#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1i0b n ASP 35 N 0.00 1.30 -3.82 1.61 5.75 -1.26 -4.66 116.55 115.47 1i0b n ASP 35 Ca 0.00 -1.15 -0.12 0.00 -0.01 0.00 0.00 54.79 53.50 1i0b n ASP 35 Cb 0.00 0.64 -0.13 0.00 -1.03 0.00 0.00 41.12 40.60 1i0b n ASP 35 CO 0.00 0.00 0.00 -0.13 -0.11 0.00 0.00 177.20 176.96 1i0b s ARG 36 N -2.03 0.15 -0.19 0.11 0.52 -1.26 -3.55 118.95 112.69 1i0b s ARG 36 Ca 0.11 0.19 -0.07 0.00 -0.52 0.00 0.00 55.73 55.44 1i0b s ARG 36 Cb 0.12 0.06 -0.04 0.00 0.52 0.00 0.00 34.95 35.61 1i0b s ARG 36 CO 0.46 -0.03 0.07 0.42 0.02 0.00 0.00 175.30 176.24 1i0b s ILE 37 N 0.13 4.76 0.12 1.52 1.01 0.30 -4.52 121.20 124.50 1i0b s ILE 37 Ca -0.00 -0.04 -0.30 0.00 0.00 0.00 0.00 60.65 60.30 1i0b s ILE 37 Cb -0.01 -3.15 -0.06 0.00 0.01 0.00 0.00 42.46 39.24 1i0b s ILE 37 CO -0.00 0.44 1.03 0.20 0.00 0.00 0.00 174.94 176.61 1i0b s ASN 38 N 0.53 7.36 0.33 3.58 0.02 -1.26 -0.15 114.94 125.35 1i0b s ASN 38 Ca 0.03 1.90 0.04 0.00 -1.02 0.00 0.00 52.86 53.82 1i0b s ASN 38 Cb -0.13 -2.59 -0.06 0.00 0.02 0.00 0.00 41.25 38.49 1i0b s ASN 38 CO 0.01 -0.18 0.04 0.42 0.02 0.00 0.00 177.10 177.41 1i0b s THR 39 N 0.14 1.29 -0.03 1.60 -4.23 0.12 -4.43 115.64 110.12 1i0b s THR 39 Ca 0.50 -2.01 0.29 0.00 -1.18 0.00 0.00 61.69 59.28 1i0b s THR 39 Cb -0.26 -2.77 0.30 0.00 1.34 0.00 0.00 72.50 71.11 1i0b s THR 39 CO 0.31 -0.04 1.88 -0.37 -0.54 0.00 0.00 174.62 175.86 1i0b h VAL 40 N 2.11 0.00 -0.38 2.29 -1.51 -1.22 0.90 116.25 118.43 1i0b h VAL 40 Ca -0.41 -0.12 0.00 0.00 -1.23 0.00 0.00 66.70 64.94 1i0b h VAL 40 Cb 1.24 0.84 0.00 0.00 -2.13 0.00 0.00 31.29 31.24 1i0b h VAL 40 CO 0.70 0.00 0.00 0.54 -1.23 0.00 0.00 177.57 177.58 1i0b n ARG 41 N -2.55 2.36 0.00 5.19 1.74 -1.26 -4.80 116.66 117.35 1i0b n ARG 41 Ca -0.01 -2.13 0.00 0.00 -0.77 0.00 0.00 57.85 54.95 1i0b n ARG 41 Cb 0.12 -1.41 0.00 0.00 -1.02 0.00 0.00 32.46 30.15 1i0b n ARG 41 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1i0b n GLY 42 N 1.12 0.20 3.77 -0.13 0.00 0.31 -5.06 105.19 105.40 1i0b n GLY 42 Ca 0.16 -2.30 -0.38 0.00 0.00 0.00 0.00 46.02 43.50 1i0b n GLY 42 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1i0b s PRO 43 N -0.29 4.44 0.18 1.61 0.04 -1.26 0.15 135.00 139.87 1i0b s PRO 43 Ca 0.00 1.61 0.08 0.00 0.04 0.00 0.00 61.00 62.73 1i0b s PRO 43 Cb 0.00 -2.88 -0.04 0.00 0.04 0.00 0.00 34.50 31.62 1i0b s PRO 43 CO 0.00 0.09 -0.16 0.96 0.04 0.00 0.00 177.00 177.92 1i0b s ILE 44 N -1.42 1.75 0.66 0.56 -4.36 0.79 -4.91 121.20 114.28 1i0b s ILE 44 Ca 0.51 -2.02 -0.11 0.00 -0.26 0.00 0.00 60.65 58.76 1i0b s ILE 44 Cb -0.26 -1.90 -0.01 0.00 1.25 0.00 0.00 42.46 41.54 1i0b s ILE 44 CO 0.33 -0.44 1.05 0.42 0.24 0.00 0.00 174.94 176.55 1i0b s THR 45 N -2.42 4.25 0.40 8.37 -4.23 -1.26 -0.54 115.64 120.21 1i0b s THR 45 Ca 0.18 0.73 0.09 0.00 -1.18 0.00 0.00 61.69 61.50 1i0b s THR 45 Cb -0.04 -3.64 0.29 0.00 1.34 0.00 0.00 72.50 70.46 1i0b s THR 45 CO 0.07 -0.95 2.00 0.40 -0.54 0.00 0.00 174.62 175.59 1i0b h ILE 46 N -0.52 1.02 -0.40 2.99 1.08 -1.93 -2.46 117.51 117.28 1i0b h ILE 46 Ca -0.44 -0.20 -0.08 0.00 -0.39 0.00 0.00 64.86 63.75 1i0b h ILE 46 Cb 1.21 0.38 -0.02 0.00 -3.07 0.00 0.00 36.82 35.32 1i0b h ILE 46 CO 0.61 0.11 -0.08 -1.28 -0.69 0.00 0.00 178.15 176.81 1i0b h SER 47 N 0.59 0.67 0.49 1.72 0.87 -1.92 -2.86 113.55 113.11 1i0b h SER 47 Ca 0.24 -0.18 0.00 0.00 -1.23 0.00 0.00 61.79 60.62 1i0b h SER 47 Cb 0.22 -0.18 0.00 0.00 -0.44 0.00 0.00 62.40 62.00 1i0b h SER 47 CO -0.07 0.79 0.00 -0.62 -0.53 0.00 0.00 176.83 176.40 1i0b n GLU 48 N -4.19 0.18 -0.20 2.24 1.02 -0.93 -3.24 120.64 115.53 1i0b n GLU 48 Ca 0.01 0.50 -0.10 0.00 -0.02 0.00 0.00 57.16 57.56 1i0b n GLU 48 Cb 0.33 -1.92 0.02 0.00 -0.02 0.00 0.00 31.44 29.85 1i0b n GLU 48 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1i0b h ALA 49 N 2.17 0.78 -0.74 0.62 0.00 -1.58 -3.47 119.26 117.04 1i0b h ALA 49 Ca 0.00 -0.34 0.00 0.00 0.00 0.00 0.00 54.91 54.57 1i0b h ALA 49 Cb 0.24 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 17.83 1i0b h ALA 49 CO 0.00 0.67 0.00 0.41 0.00 0.00 0.00 179.25 180.33 1i0b n GLY 50 N -0.32 1.41 3.62 0.00 0.00 -1.20 -3.54 105.19 105.15 1i0b n GLY 50 Ca 0.02 -0.53 -0.43 0.00 0.00 0.00 0.00 46.02 45.08 1i0b n GLY 50 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1i0b s PHE 51 N 0.00 1.60 -0.01 1.61 2.19 -1.26 -4.55 117.98 117.56 1i0b s PHE 51 Ca 0.00 0.40 0.08 0.00 0.33 0.00 0.00 56.93 57.74 1i0b s PHE 51 Cb 0.00 -4.04 -0.02 0.00 -1.31 0.00 0.00 43.02 37.65 1i0b s PHE 51 CO 0.00 -3.74 -0.26 0.99 1.83 0.00 0.00 175.22 174.04 1i0b s THR 52 N 6.49 2.04 -0.36 0.12 2.01 -0.71 -1.28 115.64 123.95 1i0b s THR 52 Ca 0.86 -1.13 -0.12 0.00 0.31 0.00 0.00 61.69 61.60 1i0b s THR 52 Cb -0.30 -1.70 -0.00 0.00 0.01 0.00 0.00 72.50 70.51 1i0b s THR 52 CO 0.34 0.55 0.23 -0.76 -0.69 0.00 0.00 174.62 174.30 1i0b s LEU 53 N -0.67 4.60 0.00 4.42 1.43 -0.61 -4.89 118.68 122.97 1i0b s LEU 53 Ca 0.10 -0.63 0.30 0.00 -1.03 0.00 0.00 54.13 52.86 1i0b s LEU 53 Cb -0.10 -2.10 1.39 0.00 0.03 0.00 0.00 46.19 45.41 1i0b s LEU 53 CO -0.01 -0.30 1.96 0.35 0.23 0.00 0.00 176.35 178.58 1i0b n THR 54 N 5.08 0.00 -3.38 5.49 -2.24 -1.25 -0.71 114.28 117.27 1i0b n THR 54 Ca -0.12 -0.04 -0.18 0.00 -2.27 0.00 0.00 64.05 61.43 1i0b n THR 54 Cb 0.48 -0.23 -0.08 0.00 -2.10 0.00 0.00 70.33 68.40 1i0b n THR 54 CO 0.00 0.00 0.00 -2.28 -0.57 0.00 0.00 175.07 172.22 1i0b s HIS 55 N -2.41 -0.27 0.23 4.78 5.65 -1.26 -4.68 115.29 117.33 1i0b s HIS 55 Ca 0.32 -0.70 0.05 0.00 0.25 0.00 0.00 55.06 54.98 1i0b s HIS 55 Cb 0.20 -0.46 -0.02 0.00 -1.18 0.00 0.00 32.58 31.13 1i0b s HIS 55 CO 0.45 -0.95 0.20 0.39 -0.65 0.00 0.00 174.74 174.19 1i0b n GLU 56 N 4.53 0.29 -3.62 2.88 -0.58 -0.51 -1.59 120.64 122.05 1i0b n GLU 56 Ca 0.07 -2.29 -0.15 0.00 -0.42 0.00 0.00 57.16 54.37 1i0b n GLU 56 Cb 0.45 1.90 -0.07 0.00 -0.57 0.00 0.00 31.44 33.14 1i0b n GLU 56 CO 0.00 0.00 0.00 -1.01 -0.48 0.00 0.00 177.13 175.64 1i0b s HIS 57 N -2.97 -0.60 -0.13 -0.32 3.76 -0.30 -1.68 115.29 113.05 1i0b s HIS 57 Ca 0.27 1.26 -0.24 0.00 -0.15 0.00 0.00 55.06 56.21 1i0b s HIS 57 Cb 0.01 0.28 -0.26 0.00 1.11 0.00 