#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 2.38 0.08 0.52 0.24 -1.26 -4.68 118.33 115.61 3ii0 n VAL 16 Ca 0.00 -2.42 -0.12 0.00 -2.04 0.00 0.00 64.34 59.76 3ii0 n VAL 16 Cb 0.00 -0.29 -0.06 0.00 -1.47 0.00 0.00 33.84 32.02 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 1.16 -0.29 -1.27 1.34 5.85 -2.01 -2.24 115.31 117.84 3ii0 h LEU 17 Ca 0.11 0.04 -0.04 0.00 0.84 0.00 0.00 57.88 58.82 3ii0 h LEU 17 Cb 1.49 0.11 -0.02 0.00 0.37 0.00 0.00 40.66 42.61 3ii0 h LEU 17 CO 0.27 -0.16 0.01 -0.37 -0.34 0.00 0.00 178.44 177.86 3ii0 h VAL 18 N -0.21 1.19 -0.24 1.05 -1.51 -1.99 -1.09 116.25 113.44 3ii0 h VAL 18 Ca 0.02 -0.73 -0.13 0.00 -1.23 0.00 0.00 66.70 64.63 3ii0 h VAL 18 Cb 0.23 0.92 -0.01 0.00 -2.13 0.00 0.00 31.29 30.30 3ii0 h VAL 18 CO -0.06 0.25 -0.38 -0.26 -1.23 0.00 0.00 177.57 175.89 3ii0 h PHE 19 N 0.49 0.65 -0.49 5.19 0.05 -1.91 -0.77 116.94 120.16 3ii0 h PHE 19 Ca 0.11 -0.18 -0.04 0.00 3.82 0.00 0.00 57.97 61.68 3ii0 h PHE 19 Cb 0.30 -0.14 -0.02 0.00 2.00 0.00 0.00 35.95 38.08 3ii0 h PHE 19 CO 0.01 0.85 0.16 -0.22 -0.18 0.00 0.00 178.31 178.93 3ii0 h LYS 20 N 0.46 0.75 -0.33 1.51 1.63 -1.03 -0.48 116.57 119.08 3ii0 h LYS 20 Ca 0.04 -0.16 0.06 0.00 -0.85 0.00 0.00 60.65 59.74 3ii0 h LYS 20 Cb 0.87 -0.11 -0.05 0.00 -0.60 0.00 0.00 32.23 32.34 3ii0 h LYS 20 CO 0.07 0.70 0.01 -0.07 -3.45 0.00 0.00 179.45 176.72 3ii0 h LEU 21 N 0.66 -0.11 -0.45 5.20 3.38 -0.81 0.16 115.31 123.34 3ii0 h LEU 21 Ca 0.16 0.07 0.02 0.00 0.09 0.00 0.00 57.88 58.22 3ii0 h LEU 21 Cb 0.26 0.12 -0.03 0.00 0.09 0.00 0.00 40.66 41.10 3ii0 h LEU 21 CO -0.01 -0.02 0.27 0.74 0.09 0.00 0.00 178.44 179.51 3ii0 h THR 22 N 0.11 1.05 -0.79 0.22 2.02 -0.90 -0.16 112.91 114.46 3ii0 h THR 22 Ca 0.16 -0.19 0.01 0.00 0.77 0.00 0.00 66.41 67.16 3ii0 h THR 22 Cb 0.21 0.46 -0.04 0.00 -1.74 0.00 0.00 68.15 67.04 3ii0 h THR 22 CO -0.26 0.10 0.52 0.00 0.37 0.00 0.00 175.52 176.25 3ii0 h ALA 23 N 1.20 1.00 -0.51 6.16 0.00 -0.44 -0.29 119.26 126.37 3ii0 h ALA 23 Ca 0.18 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.04 3ii0 h ALA 23 Cb 0.01 -0.32 -0.03 0.00 0.00 0.00 0.00 17.79 17.45 3ii0 h ALA 23 CO -0.08 0.42 0.33 -0.44 0.00 0.00 0.00 179.25 179.48 3ii0 h ASP 24 N 1.07 0.60 -0.70 0.00 3.32 -0.41 -2.69 116.42 117.61 3ii0 h ASP 24 Ca 0.29 -0.03 0.02 0.00 0.02 0.00 0.00 57.03 57.33 3ii0 h ASP 24 Cb -0.12 -0.15 -0.04 0.00 0.22 0.00 0.00 39.33 39.24 3ii0 h ASP 24 CO -0.06 0.44 0.45 0.15 -1.72 0.00 0.00 179.24 178.51 3ii0 h PHE 25 N 0.69 0.85 -0.81 4.55 3.57 -0.19 -2.42 116.94 123.20 3ii0 h PHE 25 Ca 0.19 0.02 -0.02 0.00 3.53 0.00 0.00 57.97 61.69 3ii0 h PHE 25 Cb -0.06 -0.28 -0.04 0.00 2.79 0.00 0.00 35.95 38.36 3ii0 h PHE 25 CO -0.04 0.51 0.44 0.00 -2.23 0.00 0.00 178.31 176.99 3ii0 h ARG 26 N 0.90 1.13 0.00 1.11 3.08 -0.86 -2.65 114.38 117.10 3ii0 h ARG 26 Ca 0.27 -0.14 0.00 0.00 0.07 0.00 0.00 59.98 60.19 3ii0 h ARG 26 Cb -0.04 -0.22 0.00 0.00 0.08 0.00 0.00 29.97 29.79 3ii0 h ARG 26 CO -0.09 0.84 0.00 0.39 -1.07 0.00 0.00 179.97 180.04 3ii0 n GLU 27 N -4.40 0.26 -2.07 0.04 4.71 -1.03 -4.83 120.64 113.31 3ii0 n GLU 27 Ca 0.08 0.22 -0.42 0.00 -0.01 0.00 0.00 57.16 57.02 3ii0 n GLU 27 Cb 0.10 -1.80 -0.03 0.00 -1.01 0.00 0.00 31.44 28.70 3ii0 n GLU 27 CO 0.00 0.00 0.00 0.34 0.09 0.00 0.00 177.13 177.56 3ii0 s ASP 28 N -4.50 6.71 0.10 1.62 -1.08 -0.94 -4.91 116.67 113.68 3ii0 s ASP 28 Ca 0.11 2.21 0.25 0.00 -0.52 0.00 0.00 52.55 54.60 3ii0 s ASP 28 Cb 0.12 -2.54 0.96 0.00 -1.46 0.00 0.00 42.92 40.00 3ii0 s ASP 28 CO 0.59 -0.87 1.77 -0.81 0.52 0.00 0.00 175.17 176.37 3ii0 n PRO 29 N 6.52 0.11 -1.91 4.34 -0.04 -1.26 -4.87 135.00 137.88 3ii0 n PRO 29 Ca 0.16 0.17 -0.42 0.00 -0.04 0.00 0.00 63.50 63.37 3ii0 n PRO 29 Cb 0.43 -1.65 -0.03 0.00 -0.04 0.00 0.00 33.50 32.21 3ii0 n PRO 29 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 3ii0 s ASP 30 N -3.65 6.58 0.24 3.54 -1.08 -1.26 -4.87 116.67 116.17 3ii0 s ASP 30 Ca 0.10 2.54 0.23 0.00 -0.52 0.00 0.00 52.55 54.90 3ii0 s ASP 30 Cb 0.14 -2.57 0.95 0.00 -1.46 0.00 0.00 42.92 39.98 3ii0 s ASP 30 CO 0.48 -0.88 1.68 -0.81 0.52 0.00 0.00 175.17 176.16 3ii0 n PRO 31 N 5.26 0.18 0.00 4.34 -0.04 -1.26 -2.56 135.00 140.92 3ii0 n PRO 31 Ca 0.16 0.42 0.14 0.00 -0.04 0.00 0.00 63.50 64.18 3ii0 n PRO 31 Cb 0.40 -1.84 0.63 0.00 -0.04 0.00 0.00 33.50 32.65 3ii0 n PRO 31 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 3ii0 n ARG 32 N -2.18 0.53 -1.79 0.54 1.74 -1.26 -4.99 116.66 109.25 3ii0 n ARG 32 Ca 0.02 -0.14 -0.38 0.00 -0.77 0.00 0.00 57.85 56.58 3ii0 n ARG 32 Cb 0.21 -1.50 0.04 0.00 -1.02 0.00 0.00 32.46 30.20 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 -2.57 3.10 -0.02 5.56 -2.85 -1.06 -4.88 119.74 117.02 3ii0 s LYS 33 Ca 0.27 2.21 0.00 0.00 -1.00 0.00 0.00 55.97 57.45 3ii0 s LYS 33 Cb 0.20 -2.22 0.02 0.00 -2.06 0.00 0.00 37.83 33.77 3ii0 s LYS 33 CO 0.49 -1.21 0.01 0.08 0.10 0.00 0.00 175.35 174.82 3ii0 s VAL 34 N -1.32 0.05 -0.45 1.79 1.01 -0.52 -5.00 120.40 115.96 3ii0 s VAL 34 Ca 0.72 0.11 -0.19 0.00 0.00 0.00 0.00 61.98 62.63 3ii0 s VAL 34 Cb -0.40 -0.14 0.03 0.00 0.00 0.00 0.00 36.38 35.87 3ii0 s VAL 34 CO 0.47 0.09 0.55 0.21 0.00 0.00 0.00 175.10 176.41 3ii0 s ASN 35 N 0.77 6.24 -0.19 3.32 3.84 -1.26 -0.98 114.94 126.69 3ii0 s ASN 35 Ca -0.07 -0.65 0.14 0.00 0.21 0.00 0.00 52.86 52.50 3ii0 s ASN 35 Cb -0.10 -2.27 0.39 0.00 -0.55 0.00 0.00 41.25 38.72 3ii0 s ASN 35 CO -0.02 -0.72 1.23 0.18 -2.79 0.00 0.00 177.10 174.98 3ii0 n LEU 36 N 5.93 2.78 0.00 3.21 4.77 0.11 -4.73 117.00 129.07 3ii0 n LEU 36 Ca -0.05 -3.55 0.00 0.00 -0.03 0.00 0.00 56.01 52.38 3ii0 n LEU 36 Cb 0.47 -0.50 0.00 0.00 -2.33 0.00 0.00 43.42 41.05 3ii0 n LEU 36 CO 0.50 1.10 0.00 0.61 -1.33 0.00 0.00 177.39 178.27 3ii0 n GLY 37 N -1.20 1.43 3.72 -0.72 0.00 -0.86 -0.71 105.19 106.84 3ii0 n GLY 37 Ca 0.19 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.80 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 2.22 -1.67 1.61 3.14 -1.26 -4.07 118.33 118.30 3ii0 n VAL 38 Ca 0.00 -0.50 -0.40 0.00 -2.96 0.00 0.00 64.34 60.48 3ii0 n VAL 38 Cb 0.00 -1.67 -0.03 0.00 -1.06 0.00 0.00 33.84 31.08 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 0.71 2.81 3.14 7.55 0.00 -1.26 -4.79 105.19 113.35 3ii0 n GLY 39 Ca 0.05 -1.29 -0.31 0.00 0.00 0.00 0.00 46.02 44.47 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 5.46 2.08 0.32 4.61 0.00 -1.26 -4.99 121.76 127.99 3ii0 s ALA 40 Ca 0.56 -0.98 -0.29 0.00 0.00 0.00 0.00 51.96 51.25 3ii0 s ALA 40 Cb 0.10 -0.94 -0.10 0.00 0.00 0.00 0.00 23.12 22.18 3ii0 s ALA 40 CO 0.06 -0.03 1.40 -0.47 0.00 0.00 0.00 175.76 176.73 3ii0 s TYR 41 N 0.84 2.90 0.11 0.00 5.04 -1.26 -4.63 117.35 120.35 3ii0 s TYR 41 Ca -0.08 1.22 0.08 0.00 -2.44 0.00 0.00 57.07 55.85 3ii0 s TYR 41 Cb -0.15 -3.83 -0.04 0.00 0.35 0.00 0.00 41.96 38.29 3ii0 s TYR 41 CO -0.01 -2.46 -0.20 1.03 -1.34 0.00 0.00 175.55 172.57 3ii0 s ARG 42 N -1.44 1.11 0.93 4.97 1.81 -0.91 -4.29 118.95 121.13 3ii0 s ARG 42 Ca 0.53 -1.18 -0.12 0.00 -1.72 0.00 0.00 55.73 53.24 3ii0 s ARG 42 Cb -0.42 -1.31 0.15 0.00 -0.45 0.00 0.00 34.95 32.91 3ii0 s ARG 42 CO 0.53 0.30 1.11 0.95 -0.68 0.00 0.00 175.30 177.51 3ii0 s THR 43 N -1.34 2.20 0.44 0.02 -4.23 -0.55 -4.83 115.64 107.35 3ii0 s THR 43 Ca 0.07 0.07 0.35 0.00 -1.18 0.00 0.00 61.69 61.00 3ii0 s THR 43 Cb -0.09 -2.69 0.35 0.00 1.34 0.00 0.00 72.50 71.40 3ii0 s THR 43 CO 0.04 -0.09 2.07 -0.78 -0.54 0.00 0.00 174.62 175.33 3ii0 h ASP 44 N -1.61 0.00 -0.49 3.99 3.58 -1.91 0.33 116.42 120.31 3ii0 h ASP 44 Ca -0.52 0.00 0.00 0.00 0.42 0.00 0.00 57.03 56.93 3ii0 h ASP 44 Cb 1.32 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.37 3ii0 h ASP 44 CO 0.59 0.00 0.00 0.47 -2.88 0.00 0.00 179.24 177.42 3ii0 n ASP 45 N -2.80 3.41 -2.49 2.28 8.00 -1.26 -4.41 116.55 119.29 3ii0 n ASP 45 Ca -0.02 -2.25 -0.18 0.00 0.71 0.00 0.00 54.79 53.04 3ii0 n ASP 45 Cb 0.14 -0.46 0.03 0.00 -0.02 0.00 0.00 41.12 40.80 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 -3.06 2.96 0.61 0.00 3.76 -1.26 -4.87 115.29 113.44 3ii0 s HIS 47 Ca 0.24 -0.12 -0.19 0.00 -0.15 0.00 0.00 55.06 54.84 3ii0 s HIS 47 Cb -0.11 -1.38 -0.04 0.00 1.11 0.00 0.00 32.58 32.17 3ii0 s HIS 47 CO 0.29 0.54 1.08 -2.30 -0.85 0.00 0.00 174.74 173.51 3ii0 n PRO 48 N -0.66 1.01 -3.99 8.40 -0.02 -1.26 -1.49 135.00 136.99 3ii0 n PRO 48 Ca -0.08 0.39 -0.31 0.00 -2.02 0.00 0.00 63.50 61.48 3ii0 n PRO 48 Cb 0.57 -2.29 -0.15 0.00 -0.02 0.00 0.00 33.50 31.60 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 -1.46 3.05 -0.16 6.00 -0.00 -1.26 -4.77 118.94 120.34 3ii0 s TRP 49 Ca 0.78 -2.33 -0.29 0.00 -0.00 0.00 0.00 56.10 54.26 3ii0 s TRP 49 Cb -0.41 -2.12 -0.01 0.00 -0.00 0.00 0.00 33.47 30.94 3ii0 s TRP 49 CO 0.45 -0.87 1.20 0.08 -0.00 0.00 0.00 176.95 177.81 3ii0 s VAL 50 N 1.16 4.38 0.35 5.86 1.01 -1.26 -4.89 120.40 127.01 3ii0 s VAL 50 Ca -0.01 1.67 -0.29 0.00 0.00 0.00 0.00 61.98 63.36 3ii0 s VAL 50 Cb -0.19 -4.08 -0.11 0.00 0.00 0.00 0.00 36.38 32.00 3ii0 s VAL 50 CO -0.08 -0.12 1.50 -0.76 0.00 0.00 0.00 175.10 175.64 3ii0 s LEU 51 N 3.21 4.33 0.31 3.92 1.02 -1.26 -4.80 118.68 125.41 3ii0 s LEU 51 Ca 0.52 3.00 0.04 0.00 0.02 0.00 0.00 54.13 57.71 3ii0 s LEU 51 Cb -0.21 -3.66 0.63 0.00 0.02 0.00 0.00 46.19 42.98 3ii0 s LEU 51 CO 0.14 -0.86 1.86 -0.65 0.02 0.00 0.00 176.35 176.85 3ii0 h PRO 52 N 3.50 0.88 -0.15 1.29 0.11 -1.97 0.14 132.00 135.81 3ii0 h PRO 52 Ca -0.50 -0.05 -0.01 0.00 0.11 0.00 0.00 66.00 65.55 3ii0 h PRO 52 Cb 1.23 -0.20 -0.01 0.00 0.11 0.00 0.00 31.00 32.14 3ii0 h PRO 52 CO 0.68 0.58 0.03 -0.24 -0.21 0.00 0.00 178.00 178.84 3ii0 h VAL 53 N 0.91 1.08 -0.10 3.15 3.04 -1.90 -2.22 116.25 120.21 3ii0 h VAL 53 Ca 0.47 -0.30 -0.14 0.00 -1.01 0.00 0.00 66.70 65.71 3ii0 h VAL 53 Cb 0.52 0.94 0.01 0.00 -2.01 0.00 0.00 31.29 30.75 3ii0 h VAL 53 CO -0.23 0.10 -0.49 0.58 -1.01 0.00 0.00 177.57 176.52 3ii0 h VAL 54 N 0.21 1.37 -0.81 1.51 2.07 -1.09 -1.88 116.25 117.64 3ii0 h VAL 54 Ca 0.05 -1.82 0.09 0.00 0.82 0.00 0.00 66.70 65.84 3ii0 h VAL 54 Cb 0.10 2.19 -0.07 0.00 -1.52 0.00 0.00 31.29 32.00 3ii0 h VAL 54 CO -0.00 0.55 0.46 0.11 0.02 0.00 0.00 177.57 178.70 3ii0 h LYS 55 N 0.11 0.76 -0.21 1.57 1.79 -1.04 -0.20 116.57 119.35 3ii0 h LYS 55 Ca -0.03 -0.05 -0.05 0.00 -2.18 0.00 0.00 60.65 58.34 3ii0 h LYS 55 Cb 1.14 -0.17 -0.01 0.00 -1.58 0.00 0.00 32.23 31.61 3ii0 h LYS 55 CO 0.10 0.50 -0.05 -0.22 -1.08 0.00 0.00 179.45 178.70 3ii0 h LYS 56 N 0.78 0.42 -0.45 3.15 3.64 -1.35 -2.28 116.57 120.48 3ii0 h LYS 56 Ca 0.38 -0.16 -0.11 0.00 -1.27 0.00 0.00 60.65 59.50 3ii0 h LYS 56 Cb 0.33 -0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 32.11 3ii0 h LYS 56 CO -0.24 0.66 -0.14 0.28 -2.27 0.00 0.00 179.45 177.74 3ii0 h VAL 57 N 0.14 1.26 -0.91 2.00 2.07 -1.16 -2.07 116.25 117.58 3ii0 h VAL 57 Ca 0.05 -1.24 0.11 0.00 0.82 0.00 0.00 66.70 66.44 3ii0 h VAL 57 Cb 0.51 1.07 -0.08 0.00 -1.52 0.00 0.00 31.29 31.27 3ii0 h VAL 57 CO 0.02 0.43 0.54 -0.33 0.02 0.00 0.00 177.57 178.25 3ii0 h GLU 58 N 0.75 0.85 -0.51 1.57 5.08 -0.96 -0.29 114.58 121.07 3ii0 h GLU 58 Ca 0.12 -0.05 -0.12 0.00 -1.00 0.00 0.00 59.36 58.30 3ii0 h GLU 58 Cb 0.65 -0.19 -0.02 0.00 0.50 0.00 0.00 28.75 29.70 3ii0 h GLU 58 CO 0.05 0.56 -0.16 1.96 -1.00 0.00 0.00 179.01 180.42 3ii0 h GLN 59 N 0.88 1.01 -0.66 2.33 1.08 -1.06 -1.25 115.11 117.44 3ii0 h GLN 59 Ca 0.45 -0.41 -0.01 0.00 -1.45 0.00 0.00 58.65 57.23 3ii0 h GLN 59 Cb 0.44 -0.05 -0.03 0.00 -0.05 0.00 0.00 27.48 27.79 3ii0 h GLN 59 CO -0.27 1.09 0.37 0.87 -0.95 0.00 0.00 178.83 179.94 3ii0 h LYS 60 N 0.88 0.91 -0.26 1.46 1.57 -0.65 -1.21 116.57 119.28 3ii0 h LYS 60 Ca 0.13 -0.10 0.00 0.00 -1.87 0.00 0.00 60.65 58.81 3ii0 h LYS 60 Cb 0.74 -0.18 -0.01 0.00 0.08 0.00 0.00 32.23 32.85 3ii0 h LYS 60 CO 0.06 0.68 0.17 0.82 -0.57 0.00 0.00 179.45 180.61 3ii0 h ILE 61 N 0.90 1.06 -0.54 1.86 2.04 -0.98 -0.87 117.51 120.97 3ii0 h ILE 61 Ca 0.23 -0.12 -0.01 0.00 1.00 0.00 0.00 64.86 65.97 3ii0 h ILE 61 Cb 0.03 0.68 -0.03 0.00 -0.74 0.00 0.00 36.82 36.76 3ii0 h ILE 61 CO -0.04 0.06 0.30 0.00 0.00 0.00 0.00 178.15 178.48 3ii0 h ALA 62 N 1.10 1.52 0.00 1.87 0.00 -0.90 -2.37 119.26 120.48 3ii0 h ALA 62 Ca 0.10 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.93 3ii0 h ALA 62 Cb -0.03 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 17.54 3ii0 h ALA 62 CO -0.03 0.41 -0.35 0.09 0.00 0.00 0.00 179.25 179.37 3ii0 n ASN 63 N -4.41 0.39 -4.47 0.00 3.02 -0.49 -4.76 115.26 104.54 3ii0 n ASN 63 Ca 0.05 0.05 -0.43 0.00 -0.03 0.00 0.00 54.58 54.22 3ii0 n ASN 63 Cb 0.09 -0.02 -0.04 0.00 -0.61 0.00 0.00 39.78 39.20 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 -3.20 6.21 0.00 6.41 -1.08 -0.36 -4.90 116.67 119.75 3ii0 s ASP 64 Ca 0.11 -0.83 0.28 0.00 -0.52 0.00 0.00 52.55 51.59 3ii0 s ASP 64 Cb 0.17 -2.43 1.29 0.00 -1.46 0.00 0.00 42.92 40.50 3ii0 s ASP 64 CO 0.65 -1.41 1.92 0.59 0.52 0.00 0.00 175.17 177.44 3ii0 n ASN 65 N 7.72 0.00 0.05 -0.34 3.02 -1.26 -3.02 115.26 121.43 3ii0 n ASN 65 Ca -0.02 0.21 0.11 0.00 -0.03 0.00 0.00 54.58 54.85 3ii0 n ASN 65 Cb 0.46 -0.40 0.46 0.00 -0.61 0.00 0.00 39.78 39.69 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 -1.40 0.31 -4.74 6.41 3.41 -1.26 -4.85 113.62 111.50 3ii0 n SER 66 Ca 0.10 0.55 -0.40 0.00 -0.26 0.00 0.00 58.87 58.86 3ii0 n SER 66 Cb 0.28 -0.63 -0.05 0.00 -0.26 0.00 0.00 64.21 63.55 