 117.29 3ii0 n GLU 183 Ca 0.11 0.42 0.00 0.00 -0.02 0.00 0.00 57.16 57.67 3ii0 n GLU 183 Cb 0.44 -2.16 0.00 0.00 -0.02 0.00 0.00 31.44 29.71 3ii0 n GLU 183 CO 0.00 0.00 0.00 1.19 1.18 0.00 0.00 177.13 179.50 3ii0 n PHE 184 N -1.26 0.00 -1.65 -0.32 3.72 -0.14 -5.00 117.46 112.81 3ii0 n PHE 184 Ca 0.12 0.00 -0.38 0.00 -0.05 0.00 0.00 57.45 57.14 3ii0 n PHE 184 Cb 0.45 -1.02 0.05 0.00 -0.94 0.00 0.00 39.48 38.02 3ii0 n PHE 184 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 176.76 177.14 3ii0 n SER 185 N -0.23 1.24 -4.72 4.37 7.64 -0.89 -4.45 113.62 116.57 3ii0 n SER 185 Ca 0.00 0.85 -0.38 0.00 1.01 0.00 0.00 58.87 60.35 3ii0 n SER 185 Cb 0.12 -1.43 -0.06 0.00 -1.01 0.00 0.00 64.21 61.83 3ii0 n SER 185 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 3ii0 s ILE 186 N -1.44 5.14 -0.19 0.44 1.01 -0.67 -0.59 121.20 124.90 3ii0 s ILE 186 Ca 0.75 1.11 0.01 0.00 0.00 0.00 0.00 60.65 62.51 3ii0 s ILE 186 Cb -0.43 -3.89 0.02 0.00 0.01 0.00 0.00 42.46 38.18 3ii0 s ILE 186 CO 0.48 0.30 -0.19 -0.69 0.00 0.00 0.00 174.94 174.84 3ii0 s VAL 187 N 0.67 2.11 -0.39 2.92 1.01 0.51 -0.67 120.40 126.56 3ii0 s VAL 187 Ca 0.30 -0.99 -0.21 0.00 0.00 0.00 0.00 61.98 61.08 3ii0 s VAL 187 Cb -0.16 -1.92 0.01 0.00 0.00 0.00 0.00 36.38 34.31 3ii0 s VAL 187 CO 0.13 0.49 0.68 -0.69 0.00 0.00 0.00 175.10 175.71 3ii0 s VAL 188 N 1.28 4.81 -0.14 2.92 1.01 -0.47 -0.70 120.40 129.11 3ii0 s VAL 188 Ca 0.04 0.49 0.01 0.00 0.00 0.00 0.00 61.98 62.51 3ii0 s VAL 188 Cb -0.14 -4.17 -0.01 0.00 0.00 0.00 0.00 36.38 32.07 3ii0 s VAL 188 CO -0.12 -0.47 -0.16 -0.76 0.00 0.00 0.00 175.10 173.60 3ii0 s LEU 189 N 2.89 2.53 -0.17 3.92 1.43 -0.61 -4.36 118.68 124.31 3ii0 s LEU 189 Ca 0.26 -0.42 -0.29 0.00 -1.03 0.00 0.00 54.13 52.65 3ii0 s LEU 189 Cb -0.14 -1.56 -0.01 0.00 0.03 0.00 0.00 46.19 44.51 3ii0 s LEU 189 CO 0.17 0.13 1.15 -1.00 0.23 0.00 0.00 176.35 177.03 3ii0 s HIS 190 N 0.55 3.14 0.22 0.29 3.76 -1.26 -0.14 115.29 121.85 3ii0 s HIS 190 Ca -0.10 1.27 -0.06 0.00 -0.15 0.00 0.00 55.06 56.02 3ii0 s HIS 190 Cb -0.16 -3.37 0.20 0.00 1.11 0.00 0.00 32.58 30.35 3ii0 s HIS 190 CO 0.04 -1.05 1.74 0.00 -0.85 0.00 0.00 174.74 174.62 3ii0 h ALA 191 N 7.71 1.01 -2.35 -1.40 0.00 -1.58 -3.46 119.26 119.18 3ii0 h ALA 191 Ca -0.25 -0.25 0.16 0.00 0.00 0.00 0.00 54.91 54.57 3ii0 h ALA 191 Cb 1.10 -0.25 -0.10 0.00 0.00 0.00 0.00 17.79 18.55 3ii0 h ALA 191 CO 0.95 0.64 0.48 0.00 0.00 0.00 0.00 179.25 181.31 3ii0 n ALA 193 N -0.42 -2.39 -1.64 0.00 0.00 -1.26 -4.73 120.51 110.07 3ii0 n ALA 193 Ca -0.07 0.04 -0.47 0.00 0.00 0.00 0.00 53.44 52.94 3ii0 n ALA 193 Cb 0.61 -4.81 -0.04 0.00 0.00 0.00 0.00 19.45 15.21 3ii0 n ALA 193 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 177.50 179.08 3ii0 n HIS 194 N -3.56 1.94 -3.77 0.00 -0.00 -1.26 -4.84 115.22 103.73 3ii0 n HIS 194 Ca -0.12 0.45 -0.37 0.00 0.46 0.00 0.00 57.72 58.14 3ii0 n HIS 194 Cb 0.63 -2.44 -0.13 0.00 -0.12 0.00 0.00 29.99 27.93 3ii0 n HIS 194 CO 0.00 0.00 0.00 1.21 0.46 0.00 0.00 176.34 178.01 3ii0 s ASN 195 N 0.54 5.09 0.00 0.26 2.47 -1.26 -1.33 114.94 120.71 3ii0 s ASN 195 Ca 0.77 -0.67 0.18 0.00 0.42 0.00 0.00 52.86 53.56 3ii0 s ASN 195 Cb -0.76 -1.88 0.07 0.00 -1.45 0.00 0.00 41.25 37.23 3ii0 s ASN 195 CO 0.45 -0.17 0.98 -0.81 -3.72 0.00 0.00 177.10 173.82 3ii0 n PRO 196 N 4.87 1.56 0.20 0.43 -0.04 -1.26 -2.41 135.00 138.35 3ii0 n PRO 196 Ca -0.15 -1.20 0.10 0.00 -0.04 0.00 0.00 63.50 62.22 3ii0 n PRO 196 Cb 0.48 -1.32 0.16 0.00 -0.04 0.00 0.00 33.50 32.78 3ii0 n PRO 196 CO 0.00 0.00 0.00 1.79 -0.04 0.00 0.00 175.50 177.25 3ii0 h THR 197 N 2.69 0.22 -0.85 0.52 1.35 -1.89 -3.36 112.91 111.59 3ii0 h THR 197 Ca 0.00 -1.27 -0.35 0.00 -0.55 0.00 0.00 66.41 64.23 3ii0 h THR 197 Cb 0.66 2.08 -0.14 0.00 -1.73 0.00 0.00 68.15 69.02 3ii0 h THR 197 CO 0.00 0.12 -0.32 0.61 -0.25 0.00 0.00 175.52 175.68 3ii0 n GLY 198 N 1.06 1.68 3.21 5.82 0.00 -0.44 -4.27 105.19 112.25 3ii0 n GLY 198 Ca 0.03 -0.19 -0.33 0.00 0.00 0.00 0.00 46.02 45.54 3ii0 n GLY 198 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3ii0 s ILE 199 N -2.65 2.24 0.22 -0.61 -1.09 -1.26 -0.37 121.20 117.69 3ii0 s ILE 199 Ca 0.00 -0.93 0.10 0.00 -2.23 0.00 0.00 60.65 57.59 3ii0 s ILE 199 Cb 0.00 -1.90 -0.04 0.00 -1.58 0.00 0.00 42.46 38.94 3ii0 s ILE 199 CO 0.00 0.54 -0.08 -1.81 -1.23 0.00 0.00 174.94 172.37 3ii0 s ASP 200 N 0.66 4.27 0.48 3.58 1.01 -1.26 -4.54 116.67 120.87 3ii0 s ASP 200 Ca -0.10 -0.66 -0.23 0.00 0.71 0.00 0.00 52.55 52.27 3ii0 s ASP 200 Cb -0.16 -0.71 -0.07 0.00 1.01 0.00 0.00 42.92 42.99 3ii0 s ASP 200 CO 0.02 0.06 1.25 -2.84 0.21 0.00 0.00 175.17 173.86 3ii0 s PRO 201 N -3.22 3.58 0.78 8.23 0.02 -1.26 -5.01 135.00 138.12 3ii0 s PRO 201 Ca 0.28 1.98 -0.11 0.00 0.02 0.00 0.00 61.00 63.16 3ii0 s PRO 201 Cb -0.07 -2.41 0.06 0.00 0.02 0.00 0.00 34.50 32.10 3ii0 s PRO 201 CO 0.17 -0.75 1.08 0.95 -0.33 0.00 0.00 177.00 178.12 3ii0 s THR 202 N -1.43 3.32 0.26 0.99 -4.23 -1.26 -4.78 115.64 108.52 3ii0 s THR 202 Ca 0.65 0.43 -0.01 0.00 -1.18 0.00 0.00 61.69 61.58 3ii0 s THR 202 Cb -0.34 -3.07 0.25 0.00 1.34 0.00 0.00 72.50 70.68 3ii0 s THR 202 CO 0.41 -0.56 1.72 -0.65 -0.54 0.00 0.00 174.62 174.99 3ii0 h PRO 203 N -1.08 0.42 -0.37 3.99 0.11 -1.98 0.64 132.00 133.73 3ii0 h PRO 203 Ca -0.46 -0.03 -0.06 0.00 0.11 0.00 0.00 66.00 65.57 3ii0 h PRO 203 Cb 1.25 -0.09 -0.02 0.00 0.11 0.00 0.00 31.00 32.24 3ii0 h PRO 203 CO 0.56 0.28 -0.03 0.93 -0.21 0.00 0.00 178.00 179.53 3ii0 h GLU 204 N 0.43 0.59 -0.36 1.05 4.39 -2.01 -2.25 114.58 116.42 3ii0 h GLU 204 Ca 0.47 -0.15 -0.13 0.00 0.34 0.00 0.00 59.36 59.90 3ii0 h GLU 204 Cb 0.78 -0.08 -0.01 0.00 -0.10 0.00 0.00 28.75 29.35 3ii0 h GLU 204 CO -0.46 0.64 -0.26 1.96 -1.16 0.00 0.00 179.01 179.73 3ii0 h GLN 205 N 0.56 0.82 -0.47 2.33 4.20 -1.58 -2.86 115.11 118.10 3ii0 h GLN 205 Ca 0.11 -0.40 0.11 0.00 0.06 0.00 0.00 58.65 58.53 3ii0 h GLN 205 Cb 0.40 -0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.15 3ii0 h GLN 205 CO 0.02 1.03 0.33 -1.49 -0.67 0.00 0.00 178.83 178.05 3ii0 h TRP 206 N 0.61 0.18 -0.39 2.96 4.06 -0.66 -1.49 115.95 121.23 3ii0 h TRP 206 Ca 0.07 0.00 -0.15 0.00 2.06 0.00 0.00 58.89 60.88 3ii0 h TRP 206 Cb 0.83 -0.06 -0.01 0.00 -1.00 0.00 0.00 29.16 28.93 3ii0 h TRP 206 CO 0.06 0.09 -0.34 0.87 -3.56 0.00 0.00 178.44 175.56 3ii0 h LYS 207 N 0.17 0.90 -0.32 0.49 1.57 -1.18 -1.41 116.57 116.79 3ii0 h LYS 207 Ca 0.22 -0.45 -0.12 0.00 -1.87 0.00 0.00 60.65 58.43 3ii0 h LYS 207 Cb 0.65 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.95 3ii0 h LYS 207 CO -0.03 1.10 -0.30 1.96 -0.57 0.00 0.00 179.45 181.60 3ii0 h GLN 208 N 0.75 0.68 0.09 3.15 4.20 -1.24 -1.31 115.11 121.43 3ii0 h GLN 208 Ca 0.07 -0.30 -0.00 0.00 0.06 0.00 0.00 58.65 58.47 3ii0 h GLN 208 Cb 0.92 -0.02 0.00 0.00 0.30 0.00 0.00 27.48 28.68 3ii0 h GLN 208 CO 0.09 0.90 -0.04 0.82 -0.67 0.00 0.00 178.83 179.92 3ii0 h ILE 209 N 0.58 0.99 -0.80 2.54 2.04 -1.23 -2.57 117.51 119.07 3ii0 h ILE 209 Ca 0.07 -0.29 0.07 0.00 1.00 0.00 0.00 64.86 65.71 3ii0 h ILE 209 Cb 0.81 1.18 -0.06 0.00 -0.74 0.00 0.00 36.82 38.01 3ii0 h ILE 209 CO 0.07 0.07 0.47 0.00 0.00 0.00 0.00 178.15 178.76 3ii0 h ALA 210 N 0.65 1.10 -0.48 1.87 0.00 -1.20 -1.43 119.26 119.78 3ii0 h ALA 210 Ca -0.01 0.01 0.05 0.00 0.00 0.00 0.00 54.91 54.96 3ii0 h ALA 210 Cb 0.21 -0.17 -0.05 0.00 0.00 0.00 0.00 17.79 17.78 3ii0 h ALA 210 CO 0.02 0.15 0.21 1.03 0.00 0.00 0.00 179.25 180.66 3ii0 h SER 211 N 0.83 0.27 -0.56 0.00 0.87 -1.05 0.18 113.55 114.08 3ii0 h SER 211 Ca 0.36 0.04 -0.11 0.00 -1.23 0.00 0.00 61.79 60.85 3ii0 h SER 211 Cb 0.24 -0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 62.18 3ii0 h SER 211 CO -0.20 0.19 -0.07 0.58 -0.53 0.00 0.00 176.83 176.79 3ii0 h VAL 212 N 0.41 1.27 -0.56 2.23 2.07 -1.05 -1.41 116.25 119.21 3ii0 h VAL 212 Ca 0.22 -1.23 -0.02 0.00 0.82 0.00 0.00 66.70 66.48 3ii0 h VAL 212 Cb 0.17 0.90 -0.03 0.00 -1.52 0.00 0.00 31.29 30.82 3ii0 h VAL 212 CO -0.19 0.44 0.26 0.24 0.02 0.00 0.00 177.57 178.34 3ii0 h MET 213 N 0.93 0.81 -0.10 1.57 2.86 -0.78 -1.84 114.93 