0.00 32.58 33.72 1i0b s HIS 57 CO 0.19 -0.44 0.67 0.82 -0.85 0.00 0.00 174.74 175.13 1i0b h ILE 58 N 3.69 1.47 -3.23 0.60 1.08 -1.94 -3.31 117.51 115.86 1i0b h ILE 58 Ca -0.28 -2.37 -0.26 0.00 -0.39 0.00 0.00 64.86 61.56 1i0b h ILE 58 Cb 1.16 3.05 -0.33 0.00 -3.07 0.00 0.00 36.82 37.63 1i0b h ILE 58 CO 0.26 0.60 -0.62 0.00 -0.69 0.00 0.00 178.15 177.70 1i0b s GLY 60 N 1.45 1.87 0.00 0.00 0.00 -0.01 -4.77 107.32 105.86 1i0b s GLY 60 Ca -0.06 -2.35 0.00 0.00 0.00 0.00 0.00 44.72 42.31 1i0b s GLY 60 CO -0.06 1.53 0.00 -1.26 0.00 0.00 0.00 173.10 173.31 1i0b n SER 61 N 6.07 0.00 -3.89 1.64 2.88 -0.12 0.62 113.62 120.82 1i0b n SER 61 Ca -0.08 0.00 -0.10 0.00 -1.33 0.00 0.00 58.87 57.36 1i0b n SER 61 Cb 0.43 0.00 -0.09 0.00 -0.75 0.00 0.00 64.21 63.80 1i0b n SER 61 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 1i0b s SER 62 N 1.00 0.11 0.06 -3.46 0.01 -1.21 -3.91 113.70 106.30 1i0b s SER 62 Ca 0.00 -0.46 -0.36 0.00 1.31 0.00 0.00 55.95 56.43 1i0b s SER 62 Cb 0.00 0.26 -0.16 0.00 0.21 0.00 0.00 66.02 66.33 1i0b s SER 62 CO 0.00 -0.54 1.45 0.00 0.41 0.00 0.00 173.24 174.56 1i0b n ALA 63 N 0.68 -0.31 -0.17 1.44 0.00 -1.23 -0.88 120.51 120.03 1i0b n ALA 63 Ca -0.19 0.48 0.00 0.00 0.00 0.00 0.00 53.44 53.73 1i0b n ALA 63 Cb 0.59 -2.17 0.00 0.00 0.00 0.00 0.00 19.45 17.87 1i0b n ALA 63 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1i0b n GLY 64 N 2.96 1.50 0.08 0.00 0.00 -1.26 -4.91 105.19 103.55 1i0b n GLY 64 Ca 0.19 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.11 1i0b n GLY 64 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1i0b h PHE 65 N 0.00 0.02 -0.57 1.61 3.04 -1.37 -2.03 116.94 117.64 1i0b h PHE 65 Ca 0.00 0.01 -0.03 0.00 3.98 0.00 0.00 57.97 61.93 1i0b h PHE 65 Cb 0.00 0.01 -0.03 0.00 2.56 0.00 0.00 35.95 38.49 1i0b h PHE 65 CO 0.00 0.00 0.25 1.25 -2.02 0.00 0.00 178.31 177.79 1i0b h LEU 66 N 0.06 0.73 -0.21 0.59 5.85 -1.86 0.22 115.31 120.69 1i0b h LEU 66 Ca 0.05 -0.08 -0.21 0.00 0.84 0.00 0.00 57.88 58.48 1i0b h LEU 66 Cb 0.05 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 40.88 1i0b h LEU 66 CO -0.07 0.64 -0.93 0.03 -0.34 0.00 0.00 178.44 177.77 1i0b h ARG 67 N 0.81 0.21 0.10 1.25 2.47 -1.92 -2.95 114.38 114.35 1i0b h ARG 67 Ca 0.20 -0.25 -0.27 0.00 -1.26 0.00 0.00 59.98 58.40 1i0b h ARG 67 Cb 0.12 0.08 -0.00 0.00 -1.65 0.00 0.00 29.97 28.51 1i0b h ARG 67 CO -0.02 1.00 -1.25 0.00 0.56 0.00 0.00 179.97 180.25 1i0b h ALA 68 N 0.91 0.17 -1.77 0.04 0.00 -1.07 -3.41 119.26 114.14 1i0b h ALA 68 Ca -0.05 -0.93 -0.47 0.00 0.00 0.00 0.00 54.91 53.45 1i0b h ALA 68 Cb 1.58 0.03 -0.37 0.00 0.00 0.00 0.00 17.79 19.02 1i0b h ALA 68 CO 0.14 1.05 -1.09 1.87 0.00 0.00 0.00 179.25 181.22 1i0b n TRP 69 N -3.48 -0.31 0.29 0.00 -0.00 0.74 -4.94 117.44 109.74 1i0b n TRP 69 Ca -0.08 -3.55 0.14 0.00 -0.00 0.00 0.00 57.50 54.00 1i0b n TRP 69 Cb 1.01 -0.17 0.85 0.00 -0.00 0.00 0.00 31.31 33.00 1i0b n TRP 69 CO 0.00 0.00 0.00 -1.00 -0.00 0.00 0.00 177.69 176.69 1i0b h PRO 70 N 3.26 0.00 0.00 5.87 0.13 -1.69 -0.53 132.00 139.04 1i0b h PRO 70 Ca 0.07 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.20 1i0b h PRO 70 Cb 0.96 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.09 1i0b h PRO 70 CO 0.45 0.02 0.00 0.39 -0.23 0.00 0.00 178.00 178.64 1i0b n GLU 71 N -3.92 0.11 0.29 0.86 4.71 -1.26 -1.46 120.64 119.97 1i0b n GLU 71 Ca -0.03 0.37 0.15 0.00 -0.01 0.00 0.00 57.16 57.64 1i0b n GLU 71 Cb 0.11 -1.71 0.88 0.00 -1.01 0.00 0.00 31.44 29.71 1i0b n GLU 71 CO 0.00 0.00 0.00 0.35 0.09 0.00 0.00 177.13 177.57 1i0b h PHE 72 N 0.00 0.00 -0.39 -0.32 3.57 -1.48 0.34 116.94 118.66 1i0b h PHE 72 Ca 0.00 0.00 -0.05 0.00 3.53 0.00 0.00 57.97 61.45 1i0b h PHE 72 Cb 0.28 0.00 -0.03 0.00 2.79 0.00 0.00 35.95 38.99 1i0b h PHE 72 CO 0.00 0.03 0.03 1.19 -2.23 0.00 0.00 178.31 177.33 1i0b n PHE 73 N -3.79 1.36 0.00 0.41 3.01 -0.53 -4.94 117.46 112.98 1i0b n PHE 73 Ca -0.03 -0.98 0.00 0.00 1.01 0.00 0.00 57.45 57.45 1i0b n PHE 73 Cb 0.11 -0.42 0.00 0.00 -0.01 0.00 0.00 39.48 39.16 1i0b n PHE 73 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1i0b n GLY 74 N -0.35 1.96 3.65 1.37 0.00 0.11 -4.29 105.19 107.63 1i0b n GLY 74 Ca 0.27 -0.44 -0.02 0.00 0.00 0.00 0.00 46.02 45.83 1i0b n GLY 74 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1i0b s SER 75 N 0.00 -0.14 0.14 1.61 1.04 -1.15 -4.26 113.70 110.94 1i0b s SER 75 Ca 0.00 -0.20 -0.14 0.00 0.48 0.00 0.00 55.95 56.10 1i0b s SER 75 Cb 0.00 0.30 -0.00 0.00 0.10 0.00 0.00 66.02 66.42 1i0b s SER 75 CO 0.00 -0.53 1.60 -0.09 0.98 0.00 0.00 173.24 175.19 1i0b h ARG 76 N 2.00 0.77 -0.54 4.02 2.43 -1.87 -0.94 114.38 120.25 1i0b h ARG 76 Ca -0.25 -0.23 -0.00 0.00 -0.81 0.00 0.00 59.98 58.69 1i0b h ARG 76 Cb 1.21 -0.08 -0.03 0.00 -0.42 0.00 0.00 29.97 30.66 1i0b h ARG 76 CO 0.27 0.82 0.33 -0.22 -1.51 0.00 0.00 179.97 179.66 1i0b h LYS 77 N 0.62 0.73 -0.26 0.20 3.64 -1.95 0.28 116.57 119.84 1i0b h LYS 77 Ca 0.13 -0.06 -0.00 0.00 -1.27 0.00 0.00 60.65 59.44 1i0b h LYS 77 Cb 0.45 -0.15 -0.01 0.00 -0.41 0.00 0.00 32.23 32.11 1i0b h LYS 77 CO 0.02 0.52 0.15 0.00 -2.27 0.00 0.00 179.45 177.88 1i0b h ALA 78 N 1.16 0.33 -0.24 5.00 0.00 -1.80 -0.59 119.26 123.13 1i0b h ALA 78 Ca 0.19 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.06 1i0b h ALA 78 Cb -0.02 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.65 1i0b h ALA 78 CO -0.04 -0.17 0.15 1.25 0.00 0.00 0.00 179.25 180.45 1i0b h LEU 79 N 0.32 0.27 -0.63 0.00 5.85 -0.87 0.64 115.31 120.88 1i0b h LEU 79 Ca 0.09 -0.01 0.01 0.00 0.84 0.00 0.00 57.88 58.82 1i0b h LEU 79 Cb 0.02 -0.07 -0.03 0.00 0.37 0.00 0.00 40.66 40.95 1i0b h LEU 79 CO -0.02 0.19 0.40 0.00 -0.34 0.00 0.00 178.44 178.68 1i0b h ALA 80 N 1.09 0.80 -0.58 1.25 0.00 -0.77 -0.73 119.26 120.31 1i0b h ALA 80 Ca 0.09 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 54.93 1i0b h ALA 80 Cb -0.03 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 17.50 1i0b h ALA 80 CO -0.02 0.19 0.24 0.93 0.00 0.00 0.00 179.25 180.59 1i0b h GLU 81 N 0.81 0.86 -0.88 0.00 5.08 -0.64 0.11 114.58 119.92 1i0b h GLU 81 Ca 0.24 -0.15 0.03 0.00 -1.00 0.00 0.00 59.36 58.48 1i0b h GLU 