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 -3.63 4.48 0.00 1.04 1.43 -1.17 -5.05 118.68 115.78 3ii0 s LEU 67 Ca 0.09 1.56 0.01 0.00 -1.03 0.00 0.00 54.13 54.75 3ii0 s LEU 67 Cb 0.13 -3.33 0.01 0.00 0.03 0.00 0.00 46.19 43.03 3ii0 s LEU 67 CO 0.44 0.01 0.04 -0.46 0.23 0.00 0.00 176.35 176.62 3ii0 n ASN 68 N 2.68 2.27 -0.56 2.29 0.23 -1.26 -5.07 115.26 115.84 3ii0 n ASN 68 Ca -0.02 -1.78 0.06 0.00 -0.53 0.00 0.00 54.58 52.31 3ii0 n ASN 68 Cb 0.50 0.09 0.19 0.00 -2.08 0.00 0.00 39.78 38.48 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 -0.61 0.30 -1.99 -2.53 8.25 -1.26 -5.05 115.22 112.32 3ii0 n HIS 69 Ca -0.06 -1.28 -0.34 0.00 -0.26 0.00 0.00 57.72 55.78 3ii0 n HIS 69 Cb 0.23 -0.27 0.02 0.00 1.12 0.00 0.00 29.99 31.10 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 -3.08 3.11 0.23 -0.41 0.41 -1.26 -4.90 118.70 112.81 3ii0 s GLU 70 Ca 0.38 1.42 -0.30 0.00 -0.41 0.00 0.00 54.97 56.05 3ii0 s GLU 70 Cb 0.34 -1.99 -0.15 0.00 -1.78 0.00 0.00 34.13 30.56 3ii0 s GLU 70 CO -0.01 -1.01 1.06 0.66 -0.49 0.00 0.00 175.26 175.47 3ii0 n TYR 71 N -1.95 1.21 -1.58 1.61 4.01 -1.26 -4.97 117.16 114.23 3ii0 n TYR 71 Ca 0.10 0.70 -0.30 0.00 -0.16 0.00 0.00 57.90 58.24 3ii0 n TYR 71 Cb 0.52 -2.25 0.08 0.00 -0.31 0.00 0.00 39.34 37.37 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 0.67 2.78 0.72 7.72 1.43 -1.26 -5.02 118.68 125.72 3ii0 s LEU 72 Ca 0.65 1.39 -0.16 0.00 -1.03 0.00 0.00 54.13 54.99 3ii0 s LEU 72 Cb -0.78 -4.10 -0.01 0.00 0.03 0.00 0.00 46.19 41.34 3ii0 s LEU 72 CO 0.56 -1.77 0.82 -2.65 0.23 0.00 0.00 176.35 173.55 3ii0 n PRO 73 N -3.31 0.43 -0.27 1.29 -0.02 -1.26 -4.81 135.00 127.05 3ii0 n PRO 73 Ca 0.07 0.20 0.08 0.00 -2.02 0.00 0.00 63.50 61.83 3ii0 n PRO 73 Cb 0.55 -2.09 0.22 0.00 -0.02 0.00 0.00 33.50 32.17 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 -0.30 0.45 0.00 4.25 2.04 -1.96 0.44 117.51 122.43 3ii0 h ILE 74 Ca -0.47 -0.09 0.00 0.00 1.00 0.00 0.00 64.86 65.30 3ii0 h ILE 74 Cb 1.34 0.16 0.00 0.00 -0.74 0.00 0.00 36.82 37.58 3ii0 h ILE 74 CO 0.45 0.05 -0.14 0.18 0.00 0.00 0.00 178.15 178.69 3ii0 n LEU 75 N -5.17 0.15 0.00 1.44 4.77 -1.26 -4.31 117.00 112.62 3ii0 n LEU 75 Ca 0.17 0.36 0.00 0.00 -0.03 0.00 0.00 56.01 56.51 3ii0 n LEU 75 Cb 0.54 -0.43 0.00 0.00 -2.33 0.00 0.00 43.42 41.20 3ii0 n LEU 75 CO 0.11 0.03 0.00 0.61 -1.33 0.00 0.00 177.39 176.81 3ii0 n GLY 76 N 1.50 -1.27 3.68 -0.72 0.00 0.14 -0.58 105.19 107.94 3ii0 n GLY 76 Ca 0.07 -2.21 -0.42 0.00 0.00 0.00 0.00 46.02 43.45 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 4.32 0.09 0.99 2.96 -1.26 -4.37 118.68 121.41 3ii0 s LEU 77 Ca 0.00 2.22 -0.28 0.00 -0.22 0.00 0.00 54.13 55.85 3ii0 s LEU 77 Cb 0.00 -3.55 -0.15 0.00 0.50 0.00 0.00 46.19 42.99 3ii0 s LEU 77 CO 0.00 -0.84 1.67 0.00 -1.32 0.00 0.00 176.35 175.86 3ii0 h ALA 78 N 8.62 -0.49 -0.87 5.97 0.00 -1.99 -0.88 119.26 129.62 3ii0 h ALA 78 Ca -0.39 -0.10 0.12 0.00 0.00 0.00 0.00 54.91 54.54 3ii0 h ALA 78 Cb 1.18 0.23 -0.08 0.00 0.00 0.00 0.00 17.79 19.12 3ii0 h ALA 78 CO 0.93 -0.78 0.50 1.49 0.00 0.00 0.00 179.25 181.39 3ii0 h GLU 79 N -0.50 0.76 -0.11 0.00 4.81 -1.99 -0.45 114.58 117.10 3ii0 h GLU 79 Ca -0.04 -0.05 -0.01 0.00 -0.13 0.00 0.00 59.36 59.14 3ii0 h GLU 79 Cb 0.41 -0.17 -0.00 0.00 0.63 0.00 0.00 28.75 29.61 3ii0 h GLU 79 CO 0.04 0.50 0.04 0.35 -0.73 0.00 0.00 179.01 179.22 3ii0 h PHE 80 N 0.78 0.17 -0.62 0.92 3.57 -1.71 -0.61 116.94 119.43 3ii0 h PHE 80 Ca 0.44 -0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.90 3ii0 h PHE 80 Cb 0.49 -0.05 -0.03 0.00 2.79 0.00 0.00 35.95 39.16 3ii0 h PHE 80 CO -0.06 0.27 0.28 0.00 -2.23 0.00 0.00 178.31 176.58 3ii0 h ARG 81 N 0.02 0.91 0.17 1.11 3.08 -0.60 -0.02 114.38 119.06 3ii0 h ARG 81 Ca 0.04 -0.14 -0.01 0.00 0.07 0.00 0.00 59.98 59.93 3ii0 h ARG 81 Cb 0.17 -0.16 0.00 0.00 0.08 0.00 0.00 29.97 30.07 3ii0 h ARG 81 CO -0.00 0.74 -0.08 0.77 -1.07 0.00 0.00 179.97 180.33 3ii0 h SER 82 N 0.86 -0.20 -0.95 7.04 0.02 -1.04 -2.41 113.55 116.87 3ii0 h SER 82 Ca 0.21 -0.08 0.03 0.00 -0.84 0.00 0.00 61.79 61.11 3ii0 h SER 82 Cb 0.15 0.05 -0.05 0.00 0.14 0.00 0.00 62.40 62.68 3ii0 h SER 82 CO -0.02 -0.04 0.62 0.00 -1.14 0.00 0.00 176.83 176.25 3ii0 h ALA 84 N 1.44 0.39 -0.08 0.00 0.00 -0.93 -1.46 119.26 118.62 3ii0 h ALA 84 Ca 0.37 -0.15 -0.18 0.00 0.00 0.00 0.00 54.91 54.96 3ii0 h ALA 84 Cb -0.01 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 3ii0 h ALA 84 CO -0.11 0.02 -0.70 0.77 0.00 0.00 0.00 179.25 179.23 3ii0 h SER 85 N 0.32 0.43 -0.79 0.00 0.02 -1.21 -2.57 113.55 109.76 3ii0 h SER 85 Ca 0.10 -0.27 -0.02 0.00 -0.84 0.00 0.00 61.79 60.75 3ii0 h SER 85 Cb 0.24 -0.13 -0.04 0.00 0.14 0.00 0.00 62.40 62.61 3ii0 h SER 85 CO -0.00 1.00 0.41 -0.09 -1.14 0.00 0.00 176.83 177.00 3ii0 h ARG 86 N 0.25 1.13 -0.78 3.45 2.43 -1.13 0.81 114.38 120.54 3ii0 h ARG 86 Ca -0.02 -0.15 -0.02 0.00 -0.81 0.00 0.00 59.98 58.98 3ii0 h ARG 86 Cb 1.26 -0.21 -0.04 0.00 -0.42 0.00 0.00 29.97 30.56 3ii0 h ARG 86 CO 0.12 0.85 0.43 1.25 -1.51 0.00 0.00 179.97 181.10 3ii0 h LEU 87 N 1.12 0.99 -0.09 3.80 5.85 -0.89 0.11 115.31 126.20 3ii0 h LEU 87 Ca 0.28 -0.10 -0.03 0.00 0.84 0.00 0.00 57.88 58.87 3ii0 h LEU 87 Cb 0.08 -0.25 -0.00 0.00 0.37 0.00 0.00 40.66 40.85 3ii0 h LEU 87 CO -0.04 0.80 -0.05 0.00 -0.34 0.00 0.00 178.44 178.82 3ii0 h ALA 88 N 1.22 0.13 0.00 1.25 0.00 -1.06 -3.37 119.26 117.43 3ii0 h ALA 88 Ca 0.28 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.94 3ii0 h ALA 88 Cb 0.04 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.80 3ii0 h ALA 88 CO -0.04 -0.10 -1.26 1.28 0.00 0.00 0.00 179.25 179.13 3ii0 n LEU 89 N -4.74 0.55 0.00 0.00 4.77 0.23 -4.64 117.00 113.17 3ii0 n LEU 89 Ca -0.07 0.11 0.00 0.00 -0.03 0.00 0.00 56.01 56.02 3ii0 n LEU 89 Cb 0.27 -0.06 0.00 0.00 -2.33 0.00 0.00 43.42 41.30 3ii0 n LEU 89 CO 0.36 -0.05 0.00 0.61 -1.33 0.00 0.00 177.39 176.98 3ii0 n GLY 90 N 1.27 0.67 0.35 -0.72 0.00 0.36 -4.32 105.19 102.81 3ii0 n GLY 90 Ca -0.00 -1.43 0.16 0.00 0.00 0.00 0.00 46.02 44.75 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 0.70 -0.45 1.61 3.45 -1.94 -1.43 116.42 118.36 3ii0 h ASP 91 Ca 0.00 0.12 0.00 0.00 0.43 0.00 0.00 57.03 57.58 3ii0 h ASP 91 Cb 0.00 0.01 0.00 0.00 -0.56 0.00 0.00 39.33 38.78 3ii0 h ASP 91 CO 0.00 0.15 0.00 -0.90 -1.57 0.00 0.00 179.24 176.92 3ii0 n ASP 92 N -4.83 2.68 -4.63 6.45 5.68 -1.26 -4.95 116.55 115.68 3ii0 n ASP 92 Ca 0.26 -2.08 -0.50 0.00 -0.50 0.00 0.00 54.79 51.97 3ii0 n ASP 92 Cb 0.70 -0.35 -0.05 0.00 -1.14 0.00 0.00 41.12 40.28 3ii0 n ASP 92 CO 0.00 0.00 0.00 -0.24 -1.33 0.00 0.00 177.20 175.63 3ii0 n SER 93 N 0.78 2.34 0.05 -1.12 2.88 -0.54 -4.85 113.62 113.16 3ii0 n SER 93 Ca 0.16 1.10 0.08 0.00 -1.33 0.00 0.00 58.87 58.88 3ii0 n SER 93 Cb 0.45 -1.29 0.52 0.00 -0.75 0.00 0.00 64.21 63.15 3ii0 n SER 93 CO 0.00 0.00 0.00 -0.65 -1.23 0.00 0.00 175.04 173.16 3ii0 h PRO 94 N 5.47 0.32 -0.81 -1.46 0.11 -1.92 -2.28 132.00 131.43 3ii0 h PRO 94 Ca -0.47 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.63 3ii0 h PRO 94 Cb 1.30 -0.07 -0.04 0.00 0.11 0.00 0.00 31.00 32.30 3ii0 h PRO 94 CO 0.84 0.21 0.52 0.00 -0.21 0.00 0.00 178.00 179.36 3ii0 h ALA 95 N 1.80 1.40 -0.38 -0.75 0.00 -1.95 0.80 119.26 120.17 3ii0 h ALA 95 Ca 0.15 -0.07 -0.11 0.00 0.00 0.00 0.00 54.91 54.89 3ii0 h ALA 95 Cb 0.19 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.65 3ii0 h ALA 95 CO -0.03 0.55 -0.18 -0.07 0.00 0.00 0.00 179.25 179.51 3ii0 h LEU 96 N 1.11 0.82 -0.85 0.00 3.38 -1.79 -1.22 115.31 116.75 3ii0 h LEU 96 Ca 0.30 -0.41 -0.03 0.00 0.09 0.00 0.00 57.88 57.83 3ii0 h LEU 96 Cb -0.11 -0.23 -0.04 0.00 0.09 0.00 0.00 40.66 40.38 3ii0 h LEU 96 CO -0.06 1.04 0.42 0.11 0.09 0.00 0.00 178.44 180.04 3ii0 h LYS 97 N 0.59 1.21 -0.12 1.13 1.57 -0.86 -2.17 116.57 117.92 3ii0 h LYS 97 Ca 0.08 -0.17 0.00 0.00 -1.87 0.00 0.00 60.65 58.70 3ii0 h LYS 97 Cb 0.73 -0.22 0.00 0.00 0.08 0.00 0.00 32.23 32.82 3ii0 h LYS 97 CO 0.06 0.92 0.00 0.39 -0.57 0.00 0.00 179.45 180.24 3ii0 n GLU 98 N -4.33 1.45 -3.85 3.15 1.02 0.20 -4.92 120.64 113.36 3ii0 n GLU 98 Ca 0.08 -0.68 -0.26 0.00 -0.02 0.00 0.00 57.16 56.29 3ii0 n GLU 98 Cb 0.13 -1.31 0.02 0.00 -0.02 0.00 0.00 31.44 30.25 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 -0.07 -4.68 -1.86 3.49 5.02 -0.82 -4.54 118.16 114.70 3ii0 n LYS 99 Ca 0.13 0.56 -0.22 0.00 -2.02 0.00 0.00 58.31 56.76 3ii0 n LYS 99 Cb 0.21 -5.14 0.04 0.00 -0.02 0.00 0.00 35.03 30.12 3ii0 n LYS 99 CO 0.00 0.00 0.00 2.89 -0.52 0.00 0.00 177.40 179.77 3ii0 n ARG 100 N -4.43 3.40 -4.52 1.97 1.85 -0.52 -3.90 116.66 110.51 3ii0 n ARG 100 Ca -0.18 -4.05 -0.22 0.00 -1.00 0.00 0.00 57.85 52.41 3ii0 n ARG 100 Cb 0.62 -2.22 -0.15 0.00 -1.05 0.00 0.00 32.46 29.65 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 -4.49 0.96 0.25 8.89 1.01 -1.26 -1.18 120.40 124.58 3ii0 s VAL 101 Ca 0.51 -0.47 0.09 0.00 0.00 0.00 0.00 61.98 62.10 3ii0 s VAL 101 Cb 0.41 -0.83 -0.05 0.00 0.00 0.00 0.00 36.38 35.91 3ii0 s VAL 101 CO 0.03 0.29 -0.14 -0.83 0.00 0.00 0.00 175.10 174.44 3ii0 s GLY 102 N 0.04 1.72 -0.07 4.51 0.00 0.56 -4.98 107.32 109.10 3ii0 s GLY 102 Ca -0.01 -1.81 -0.03 0.00 0.00 0.00 0.00 44.72 42.86 3ii0 s GLY 102 CO 0.01 -1.86 0.16 -0.32 0.00 0.00 0.00 173.10 171.08 3ii0 s GLY 103 N -3.43 -0.06 -0.25 0.20 0.00 -1.26 -0.50 107.32 102.03 3ii0 s GLY 103 Ca 0.27 0.70 -0.01 0.00 0.00 0.00 0.00 44.72 45.67 3ii0 s GLY 103 CO 0.11 0.95 -0.06 0.14 0.00 0.00 0.00 173.10 174.24 3ii0 s VAL 104 N 1.04 2.86 0.26 1.40 1.01 -0.15 -4.93 120.40 121.88 3ii0 s VAL 104 Ca -0.08 -1.05 -0.30 0.00 0.00 0.00 0.00 61.98 60.55 3ii0 s VAL 104 Cb -0.10 -2.46 -0.10 0.00 0.00 0.00 0.00 36.38 33.72 3ii0 s VAL 104 CO -0.06 0.18 1.45 -1.58 0.00 0.00 0.00 175.10 175.10 3ii0 s GLN 105 N 1.32 4.25 0.18 2.72 0.74 0.25 -0.01 119.66 129.11 3ii0 s GLN 105 Ca -0.00 2.33 -0.01 0.00 0.05 0.00 0.00 55.36 57.73 3ii0 s GLN 105 Cb -0.17 -3.10 -0.04 0.00 1.10 0.00 0.00 33.01 30.80 3ii0 s GLN 105 CO -0.04 -0.43 0.10 -1.54 -0.55 0.00 0.00 175.29 172.82 3ii0 s SER 106 N 0.34 0.29 -1.19 6.67 1.04 0.04 -4.78 113.70 116.11 3ii0 s SER 106 Ca 0.59 -1.33 -0.16 0.00 0.48 0.00 0.00 55.95 55.53 3ii0 s SER 106 Cb -0.42 0.33 0.13 0.00 0.10 0.00 0.00 66.02 66.15 3ii0 s SER 106 CO 0.44 -0.79 1.49 -0.76 0.98 0.00 0.00 173.24 174.61 3ii0 s LEU 107 N -3.13 4.55 0.00 2.42 2.01 -1.26 -1.37 118.68 121.90 3ii0 s LEU 107 Ca 0.34 -2.59 0.00 0.00 0.01 0.00 0.00 54.13 51.89 3ii0 s LEU 107 Cb 0.07 -2.47 0.00 0.00 0.01 0.00 0.00 46.19 43.80 3ii0 s LEU 107 CO 0.09 -0.98 0.00 0.61 1.01 0.00 0.00 176.35 177.08 3ii0 n GLY 108 N 4.89 -1.94 0.36 -3.19 0.00 -1.05 -0.96 105.19 103.30 3ii0 n GLY 108 Ca 0.39 -1.31 0.04 0.00 0.00 0.00 0.00 46.02 45.13 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 -0.49 1.30 0.49 -0.02 0.00 -1.78 -2.62 103.07 99.95 3ii0 h GLY 109 Ca 0.01 -0.42 0.06 0.00 0.00 0.00 0.00 47.33 46.98 3ii0 h GLY 109 CO 0.00 0.31 0.02 -0.84 0.00 0.00 0.00 176.54 176.04 3ii0 h THR 110 N 1.04 0.77 -0.86 4.70 2.02 -1.92 -0.82 112.91 117.83 3ii0 h THR 110 Ca 0.38 -0.04 -0.02 0.00 0.77 0.00 0.00 66.41 67.49 3ii0 h THR 110 Cb 0.16 0.63 -0.04 0.00 -1.74 0.00 0.00 68.15 67.16 3ii0 h THR 110 CO -0.14 0.02 0.45 1.23 0.37 0.00 0.00 175.52 177.45 3ii0 h GLY 111 N 0.13 1.31 0.93 2.16 0.00 -0.81 -0.58 103.07 106.21 3ii0 h GLY 111 Ca 0.17 -0.62 -0.02 0.00 0.00 0.00 0.00 47.33 46.86 3ii0 h GLY 111 CO -0.26 0.59 0.14 0.00 0.00 0.00 0.00 176.54 177.01 3ii0 h ALA 112 N 1.24 0.47 -0.69 3.60 0.00 -1.10 -0.96 119.26 121.82 3ii0 h ALA 112 Ca 0.30 -0.14 -0.06 0.00 0.00 0.00 0.00 54.91 55.02 3ii0 h ALA 112 Cb 0.07 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.69 3ii0 h ALA 112 CO -0.04 0.08 0.21 -0.07 0.00 0.00 0.00 179.25 179.42 3ii0 h LEU 113 N 0.43 1.01 -0.23 0.00 3.38 -0.61 -1.87 115.31 117.42 3ii0 h LEU 113 Ca 0.12 -0.21 -0.04 0.00 0.09 0.00 0.00 57.88 57.84 3ii0 h LEU 113 Cb 0.20 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.67 3ii0 h LEU 113 CO -0.01 0.95 0.00 -0.09 0.09 0.00 0.00 178.44 179.39 3ii0 h ARG 114 N 1.01 0.40 -0.78 1.13 9.65 -0.90 0.73 114.38 125.62 3ii0 h ARG 114 Ca 0.22 -0.12 -0.01 0.00 -1.10 0.00 0.00 59.98 58.97 3ii0 h ARG 114 Cb 0.31 -0.04 -0.04 0.00 -1.39 0.00 0.00 29.97 28.82 3ii0 h ARG 114 CO -0.01 0.58 0.46 0.82 2.80 0.00 0.00 179.97 184.62 3ii0 h ILE 115 N 0.17 1.23 -0.39 1.20 1.08 -1.12 -0.18 117.51 119.49 3ii0 h ILE 115 Ca 0.06 -0.52 -0.07 0.00 -0.39 0.00 0.00 64.86 63.95 3ii0 h ILE 115 Cb 0.40 0.15 -0.01 0.00 -3.07 0.00 0.00 36.82 34.28 3ii0 h ILE 115 CO 0.01 0.24 -0.01 1.23 -0.69 0.00 0.00 178.15 178.93 3ii0 h GLY 116 N 1.08 0.75 0.94 5.37 0.00 -1.18 -2.01 103.07 108.02 3ii0 h GLY 116 Ca 0.28 -0.56 0.01 0.00 0.00 0.00 0.00 47.33 47.06 3ii0 h GLY 116 CO -0.05 0.52 0.31 0.00 0.00 0.00 0.00 176.54 177.32 3ii0 h ALA 117 N 0.88 0.63 -0.42 3.60 0.00 -0.50 -1.84 119.26 121.60 3ii0 h ALA 117 Ca 0.11 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.98 3ii0 h ALA 117 Cb 0.49 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.09 3ii0 h ALA 117 CO 0.02 0.03 0.16 -0.44 0.00 0.00 0.00 179.25 179.03 3ii0 h ASP 118 N 0.63 0.54 -0.07 0.00 3.32 -0.89 -1.48 116.42 118.47 3ii0 h ASP 118 Ca 0.19 -0.06 -0.01 0.00 0.02 0.00 0.00 57.03 57.17 3ii0 h ASP 118 Cb -0.03 -0.14 -0.00 0.00 0.22 0.00 0.00 39.33 39.38 3ii0 h ASP 118 CO -0.07 0.50 0.01 0.15 -1.72 0.00 0.00 179.24 