118.39 3ii0 h MET 213 Ca 0.15 -0.13 -0.00 0.00 -2.06 0.00 0.00 59.70 57.66 3ii0 h MET 213 Cb 0.64 -0.14 -0.00 0.00 0.06 0.00 0.00 31.60 32.15 3ii0 h MET 213 CO 0.04 0.68 0.04 -0.22 1.06 0.00 0.00 176.91 178.51 3ii0 h LYS 214 N 0.76 0.14 -0.99 1.72 3.64 -0.49 0.54 116.57 121.90 3ii0 h LYS 214 Ca 0.19 -0.02 0.01 0.00 -1.27 0.00 0.00 60.65 59.55 3ii0 h LYS 214 Cb 0.14 -0.02 -0.05 0.00 -0.41 0.00 0.00 32.23 31.89 3ii0 h LYS 214 CO -0.02 0.24 0.64 0.45 -2.27 0.00 0.00 179.45 178.49 3ii0 h HIS 215 N 0.02 1.26 -0.57 1.91 3.86 -1.15 -2.87 115.15 117.60 3ii0 h HIS 215 Ca 0.03 0.02 0.00 0.00 -1.16 0.00 0.00 60.37 59.26 3ii0 h HIS 215 Cb 0.15 -0.42 0.00 0.00 1.06 0.00 0.00 27.41 28.19 3ii0 h HIS 215 CO -0.02 0.80 0.00 0.54 0.86 0.00 0.00 177.93 180.11 3ii0 n ARG 216 N -4.37 2.46 -3.64 2.45 1.74 -0.70 -4.96 116.66 109.64 3ii0 n ARG 216 Ca 0.12 -2.26 -0.22 0.00 -0.77 0.00 0.00 57.85 54.72 3ii0 n ARG 216 Cb 0.02 -1.50 0.05 0.00 -1.02 0.00 0.00 32.46 30.02 3ii0 n ARG 216 CO 0.00 0.00 0.00 1.19 -1.52 0.00 0.00 177.63 177.30 3ii0 n PHE 217 N 1.36 -2.16 -3.27 -1.55 3.72 0.08 -3.32 117.46 112.32 3ii0 n PHE 217 Ca 0.21 0.90 -0.35 0.00 -0.05 0.00 0.00 57.45 58.16 3ii0 n PHE 217 Cb 0.55 -4.61 -0.06 0.00 -0.94 0.00 0.00 39.48 34.42 3ii0 n PHE 217 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 176.76 176.20 3ii0 s LEU 218 N -6.74 4.28 -0.30 4.37 1.43 -0.58 -0.97 118.68 120.16 3ii0 s LEU 218 Ca 0.16 1.16 -0.17 0.00 -1.03 0.00 0.00 54.13 54.25 3ii0 s LEU 218 Cb -0.08 -3.52 -0.02 0.00 0.03 0.00 0.00 46.19 42.60 3ii0 s LEU 218 CO 0.78 0.02 0.47 0.12 0.23 0.00 0.00 176.35 177.97 3ii0 s PHE 219 N -1.60 3.22 -0.14 0.29 5.36 0.24 -4.80 117.98 120.55 3ii0 s PHE 219 Ca 0.43 0.37 -0.29 0.00 -0.96 0.00 0.00 56.93 56.47 3ii0 s PHE 219 Cb -0.14 -2.76 -0.01 0.00 -0.34 0.00 0.00 43.02 39.77 3ii0 s PHE 219 CO 0.20 -0.37 1.05 -2.14 -1.46 0.00 0.00 175.22 172.49 3ii0 s PRO 220 N 2.26 4.36 -0.43 10.12 0.02 -1.26 -0.36 135.00 149.71 3ii0 s PRO 220 Ca 0.18 1.42 0.02 0.00 0.02 0.00 0.00 61.00 62.64 3ii0 s PRO 220 Cb -0.16 -3.58 0.12 0.00 0.02 0.00 0.00 34.50 30.90 3ii0 s PRO 220 CO 0.11 -0.43 0.17 0.12 -0.33 0.00 0.00 177.00 176.64 3ii0 s PHE 221 N 2.41 3.55 0.34 6.54 5.99 0.12 -2.45 117.98 134.49 3ii0 s PHE 221 Ca 0.48 -2.91 -0.27 0.00 0.00 0.00 0.00 56.93 54.24 3ii0 s PHE 221 Cb -0.18 -2.99 -0.09 0.00 0.00 0.00 0.00 43.02 39.76 3ii0 s PHE 221 CO 0.15 -0.89 1.08 -0.06 -0.00 0.00 0.00 175.22 175.49 3ii0 s PHE 222 N 0.55 3.42 -0.21 10.12 0.08 0.18 -1.57 117.98 130.55 3ii0 s PHE 222 Ca 0.13 1.67 0.02 0.00 0.12 0.00 0.00 56.93 58.87 3ii0 s PHE 222 Cb -0.22 -3.21 0.04 0.00 -0.57 0.00 0.00 43.02 39.06 3ii0 s PHE 222 CO -0.05 -0.60 -0.16 0.34 -0.10 0.00 0.00 175.22 174.66 3ii0 s ASP 223 N -1.21 3.69 -0.66 1.36 -1.08 0.80 -0.67 116.67 118.89 3ii0 s ASP 223 Ca 0.51 -0.98 0.05 0.00 -0.52 0.00 0.00 52.55 51.61 3ii0 s ASP 223 Cb -0.27 -1.49 0.16 0.00 -1.46 0.00 0.00 42.92 39.86 3ii0 s ASP 223 CO 0.35 -0.09 0.45 -0.55 0.52 0.00 0.00 175.17 175.84 3ii0 s SER 224 N 1.22 4.59 0.00 -0.34 0.15 0.31 -1.33 113.70 118.30 3ii0 s SER 224 Ca -0.01 -3.68 0.20 0.00 0.70 0.00 0.00 55.95 53.16 3ii0 s SER 224 Cb -0.16 -1.58 -0.19 0.00 -1.71 0.00 0.00 66.02 62.38 3ii0 s SER 224 CO -0.09 -0.11 0.88 0.00 1.20 0.00 0.00 173.24 175.11 3ii0 n ALA 225 N 2.20 4.47 -2.07 5.45 0.00 -1.26 -1.58 120.51 127.71 3ii0 n ALA 225 Ca 0.18 -0.58 0.04 0.00 0.00 0.00 0.00 53.44 53.08 3ii0 n ALA 225 Cb 0.35 -0.73 0.05 0.00 0.00 0.00 0.00 19.45 19.13 3ii0 n ALA 225 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 3ii0 n TYR 226 N -1.28 0.00 -1.68 0.00 4.01 -1.26 -4.49 117.16 112.45 3ii0 n TYR 226 Ca 0.04 -0.55 -0.49 0.00 -0.16 0.00 0.00 57.90 56.74 3ii0 n TYR 226 Cb 0.33 -0.14 -0.05 0.00 -0.31 0.00 0.00 39.34 39.17 3ii0 n TYR 226 CO 0.00 0.00 0.00 0.94 -0.46 0.00 0.00 176.86 177.34 3ii0 n GLN 227 N -0.09 2.05 0.00 -0.72 7.27 -1.26 -0.57 117.38 124.06 3ii0 n GLN 227 Ca 0.07 0.75 0.00 0.00 0.07 0.00 0.00 57.00 57.89 3ii0 n GLN 227 Cb 0.90 -2.57 0.00 0.00 2.41 0.00 0.00 30.24 30.98 3ii0 n GLN 227 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 3ii0 n GLY 228 N 4.26 1.51 0.11 1.69 0.00 -1.26 -4.77 105.19 106.74 3ii0 n GLY 228 Ca 0.22 -0.22 0.12 0.00 0.00 0.00 0.00 46.02 46.15 3ii0 n GLY 228 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 3ii0 h PHE 229 N 0.00 0.00 0.06 1.61 0.04 -1.20 -1.15 116.94 116.29 3ii0 h PHE 229 Ca 0.00 0.00 -0.16 0.00 2.80 0.00 0.00 57.97 60.61 3ii0 h PHE 229 Cb 0.00 0.00 0.02 0.00 2.20 0.00 0.00 35.95 38.17 3ii0 h PHE 229 CO 0.00 0.00 -0.68 0.00 -0.60 0.00 0.00 178.31 177.03 3ii0 h ALA 230 N 2.42 0.01 -0.00 2.45 0.00 -1.92 -3.11 119.26 119.10 3ii0 h ALA 230 Ca 0.00 -0.62 0.00 0.00 0.00 0.00 0.00 54.91 54.29 3ii0 h ALA 230 Cb 0.79 0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.64 3ii0 h ALA 230 CO 0.00 0.35 -0.07 -1.13 0.00 0.00 0.00 179.25 178.41 3ii0 n SER 231 N -4.19 0.35 0.00 0.00 3.41 -1.26 -4.46 113.62 107.47 3ii0 n SER 231 Ca -0.12 -0.67 0.00 0.00 -0.26 0.00 0.00 58.87 57.82 3ii0 n SER 231 Cb 0.73 0.76 0.00 0.00 -0.26 0.00 0.00 64.21 65.44 3ii0 n SER 231 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3ii0 n GLY 232 N 0.82 1.85 2.96 5.00 0.00 -0.44 -5.02 105.19 110.36 3ii0 n GLY 232 Ca 0.01 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.73 3ii0 n GLY 232 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 3ii0 s ASN 233 N -3.36 2.86 0.20 1.61 3.84 -1.24 -4.40 114.94 114.44 3ii0 s ASN 233 Ca 0.00 -0.63 -0.11 0.00 0.21 0.00 0.00 52.86 52.34 3ii0 s ASN 233 Cb 0.00 -1.07 0.19 0.00 -0.55 0.00 0.00 41.25 39.82 3ii0 s ASN 233 CO 0.00 -0.13 1.81 -0.07 -2.79 0.00 0.00 177.10 175.92 3ii0 h LEU 234 N 8.07 0.52 -0.12 3.21 3.38 -1.91 -2.34 115.31 126.11 3ii0 h LEU 234 Ca -0.30 0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.70 3ii0 h LEU 234 Cb 1.12 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 41.78 3ii0 h LEU 234 CO 0.46 0.35 0.07 -0.08 0.09 0.00 0.00 178.44 179.32 3ii0 h GLU 235 N 0.65 0.14 -0.76 1.13 4.81 -1.96 -2.86 114.58 115.72 3ii0 h GLU 235 Ca 0.27 -0.01 -0.04 0.00 -0.13 0.00 0.00 59.36 59.45 3ii0 h GLU 235 Cb 0.14 -0.03 -0.03 0.00 0.63 0.00 0.00 28.75 29.45 3ii0 h GLU 235 CO -0.16 0.09 0.31 -0.09 -0.73 0.00 0.00 179.01 178.44 3ii0 h ARG 236 N 0.14 1.13 0.00 1.92 2.43 -1.95 -2.44 114.38 115.61 3ii0 h ARG 236 Ca 0.04 -0.19 0.00 0.00 -0.81 0.00 0.00 59.98 59.02 3ii0 h ARG 236 Cb -0.01 -0.19 0.00 0.00 -0.42 0.00 0.00 29.97 29.36 3ii0 h ARG 236 CO -0.02 0.91 0.00 -0.44 -1.51 0.00 0.00 179.97 178.91 3ii0 h ASP 237 N 1.11 0.00 -0.21 -3.80 3.32 -1.21 -2.26 116.42 113.37 3ii0 h ASP 237 Ca 0.26 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.31 3ii0 h ASP 237 Cb 0.19 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.74 3ii0 h ASP 237 CO -0.02 0.00 0.00 0.00 -1.72 0.00 0.00 179.24 177.50 3ii0 n ALA 238 N -2.04 2.49 -0.29 3.45 0.00 -0.93 -4.55 120.51 118.65 3ii0 n ALA 238 Ca 0.00 -0.67 0.09 0.00 0.00 0.00 0.00 53.44 52.87 3ii0 n ALA 238 Cb 0.26 -1.01 0.25 0.00 0.00 0.00 0.00 19.45 18.95 3ii0 n ALA 238 CO 0.00 0.00 0.00 2.35 0.00 0.00 0.00 177.50 179.85 3ii0 h TRP 239 N 3.09 0.57 -0.38 0.00 7.01 -1.33 -1.65 115.95 123.25 3ii0 h TRP 239 Ca 0.00 0.04 -0.09 0.00 2.11 0.00 0.00 58.89 60.95 3ii0 h TRP 239 Cb 0.67 -0.12 -0.01 0.00 -2.10 0.00 0.00 29.16 27.60 3ii0 h TRP 239 CO 0.13 -0.00 -0.11 0.00 -2.79 0.00 0.00 178.44 175.67 3ii0 h ALA 240 N 1.64 0.53 -0.26 2.65 0.00 -1.84 0.17 119.26 122.16 3ii0 h ALA 240 Ca 0.49 -0.32 0.04 0.00 0.00 0.00 0.00 54.91 55.12 3ii0 h ALA 240 Cb 0.85 -0.13 -0.04 0.00 0.00 0.00 0.00 17.79 18.47 3ii0 h ALA 240 CO -0.48 0.41 0.02 0.82 0.00 0.00 0.00 179.25 180.01 3ii0 h ILE 241 N 0.55 0.84 -0.07 0.00 2.04 -1.71 -2.09 117.51 117.07 3ii0 h ILE 241 Ca 0.09 -0.03 -0.08 0.00 1.00 0.00 0.00 64.86 65.84 3ii0 h ILE 241 Cb 0.63 0.73 -0.01 0.00 -0.74 0.00 0.00 36.82 37.43 3ii0 h ILE 241 CO 0.04 0.02 -0.34 0.03 0.00 0.00 0.00 178.15 177.90 3ii0 h ARG 242 N 0.10 0.14 -0.55 2.37 3.08 -1.00 -1.66 114.38 116.87 3ii0 h ARG 242 Ca 0.12 -0.06 -0.09 0.00 0.07 