81 Cb -0.05 -0.14 -0.05 0.00 0.50 0.00 0.00 28.75 29.01 1i0b h GLU 81 CO -0.07 0.73 0.57 -0.22 -1.00 0.00 0.00 179.01 179.02 1i0b h LYS 82 N 0.80 1.10 -0.33 2.33 3.64 -0.54 -0.97 116.57 122.59 1i0b h LYS 82 Ca 0.19 -0.07 -0.03 0.00 -1.27 0.00 0.00 60.65 59.48 1i0b h LYS 82 Cb 0.18 -0.25 -0.01 0.00 -0.41 0.00 0.00 32.23 31.74 1i0b h LYS 82 CO -0.02 0.73 0.09 0.00 -2.27 0.00 0.00 179.45 177.98 1i0b h ALA 83 N 1.35 0.43 -0.59 5.00 0.00 -0.61 -1.57 119.26 123.28 1i0b h ALA 83 Ca 0.34 -0.16 -0.06 0.00 0.00 0.00 0.00 54.91 55.03 1i0b h ALA 83 Cb -0.03 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 17.61 1i0b h ALA 83 CO -0.11 0.08 0.14 0.28 0.00 0.00 0.00 179.25 179.64 1i0b h VAL 84 N 0.37 1.24 -0.06 0.00 2.07 -0.25 0.87 116.25 120.50 1i0b h VAL 84 Ca 0.10 -0.87 0.00 0.00 0.82 0.00 0.00 66.70 66.76 1i0b h VAL 84 Cb 0.27 0.64 -0.00 0.00 -1.52 0.00 0.00 31.29 30.67 1i0b h VAL 84 CO -0.00 0.33 0.04 0.03 0.02 0.00 0.00 177.57 177.98 1i0b h ARG 85 N 0.88 0.08 -0.32 1.57 3.08 -1.00 0.20 114.38 118.85 1i0b h ARG 85 Ca 0.19 -0.01 -0.01 0.00 0.07 0.00 0.00 59.98 60.23 1i0b h ARG 85 Cb 0.32 -0.02 -0.02 0.00 0.08 0.00 0.00 29.97 30.34 1i0b h ARG 85 CO -0.00 0.06 0.18 0.78 -1.07 0.00 0.00 179.97 179.92 1i0b h GLY 86 N 0.07 0.49 1.29 0.04 0.00 -0.93 -2.11 103.07 101.91 1i0b h GLY 86 Ca 0.02 -0.22 -0.07 0.00 0.00 0.00 0.00 47.33 47.06 1i0b h GLY 86 CO -0.00 0.21 0.03 1.41 0.00 0.00 0.00 176.54 178.19 1i0b h LEU 87 N 0.40 0.82 -0.98 3.11 3.38 -0.74 -1.62 115.31 119.69 1i0b h LEU 87 Ca 0.11 -0.19 -0.02 0.00 0.09 0.00 0.00 57.88 57.87 1i0b h LEU 87 Cb 0.07 -0.22 -0.04 0.00 0.09 0.00 0.00 40.66 40.56 1i0b h LEU 87 CO -0.02 0.87 0.48 0.03 0.09 0.00 0.00 178.44 179.89 1i0b h ARG 88 N 0.81 1.19 -0.30 1.13 3.08 -0.66 -0.33 114.38 119.31 1i0b h ARG 88 Ca 0.16 -0.13 -0.14 0.00 0.07 0.00 0.00 59.98 59.94 1i0b h ARG 88 Cb 0.44 -0.24 -0.00 0.00 0.08 0.00 0.00 29.97 30.25 1i0b h ARG 88 CO 0.02 0.87 -0.35 0.00 -1.07 0.00 0.00 179.97 179.43 1i0b h ARG 89 N 1.20 0.76 -0.70 0.04 3.08 -1.18 0.23 114.38 117.81 1i0b h ARG 89 Ca 0.30 -0.42 -0.06 0.00 0.07 0.00 0.00 59.98 59.87 1i0b h ARG 89 Cb 0.02 0.03 -0.03 0.00 0.08 0.00 0.00 29.97 30.07 1i0b h ARG 89 CO -0.05 1.05 0.20 0.00 -1.07 0.00 0.00 179.97 180.10 1i0b h ALA 90 N 0.70 1.02 -0.57 0.04 0.00 -1.05 -2.08 119.26 117.32 1i0b h ALA 90 Ca 0.04 -0.23 -0.00 0.00 0.00 0.00 0.00 54.91 54.72 1i0b h ALA 90 Cb 0.94 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 18.43 1i0b h ALA 90 CO 0.08 0.65 0.35 -0.09 0.00 0.00 0.00 179.25 180.24 1i0b h ARG 91 N 1.05 0.77 -0.27 0.00 2.43 -0.91 0.11 114.38 117.58 1i0b h ARG 91 Ca 0.23 -0.07 -0.00 0.00 -0.81 0.00 0.00 59.98 59.32 1i0b h ARG 91 Cb 0.33 -0.16 -0.01 0.00 -0.42 0.00 0.00 29.97 29.70 1i0b h ARG 91 CO -0.00 0.56 0.15 0.00 -1.51 0.00 0.00 179.97 179.16 1i0b h ALA 92 N 1.17 1.76 0.00 2.80 0.00 -0.51 -0.54 119.26 123.95 1i0b h ALA 92 Ca 0.20 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.07 1i0b h ALA 92 Cb -0.02 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.66 1i0b h ALA 92 CO -0.04 0.21 0.00 0.00 0.00 0.00 0.00 179.25 179.42 1i0b n ALA 93 N -2.50 2.54 0.00 0.00 0.00 -0.53 -4.90 120.51 115.13 1i0b n ALA 93 Ca 0.01 -0.16 0.00 0.00 0.00 0.00 0.00 53.44 53.29 1i0b n ALA 93 Cb 0.09 -1.49 0.00 0.00 0.00 0.00 0.00 19.45 18.05 1i0b n ALA 93 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1i0b n GLY 94 N 1.13 0.67 3.70 0.00 0.00 -0.21 -4.86 105.19 105.63 1i0b n GLY 94 Ca 0.18 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.78 1i0b n GLY 94 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1i0b s VAL 95 N -2.00 4.31 -0.19 1.61 1.01 -0.09 -4.50 120.40 120.56 1i0b s VAL 95 Ca 0.00 1.65 0.11 0.00 0.00 0.00 0.00 61.98 63.74 1i0b s VAL 95 Cb 0.00 -4.06 -0.19 0.00 0.00 0.00 0.00 36.38 32.13 1i0b s VAL 95 CO 0.00 0.09 -0.03 0.54 0.00 0.00 0.00 175.10 175.70 1i0b n ARG 96 N 4.31 0.98 -4.00 2.72 5.12 -0.40 -3.96 116.66 121.43 1i0b n ARG 96 Ca 0.09 0.04 -0.09 0.00 -1.93 0.00 0.00 57.85 55.95 1i0b n ARG 96 Cb 0.47 -1.44 -0.11 0.00 -1.16 0.00 0.00 32.46 30.23 1i0b n ARG 96 CO 0.00 0.00 0.00 0.99 -1.93 0.00 0.00 177.63 176.69 1i0b s THR 97 N -2.42 0.18 0.03 0.55 2.01 -0.89 -1.32 115.64 113.77 1i0b s THR 97 Ca -0.16 -1.01 0.03 0.00 0.31 0.00 0.00 61.69 60.87 1i0b s THR 97 Cb 0.06 -0.41 -0.02 0.00 0.01 0.00 0.00 72.50 72.14 1i0b s THR 97 CO 0.63 -0.53 -0.10 0.27 -0.69 0.00 0.00 174.62 174.21 1i0b s ILE 98 N -1.65 0.77 -0.30 1.82 -4.36 -0.34 -1.57 121.20 115.56 1i0b s ILE 98 Ca -0.13 -0.88 -0.08 0.00 -0.26 0.00 0.00 60.65 59.30 1i0b s ILE 98 Cb -0.09 -0.74 0.01 0.00 1.25 0.00 0.00 42.46 42.90 1i0b s ILE 98 CO -0.02 -0.12 0.10 -0.69 0.24 0.00 0.00 174.94 174.46 1i0b s VAL 99 N -0.91 4.12 -0.54 8.37 1.01 0.12 -1.44 120.40 131.12 1i0b s VAL 99 Ca -0.03 -0.66 -0.21 0.00 0.00 0.00 0.00 61.98 61.09 1i0b s VAL 99 Cb -0.07 -3.13 0.06 0.00 0.00 0.00 0.00 36.38 33.23 1i0b s VAL 99 CO 0.01 0.06 0.74 -0.62 0.00 0.00 0.00 175.10 175.28 1i0b s ASP 100 N 1.52 6.24 -0.01 3.32 3.68 0.59 -1.42 116.67 130.60 1i0b s ASP 100 Ca 0.03 -0.84 0.00 0.00 2.13 0.00 0.00 52.55 53.87 1i0b s ASP 100 Cb -0.17 -2.34 0.02 0.00 -1.45 0.00 0.00 42.92 38.98 1i0b s ASP 100 CO 0.03 -1.05 0.64 1.33 0.13 0.00 0.00 175.17 176.25 1i0b n VAL 101 N 5.78 0.28 -2.71 1.11 0.24 -0.68 -2.93 118.33 119.43 1i0b n VAL 101 Ca -0.05 -0.04 -0.42 0.00 -2.04 0.00 0.00 64.34 61.79 1i0b n VAL 101 Cb 0.46 -0.60 -0.03 0.00 -1.47 0.00 0.00 33.84 32.20 1i0b n VAL 101 CO 0.00 0.00 0.00 -0.44 -2.14 0.00 0.00 176.83 174.25 1i0b s SER 102 N 0.18 7.30 0.65 -1.34 0.01 -1.26 -4.86 113.70 114.38 1i0b s SER 102 Ca 0.02 1.59 0.03 0.00 1.31 0.00 0.00 55.95 58.89 1i0b s SER 102 Cb 0.01 -2.56 0.10 0.00 0.21 0.00 0.00 66.02 63.79 1i0b s SER 102 CO 0.00 -0.35 0.90 0.42 0.41 0.00 0.00 173.24 174.63 1i0b s THR 103 N 1.50 2.22 0.24 1.44 -4.23 -1.26 -4.18 115.64 111.36 1i0b s THR 103 Ca 0.50 -0.73 -0.08 0.00 -1.18 0.00 0.00 61.69 60.20 1i0b s THR 103 Cb -0.20 -2.49 0.27 0.00 1.34 0.00 0.00 72.50 71.42 1i0b s THR 103 CO 0.23 0.00 1.64 0.15 -0.54 0.00 0.00 174.62 176.10 1i0b h PHE 104 N -0.24 -0.09 0.00 3.99 3.57 -1.85 0.89 