178.11 3ii0 h PHE 119 N 0.60 0.12 -0.61 4.55 3.04 -0.78 -2.71 116.94 121.14 3ii0 h PHE 119 Ca 0.15 -0.02 0.02 0.00 3.98 0.00 0.00 57.97 62.10 3ii0 h PHE 119 Cb 0.13 -0.03 -0.04 0.00 2.56 0.00 0.00 35.95 38.57 3ii0 h PHE 119 CO 0.01 0.36 0.39 -0.07 -2.02 0.00 0.00 178.31 176.98 3ii0 h LEU 120 N -0.15 0.65 -1.51 0.59 3.38 -1.09 0.13 115.31 117.32 3ii0 h LEU 120 Ca 0.02 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.98 3ii0 h LEU 120 Cb 0.31 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 40.91 3ii0 h LEU 120 CO 0.00 0.46 0.00 0.00 0.09 0.00 0.00 178.44 178.99 3ii0 h ALA 121 N 1.25 1.00 0.00 1.53 0.00 -1.18 -2.44 119.26 119.42 3ii0 h ALA 121 Ca 0.24 0.00 -0.27 0.00 0.00 0.00 0.00 54.91 54.88 3ii0 h ALA 121 Cb -0.03 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 17.72 3ii0 h ALA 121 CO -0.08 0.00 -1.98 0.54 0.00 0.00 0.00 179.25 177.73 3ii0 n ARG 122 N -2.56 0.42 0.00 0.00 1.74 -0.58 -3.12 116.66 112.56 3ii0 n ARG 122 Ca -0.00 0.11 0.00 0.00 -0.77 0.00 0.00 57.85 57.20 3ii0 n ARG 122 Cb 0.15 -1.30 0.00 0.00 -1.02 0.00 0.00 32.46 30.30 3ii0 n ARG 122 CO 0.00 0.00 0.00 0.91 -1.52 0.00 0.00 177.63 177.02 3ii0 n TRP 123 N -3.18 0.00 -4.49 -1.55 7.02 0.36 -0.88 117.44 114.72 3ii0 n TRP 123 Ca -0.32 0.00 -0.34 0.00 -1.02 0.00 0.00 57.50 55.82 3ii0 n TRP 123 Cb 0.81 0.00 -0.11 0.00 -2.42 0.00 0.00 31.31 29.59 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 -0.20 3.03 -1.21 -5.99 5.04 -0.92 -4.56 117.35 112.54 3ii0 s TYR 124 Ca 0.01 -0.00 -0.06 0.00 -2.44 0.00 0.00 57.07 54.58 3ii0 s TYR 124 Cb 0.01 -1.80 0.01 0.00 0.35 0.00 0.00 41.96 40.53 3ii0 s TYR 124 CO 0.02 0.28 1.05 -1.71 -1.34 0.00 0.00 175.55 173.84 3ii0 n ASN 125 N 2.53 -4.78 0.00 4.32 5.15 -1.26 -4.54 115.26 116.68 3ii0 n ASN 125 Ca -0.18 -0.52 0.00 0.00 -0.60 0.00 0.00 54.58 53.28 3ii0 n ASN 125 Cb 0.53 -4.74 0.00 0.00 -0.53 0.00 0.00 39.78 35.04 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 -1.65 -0.92 3.52 8.20 0.00 -1.26 -4.76 105.19 108.32 3ii0 n GLY 126 Ca -0.08 -2.16 -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 4.28 -1.44 2.61 2.01 -1.26 -4.37 115.64 117.47 3ii0 s THR 127 Ca 0.00 -0.20 -0.02 0.00 0.31 0.00 0.00 61.69 61.78 3ii0 s THR 127 Cb 0.00 -2.94 0.01 0.00 0.01 0.00 0.00 72.50 69.59 3ii0 s THR 127 CO 0.00 0.43 0.42 0.59 -0.69 0.00 0.00 174.62 175.38 3ii0 n ASN 128 N 4.02 -0.50 -4.46 3.53 5.03 -0.06 -4.89 115.26 117.94 3ii0 n ASN 128 Ca -0.17 -1.02 -0.43 0.00 0.87 0.00 0.00 54.58 53.83 3ii0 n ASN 128 Cb 0.52 -2.95 -0.05 0.00 -1.02 0.00 0.00 39.78 36.28 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 -4.28 6.24 0.00 6.41 3.84 -1.18 -4.85 114.94 121.12 3ii0 s ASN 129 Ca 0.07 -0.84 0.25 0.00 0.21 0.00 0.00 52.86 52.55 3ii0 s ASN 129 Cb -0.04 -2.35 0.47 0.00 -0.55 0.00 0.00 41.25 38.79 3ii0 s ASN 129 CO 0.90 -1.08 1.41 0.29 -2.79 0.00 0.00 177.10 175.84 3ii0 n LYS 130 N 6.72 1.94 0.02 0.43 4.76 -1.26 -4.16 118.16 126.61 3ii0 n LYS 130 Ca -0.04 -1.47 0.12 0.00 -2.87 0.00 0.00 58.31 54.05 3ii0 n LYS 130 Cb 0.46 -1.47 0.16 0.00 -1.84 0.00 0.00 35.03 32.34 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 0.75 0.60 -4.69 4.39 3.02 -1.26 -1.74 115.26 116.34 3ii0 n ASN 131 Ca 0.15 -0.18 -0.50 0.00 -0.03 0.00 0.00 54.58 54.03 3ii0 n ASN 131 Cb 0.50 0.39 -0.05 0.00 -0.61 0.00 0.00 39.78 40.00 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 -1.76 0.52 -1.92 3.41 -1.04 -1.26 -4.76 114.28 107.47 3ii0 n THR 132 Ca 0.04 -0.09 -0.40 0.00 -2.04 0.00 0.00 64.05 61.56 3ii0 n THR 132 Cb 0.39 -1.77 0.01 0.00 -1.82 0.00 0.00 70.33 67.14 3ii0 n THR 132 CO 0.00 0.00 0.00 -2.84 -0.64 0.00 0.00 175.07 171.59 3ii0 s PRO 133 N 3.87 3.84 -0.18 -2.82 0.02 -1.26 -4.72 135.00 133.75 3ii0 s PRO 133 Ca 0.93 2.31 -0.01 0.00 0.02 0.00 0.00 61.00 64.25 3ii0 s PRO 133 Cb -0.75 -2.72 0.00 0.00 0.02 0.00 0.00 34.50 31.05 3ii0 s PRO 133 CO 0.53 -0.65 -0.14 0.08 -0.33 0.00 0.00 177.00 176.49 3ii0 s VAL 134 N -1.22 2.62 -0.21 3.83 1.01 -0.72 -1.12 120.40 124.59 3ii0 s VAL 134 Ca 0.59 -0.76 -0.06 0.00 0.00 0.00 0.00 61.98 61.74 3ii0 s VAL 134 Cb -0.41 -2.13 -0.03 0.00 0.00 0.00 0.00 36.38 33.81 3ii0 s VAL 134 CO 0.53 0.50 0.04 -0.31 0.00 0.00 0.00 175.10 175.86 3ii0 s TYR 135 N 1.17 3.11 0.24 5.22 1.51 0.51 0.51 117.35 129.61 3ii0 s TYR 135 Ca 0.01 -0.28 0.12 0.00 -1.01 0.00 0.00 57.07 55.91 3ii0 s TYR 135 Cb -0.14 -2.12 -0.05 0.00 -0.11 0.00 0.00 41.96 39.54 3ii0 s TYR 135 CO -0.06 -0.15 -0.20 0.14 -1.11 0.00 0.00 175.55 174.17 3ii0 s VAL 136 N 0.96 2.49 0.62 0.71 -7.23 0.68 -1.29 120.40 117.35 3ii0 s VAL 136 Ca 0.03 -2.22 -0.18 0.00 -1.81 0.00 0.00 61.98 57.80 3ii0 s VAL 136 Cb -0.14 -2.26 -0.02 0.00 0.56 0.00 0.00 36.38 34.52 3ii0 s VAL 136 CO 0.02 -0.28 1.18 -0.94 -0.31 0.00 0.00 175.10 174.78 3ii0 s SER 137 N -3.17 5.06 -0.41 4.85 1.04 -1.26 -1.09 113.70 118.72 3ii0 s SER 137 Ca 0.26 2.29 -0.11 0.00 0.48 0.00 0.00 55.95 58.88 3ii0 s SER 137 Cb -0.06 -2.59 0.06 0.00 0.10 0.00 0.00 66.02 63.53 3ii0 s SER 137 CO 0.13 -1.67 0.26 -0.55 0.98 0.00 0.00 173.24 172.39 3ii0 s SER 138 N -1.85 5.75 0.79 7.02 0.15 -0.14 -3.11 113.70 122.31 3ii0 s SER 138 Ca 0.75 -1.30 -0.06 0.00 0.70 0.00 0.00 55.95 56.04 3ii0 s SER 138 Cb -0.28 -2.03 0.14 0.00 -1.71 0.00 0.00 66.02 62.14 3ii0 s SER 138 CO 0.36 -0.50 1.09 -2.16 1.20 0.00 0.00 173.24 173.23 3ii0 s PRO 139 N 1.50 1.47 0.35 5.44 0.04 -1.26 -1.36 135.00 141.18 3ii0 s PRO 139 Ca 0.03 -0.76 0.02 0.00 0.04 0.00 0.00 61.00 60.33 3ii0 s PRO 139 Cb -0.22 -2.16 -0.01 0.00 0.04 0.00 0.00 34.50 32.15 3ii0 s PRO 139 CO 0.04 -1.69 0.42 -2.37 0.04 0.00 0.00 177.00 173.45 3ii0 n THR 140 N -3.12 0.00 -1.73 1.26 5.66 -1.18 -4.63 114.28 110.55 3ii0 n THR 140 Ca 0.14 -2.06 -0.42 0.00 -3.05 0.00 0.00 64.05 58.66 3ii0 n THR 140 Cb 0.60 1.16 -0.02 0.00 -1.55 0.00 0.00 70.33 70.52 3ii0 n THR 140 CO 0.00 0.00 0.00 1.87 -3.05 0.00 0.00 175.07 173.89 3ii0 n TRP 141 N -0.61 2.72 -0.17 1.09 -0.00 -1.05 -4.58 117.44 114.84 3ii0 n TRP 141 Ca 0.03 0.22 0.18 0.00 -0.00 0.00 0.00 57.50 57.93 3ii0 n TRP 141 Cb 0.61 -2.60 0.54 0.00 -0.00 0.00 0.00 31.31 29.86 3ii0 n TRP 141 CO 0.00 0.00 0.00 1.05 -0.00 0.00 0.00 177.69 178.74 3ii0 h GLU 142 N 5.27 0.33 -0.00 5.87 4.11 -1.93 -2.27 114.58 125.96 3ii0 h GLU 142 Ca -0.46 -0.02 0.00 0.00 0.07 0.00 0.00 59.36 58.95 3ii0 h GLU 142 Cb 1.23 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 30.40 3ii0 h GLU 142 CO 0.83 0.22 -0.05 -1.71 0.07 0.00 0.00 179.01 178.38 3ii0 n ASN 143 N -4.46 0.09 0.28 3.06 5.15 -1.26 -4.08 115.26 114.03 3ii0 n ASN 143 Ca 0.16 0.05 -0.16 0.00 -0.60 0.00 0.00 54.58 54.03 3ii0 n ASN 143 Cb 0.62 -0.31 -0.08 0.00 -0.53 0.00 0.00 39.78 39.48 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 0.07 -0.64 -0.51 1.20 3.86 -1.79 -1.34 115.15 116.00 3ii0 h HIS 144 Ca 0.00 -0.02 0.05 0.00 -1.16 0.00 0.00 60.37 59.25 3ii0 h HIS 144 Cb 0.39 0.21 -0.05 0.00 1.06 0.00 0.00 27.41 29.03 3ii0 h HIS 144 CO 0.00 -0.34 0.24 -0.91 0.86 0.00 0.00 177.93 177.78 3ii0 h ASN 145 N -0.83 0.33 -0.53 2.45 2.35 -1.78 -2.53 115.58 115.04 3ii0 h ASN 145 Ca -0.07 0.04 -0.06 0.00 -0.55 0.00 0.00 56.30 55.66 3ii0 h ASN 145 Cb 0.59 -0.02 -0.02 0.00 0.05 0.00 0.00 38.32 38.92 3ii0 h ASN 145 CO 0.12 0.22 0.11 0.00 -1.65 0.00 0.00 177.43 176.23 3ii0 h ALA 146 N 1.29 0.70 -0.36 -0.83 0.00 -1.69 -0.55 119.26 117.82 3ii0 h ALA 146 Ca 0.23 -0.23 -0.07 0.00 0.00 0.00 0.00 54.91 54.85 3ii0 h ALA 146 Cb 0.17 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 3ii0 h ALA 146 CO -0.18 0.42 -0.04 0.28 0.00 0.00 0.00 179.25 179.73 3ii0 h VAL 147 N 0.75 1.27 -0.09 0.00 2.07 -1.08 -1.09 116.25 118.09 3ii0 h VAL 147 Ca 0.16 -1.06 -0.20 0.00 0.82 0.00 0.00 66.70 66.43 3ii0 h VAL 147 Cb 0.36 1.23 -0.00 0.00 -1.52 0.00 0.00 31.29 31.36 3ii0 h VAL 147 CO 0.01 0.35 -0.75 -0.26 0.02 0.00 0.00 177.57 176.93 3ii0 h PHE 148 N 0.47 0.66 -0.65 1.57 -1.00 -1.34 -2.01 116.94 114.63 3ii0 h PHE 148 Ca 0.10 -0.30 0.05 0.00 2.81 0.00 0.00 57.97 60.64 3ii0 h PHE 148 Cb 0.52 -0.10 -0.05 0.00 3.61 0.00 0.00 35.95 39.93 3ii0 h PHE 148 CO 0.04 1.07 0.37 0.77 -1.61 0.00 0.00 178.31 178.95 3ii0 h SER 149 N 0.33 0.55 -0.36 2.17 0.02 -1.09 -2.37 113.55 112.79 3ii0 h SER 149 Ca -0.04 0.03 -0.03 0.00 -0.84 0.00 0.00 61.79 60.91 3ii0 h SER 149 Cb 1.35 -0.08 -0.02 0.00 0.14 0.00 0.00 62.40 63.78 3ii0 h SER 149 CO 0.14 0.36 0.13 0.00 -1.14 0.00 0.00 176.83 176.32 3ii0 h ALA 150 N 1.33 1.43 0.00 3.77 0.00 -0.97 -0.68 119.26 124.15 3ii0 h ALA 150 Ca 0.29 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 55.05 3ii0 h ALA 150 Cb 0.16 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 17.77 3ii0 h ALA 150 CO -0.17 0.42 0.00 0.00 0.00 0.00 0.00 179.25 179.50 3ii0 n ALA 151 N -2.47 1.41 0.00 0.00 0.00 -0.78 -4.88 120.51 113.79 3ii0 n ALA 151 Ca 0.03 0.10 0.00 0.00 0.00 0.00 0.00 53.44 53.57 3ii0 n ALA 151 Cb 0.18 -1.32 0.00 0.00 0.00 0.00 0.00 19.45 18.31 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 -0.54 0.88 3.71 0.00 0.00 -0.26 -4.83 105.19 104.14 3ii0 n GLY 152 Ca 0.01 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.61 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 3.14 -0.54 1.61 0.08 -0.92 -4.83 117.98 114.52 3ii0 s PHE 153 Ca 0.00 0.92 0.23 0.00 0.12 0.00 0.00 56.93 58.19 3ii0 s PHE 153 Cb 0.00 -3.68 0.04 0.00 -0.57 0.00 0.00 43.02 38.81 3ii0 s PHE 153 CO 0.00 -2.40 1.01 1.63 -0.10 0.00 0.00 175.22 175.36 3ii0 n LYS 154 N 4.31 0.34 -3.57 0.44 5.02 -0.71 -4.41 118.16 119.58 3ii0 n LYS 154 Ca 0.12 0.00 -0.27 0.00 -2.02 0.00 0.00 58.31 56.14 3ii0 n LYS 154 Cb 0.43 -1.62 -0.11 0.00 -0.02 0.00 0.00 35.03 33.71 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 -2.07 0.85 -4.65 4.39 -0.08 -1.26 -5.07 116.55 108.65 3ii0 n ASP 155 Ca 0.01 -2.70 -0.37 0.00 -1.51 0.00 0.00 54.79 50.22 3ii0 n ASP 155 Cb 0.46 -0.63 -0.09 0.00 2.34 0.00 0.00 41.12 43.20 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 -0.55 5.28 0.35 5.18 1.01 -1.26 -1.75 121.20 129.46 3ii0 s ILE 156 Ca 0.30 0.42 0.04 0.00 0.00 0.00 0.00 60.65 61.42 3ii0 s ILE 156 Cb 0.01 -3.61 -0.06 0.00 0.01 0.00 0.00 42.46 38.81 3ii0 s ILE 156 CO -0.19 0.28 0.05 -0.13 0.00 0.00 0.00 174.94 174.96 3ii0 s ARG 157 N 1.30 1.75 -0.04 2.79 0.52 0.18 -4.95 118.95 120.51 3ii0 s ARG 157 Ca 0.13 -1.99 0.03 0.00 -0.52 0.00 0.00 55.73 53.38 3ii0 s ARG 157 Cb -0.14 -1.04 -0.03 0.00 0.52 0.00 0.00 34.95 34.26 3ii0 s ARG 157 CO 0.07 -0.18 -0.12 -1.12 0.02 0.00 0.00 175.30 173.96 3ii0 s SER 158 N -3.55 4.19 -0.09 0.23 0.01 -1.26 -0.23 113.70 113.00 3ii0 s SER 158 Ca 0.35 -0.18 -0.05 0.00 1.31 0.00 0.00 55.95 57.38 3ii0 s SER 158 Cb 0.08 -0.91 -0.04 0.00 0.21 0.00 0.00 66.02 65.37 3ii0 s SER 158 CO 0.16 0.33 0.11 -0.72 0.41 0.00 0.00 173.24 173.52 3ii0 s TYR 159 N -0.80 3.46 0.32 2.43 -0.85 -0.25 -4.85 117.35 116.81 3ii0 s TYR 159 Ca 0.13 0.40 -0.29 0.00 -0.52 0.00 0.00 57.07 56.79 3ii0 s TYR 159 Cb -0.11 -1.87 -0.13 0.00 0.38 0.00 0.00 41.96 40.23 3ii0 s TYR 159 CO 0.02 0.65 1.30 0.54 -1.52 0.00 0.00 175.55 176.54 3ii0 n ARG 160 N 1.84 2.08 0.05 -3.49 1.74 -1.26 -0.96 116.66 116.66 3ii0 n ARG 160 Ca -0.18 0.73 0.00 0.00 -0.77 0.00 0.00 57.85 57.63 3ii0 n ARG 160 Cb 0.54 -2.32 0.00 0.00 -1.02 0.00 0.00 32.46 29.66 3ii0 n ARG 160 CO 0.00 0.00 0.00 0.98 -1.52 0.00 0.00 177.63 177.09 3ii0 n TYR 161 N 0.64 -1.54 -2.66 -1.55 9.36 -1.22 -3.40 117.16 116.79 3ii0 n TYR 161 Ca 0.06 0.26 -0.42 0.00 3.32 0.00 0.00 57.90 61.11 3ii0 n TYR 161 Cb 0.35 0.87 -0.03 0.00 -0.63 0.00 0.00 39.34 39.90 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 -1.30 3.47 -0.41 2.98 -0.11 -0.46 0.41 118.94 123.51 3ii0 s TRP 162 Ca 0.00 1.54 -0.16 0.00 1.22 0.00 0.00 56.10 58.70 3ii0 s TRP 162 Cb 0.00 -3.22 0.02 0.00 -1.50 0.00 0.00 33.47 28.77 3ii0 s TRP 162 CO 0.00 -0.37 0.37 0.34 -4.62 0.00 0.00 176.95 172.67 3ii0 s ASP 163 N 1.15 6.15 0.38 5.86 -1.08 0.10 -4.80 116.67 124.43 3ii0 s ASP 163 Ca 0.49 -0.73 0.11 0.00 -0.52 0.00 0.00 52.55 51.90 3ii0 s ASP 163 Cb -0.19 -2.19 0.74 0.00 -1.46 0.00 0.00 42.92 39.82 3ii0 s ASP 163 CO 0.18 -0.50 1.86 0.00 0.52 0.00 0.00 175.17 177.23 3ii0 h ALA 164 N 8.66 1.43 0.35 3.66 0.00 -1.95 -1.06 119.26 130.35 3ii0 h ALA 164 Ca -0.27 -0.28 -0.02 0.00 0.00 0.00 0.00 54.91 54.34 3ii0 h ALA 164 Cb 1.12 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.84 3ii0 h ALA 164 CO 0.76 0.41 -0.17 1.05 0.00 0.00 0.00 179.25 181.30 3ii0 h GLU 165 N 0.10 -0.45 0.00 0.00 9.09 -1.95 -3.23 114.58 118.14 3ii0 h GLU 165 Ca 0.02 0.03 0.00 0.00 0.05 0.00 0.00 59.36 59.46 3ii0 h GLU 165 Cb 0.54 0.10 0.00 0.00 -1.65 0.00 0.00 28.75 27.74 3ii0 h GLU 165 CO 0.04 -0.15 0.00 0.36 0.05 0.00 0.00 179.01 179.31 3ii0 n LYS 166 N -5.11 0.01 -4.10 1.06 0.00 -1.24 -4.92 118.16 103.87 3ii0 n LYS 166 Ca -0.08 0.17 -0.29 0.00 -0.00 0.00 0.00 58.31 58.11 3ii0 n LYS 166 Cb 0.26 -1.52 -0.05 0.00 -0.00 0.00 0.00 35.03 33.72 3ii0 n LYS 166 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.40 177.94 3ii0 n ARG 167 N -1.54 -2.17 -0.41 -1.58 1.74 -0.41 -4.95 116.66 107.34 3ii0 n ARG 167 Ca 0.05 0.27 0.00 0.00 -0.77 0.00 0.00 57.85 57.39 3ii0 n ARG 167 Cb 0.24 -4.06 0.00 0.00 -1.02 0.00 0.00 32.46 27.62 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 -2.23 2.96 3.72 -0.13 0.00 -1.15 -5.00 105.19 103.36 3ii0 n GLY 168 Ca -0.31 -0.94 -0.41 0.00 0.00 0.00 0.00 46.02 44.35 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 