0.00 0.00 59.98 60.02 3ii0 h ARG 242 Cb 0.15 -0.01 -0.02 0.00 0.08 0.00 0.00 29.97 30.17 3ii0 h ARG 242 CO -0.19 0.47 -0.03 -0.92 -1.07 0.00 0.00 179.97 178.24 3ii0 h TYR 243 N 0.12 1.05 -0.24 3.04 3.20 -0.19 -1.97 116.97 121.99 3ii0 h TYR 243 Ca 0.01 -0.18 -0.12 0.00 3.14 0.00 0.00 58.73 61.58 3ii0 h TYR 243 Cb 0.67 -0.27 -0.01 0.00 1.54 0.00 0.00 36.73 38.66 3ii0 h TYR 243 CO 0.01 0.95 -0.37 0.74 -1.64 0.00 0.00 178.16 177.85 3ii0 h PHE 244 N 0.88 0.63 -0.03 -3.82 -1.00 -0.72 -0.64 116.94 112.24 3ii0 h PHE 244 Ca 0.16 -0.17 0.02 0.00 2.81 0.00 0.00 57.97 60.79 3ii0 h PHE 244 Cb 0.55 -0.14 -0.03 0.00 3.61 0.00 0.00 35.95 39.95 3ii0 h PHE 244 CO 0.03 0.83 -0.10 0.28 -1.61 0.00 0.00 178.31 177.74 3ii0 h VAL 245 N 0.45 0.73 0.00 -0.55 2.07 -1.20 -2.77 116.25 114.98 3ii0 h VAL 245 Ca 0.05 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.55 3ii0 h VAL 245 Cb 0.85 0.73 -0.00 0.00 -1.52 0.00 0.00 31.29 31.34 3ii0 h VAL 245 CO 0.07 0.00 -0.08 0.77 0.02 0.00 0.00 177.57 178.35 3ii0 h SER 246 N -0.16 0.00 0.18 0.57 4.64 -0.60 -2.03 113.55 116.15 3ii0 h SER 246 Ca 0.05 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.37 3ii0 h SER 246 Cb 0.23 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.32 3ii0 h SER 246 CO -0.13 0.08 -0.07 -0.62 -0.87 0.00 0.00 176.83 175.22 3ii0 n GLU 247 N -3.31 1.02 -0.19 4.77 -0.58 -0.32 -4.93 120.64 117.10 3ii0 n GLU 247 Ca -0.01 -0.39 0.00 0.00 -0.42 0.00 0.00 57.16 56.34 3ii0 n GLU 247 Cb 0.28 -1.49 0.00 0.00 -0.57 0.00 0.00 31.44 29.66 3ii0 n GLU 247 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3ii0 n GLY 248 N 1.20 0.91 3.76 0.62 0.00 -0.76 -5.07 105.19 105.85 3ii0 n GLY 248 Ca 0.17 -0.01 -0.40 0.00 0.00 0.00 0.00 46.02 45.79 3ii0 n GLY 248 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3ii0 s PHE 249 N -2.00 3.41 0.28 1.61 0.40 -1.07 -4.98 117.98 115.63 3ii0 s PHE 249 Ca 0.00 1.64 -0.16 0.00 -0.60 0.00 0.00 56.93 57.81 3ii0 s PHE 249 Cb 0.00 -3.33 -0.09 0.00 0.51 0.00 0.00 43.02 40.11 3ii0 s PHE 249 CO 0.00 -0.82 0.71 -1.21 0.70 0.00 0.00 175.22 174.60 3ii0 s GLU 250 N -1.71 4.06 -0.03 0.44 2.02 -1.26 -4.73 118.70 117.48 3ii0 s GLU 250 Ca 0.48 0.68 -0.31 0.00 0.02 0.00 0.00 54.97 55.85 3ii0 s GLU 250 Cb -0.32 -2.60 0.11 0.00 0.10 0.00 0.00 34.13 31.42 3ii0 s GLU 250 CO 0.41 0.25 1.16 -0.59 0.02 0.00 0.00 175.26 176.51 3ii0 s PHE 251 N -1.81 -0.12 0.11 1.61 -0.12 -0.76 -4.52 117.98 112.38 3ii0 s PHE 251 Ca 0.50 -0.01 0.05 0.00 -0.05 0.00 0.00 56.93 57.42 3ii0 s PHE 251 Cb -0.12 0.55 -0.04 0.00 -0.63 0.00 0.00 43.02 42.78 3ii0 s PHE 251 CO 0.19 -0.39 -0.01 -0.06 -0.05 0.00 0.00 175.22 174.90 3ii0 s PHE 252 N -2.66 2.94 -0.22 3.49 0.08 -1.02 -1.20 117.98 119.39 3ii0 s PHE 252 Ca 0.11 -0.06 -0.04 0.00 0.12 0.00 0.00 56.93 57.07 3ii0 s PHE 252 Cb 0.01 -1.50 0.09 0.00 -0.57 0.00 0.00 43.02 41.06 3ii0 s PHE 252 CO -0.04 0.48 0.19 0.00 -0.10 0.00 0.00 175.22 175.75 3ii0 s ALA 254 N 2.26 3.37 -0.11 0.00 0.00 0.15 -1.21 121.76 126.21 3ii0 s ALA 254 Ca 0.06 -0.55 -0.05 0.00 0.00 0.00 0.00 51.96 51.42 3ii0 s ALA 254 Cb -0.16 -3.54 -0.04 0.00 0.00 0.00 0.00 23.12 19.38 3ii0 s ALA 254 CO -0.18 -1.70 0.09 -0.65 0.00 0.00 0.00 175.76 173.31 3ii0 s GLN 255 N 3.50 3.28 0.01 0.00 -0.21 0.16 -0.53 119.66 125.88 3ii0 s GLN 255 Ca 0.37 -0.24 0.09 0.00 0.02 0.00 0.00 55.36 55.60 3ii0 s GLN 255 Cb -0.12 -3.04 -0.02 0.00 1.00 0.00 0.00 33.01 30.83 3ii0 s GLN 255 CO 0.20 0.74 -0.26 0.45 -2.12 0.00 0.00 175.29 174.31 3ii0 s SER 256 N -0.95 3.11 -0.07 5.90 0.15 -0.62 -1.32 113.70 119.90 3ii0 s SER 256 Ca 0.14 -0.53 0.11 0.00 0.70 0.00 0.00 55.95 56.37 3ii0 s SER 256 Cb -0.12 -0.31 0.27 0.00 -1.71 0.00 0.00 66.02 64.15 3ii0 s SER 256 CO 0.03 0.29 1.20 0.49 1.20 0.00 0.00 173.24 176.45 3ii0 n PHE 257 N 2.09 0.35 -0.24 3.44 3.72 -0.74 -4.68 117.46 121.40 3ii0 n PHE 257 Ca -0.16 -0.69 -0.01 0.00 -0.05 0.00 0.00 57.45 56.53 3ii0 n PHE 257 Cb 0.51 -0.12 0.19 0.00 -0.94 0.00 0.00 39.48 39.12 3ii0 n PHE 257 CO 0.00 0.00 0.00 0.77 -0.05 0.00 0.00 176.76 177.48 3ii0 h SER 258 N 1.00 0.93 0.00 4.37 0.02 -1.82 -2.81 113.55 115.23 3ii0 h SER 258 Ca 0.00 -0.07 -0.09 0.00 -0.84 0.00 0.00 61.79 60.80 3ii0 h SER 258 Cb 0.89 -0.24 -0.01 0.00 0.14 0.00 0.00 62.40 63.18 3ii0 h SER 258 CO 0.05 0.74 -1.02 0.29 -1.14 0.00 0.00 176.83 175.75 3ii0 n LYS 259 N -4.37 0.51 0.30 3.45 4.01 -1.26 -1.74 118.16 119.05 3ii0 n LYS 259 Ca 0.08 0.39 0.19 0.00 -0.51 0.00 0.00 58.31 58.46 3ii0 n LYS 259 Cb 0.09 -1.58 0.85 0.00 -0.51 0.00 0.00 35.03 33.87 3ii0 n LYS 259 CO 0.00 0.00 0.00 -2.95 -1.11 0.00 0.00 177.40 173.34 3ii0 h ASN 260 N -1.00 0.00 -0.01 4.39 7.08 -1.83 -1.26 115.58 122.95 3ii0 h ASN 260 Ca -0.13 0.00 0.00 0.00 -3.08 0.00 0.00 56.30 53.09 3ii0 h ASN 260 Cb 0.92 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 37.16 3ii0 h ASN 260 CO -0.08 0.01 -0.18 0.49 -2.08 0.00 0.00 177.43 175.58 3ii0 n PHE 261 N -3.10 0.00 -2.04 4.14 3.01 -1.07 -4.76 117.46 113.64 3ii0 n PHE 261 Ca -0.01 0.00 -0.16 0.00 1.01 0.00 0.00 57.45 58.29 3ii0 n PHE 261 Cb 0.23 0.00 -0.03 0.00 -0.01 0.00 0.00 39.48 39.67 3ii0 n PHE 261 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3ii0 n GLY 262 N 1.00 0.34 2.43 1.37 0.00 -0.48 -4.64 105.19 105.21 3ii0 n GLY 262 Ca 0.07 -0.21 -0.35 0.00 0.00 0.00 0.00 46.02 45.53 3ii0 n GLY 262 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3ii0 n LEU 263 N -2.20 7.47 -0.29 0.99 4.77 -0.71 -4.80 117.00 122.22 3ii0 n LEU 263 Ca -0.19 -4.44 -0.06 0.00 -0.03 0.00 0.00 56.01 51.29 3ii0 n LEU 263 Cb 0.61 -0.95 -0.01 0.00 -2.33 0.00 0.00 43.42 40.74 3ii0 n LEU 263 CO 0.24 1.58 0.57 1.88 -1.33 0.00 0.00 177.39 180.32 3ii0 h TYR 264 N 2.22 -1.25 -0.23 -1.77 -1.99 -1.81 -1.76 116.97 110.38 3ii0 h TYR 264 Ca 0.58 0.09 0.00 0.00 2.00 0.00 0.00 58.73 61.41 3ii0 h TYR 264 Cb 0.70 0.66 0.00 0.00 2.00 0.00 0.00 36.73 40.08 3ii0 h TYR 264 CO 1.34 -0.41 0.00 0.27 -0.00 0.00 0.00 178.16 179.37 3ii0 n ASN 265 N -5.41 1.39 -0.53 3.88 0.23 -1.26 -3.27 115.26 110.28 3ii0 n ASN 265 Ca 0.05 -1.89 0.10 0.00 -0.53 0.00 0.00 54.58 52.30 3ii0 n ASN 265 Cb 0.35 -0.15 0.02 0.00 -2.08 0.00 0.00 39.78 37.92 3ii0 n ASN 265 CO 0.00 0.00 0.00 -0.62 -0.93 0.00 0.00 177.26 175.71 3ii0 n GLU 266 N 0.22 1.55 -3.31 -3.83 -0.58 -0.66 -5.04 120.64 108.99 3ii0 n GLU 266 Ca 0.11 -1.11 -0.13 0.00 -0.42 0.00 0.00 57.16 55.61 3ii0 n GLU 266 Cb 0.24 -1.38 0.03 0.00 -0.57 0.00 0.00 31.44 29.76 3ii0 n GLU 266 CO 0.00 0.00 0.00 0.54 -0.48 0.00 0.00 177.13 177.19 3ii0 n ARG 267 N 0.24 -1.58 -3.86 3.49 5.12 -1.20 -4.49 116.66 114.37 3ii0 n ARG 267 Ca 0.09 1.04 -0.36 0.00 -1.93 0.00 0.00 57.85 56.70 3ii0 n ARG 267 Cb 0.43 -5.09 -0.13 0.00 -1.16 0.00 0.00 32.46 26.50 3ii0 n ARG 267 CO 0.00 0.00 0.00 0.08 -1.93 0.00 0.00 177.63 175.78 3ii0 s VAL 268 N -3.20 3.25 0.26 1.55 1.01 -1.26 -2.64 120.40 119.37 3ii0 s VAL 268 Ca 0.22 -1.26 -0.02 0.00 0.00 0.00 0.00 61.98 60.92 3ii0 s VAL 268 Cb -0.05 -2.84 -0.02 0.00 0.00 0.00 0.00 36.38 33.47 3ii0 s VAL 268 CO 0.78 -0.10 0.29 -0.83 0.00 0.00 0.00 175.10 175.24 3ii0 s GLY 269 N 1.31 1.46 -0.14 4.51 0.00 -0.69 -1.80 107.32 111.97 3ii0 s GLY 269 Ca -0.04 -1.59 -0.08 0.00 0.00 0.00 0.00 44.72 43.01 3ii0 s GLY 269 CO 0.00 -1.20 0.35 0.21 0.00 0.00 0.00 173.10 172.46 3ii0 s ASN 270 N -3.19 -0.42 -0.42 1.64 3.04 -0.44 -1.06 114.94 114.09 3ii0 s ASN 270 Ca 0.35 0.75 -0.18 0.00 0.04 0.00 0.00 52.86 53.82 3ii0 s ASN 270 Cb 0.03 0.65 0.02 0.00 -1.54 0.00 0.00 41.25 40.42 3ii0 s ASN 270 CO 0.16 -0.17 0.47 -0.22 -3.04 0.00 0.00 177.10 174.30 3ii0 s LEU 271 N 1.17 4.80 0.08 3.21 2.96 0.42 0.39 118.68 131.71 3ii0 s LEU 271 Ca -0.08 -0.62 -0.24 0.00 -0.22 0.00 0.00 54.13 52.97 3ii0 s LEU 271 Cb -0.08 -2.44 -0.06 0.00 0.50 0.00 0.00 46.19 44.10 3ii0 s LEU 271 CO -0.09 -0.61 0.74 -0.89 -1.32 0.00 0.00 176.35 174.17 3ii0 s THR 272 N 2.25 4.63 -0.14 3.68 2.01 -0.35 -0.98 115.64 126.73 3ii0 s THR 272 Ca 0.14 1.59 0.02 0.00 0.31 0.00 0.00 61.69 63.74 3ii0 s THR 272 Cb -0.17 -4.09 0.01 0.00 0.01 0.00 0.00 72.50 68.27 3ii0 s THR 272 CO 0.14 0.44 -0.19 -0.69 -0.69 