116.94 123.22 1i0b h PHE 104 Ca -0.35 0.06 0.00 0.00 3.53 0.00 0.00 57.97 61.20 1i0b h PHE 104 Cb 1.28 0.15 0.00 0.00 2.79 0.00 0.00 35.95 40.17 1i0b h PHE 104 CO 0.05 -0.24 0.00 -0.40 -2.23 0.00 0.00 178.31 175.49 1i0b n ASP 105 N -5.35 0.00 -1.03 0.41 3.85 -1.26 -1.52 116.55 111.64 1i0b n ASP 105 Ca 0.12 -0.27 0.12 0.00 -0.71 0.00 0.00 54.79 54.05 1i0b n ASP 105 Cb 0.44 -0.21 0.23 0.00 -1.35 0.00 0.00 41.12 40.24 1i0b n ASP 105 CO 0.00 0.00 0.00 -0.38 -1.01 0.00 0.00 177.20 175.81 1i0b n ILE 106 N -1.21 0.40 -2.07 2.12 5.41 0.28 -4.05 119.36 120.23 1i0b n ILE 106 Ca 0.14 -0.65 -0.07 0.00 1.00 0.00 0.00 62.75 63.17 1i0b n ILE 106 Cb 0.17 0.93 -0.01 0.00 -0.71 0.00 0.00 39.64 40.02 1i0b n ILE 106 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1i0b n GLY 107 N 1.43 0.13 3.64 7.39 0.00 -0.58 -0.94 105.19 116.25 1i0b n GLY 107 Ca 0.18 -0.58 -0.50 0.00 0.00 0.00 0.00 46.02 45.12 1i0b n GLY 107 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1i0b n ARG 108 N -1.80 1.57 -3.86 1.61 0.63 -1.02 -4.71 116.66 109.09 1i0b n ARG 108 Ca -0.09 0.57 -0.30 0.00 -0.92 0.00 0.00 57.85 57.11 1i0b n ARG 108 Cb 0.54 -2.27 -0.14 0.00 0.45 0.00 0.00 32.46 31.04 1i0b n ARG 108 CO 0.00 0.00 0.00 0.34 -2.51 0.00 0.00 177.63 175.46 1i0b s ASP 109 N 1.22 4.12 0.42 6.15 -1.08 -1.26 -4.90 116.67 121.35 1i0b s ASP 109 Ca 0.85 -2.62 0.19 0.00 -0.52 0.00 0.00 52.55 50.44 1i0b s ASP 109 Cb -0.85 -1.35 1.12 0.00 -1.46 0.00 0.00 42.92 40.37 1i0b s ASP 109 CO 0.46 -0.28 1.84 0.58 0.52 0.00 0.00 175.17 178.28 1i0b h VAL 110 N 5.67 0.63 -0.64 1.11 2.07 -1.98 0.02 116.25 123.13 1i0b h VAL 110 Ca -0.06 -0.13 -0.05 0.00 0.82 0.00 0.00 66.70 67.29 1i0b h VAL 110 Cb 0.93 0.22 -0.03 0.00 -1.52 0.00 0.00 31.29 30.90 1i0b h VAL 110 CO 0.57 0.07 0.22 0.28 0.02 0.00 0.00 177.57 178.73 1i0b h SER 111 N 0.38 0.91 -0.47 0.57 0.02 -1.99 -0.14 113.55 112.82 1i0b h SER 111 Ca 0.50 -0.19 -0.01 0.00 -0.84 0.00 0.00 61.79 61.24 1i0b h SER 111 Cb 1.30 -0.24 -0.02 0.00 0.14 0.00 0.00 62.40 63.58 1i0b h SER 111 CO -0.19 0.86 0.25 0.25 -1.14 0.00 0.00 176.83 176.86 1i0b h LEU 112 N 0.92 0.60 -0.52 5.07 5.85 -1.44 -0.49 115.31 125.30 1i0b h LEU 112 Ca 0.21 -0.10 0.01 0.00 0.84 0.00 0.00 57.88 58.84 1i0b h LEU 112 Cb 0.26 -0.15 -0.03 0.00 0.37 0.00 0.00 40.66 41.11 1i0b h LEU 112 CO -0.01 0.53 0.33 -0.07 -0.34 0.00 0.00 178.44 178.88 1i0b h LEU 113 N 0.62 0.56 -0.40 2.25 4.07 -1.14 -1.27 115.31 120.01 1i0b h LEU 113 Ca 0.17 -0.01 -0.03 0.00 0.08 0.00 0.00 57.88 58.09 1i0b h LEU 113 Cb 0.07 -0.13 -0.02 0.00 1.08 0.00 0.00 40.66 41.66 1i0b h LEU 113 CO -0.03 0.40 0.13 0.00 -1.08 0.00 0.00 178.44 177.87 1i0b h ALA 114 N 1.20 0.52 -0.03 1.53 0.00 -0.71 0.07 119.26 121.85 1i0b h ALA 114 Ca 0.20 -0.16 0.01 0.00 0.00 0.00 0.00 54.91 54.95 1i0b h ALA 114 Cb -0.05 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.58 1i0b h ALA 114 CO -0.06 0.16 -0.01 1.49 0.00 0.00 0.00 179.25 180.82 1i0b h GLU 115 N 0.50 -0.01 0.00 0.00 4.81 -0.74 -2.31 114.58 116.84 1i0b h GLU 115 Ca 0.13 0.00 -0.07 0.00 -0.13 0.00 0.00 59.36 59.29 1i0b h GLU 115 Cb 0.24 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.61 1i0b h GLU 115 CO -0.01 -0.01 -0.33 -0.39 -0.73 0.00 0.00 179.01 177.55 1i0b h VAL 116 N -0.01 0.89 -0.42 0.32 -1.51 -1.18 -0.58 116.25 113.75 1i0b h VAL 116 Ca 0.02 -1.31 -0.04 0.00 -1.23 0.00 0.00 66.70 64.14 1i0b h VAL 116 Cb 0.04 1.78 -0.02 0.00 -2.13 0.00 0.00 31.29 30.96 1i0b h VAL 116 CO -0.04 0.32 0.12 -1.28 -1.23 0.00 0.00 177.57 175.47 1i0b h SER 117 N 0.00 0.63 -0.10 4.19 0.87 -0.67 -0.76 113.55 117.70 1i0b h SER 117 Ca -0.00 -0.22 -0.02 0.00 -1.23 0.00 0.00 61.79 60.32 1i0b h SER 117 Cb 0.76 -0.16 -0.00 0.00 -0.44 0.00 0.00 62.40 62.55 1i0b h SER 117 CO 0.04 0.68 -0.03 0.03 -0.53 0.00 0.00 176.83 177.02 1i0b h ARG 118 N 0.54 0.20 -0.79 2.24 3.08 -1.20 0.25 114.38 118.70 1i0b h ARG 118 Ca 0.13 -0.08 -0.05 0.00 0.07 0.00 0.00 59.98 60.06 1i0b h ARG 118 Cb 0.28 -0.01 -0.04 0.00 0.08 0.00 0.00 29.97 30.29 1i0b h ARG 118 CO -0.00 0.52 0.32 0.00 -1.07 0.00 0.00 179.97 179.74 1i0b h ALA 119 N 0.67 1.06 0.00 0.04 0.00 -1.07 -2.98 119.26 116.98 1i0b h ALA 119 Ca 0.02 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.74 1i0b h ALA 119 Cb 0.46 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 17.94 1i0b h ALA 119 CO 0.01 0.66 -0.70 0.00 0.00 0.00 0.00 179.25 179.23 1i0b n ALA 120 N -2.44 3.55 -3.26 0.00 0.00 -0.30 -4.98 120.51 113.09 1i0b n ALA 120 Ca 0.07 -0.37 -0.15 0.00 0.00 0.00 0.00 53.44 52.99 1i0b n ALA 120 Cb 0.19 -1.05 0.08 0.00 0.00 0.00 0.00 19.45 18.66 1i0b n ALA 120 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1i0b n ASP 121 N -1.70 -3.53 -3.93 0.00 2.03 0.83 -4.72 116.55 105.52 1i0b n ASP 121 Ca 0.04 -0.61 -0.20 0.00 0.52 0.00 0.00 54.79 54.54 1i0b n ASP 121 Cb 0.37 -4.85 -0.16 0.00 -0.72 0.00 0.00 41.12 35.77 1i0b n ASP 121 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 1i0b s VAL 122 N -3.35 0.66 0.28 5.18 1.01 -0.91 -5.04 120.40 118.24 1i0b s VAL 122 Ca 0.15 -0.22 -0.29 0.00 0.00 0.00 0.00 61.98 61.62 1i0b s VAL 122 Cb -0.02 -0.65 -0.10 0.00 0.00 0.00 0.00 36.38 35.62 1i0b s VAL 122 CO 0.68 0.24 1.25 -1.00 0.00 0.00 0.00 175.10 176.28 1i0b s HIS 123 N 0.70 3.25 -0.08 5.22 3.76 -0.43 -4.57 115.29 123.14 1i0b s HIS 123 Ca -0.10 1.44 0.00 0.00 -0.15 0.00 0.00 55.06 56.25 1i0b s HIS 123 Cb -0.13 -3.55 0.02 0.00 1.11 0.00 0.00 32.58 30.03 1i0b s HIS 123 CO 0.01 -1.50 -0.07 0.42 -0.85 0.00 0.00 174.74 172.75 1i0b s ILE 124 N -0.82 0.83 -0.21 0.60 1.01 -1.26 -1.20 121.20 120.15 1i0b s ILE 124 Ca 0.50 -0.22 -0.16 0.00 0.00 0.00 0.00 60.65 60.77 1i0b s ILE 124 Cb -0.37 -0.85 -0.04 0.00 0.01 0.00 0.00 42.46 41.22 1i0b s ILE 124 CO 0.46 0.31 0.40 -0.69 0.00 0.00 0.00 174.94 175.42 1i0b s VAL 125 N 1.35 5.19 0.46 2.92 1.01 -0.52 -0.68 120.40 130.13 1i0b s VAL 125 Ca -0.03 0.70 -0.02 0.00 0.00 0.00 0.00 61.98 62.62 1i0b s VAL 125 Cb -0.14 -3.73 -0.02 0.00 0.00 0.00 0.00 36.38 32.50 1i0b s VAL 125 CO -0.03 0.24 0.72 0.00 0.00 0.00 0.00 175.10 176.03 1i0b s ALA 126 N 1.40 3.55 0.26 5.51 0.00 -1.26 -0.30 121.76 130.92 1i0b s ALA 126 Ca 0.19 -0.79 