4.39 -1.19 0.99 2.96 -1.26 -0.72 118.68 123.84 3ii0 s LEU 169 Ca 0.00 1.61 -0.11 0.00 -0.22 0.00 0.00 54.13 55.41 3ii0 s LEU 169 Cb 0.00 -3.50 0.20 0.00 0.50 0.00 0.00 46.19 43.40 3ii0 s LEU 169 CO 0.00 -0.20 1.43 -0.67 -1.32 0.00 0.00 176.35 175.59 3ii0 n ASP 170 N 3.67 5.34 -0.25 3.68 2.03 0.16 -4.82 116.55 126.37 3ii0 n ASP 170 Ca 0.04 -3.04 -0.05 0.00 0.52 0.00 0.00 54.79 52.26 3ii0 n ASP 170 Cb 0.51 -1.50 0.05 0.00 -0.72 0.00 0.00 41.12 39.46 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 8.51 0.80 -0.34 -2.67 5.85 -1.92 -1.36 115.31 124.18 3ii0 h LEU 171 Ca 0.29 -0.03 -0.02 0.00 0.84 0.00 0.00 57.88 58.96 3ii0 h LEU 171 Cb 0.82 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 41.63 3ii0 h LEU 171 CO 1.26 0.59 0.12 1.56 -0.34 0.00 0.00 178.44 181.63 3ii0 h GLN 172 N 0.94 0.53 -0.33 1.25 1.08 -1.97 0.27 115.11 116.88 3ii0 h GLN 172 Ca 0.25 -0.11 0.07 0.00 -1.45 0.00 0.00 58.65 57.42 3ii0 h GLN 172 Cb -0.09 -0.08 -0.08 0.00 -0.05 0.00 0.00 27.48 27.18 3ii0 h GLN 172 CO -0.05 0.54 -0.18 0.78 -0.95 0.00 0.00 178.83 178.96 3ii0 h GLY 173 N 0.40 0.05 0.37 3.46 0.00 -1.84 0.10 103.07 105.61 3ii0 h GLY 173 Ca 0.11 0.23 0.06 0.00 0.00 0.00 0.00 47.33 47.73 3ii0 h GLY 173 CO -0.01 -0.18 -0.11 -2.75 0.00 0.00 0.00 176.54 173.49 3ii0 h PHE 174 N -0.14 -0.27 -0.44 5.60 3.04 -0.99 -0.28 116.94 123.45 3ii0 h PHE 174 Ca 0.17 0.03 -0.12 0.00 3.98 0.00 0.00 57.97 62.03 3ii0 h PHE 174 Cb 0.40 0.16 -0.01 0.00 2.56 0.00 0.00 35.95 39.05 3ii0 h PHE 174 CO -0.39 -0.18 -0.20 -0.07 -2.02 0.00 0.00 178.31 175.45 3ii0 h LEU 175 N -0.08 0.89 -0.65 0.59 3.38 -0.53 -1.71 115.31 117.20 3ii0 h LEU 175 Ca 0.14 -0.32 -0.03 0.00 0.09 0.00 0.00 57.88 57.76 3ii0 h LEU 175 Cb 0.28 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 40.76 3ii0 h LEU 175 CO -0.31 1.07 0.30 -1.13 0.09 0.00 0.00 178.44 178.46 3ii0 h ASN 176 N 0.77 0.86 -0.52 -0.43 -0.73 -0.15 0.18 115.58 115.55 3ii0 h ASN 176 Ca 0.11 -0.14 -0.03 0.00 1.87 0.00 0.00 56.30 58.11 3ii0 h ASN 176 Cb 0.74 -0.22 -0.02 0.00 0.27 0.00 0.00 38.32 39.09 3ii0 h ASN 176 CO 0.06 0.75 0.20 0.44 -0.37 0.00 0.00 177.43 178.51 3ii0 h ASP 177 N 0.90 0.73 -0.53 1.15 3.32 -0.78 -0.76 116.42 120.44 3ii0 h ASP 177 Ca 0.22 -0.18 -0.01 0.00 0.02 0.00 0.00 57.03 57.09 3ii0 h ASP 177 Cb 0.13 -0.19 -0.03 0.00 0.22 0.00 0.00 39.33 39.47 3ii0 h ASP 177 CO -0.03 0.71 0.30 -0.07 -1.72 0.00 0.00 179.24 178.43 3ii0 h LEU 178 N 0.71 0.66 -1.21 1.55 3.38 -1.08 -2.52 115.31 116.81 3ii0 h LEU 178 Ca 0.17 -0.08 0.07 0.00 0.09 0.00 0.00 57.88 58.13 3ii0 h LEU 178 Cb 0.22 -0.17 -0.06 0.00 0.09 0.00 0.00 40.66 40.74 3ii0 h LEU 178 CO -0.01 0.55 0.56 -0.33 0.09 0.00 0.00 178.44 179.30 3ii0 h GLU 179 N 0.71 0.93 -0.01 1.13 3.07 -0.49 -2.61 114.58 117.31 3ii0 h GLU 179 Ca 0.19 -0.06 0.00 0.00 -0.50 0.00 0.00 59.36 58.99 3ii0 h GLU 179 Cb 0.03 -0.21 0.00 0.00 -0.84 0.00 0.00 28.75 27.73 3ii0 h GLU 179 CO -0.03 0.61 -0.03 0.09 -1.40 0.00 0.00 179.01 178.25 3ii0 n ASN 180 N -4.49 0.85 -4.77 1.42 3.02 -0.33 -4.92 115.26 106.04 3ii0 n ASN 180 Ca 0.13 -1.16 -0.38 0.00 -0.03 0.00 0.00 54.58 53.14 3ii0 n ASN 180 Cb 0.21 -0.00 -0.04 0.00 -0.61 0.00 0.00 39.78 39.34 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 -2.11 3.20 0.50 5.41 0.00 -0.96 -4.99 121.76 122.80 3ii0 s ALA 181 Ca 0.39 0.81 -0.23 0.00 0.00 0.00 0.00 51.96 52.93 3ii0 s ALA 181 Cb 0.21 -3.31 -0.07 0.00 0.00 0.00 0.00 23.12 19.95 3ii0 s ALA 181 CO 0.38 -0.25 1.36 -2.30 0.00 0.00 0.00 175.76 174.94 3ii0 n PRO 182 N 0.37 1.90 -1.55 0.00 -0.02 -1.26 -4.92 135.00 129.52 3ii0 n PRO 182 Ca 0.03 0.69 -0.46 0.00 -2.02 0.00 0.00 63.50 61.73 3ii0 n PRO 182 Cb 0.47 -2.55 -0.02 0.00 -0.02 0.00 0.00 33.50 31.38 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 -0.56 1.07 -0.92 -0.52 1.02 -1.26 -1.89 120.64 117.59 3ii0 n GLU 183 Ca 0.08 0.38 0.00 0.00 -0.02 0.00 0.00 57.16 57.60 3ii0 n GLU 183 Cb 0.43 -1.71 0.00 0.00 -0.02 0.00 0.00 31.44 30.14 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 0.43 0.00 -1.60 -0.32 3.72 -0.25 -5.02 117.46 114.43 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 0.29 -0.26 0.05 0.00 -0.94 0.00 0.00 39.48 38.62 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 -0.01 0.59 -4.74 4.37 7.64 -0.79 -4.47 113.62 116.21 3ii0 n SER 185 Ca 0.00 0.81 -0.37 0.00 1.01 0.00 0.00 58.87 60.32 3ii0 n SER 185 Cb 0.01 -1.36 -0.07 0.00 -1.01 0.00 0.00 64.21 61.77 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 -1.53 5.27 -0.18 0.44 1.01 -0.28 -0.76 121.20 125.18 3ii0 s ILE 186 Ca 0.74 0.61 0.01 0.00 0.00 0.00 0.00 60.65 62.01 3ii0 s ILE 186 Cb -0.43 -3.65 0.03 0.00 0.01 0.00 0.00 42.46 38.42 3ii0 s ILE 186 CO 0.48 0.41 -0.15 -0.69 0.00 0.00 0.00 174.94 174.99 3ii0 s VAL 187 N 0.27 1.83 -0.38 2.92 1.01 -0.11 -0.36 120.40 125.58 3ii0 s VAL 187 Ca 0.18 -0.93 -0.22 0.00 0.00 0.00 0.00 61.98 61.01 3ii0 s VAL 187 Cb -0.14 -1.75 0.01 0.00 0.00 0.00 0.00 36.38 34.50 3ii0 s VAL 187 CO 0.06 0.37 0.73 -0.69 0.00 0.00 0.00 175.10 175.57 3ii0 s VAL 188 N 1.35 4.77 -0.13 2.92 1.01 -0.41 -1.23 120.40 128.69 3ii0 s VAL 188 Ca 0.02 0.70 0.00 0.00 0.00 0.00 0.00 61.98 62.71 3ii0 s VAL 188 Cb -0.14 -4.18 -0.01 0.00 0.00 0.00 0.00 36.38 32.04 3ii0 s VAL 188 CO -0.10 -0.44 -0.14 -0.76 0.00 0.00 0.00 175.10 173.65 3ii0 s LEU 189 N 2.99 2.62 -0.16 3.92 1.43 -0.51 -4.38 118.68 124.60 3ii0 s LEU 189 Ca 0.29 -0.37 -0.29 0.00 -1.03 0.00 0.00 54.13 52.72 3ii0 s LEU 189 Cb -0.13 -1.59 -0.01 0.00 0.03 0.00 0.00 46.19 44.49 3ii0 s LEU 189 CO 0.17 0.15 1.15 -1.00 0.23 0.00 0.00 176.35 177.05 3ii0 s HIS 190 N 0.45 3.14 0.16 0.29 3.76 -1.26 -0.44 115.29 121.39 3ii0 s HIS 190 Ca -0.11 1.26 -0.12 0.00 -0.15 0.00 0.00 55.06 55.94 3ii0 s HIS 190 Cb -0.16 -3.38 0.06 0.00 1.11 0.00 0.00 32.58 30.21 3ii0 s HIS 190 CO 0.05 -1.08 1.71 0.00 -0.85 0.00 0.00 174.74 174.56 3ii0 h ALA 191 N 7.70 0.73 -2.63 -1.40 0.00 -1.62 -3.47 119.26 118.58 3ii0 h ALA 191 Ca -0.26 -0.18 0.12 0.00 0.00 0.00 0.00 54.91 54.59 3ii0 h ALA 191 Cb 1.11 -0.22 -0.06 0.00 0.00 0.00 0.00 17.79 18.62 3ii0 h ALA 191 CO 0.94 0.37 0.40 0.00 0.00 0.00 0.00 179.25 180.96 3ii0 n ALA 193 N -0.50 -2.59 -1.65 0.00 0.00 -1.26 -4.72 120.51 109.78 3ii0 n ALA 193 Ca -0.05 -0.22 -0.47 0.00 0.00 0.00 0.00 53.44 52.70 3ii0 n ALA 193 Cb 0.60 -3.15 -0.05 0.00 0.00 0.00 0.00 19.45 16.86 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 -3.59 2.12 -3.72 0.00 -0.00 -1.26 -4.86 115.22 103.91 3ii0 n HIS 194 Ca -0.12 0.34 -0.37 0.00 0.46 0.00 0.00 57.72 58.03 3ii0 n HIS 194 Cb 0.59 -2.50 -0.12 0.00 -0.12 0.00 0.00 29.99 27.84 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 0.88 5.26 0.00 0.26 2.47 -1.26 -1.01 114.94 121.54 3ii0 s ASN 195 Ca 0.80 -0.50 0.17 0.00 0.42 0.00 0.00 52.86 53.76 3ii0 s ASN 195 Cb -0.74 -1.93 0.07 0.00 -1.45 0.00 0.00 41.25 37.20 3ii0 s ASN 195 CO 0.40 -0.14 0.97 -0.81 -3.72 0.00 0.00 177.10 173.79 3ii0 n PRO 196 N 4.92 1.55 0.13 0.43 -0.04 -1.26 -2.52 135.00 138.21 3ii0 n PRO 196 Ca -0.15 -1.19 0.01 0.00 -0.04 0.00 0.00 63.50 62.13 3ii0 n PRO 196 Cb 0.49 -1.32 0.04 0.00 -0.04 0.00 0.00 33.50 32.68 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 2.67 1.09 -0.61 0.52 1.35 -1.89 -3.36 112.91 112.67 3ii0 h THR 197 Ca 0.00 -2.41 -0.26 0.00 -0.55 0.00 0.00 66.41 63.19 3ii0 h THR 197 Cb 0.65 2.45 -0.10 0.00 -1.73 0.00 0.00 68.15 69.42 3ii0 h THR 197 CO 0.00 0.60 -0.24 0.61 -0.25 0.00 0.00 175.52 176.24 3ii0 n GLY 198 N 1.09 1.35 3.17 5.82 0.00 -0.18 -4.26 105.19 112.18 3ii0 n GLY 198 Ca 0.01 -0.34 -0.32 0.00 0.00 0.00 0.00 46.02 45.37 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 -2.42 1.99 0.15 -0.61 -1.09 -1.26 -0.58 121.20 117.37 3ii0 s ILE 199 Ca 0.00 -0.95 0.07 0.00 -2.23 0.00 0.00 60.65 57.54 3ii0 s ILE 199 Cb 0.00 -1.75 -0.04 0.00 -1.58 0.00 0.00 42.46 39.09 3ii0 s ILE 199 CO 0.00 0.54 -0.03 -1.81 -1.23 0.00 0.00 174.94 172.41 3ii0 s ASP 200 N 0.69 4.66 0.42 3.58 1.01 -1.26 -4.59 116.67 121.19 3ii0 s ASP 200 Ca -0.10 -0.40 -0.26 0.00 0.71 0.00 0.00 52.55 52.50 3ii0 s ASP 200 Cb -0.16 -0.96 -0.09 0.00 1.01 0.00 0.00 42.92 42.72 3ii0 s ASP 200 CO 0.01 0.12 1.37 -2.84 0.21 0.00 0.00 175.17 174.03 3ii0 s PRO 201 N -2.73 3.87 0.88 8.23 0.02 -1.26 -5.01 135.00 139.00 3ii0 s PRO 201 Ca 0.26 2.29 -0.11 0.00 0.02 0.00 0.00 61.00 63.46 3ii0 s PRO 201 Cb -0.10 -2.74 0.12 0.00 0.02 0.00 0.00 34.50 31.81 3ii0 s PRO 201 CO 0.17 -0.62 1.10 0.95 -0.33 0.00 0.00 177.00 178.27 3ii0 s THR 202 N -1.22 2.66 0.29 0.99 -4.23 -1.26 -4.76 115.64 108.10 3ii0 s THR 202 Ca 0.58 0.21 0.03 0.00 -1.18 0.00 0.00 61.69 61.33 3ii0 s THR 202 Cb -0.41 -2.53 0.28 0.00 1.34 0.00 0.00 72.50 71.19 3ii0 s THR 202 CO 0.53 -0.28 1.79 -0.65 -0.54 0.00 0.00 174.62 175.47 3ii0 h PRO 203 N -1.60 0.77 -0.38 3.99 0.11 -1.99 0.01 132.00 132.91 3ii0 h PRO 203 Ca -0.47 -0.05 -0.11 0.00 0.11 0.00 0.00 66.00 65.49 3ii0 h PRO 203 Cb 1.27 -0.17 -0.02 0.00 0.11 0.00 0.00 31.00 32.19 3ii0 h PRO 203 CO 0.49 0.51 -0.20 0.93 -0.21 0.00 0.00 178.00 179.53 3ii0 h GLU 204 N 0.80 0.73 -0.32 1.05 4.39 -2.01 -2.42 114.58 116.81 3ii0 h GLU 204 Ca 0.53 -0.28 -0.14 0.00 0.34 0.00 0.00 59.36 59.82 3ii0 h GLU 204 Cb 0.73 -0.04 -0.01 0.00 -0.10 0.00 0.00 28.75 29.32 3ii0 h GLU 204 CO -0.35 0.87 -0.35 1.96 -1.16 0.00 0.00 179.01 179.99 3ii0 h GLN 205 N 0.65 0.72 -0.85 2.33 4.20 -1.62 -2.70 115.11 117.84 3ii0 h GLN 205 Ca 0.10 -0.35 0.09 0.00 0.06 0.00 0.00 58.65 58.55 3ii0 h GLN 205 Cb 0.68 -0.00 -0.06 0.00 0.30 0.00 0.00 27.48 28.40 3ii0 h GLN 205 CO 0.05 0.96 0.55 -1.49 -0.67 0.00 0.00 178.83 178.23 3ii0 h TRP 206 N 0.60 0.89 -0.35 2.96 4.06 -0.82 -2.10 115.95 121.20 3ii0 h TRP 206 Ca 0.06 0.02 -0.06 0.00 2.06 0.00 0.00 58.89 60.97 3ii0 h TRP 206 Cb 0.88 -0.29 -0.02 0.00 -1.00 0.00 0.00 29.16 28.73 3ii0 h TRP 206 CO 0.04 0.42 -0.05 0.87 -3.56 0.00 0.00 178.44 176.16 3ii0 h LYS 207 N 0.83 0.56 -0.16 0.49 1.57 -1.10 0.11 116.57 118.88 3ii0 h LYS 207 Ca 0.39 -0.14 -0.18 0.00 -1.87 0.00 0.00 60.65 58.85 3ii0 h LYS 207 Cb 0.40 -0.07 -0.00 0.00 0.08 0.00 0.00 32.23 32.64 3ii0 h LYS 207 CO -0.16 0.62 -0.64 1.96 -0.57 0.00 0.00 179.45 180.67 3ii0 h GLN 208 N 0.53 0.59 0.24 3.15 4.20 -1.35 -1.88 115.11 120.59 3ii0 h GLN 208 Ca 0.11 -0.42 -0.01 0.00 0.06 0.00 0.00 58.65 58.39 3ii0 h GLN 208 Cb 0.41 0.07 0.00 0.00 0.30 0.00 0.00 27.48 28.26 3ii0 h GLN 208 CO 0.02 1.04 -0.11 0.82 -0.67 0.00 0.00 178.83 179.92 3ii0 h ILE 209 N 0.43 0.82 -0.85 2.54 2.04 -0.99 -2.61 117.51 118.89 3ii0 h ILE 209 Ca -0.01 -0.33 0.15 0.00 1.00 0.00 0.00 64.86 65.67 3ii0 h ILE 209 Cb 1.21 1.01 -0.10 0.00 -0.74 0.00 0.00 36.82 38.20 3ii0 h ILE 209 CO 0.12 0.07 0.43 0.00 0.00 0.00 0.00 178.15 178.78 3ii0 h ALA 210 N 0.24 1.29 -0.49 1.87 0.00 -0.80 -1.08 119.26 120.28 3ii0 h ALA 210 Ca -0.03 0.09 -0.04 0.00 0.00 0.00 0.00 54.91 54.93 3ii0 h ALA 210 Cb 0.36 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.13 3ii0 h ALA 210 CO 0.05 -0.11 0.13 1.03 0.00 0.00 0.00 179.25 180.36 3ii0 h SER 211 N 0.60 0.73 -0.23 0.00 0.87 -1.24 0.16 113.55 114.45 3ii0 h SER 211 Ca 0.47 -0.22 -0.10 0.00 -1.23 0.00 0.00 61.79 60.71 3ii0 h SER 211 Cb 0.68 -0.19 -0.00 0.00 -0.44 0.00 0.00 62.40 62.45 3ii0 h SER 211 CO -0.38 0.76 -0.23 0.58 -0.53 0.00 0.00 176.83 177.03 3ii0 h VAL 212 N 0.66 1.32 -0.82 2.23 2.07 -0.99 -2.18 116.25 118.55 3ii0 h VAL 212 Ca 0.16 -1.40 0.05 0.00 0.82 0.00 0.00 66.70 66.33 3ii0 h VAL 212 Cb 0.30 1.71 -0.06 0.00 -1.52 0.00 0.00 31.29 31.73 3ii0 h VAL 212 CO -0.00 0.43 0.51 0.24 0.02 0.00 0.00 177.57 178.77 3ii0 h MET 213 N 0.25 0.92 -0.58 1.57 2.86 -1.00 -0.13 114.93 118.82 3ii0 h MET 213 Ca 0.04 -0.06 -0.01 0.00 -2.06 0.00 0.00 59.70 57.61 3ii0 h MET 213 Cb 0.79 -0.21 -0.03 0.00 0.06 0.00 0.00 31.60 32.21 3ii0 h MET 213 CO 0.06 0.61 0.33 -0.22 1.06 0.00 0.00 176.91 178.74 3ii0 h LYS 214 N 0.95 0.81 -0.08 1.72 3.64 -0.63 -0.63 116.57 122.34 3ii0 h LYS 214 Ca 0.35 -0.09 -0.12 0.00 -1.27 0.00 0.00 60.65 59.52 3ii0 h LYS 214 Cb 0.12 -0.16 -0.01 0.00 -0.41 0.00 0.00 32.23 31.77 3ii0 h LYS 214 CO -0.15 0.61 -0.50 1.25 -2.27 0.00 0.00 179.45 178.38 3ii0 h HIS 215 N 0.79 0.25 -0.64 1.91 6.17 -0.71 -3.22 115.15 119.69 3ii0 h HIS 215 Ca 0.21 -0.08 0.00 0.00 0.71 0.00 0.00 60.37 61.21 3ii0 h HIS 215 Cb 0.03 -0.05 0.00 0.00 2.52 0.00 0.00 27.41 29.91 3ii0 h HIS 215 CO -0.01 0.67 0.00 0.54 0.71 0.00 0.00 177.93 179.83 3ii0 n ARG 216 N -3.95 3.31 -3.63 5.26 1.74 -0.12 -4.96 116.66 114.30 3ii0 n ARG 216 Ca -0.02 -2.75 -0.21 0.00 -0.77 0.00 0.00 57.85 54.10 3ii0 n ARG 216 Cb 0.54 -1.73 0.04 0.00 -1.02 0.00 0.00 32.46 30.29 3ii0 n ARG 216 CO 0.00 0.00 0.00 1.97 -1.52 0.00 0.00 177.63 178.08 3ii0 n PHE 217 N 1.21 -1.98 -3.65 -1.55 1.16 -0.63 -3.30 117.46 108.73 3ii0 n PHE 217 Ca 0.24 0.84 -0.36 0.00 -1.87 0.00 0.00 57.45 56.30 3ii0 n PHE 217 Cb 0.76 -4.44 -0.06 0.00 -1.61 0.00 0.00 39.48 34.14 3ii0 n PHE 217 CO 0.00 0.00 0.00 -0.51 -1.87 0.00 0.00 176.76 174.38 3ii0 s LEU 218 N -6.54 4.40 -0.26 5.98 1.43 -0.34 -1.09 118.68 122.26 3ii0 s LEU 218 Ca 0.05 0.73 -0.17 0.00 -1.03 0.00 0.00 54.13 53.71 3ii0 s LEU 218 Cb -0.01 -2.65 -0.03 0.00 0.03 0.00 0.00 46.19 43.53 3ii0 s LEU 218 CO 0.80 0.27 0.48 0.12 0.23 0.00 0.00 176.35 178.25 3ii0 s PHE 219 N -1.22 3.26 -0.16 0.29 5.36 0.06 -4.80 117.98 120.78 3ii0 s PHE 219 Ca 0.26 0.58 -0.26 0.00 -0.96 0.00 0.00 56.93 56.56 3ii0 s PHE 219 Cb -0.14 -2.68 -0.01 0.00 -0.34 0.00 0.00 43.02 39.84 3ii0 s PHE 219 CO 0.14 -0.26 0.86 -1.25 -1.46 0.00 0.00 175.22 173.25 3ii0 s PRO 220 N 2.22 4.32 -0.46 10.12 0.05 -1.26 -0.94 135.00 149.06 3ii0 s PRO 220 Ca 0.20 1.07 0.02 0.00 0.05 0.00 0.00 61.00 62.34 3ii0 s PRO 220 Cb -0.16 -3.56 0.12 0.00 0.05 0.00 0.00 34.50 30.95 3ii0 s PRO 220 CO 0.09 -0.31 0.21 0.12 0.05 0.00 0.00 177.00 177.16 3ii0 s PHE 221 N 2.09 3.47 0.36 0.56 2.19 -0.36 -2.36 117.98 123.92 3ii0 s PHE 221 Ca 0.40 -2.96 -0.25 0.00 0.33 0.00 0.00 56.93 54.45 3ii0 s PHE 221 Cb -0.17 -2.96 -0.09 0.00 -1.31 0.00 0.00 43.02 38.49 3ii0 s PHE 221 CO 0.13 -0.86 1.04 -0.06 1.83 0.00 0.00 175.22 177.30 3ii0 s PHE 222 N 0.33 3.41 -0.22 10.12 0.08 -0.19 -1.42 117.98 130.09 3ii0 s PHE 222 Ca 0.14 1.68 -0.00 0.00 0.12 0.00 0.00 56.93 58.87 3ii0 s PHE 222 Cb -0.22 -3.12 0.03 0.00 -0.57 0.00 0.00 43.02 39.13 3ii0 s PHE 222 CO -0.04 -0.45 -0.12 0.34 -0.10 0.00 0.00 175.22 174.86 3ii0 s ASP 223 N -1.44 3.91 -0.58 1.36 -1.08 0.42 -0.88 116.67 118.38 3ii0 s ASP 223 Ca 0.54 -0.82 0.04 0.00 -0.52 0.00 0.00 52.55 51.79 3ii0 s ASP 223 Cb -0.23 -1.59 0.15 0.00 -1.46 0.00 0.00 42.92 39.79 3ii0 s ASP 223 CO 0.29 -0.08 0.37 -0.55 0.52 0.00 0.00 175.17 175.72 3ii0 s SER 224 N 1.30 4.15 -0.01 -0.34 0.15 0.32 -1.42 113.70 117.85 3ii0 s SER 224 Ca 0.01 -3.33 0.20 0.00 0.70 0.00 0.00 55.95 53.53 3ii0 s SER 224 Cb -0.16 -1.42 -0.24 0.00 -1.71 0.00 0.00 66.02 62.49 3ii0 s SER 224 CO -0.07 -0.17 0.71 0.00 1.20 0.00 0.00 173.24 174.91 3ii0 n ALA 225 N 2.64 4.01 -2.06 5.45 0.00 -1.26 -1.58 120.51 127.71 3ii0 n ALA 225 Ca 0.15 -0.53 0.04 0.00 0.00 0.00 0.00 53.44 53.10 3ii0 n ALA 225 Cb 0.35 -0.71 0.07 0.00 0.00 0.00 0.00 19.45 19.17 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 -1.69 0.00 -1.67 0.00 4.01 -1.26 -4.48 117.16 112.07 3ii0 n TYR 226 Ca 0.01 -0.69 -0.44 0.00 -0.16 0.00 0.00 57.90 56.62 3ii0 n TYR 226 Cb 0.37 -0.15 -0.04 0.00 -0.31 0.00 0.00 39.34 39.21 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 -0.16 2.58 0.00 -0.72 7.27 -1.26 -0.41 117.38 124.68 3ii0 n GLN 227 Ca 0.09 0.94 0.00 0.00 0.07 0.00 0.00 57.00 58.10 3ii0 n GLN 227 Cb 0.91 -2.84 0.00 0.00 2.41 0.00 0.00 30.24 30.72 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 4.36 2.27 0.01 1.69 0.00 -1.26 -4.79 105.19 107.46 3ii0 n GLY 228 Ca 0.20 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.35 3ii0 n GLY 228 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3ii0 n PHE 229 N -0.51 0.07 -0.01 1.61 3.72 0.46 -1.91 117.46 120.89 3ii0 n PHE 229 Ca 0.00 0.02 -0.19 0.00 -0.05 0.00 0.00 57.45 57.23 3ii0 n PHE 229 Cb 0.00 -0.38 -0.14 0.00 -0.94 0.00 0.00 39.48 38.02 3ii0 n PHE 229 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3ii0 h ALA 230 N 2.95 0.02 0.00 4.37 0.00 -1.92 -2.99 119.26 121.68 3ii0 h ALA 230 Ca 0.00 -0.76 0.00 0.00 0.00 0.00 0.00 54.91 54.15 3ii0 h ALA 230 Cb 0.52 0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.52 3ii0 h ALA 230 CO 0.00 0.38 -0.35 -1.13 0.00 0.00 0.00 179.25 178.15 3ii0 n SER 231 N -4.25 0.74 0.00 0.00 3.41 -1.26 -4.45 113.62 107.81 3ii0 n SER 231 Ca -0.17 -0.52 0.00 0.00 -0.26 0.00 0.00 58.87 57.93 3ii0 n SER 231 Cb 0.73 1.03 0.00 0.00 -0.26 0.00 0.00 64.21 65.71 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 1.27 1.38 2.98 5.00 0.00 -0.80 -5.03 105.19 109.99 3ii0 n GLY 232 Ca 0.01 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.74 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 -3.20 2.55 0.21 1.61 3.84 -1.25 -4.44 114.94 114.26 3ii0 s ASN 233 Ca 0.00 -0.44 -0.09 0.00 0.21 0.00 0.00 52.86 52.54 3ii0 s ASN 233 Cb 0.00 -1.08 0.16 0.00 -0.55 0.00 0.00 41.25 39.78 3ii0 s ASN 233 CO 0.00 -0.08 1.84 -0.07 -2.79 0.00 0.00 177.10 176.00 3ii0 h LEU 234 N 8.09 0.96 -0.11 3.21 3.38 -1.92 -1.39 115.31 127.54 3ii0 h LEU 234 Ca -0.35 -0.09 -0.02 0.00 0.09 0.00 0.00 57.88 57.51 3ii0 h LEU 234 Cb 1.13 -0.24 -0.00 0.00 0.09 0.00 0.00 40.66 41.63 3ii0 h LEU 234 CO 0.49 0.77 -0.01 -0.08 0.09 0.00 0.00 178.44 179.70 3ii0 h GLU 235 N 1.08 0.20 -0.80 1.13 4.81 -1.96 -3.02 114.58 116.02 3ii0 h GLU 235 Ca 0.28 -0.07 -0.00 0.00 -0.13 0.00 0.00 59.36 59.44 3ii0 h GLU 235 Cb 0.01 -0.02 -0.04 0.00 0.63 0.00 0.00 28.75 29.33 3ii0 h GLU 235 CO -0.05 0.47 0.50 -0.09 -0.73 0.00 0.00 179.01 179.11 3ii0 h ARG 236 N -0.09 1.08 0.00 1.92 2.43 -1.96 -2.26 114.38 115.51 3ii0 h ARG 236 Ca 0.03 -0.09 -0.01 0.00 -0.81 0.00 0.00 59.98 59.11 3ii0 h ARG 236 Cb 0.38 -0.23 -0.00 0.00 -0.42 0.00 0.00 29.97 29.70 3ii0 h ARG 236 CO 0.01 0.75 -0.03 -0.44 -1.51 0.00 0.00 179.97 178.74 3ii0 h ASP 237 N 1.10 0.00 -0.23 -3.80 5.19 -1.20 -2.26 116.42 115.22 3ii0 h ASP 237 Ca 0.29 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.70 3ii0 h ASP 237 Cb -0.07 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.44 3ii0 h ASP 237 CO -0.06 0.03 0.00 0.00 -3.12 0.00 0.00 179.24 176.09 3ii0 n ALA 238 N -2.13 2.49 -0.12 3.45 0.00 -0.85 -4.56 120.51 118.80 3ii0 n ALA 238 Ca -0.01 -0.56 -0.06 0.00 0.00 0.00 0.00 53.44 52.81 3ii0 n ALA 238 Cb 0.21 -1.05 0.02 0.00 0.00 0.00 0.00 19.45 18.63 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 2.17 0.26 -0.82 0.00 7.01 -1.43 -2.16 115.95 120.97 3ii0 h TRP 239 Ca 0.00 0.02 0.01 0.00 2.11 0.00 0.00 58.89 61.03 3ii0 h TRP 239 Cb 0.48 -0.06 -0.04 0.00 -2.10 0.00 0.00 29.16 27.44 3ii0 h TRP 239 CO 0.15 0.11 0.54 0.00 -2.79 0.00 0.00 178.44 176.45 3ii0 h ALA 240 N 1.24 1.05 -0.57 2.65 0.00 -1.84 0.28 119.26 122.07 3ii0 h ALA 240 Ca 0.18 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 55.01 3ii0 h ALA 240 Cb 0.15 -0.33 -0.03 0.00 0.00 0.00 0.00 17.79 17.58 3ii0 h ALA 240 CO -0.17 0.44 0.27 0.82 0.00 0.00 0.00 179.25 180.61 3ii0 h ILE 241 N 1.10 1.21 -0.09 0.00 2.04 -1.76 -1.96 117.51 118.05 3ii0 h ILE 241 Ca 0.31 -0.59 -0.10 0.00 1.00 0.00 0.00 64.86 65.48 3ii0 h ILE 241 Cb -0.11 0.54 -0.01 0.00 -0.74 0.00 0.00 36.82 36.50 3ii0 h ILE 241 CO -0.07 0.24 -0.41 0.03 0.00 0.00 0.00 178.15 177.93 3ii0 h ARG 242 N 0.78 0.19 -0.36 2.37 3.08 -0.81 -2.04 114.38 117.59 3ii0 h ARG 242 Ca 0.20 -0.09 -0.08 0.00 0.07 0.00 0.00 59.98 60.08 3ii0 h ARG 242 Cb 0.12 -0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.16 3ii0 h ARG 242 CO -0.02 0.58 -0.07 -0.92 -1.07 0.00 0.00 179.97 178.46 3ii0 h TYR 243 N 0.16 0.76 -0.66 3.04 3.20 -0.56 -2.24 116.97 120.67 3ii0 h TYR 243 Ca 0.01 -0.16 -0.04 0.00 3.14 0.00 0.00 58.73 61.68 3ii0 h TYR 243 Cb 0.80 -0.19 -0.03 0.00 1.54 0.00 0.00 36.73 38.85 3ii0 h TYR 243 CO 0.01 0.83 0.23 0.74 -1.64 0.00 0.00 178.16 178.33 3ii0 h PHE 244 N 0.48 1.00 -0.25 -3.82 -1.00 -1.08 -0.59 116.94 111.68 3ii0 h PHE 244 Ca 0.09 -0.08 0.05 0.00 2.81 0.00 0.00 57.97 60.85 3ii0 h PHE 244 Cb 0.58 -0.30 -0.05 0.00 3.61 0.00 0.00 35.95 39.79 3ii0 h PHE 244 CO 0.05 0.79 -0.08 0.28 -1.61 0.00 0.00 178.31 177.74 3ii0 h VAL 245 N 0.96 0.72 0.00 -0.55 2.07 -1.21 -2.77 116.25 115.46 3ii0 h VAL 245 Ca 0.22 0.00 -0.07 0.00 0.82 0.00 0.00 66.70 67.67 3ii0 h VAL 245 Cb 0.23 0.72 -0.01 0.00 -1.52 0.00 0.00 31.29 30.71 3ii0 h VAL 245 CO -0.01 0.00 -0.35 0.77 0.02 0.00 0.00 177.57 178.00 3ii0 h SER 246 N -0.02 0.00 0.00 0.57 4.64 -0.73 -1.90 113.55 116.11 3ii0 h SER 246 Ca 0.13 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.45 3ii0 h SER 246 Cb 0.21 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.30 3ii0 h SER 246 CO -0.27 0.35 0.00 -0.62 -0.87 0.00 0.00 176.83 175.41 3ii0 n GLU 247 N -3.71 0.87 -0.68 4.77 -0.58 -0.30 -4.90 120.64 116.11 3ii0 n GLU 247 Ca -0.01 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.73 3ii0 n GLU 247 Cb 0.44 -1.43 0.00 0.00 -0.57 0.00 0.00 31.44 29.88 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 0.69 0.72 3.83 0.62 0.00 -0.71 -5.06 105.19 105.29 3ii0 n GLY 248 Ca 0.18 -0.61 -0.34 0.00 0.00 0.00 0.00 46.02 45.25 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 3.49 0.07 1.61 0.40 -1.07 -5.01 117.98 115.48 3ii0 s PHE 249 Ca 0.00 1.32 -0.12 0.00 -0.60 0.00 0.00 56.93 57.54 3ii0 s PHE 249 Cb 0.00 -2.60 -0.06 0.00 0.51 0.00 0.00 43.02 40.87 3ii0 s PHE 249 CO 0.00 0.18 0.43 -1.21 0.70 0.00 0.00 175.22 175.32 3ii0 s GLU 250 N -2.57 3.83 0.10 0.44 2.02 -1.26 -4.74 118.70 116.52 3ii0 s GLU 250 Ca 0.50 0.28 -0.27 0.00 0.02 0.00 0.00 54.97 55.51 3ii0 s GLU 250 Cb -0.13 -3.03 0.08 0.00 0.10 0.00 0.00 34.13 31.15 3ii0 s GLU 250 CO 0.19 0.57 0.99 -0.59 0.02 0.00 0.00 175.26 176.44 3ii0 s PHE 251 N -1.34 -0.16 0.14 1.61 -0.12 -0.71 -4.50 117.98 112.90 3ii0 s PHE 251 Ca 0.32 -0.08 0.06 0.00 -0.05 0.00 0.00 56.93 57.18 3ii0 s PHE 251 Cb -0.15 0.61 -0.04 0.00 -0.63 0.00 0.00 43.02 42.81 3ii0 s PHE 251 CO 0.17 -0.70 -0.00 -0.06 -0.05 0.00 0.00 175.22 174.58 3ii0 s PHE 252 N -3.14 2.90 -0.24 3.49 0.08 -0.99 -1.69 117.98 118.38 3ii0 s PHE 252 Ca 0.11 -0.10 -0.04 0.00 0.12 0.00 0.00 56.93 57.02 3ii0 s PHE 252 Cb -0.01 -1.44 0.09 0.00 -0.57 0.00 0.00 43.02 41.10 3ii0 s PHE 252 CO -0.01 0.50 0.16 0.00 -0.10 0.00 0.00 175.22 175.77 3ii0 s ALA 254 N 2.19 3.00 -0.12 0.00 0.00 -0.06 -1.14 121.76 125.62 3ii0 s ALA 254 Ca 0.07 -0.52 -0.09 0.00 0.00 0.00 0.00 51.96 51.42 3ii0 s ALA 254 Cb -0.16 -3.99 -0.04 0.00 0.00 0.00 0.00 23.12 18.93 3ii0 s ALA 254 CO -0.24 -2.56 0.17 -0.65 0.00 0.00 0.00 175.76 172.48 3ii0 s GLN 255 N 4.96 3.66 0.02 0.00 -0.21 0.54 -0.52 119.66 128.11 3ii0 s GLN 255 Ca 0.51 -0.08 0.05 0.00 0.02 0.00 0.00 55.36 55.86 3ii0 s GLN 255 Cb -0.10 -3.25 -0.03 0.00 1.00 0.00 0.00 33.01 30.63 3ii0 s GLN 255 CO 0.29 0.66 -0.12 0.45 -2.12 0.00 0.00 175.29 174.45 3ii0 s SER 256 N -0.71 4.25 -0.11 5.90 0.15 -0.62 -1.07 113.70 121.49 3ii0 s SER 256 Ca 0.15 -0.26 0.14 0.00 0.70 0.00 0.00 55.95 56.68 3ii0 s SER 256 Cb -0.12 -0.87 0.35 0.00 -1.71 0.00 0.00 66.02 63.66 3ii0 s SER 256 CO 0.04 0.28 1.25 0.49 1.20 0.00 0.00 173.24 176.49 3ii0 n PHE 257 N 1.60 0.43 -0.20 3.44 3.72 -0.29 -4.70 117.46 121.46 3ii0 n PHE 257 Ca -0.16 -0.81 -0.04 0.00 -0.05 0.00 0.00 57.45 56.39 3ii0 n PHE 257 Cb 0.52 -0.18 0.13 0.00 -0.94 0.00 0.00 39.48 39.01 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 0.99 0.92 0.00 4.37 0.02 -1.84 -3.00 113.55 115.01 3ii0 h SER 258 Ca 0.00 -0.17 -0.28 0.00 -0.84 0.00 0.00 61.79 60.50 3ii0 h SER 258 Cb 1.06 -0.24 -0.04 0.00 0.14 0.00 0.00 62.40 63.32 3ii0 h SER 258 CO 0.09 0.87 -1.70 0.29 -1.14 0.00 0.00 176.83 175.24 3ii0 n LYS 259 N -4.26 0.56 0.26 3.45 4.01 -1.26 -1.45 118.16 119.46 3ii0 n LYS 259 Ca 0.05 0.40 0.15 0.00 -0.51 0.00 0.00 58.31 58.40 3ii0 n LYS 259 Cb 0.22 -1.60 0.59 0.00 -0.51 0.00 0.00 35.03 33.73 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 -0.02 4.39 7.08 -1.82 -0.82 115.58 123.39 3ii0 h ASN 260 Ca -0.43 0.00 0.00 0.00 -3.08 0.00 0.00 56.30 52.79 3ii0 h ASN 260 Cb 1.32 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 37.56 3ii0 h ASN 260 CO -0.26 0.04 -0.19 0.49 -2.08 0.00 0.00 177.43 175.43 3ii0 n PHE 261 N -3.14 0.00 -2.21 4.14 3.01 -1.14 -4.74 117.46 113.37 3ii0 n PHE 261 Ca 0.01 0.00 -0.20 0.00 1.01 0.00 0.00 57.45 58.27 3ii0 n PHE 261 Cb 0.35 0.00 -0.03 0.00 -0.01 0.00 0.00 39.48 39.80 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 1.05 0.05 2.25 1.37 0.00 -0.31 -4.63 105.19 104.96 3ii0 n GLY 262 Ca 0.08 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.79 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 -2.83 7.41 -0.30 0.99 4.77 -0.53 -4.80 117.00 121.71 3ii0 n LEU 263 Ca -0.22 -4.06 -0.00 0.00 -0.03 0.00 0.00 56.01 51.69 3ii0 n LEU 263 Cb 0.67 -0.98 0.06 0.00 -2.33 0.00 0.00 43.42 40.84 3ii0 n LEU 263 CO 0.28 1.39 0.64 1.88 -1.33 0.00 0.00 177.39 180.25 3ii0 h TYR 264 N 1.82 -0.79 -0.36 -1.77 -1.99 -1.82 -0.28 116.97 111.78 3ii0 h TYR 264 Ca 0.56 0.08 0.00 0.00 2.00 0.00 0.00 58.73 61.37 3ii0 h TYR 264 Cb 1.01 0.47 0.00 0.00 2.00 0.00 0.00 36.73 40.21 3ii0 h TYR 264 CO 1.35 -0.38 0.00 0.27 -0.00 0.00 0.00 178.16 179.39 3ii0 n ASN 265 N -5.49 2.26 -0.61 3.88 0.23 -1.26 -3.23 115.26 111.04 3ii0 n ASN 265 Ca 0.09 -1.92 0.10 0.00 -0.53 0.00 0.00 54.58 52.33 3ii0 n ASN 265 Cb 0.40 -0.24 0.03 0.00 -2.08 0.00 0.00 39.78 37.89 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 0.72 1.60 -3.38 -3.83 -0.58 -0.12 -5.03 120.64 110.01 3ii0 n GLU 266 Ca 0.15 -1.25 -0.17 0.00 -0.42 0.00 0.00 57.16 55.48 3ii0 n GLU 266 Cb 0.38 -1.42 0.03 0.00 -0.57 0.00 0.00 31.44 29.86 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 0.40 -1.58 -3.85 3.49 5.12 -1.20 -4.55 116.66 114.49 3ii0 n ARG 267 Ca 0.10 0.92 -0.36 0.00 -1.93 0.00 0.00 57.85 56.58 3ii0 n ARG 267 Cb 0.48 -4.92 -0.13 0.00 -1.16 0.00 0.00 32.46 26.73 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 -3.25 3.45 0.26 1.55 1.01 -1.26 -2.54 120.40 119.61 3ii0 s VAL 268 Ca 0.28 -0.90 -0.06 0.00 0.00 0.00 0.00 61.98 61.31 3ii0 s VAL 268 Cb -0.07 -2.79 -0.01 0.00 0.00 0.00 0.00 36.38 33.50 3ii0 s VAL 268 CO 0.80 0.10 0.36 -0.83 0.00 0.00 0.00 175.10 175.53 3ii0 s GLY 269 N 1.41 1.13 -0.14 4.51 0.00 -0.47 -1.14 107.32 112.62 3ii0 s GLY 269 Ca 0.01 -1.34 -0.07 0.00 0.00 0.00 0.00 44.72 43.32 3ii0 s GLY 269 CO -0.01 -0.99 0.32 0.21 0.00 0.00 0.00 173.10 172.63 3ii0 s ASN 270 N -3.13 -0.34 -0.41 1.64 2.47 -0.24 -0.78 114.94 114.16 3ii0 s ASN 270 Ca 0.30 0.70 -0.21 0.00 0.42 0.00 0.00 52.86 54.07 3ii0 s ASN 270 Cb 0.02 0.61 0.02 0.00 -1.45 0.00 0.00 41.25 40.45 3ii0 s ASN 270 CO 0.14 -0.18 0.67 -0.22 -3.72 0.00 0.00 177.10 173.78 3ii0 s LEU 271 N 