0.00 0.00 174.62 173.64 3ii0 s VAL 273 N -0.51 1.83 -0.23 3.82 1.01 0.25 -0.94 120.40 125.63 3ii0 s VAL 273 Ca 0.36 -0.83 -0.05 0.00 0.00 0.00 0.00 61.98 61.47 3ii0 s VAL 273 Cb -0.21 -1.65 -0.02 0.00 0.00 0.00 0.00 36.38 34.50 3ii0 s VAL 273 CO 0.23 0.50 -0.00 -0.69 0.00 0.00 0.00 175.10 175.14 3ii0 s VAL 274 N 1.05 3.72 0.44 2.92 1.01 -0.34 -0.95 120.40 128.26 3ii0 s VAL 274 Ca -0.03 -0.37 0.06 0.00 0.00 0.00 0.00 61.98 61.64 3ii0 s VAL 274 Cb -0.14 -2.71 -0.05 0.00 0.00 0.00 0.00 36.38 33.47 3ii0 s VAL 274 CO -0.05 0.39 0.09 -0.83 0.00 0.00 0.00 175.10 174.71 3ii0 s GLY 275 N 1.51 2.54 0.27 4.51 0.00 -0.21 -1.82 107.32 114.12 3ii0 s GLY 275 Ca 0.06 -1.81 0.07 0.00 0.00 0.00 0.00 44.72 43.04 3ii0 s GLY 275 CO -0.01 -2.04 1.64 0.50 0.00 0.00 0.00 173.10 173.19 3ii0 h LYS 276 N 1.50 0.18 -3.70 2.90 1.79 -1.91 -3.46 116.57 113.87 3ii0 h LYS 276 Ca -0.43 -0.11 -0.07 0.00 -2.18 0.00 0.00 60.65 57.86 3ii0 h LYS 276 Cb 1.26 0.01 -0.11 0.00 -1.58 0.00 0.00 32.23 31.81 3ii0 h LYS 276 CO 0.74 0.66 -0.19 -1.83 -1.08 0.00 0.00 179.45 177.75 3ii0 s GLU 277 N -3.92 1.32 0.47 3.15 1.03 -1.26 -5.00 118.70 114.49 3ii0 s GLU 277 Ca -0.04 -1.14 0.13 0.00 0.03 0.00 0.00 54.97 53.96 3ii0 s GLU 277 Cb 0.13 0.43 1.10 0.00 -0.80 0.00 0.00 34.13 34.99 3ii0 s GLU 277 CO 0.78 -0.52 2.09 -1.35 -1.33 0.00 0.00 175.26 174.92 3ii0 h PRO 278 N 2.39 0.14 -0.49 -4.83 0.11 -1.80 -2.86 132.00 124.66 3ii0 h PRO 278 Ca -0.30 -0.01 -0.08 0.00 0.11 0.00 0.00 66.00 65.72 3ii0 h PRO 278 Cb 1.24 -0.03 -0.02 0.00 0.11 0.00 0.00 31.00 32.31 3ii0 h PRO 278 CO 0.42 0.14 -0.00 0.93 -0.21 0.00 0.00 178.00 179.28 3ii0 h GLU 279 N 0.14 0.87 -0.68 1.05 3.07 -1.97 -1.86 114.58 115.20 3ii0 h GLU 279 Ca 0.04 -0.28 0.13 0.00 -0.50 0.00 0.00 59.36 58.75 3ii0 h GLU 279 Cb 0.07 -0.08 -0.13 0.00 -0.84 0.00 0.00 28.75 27.77 3ii0 h GLU 279 CO -0.00 0.91 -0.26 0.77 -1.40 0.00 0.00 179.01 179.03 3ii0 h SER 280 N 0.72 -0.92 -0.26 1.42 0.02 -1.92 -2.10 113.55 110.52 3ii0 h SER 280 Ca 0.14 0.23 -0.05 0.00 -0.84 0.00 0.00 61.79 61.26 3ii0 h SER 280 Cb 0.52 0.52 -0.01 0.00 0.14 0.00 0.00 62.40 63.57 3ii0 h SER 280 CO 0.03 -0.27 -0.04 0.40 -1.14 0.00 0.00 176.83 175.81 3ii0 h ILE 281 N -0.07 1.27 -0.96 3.27 1.08 -1.48 -1.86 117.51 118.77 3ii0 h ILE 281 Ca 0.30 -1.02 0.07 0.00 -0.39 0.00 0.00 64.86 63.82 3ii0 h ILE 281 Cb 0.54 1.42 -0.07 0.00 -3.07 0.00 0.00 36.82 35.65 3ii0 h ILE 281 CO -0.73 0.32 0.61 -0.07 -0.69 0.00 0.00 178.15 177.59 3ii0 h LEU 282 N 0.24 0.96 0.17 1.44 -0.00 -1.09 0.33 115.31 117.37 3ii0 h LEU 282 Ca 0.07 0.02 -0.01 0.00 -0.00 0.00 0.00 57.88 57.96 3ii0 h LEU 282 Cb 0.49 -0.19 0.00 0.00 -0.00 0.00 0.00 40.66 40.97 3ii0 h LEU 282 CO 0.02 0.60 -0.08 -0.61 -0.00 0.00 0.00 178.44 178.37 3ii0 h GLN 283 N 1.09 -0.22 -0.48 1.13 4.15 -1.24 -1.67 115.11 117.88 3ii0 h GLN 283 Ca 0.42 0.02 0.10 0.00 0.77 0.00 0.00 58.65 59.95 3ii0 h GLN 283 Cb 0.20 0.05 -0.09 0.00 0.21 0.00 0.00 27.48 27.85 3ii0 h GLN 283 CO -0.18 0.15 -0.10 0.28 -1.93 0.00 0.00 178.83 177.04 3ii0 h VAL 284 N -0.64 0.54 -0.78 2.39 2.07 -1.17 -1.78 116.25 116.87 3ii0 h VAL 284 Ca -0.02 -0.01 -0.04 0.00 0.82 0.00 0.00 66.70 67.45 3ii0 h VAL 284 Cb 0.47 0.52 -0.04 0.00 -1.52 0.00 0.00 31.29 30.73 3ii0 h VAL 284 CO 0.04 0.00 0.34 -0.07 0.02 0.00 0.00 177.57 177.90 3ii0 h LEU 285 N 0.01 1.05 -1.19 2.57 3.38 -0.90 0.32 115.31 120.55 3ii0 h LEU 285 Ca 0.23 -0.14 -0.07 0.00 0.09 0.00 0.00 57.88 57.98 3ii0 h LEU 285 Cb 0.35 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.82 3ii0 h LEU 285 CO -0.48 0.91 -0.22 0.77 0.09 0.00 0.00 178.44 179.52 3ii0 h SER 286 N 1.12 0.28 0.15 -0.43 4.64 -0.70 -1.87 113.55 116.75 3ii0 h SER 286 Ca 0.26 -0.08 -0.24 0.00 -0.47 0.00 0.00 61.79 61.27 3ii0 h SER 286 Cb 0.17 -0.07 0.01 0.00 -0.31 0.00 0.00 62.40 62.20 3ii0 h SER 286 CO -0.03 0.51 -0.95 1.56 -0.87 0.00 0.00 176.83 177.06 3ii0 h GLN 287 N 0.26 0.56 -0.57 4.77 1.08 -0.77 -3.06 115.11 117.39 3ii0 h GLN 287 Ca 0.04 -0.57 0.08 0.00 -1.45 0.00 0.00 58.65 56.75 3ii0 h GLN 287 Cb 0.54 0.16 -0.03 0.00 -0.05 0.00 0.00 27.48 28.09 3ii0 h GLN 287 CO 0.04 1.20 0.38 0.52 -0.95 0.00 0.00 178.83 180.01 3ii0 h MET 288 N 0.33 0.42 -0.68 1.46 2.86 -0.59 -2.53 114.93 116.20 3ii0 h MET 288 Ca -0.09 -0.03 0.06 0.00 -2.06 0.00 0.00 59.70 57.58 3ii0 h MET 288 Cb 1.58 -0.09 -0.06 0.00 0.06 0.00 0.00 31.60 33.09 3ii0 h MET 288 CO 0.18 0.28 0.38 0.93 1.06 0.00 0.00 176.91 179.73 3ii0 h GLU 289 N 0.43 0.67 -0.60 1.72 5.08 -1.24 -0.71 114.58 119.93 3ii0 h GLU 289 Ca 0.26 -0.04 -0.05 0.00 -1.00 0.00 0.00 59.36 58.53 3ii0 h GLU 289 Cb 0.45 -0.15 -0.03 0.00 0.50 0.00 0.00 28.75 29.52 3ii0 h GLU 289 CO -0.07 0.44 0.19 0.87 -1.00 0.00 0.00 179.01 179.44 3ii0 h LYS 290 N 0.69 0.93 -0.54 2.33 6.56 -1.53 -1.25 116.57 123.77 3ii0 h LYS 290 Ca 0.30 -0.20 -0.05 0.00 -1.06 0.00 0.00 60.65 59.64 3ii0 h LYS 290 Cb 0.19 -0.13 -0.02 0.00 -0.57 0.00 0.00 32.23 31.69 3ii0 h LYS 290 CO -0.18 0.83 0.14 0.82 -2.06 0.00 0.00 179.45 178.99 3ii0 h ILE 291 N 0.85 1.24 -0.33 1.86 2.04 -1.38 -2.82 117.51 118.96 3ii0 h ILE 291 Ca 0.19 -0.85 -0.04 0.00 1.00 0.00 0.00 64.86 65.17 3ii0 h ILE 291 Cb 0.28 0.77 -0.01 0.00 -0.74 0.00 0.00 36.82 37.12 3ii0 h ILE 291 CO -0.01 0.31 0.07 0.58 0.00 0.00 0.00 178.15 179.10 3ii0 h VAL 292 N 0.75 1.23 -0.99 1.67 2.07 -1.02 -3.00 116.25 116.96 3ii0 h VAL 292 Ca 0.17 -0.79 0.16 0.00 0.82 0.00 0.00 66.70 67.06 3ii0 h VAL 292 Cb 0.32 1.11 -0.09 0.00 -1.52 0.00 0.00 31.29 31.11 3ii0 h VAL 292 CO 0.00 0.26 0.62 -0.09 0.02 0.00 0.00 177.57 178.38 3ii0 h ARG 293 N 0.38 0.81 -0.23 1.57 9.65 -1.05 -0.10 114.38 125.40 3ii0 h ARG 293 Ca 0.10 -0.05 0.00 0.00 -1.10 0.00 0.00 59.98 58.93 3ii0 h ARG 293 Cb 0.33 -0.18 0.00 0.00 -1.39 0.00 0.00 29.97 28.72 3ii0 h ARG 293 CO 0.00 0.53 0.00 0.44 2.80 0.00 0.00 179.97 183.75 3ii0 n ILE 294 N -4.68 0.30 -0.00 1.20 -5.35 -1.08 -3.34 119.36 106.41 3ii0 n ILE 294 Ca 0.21 -0.47 -0.02 0.00 -0.27 0.00 0.00 62.75 62.20 3ii0 n ILE 294 Cb 0.49 0.56 -0.01 0.00 -1.74 0.00 0.00 39.64 38.94 3ii0 n ILE 294 CO 0.00 0.00 0.00 0.41 -1.76 0.00 0.00 176.55 175.20 3ii0 n THR 295 N 0.68 0.88 -0.53 7.28 -1.04 -0.64 -4.93 114.28 115.98 3ii0 n THR 295 Ca 0.17 0.27 0.00 0.00 -2.04 0.00 0.00 64.05 62.44 3ii0 n THR 295 Cb 0.41 -1.66 0.00 0.00 -1.82 0.00 0.00 70.33 67.26 3ii0 n THR 295 CO 0.00 0.00 0.00 -2.67 -0.64 0.00 0.00 175.07 171.76 3ii0 n TRP 296 N -3.41 0.00 0.00 -1.42 2.14 -0.59 -5.07 117.44 109.09 3ii0 n TRP 296 Ca -0.04 -0.01 0.00 0.00 2.07 0.00 0.00 57.50 59.52 3ii0 n TRP 296 Cb 0.14 -0.00 0.00 0.00 -0.81 0.00 0.00 31.31 30.64 3ii0 n TRP 296 CO 0.00 0.00 0.00 0.45 2.07 0.00 0.00 177.69 180.21 3ii0 n SER 297 N -0.01 0.00 -3.45 -0.67 2.88 -0.15 -4.72 113.62 107.49 3ii0 n SER 297 Ca 0.00 0.00 -0.11 0.00 -1.33 0.00 0.00 58.87 57.43 3ii0 n SER 297 Cb 0.14 0.00 -0.02 0.00 -0.75 0.00 0.00 64.21 63.58 3ii0 n SER 297 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 3ii0 s ASN 298 N 0.00 -0.50 0.42 -3.46 2.20 -1.26 -4.16 114.94 108.18 3ii0 s ASN 298 Ca 0.00 0.03 -0.02 0.00 -0.94 0.00 0.00 52.86 51.93 3ii0 s ASN 298 Cb 0.00 0.52 -0.03 0.00 -2.00 0.00 0.00 41.25 39.75 3ii0 s ASN 298 CO 0.00 -0.84 0.67 -2.16 -2.94 0.00 0.00 177.10 171.84 3ii0 s PRO 299 N -3.43 3.42 0.57 3.55 0.04 -1.26 -5.03 135.00 132.87 3ii0 s PRO 299 Ca 0.02 -0.13 -0.16 0.00 0.04 0.00 0.00 61.00 60.76 3ii0 s PRO 299 Cb -0.01 -2.52 -0.05 0.00 0.04 0.00 0.00 34.50 31.97 3ii0 s PRO 299 CO -0.11 -0.09 1.05 -1.25 0.04 0.00 0.00 177.00 176.65 3ii0 s PRO 300 N -4.55 3.42 -0.16 0.56 0.04 -1.26 -4.67 135.00 128.38 3ii0 s PRO 300 Ca 0.45 1.22 -0.06 0.00 0.04 0.00 0.00 61.00 62.64 3ii0 s PRO 300 Cb -0.10 -2.05 -0.24 0.00 0.04 0.00 0.00 34.50 32.16 3ii0 s PRO 300 CO 0.40 -0.73 0.22 0.00 0.04 0.00 0.00 177.00 176.93 3ii0 n ALA 301 N -1.85 0.99 0.01 8.56 0.00 -1.26 -4.50 120.51 122.47 3ii0 n ALA 301 Ca 0.09 -0.69 -0.10 0.00 0.00 0.00 0.00 53.44 52.74 3ii0 n ALA 301 Cb 0.53 -0.54 -0.03 0.00 0.00 0.00 0.00 19.45 19.40 3ii0 n ALA 301 CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 177.50 177.87 3ii0 h GLN 