0.10 0.00 0.00 0.00 0.00 51.96 51.46 1i0b s ALA 126 Cb -0.15 -2.36 -0.05 0.00 0.00 0.00 0.00 23.12 20.56 1i0b s ALA 126 CO 0.08 -0.37 -0.17 0.00 0.00 0.00 0.00 175.76 175.30 1i0b s ALA 127 N -2.64 2.53 0.00 0.00 0.00 -1.15 -1.41 121.76 119.09 1i0b s ALA 127 Ca 0.47 -1.83 0.00 0.00 0.00 0.00 0.00 51.96 50.60 1i0b s ALA 127 Cb -0.10 -0.17 0.00 0.00 0.00 0.00 0.00 23.12 22.85 1i0b s ALA 127 CO 0.41 0.19 0.00 -2.37 0.00 0.00 0.00 175.76 173.99 1i0b n THR 128 N -0.56 0.00 0.00 0.00 5.66 -0.53 -4.66 114.28 114.19 1i0b n THR 128 Ca -0.06 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.94 1i0b n THR 128 Cb 0.61 -0.04 0.00 0.00 -1.55 0.00 0.00 70.33 69.34 1i0b n THR 128 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1i0b n GLY 129 N 5.00 -1.60 2.89 1.09 0.00 -1.26 -0.44 105.19 110.87 1i0b n GLY 129 Ca 0.00 -2.16 -0.13 0.00 0.00 0.00 0.00 46.02 43.73 1i0b n GLY 129 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1i0b s LEU 130 N 0.00 1.35 0.00 0.99 1.43 -0.22 -4.23 118.68 118.00 1i0b s LEU 130 Ca 0.00 0.14 0.00 0.00 -1.03 0.00 0.00 54.13 53.24 1i0b s LEU 130 Cb 0.00 0.18 0.00 0.00 0.03 0.00 0.00 46.19 46.40 1i0b s LEU 130 CO 0.00 -0.08 0.00 1.87 0.23 0.00 0.00 176.35 178.37 1i0b n TRP 131 N 3.60 -0.66 -0.35 0.29 -0.00 -1.26 -3.77 117.44 115.28 1i0b n TRP 131 Ca -0.19 0.00 -0.07 0.00 -0.00 0.00 0.00 57.50 57.24 1i0b n TRP 131 Cb 0.55 0.00 0.18 0.00 -0.00 0.00 0.00 31.31 32.05 1i0b n TRP 131 CO 0.00 0.00 0.00 1.97 -0.00 0.00 0.00 177.69 179.66 1i0b n PHE 132 N -0.27 1.72 -2.60 5.87 1.16 -1.26 -4.24 117.46 117.83 1i0b n PHE 132 Ca 0.00 -0.97 -0.14 0.00 -1.87 0.00 0.00 57.45 54.47 1i0b n PHE 132 Cb 0.00 -0.56 0.02 0.00 -1.61 0.00 0.00 39.48 37.34 1i0b n PHE 132 CO 0.00 0.00 0.00 -3.47 -1.87 0.00 0.00 176.76 171.42 1i0b n ASP 133 N -0.13 2.47 -4.74 5.98 4.64 -1.26 -5.09 116.55 118.41 1i0b n ASP 133 Ca 0.30 -2.97 -0.41 0.00 -1.38 0.00 0.00 54.79 50.32 1i0b n ASP 133 Cb 1.09 -0.50 -0.03 0.00 -1.04 0.00 0.00 41.12 40.64 1i0b n ASP 133 CO 0.00 0.00 0.00 -2.16 -0.82 0.00 0.00 177.20 174.22 1i0b s PRO 134 N -3.31 4.40 0.96 -0.67 0.04 -1.26 -4.86 135.00 130.30 1i0b s PRO 134 Ca 0.34 2.01 -0.13 0.00 0.04 0.00 0.00 61.00 63.26 1i0b s PRO 134 Cb 0.43 -3.21 0.17 0.00 0.04 0.00 0.00 34.50 31.93 1i0b s PRO 134 CO -0.03 -0.24 1.14 -1.25 0.04 0.00 0.00 177.00 176.67 1i0b s PRO 135 N -0.02 0.73 0.28 0.56 0.04 -1.26 -4.59 135.00 130.74 1i0b s PRO 135 Ca 0.57 0.23 0.02 0.00 0.04 0.00 0.00 61.00 61.85 1i0b s PRO 135 Cb -0.36 -1.80 0.60 0.00 0.04 0.00 0.00 34.50 32.99 1i0b s PRO 135 CO 0.37 -2.46 1.79 -0.07 0.04 0.00 0.00 177.00 176.66 1i0b h LEU 136 N -1.69 0.71 -2.18 -3.56 3.38 -1.97 0.26 115.31 110.26 1i0b h LEU 136 Ca -0.50 0.08 0.05 0.00 0.09 0.00 0.00 57.88 57.60 1i0b h LEU 136 Cb 1.32 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 42.02 1i0b h LEU 136 CO 0.57 0.31 0.16 0.28 0.09 0.00 0.00 178.44 179.85 1i0b h SER 137 N 0.76 0.00 0.00 -0.43 0.02 -2.00 -2.12 113.55 109.78 1i0b h SER 137 Ca 0.51 0.00 -0.22 0.00 -0.84 0.00 0.00 61.79 61.24 1i0b h SER 137 Cb 0.69 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 63.19 1i0b h SER 137 CO -0.34 0.00 -1.20 0.24 -1.14 0.00 0.00 176.83 174.39 1i0b h MET 138 N 0.00 0.00 -0.39 3.45 2.86 -1.42 -3.40 114.93 116.04 1i0b h MET 138 Ca 0.08 0.00 0.11 0.00 -2.06 0.00 0.00 59.70 57.84 1i0b h MET 138 Cb 0.41 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.06 1i0b h MET 138 CO -0.00 0.95 0.39 0.07 1.06 0.00 0.00 176.91 179.39 1i0b h ARG 139 N -1.00 0.00 -0.11 1.72 0.11 -0.70 -1.43 114.38 112.98 1i0b h ARG 139 Ca -0.33 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.75 1i0b h ARG 139 Cb 1.26 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.34 1i0b h ARG 139 CO -0.20 0.00 0.00 1.28 0.10 0.00 0.00 179.97 181.15 1i0b n LEU 140 N -3.82 1.58 -4.84 0.08 4.77 -0.83 -4.95 117.00 108.98 1i0b n LEU 140 Ca 0.07 -0.61 -0.32 0.00 -0.03 0.00 0.00 56.01 55.11 1i0b n LEU 140 Cb 0.57 -0.06 -0.04 0.00 -2.33 0.00 0.00 43.42 41.55 1i0b n LEU 140 CO 0.29 0.31 0.62 -0.13 -1.33 0.00 0.00 177.39 177.14 1i0b s ARG 141 N -1.87 3.99 0.58 3.23 1.81 -0.54 -5.09 118.95 121.06 1i0b s ARG 141 Ca 0.35 0.90 -0.07 0.00 -1.72 0.00 0.00 55.73 55.19 1i0b s ARG 141 Cb 0.19 -2.21 -0.01 0.00 -0.45 0.00 0.00 34.95 32.47 1i0b s ARG 141 CO 0.29 -0.15 0.91 -1.54 -0.68 0.00 0.00 175.30 174.13 1i0b s SER 142 N -2.81 5.81 0.30 0.23 1.04 -1.26 -4.87 113.70 112.14 1i0b s SER 142 Ca 0.58 0.88 -0.01 0.00 0.48 0.00 0.00 55.95 57.89 1i0b s SER 142 Cb -0.10 -1.95 0.48 0.00 0.10 0.00 0.00 66.02 64.56 1i0b s SER 142 CO 0.26 -0.95 1.95 1.62 0.98 0.00 0.00 173.24 177.10 1i0b h VAL 143 N -0.14 1.16 -0.25 5.02 3.04 -1.99 -0.51 116.25 122.58 1i0b h VAL 143 Ca -0.46 -0.37 -0.00 0.00 -1.01 0.00 0.00 66.70 64.86 1i0b h VAL 143 Cb 1.24 -0.02 -0.01 0.00 -2.01 0.00 0.00 31.29 30.49 1i0b h VAL 143 CO 0.61 0.20 0.16 -0.33 -1.01 0.00 0.00 177.57 177.20 1i0b h GLU 144 N 1.08 0.34 0.57 4.17 3.07 -1.95 0.04 114.58 121.89 1i0b h GLU 144 Ca 0.33 -0.03 -0.02 0.00 -0.50 0.00 0.00 59.36 59.14 1i0b h GLU 144 Cb -0.01 -0.07 -0.00 0.00 -0.84 0.00 0.00 28.75 27.83 1i0b h GLU 144 CO -0.09 0.26 -0.32 0.93 -1.40 0.00 0.00 179.01 178.38 1i0b h GLU 145 N 0.32 -0.80 -0.76 2.33 5.08 -1.72 -2.09 114.58 116.95 1i0b h GLU 145 Ca 0.09 0.05 0.16 0.00 -1.00 0.00 0.00 59.36 58.67 1i0b h GLU 145 Cb -0.00 0.18 -0.05 0.00 0.50 0.00 0.00 28.75 29.38 1i0b h GLU 145 CO -0.02 -0.53 0.51 -0.07 -1.00 0.00 0.00 179.01 177.90 1i0b h LEU 146 N -0.83 0.34 -0.75 1.33 3.38 -1.04 0.61 115.31 118.34 1i0b h LEU 146 Ca -0.07 0.02 -0.08 0.00 0.09 0.00 0.00 57.88 57.84 1i0b h LEU 146 Cb 0.66 -0.04 -0.03 0.00 0.09 0.00 0.00 40.66 41.34 1i0b h LEU 146 CO 0.09 0.17 0.08 0.74 0.09 0.00 0.00 178.44 179.61 1i0b h THR 147 N 0.35 1.26 -0.22 0.22 2.02 -0.39 -1.12 112.91 115.04 1i0b h THR 147 Ca 0.37 -1.03 -0.11 0.00 0.77 0.00 0.00 66.41 66.42 1i0b h THR 147 Cb 0.95 0.69 -0.01 0.00 -1.74 0.00 0.00 68.15 68.04 1i0b h THR 147 CO -0.11 0.38 -0.33 1.56 0.37 0.00 0.00 175.52 177.40 1i0b h GLN 148 N 0.96 0.46 -0.39 6.66 1.08 -0.27 -0.90 115.11 122.71 1i0b h GLN 148 Ca 0.19 -0.20 -0.16 0.00 -1.45 