1.43 4.38 -0.02 3.21 2.96 0.98 -0.34 118.68 131.28 3ii0 s LEU 271 Ca -0.09 -0.14 -0.21 0.00 -0.22 0.00 0.00 54.13 53.48 3ii0 s LEU 271 Cb -0.10 -2.79 -0.05 0.00 0.50 0.00 0.00 46.19 43.76 3ii0 s LEU 271 CO -0.10 -0.74 0.60 -0.89 -1.32 0.00 0.00 176.35 173.89 3ii0 s THR 272 N 2.87 4.96 -0.14 3.68 2.01 -0.29 -0.98 115.64 127.74 3ii0 s THR 272 Ca 0.24 1.25 0.01 0.00 0.31 0.00 0.00 61.69 63.50 3ii0 s THR 272 Cb -0.14 -3.94 0.02 0.00 0.01 0.00 0.00 72.50 68.46 3ii0 s THR 272 CO 0.18 0.39 -0.14 -0.69 -0.69 0.00 0.00 174.62 173.66 3ii0 s VAL 273 N 0.03 1.55 -0.21 3.82 1.01 0.34 -0.67 120.40 126.28 3ii0 s VAL 273 Ca 0.31 -0.64 -0.05 0.00 0.00 0.00 0.00 61.98 61.61 3ii0 s VAL 273 Cb -0.18 -1.45 -0.02 0.00 0.00 0.00 0.00 36.38 34.73 3ii0 s VAL 273 CO 0.17 0.45 0.00 -0.69 0.00 0.00 0.00 175.10 175.04 3ii0 s VAL 274 N 1.35 3.95 0.45 2.92 1.01 -0.68 -0.32 120.40 129.07 3ii0 s VAL 274 Ca 0.02 -0.31 0.04 0.00 0.00 0.00 0.00 61.98 61.73 3ii0 s VAL 274 Cb -0.13 -2.79 -0.05 0.00 0.00 0.00 0.00 36.38 33.40 3ii0 s VAL 274 CO -0.08 0.42 0.01 -0.83 0.00 0.00 0.00 175.10 174.62 3ii0 s GLY 275 N 1.11 2.72 0.15 4.51 0.00 -0.32 -1.73 107.32 113.75 3ii0 s GLY 275 Ca 0.03 -1.41 -0.02 0.00 0.00 0.00 0.00 44.72 43.32 3ii0 s GLY 275 CO 0.02 -2.12 1.36 0.50 0.00 0.00 0.00 173.10 172.86 3ii0 h LYS 276 N 1.61 0.37 -4.30 2.90 1.79 -1.90 -3.46 116.57 113.59 3ii0 h LYS 276 Ca -0.43 -0.37 -0.17 0.00 -2.18 0.00 0.00 60.65 57.50 3ii0 h LYS 276 Cb 1.27 0.10 -0.14 0.00 -1.58 0.00 0.00 32.23 31.88 3ii0 h LYS 276 CO 0.76 1.03 -0.55 -1.83 -1.08 0.00 0.00 179.45 177.79 3ii0 s GLU 277 N -3.37 1.03 0.27 3.15 1.03 -1.26 -4.99 118.70 114.56 3ii0 s GLU 277 Ca -0.05 -1.39 -0.02 0.00 0.03 0.00 0.00 54.97 53.54 3ii0 s GLU 277 Cb 0.10 0.28 0.44 0.00 -0.80 0.00 0.00 34.13 34.15 3ii0 s GLU 277 CO 0.85 -0.32 1.87 -1.35 -1.33 0.00 0.00 175.26 174.98 3ii0 h PRO 278 N 2.74 1.11 -0.58 -4.83 0.11 -1.80 -2.77 132.00 125.99 3ii0 h PRO 278 Ca -0.34 -0.07 -0.00 0.00 0.11 0.00 0.00 66.00 65.70 3ii0 h PRO 278 Cb 1.21 -0.25 -0.03 0.00 0.11 0.00 0.00 31.00 32.04 3ii0 h PRO 278 CO 0.55 0.73 0.35 0.93 -0.21 0.00 0.00 178.00 180.36 3ii0 h GLU 279 N 1.14 0.77 -0.40 1.05 3.07 -1.97 -1.81 114.58 116.43 3ii0 h GLU 279 Ca 0.45 -0.06 0.04 0.00 -0.50 0.00 0.00 59.36 59.29 3ii0 h GLU 279 Cb 0.23 -0.17 -0.04 0.00 -0.84 0.00 0.00 28.75 27.94 3ii0 h GLU 279 CO -0.19 0.54 0.16 0.77 -1.40 0.00 0.00 179.01 178.89 3ii0 h SER 280 N 0.79 0.19 -0.36 1.42 0.02 -1.91 -2.06 113.55 111.65 3ii0 h SER 280 Ca 0.21 0.04 -0.02 0.00 -0.84 0.00 0.00 61.79 61.17 3ii0 h SER 280 Cb -0.04 0.01 -0.02 0.00 0.14 0.00 0.00 62.40 62.50 3ii0 h SER 280 CO -0.04 0.15 0.13 0.40 -1.14 0.00 0.00 176.83 176.33 3ii0 h ILE 281 N 0.33 1.19 -0.79 3.27 1.08 -1.45 -1.05 117.51 120.10 3ii0 h ILE 281 Ca 0.18 -0.61 0.02 0.00 -0.39 0.00 0.00 64.86 64.06 3ii0 h ILE 281 Cb 0.14 0.93 -0.04 0.00 -3.07 0.00 0.00 36.82 34.78 3ii0 h ILE 281 CO -0.17 0.21 0.51 -0.07 -0.69 0.00 0.00 178.15 177.95 3ii0 h LEU 282 N 0.43 0.85 0.16 1.44 -0.00 -1.11 -0.84 115.31 116.24 3ii0 h LEU 282 Ca 0.12 -0.01 -0.01 0.00 -0.00 0.00 0.00 57.88 57.98 3ii0 h LEU 282 Cb 0.21 -0.20 0.00 0.00 -0.00 0.00 0.00 40.66 40.67 3ii0 h LEU 282 CO -0.01 0.60 -0.08 -0.61 -0.00 0.00 0.00 178.44 178.34 3ii0 h GLN 283 N 1.01 -0.21 -0.15 1.13 5.75 -1.20 -2.39 115.11 119.04 3ii0 h GLN 283 Ca 0.31 0.01 0.04 0.00 -0.15 0.00 0.00 58.65 58.86 3ii0 h GLN 283 Cb -0.03 0.05 -0.04 0.00 1.07 0.00 0.00 27.48 28.53 3ii0 h GLN 283 CO -0.10 0.02 -0.08 0.28 -2.65 0.00 0.00 178.83 176.31 3ii0 h VAL 284 N -0.42 0.75 -0.38 2.39 2.07 -0.74 -1.86 116.25 118.06 3ii0 h VAL 284 Ca -0.02 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.48 3ii0 h VAL 284 Cb 0.33 0.75 -0.02 0.00 -1.52 0.00 0.00 31.29 30.83 3ii0 h VAL 284 CO 0.04 0.00 0.14 -0.07 0.02 0.00 0.00 177.57 177.69 3ii0 h LEU 285 N -0.07 0.48 -0.64 2.57 3.38 -1.21 0.75 115.31 120.57 3ii0 h LEU 285 Ca 0.09 -0.05 -0.11 0.00 0.09 0.00 0.00 57.88 57.89 3ii0 h LEU 285 Cb 0.20 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 40.81 3ii0 h LEU 285 CO -0.20 0.45 -0.14 0.77 0.09 0.00 0.00 178.44 179.42 3ii0 h SER 286 N 0.53 0.93 -0.55 -0.43 4.64 -0.81 -1.86 113.55 116.00 3ii0 h SER 286 Ca 0.13 -0.31 -0.07 0.00 -0.47 0.00 0.00 61.79 61.07 3ii0 h SER 286 Cb 0.13 -0.25 -0.02 0.00 -0.31 0.00 0.00 62.40 61.95 3ii0 h SER 286 CO -0.01 1.07 0.07 1.56 -0.87 0.00 0.00 176.83 178.65 3ii0 h GLN 287 N 0.83 0.93 -0.69 4.77 4.20 -0.86 -2.94 115.11 121.34 3ii0 h GLN 287 Ca 0.13 -0.26 0.07 0.00 0.06 0.00 0.00 58.65 58.65 3ii0 h GLN 287 Cb 0.68 -0.10 -0.04 0.00 0.30 0.00 0.00 27.48 28.31 3ii0 h GLN 287 CO 0.05 0.90 0.45 0.52 -0.67 0.00 0.00 178.83 180.09 3ii0 h MET 288 N 0.81 0.64 -0.58 1.46 2.86 -0.68 -1.75 114.93 117.69 3ii0 h MET 288 Ca 0.17 -0.04 -0.00 0.00 -2.06 0.00 0.00 59.70 57.76 3ii0 h MET 288 Cb 0.44 -0.14 -0.03 0.00 0.06 0.00 0.00 31.60 31.93 3ii0 h MET 288 CO 0.01 0.42 0.34 0.93 1.06 0.00 0.00 176.91 179.68 3ii0 h GLU 289 N 0.66 0.78 -0.30 1.72 5.08 -1.15 -0.81 114.58 120.55 3ii0 h GLU 289 Ca 0.30 -0.07 -0.05 0.00 -1.00 0.00 0.00 59.36 58.55 3ii0 h GLU 289 Cb 0.33 -0.17 -0.01 0.00 0.50 0.00 0.00 28.75 29.41 3ii0 h GLU 289 CO -0.10 0.55 -0.00 0.87 -1.00 0.00 0.00 179.01 179.33 3ii0 h LYS 290 N 0.79 0.53 -0.49 2.33 6.56 -1.36 -1.64 116.57 123.30 3ii0 h LYS 290 Ca 0.21 -0.17 -0.02 0.00 -1.06 0.00 0.00 60.65 59.61 3ii0 h LYS 290 Cb -0.02 -0.05 -0.02 0.00 -0.57 0.00 0.00 32.23 31.57 3ii0 h LYS 290 CO -0.04 0.68 0.23 0.82 -2.06 0.00 0.00 179.45 179.08 3ii0 h ILE 291 N 0.33 1.20 -0.45 1.86 2.04 -1.21 -2.75 117.51 118.52 3ii0 h ILE 291 Ca 0.08 -0.57 -0.02 0.00 1.00 0.00 0.00 64.86 65.36 3ii0 h ILE 291 Cb 0.44 0.66 -0.02 0.00 -0.74 0.00 0.00 36.82 37.15 3ii0 h ILE 291 CO 0.02 0.22 0.20 0.58 0.00 0.00 0.00 178.15 179.16 3ii0 h VAL 292 N 0.65 1.19 -0.76 1.67 2.07 -1.13 -3.00 116.25 116.95 3ii0 h VAL 292 Ca 0.17 -0.57 0.09 0.00 0.82 0.00 0.00 66.70 67.21 3ii0 h VAL 292 Cb 0.13 0.74 -0.07 0.00 -1.52 0.00 0.00 31.29 30.58 3ii0 h VAL 292 CO -0.02 0.22 0.41 -0.09 0.02 0.00 0.00 177.57 178.10 3ii0 h ARG 293 N 0.58 0.67 -0.24 1.57 9.65 -1.10 0.44 114.38 125.95 3ii0 h ARG 293 Ca 0.15 -0.04 0.00 0.00 -1.10 0.00 0.00 59.98 58.99 3ii0 h ARG 293 Cb 0.16 -0.15 0.00 0.00 -1.39 0.00 0.00 29.97 28.58 3ii0 h ARG 293 CO -0.02 0.44 0.00 0.44 2.80 0.00 0.00 179.97 183.64 3ii0 n ILE 294 N -4.81 0.31 0.01 1.20 -5.35 -1.05 -3.32 119.36 106.35 3ii0 n ILE 294 Ca 0.12 -0.36 -0.02 0.00 -0.27 0.00 0.00 62.75 62.22 3ii0 n ILE 294 Cb 0.27 0.23 -0.01 0.00 -1.74 0.00 0.00 39.64 38.39 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 0.29 1.02 -0.42 7.28 -1.04 -0.71 -4.94 114.28 115.76 3ii0 n THR 295 Ca 0.12 0.30 0.00 0.00 -2.04 0.00 0.00 64.05 62.43 3ii0 n THR 295 Cb 0.27 -1.63 0.00 0.00 -1.82 0.00 0.00 70.33 67.15 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 -3.47 0.00 0.00 -1.42 2.14 -0.60 -5.06 117.44 109.03 3ii0 n TRP 296 Ca -0.03 0.00 0.00 0.00 2.07 0.00 0.00 57.50 59.54 3ii0 n TRP 296 Cb 0.10 0.00 0.00 0.00 -0.81 0.00 0.00 31.31 30.60 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 -0.02 0.00 -3.54 -0.67 2.88 0.05 -4.74 113.62 107.57 3ii0 n SER 297 Ca 0.00 0.00 -0.09 0.00 -1.33 0.00 0.00 58.87 57.45 3ii0 n SER 297 Cb 0.10 0.00 -0.02 0.00 -0.75 0.00 0.00 64.21 63.54 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 -0.39 0.45 -3.46 2.20 -1.26 -4.19 114.94 108.30 3ii0 s ASN 298 Ca 0.00 -0.10 0.01 0.00 -0.94 0.00 0.00 52.86 51.83 3ii0 s ASN 298 Cb 0.00 0.48 -0.00 0.00 -2.00 0.00 0.00 41.25 39.73 3ii0 s ASN 298 CO 0.00 -0.81 0.67 -2.16 -2.94 0.00 0.00 177.10 171.86 3ii0 s PRO 299 N -3.37 3.02 0.46 3.55 0.04 -1.26 -5.03 135.00 132.41 3ii0 s PRO 299 Ca 0.05 -0.55 -0.21 0.00 0.04 0.00 0.00 61.00 60.34 3ii0 s PRO 299 Cb -0.01 -2.57 -0.09 0.00 0.04 0.00 0.00 34.50 31.87 3ii0 s PRO 299 CO -0.07 -0.30 1.01 -1.25 0.04 0.00 0.00 177.00 176.43 3ii0 s PRO 300 N -4.55 3.98 -0.16 0.56 0.04 -1.26 -4.66 135.00 128.94 3ii0 s PRO 300 Ca 0.49 1.28 -0.17 0.00 0.04 0.00 0.00 61.00 62.64 3ii0 s PRO 300 Cb -0.10 -2.16 -0.23 0.00 0.04 0.00 0.00 34.50 32.05 3ii0 s PRO 300 CO 0.38 -0.27 0.36 0.00 0.04 0.00 0.00 177.00 177.51 3ii0 h ALA 301 N 1.75 0.27 -0.18 8.56 0.00 -1.97 -3.40 119.26 124.29 3ii0 h ALA 301 Ca -0.49 -1.19 0.05 0.00 0.00 0.00 0.00 54.91 53.28 3ii0 h ALA 301 Cb 1.21 0.63 -0.07 0.00 0.00 0.00 0.00 17.79 19.56 3ii0 h ALA 301 CO 0.60 0.84 -0.29 0.37 0.00 0.00 0.00 179.25 180.77 3ii0 h GLN 302 N -0.57 -0.33 -0.45 0.00 5.75 -1.95 -0.42 115.11 117.15 3ii0 h GLN 302 Ca -0.34 0.02 -0.04 0.00 -0.15 0.00 0.00 58.65 58.15 3ii0 h GLN 302 Cb 1.58 0.07 -0.02 0.00 1.07 0.00 0.00 27.48 30.18 3ii0 h GLN 302 CO -0.06 -0.22 0.14 0.78 -2.65 0.00 0.00 178.83 176.82 3ii0 h GLY 303 N -0.34 0.75 0.92 2.39 0.00 -1.83 -2.11 103.07 102.85 3ii0 h GLY 303 Ca 0.11 -0.44 0.05 0.00 0.00 0.00 0.00 47.33 47.05 3ii0 h GLY 303 CO -0.37 0.41 0.60 0.00 0.00 0.00 0.00 176.54 177.18 3ii0 h ALA 304 N 0.99 1.46 -0.26 3.60 0.00 -1.72 -2.38 119.26 120.96 3ii0 h ALA 304 Ca 0.14 -0.03 -0.11 0.00 0.00 0.00 0.00 54.91 54.91 3ii0 h ALA 304 Cb 0.27 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 3ii0 h ALA 304 CO -0.00 0.43 -0.30 0.00 0.00 0.00 0.00 179.25 179.37 3ii0 h ARG 305 N 1.09 0.54 -0.24 0.00 3.08 -0.68 -0.59 114.38 117.58 3ii0 h ARG 305 Ca 0.38 -0.23 -0.04 0.00 0.07 0.00 0.00 59.98 60.16 3ii0 h ARG 305 Cb 0.10 -0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.12 3ii0 h ARG 305 CO -0.13 0.78 0.01 0.82 -1.07 0.00 0.00 179.97 180.38 3ii0 h ILE 306 N 0.47 1.25 -0.17 2.04 2.04 -1.14 -1.95 117.51 120.04 3ii0 h ILE 306 Ca 0.06 -0.87 -0.03 0.00 1.00 0.00 0.00 64.86 65.02 3ii0 h ILE 306 Cb 0.76 1.34 -0.01 0.00 -0.74 0.00 0.00 36.82 38.17 3ii0 h ILE 306 CO 0.06 0.27 0.01 0.58 0.00 0.00 0.00 178.15 179.07 3ii0 h VAL 307 N 0.21 1.24 -0.32 1.67 2.07 -1.35 -2.49 116.25 117.28 3ii0 h VAL 307 Ca 0.07 -0.81 0.04 0.00 0.82 0.00 0.00 66.70 66.82 3ii0 h VAL 307 Cb 0.39 1.44 -0.04 0.00 -1.52 0.00 0.00 31.29 31.56 3ii0 h VAL 307 CO 0.01 0.24 0.11 0.00 0.02 0.00 0.00 177.57 177.95 3ii0 h ALA 308 N 0.79 0.37 -0.14 1.67 0.00 -1.13 -0.56 119.26 120.26 3ii0 h ALA 308 Ca 0.05 0.04 -0.04 0.00 0.00 0.00 0.00 54.91 54.96 3ii0 h ALA 308 Cb 0.36 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 3ii0 h ALA 308 CO 0.01 -0.29 -0.09 0.77 0.00 0.00 0.00 179.25 179.64 3ii0 h SER 309 N 0.24 0.19 0.08 0.00 0.02 -1.34 -2.31 113.55 110.44 3ii0 h SER 309 Ca 0.15 -0.03 -0.00 0.00 -0.84 0.00 0.00 61.79 61.06 3ii0 h SER 309 Cb 0.12 -0.05 0.00 0.00 0.14 0.00 0.00 62.40 62.61 3ii0 h SER 309 CO -0.15 0.32 -0.04 0.74 -1.14 0.00 0.00 176.83 176.55 3ii0 h THR 310 N 0.20 1.15 0.00 -2.27 2.02 -0.96 -3.25 112.91 109.80 3ii0 h THR 310 Ca 0.04 -1.39 0.00 0.00 0.77 0.00 0.00 66.41 65.83 3ii0 h THR 310 Cb 0.30 1.97 0.00 0.00 -1.74 0.00 0.00 68.15 68.68 3ii0 h THR 310 CO 0.02 0.31 0.00 -0.07 0.37 0.00 0.00 175.52 176.15 3ii0 h LEU 311 N -0.81 0.00 -0.23 2.58 3.38 -1.05 -2.75 115.31 116.43 3ii0 h LEU 311 Ca -0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.96 3ii0 h LEU 311 Cb 0.60 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.35 3ii0 h LEU 311 CO 0.02 0.00 -0.79 -1.54 0.09 0.00 0.00 178.44 176.22 3ii0 n SER 312 N -2.61 1.15 -4.48 -0.43 3.41 -0.88 -4.80 113.62 104.98 3ii0 n SER 312 Ca 0.02 -1.01 -0.37 0.00 -0.26 0.00 0.00 58.87 57.26 3ii0 n SER 312 Cb 0.32 0.75 -0.12 0.00 -0.26 0.00 0.00 64.21 64.91 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 -2.87 5.45 0.47 4.04 3.84 -1.18 -5.00 114.94 119.69 3ii0 s ASN 313 Ca 0.11 -0.24 0.16 0.00 0.21 0.00 0.00 52.86 53.10 3ii0 s ASN 313 Cb 0.17 -1.99 1.15 0.00 -0.55 0.00 0.00 41.25 40.03 3ii0 s ASN 313 CO 0.77 -0.08 2.02 -0.65 -2.79 0.00 0.00 177.10 176.37 3ii0 h PRO 314 N 8.30 0.24 -0.01 0.43 0.11 -1.87 -0.14 132.00 139.06 3ii0 h PRO 314 Ca -0.36 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 65.72 3ii0 h PRO 314 Cb 1.17 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.23 3ii0 h PRO 314 CO 0.58 0.16 -0.05 1.49 -0.21 0.00 0.00 178.00 179.97 3ii0 h GLU 315 N 0.25 0.05 -0.54 1.05 4.81 -1.94 -2.23 114.58 116.02 3ii0 h GLU 315 Ca 0.21 -0.04 -0.04 0.00 -0.13 0.00 0.00 59.36 59.35 3ii0 h GLU 315 Cb 0.50 0.01 -0.03 0.00 0.63 0.00 0.00 28.75 29.86 3ii0 h GLU 315 CO -0.04 0.70 0.15 -0.07 -0.73 0.00 0.00 179.01 179.02 3ii0 h LEU 316 N -0.58 0.75 -0.29 1.64 3.38 -1.73 -2.02 115.31 116.45 3ii0 h LEU 316 Ca -0.00 -0.12 0.02 0.00 0.09 0.00 0.00 57.88 57.86 3ii0 h LEU 316 Cb 0.70 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 41.24 3ii0 h LEU 316 CO 0.01 0.72 0.16 0.15 0.09 0.00 0.00 178.44 179.57 3ii0 h PHE 317 N 0.79 0.29 -0.57 1.13 3.04 -0.72 0.37 116.94 121.28 3ii0 h PHE 317 Ca 0.18 0.01 -0.03 0.00 3.98 0.00 0.00 57.97 62.10 3ii0 h PHE 317 Cb 0.26 -0.09 -0.02 0.00 2.56 0.00 0.00 35.95 38.65 3ii0 h PHE 317 CO 0.01 0.17 0.22 1.49 -2.02 0.00 0.00 178.31 178.18 3ii0 h GLU 318 N 0.33 0.85 -0.71 1.11 4.81 -1.12 -1.53 114.58 118.32 3ii0 h GLU 318 Ca 0.12 -0.16 0.03 0.00 -0.13 0.00 0.00 59.36 59.21 3ii0 h GLU 318 Cb 0.02 -0.14 -0.04 0.00 0.63 0.00 0.00 28.75 29.22 3ii0 h GLU 318 CO -0.07 0.74 0.45 1.49 -0.73 0.00 0.00 179.01 180.89 3ii0 h GLU 319 N 0.78 0.86 -0.50 1.92 4.81 -0.97 -2.64 114.58 118.83 3ii0 h GLU 319 Ca 0.19 -0.05 -0.02 0.00 -0.13 0.00 0.00 59.36 59.35 3ii0 h GLU 319 Cb 0.21 -0.19 -0.02 0.00 0.63 0.00 0.00 