302 N -0.05 -0.20 -0.15 0.00 5.75 -1.95 0.57 115.11 119.08 3ii0 h GLN 302 Ca -0.46 0.01 -0.00 0.00 -0.15 0.00 0.00 58.65 58.06 3ii0 h GLN 302 Cb 1.94 0.05 -0.01 0.00 1.07 0.00 0.00 27.48 30.53 3ii0 h GLN 302 CO 0.02 -0.13 0.08 0.78 -2.65 0.00 0.00 178.83 176.93 3ii0 h GLY 303 N -0.21 0.22 0.80 2.39 0.00 -1.83 -2.10 103.07 102.35 3ii0 h GLY 303 Ca 0.08 -0.10 0.04 0.00 0.00 0.00 0.00 47.33 47.35 3ii0 h GLY 303 CO -0.21 0.10 0.49 0.00 0.00 0.00 0.00 176.54 176.91 3ii0 h ALA 304 N 0.98 1.05 -0.84 3.60 0.00 -1.65 -2.13 119.26 120.27 3ii0 h ALA 304 Ca 0.05 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.92 3ii0 h ALA 304 Cb 0.07 -0.23 -0.04 0.00 0.00 0.00 0.00 17.79 17.59 3ii0 h ALA 304 CO -0.01 0.26 0.41 0.00 0.00 0.00 0.00 179.25 179.91 3ii0 h ARG 305 N 0.93 1.20 -0.39 0.00 3.08 -0.69 -0.13 114.38 118.39 3ii0 h ARG 305 Ca 0.33 -0.17 -0.02 0.00 0.07 0.00 0.00 59.98 60.19 3ii0 h ARG 305 Cb 0.09 -0.22 -0.02 0.00 0.08 0.00 0.00 29.97 29.90 3ii0 h ARG 305 CO -0.14 0.92 0.17 0.82 -1.07 0.00 0.00 179.97 180.67 3ii0 h ILE 306 N 1.19 1.18 -0.06 2.04 2.04 -0.95 -1.00 117.51 121.95 3ii0 h ILE 306 Ca 0.29 -0.55 -0.02 0.00 1.00 0.00 0.00 64.86 65.59 3ii0 h ILE 306 Cb 0.10 0.83 -0.00 0.00 -0.74 0.00 0.00 36.82 37.01 3ii0 h ILE 306 CO -0.04 0.20 -0.02 0.58 0.00 0.00 0.00 178.15 178.87 3ii0 h VAL 307 N 0.48 1.31 -0.39 1.67 2.07 -1.27 -1.93 116.25 118.19 3ii0 h VAL 307 Ca 0.13 -0.97 0.07 0.00 0.82 0.00 0.00 66.70 66.75 3ii0 h VAL 307 Cb 0.16 1.83 -0.06 0.00 -1.52 0.00 0.00 31.29 31.69 3ii0 h VAL 307 CO -0.01 0.27 -0.01 0.00 0.02 0.00 0.00 177.57 177.84 3ii0 h ALA 308 N 0.65 0.35 -0.71 1.67 0.00 -1.00 -0.18 119.26 120.04 3ii0 h ALA 308 Ca 0.02 0.12 -0.01 0.00 0.00 0.00 0.00 54.91 55.03 3ii0 h ALA 308 Cb 0.43 0.20 -0.03 0.00 0.00 0.00 0.00 17.79 18.39 3ii0 h ALA 308 CO 0.01 -0.40 0.41 0.77 0.00 0.00 0.00 179.25 180.04 3ii0 h SER 309 N 0.10 0.86 0.14 0.00 0.02 -1.17 -1.67 113.55 111.82 3ii0 h SER 309 Ca 0.19 -0.08 -0.01 0.00 -0.84 0.00 0.00 61.79 61.06 3ii0 h SER 309 Cb 0.27 -0.22 0.00 0.00 0.14 0.00 0.00 62.40 62.59 3ii0 h SER 309 CO -0.32 0.69 -0.07 0.74 -1.14 0.00 0.00 176.83 176.72 3ii0 h THR 310 N 0.97 0.98 0.00 -2.27 2.02 -0.62 -3.25 112.91 110.74 3ii0 h THR 310 Ca 0.25 -0.49 -0.04 0.00 0.77 0.00 0.00 66.41 66.91 3ii0 h THR 310 Cb -0.01 1.28 -0.01 0.00 -1.74 0.00 0.00 68.15 67.68 3ii0 h THR 310 CO -0.04 0.12 -0.17 -0.07 0.37 0.00 0.00 175.52 175.72 3ii0 h LEU 311 N -0.42 0.00 -0.31 2.58 3.38 -1.02 -2.40 115.31 117.12 3ii0 h LEU 311 Ca -0.02 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.95 3ii0 h LEU 311 Cb 0.33 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.08 3ii0 h LEU 311 CO 0.03 0.17 -0.13 -1.54 0.09 0.00 0.00 178.44 177.06 3ii0 n SER 312 N -3.21 0.61 -4.15 -0.43 3.41 -0.64 -4.78 113.62 104.44 3ii0 n SER 312 Ca 0.02 -0.69 -0.33 0.00 -0.26 0.00 0.00 58.87 57.60 3ii0 n SER 312 Cb 0.50 -0.03 -0.15 0.00 -0.26 0.00 0.00 64.21 64.27 3ii0 n SER 312 CO 0.00 0.00 0.00 0.21 -0.16 0.00 0.00 175.04 175.09 3ii0 s ASN 313 N -2.44 3.72 0.31 4.04 3.84 -1.21 -5.03 114.94 118.17 3ii0 s ASN 313 Ca 0.29 -0.78 0.03 0.00 0.21 0.00 0.00 52.86 52.60 3ii0 s ASN 313 Cb 0.20 -1.56 0.60 0.00 -0.55 0.00 0.00 41.25 39.94 3ii0 s ASN 313 CO 0.47 -0.06 1.90 -0.65 -2.79 0.00 0.00 177.10 175.97 3ii0 h PRO 314 N 7.95 0.92 0.31 0.43 0.11 -1.86 -0.17 132.00 139.69 3ii0 h PRO 314 Ca -0.38 -0.06 -0.02 0.00 0.11 0.00 0.00 66.00 65.65 3ii0 h PRO 314 Cb 1.12 -0.21 0.00 0.00 0.11 0.00 0.00 31.00 32.03 3ii0 h PRO 314 CO 0.59 0.61 -0.15 1.49 -0.21 0.00 0.00 178.00 180.33 3ii0 h GLU 315 N 0.94 -0.40 -0.92 1.05 4.57 -1.95 -2.44 114.58 115.42 3ii0 h GLU 315 Ca 0.41 0.03 0.01 0.00 -1.18 0.00 0.00 59.36 58.63 3ii0 h GLU 315 Cb 0.33 0.09 -0.05 0.00 -0.16 0.00 0.00 28.75 28.97 3ii0 h GLU 315 CO -0.17 -0.08 0.61 -0.07 -1.18 0.00 0.00 179.01 178.12 3ii0 h LEU 316 N -0.78 1.04 -0.67 1.64 3.38 -1.72 -1.76 115.31 116.45 3ii0 h LEU 316 Ca -0.04 -0.02 0.09 0.00 0.09 0.00 0.00 57.88 57.99 3ii0 h LEU 316 Cb 0.51 -0.26 -0.07 0.00 0.09 0.00 0.00 40.66 40.93 3ii0 h LEU 316 CO 0.07 0.75 0.32 0.15 0.09 0.00 0.00 178.44 179.82 3ii0 h PHE 317 N 1.23 0.57 -0.44 1.13 3.04 -0.50 0.13 116.94 122.09 3ii0 h PHE 317 Ca 0.34 0.03 -0.14 0.00 3.98 0.00 0.00 57.97 62.18 3ii0 h PHE 317 Cb -0.11 -0.15 -0.01 0.00 2.56 0.00 0.00 35.95 38.23 3ii0 h PHE 317 CO -0.00 0.20 -0.28 1.49 -2.02 0.00 0.00 178.31 177.70 3ii0 h GLU 318 N 0.55 0.96 -0.43 1.11 4.81 -0.89 -1.22 114.58 119.48 3ii0 h GLU 318 Ca 0.33 -0.45 -0.03 0.00 -0.13 0.00 0.00 59.36 59.08 3ii0 h GLU 318 Cb 0.34 -0.01 -0.02 0.00 0.63 0.00 0.00 28.75 29.69 3ii0 h GLU 318 CO -0.26 1.12 0.17 1.49 -0.73 0.00 0.00 179.01 180.79 3ii0 h GLU 319 N 0.80 0.65 -0.40 1.92 4.81 -0.87 -2.55 114.58 118.94 3ii0 h GLU 319 Ca 0.09 -0.12 0.05 0.00 -0.13 0.00 0.00 59.36 59.25 3ii0 h GLU 319 Cb 0.87 -0.10 -0.05 0.00 0.63 0.00 0.00 28.75 30.10 3ii0 h GLU 319 CO 0.08 0.60 0.13 2.35 -0.73 0.00 0.00 179.01 181.44 3ii0 h TRP 320 N 0.55 0.24 0.00 0.92 7.01 -0.59 -1.30 115.95 122.78 3ii0 h TRP 320 Ca 0.14 0.02 -0.04 0.00 2.11 0.00 0.00 58.89 61.13 3ii0 h TRP 320 Cb 0.20 -0.05 -0.01 0.00 -2.10 0.00 0.00 29.16 27.21 3ii0 h TRP 320 CO 0.00 0.09 -0.17 1.79 -2.79 0.00 0.00 178.44 177.36 3ii0 h THR 321 N 0.29 0.93 -0.41 2.65 1.35 -1.05 -1.28 112.91 115.39 3ii0 h THR 321 Ca 0.18 -0.64 -0.12 0.00 -0.55 0.00 0.00 66.41 65.29 3ii0 h THR 321 Cb 0.17 1.36 -0.01 0.00 -1.73 0.00 0.00 68.15 67.94 3ii0 h THR 321 CO -0.19 0.17 -0.19 1.23 -0.25 0.00 0.00 175.52 176.28 3ii0 h GLY 322 N 0.68 0.93 1.01 5.82 0.00 -0.93 -1.78 103.07 108.80 3ii0 h GLY 322 Ca -0.00 -0.84 0.01 0.00 0.00 0.00 0.00 47.33 46.50 3ii0 h GLY 322 CO 0.02 0.76 0.47 3.43 0.00 0.00 0.00 176.54 181.23 3ii0 h ASN 323 N 0.68 0.84 -0.47 0.19 -0.26 -0.25 -1.26 115.58 115.05 3ii0 h ASN 323 Ca 0.09 -0.03 -0.01 0.00 -0.56 0.00 0.00 56.30 55.79 3ii0 h ASN 323 Cb 0.75 -0.21 -0.02 0.00 -1.06 0.00 0.00 38.32 37.78 3ii0 h ASN 323 CO 0.06 0.61 0.25 0.58 -1.06 0.00 0.00 177.43 177.87 3ii0 h VAL 324 N 0.98 1.17 -0.97 2.81 2.07 -1.27 -2.73 116.25 118.31 3ii0 h VAL 324 Ca 0.26 -0.47 0.04 0.00 0.82 0.00 0.00 66.70 67.36 3ii0 h VAL 324 Cb -0.10 0.62 -0.06 0.00 -1.52 0.00 0.00 31.29 30.24 3ii0 h VAL 324 CO -0.06 0.19 0.64 0.50 0.02 0.00 0.00 177.57 178.86 3ii0 h LYS 325 N 0.62 1.18 -0.91 1.57 1.63 -1.11 -1.20 116.57 118.35 3ii0 h LYS 325 Ca 0.16 -0.07 0.03 0.00 -0.85 0.00 0.00 60.65 59.92 3ii0 h LYS 325 Cb 0.08 -0.27 -0.05 0.00 -0.60 0.00 0.00 32.23 31.39 3ii0 h LYS 325 CO -0.02 0.78 0.59 1.15 -3.45 0.00 0.00 179.45 178.50 3ii0 h THR 326 N 1.22 1.17 -0.09 1.00 2.02 -0.99 0.48 112.91 117.71 3ii0 h THR 326 Ca 0.39 -0.40 -0.04 0.00 0.77 0.00 0.00 66.41 67.14 3ii0 h THR 326 Cb 0.03 -0.10 -0.00 0.00 -1.74 0.00 0.00 68.15 66.34 3ii0 h THR 326 CO -0.13 0.21 -0.08 0.24 0.37 0.00 0.00 175.52 176.14 3ii0 h MET 327 N 1.16 0.22 -0.93 6.66 2.86 -1.11 -2.09 114.93 121.71 3ii0 h MET 327 Ca 0.36 -0.11 -0.00 0.00 -2.06 0.00 0.00 59.70 57.89 3ii0 h MET 327 Cb -0.02 0.00 -0.04 0.00 0.06 0.00 0.00 31.60 31.59 3ii0 h MET 327 CO -0.11 0.63 0.57 0.00 1.06 0.00 0.00 176.91 179.06 3ii0 h ALA 328 N 0.59 1.18 -0.57 6.32 0.00 -1.01 -2.08 119.26 123.68 3ii0 h ALA 328 Ca 0.02 -0.09 -0.09 0.00 0.00 0.00 0.00 54.91 54.74 3ii0 h ALA 328 Cb 0.58 -0.37 -0.02 0.00 0.00 0.00 0.00 17.79 17.97 3ii0 h ALA 328 CO 0.02 0.62 -0.02 -0.44 0.00 0.00 0.00 179.25 179.44 3ii0 h ASP 329 N 1.27 0.99 -0.59 0.00 3.32 -0.91 -2.05 116.42 118.44 3ii0 h ASP 329 Ca 0.33 -0.28 -0.06 0.00 0.02 0.00 0.00 57.03 57.04 3ii0 h ASP 329 Cb -0.08 -0.27 -0.03 0.00 0.22 0.00 0.00 39.33 39.18 3ii0 h ASP 329 CO -0.07 1.05 0.13 -0.09 -1.72 0.00 0.00 179.24 178.55 3ii0 h ARG 330 N 0.92 0.99 -0.43 3.56 2.43 -0.98 -2.28 114.38 118.59 3ii0 h ARG 330 Ca 0.16 -0.23 -0.00 0.00 -0.81 0.00 0.00 59.98 59.10 3ii0 h ARG 330 Cb 0.56 -0.13 -0.02 0.00 -0.42 0.00 0.00 29.97 29.95 3ii0 h ARG 330 CO 0.03 0.90 0.25 0.82 -1.51 0.00 0.00 179.97 180.46 3ii0 h ILE 331 N 0.95 1.14 -0.65 1.20 2.04 -1.24 -1.52 117.51 119.43 3ii0 h ILE 331 Ca 0.20 -0.33 0.09 0.00 