0.00 0.00 58.65 57.03 1i0b h GLN 148 Cb 0.44 -0.01 -0.01 0.00 -0.05 0.00 0.00 27.48 27.85 1i0b h GLN 148 CO 0.01 0.73 -0.37 0.35 -0.95 0.00 0.00 178.83 178.60 1i0b h PHE 149 N 0.39 1.13 -0.46 2.96 3.04 -0.76 -0.75 116.94 122.50 1i0b h PHE 149 Ca 0.05 -0.34 -0.06 0.00 3.98 0.00 0.00 57.97 61.61 1i0b h PHE 149 Cb 0.77 -0.24 -0.02 0.00 2.56 0.00 0.00 35.95 39.02 1i0b h PHE 149 CO 0.02 1.17 0.07 0.74 -2.02 0.00 0.00 178.31 178.29 1i0b h PHE 150 N 0.78 0.82 -0.71 0.41 0.04 -1.07 -2.69 116.94 114.52 1i0b h PHE 150 Ca 0.07 -0.12 0.09 0.00 2.80 0.00 0.00 57.97 60.81 1i0b h PHE 150 Cb 0.97 -0.22 -0.07 0.00 2.20 0.00 0.00 35.95 38.83 1i0b h PHE 150 CO 0.06 0.77 0.36 -0.07 -0.60 0.00 0.00 178.31 178.83 1i0b h LEU 151 N 0.64 0.48 -0.36 1.54 3.38 -1.02 -0.67 115.31 119.30 1i0b h LEU 151 Ca 0.14 0.05 0.07 0.00 0.09 0.00 0.00 57.88 58.24 1i0b h LEU 151 Cb 0.39 -0.03 -0.07 0.00 0.09 0.00 0.00 40.66 41.05 1i0b h LEU 151 CO 0.01 0.28 -0.08 -0.09 0.09 0.00 0.00 178.44 178.66 1i0b h ARG 152 N 0.62 0.01 -0.01 1.13 2.43 -0.83 0.18 114.38 117.92 1i0b h ARG 152 Ca 0.34 -0.00 -0.06 0.00 -0.81 0.00 0.00 59.98 59.45 1i0b h ARG 152 Cb 0.34 -0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.87 1i0b h ARG 152 CO -0.25 0.01 -0.29 0.93 -1.51 0.00 0.00 179.97 178.86 1i0b h GLU 153 N 0.01 0.02 0.00 0.20 5.08 -0.88 0.44 114.58 119.45 1i0b h GLU 153 Ca 0.17 -0.01 -0.09 0.00 -1.00 0.00 0.00 59.36 58.44 1i0b h GLU 153 Cb 0.26 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.50 1i0b h GLU 153 CO -0.36 0.31 -0.52 0.82 -1.00 0.00 0.00 179.01 178.26 1i0b h ILE 154 N 0.02 1.22 0.01 3.13 2.04 -0.50 0.60 117.51 124.02 1i0b h ILE 154 Ca 0.00 -2.11 -0.11 0.00 1.00 0.00 0.00 64.86 63.64 1i0b h ILE 154 Cb 0.52 2.49 0.01 0.00 -0.74 0.00 0.00 36.82 39.11 1i0b h ILE 154 CO 0.04 0.41 -0.45 1.56 0.00 0.00 0.00 178.15 179.71 1i0b h GLN 155 N -1.00 0.29 0.00 2.37 4.20 -0.69 -3.37 115.11 116.90 1i0b h GLN 155 Ca -0.14 -0.32 -0.14 0.00 0.06 0.00 0.00 58.65 58.11 1i0b h GLN 155 Cb 1.02 0.09 -0.02 0.00 0.30 0.00 0.00 27.48 28.87 1i0b h GLN 155 CO -0.08 1.03 -1.37 0.66 -0.67 0.00 0.00 178.83 178.40 1i0b n TYR 156 N -4.35 0.20 0.00 2.96 4.01 -0.64 -5.04 117.16 114.30 1i0b n TYR 156 Ca -0.10 0.08 0.00 0.00 -0.16 0.00 0.00 57.90 57.72 1i0b n TYR 156 Cb 0.60 -0.71 0.00 0.00 -0.31 0.00 0.00 39.34 38.92 1i0b n TYR 156 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1i0b n GLY 157 N 1.42 3.59 3.72 2.72 0.00 0.05 -4.51 105.19 112.18 1i0b n GLY 157 Ca -0.25 -1.07 -0.41 0.00 0.00 0.00 0.00 46.02 44.28 1i0b n GLY 157 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1i0b s ILE 158 N -2.00 4.74 0.00 -0.61 1.01 0.68 -4.30 121.20 120.72 1i0b s ILE 158 Ca 0.00 2.02 0.00 0.00 0.00 0.00 0.00 60.65 62.67 1i0b s ILE 158 Cb 0.00 -4.30 0.00 0.00 0.01 0.00 0.00 42.46 38.17 1i0b s ILE 158 CO 0.00 0.23 0.00 -0.62 0.00 0.00 0.00 174.94 174.55 1i0b n GLU 159 N 3.45 0.00 -0.82 2.79 1.02 -1.26 -1.46 120.64 124.36 1i0b n GLU 159 Ca 0.04 0.00 -0.02 0.00 -0.02 0.00 0.00 57.16 57.16 1i0b n GLU 159 Cb 0.50 0.00 0.26 0.00 -0.02 0.00 0.00 31.44 32.19 1i0b n GLU 159 CO 0.00 0.00 0.00 -0.40 1.18 0.00 0.00 177.13 177.91 1i0b n ASP 160 N 1.53 3.97 0.04 1.62 3.85 -1.26 -4.64 116.55 121.67 1i0b n ASP 160 Ca 0.00 -3.31 0.11 0.00 -0.71 0.00 0.00 54.79 50.88 1i0b n ASP 160 Cb 0.00 -0.67 -0.05 0.00 -1.35 0.00 0.00 41.12 39.05 1i0b n ASP 160 CO 0.00 0.00 0.00 0.35 -1.01 0.00 0.00 177.20 176.54 1i0b n THR 161 N -0.53 0.28 -0.44 2.12 -2.24 -0.53 -4.96 114.28 107.97 1i0b n THR 161 Ca 0.35 -0.43 0.00 0.00 -2.27 0.00 0.00 64.05 61.69 1i0b n THR 161 Cb 1.18 -0.05 0.00 0.00 -2.10 0.00 0.00 70.33 69.37 1i0b n THR 161 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1i0b n GLY 162 N 1.27 1.87 3.63 3.38 0.00 -1.26 -4.93 105.19 109.14 1i0b n GLY 162 Ca -0.01 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.58 1i0b n GLY 162 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1i0b s ILE 163 N -3.22 4.05 -0.03 -0.61 1.01 -1.26 -4.69 121.20 116.45 1i0b s ILE 163 Ca 0.00 1.18 -0.17 0.00 0.00 0.00 0.00 60.65 61.66 1i0b s ILE 163 Cb 0.00 -4.08 -0.05 0.00 0.01 0.00 0.00 42.46 38.34 1i0b s ILE 163 CO 0.00 -0.46 0.46 -0.13 0.00 0.00 0.00 174.94 174.81 1i0b s ARG 164 N 4.30 4.12 0.41 2.79 0.52 -1.26 -0.23 118.95 129.60 1i0b s ARG 164 Ca 0.59 0.47 -0.25 0.00 -0.52 0.00 0.00 55.73 56.02 1i0b s ARG 164 Cb -0.18 -3.30 -0.08 0.00 0.52 0.00 0.00 34.95 31.90 1i0b s ARG 164 CO 0.25 0.48 1.20 0.00 0.02 0.00 0.00 175.30 177.25 1i0b s ALA 165 N -0.45 3.15 -0.47 2.13 0.00 0.20 -4.52 121.76 121.80 1i0b s ALA 165 Ca 0.25 1.03 0.05 0.00 0.00 0.00 0.00 51.96 53.29 1i0b s ALA 165 Cb -0.17 -3.41 0.12 0.00 0.00 0.00 0.00 23.12 19.66 1i0b s ALA 165 CO 0.13 -0.62 1.01 0.41 0.00 0.00 0.00 175.76 176.69 1i0b n GLY 166 N 0.63 1.98 3.50 0.00 0.00 -0.50 -4.57 105.19 106.23 1i0b n GLY 166 Ca 0.05 -0.16 -0.12 0.00 0.00 0.00 0.00 46.02 45.78 1i0b n GLY 166 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1i0b s ILE 167 N -0.86 0.00 -0.19 -0.61 2.07 -1.22 -4.45 121.20 115.94 1i0b s ILE 167 Ca 0.09 0.00 -0.01 0.00 -1.41 0.00 0.00 60.65 59.32 1i0b s ILE 167 Cb 0.05 -1.00 -0.00 0.00 0.13 0.00 0.00 42.46 41.64 1i0b s ILE 167 CO 0.07 0.00 -0.11 -0.63 -1.91 0.00 0.00 174.94 172.36 1i0b s ILE 168 N -2.38 2.88 -0.15 2.00 1.01 -0.10 -1.45 121.20 123.02 1i0b s ILE 168 Ca -0.01 -0.67 -0.06 0.00 0.00 0.00 0.00 60.65 59.91 1i0b s ILE 168 Cb -0.01 -2.26 -0.04 0.00 0.01 0.00 0.00 42.46 40.17 1i0b s ILE 168 CO -0.03 0.48 0.04 -0.75 0.00 0.00 0.00 174.94 174.68 1i0b s LYS 169 N 1.15 3.68 0.27 2.79 2.47 0.41 -0.35 119.74 130.16 1i0b s LYS 169 Ca 0.01 -0.37 0.02 0.00 -1.56 0.00 0.00 55.97 54.08 1i0b s LYS 169 Cb -0.14 -3.07 -0.04 0.00 -1.46 0.00 0.00 37.83 33.12 1i0b s LYS 169 CO -0.04 0.40 0.17 0.14 0.16 0.00 0.00 175.35 176.18 1i0b s VAL 170 N -0.00 0.14 -0.01 4.02 -7.23 -0.84 -1.06 120.40 115.42 1i0b s VAL 170 Ca 0.05 -2.00 -0.28 0.00 -1.81 0.00 0.00 61.98 57.94 1i0b s VAL 170 Cb -0.12 -2.51 0.10 0.00 0.56 0.00 0.00 36.38 34.40 1i0b s VAL 170 CO 0.01 0.00 0.82 0.00 -0.31 0.00 0.00 175.10 175.62 1i0b s ALA 171 N -3.79 -1.79 0.04 1.32 0.00 -1.25 -1.32 121.76 114.97 1i0b s ALA 171 Ca 0.38 1.06 -0.03 0.00 0.00 0.00 0.00 51.96 53.38 1i0b s ALA 171 Cb 0.05 0.24 -0.02 0.00 0.00 0.00 0.00 23.12 23.39 1i0b s ALA 171 CO 0.18 -0.59 0.02 0.95 0.00 0.00 0.00 175.76 176.32 1i0b s THR 172 N -2.58 0.17 -0.41 0.00 -4.23 -1.00 -4.81 115.64 102.77 1i0b s THR 172 Ca 0.00 -1.39 0.06 0.00 -1.18 0.00 0.00 61.69 59.19 1i0b s THR 172 Cb -0.01 -1.09 0.21 0.00 1.34 0.00 0.00 72.50 72.95 1i0b s THR 172 CO -0.05 -0.77 0.44 0.35 -0.54 0.00 0.00 174.62 174.05 1i0b n THR 173 N 0.56 -0.82 0.00 3.99 -2.24 -1.26 -3.73 114.28 110.79 1i0b n THR 173 Ca -0.17 -3.77 0.00 0.00 -2.27 0.00 0.00 64.05 57.83 1i0b n THR 173 Cb 0.59 -1.82 0.00 0.00 -2.10 0.00 0.00 70.33 67.01 1i0b n THR 173 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1i0b n GLY 174 N 2.11 0.06 3.74 3.38 0.00 -1.26 -4.94 105.19 108.29 1i0b n GLY 174 Ca 0.26 -1.82 -0.42 0.00 0.00 0.00 0.00 46.02 44.04 1i0b n GLY 174 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1i0b s LYS 175 N 0.00 4.14 0.46 1.61 2.20 -1.26 -4.83 119.74 122.05 1i0b s LYS 175 Ca 0.00 2.55 -0.25 0.00 -0.36 0.00 0.00 55.97 57.91 1i0b s LYS 175 Cb 0.00 -3.04 -0.08 0.00 -1.51 0.00 0.00 37.83 33.20 1i0b s LYS 175 CO 0.00 -0.63 1.39 0.00 -0.36 0.00 0.00 175.35 175.76 1i0b s ALA 176 N 0.19 3.18 0.88 3.13 0.00 -1.26 -5.01 121.76 122.86 1i0b s ALA 176 Ca 0.65 1.40 -0.14 0.00 0.00 0.00 0.00 51.96 53.87 1i0b s ALA 176 Cb -0.47 -3.57 0.13 0.00 0.00 0.00 0.00 23.12 19.21 1i0b s ALA 176 CO 0.45 -1.16 1.23 0.95 0.00 0.00 0.00 175.76 177.23 1i0b s THR 177 N -1.23 1.99 0.21 0.00 -4.23 -1.26 -4.84 115.64 106.28 1i0b s THR 177 Ca 0.62 0.00 -0.09 0.00 -1.18 0.00 0.00 61.69 61.04 1i0b s THR 177 Cb -0.42 -2.98 0.16 0.00 1.34 0.00 0.00 72.50 70.60 1i0b s THR 177 CO 0.54 0.00 1.80 -0.65 -0.54 0.00 0.00 174.62 175.77 1i0b h PRO 178 N -1.32 1.13 -0.63 3.99 0.11 -2.00 -2.02 132.00 131.26 1i0b h PRO 178 Ca -0.46 -0.16 -0.04 0.00 0.11 0.00 0.00 66.00 65.45 1i0b h PRO 178 Cb 1.29 -0.20 -0.03 0.00 0.11 0.00 0.00 31.00 32.17 1i0b h PRO 178 CO 0.55 0.87 0.23 0.35 -0.21 0.00 0.00 178.00 179.80 1i0b h PHE 179 N 1.11 0.98 -0.34 0.65 3.57 -1.93 -2.40 116.94 118.59 1i0b h PHE 179 Ca 0.27 -0.08 -0.02 0.00 3.53 0.00 0.00 57.97 61.67 1i0b h PHE 179 Cb 0.11 -0.29 -0.02 0.00 2.79 0.00 0.00 35.95 38.55 1i0b h PHE 179 CO 0.01 0.79 0.12 1.96 -2.23 0.00 0.00 178.31 178.96 1i0b h GLN 180 N 0.89 0.48 -0.48 1.11 4.20 -1.84 -0.05 115.11 119.42 1i0b h GLN 180 Ca 0.21 -0.06 -0.07 0.00 0.06 0.00 0.00 58.65 58.79 1i0b h GLN 180 Cb 0.24 -0.09 -0.02 0.00 0.30 0.00 0.00 27.48 27.91 1i0b h GLN 180 CO -0.01 0.41 0.02 0.93 -0.67 0.00 0.00 178.83 179.50 1i0b h GLU 181 N 0.48 0.79 -0.59 1.46 5.08 -0.87 0.86 114.58 121.79 1i0b h GLU 181 Ca 0.12 -0.20 -0.04 0.00 -1.00 0.00 0.00 59.36 58.24 1i0b h GLU 181 Cb 0.12 -0.10 -0.03 0.00 0.50 0.00 0.00 28.75 29.25 1i0b h GLU 181 CO -0.01 0.78 0.23 -0.07 -1.00 0.00 0.00 179.01 178.94 1i0b h LEU 182 N 0.74 0.82 -0.46 1.33 3.38 -0.92 -1.14 115.31 119.06 1i0b h LEU 182 Ca 0.15 -0.18 0.01 0.00 0.09 0.00 0.00 57.88 57.95 1i0b h LEU 182 Cb 0.42 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 40.93 1i0b h LEU 182 CO 0.02 0.77 0.30 0.58 0.09 0.00 0.00 178.44 180.20 1i0b h VAL 183 N 0.82 1.09 -0.90 1.22 2.07 -0.35 -0.38 116.25 119.81 1i0b h VAL 183 Ca 0.20 -0.21 -0.01 0.00 0.82 0.00 0.00 66.70 67.50 1i0b h VAL 183 Cb 0.21 0.44 -0.04 0.00 -1.52 0.00 0.00 31.29 30.38 1i0b h VAL 183 CO -0.01 0.11 0.52 -0.07 0.02 0.00 0.00 177.57 178.13 1i0b h LEU 184 N 0.60 1.11 -0.29 2.57 4.07 -0.56 0.27 115.31 123.09 1i0b h LEU 184 Ca 0.18 -0.09 -0.05 0.00 0.08 0.00 0.00 57.88 58.00 1i0b h LEU 184 Cb -0.04 -0.28 -0.01 0.00 1.08 0.00 0.00 40.66 41.41 1i0b h LEU 184 CO -0.05 0.88 -0.02 0.11 -1.08 0.00 0.00 178.44 178.27 1i0b h LYS 185 N 1.26 0.53 -0.64 1.13 1.57 -0.84 -1.26 116.57 118.31 1i0b h LYS 185 Ca 0.32 -0.18 -0.07 0.00 -1.87 0.00 0.00 60.65 58.85 1i0b h LYS 185 Cb -0.00 -0.04 -0.03 0.00 0.08 0.00 0.00 32.23 32.24 1i0b h LYS 185 CO -0.06 0.69 0.13 0.00 -0.57 0.00 0.00 179.45 179.64 1i0b h ALA 186 N 0.82 1.01 -0.37 3.86 0.00 -0.79 -0.49 119.26 123.29 1i0b h ALA 186 Ca 0.08 -0.25 0.03 0.00 0.00 0.00 0.00 54.91 54.77 1i0b h ALA 186 Cb 0.47 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 17.98 1i0b h ALA 186 CO 0.02 0.64 0.18 0.00 0.00 0.00 0.00 179.25 180.09 1i0b h ALA 187 N 1.15 0.45 -0.86 0.00 0.00 -0.79 0.13 119.26 119.34 1i0b h ALA 187 Ca 0.20 0.01 -0.03 0.00 0.00 0.00 0.00 54.91 55.10 1i0b h ALA 187 Cb 0.39 -0.06 -0.04 0.00 0.00 0.00 0.00 17.79 18.08 1i0b h ALA 187 CO 0.01 -0.18 0.43 0.00 0.00 0.00 0.00 179.25 179.50 1i0b h ALA 188 N 1.19 1.14 -0.52 0.00 0.00 -0.75 0.11 119.26 120.44 1i0b h ALA 188 Ca 0.16 -0.15 -0.05 0.00 0.00 0.00 0.00 54.91 54.87 1i0b h ALA 188 Cb 0.06 -0.34 -0.02 0.00 0.00 0.00 0.00 17.79 17.49 1i0b h ALA 188 CO -0.11 0.66 0.14 0.00 0.00 0.00 0.00 179.25 179.95 1i0b h ARG 189 N 1.22 0.81 -0.60 0.00 3.08 -0.34 -0.39 114.38 118.16 1i0b h ARG 189 Ca 0.30 -0.19 -0.06 0.00 0.07 0.00 0.00 59.98 60.10 1i0b h ARG 189 Cb 0.09 -0.11 -0.02 0.00 0.08 0.00 0.00 29.97 30.00 1i0b h ARG 189 CO -0.04 0.77 0.16 0.00 -1.07 0.00 0.00 179.97 179.79 1i0b h ALA 190 N 1.01 0.80 -0.74 0.04 0.00 -0.47 -1.64 119.26 118.25 1i0b h ALA 190 Ca 0.16 -0.22 -0.04 0.00 0.00 0.00 0.00 54.91 54.81 1i0b h ALA 190 Cb 0.31 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 17.83 1i0b h ALA 190 CO -0.00 0.49 0.31 1.03 0.00 0.00 0.00 179.25 181.08 1i0b h SER 191 N 0.87 1.02 -0.79 0.00 0.87 -0.47 -1.66 113.55 113.40 1i0b h SER 191 Ca 0.19 -0.17 -0.04 0.00 -1.23 0.00 0.00 61.79 60.54 1i0b h SER 191 Cb 0.34 -0.26 -0.04 0.00 -0.44 0.00 0.00 62.40 62.00 1i0b h SER 191 CO -0.00 0.91 0.33 -0.07 -0.53 0.00 0.00 176.83 177.47 1i0b h LEU 192 N 1.07 1.07 -0.53 2.23 3.38 -0.71 0.25 115.31 122.07 1i0b h LEU 192 Ca 0.25 -0.16 -0.15 0.00 0.09 0.00 0.00 57.88 57.91 1i0b h LEU 192 Cb 0.20 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.65 1i0b h LEU 192 CO -0.02 0.94 -0.73 0.00 0.09 0.00 0.00 178.44 178.72 1i0b h ALA 193 N 1.21 0.79 0.00 1.53 0.00 -1.12 -3.38 119.26 118.30 1i0b h ALA 193 Ca 0.27 -0.67 -0.05 