28.75 29.38 3ii0 h GLU 319 CO -0.01 0.57 0.24 2.35 -0.73 0.00 0.00 179.01 181.43 3ii0 h TRP 320 N 0.88 0.73 0.00 0.92 7.01 -0.55 -0.85 115.95 124.09 3ii0 h TRP 320 Ca 0.28 -0.03 -0.06 0.00 2.11 0.00 0.00 58.89 61.19 3ii0 h TRP 320 Cb -0.01 -0.23 -0.01 0.00 -2.10 0.00 0.00 29.16 26.82 3ii0 h TRP 320 CO -0.04 0.57 -0.26 1.79 -2.79 0.00 0.00 178.44 177.71 3ii0 h THR 321 N 0.67 1.06 -0.30 2.65 1.35 -1.10 -0.24 112.91 117.00 3ii0 h THR 321 Ca 0.17 -0.94 -0.06 0.00 -0.55 0.00 0.00 66.41 65.04 3ii0 h THR 321 Cb 0.12 1.52 -0.01 0.00 -1.73 0.00 0.00 68.15 68.05 3ii0 h THR 321 CO -0.02 0.26 -0.04 1.23 -0.25 0.00 0.00 175.52 176.70 3ii0 h GLY 322 N 0.94 0.60 0.85 5.82 0.00 -1.10 -1.11 103.07 109.07 3ii0 h GLY 322 Ca -0.00 -0.47 0.03 0.00 0.00 0.00 0.00 47.33 46.89 3ii0 h GLY 322 CO 0.03 0.43 0.43 3.43 0.00 0.00 0.00 176.54 180.86 3ii0 h ASN 323 N 0.33 0.69 -0.29 0.19 -0.26 -0.14 0.13 115.58 116.25 3ii0 h ASN 323 Ca 0.08 0.00 -0.01 0.00 -0.56 0.00 0.00 56.30 55.81 3ii0 h ASN 323 Cb 0.50 -0.14 -0.01 0.00 -1.06 0.00 0.00 38.32 37.60 3ii0 h ASN 323 CO 0.02 0.48 0.13 0.58 -1.06 0.00 0.00 177.43 177.58 3ii0 h VAL 324 N 0.83 1.16 -0.96 2.81 2.07 -1.02 -2.73 116.25 118.41 3ii0 h VAL 324 Ca 0.28 -0.47 0.11 0.00 0.82 0.00 0.00 66.70 67.44 3ii0 h VAL 324 Cb 0.04 0.94 -0.08 0.00 -1.52 0.00 0.00 31.29 30.68 3ii0 h VAL 324 CO -0.12 0.16 0.59 0.50 0.02 0.00 0.00 177.57 178.73 3ii0 h LYS 325 N 0.32 0.92 -0.55 1.57 1.63 -0.84 -1.61 116.57 118.01 3ii0 h LYS 325 Ca 0.10 -0.06 0.03 0.00 -0.85 0.00 0.00 60.65 59.88 3ii0 h LYS 325 Cb 0.14 -0.21 -0.04 0.00 -0.60 0.00 0.00 32.23 31.52 3ii0 h LYS 325 CO -0.01 0.61 0.32 1.15 -3.45 0.00 0.00 179.45 178.07 3ii0 h THR 326 N 0.95 1.02 -0.07 1.00 2.02 -0.45 -0.46 112.91 116.92 3ii0 h THR 326 Ca 0.47 -0.21 -0.00 0.00 0.77 0.00 0.00 66.41 67.43 3ii0 h THR 326 Cb 0.45 0.35 -0.00 0.00 -1.74 0.00 0.00 68.15 67.20 3ii0 h THR 326 CO -0.26 0.11 0.03 0.24 0.37 0.00 0.00 175.52 176.01 3ii0 h MET 327 N 0.62 0.11 -0.38 6.66 2.86 -1.17 -2.47 114.93 121.16 3ii0 h MET 327 Ca 0.23 -0.02 -0.04 0.00 -2.06 0.00 0.00 59.70 57.81 3ii0 h MET 327 Cb 0.07 -0.02 -0.02 0.00 0.06 0.00 0.00 31.60 31.69 3ii0 h MET 327 CO -0.12 0.25 0.07 0.00 1.06 0.00 0.00 176.91 178.18 3ii0 h ALA 328 N 0.85 1.42 -0.32 6.32 0.00 -1.10 -2.33 119.26 124.09 3ii0 h ALA 328 Ca 0.02 -0.17 -0.16 0.00 0.00 0.00 0.00 54.91 54.61 3ii0 h ALA 328 Cb 0.19 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 3ii0 h ALA 328 CO -0.00 0.42 -0.44 -0.44 0.00 0.00 0.00 179.25 178.79 3ii0 h ASP 329 N 0.55 0.89 -0.41 0.00 3.32 -0.98 -2.12 116.42 117.67 3ii0 h ASP 329 Ca 0.13 -0.43 -0.04 0.00 0.02 0.00 0.00 57.03 56.71 3ii0 h ASP 329 Cb 0.25 -0.25 -0.02 0.00 0.22 0.00 0.00 39.33 39.52 3ii0 h ASP 329 CO -0.00 1.20 0.12 -0.09 -1.72 0.00 0.00 179.24 178.75 3ii0 h ARG 330 N 0.67 0.72 -0.32 3.56 2.43 -1.14 -1.65 114.38 118.64 3ii0 h ARG 330 Ca 0.04 -0.13 -0.06 0.00 -0.81 0.00 0.00 59.98 59.02 3ii0 h ARG 330 Cb 1.01 -0.11 -0.01 0.00 -0.42 0.00 0.00 29.97 30.44 3ii0 h ARG 330 CO 0.10 0.65 -0.02 0.82 -1.51 0.00 0.00 179.97 180.01 3ii0 h ILE 331 N 0.70 1.26 -0.71 1.20 2.04 -1.23 -1.00 117.51 119.78 3ii0 h ILE 331 Ca 0.16 -1.00 0.10 0.00 1.00 0.00 0.00 64.86 65.11 3ii0 h ILE 331 Cb 0.25 1.27 -0.07 0.00 -0.74 0.00 0.00 36.82 37.53 3ii0 h ILE 331 CO -0.00 0.33 0.34 -0.07 0.00 0.00 0.00 178.15 178.75 3ii0 h LEU 332 N 0.38 0.44 -0.25 1.44 3.38 -1.06 -0.80 115.31 118.84 3ii0 h LEU 332 Ca 0.09 0.06 -0.00 0.00 0.09 0.00 0.00 57.88 58.12 3ii0 h LEU 332 Cb 0.48 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 41.21 3ii0 h LEU 332 CO 0.02 0.25 0.15 0.74 0.09 0.00 0.00 178.44 179.69 3ii0 h THR 333 N 0.58 1.09 -0.86 0.22 2.02 -0.92 -1.97 112.91 113.06 3ii0 h THR 333 Ca 0.35 -0.21 -0.03 0.00 0.77 0.00 0.00 66.41 67.29 3ii0 h THR 333 Cb 0.38 0.78 -0.04 0.00 -1.74 0.00 0.00 68.15 67.53 3ii0 h THR 333 CO -0.28 0.09 0.43 0.24 0.37 0.00 0.00 175.52 176.37 3ii0 h MET 334 N 0.32 1.24 -0.24 6.66 2.86 -0.84 -1.08 114.93 123.84 3ii0 h MET 334 Ca 0.09 -0.18 0.02 0.00 -2.06 0.00 0.00 59.70 57.57 3ii0 h MET 334 Cb 0.01 -0.23 -0.02 0.00 0.06 0.00 0.00 31.60 31.42 3ii0 h MET 334 CO -0.02 0.94 0.11 0.00 1.06 0.00 0.00 176.91 179.00 3ii0 h ARG 335 N 1.23 0.23 -0.35 1.72 3.08 -0.88 -0.86 114.38 118.56 3ii0 h ARG 335 Ca 0.30 -0.01 0.02 0.00 0.07 0.00 0.00 59.98 60.35 3ii0 h ARG 335 Cb 0.10 -0.05 -0.02 0.00 0.08 0.00 0.00 29.97 30.08 3ii0 h ARG 335 CO -0.04 0.15 0.20 1.03 -1.07 0.00 0.00 179.97 180.24 3ii0 h SER 336 N 0.24 0.31 -0.43 7.04 0.87 -1.04 -2.10 113.55 118.44 3ii0 h SER 336 Ca 0.10 0.01 -0.13 0.00 -1.23 0.00 0.00 61.79 60.54 3ii0 h SER 336 Cb 0.04 -0.06 -0.01 0.00 -0.44 0.00 0.00 62.40 61.92 3ii0 h SER 336 CO -0.08 0.23 -0.22 -0.33 -0.53 0.00 0.00 176.83 175.91 3ii0 h GLU 337 N 0.40 0.94 0.18 2.24 4.39 -1.12 0.15 114.58 121.77 3ii0 h GLU 337 Ca 0.14 -0.40 -0.01 0.00 0.34 0.00 0.00 59.36 59.43 3ii0 h GLU 337 Cb 0.01 -0.04 0.00 0.00 -0.10 0.00 0.00 28.75 28.63 3ii0 h GLU 337 CO -0.07 1.06 -0.09 1.25 -1.16 0.00 0.00 179.01 180.00 3ii0 h LEU 338 N 0.82 -0.21 -0.35 1.33 5.85 -1.09 -1.68 115.31 119.98 3ii0 h LEU 338 Ca 0.11 -0.16 0.04 0.00 0.84 0.00 0.00 57.88 58.70 3ii0 h LEU 338 Cb 0.78 0.05 -0.04 0.00 0.37 0.00 0.00 40.66 41.83 3ii0 h LEU 338 CO 0.06 0.05 0.13 -0.09 -0.34 0.00 0.00 178.44 178.25 3ii0 h ARG 339 N -0.46 0.27 -0.71 1.25 2.43 -1.36 -1.07 114.38 114.72 3ii0 h ARG 339 Ca -0.02 -0.02 0.07 0.00 -0.81 0.00 0.00 59.98 59.20 3ii0 h ARG 339 Cb 0.36 -0.06 -0.06 0.00 -0.42 0.00 0.00 29.97 29.78 3ii0 h ARG 339 CO 0.04 0.18 0.38 0.00 -1.51 0.00 0.00 179.97 179.07 3ii0 h ALA 340 N 1.22 0.97 -0.34 2.80 0.00 -0.91 -0.95 119.26 122.04 3ii0 h ALA 340 Ca 0.16 0.03 -0.06 0.00 0.00 0.00 0.00 54.91 55.04 3ii0 h ALA 340 Cb 0.12 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 3ii0 h ALA 340 CO -0.15 0.03 -0.02 0.00 0.00 0.00 0.00 179.25 179.11 3ii0 h ARG 341 N 0.68 0.62 -0.83 0.00 3.08 -0.87 -0.31 114.38 116.75 3ii0 h ARG 341 Ca 0.33 -0.21 -0.00 0.00 0.07 0.00 0.00 59.98 60.17 3ii0 h ARG 341 Cb 0.27 -0.05 -0.04 0.00 0.08 0.00 0.00 29.97 30.22 3ii0 h ARG 341 CO -0.22 0.75 0.51 -0.07 -1.07 0.00 0.00 179.97 179.88 3ii0 h LEU 342 N 0.42 0.99 -0.45 3.04 3.38 -0.86 -0.47 115.31 121.37 3ii0 h LEU 342 Ca 0.09 -0.05 -0.16 0.00 0.09 0.00 0.00 57.88 57.85 3ii0 h LEU 342 Cb 0.49 -0.25 -0.00 0.00 0.09 0.00 0.00 40.66 40.98 3ii0 h LEU 342 CO 0.02 0.75 -0.50 -0.33 0.09 0.00 0.00 178.44 178.47 3ii0 h GLU 343 N 1.14 0.72 -0.06 1.13 5.08 -0.99 -2.10 114.58 119.51 3ii0 h GLU 343 Ca 0.30 -0.43 -0.06 0.00 -1.00 0.00 0.00 59.36 58.17 3ii0 h GLU 343 Cb -0.07 0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.21 3ii0 h GLU 343 CO -0.06 1.05 -0.26 0.00 -1.00 0.00 0.00 179.01 178.74 3ii0 h ALA 344 N 0.87 1.45 0.00 3.43 0.00 -0.37 -0.97 119.26 123.67 3ii0 h ALA 344 Ca 0.02 -0.27 0.00 0.00 0.00 0.00 0.00 54.91 54.66 3ii0 h ALA 344 Cb 1.07 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.79 3ii0 h ALA 344 CO 0.10 0.40 0.00 1.28 0.00 0.00 0.00 179.25 181.03 3ii0 n LEU 345 N -4.19 0.00 -2.37 0.00 4.77 -0.25 -4.93 117.00 110.03 3ii0 n LEU 345 Ca -0.02 0.34 -0.18 0.00 -0.03 0.00 0.00 56.01 56.13 3ii0 n LEU 345 Cb 0.34 -0.34 0.03 0.00 -2.33 0.00 0.00 43.42 41.12 3ii0 n LEU 345 CO 0.38 -0.03 -0.02 0.29 -1.33 0.00 0.00 177.39 176.68 3ii0 n LYS 346 N -1.34 -3.63 -1.79 3.23 4.76 -0.37 -4.95 118.16 114.07 3ii0 n LYS 346 Ca 0.11 0.73 -0.42 0.00 -2.87 0.00 0.00 58.31 55.86 3ii0 n LYS 346 Cb 0.24 -5.19 -0.03 0.00 -1.84 0.00 0.00 35.03 28.22 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 2.48 0.62 -0.18 2.01 -0.81 -4.94 115.64 111.79 3ii0 s THR 347 Ca 0.22 0.18 -0.18 0.00 0.31 0.00 0.00 61.69 62.22 3ii0 s THR 347 Cb -0.10 -3.12 -0.05 0.00 0.01 0.00 0.00 72.50 69.24 3ii0 s THR 347 CO 0.27 0.01 0.75 -2.65 -0.69 0.00 0.00 174.62 172.30 3ii0 n PRO 348 N 4.86 0.62 0.00 4.92 -0.02 -1.26 -4.79 135.00 139.34 3ii0 n PRO 348 Ca 0.16 0.25 0.00 0.00 -2.02 0.00 0.00 63.50 61.89 3ii0 n PRO 348 Cb 0.38 -1.96 0.00 0.00 -0.02 0.00 0.00 33.50 31.90 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 1.50 -0.76 3.89 -1.23 0.00 -1.26 -4.97 105.19 102.36 3ii0 n GLY 349 Ca 0.13 -1.71 -0.28 0.00 0.00 0.00 0.00 46.02 44.15 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 -1.21 5.11 -0.03 2.61 -4.23 -1.26 -5.03 115.64 111.60 3ii0 s THR 350 Ca 0.00 -0.68 0.04 0.00 -1.18 0.00 0.00 61.69 59.88 3ii0 s THR 350 Cb 0.00 -3.57 0.07 0.00 1.34 0.00 0.00 72.50 70.34 3ii0 s THR 350 CO 0.00 -0.00 0.90 0.79 -0.54 0.00 0.00 174.62 175.77 3ii0 n TRP 351 N -0.15 0.00 0.34 3.99 7.02 -1.26 -4.74 117.44 122.65 3ii0 n TRP 351 Ca -0.07 -0.33 0.14 0.00 -1.02 0.00 0.00 57.50 56.22 3ii0 n TRP 351 Cb 0.53 -0.06 0.59 0.00 -2.42 0.00 0.00 31.31 29.95 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 0.18 -0.99 -1.07 -1.97 -2.65 115.58 109.08 3ii0 h ASN 352 Ca 0.00 0.00 -0.02 0.00 0.07 0.00 0.00 56.30 56.35 3ii0 h ASN 352 Cb 1.02 0.00 -0.00 0.00 -2.07 0.00 0.00 38.32 37.27 3ii0 h ASN 352 CO 0.00 0.00 -0.11 1.12 0.07 0.00 0.00 177.43 178.51 3ii0 h HIS 353 N 0.00 0.00 -0.69 4.14 2.07 -1.96 0.10 115.15 118.81 3ii0 h HIS 353 Ca 0.00 0.00 -0.02 0.00 -2.85 0.00 0.00 60.37 57.50 3ii0 h HIS 353 Cb 0.36 0.00 -0.03 0.00 2.57 0.00 0.00 27.41 30.31 3ii0 h HIS 353 CO 0.00 0.11 0.37 0.82 -3.07 0.00 0.00 177.93 176.16 3ii0 h ILE 354 N 0.00 1.22 0.00 6.12 1.08 -1.83 -2.04 117.51 122.06 3ii0 h ILE 354 Ca -0.00 -0.57 0.00 0.00 -0.39 0.00 0.00 64.86 63.90 3ii0 h ILE 354 Cb 0.23 0.33 0.00 0.00 -3.07 0.00 0.00 36.82 34.31 3ii0 h ILE 354 CO 0.01 0.25 -0.96 0.35 -0.69 0.00 0.00 178.15 177.11 3ii0 n THR 355 N -4.48 0.50 0.01 -0.27 -2.24 -0.90 -4.06 114.28 102.84 3ii0 n THR 355 Ca 0.06 -0.46 -0.16 0.00 -2.27 0.00 0.00 64.05 61.22 3ii0 n THR 355 Cb 0.10 -0.23 -0.05 0.00 -2.10 0.00 0.00 70.33 68.05 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 0.80 -4.13 3.42 3.32 -0.60 -3.46 116.42 115.76 3ii0 h ASP 356 Ca 0.00 -0.55 -0.51 0.00 0.02 0.00 0.00 57.03 55.99 3ii0 h ASP 356 Cb 0.92 -0.24 0.09 0.00 0.22 0.00 0.00 39.33 40.32 3ii0 h ASP 356 CO 0.00 1.34 0.42 -1.10 -1.72 0.00 0.00 179.24 178.17 3ii0 s GLN 357 N -3.61 3.05 0.29 3.56 -0.21 -0.78 -4.97 119.66 116.98 3ii0 s GLN 357 Ca -0.09 1.57 0.06 0.00 0.02 0.00 0.00 55.36 56.93 3ii0 s GLN 357 Cb 0.09 -1.97 -0.06 0.00 1.00 0.00 0.00 33.01 32.07 3ii0 s GLN 357 CO 0.89 -1.09 -0.05 0.96 -2.12 0.00 0.00 175.29 173.89 3ii0 s ILE 358 N -1.95 1.62 0.00 1.08 -4.36 0.25 -4.99 121.20 112.85 3ii0 s ILE 358 Ca 0.72 -2.11 0.00 0.00 -0.26 0.00 0.00 60.65 58.99 3ii0 s ILE 358 Cb -0.24 -2.49 0.00 0.00 1.25 0.00 0.00 42.46 40.99 3ii0 s ILE 358 CO 0.34 -0.27 0.00 0.61 0.24 0.00 0.00 174.94 175.85 3ii0 n GLY 359 N -0.60 0.25 0.04 6.27 0.00 -1.13 -4.42 105.19 105.60 3ii0 n GLY 359 Ca -0.05 -1.63 0.09 0.00 0.00 0.00 0.00 46.02 44.42 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 0.71 0.65 -4.20 1.61 1.56 -1.26 -4.93 117.12 111.25 3ii0 n MET 360 Ca 0.00 -0.10 -0.23 0.00 -0.27 0.00 0.00 57.70 57.10 3ii0 n MET 360 Cb 0.00 -1.60 -0.07 0.00 2.15 0.00 0.00 33.22 33.71 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 -3.36 2.72 -0.07 1.12 0.08 -1.26 -1.23 117.98 115.98 3ii0 s PHE 361 Ca -0.06 -0.30 0.03 0.00 0.12 0.00 0.00 56.93 56.72 3ii0 s PHE 361 Cb 0.12 -1.42 0.01 0.00 -0.57 0.00 0.00 43.02 41.16 3ii0 s PHE 361 CO 0.87 0.48 -0.18 0.45 -0.10 0.00 0.00 175.22 176.75 3ii0 s SER 362 N -3.76 2.35 -0.77 1.36 0.15 -0.25 -4.67 113.70 108.10 3ii0 s SER 362 Ca 0.34 -0.41 -0.19 0.00 0.70 0.00 0.00 55.95 56.39 3ii0 s SER 362 Cb -0.04 -1.01 0.12 0.00 -1.71 0.00 0.00 66.02 63.38 3ii0 s SER 362 CO 0.21 0.10 0.95 0.12 1.20 0.00 0.00 173.24 175.83 3ii0 s PHE 363 N 0.43 3.04 0.09 3.44 5.36 -1.26 -1.36 117.98 127.73 3ii0 s PHE 363 Ca -0.14 -1.14 0.21 0.00 -0.96 0.00 0.00 56.93 54.89 3ii0 s PHE 363 Cb -0.16 -4.18 0.71 0.00 -0.34 0.00 0.00 43.02 39.05 3ii0 s PHE 363 CO 0.05 -1.44 1.74 1.79 -1.46 0.00 0.00 175.22 175.90 3ii0 h THR 364 N 5.79 0.69 0.00 0.12 1.35 -1.83 -3.48 112.91 115.55 3ii0 h THR 364 Ca -0.06 -1.40 0.00 0.00 -0.55 0.00 0.00 66.41 64.40 3ii0 h THR 364 Cb 1.05 1.92 0.00 0.00 -1.73 0.00 0.00 68.15 69.39 3ii0 h THR 364 CO 1.09 0.30 0.00 0.61 -0.25 0.00 0.00 175.52 177.27 3ii0 n GLY 365 N 0.35 0.76 3.77 5.82 0.00 -1.26 -5.04 105.19 109.59 3ii0 n GLY 365 Ca 0.00 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.63 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 4.24 0.87 0.99 1.43 -1.26 -5.03 118.68 119.91 3ii0 s LEU 366 Ca 0.00 2.64 -0.13 0.00 -1.03 0.00 0.00 54.13 55.61 3ii0 s LEU 366 Cb 0.00 -3.88 0.14 0.00 0.03 0.00 0.00 46.19 42.48 3ii0 s LEU 366 CO 0.00 -0.80 1.23 0.54 0.23 0.00 0.00 176.35 177.55 3ii0 s ASN 367 N -0.73 3.88 0.35 2.29 2.20 -1.26 -4.27 114.94 117.40 3ii0 s ASN 367 Ca 0.56 0.48 0.07 0.00 -0.94 0.00 0.00 52.86 53.02 3ii0 s ASN 367 Cb -0.38 -0.77 0.67 0.00 -2.00 0.00 0.00 41.25 38.77 3ii0 s ASN 367 CO 0.49 -2.26 1.88 -0.65 -2.94 0.00 0.00 177.10 173.61 3ii0 h PRO 368 N -1.27 0.38 -0.25 3.55 0.11 -1.94 -1.62 132.00 130.96 3ii0 h PRO 368 Ca -0.45 -0.09 -0.14 0.00 0.11 0.00 0.00 66.00 65.43 3ii0 h PRO 368 Cb 1.28 -0.05 -0.00 0.00 0.11 0.00 0.00 31.00 32.34 3ii0 h PRO 368 CO 0.52 0.48 -0.39 0.87 -0.21 0.00 0.00 178.00 179.27 3ii0 h LYS 369 N 0.36 0.71 -0.84 1.05 1.57 -1.94 -1.31 116.57 116.17 3ii0 h LYS 369 Ca 0.07 -0.43 0.06 0.00 -1.87 0.00 0.00 60.65 58.49 