1.00 0.00 0.00 64.86 65.82 3ii0 h ILE 331 Cb 0.37 0.59 -0.07 0.00 -0.74 0.00 0.00 36.82 36.97 3ii0 h ILE 331 CO 0.00 0.14 0.28 -0.07 0.00 0.00 0.00 178.15 178.51 3ii0 h LEU 332 N 0.56 0.33 -0.62 1.44 3.38 -1.05 -0.91 115.31 118.45 3ii0 h LEU 332 Ca 0.15 0.07 -0.05 0.00 0.09 0.00 0.00 57.88 58.14 3ii0 h LEU 332 Cb 0.01 0.02 -0.03 0.00 0.09 0.00 0.00 40.66 40.76 3ii0 h LEU 332 CO -0.03 0.19 0.19 0.74 0.09 0.00 0.00 178.44 179.62 3ii0 h THR 333 N 0.49 1.25 -0.32 0.22 2.02 -1.02 -1.94 112.91 113.61 3ii0 h THR 333 Ca 0.32 -0.84 -0.10 0.00 0.77 0.00 0.00 66.41 66.56 3ii0 h THR 333 Cb 0.37 0.62 -0.01 0.00 -1.74 0.00 0.00 68.15 67.39 3ii0 h THR 333 CO -0.29 0.32 -0.23 0.24 0.37 0.00 0.00 175.52 175.93 3ii0 h MET 334 N 0.89 0.61 -0.51 6.66 2.86 -0.61 -0.36 114.93 124.47 3ii0 h MET 334 Ca 0.20 -0.23 -0.03 0.00 -2.06 0.00 0.00 59.70 57.57 3ii0 h MET 334 Cb 0.29 -0.03 -0.02 0.00 0.06 0.00 0.00 31.60 31.90 3ii0 h MET 334 CO -0.01 0.79 0.19 0.00 1.06 0.00 0.00 176.91 178.95 3ii0 h ARG 335 N 0.54 0.76 -0.34 1.72 3.08 -1.04 -0.71 114.38 118.40 3ii0 h ARG 335 Ca 0.08 -0.15 -0.06 0.00 0.07 0.00 0.00 59.98 59.92 3ii0 h ARG 335 Cb 0.69 -0.12 -0.01 0.00 0.08 0.00 0.00 29.97 30.61 3ii0 h ARG 335 CO 0.05 0.69 -0.02 1.03 -1.07 0.00 0.00 179.97 180.65 3ii0 h SER 336 N 0.68 0.60 -0.60 7.04 0.87 -1.00 -2.30 113.55 118.85 3ii0 h SER 336 Ca 0.17 -0.32 -0.08 0.00 -1.23 0.00 0.00 61.79 60.33 3ii0 h SER 336 Cb 0.22 -0.16 -0.03 0.00 -0.44 0.00 0.00 62.40 61.99 3ii0 h SER 336 CO -0.01 0.78 0.09 -0.33 -0.53 0.00 0.00 176.83 176.83 3ii0 h GLU 337 N 0.41 1.02 -0.07 2.24 4.39 -1.01 -1.74 114.58 119.82 3ii0 h GLU 337 Ca 0.09 -0.27 -0.02 0.00 0.34 0.00 0.00 59.36 59.51 3ii0 h GLU 337 Cb 0.49 -0.12 -0.00 0.00 -0.10 0.00 0.00 28.75 29.01 3ii0 h GLU 337 CO 0.02 0.95 -0.03 1.25 -1.16 0.00 0.00 179.01 180.03 3ii0 h LEU 338 N 0.96 0.15 -0.37 1.33 5.85 -1.01 -1.34 115.31 120.86 3ii0 h LEU 338 Ca 0.19 -0.41 0.06 0.00 0.84 0.00 0.00 57.88 58.55 3ii0 h LEU 338 Cb 0.43 -0.04 -0.05 0.00 0.37 0.00 0.00 40.66 41.37 3ii0 h LEU 338 CO 0.01 0.53 0.06 -0.09 -0.34 0.00 0.00 178.44 178.61 3ii0 h ARG 339 N -0.23 0.18 -0.73 1.25 2.43 -1.42 -1.37 114.38 114.47 3ii0 h ARG 339 Ca 0.02 -0.01 0.05 0.00 -0.81 0.00 0.00 59.98 59.23 3ii0 h ARG 339 Cb 0.47 -0.04 -0.05 0.00 -0.42 0.00 0.00 29.97 29.93 3ii0 h ARG 339 CO 0.01 0.12 0.44 0.00 -1.51 0.00 0.00 179.97 179.03 3ii0 h ALA 340 N 1.29 0.98 -0.22 2.80 0.00 -1.17 -0.62 119.26 122.31 3ii0 h ALA 340 Ca 0.18 -0.00 -0.19 0.00 0.00 0.00 0.00 54.91 54.90 3ii0 h ALA 340 Cb 0.22 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.82 3ii0 h ALA 340 CO -0.25 0.17 -0.62 0.00 0.00 0.00 0.00 179.25 178.55 3ii0 h ARG 341 N 0.82 0.76 -0.52 0.00 3.08 -0.79 -0.80 114.38 116.94 3ii0 h ARG 341 Ca 0.32 -0.53 -0.00 0.00 0.07 0.00 0.00 59.98 59.84 3ii0 h ARG 341 Cb 0.13 0.08 -0.02 0.00 0.08 0.00 0.00 29.97 30.23 3ii0 h ARG 341 CO -0.16 1.15 0.31 -0.07 -1.07 0.00 0.00 179.97 180.13 3ii0 h LEU 342 N 0.57 0.63 -0.76 3.04 3.38 -1.08 -1.38 115.31 119.70 3ii0 h LEU 342 Ca -0.01 -0.06 -0.03 0.00 0.09 0.00 0.00 57.88 57.87 3ii0 h LEU 342 Cb 1.22 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 41.78 3ii0 h LEU 342 CO 0.13 0.51 0.37 -0.33 0.09 0.00 0.00 178.44 179.20 3ii0 h GLU 343 N 0.69 1.09 -0.03 1.13 5.08 -0.99 -2.37 114.58 119.18 3ii0 h GLU 343 Ca 0.18 -0.16 -0.08 0.00 -1.00 0.00 0.00 59.36 58.31 3ii0 h GLU 343 Cb 0.00 -0.20 -0.01 0.00 0.50 0.00 0.00 28.75 29.04 3ii0 h GLU 343 CO -0.03 0.85 -0.34 0.00 -1.00 0.00 0.00 179.01 178.48 3ii0 h ALA 344 N 1.19 1.37 0.00 3.43 0.00 -0.86 -2.01 119.26 122.38 3ii0 h ALA 344 Ca 0.26 -0.33 0.00 0.00 0.00 0.00 0.00 54.91 54.84 3ii0 h ALA 344 Cb 0.12 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.84 3ii0 h ALA 344 CO -0.03 0.46 0.00 1.28 0.00 0.00 0.00 179.25 180.96 3ii0 n LEU 345 N -4.12 0.00 -2.16 0.00 4.77 -0.54 -4.90 117.00 110.05 3ii0 n LEU 345 Ca -0.02 0.43 -0.15 0.00 -0.03 0.00 0.00 56.01 56.25 3ii0 n LEU 345 Cb 0.39 -0.43 0.03 0.00 -2.33 0.00 0.00 43.42 41.08 3ii0 n LEU 345 CO 0.39 -0.12 0.04 0.29 -1.33 0.00 0.00 177.39 176.66 3ii0 n LYS 346 N -1.43 -3.69 -1.81 3.23 4.76 -0.76 -4.95 118.16 113.50 3ii0 n LYS 346 Ca 0.07 0.58 -0.42 0.00 -2.87 0.00 0.00 58.31 55.67 3ii0 n LYS 346 Cb 0.22 -4.77 -0.03 0.00 -1.84 0.00 0.00 35.03 28.62 3ii0 n LYS 346 CO 0.00 0.00 0.00 0.99 -1.37 0.00 0.00 177.40 177.02 3ii0 s THR 347 N -3.02 2.41 0.78 -0.18 2.01 -0.92 -4.95 115.64 111.78 3ii0 s THR 347 Ca 0.24 0.21 -0.14 0.00 0.31 0.00 0.00 61.69 62.31 3ii0 s THR 347 Cb -0.11 -3.14 0.06 0.00 0.01 0.00 0.00 72.50 69.33 3ii0 s THR 347 CO 0.30 0.01 1.17 -2.65 -0.69 0.00 0.00 174.62 172.77 3ii0 n PRO 348 N 4.43 0.33 0.00 4.92 -0.02 -1.26 -4.80 135.00 138.60 3ii0 n PRO 348 Ca 0.16 0.18 0.00 0.00 -2.02 0.00 0.00 63.50 61.82 3ii0 n PRO 348 Cb 0.37 -2.42 0.00 0.00 -0.02 0.00 0.00 33.50 31.44 3ii0 n PRO 348 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3ii0 n GLY 349 N 0.68 -2.79 3.89 -1.23 0.00 -1.26 -4.97 105.19 99.51 3ii0 n GLY 349 Ca 0.14 -1.69 -0.27 0.00 0.00 0.00 0.00 46.02 44.20 3ii0 n GLY 349 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3ii0 s THR 350 N -0.91 5.06 -0.04 2.61 -4.23 -1.26 -5.05 115.64 111.82 3ii0 s THR 350 Ca 0.00 -0.77 0.06 0.00 -1.18 0.00 0.00 61.69 59.80 3ii0 s THR 350 Cb 0.00 -3.58 0.09 0.00 1.34 0.00 0.00 72.50 70.35 3ii0 s THR 350 CO 0.00 -0.06 0.96 0.79 -0.54 0.00 0.00 174.62 175.77 3ii0 n TRP 351 N -0.36 0.00 0.28 3.99 7.02 -1.26 -4.77 117.44 122.34 3ii0 n TRP 351 Ca -0.07 -0.37 0.17 0.00 -1.02 0.00 0.00 57.50 56.20 3ii0 n TRP 351 Cb 0.54 -0.07 0.80 0.00 -2.42 0.00 0.00 31.31 30.15 3ii0 n TRP 351 CO 0.00 0.00 0.00 -2.95 -2.02 0.00 0.00 177.69 172.72 3ii0 h ASN 352 N 0.00 0.00 0.11 -0.99 -1.07 -1.96 -2.21 115.58 109.47 3ii0 h ASN 352 Ca 0.00 0.00 -0.01 0.00 0.07 0.00 0.00 56.30 56.36 3ii0 h ASN 352 Cb 1.08 0.00 -0.00 0.00 -2.07 0.00 0.00 38.32 37.33 3ii0 h ASN 352 CO 0.00 0.05 -0.05 1.12 0.07 0.00 0.00 177.43 178.62 3ii0 h HIS 353 N 0.00 0.00 -0.83 4.14 2.07 -1.96 0.11 115.15 118.68 3ii0 h HIS 353 Ca -0.00 0.00 -0.01 0.00 -2.85 0.00 0.00 60.37 57.51 3ii0 h HIS 353 Cb 0.37 0.00 -0.04 0.00 2.57 0.00 0.00 27.41 30.32 3ii0 h HIS 353 CO 0.00 0.05 0.48 0.82 -3.07 0.00 0.00 177.93 176.21 3ii0 h ILE 354 N 0.00 1.24 0.00 6.12 1.08 -1.75 -2.28 117.51 121.92 3ii0 h ILE 354 Ca -0.00 -0.55 -0.02 0.00 -0.39 0.00 0.00 64.86 63.90 3ii0 h ILE 354 Cb 0.12 0.09 -0.00 0.00 -3.07 0.00 0.00 36.82 33.96 3ii0 h ILE 354 CO 0.01 0.26 -1.33 0.35 -0.69 0.00 0.00 178.15 176.74 3ii0 n THR 355 N -4.42 0.49 -0.09 -0.27 -2.24 -0.75 -3.98 114.28 103.02 3ii0 n THR 355 Ca 0.08 -0.55 -0.08 0.00 -2.27 0.00 0.00 64.05 61.24 3ii0 n THR 355 Cb 0.07 -0.27 0.09 0.00 -2.10 0.00 0.00 70.33 68.12 3ii0 n THR 355 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 3ii0 h ASP 356 N 0.00 0.79 -4.26 3.42 3.32 -0.74 -3.45 116.42 115.50 3ii0 h ASP 356 Ca -0.02 -0.29 -0.51 0.00 0.02 0.00 0.00 57.03 56.24 3ii0 h ASP 356 Cb 1.05 -0.22 0.10 0.00 0.22 0.00 0.00 39.33 40.48 3ii0 h ASP 356 CO 0.00 0.99 0.36 -1.10 -1.72 0.00 0.00 179.24 177.78 3ii0 s GLN 357 N -4.59 2.85 0.26 3.56 -0.21 -0.86 -4.98 119.66 115.69 3ii0 s GLN 357 Ca -0.09 1.18 0.03 0.00 0.02 0.00 0.00 55.36 56.50 3ii0 s GLN 357 Cb 0.13 -1.97 -0.05 0.00 1.00 0.00 0.00 33.01 32.11 3ii0 s GLN 357 CO 0.84 -1.19 0.04 0.96 -2.12 0.00 0.00 175.29 173.82 3ii0 s ILE 358 N -2.67 0.93 0.00 1.08 -4.36 0.50 -5.00 121.20 111.68 3ii0 s ILE 358 Ca 0.62 -2.01 0.00 0.00 -0.26 0.00 0.00 60.65 59.00 3ii0 s ILE 358 Cb -0.17 -2.53 0.00 0.00 1.25 0.00 0.00 42.46 41.01 3ii0 s ILE 358 CO 0.47 -0.16 0.00 0.61 0.24 0.00 0.00 174.94 176.10 3ii0 n GLY 359 N -0.49 -0.12 0.09 6.27 0.00 -1.18 -4.38 105.19 105.39 3ii0 n GLY 359 Ca -0.03 -1.54 0.06 0.00 0.00 0.00 0.00 46.02 44.51 3ii0 n GLY 359 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 3ii0 n MET 360 N 0.25 0.62 -4.25 1.61 1.56 -1.26 -4.92 117.12 110.74 3ii0 n MET 360 Ca 0.00 0.12 -0.25 0.00 -0.27 0.00 0.00 57.70 57.31 3ii0 n MET 360 Cb 0.00 -1.78 -0.07 0.00 2.15 0.00 0.00 33.22 33.52 3ii0 n MET 360 CO 0.00 0.00 0.00 -0.06 -0.73 0.00 0.00 175.97 175.18 3ii0 s PHE 361 N -3.18 2.78 -0.08 1.12 0.08 -1.26 -0.61 117.98 116.84 3ii0 s PHE 361 Ca -0.03 -0.18 0.04 0.00 0.12 0.00 0.00 56.93 56.89 3ii0 s PHE 361 Cb 0.10 -1.29 -0.00 0.00 -0.57 0.00 0.00 43.02 41.25 3ii0 s PHE 361 CO 0.81 0.56 -0.22 0.45 -0.10 0.00 0.00 175.22 176.73 3ii0 s SER 362 N -3.34 2.79 -0.76 1.36 0.15 -0.71 -4.58 113.70 108.62 3ii0 s SER 362 Ca 0.29 -0.48 -0.19 0.00 0.70 0.00 0.00 55.95 56.27 3ii0 s SER 362 Cb -0.08 -1.07 0.12 0.00 -1.71 0.00 0.00 66.02 63.29 3ii0 s SER 362 CO 0.19 0.17 0.92 0.12 1.20 0.00 0.00 173.24 175.84 3ii0 s PHE 363 N 0.20 3.08 -0.07 3.44 5.36 -1.26 -0.94 117.98 127.80 3ii0 s PHE 363 Ca -0.12 -1.17 0.26 0.00 -0.96 0.00 0.00 56.93 54.93 3ii0 s PHE 363 Cb -0.16 -4.14 0.81 0.00 -0.34 0.00 0.00 43.02 39.19 3ii0 s PHE 363 CO 0.06 -1.40 1.77 1.79 -1.46 0.00 0.00 175.22 175.99 3ii0 h THR 364 N 5.76 0.25 0.00 0.12 1.35 -1.81 -3.48 112.91 115.10 3ii0 h THR 364 Ca -0.08 -1.01 0.00 0.00 -0.55 0.00 0.00 66.41 64.77 3ii0 h THR 364 Cb 1.05 1.82 0.00 0.00 -1.73 0.00 0.00 68.15 69.30 3ii0 h THR 364 CO 1.08 0.12 0.00 0.61 -0.25 0.00 0.00 175.52 177.07 3ii0 n GLY 365 N 0.50 1.16 3.77 5.82 0.00 -1.26 -5.04 105.19 110.13 3ii0 n GLY 365 Ca 0.02 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.64 3ii0 n GLY 365 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3ii0 s LEU 366 N 0.00 4.12 0.70 0.99 1.43 -1.26 -5.02 118.68 119.64 3ii0 s LEU 366 Ca 0.00 2.82 -0.08 0.00 -1.03 0.00 0.00 54.13 55.84 3ii0 s LEU 366 Cb 0.00 -3.96 0.05 0.00 0.03 0.00 0.00 46.19 42.31 3ii0 s LEU 366 CO 0.00 -1.11 1.04 0.54 0.23 0.00 0.00 176.35 177.04 3ii0 s ASN 367 N -0.62 4.96 0.50 2.29 2.20 -1.26 -4.22 114.94 118.78 3ii0 s ASN 367 Ca 0.61 0.64 0.16 0.00 -0.94 0.00 0.00 52.86 53.32 3ii0 s ASN 367 Cb -0.42 -1.33 1.20 0.00 -2.00 0.00 0.00 41.25 38.71 3ii0 s ASN 367 CO 0.53 -1.54 2.11 -0.65 -2.94 0.00 0.00 177.10 174.61 3ii0 h PRO 368 N -0.62 0.00 -0.00 3.55 0.11 -1.95 -1.78 132.00 131.31 3ii0 h PRO 368 Ca -0.45 0.00 -0.16 0.00 0.11 0.00 0.00 66.00 65.50 3ii0 h PRO 368 Cb 1.30 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.39 3ii0 h PRO 368 CO 0.62 0.05 -0.75 0.87 -0.21 0.00 0.00 178.00 178.59 3ii0 h LYS 369 N 0.00 0.00 -0.16 1.05 6.56 -1.94 -1.79 116.57 120.29 3ii0 h LYS 369 Ca -0.00 -0.00 -0.19 0.00 -1.06 0.00 0.00 60.65 59.40 3ii0 h LYS 369 Cb 0.10 0.00 -0.00 0.00 -0.57 0.00 0.00 32.23 31.76 3ii0 h LYS 369 CO 0.01 0.75 -0.66 1.96 -2.06 0.00 0.00 179.45 179.44 3ii0 h GLN 370 N 0.00 0.61 -0.39 3.15 4.20 -1.70 -1.53 115.11 119.46 3ii0 h GLN 370 Ca -0.01 -0.45 -0.05 0.00 0.06 0.00 0.00 58.65 58.20 3ii0 h GLN 370 Cb 1.32 0.08 -0.01 0.00 0.30 0.00 0.00 27.48 29.16 3ii0 h GLN 370 CO 0.10 1.07 0.05 0.28 -0.67 0.00 0.00 178.83 179.66 3ii0 h VAL 371 N 0.44 1.24 -0.60 -0.54 2.07 -1.27 -1.94 116.25 115.65 3ii0 h VAL 371 Ca -0.02 -0.89 0.06 0.00 0.82 0.00 0.00 66.70 66.67 3ii0 h VAL 371 Cb 1.25 1.07 -0.05 0.00 -1.52 0.00 0.00 31.29 32.04 3ii0 h VAL 371 CO 0.13 0.30 0.31 -0.08 0.02 0.00 0.00 177.57 178.25 3ii0 h GLU 372 N 0.49 0.56 0.23 1.57 4.81 -1.22 0.22 114.58 121.23 3ii0 h GLU 372 Ca 0.12 -0.03 -0.00 0.00 -0.13 0.00 0.00 59.36 59.31 3ii0 h GLU 372 Cb 0.39 -0.13 -0.01 0.00 0.63 0.00 0.00 28.75 29.63 3ii0 h GLU 372 CO 0.01 0.37 -0.16 -0.92 -0.73 0.00 0.00 179.01 177.57 3ii0 h TYR 373 N 0.57 -0.43 -0.56 0.92 3.20 -1.10 0.06 116.97 119.64 3ii0 h TYR 373 Ca 0.28 -0.00 0.08 0.00 3.14 0.00 0.00 58.73 62.22 3ii0 h TYR 373 Cb 0.20 0.16 -0.06 0.00 1.54 0.00 0.00 36.73 38.57 3ii0 h TYR 373 CO -0.10 -0.25 0.21 -0.07 -1.64 0.00 0.00 178.16 176.30 3ii0 h LEU 374 N -0.39 0.21 0.18 2.82 3.38 -0.50 0.15 115.31 121.15 3ii0 h LEU 374 Ca -0.01 0.07 -0.01 0.00 0.09 0.00 0.00 57.88 58.01 3ii0 h LEU 374 Cb 0.34 0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.14 3ii0 h LEU 374 CO -0.00 0.14 -0.08 0.58 0.09 0.00 0.00 178.44 179.16 3ii0 h VAL 375 N 0.39 0.93 0.11 1.22 2.07 -0.45 0.34 116.25 120.87 3ii0 h VAL 375 Ca 0.27 -0.59 -0.31 0.00 0.82 0.00 0.00 66.70 66.89 3ii0 h VAL 375 Cb 0.31 1.29 -0.01 0.00 -1.52 0.00 0.00 31.29 31.36 3ii0 h VAL 375 CO -0.27 0.14 -1.62 0.78 0.02 0.00 0.00 177.57 176.62 3ii0 h ASN 376 N -0.53 0.37 0.33 0.57 2.35 -0.85 -2.60 115.58 115.23 3ii0 h ASN 376 Ca -0.02 -0.57 -0.32 0.00 -0.55 0.00 0.00 56.30 54.84 3ii0 h ASN 376 Cb 0.40 -0.12 -0.03 0.00 0.05 0.00 0.00 38.32 38.62 3ii0 h ASN 376 CO 0.04 1.48 -1.83 -0.62 -1.65 0.00 0.00 177.43 174.85 3ii0 n GLU 377 N -3.43 0.69 0.00 0.81 -0.58 0.51 -4.59 120.64 114.05 3ii0 n GLU 377 Ca -0.19 0.29 0.03 0.00 -0.42 0.00 0.00 57.16 56.87 3ii0 n GLU 377 Cb 1.05 -1.76 -0.02 0.00 -0.57 0.00 0.00 31.44 30.14 3ii0 n GLU 377 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 3ii0 n LYS 378 N -3.25 3.25 -2.49 3.49 4.76 -0.87 -5.01 118.16 118.04 3ii0 n LYS 378 Ca -0.23 -0.31 -0.16 0.00 -2.87 0.00 0.00 58.31 54.74 3ii0 n LYS 378 Cb 1.05 -0.93 0.00 0.00 -1.84 0.00 0.00 35.03 33.32 3ii0 n LYS 378 CO 0.00 0.00 0.00 0.72 -1.37 0.00 0.00 177.40 176.75 3ii0 n HIS 379 N -0.65 -1.01 -3.69 2.13 8.25 0.03 -4.70 115.22 115.58 3ii0 n HIS 379 Ca 0.02 0.14 -0.39 0.00 -0.26 0.00 0.00 57.72 57.23 3ii0 n HIS 379 Cb 0.13 -3.41 -0.12 0.00 1.12 0.00 0.00 29.99 27.72 3ii0 n HIS 379 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 3ii0 s ILE 380 N -2.87 4.22 -0.26 1.59 1.01 -0.71 -0.89 121.20 123.29 3ii0 s ILE 380 Ca 0.08 -0.81 -0.17 0.00 0.00 0.00 0.00 60.65 59.76 3ii0 s ILE 380 Cb -0.03 -3.28 -0.03 0.00 0.01 0.00 0.00 42.46 39.12 3ii0 s ILE 380 CO 0.10 -0.08 0.45 -0.31 0.00 0.00 0.00 174.94 175.09 3ii0 s TYR 381 N 1.51 3.27 0.29 3.97 1.51 0.24 -2.90 117.35 125.25 3ii0 s TYR 381 Ca 0.02 0.56 -0.04 0.00 -1.01 0.00 0.00 57.07 56.60 3ii0 s TYR 381 Cb -0.18 -2.64 -0.01 0.00 -0.11 0.00 0.00 41.96 39.01 3ii0 s TYR 381 CO 0.04 -0.23 0.39 -0.48 -1.11 0.00 0.00 175.55 174.17 3ii0 s LEU 382 N 2.09 0.93 0.39 -1.29 2.34 -1.26 0.21 118.68 122.09 3ii0 s LEU 382 Ca 0.19 -1.35 -0.19 0.00 0.06 0.00 0.00 54.13 52.83 3ii0 s LEU 382 Cb -0.16 1.25 -0.10 0.00 -0.56 0.00 0.00 46.19 46.63 3ii0 s LEU 382 CO 0.09 -1.15 0.88 -0.76 -1.06 0.00 0.00 176.35 174.35 3ii0 s LEU 383 N -3.18 4.00 0.56 1.48 1.43 -1.19 -4.94 118.68 116.83 3ii0 s LEU 383 Ca 0.31 1.57 0.29 0.00 -1.03 0.00 0.00 54.13 55.27 3ii0 s LEU 383 Cb 0.01 -4.37 1.46 0.00 0.03 0.00 0.00 46.19 43.33 3ii0 s LEU 383 CO 0.17 -0.30 1.93 -0.65 0.23 0.00 0.00 176.35 177.73 3ii0 h PRO 384 N 2.08 0.00 0.00 1.29 0.11 -1.94 0.90 132.00 134.44 3ii0 h PRO 384 Ca -0.49 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.62 3ii0 h PRO 384 Cb 1.18 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.29 3ii0 h PRO 384 CO 0.62 0.00 0.00 0.66 -0.21 0.00 0.00 178.00 179.07 3ii0 h SER 385 N 0.00 0.00 0.00 -2.05 4.64 -1.92 -3.36 113.55 110.86 3ii0 h SER 385 Ca 0.29 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.61 3ii0 h SER 385 Cb 1.28 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.37 3ii0 h SER 385 CO -0.00 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.57 3ii0 n GLY 386 N -0.55 0.71 3.72 -0.77 0.00 0.31 -4.66 105.19 103.95 3ii0 n GLY 386 Ca -0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 3ii0 n GLY 386 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3ii0 s ARG 387 N -0.68 4.31 0.14 1.61 3.52 -1.26 -2.51 118.95 124.09 3ii0 s ARG 387 Ca 0.00 2.10 0.10 0.00 -0.13 0.00 0.00 55.73 57.80 3ii0 s ARG 387 Cb 0.00 -3.23 -0.04 0.00 -1.56 0.00 0.00 34.95 30.11 3ii0 s ARG 387 CO 0.00 -0.44 -0.21 0.96 -0.81 0.00 0.00 175.30 174.80 3ii0 s ILE 388 N 1.04 2.62 -0.54 4.11 -4.36 -0.11 -3.19 121.20 120.76 3ii0 s ILE 388 Ca 0.65 -1.68 -0.26 0.00 -0.26 0.00 0.00 60.65 59.10 3ii0 s ILE 388 Cb -0.37 -2.21 0.03 0.00 1.25 0.00 0.00 42.46 41.16 3ii0 s ILE 388 CO 0.31 0.05 1.04 0.21 0.24 0.00 0.00 174.94 176.78 3ii0 s ASN 389 N -2.25 6.42 0.48 4.36 2.47 0.25 -1.73 114.94 124.95 3ii0 s ASN 389 Ca 0.18 -0.06 0.17 0.00 0.42 0.00 0.00 52.86 53.57 3ii0 s ASN 389 Cb -0.10 -2.49 1.16 0.00 -1.45 0.00 0.00 41.25 38.38 3ii0 s ASN 389 CO 0.09 -1.29 