3ii0 h LYS 369 Cb 0.39 0.04 -0.06 0.00 0.08 0.00 0.00 32.23 32.68 3ii0 h LYS 369 CO 0.02 1.05 0.51 1.96 -0.57 0.00 0.00 179.45 182.42 3ii0 h GLN 370 N 0.44 0.90 -0.69 3.15 4.20 -1.79 -0.20 115.11 121.12 3ii0 h GLN 370 Ca 0.02 -0.05 -0.03 0.00 0.06 0.00 0.00 58.65 58.65 3ii0 h GLN 370 Cb 0.99 -0.20 -0.03 0.00 0.30 0.00 0.00 27.48 28.53 3ii0 h GLN 370 CO 0.09 0.60 0.31 0.28 -0.67 0.00 0.00 178.83 179.44 3ii0 h VAL 371 N 0.93 1.23 -0.35 -0.54 2.07 -1.09 -1.22 116.25 117.28 3ii0 h VAL 371 Ca 0.37 -0.68 -0.07 0.00 0.82 0.00 0.00 66.70 67.13 3ii0 h VAL 371 Cb 0.19 0.41 -0.02 0.00 -1.52 0.00 0.00 31.29 30.35 3ii0 h VAL 371 CO -0.18 0.28 -0.09 -0.08 0.02 0.00 0.00 177.57 177.52 3ii0 h GLU 372 N 0.96 0.59 -0.08 1.57 4.81 -0.78 0.95 114.58 122.61 3ii0 h GLU 372 Ca 0.23 -0.17 -0.00 0.00 -0.13 0.00 0.00 59.36 59.30 3ii0 h GLU 372 Cb 0.15 -0.06 -0.00 0.00 0.63 0.00 0.00 28.75 29.46 3ii0 h GLU 372 CO -0.03 0.68 0.05 -0.92 -0.73 0.00 0.00 179.01 178.06 3ii0 h TYR 373 N 0.55 0.10 -0.38 0.92 3.20 -0.69 -1.20 116.97 119.47 3ii0 h TYR 373 Ca 0.10 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.97 3ii0 h TYR 373 Cb 0.49 -0.03 -0.02 0.00 1.54 0.00 0.00 36.73 38.71 3ii0 h TYR 373 CO 0.02 0.10 0.24 -0.07 -1.64 0.00 0.00 178.16 176.81 3ii0 h LEU 374 N 0.07 0.44 0.43 2.82 3.38 -0.40 -1.06 115.31 120.99 3ii0 h LEU 374 Ca 0.03 -0.03 -0.02 0.00 0.09 0.00 0.00 57.88 57.95 3ii0 h LEU 374 Cb 0.03 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 40.67 3ii0 h LEU 374 CO -0.01 0.34 -0.21 0.58 0.09 0.00 0.00 178.44 179.24 3ii0 h VAL 375 N 0.50 0.53 0.14 1.22 2.07 -0.68 -0.67 116.25 119.37 3ii0 h VAL 375 Ca 0.14 -0.39 -0.29 0.00 0.82 0.00 0.00 66.70 66.98 3ii0 h VAL 375 Cb -0.03 0.70 0.02 0.00 -1.52 0.00 0.00 31.29 30.46 3ii0 h VAL 375 CO -0.03 0.07 -1.26 0.78 0.02 0.00 0.00 177.57 177.14 3ii0 h ASN 376 N -0.82 0.69 0.11 0.57 2.35 -1.20 -2.16 115.58 115.12 3ii0 h ASN 376 Ca -0.06 -0.68 -0.36 0.00 -0.55 0.00 0.00 56.30 54.65 3ii0 h ASN 376 Cb 0.55 -0.22 -0.05 0.00 0.05 0.00 0.00 38.32 38.65 3ii0 h ASN 376 CO 0.10 1.51 -2.21 -0.62 -1.65 0.00 0.00 177.43 174.55 3ii0 n GLU 377 N -3.69 0.69 0.00 0.81 -0.58 -0.42 -4.58 120.64 112.87 3ii0 n GLU 377 Ca -0.12 0.17 0.09 0.00 -0.42 0.00 0.00 57.16 56.88 3ii0 n GLU 377 Cb 1.01 -1.61 -0.06 0.00 -0.57 0.00 0.00 31.44 30.20 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 -3.19 1.21 -2.73 3.49 4.76 -0.71 -4.98 118.16 116.01 3ii0 n LYS 378 Ca -0.35 -0.35 -0.20 0.00 -2.87 0.00 0.00 58.31 54.54 3ii0 n LYS 378 Cb 1.05 -1.36 0.02 0.00 -1.84 0.00 0.00 35.03 32.90 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 -0.90 -1.46 -3.66 2.13 8.25 -0.34 -4.68 115.22 114.56 3ii0 n HIS 379 Ca 0.05 0.29 -0.39 0.00 -0.26 0.00 0.00 57.72 57.42 3ii0 n HIS 379 Cb 0.33 -4.05 -0.12 0.00 1.12 0.00 0.00 29.99 27.27 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 -3.07 4.52 -0.31 1.59 1.01 -0.78 -1.44 121.20 122.72 3ii0 s ILE 380 Ca 0.17 -0.54 -0.17 0.00 0.00 0.00 0.00 60.65 60.11 3ii0 s ILE 380 Cb -0.08 -3.35 -0.02 0.00 0.01 0.00 0.00 42.46 39.02 3ii0 s ILE 380 CO 0.21 0.01 0.46 -0.31 0.00 0.00 0.00 174.94 175.30 3ii0 s TYR 381 N 1.59 3.22 0.29 3.97 1.51 -0.15 -2.82 117.35 124.94 3ii0 s TYR 381 Ca 0.04 0.30 -0.02 0.00 -1.01 0.00 0.00 57.07 56.38 3ii0 s TYR 381 Cb -0.17 -2.76 -0.02 0.00 -0.11 0.00 0.00 41.96 38.90 3ii0 s TYR 381 CO 0.06 -0.39 0.35 -0.48 -1.11 0.00 0.00 175.55 173.97 3ii0 s LEU 382 N 2.24 1.06 0.46 -1.29 2.34 -1.26 -0.72 118.68 121.51 3ii0 s LEU 382 Ca 0.17 -1.41 -0.18 0.00 0.06 0.00 0.00 54.13 52.78 3ii0 s LEU 382 Cb -0.16 1.07 -0.09 0.00 -0.56 0.00 0.00 46.19 46.45 3ii0 s LEU 382 CO 0.11 -1.10 0.94 -0.76 -1.06 0.00 0.00 176.35 174.47 3ii0 s LEU 383 N -3.20 3.80 0.56 1.48 1.43 -1.13 -4.94 118.68 116.67 3ii0 s LEU 383 Ca 0.33 1.56 0.23 0.00 -1.03 0.00 0.00 54.13 55.23 3ii0 s LEU 383 Cb 0.02 -4.45 1.55 0.00 0.03 0.00 0.00 46.19 43.34 3ii0 s LEU 383 CO 0.17 -0.45 2.20 -0.65 0.23 0.00 0.00 176.35 177.85 3ii0 h PRO 384 N 1.45 0.00 0.00 1.29 0.11 -1.94 0.62 132.00 133.53 3ii0 h PRO 384 Ca -0.48 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.63 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 -3.37 113.55 110.86 3ii0 h SER 385 Ca 0.01 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.33 3ii0 h SER 385 Cb 0.04 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.13 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 -0.92 0.75 3.71 -0.77 0.00 0.21 -4.67 105.19 103.50 3ii0 n GLY 386 Ca -0.01 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.58 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 -0.64 4.38 0.11 1.61 3.52 -1.25 -2.68 118.95 124.00 3ii0 s ARG 387 Ca 0.00 1.84 0.08 0.00 -0.13 0.00 0.00 55.73 57.52 3ii0 s ARG 387 Cb 0.00 -3.39 -0.04 0.00 -1.56 0.00 0.00 34.95 29.96 3ii0 s ARG 387 CO 0.00 -0.36 -0.15 0.96 -0.81 0.00 0.00 175.30 174.94 3ii0 s ILE 388 N 1.42 3.02 -0.60 4.11 -4.36 -0.46 -2.86 121.20 121.47 3ii0 s ILE 388 Ca 0.60 -1.40 -0.26 0.00 -0.26 0.00 0.00 60.65 59.33 3ii0 s ILE 388 Cb -0.30 -2.39 0.04 0.00 1.25 0.00 0.00 42.46 41.06 3ii0 s ILE 388 CO 0.28 0.12 1.07 0.21 0.24 0.00 0.00 174.94 176.86 3ii0 s ASN 389 N -2.12 6.34 0.48 4.36 2.47 0.11 -1.09 114.94 125.48 3ii0 s ASN 389 Ca 0.19 -0.27 0.15 0.00 0.42 0.00 0.00 52.86 53.35 3ii0 s ASN 389 Cb -0.11 -2.49 1.15 0.00 -1.45 0.00 0.00 41.25 38.35 3ii0 s ASN 389 CO 0.11 -1.42 2.06 0.58 -3.72 0.00 0.00 177.10 174.71 3ii0 h VAL 390 N 6.06 0.94 0.00 -5.21 2.07 -1.48 -1.57 116.25 117.07 3ii0 h VAL 390 Ca -0.26 -0.08 0.00 0.00 0.82 0.00 0.00 66.70 67.18 3ii0 h VAL 390 Cb 1.06 0.70 0.00 0.00 -1.52 0.00 0.00 31.29 31.54 3ii0 h VAL 390 CO 1.16 0.04 0.00 -1.54 0.02 0.00 0.00 177.57 177.25 3ii0 n SER 391 N -4.48 0.00 0.00 0.57 3.41 -1.25 -1.51 113.62 110.37 3ii0 n SER 391 Ca 0.04 -1.12 0.12 0.00 -0.26 0.00 0.00 58.87 57.65 3ii0 n SER 391 Cb 0.26 0.00 0.15 0.00 -0.26 0.00 0.00 64.21 64.36 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 0.55 -1.20 3.79 5.00 0.00 -0.59 -2.14 105.19 110.60 3ii0 n GLY 392 Ca 0.13 -0.40 -0.36 0.00 0.00 0.00 0.00 46.02 45.38 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 -3.11 4.29 0.16 0.99 1.43 -0.57 -4.89 118.68 116.98 3ii0 s LEU 393 Ca 0.10 1.83 0.00 0.00 -1.03 0.00 0.00 54.13 55.03 3ii0 s LEU 393 Cb 0.17 -4.08 -0.04 0.00 0.03 0.00 0.00 46.19 42.27 3ii0 s LEU 393 CO 0.74 -0.11 0.04 0.42 0.23 0.00 0.00 176.35 177.67 3ii0 s THR 394 N -1.68 0.38 0.49 5.49 -4.23 -1.26 -4.85 115.64 109.97 3ii0 s THR 394 Ca 0.52 -1.95 0.26 0.00 -1.18 0.00 0.00 61.69 59.34 3ii0 s THR 394 Cb -0.18 -2.11 0.30 0.00 1.34 0.00 0.00 72.50 71.85 3ii0 s THR 394 CO 0.23 -0.44 2.14 0.71 -0.54 0.00 0.00 174.62 176.71 3ii0 h THR 395 N 2.76 0.64 0.00 3.99 1.35 -1.96 -0.76 112.91 118.92 3ii0 h THR 395 Ca -0.36 -0.31 -0.17 0.00 -0.55 0.00 0.00 66.41 65.02 3ii0 h THR 395 Cb 1.20 1.19 -0.02 0.00 -1.73 0.00 0.00 68.15 68.79 3ii0 h THR 395 CO 0.61 0.07 -0.80 0.11 -0.25 0.00 0.00 175.52 175.26 3ii0 h LYS 396 N 0.00 0.00 -0.00 4.72 1.57 -1.96 -3.35 116.57 117.54 3ii0 h LYS 396 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3ii0 h LYS 396 Cb 0.19 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.50 3ii0 h LYS 396 CO 0.01 0.80 -0.69 0.27 -0.57 0.00 0.00 179.45 179.28 3ii0 n ASN 397 N -3.47 1.10 -0.03 0.86 0.23 -0.94 -4.72 115.26 108.29 3ii0 n ASN 397 Ca -0.00 -1.05 -0.10 0.00 -0.53 0.00 0.00 54.58 52.90 3ii0 n ASN 397 Cb 0.80 0.84 -0.04 0.00 -2.08 0.00 0.00 39.78 39.31 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 0.60 0.02 -0.78 -4.53 -0.00 -1.30 -0.24 115.31 109.08 3ii0 h LEU 398 Ca 0.00 0.02 -0.01 0.00 -0.00 0.00 0.00 57.88 57.90 3ii0 h LEU 398 Cb 0.47 0.03 -0.04 0.00 -0.00 0.00 0.00 40.66 41.12 3ii0 h LEU 398 CO 0.00 0.04 0.46 -0.78 -0.00 0.00 0.00 178.44 178.16 3ii0 h ASP 399 N 0.10 0.95 -0.43 -0.43 3.58 -1.84 0.12 116.42 118.46 3ii0 h ASP 399 Ca 0.07 -0.07 -0.03 0.00 0.42 0.00 0.00 57.03 57.42 3ii0 h ASP 399 Cb 0.06 -0.24 -0.02 0.00 1.72 0.00 0.00 39.33 40.85 3ii0 h ASP 399 CO -0.09 0.74 0.15 0.22 -2.88 0.00 0.00 179.24 177.39 3ii0 h TYR 400 N 1.07 0.68 -0.43 0.28 3.20 -1.78 -0.14 116.97 119.85 3ii0 h TYR 400 Ca 0.28 -0.06 -0.03 0.00 3.14 0.00 0.00 58.73 62.06 3ii0 h TYR 400 Cb -0.02 -0.20 -0.02 0.00 1.54 0.00 0.00 36.73 38.03 3ii0 h TYR 400 CO -0.00 0.60 0.15 0.28 -1.64 0.00 0.00 178.16 177.54 3ii0 h VAL 401 N 0.56 1.22 -0.26 1.81 2.07 -0.75 -1.13 116.25 119.76 3ii0 h VAL 401 Ca 0.14 -0.70 -0.04 0.00 0.82 0.00 0.00 66.70 66.92 3ii0 h VAL 401 Cb 0.23 0.86 -0.01 0.00 -1.52 0.00 0.00 31.29 30.85 3ii0 h VAL 401 CO -0.01 0.25 -0.01 0.00 0.02 0.00 0.00 177.57 177.82 3ii0 h ALA 402 N 0.99 0.35 -0.69 1.67 0.00 -0.63 -1.23 119.26 119.73 3ii0 h ALA 402 Ca 0.14 -0.23 -0.04 0.00 0.00 0.00 0.00 54.91 54.77 3ii0 h ALA 402 Cb 0.25 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 17.91 3ii0 h ALA 402 CO -0.01 0.10 0.26 1.79 0.00 0.00 0.00 179.25 181.40 3ii0 h THR 403 N 0.24 1.25 -0.51 0.00 1.35 -1.00 -0.95 112.91 113.28 3ii0 h THR 403 Ca 0.07 -0.79 0.00 0.00 -0.55 0.00 0.00 66.41 65.14 3ii0 h THR 403 Cb 0.45 0.47 -0.02 0.00 -1.73 0.00 0.00 68.15 67.31 3ii0 h THR 403 CO 0.02 0.31 0.33 0.28 -0.25 0.00 0.00 175.52 176.21 3ii0 h SER 404 N 0.99 0.59 -0.65 5.36 0.02 -1.03 -0.53 113.55 118.29 3ii0 h SER 404 Ca 0.23 -0.02 0.02 0.00 -0.84 0.00 0.00 61.79 61.17 3ii0 h SER 404 Cb 0.23 -0.15 -0.04 0.00 0.14 0.00 0.00 62.40 62.59 3ii0 h SER 404 CO -0.02 0.44 0.42 0.40 -1.14 0.00 0.00 176.83 176.93 3ii0 h ILE 405 N 0.68 1.11 -0.74 3.27 2.04 -1.04 -1.10 117.51 121.73 3ii0 h ILE 405 Ca 0.18 -0.28 0.07 0.00 1.00 0.00 0.00 64.86 65.83 3ii0 h ILE 405 Cb -0.07 0.21 -0.06 0.00 -0.74 0.00 0.00 36.82 36.17 3ii0 h ILE 405 CO -0.04 0.15 0.42 -0.74 0.00 0.00 0.00 178.15 177.94 3ii0 h HIS 406 N 0.83 0.77 -0.47 1.37 2.76 -0.65 0.42 115.15 120.19 3ii0 h HIS 406 Ca 0.25 0.03 -0.04 0.00 -2.20 0.00 0.00 60.37 58.41 3ii0 h HIS 406 Cb -0.03 -0.24 -0.02 0.00 1.55 0.00 0.00 27.41 28.68 3ii0 h HIS 406 CO -0.04 0.36 0.13 0.93 -1.30 0.00 0.00 177.93 178.00 3ii0 h GLU 407 N 0.76 0.74 -0.73 5.26 5.08 -0.56 -1.99 114.58 123.14 3ii0 h GLU 407 Ca 0.34 -0.17 -0.05 0.00 -1.00 0.00 0.00 59.36 58.48 3ii0 h GLU 407 Cb 0.24 -0.10 -0.03 0.00 0.50 0.00 0.00 28.75 29.35 3ii0 h GLU 407 CO -0.20 0.72 0.26 0.00 -1.00 0.00 0.00 179.01 178.79 3ii0 h ALA 408 N 0.99 0.95 -0.22 3.43 0.00 -0.30 -0.33 119.26 123.78 3ii0 h ALA 408 Ca 0.15 -0.20 -0.18 0.00 0.00 0.00 0.00 54.91 54.68 3ii0 h ALA 408 Cb 0.31 -0.28 -0.00 0.00 0.00 0.00 0.00 17.79 17.81 3ii0 h ALA 408 CO -0.00 0.59 -0.58 0.28 0.00 0.00 0.00 179.25 179.55 3ii0 h VAL 409 N 1.05 1.30 0.00 0.00 2.07 -0.82 -2.42 116.25 117.44 3ii0 h VAL 409 Ca 0.24 -1.81 -0.18 0.00 0.82 0.00 0.00 66.70 65.77 3ii0 h VAL 409 Cb 0.25 1.75 -0.03 0.00 -1.52 0.00 0.00 31.29 31.75 3ii0 h VAL 409 CO -0.01 0.57 -1.22 0.71 0.02 0.00 0.00 177.57 177.64 3ii0 h THR 410 N 0.52 0.76 0.00 2.57 1.35 -1.23 -3.38 112.91 113.49 3ii0 h THR 410 Ca 0.00 -2.31 -0.13 0.00 -0.55 0.00 0.00 66.41 63.42 3ii0 h THR 410 Cb 1.16 2.26 -0.02 0.00 -1.73 0.00 0.00 68.15 69.81 3ii0 h THR 410 CO 0.12 0.43 -1.84 0.29 -0.25 0.00 0.00 175.52 174.27 3ii0 n LYS 411 N -3.04 0.65 -4.05 4.72 5.02 -0.15 -4.89 118.16 116.43 3ii0 n LYS 411 Ca -0.07 -0.01 -0.32 0.00 -2.02 0.00 0.00 58.31 55.89 3ii0 n LYS 411 Cb 0.86 -1.63 -0.15 0.00 -0.02 0.00 0.00 35.03 34.09 3ii0 n LYS 411 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 3ii0 s ILE 412 N -3.10 2.19 0.55 -0.18 1.01 -0.91 -5.07 121.20 115.69 3ii0 s ILE 412 Ca -0.06 -1.89 -0.15 0.00 0.00 0.00 0.00 60.65 58.55 3ii0 s ILE 412 Cb 0.10 -2.42 -0.07 0.00 0.01 0.00 0.00 42.46 40.09 3ii0 s ILE 412 CO 0.85 -0.25 1.00 0.00 0.00 0.00 0.00 174.94 176.54 3ii0 s ALA 413 N 1.04 3.08 0.12 9.38 0.00 -1.26 -4.80 121.76 129.31 3ii0 s ALA 413 Ca -0.01 0.09 -0.29 0.00 0.00 0.00 0.00 51.96 51.75 3ii0 s ALA 413 Cb -0.20 -3.11 -0.09 0.00 0.00 0.00 0.00 23.12 19.73 3ii0 s ALA 413 CO -0.06 -0.39 1.48 0.93 0.00 0.00 0.00 175.76 177.72 3ii0 h GLU 414 N 0.51 -0.28 -6.39 0.00 4.39 -1.98 -3.43 114.58 107.40 3ii0 h GLU 414 Ca -0.46 0.02 -0.69 0.00 0.34 0.00 0.00 59.36 58.57 3ii0 h GLU 414 Cb 1.19 0.06 -0.28 0.00 -0.10 0.00 0.00 28.75 29.62 3ii0 h GLU 414 CO 0.62 -0.18 -0.84 -0.80 -1.16 0.00 0.00 179.01 176.64 3ii0 s ASN 415 N -4.86 3.46 0.37 1.42 0.01 -1.26 -5.02 114.94 109.05 3ii0 s ASN 415 Ca -0.12 -0.37 0.03 0.00 -0.71 0.00 0.00 52.86 51.70 3ii0 s ASN 415 Cb 0.08 -0.64 0.69 0.00 0.41 0.00 0.00 41.25 41.80 3ii0 s ASN 415 CO 0.54 0.32 2.02 -0.07 -1.51 0.00 0.00 177.10 178.40 3ii0 h LEU 416 N 5.55 0.66 -9.53 0.60 3.38 -2.03 -3.43 115.31 110.51 3ii0 h LEU 416 Ca -0.42 -0.02 -0.59 0.00 0.09 0.00 0.00 57.88 56.94 3ii0 h LEU 416 Cb 1.14 -0.16 -0.10 0.00 0.09 0.00 0.00 40.66 41.62 3ii0 h LEU 416 CO 0.49 0.48 -0.65 -0.31 0.09 0.00 0.00 178.44 178.53 3ii0 s TYR 417 N -5.66 2.80 0.00 1.13 2.02 -1.26 -4.65 117.35 111.74 3ii0 s TYR 417 Ca -0.10 -0.17 0.00 0.00 -0.37 0.00 0.00 57.07 56.44 3ii0 s TYR 417 Cb 0.18 -1.32 0.00 0.00 -0.40 0.00 0.00 41.96 40.42 3ii0 s TYR 417 CO 0.76 0.55 0.00 1.19 -1.57 0.00 0.00 175.55 176.47 3ii0 n PHE 418 N -0.40 0.00 1.33 2.71 3.72 -1.26 -5.12 117.46 118.44 3ii0 n PHE 418 Ca -0.09 0.00 0.11 0.00 -0.05 0.00 0.00 57.45 57.42 3ii0 n PHE 418 Cb 0.56 -0.56 0.63 0.00 -0.94 0.00 0.00 39.48 39.17 3ii0 n PHE 418 CO 0.00 0.00 0.00 1.04 -0.05 0.00 0.00 176.76 177.75