2.06 0.58 -3.72 0.00 0.00 177.10 174.82 3ii0 h VAL 390 N 6.09 1.01 0.00 -5.21 2.07 -1.18 -1.10 116.25 117.93 3ii0 h VAL 390 Ca -0.25 -0.40 0.00 0.00 0.82 0.00 0.00 66.70 66.86 3ii0 h VAL 390 Cb 1.07 1.22 0.00 0.00 -1.52 0.00 0.00 31.29 32.06 3ii0 h VAL 390 CO 1.11 0.11 0.00 -1.54 0.02 0.00 0.00 177.57 177.28 3ii0 n SER 391 N -4.30 0.00 0.06 0.57 3.41 -1.25 -1.76 113.62 110.35 3ii0 n SER 391 Ca -0.03 -0.63 0.13 0.00 -0.26 0.00 0.00 58.87 58.08 3ii0 n SER 391 Cb 0.19 -0.04 0.34 0.00 -0.26 0.00 0.00 64.21 64.43 3ii0 n SER 391 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3ii0 n GLY 392 N 0.50 -1.51 3.85 5.00 0.00 -0.42 -2.56 105.19 110.05 3ii0 n GLY 392 Ca 0.17 -0.16 -0.32 0.00 0.00 0.00 0.00 46.02 45.71 3ii0 n GLY 392 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3ii0 s LEU 393 N -3.97 3.99 0.09 0.99 1.43 -0.72 -4.88 118.68 115.60 3ii0 s LEU 393 Ca 0.10 1.35 -0.08 0.00 -1.03 0.00 0.00 54.13 54.46 3ii0 s LEU 393 Cb 0.14 -4.17 -0.01 0.00 0.03 0.00 0.00 46.19 42.18 3ii0 s LEU 393 CO 0.64 -0.28 0.18 0.42 0.23 0.00 0.00 176.35 177.54 3ii0 s THR 394 N -2.10 0.14 0.57 5.49 -4.23 -1.26 -4.88 115.64 109.37 3ii0 s THR 394 Ca 0.55 -1.27 0.27 0.00 -1.18 0.00 0.00 61.69 60.06 3ii0 s THR 394 Cb -0.10 -1.42 0.36 0.00 1.34 0.00 0.00 72.50 72.69 3ii0 s THR 394 CO 0.19 -0.65 2.07 0.71 -0.54 0.00 0.00 174.62 176.41 3ii0 h THR 395 N 2.77 0.56 0.03 3.99 1.35 -1.96 -0.62 112.91 119.02 3ii0 h THR 395 Ca -0.34 0.00 -0.24 0.00 -0.55 0.00 0.00 66.41 65.29 3ii0 h THR 395 Cb 1.20 0.82 -0.03 0.00 -1.73 0.00 0.00 68.15 68.41 3ii0 h THR 395 CO 0.56 0.00 -1.15 0.11 -0.25 0.00 0.00 175.52 174.79 3ii0 h LYS 396 N 0.00 0.06 -0.00 4.72 1.79 -1.96 -3.36 116.57 117.81 3ii0 h LYS 396 Ca 0.12 -0.10 0.00 0.00 -2.18 0.00 0.00 60.65 58.49 3ii0 h LYS 396 Cb 0.59 0.04 0.00 0.00 -1.58 0.00 0.00 32.23 31.28 3ii0 h LYS 396 CO -0.00 0.98 -0.90 0.27 -1.08 0.00 0.00 179.45 178.72 3ii0 n ASN 397 N -3.35 1.10 -0.08 0.86 0.23 -0.77 -4.64 115.26 108.62 3ii0 n ASN 397 Ca -0.04 -1.02 -0.07 0.00 -0.53 0.00 0.00 54.58 52.92 3ii0 n ASN 397 Cb 0.97 0.88 -0.01 0.00 -2.08 0.00 0.00 39.78 39.55 3ii0 n ASN 397 CO 0.00 0.00 0.00 -0.07 -0.93 0.00 0.00 177.26 176.26 3ii0 h LEU 398 N 0.32 -0.19 -1.00 -4.53 -0.00 -1.29 -0.85 115.31 107.76 3ii0 h LEU 398 Ca 0.00 0.08 -0.05 0.00 -0.00 0.00 0.00 57.88 57.90 3ii0 h LEU 398 Cb 0.53 0.15 -0.03 0.00 -0.00 0.00 0.00 40.66 41.32 3ii0 h LEU 398 CO 0.00 -0.06 0.13 0.44 -0.00 0.00 0.00 178.44 178.95 3ii0 h ASP 399 N 0.04 0.79 -0.47 -0.43 3.32 -1.83 0.57 116.42 118.41 3ii0 h ASP 399 Ca 0.14 -0.14 -0.13 0.00 0.02 0.00 0.00 57.03 56.91 3ii0 h ASP 399 Cb 0.20 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 39.53 3ii0 h ASP 399 CO -0.27 0.78 -0.23 0.22 -1.72 0.00 0.00 179.24 178.03 3ii0 h TYR 400 N 0.81 1.13 -0.28 4.55 3.20 -1.69 -1.29 116.97 123.40 3ii0 h TYR 400 Ca 0.18 -0.28 -0.07 0.00 3.14 0.00 0.00 58.73 61.70 3ii0 h TYR 400 Cb 0.31 -0.26 -0.01 0.00 1.54 0.00 0.00 36.73 38.31 3ii0 h TYR 400 CO 0.02 1.10 -0.10 0.28 -1.64 0.00 0.00 178.16 177.82 3ii0 h VAL 401 N 0.83 1.29 0.19 1.81 2.07 -0.83 -1.38 116.25 120.23 3ii0 h VAL 401 Ca 0.10 -1.16 -0.01 0.00 0.82 0.00 0.00 66.70 66.45 3ii0 h VAL 401 Cb 0.81 1.47 0.00 0.00 -1.52 0.00 0.00 31.29 32.05 3ii0 h VAL 401 CO 0.07 0.37 -0.09 0.00 0.02 0.00 0.00 177.57 177.94 3ii0 h ALA 402 N 0.76 -0.25 -0.94 1.67 0.00 -0.86 -0.75 119.26 118.89 3ii0 h ALA 402 Ca 0.07 -0.10 -0.00 0.00 0.00 0.00 0.00 54.91 54.88 3ii0 h ALA 402 Cb 0.60 0.10 -0.05 0.00 0.00 0.00 0.00 17.79 18.44 3ii0 h ALA 402 CO 0.03 -0.59 0.58 1.79 0.00 0.00 0.00 179.25 181.07 3ii0 h THR 403 N -0.35 1.25 -0.44 0.00 1.35 -1.27 -0.81 112.91 112.64 3ii0 h THR 403 Ca -0.03 -0.53 -0.02 0.00 -0.55 0.00 0.00 66.41 65.29 3ii0 h THR 403 Cb 0.27 -0.09 -0.02 0.00 -1.73 0.00 0.00 68.15 66.58 3ii0 h THR 403 CO 0.04 0.26 0.20 0.28 -0.25 0.00 0.00 175.52 176.05 3ii0 h SER 404 N 1.29 0.58 -0.93 5.36 0.02 -1.07 -1.27 113.55 117.54 3ii0 h SER 404 Ca 0.34 -0.14 0.01 0.00 -0.84 0.00 0.00 61.79 61.15 3ii0 h SER 404 Cb -0.08 -0.15 -0.05 0.00 0.14 0.00 0.00 62.40 62.26 3ii0 h SER 404 CO -0.07 0.56 0.60 0.40 -1.14 0.00 0.00 176.83 177.19 3ii0 h ILE 405 N 0.56 1.24 -0.68 3.27 2.04 -0.68 -1.75 117.51 121.51 3ii0 h ILE 405 Ca 0.15 -0.46 0.00 0.00 1.00 0.00 0.00 64.86 65.56 3ii0 h ILE 405 Cb 0.14 -0.12 -0.03 0.00 -0.74 0.00 0.00 36.82 36.07 3ii0 h ILE 405 CO -0.02 0.24 0.44 -0.74 0.00 0.00 0.00 178.15 178.07 3ii0 h HIS 406 N 1.26 0.87 -0.14 1.37 2.76 -0.62 -0.67 115.15 119.98 3ii0 h HIS 406 Ca 0.34 0.01 -0.00 0.00 -2.20 0.00 0.00 60.37 58.52 3ii0 h HIS 406 Cb -0.13 -0.29 -0.01 0.00 1.55 0.00 0.00 27.41 28.53 3ii0 h HIS 406 CO 0.00 0.56 0.08 0.93 -1.30 0.00 0.00 177.93 178.20 3ii0 h GLU 407 N 0.92 0.20 -0.69 5.26 5.08 -0.89 -0.97 114.58 123.49 3ii0 h GLU 407 Ca 0.25 -0.02 -0.04 0.00 -1.00 0.00 0.00 59.36 58.54 3ii0 h GLU 407 Cb -0.08 -0.04 -0.03 0.00 0.50 0.00 0.00 28.75 29.10 3ii0 h GLU 407 CO -0.05 0.21 0.27 0.00 -1.00 0.00 0.00 179.01 178.44 3ii0 h ALA 408 N 0.98 1.17 -0.01 3.43 0.00 -0.90 -0.39 119.26 123.54 3ii0 h ALA 408 Ca 0.05 -0.18 -0.20 0.00 0.00 0.00 0.00 54.91 54.58 3ii0 h ALA 408 Cb 0.07 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.58 3ii0 h ALA 408 CO -0.01 0.60 -0.86 0.28 0.00 0.00 0.00 179.25 179.27 3ii0 h VAL 409 N 1.00 1.45 0.00 0.00 2.07 -0.93 -2.42 116.25 117.43 3ii0 h VAL 409 Ca 0.23 -2.46 -0.21 0.00 0.82 0.00 0.00 66.70 65.08 3ii0 h VAL 409 Cb 0.20 2.37 -0.03 0.00 -1.52 0.00 0.00 31.29 32.31 3ii0 h VAL 409 CO -0.02 0.73 -1.27 0.71 0.02 0.00 0.00 177.57 177.74 3ii0 h THR 410 N 0.17 0.98 0.04 2.57 1.35 -0.88 -3.38 112.91 113.75 3ii0 h THR 410 Ca -0.05 -2.63 -0.30 0.00 -0.55 0.00 0.00 66.41 62.89 3ii0 h THR 410 Cb 1.47 2.43 -0.04 0.00 -1.73 0.00 0.00 68.15 70.28 3ii0 h THR 410 CO 0.14 0.56 -1.67 0.11 -0.25 0.00 0.00 175.52 174.41 3ii0 h LYS 411 N 0.00 0.08 -4.71 4.72 1.57 -1.13 -3.45 116.57 113.65 3ii0 h LYS 411 Ca -0.14 -0.14 -0.69 0.00 -1.87 0.00 0.00 60.65 57.81 3ii0 h LYS 411 Cb 1.75 0.05 -0.30 0.00 0.08 0.00 0.00 32.23 33.81 3ii0 h LYS 411 CO 0.08 0.75 -0.64 0.42 -0.57 0.00 0.00 179.45 179.49 3ii0 s ILE 412 N -2.60 3.51 0.71 1.86 1.01 -0.91 -5.08 121.20 119.69 3ii0 s ILE 412 Ca -0.08 -1.22 -0.11 0.00 0.00 0.00 0.00 60.65 59.24 3ii0 s ILE 412 Cb 0.08 -2.99 0.02 0.00 0.01 0.00 0.00 42.46 39.57 3ii0 s ILE 412 CO 0.82 -0.15 1.09 0.00 0.00 0.00 0.00 174.94 176.70 3ii0 s ALA 413 N 1.35 2.77 0.20 9.38 0.00 -1.26 -4.73 121.76 129.47 3ii0 s ALA 413 Ca -0.03 -0.26 -0.09 0.00 0.00 0.00 0.00 51.96 51.58 3ii0 s ALA 413 Cb -0.20 -3.06 0.12 0.00 0.00 0.00 0.00 23.12 19.99 3ii0 s ALA 413 CO 0.01 -1.21 1.73 1.49 0.00 0.00 0.00 175.76 177.78 3ii0 h GLU 414 N -0.71 1.13 -4.54 0.00 4.57 -1.98 -3.43 114.58 109.62 3ii0 h GLU 414 Ca -0.45 -0.25 -0.55 0.00 -1.18 0.00 0.00 59.36 56.93 3ii0 h GLU 414 Cb 1.25 -0.16 -0.35 0.00 -0.16 0.00 0.00 28.75 29.33 3ii0 h GLU 414 CO 0.62 0.97 -0.82 1.21 -1.18 0.00 0.00 179.01 179.82 3ii0 s ASN 415 N -6.39 2.15 0.29 1.04 3.84 -1.26 -5.04 114.94 109.57 3ii0 s ASN 415 Ca -0.12 -0.35 -0.01 0.00 0.21 0.00 0.00 52.86 52.59 3ii0 s ASN 415 Cb 0.15 -0.94 0.49 0.00 -0.55 0.00 0.00 41.25 40.40 3ii0 s ASN 415 CO 0.84 -0.02 1.92 0.25 -2.79 0.00 0.00 177.10 177.30 3ii0 h LEU 416 N 7.48 0.94 -9.77 3.21 5.85 -2.01 -3.44 115.31 117.58 3ii0 h LEU 416 Ca -0.31 -0.00 -0.58 0.00 0.84 0.00 0.00 57.88 57.83 3ii0 h LEU 416 Cb 1.17 -0.21 -0.07 0.00 0.37 0.00 0.00 40.66 41.92 3ii0 h LEU 416 CO 0.47 0.62 -0.56 -0.31 -0.34 0.00 0.00 178.44 178.32 3ii0 s TYR 417 N -5.94 3.16 0.00 1.25 4.12 -1.26 -4.68 117.35 114.00 3ii0 s TYR 417 Ca -0.12 -0.01 0.00 0.00 0.02 0.00 0.00 57.07 56.96 3ii0 s TYR 417 Cb 0.19 -1.52 0.00 0.00 -1.52 0.00 0.00 41.96 39.11 3ii0 s TYR 417 CO 0.80 0.52 0.00 1.19 0.02 0.00 0.00 175.55 178.08 3ii0 n PHE 418 N -0.31 0.00 1.22 2.71 3.72 -1.26 -5.12 117.46 118.42 3ii0 n PHE 418 Ca -0.08 0.00 0.13 0.00 -0.05 0.00 0.00 57.45 57.45 3ii0 n PHE 418 Cb 0.54 0.00 0.29 0.00 -0.94 0.00 0.00 39.48 39.37 3ii0 n PHE 418 CO 0.00 0.00 0.00 1.04 -0.05 0.00 0.00 176.76 177.75