0.00 0.00 0.00 0.00 54.91 54.46 1i0b h ALA 193 Cb 0.19 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 1i0b h ALA 193 CO -0.02 0.91 -1.61 0.25 0.00 0.00 0.00 179.25 178.78 1i0b n THR 194 N -3.66 0.19 -0.56 0.00 -2.24 -0.64 -5.00 114.28 102.37 1i0b n THR 194 Ca -0.01 -0.33 0.00 0.00 -2.27 0.00 0.00 64.05 61.45 1i0b n THR 194 Cb 0.71 -0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.94 1i0b n THR 194 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1i0b n GLY 195 N 1.93 1.02 3.80 3.38 0.00 0.86 -4.66 105.19 111.53 1i0b n GLY 195 Ca -0.06 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.60 1i0b n GLY 195 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1i0b s VAL 196 N -3.22 4.43 0.91 1.61 -7.23 -1.25 -0.75 120.40 114.90 1i0b s VAL 196 Ca 0.00 1.49 -0.12 0.00 -1.81 0.00 0.00 61.98 61.54 1i0b s VAL 196 Cb 0.00 -3.89 0.14 0.00 0.56 0.00 0.00 36.38 33.18 1i0b s VAL 196 CO 0.00 0.14 1.09 -2.16 -0.31 0.00 0.00 175.10 173.86 1i0b s PRO 197 N -2.12 1.16 -0.06 4.82 0.04 -1.26 -4.47 135.00 133.12 1i0b s PRO 197 Ca 0.47 0.72 0.03 0.00 0.04 0.00 0.00 61.00 62.26 1i0b s PRO 197 Cb -0.17 -1.81 -0.03 0.00 0.04 0.00 0.00 34.50 32.54 1i0b s PRO 197 CO 0.21 -2.28 -0.13 0.08 0.04 0.00 0.00 177.00 174.92 1i0b s VAL 198 N -2.97 3.16 0.04 -0.36 1.01 0.80 -0.92 120.40 121.16 1i0b s VAL 198 Ca 0.64 -0.68 0.05 0.00 0.00 0.00 0.00 61.98 61.98 1i0b s VAL 198 Cb -0.18 -2.25 -0.02 0.00 0.00 0.00 0.00 36.38 33.93 1i0b s VAL 198 CO 0.57 0.59 -0.14 0.28 0.00 0.00 0.00 175.10 176.39 1i0b s THR 199 N -0.67 1.11 0.21 3.92 -1.32 0.52 -1.64 115.64 117.77 1i0b s THR 199 Ca 0.10 -1.04 0.05 0.00 -1.21 0.00 0.00 61.69 59.59 1i0b s THR 199 Cb -0.11 -1.01 -0.05 0.00 -1.51 0.00 0.00 72.50 69.82 1i0b s THR 199 CO 0.01 -0.03 -0.06 0.42 -2.21 0.00 0.00 174.62 172.75 1i0b s THR 200 N -0.91 1.26 -0.16 5.08 -4.23 0.38 -1.99 115.64 115.07 1i0b s THR 200 Ca 0.01 -2.08 -0.06 0.00 -1.18 0.00 0.00 61.69 58.38 1i0b s THR 200 Cb -0.08 -2.18 -0.04 0.00 1.34 0.00 0.00 72.50 71.54 1i0b s THR 200 CO 0.01 -0.48 0.04 -2.28 -0.54 0.00 0.00 174.62 171.38 1i0b s HIS 201 N -3.27 3.22 0.14 3.99 2.46 -0.44 -1.54 115.29 119.86 1i0b s HIS 201 Ca 0.24 0.06 0.03 0.00 0.47 0.00 0.00 55.06 55.86 1i0b s HIS 201 Cb 0.04 -2.00 -0.04 0.00 -0.13 0.00 0.00 32.58 30.44 1i0b s HIS 201 CO 0.07 0.22 -0.05 0.95 -2.47 0.00 0.00 174.74 173.45 1i0b s THR 202 N 0.05 0.83 -1.05 0.89 -4.23 -1.24 -2.39 115.64 108.50 1i0b s THR 202 Ca 0.04 -1.99 -0.10 0.00 -1.18 0.00 0.00 61.69 58.46 1i0b s THR 202 Cb -0.12 -1.88 0.26 0.00 1.34 0.00 0.00 72.50 72.10 1i0b s THR 202 CO 0.01 -0.71 1.03 0.00 -0.54 0.00 0.00 174.62 174.42 1i0b s ALA 203 N -3.54 4.59 0.23 3.99 0.00 -1.24 -4.81 121.76 120.98 1i0b s ALA 203 Ca 0.17 -3.72 -0.08 0.00 0.00 0.00 0.00 51.96 48.33 1i0b s ALA 203 Cb 0.05 -3.56 0.40 0.00 0.00 0.00 0.00 23.12 20.00 1i0b s ALA 203 CO -0.00 -2.22 1.65 0.00 0.00 0.00 0.00 175.76 175.19 1i0b h ALA 204 N 6.93 0.76 0.00 0.00 0.00 -1.89 -1.54 119.26 123.52 1i0b h ALA 204 Ca 0.16 0.21 0.00 0.00 0.00 0.00 0.00 54.91 55.28 1i0b h ALA 204 Cb 0.91 0.35 0.00 0.00 0.00 0.00 0.00 17.79 19.05 1i0b h ALA 204 CO 0.95 -0.40 0.00 0.66 0.00 0.00 0.00 179.25 180.46 1i0b h SER 205 N 0.14 0.00 -0.54 0.00 4.64 -1.92 -0.30 113.55 115.57 1i0b h SER 205 Ca 0.38 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.70 1i0b h SER 205 Cb 0.66 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.75 1i0b h SER 205 CO -0.59 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.37 1i0b n GLN 206 N -2.83 3.12 -2.67 4.77 6.02 -0.58 -4.97 117.38 120.24 1i0b n GLN 206 Ca -0.02 -2.57 -0.20 0.00 -0.01 0.00 0.00 57.00 54.20 1i0b n GLN 206 Cb 0.08 -1.61 0.00 0.00 1.02 0.00 0.00 30.24 29.74 1i0b n GLN 206 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 1i0b n ARG 207 N 0.91 -2.88 0.04 -1.09 1.74 -0.13 -4.86 116.66 110.39 1i0b n ARG 207 Ca 0.21 0.86 0.19 0.00 -0.77 0.00 0.00 57.85 58.34 1i0b n ARG 207 Cb 0.68 -5.58 0.70 0.00 -1.02 0.00 0.00 32.46 27.24 1i0b n ARG 207 CO 0.00 0.00 0.00 -0.44 -1.52 0.00 0.00 177.63 175.67 1i0b h ASP 208 N -0.49 0.00 -0.58 0.55 3.45 -1.78 -1.50 116.42 116.07 1i0b h ASP 208 Ca -0.46 0.00 0.16 0.00 0.43 0.00 0.00 57.03 57.16 1i0b h ASP 208 Cb 1.33 0.00 -0.03 0.00 -0.56 0.00 0.00 39.33 40.08 1i0b h ASP 208 CO 0.53 0.00 0.42 1.23 -1.57 0.00 0.00 179.24 179.85 1i0b h GLY 209 N 0.00 0.07 0.75 2.75 0.00 -1.89 -1.56 103.07 103.19 1i0b h GLY 209 Ca 0.22 -0.02 -0.02 0.00 0.00 0.00 0.00 47.33 47.51 1i0b h GLY 209 CO -0.00 0.01 -0.02 0.83 0.00 0.00 0.00 176.54 177.35 1i0b h GLU 210 N 0.04 0.23 -0.71 4.80 5.08 -1.65 0.00 114.58 122.37 1i0b h GLU 210 Ca 0.28 -0.08 -0.05 0.00 -1.00 0.00 0.00 59.36 58.51 1i0b h GLU 210 Cb 1.06 -0.02 -0.03 0.00 0.50 0.00 0.00 28.75 30.26 1i0b h GLU 210 CO -0.01 0.51 0.26 0.37 -1.00 0.00 0.00 179.01 179.13 1i0b h GLN 211 N -0.07 1.08 0.13 2.33 4.15 -1.51 -1.37 115.11 119.85 1i0b h GLN 211 Ca 0.03 -0.20 0.00 0.00 0.77 0.00 0.00 58.65 59.25 1i0b h GLN 211 Cb 0.42 -0.17 -0.01 0.00 0.21 0.00 0.00 27.48 27.93 1i0b h GLN 211 CO 0.01 0.89 -0.13 1.96 -1.93 0.00 0.00 178.83 179.63 1i0b h GLN 212 N 1.05 -0.28 -0.79 1.69 4.20 -1.16 -1.43 115.11 118.39 1i0b h GLN 212 Ca 0.24 0.02 0.11 0.00 0.06 0.00 0.00 58.65 59.07 1i0b h GLN 212 Cb 0.24 0.06 -0.08 0.00 0.30 0.00 0.00 27.48 28.01 1i0b h GLN 212 CO -0.01 -0.18 0.42 0.00 -0.67 0.00 0.00 178.83 178.38 1i0b h ALA 213 N 0.56 1.13 -0.70 3.87 0.00 -0.86 0.27 119.26 123.52 1i0b h ALA 213 Ca 0.00 0.05 -0.00 0.00 0.00 0.00 0.00 54.91 54.97 1i0b h ALA 213 Cb 0.27 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 17.96 1i0b h ALA 213 CO -0.03 0.00 0.43 0.00 0.00 0.00 0.00 179.25 179.65 1i0b h ALA 214 N 1.47 0.89 -0.33 0.00 0.00 -0.69 0.85 119.26 121.46 1i0b h ALA 214 Ca 0.40 -0.07 -0.07 0.00 0.00 0.00 0.00 54.91 55.16 1i0b h ALA 214 Cb 0.44 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 1i0b h ALA 214 CO -0.28 0.35 -0.08 0.82 0.00 0.00 0.00 179.25 180.05 1i0b h ILE 215 N 0.95 1.28 -0.37 0.00 2.04 -0.50 -1.48 117.51 119.44 1i0b h ILE 215 Ca 0.25 -1.14 0.02 0.00 1.00 0.00 0.00 64.86 64.99 1i0b h ILE 215 Cb -0.05 1.35 -0.02 0.00 -0.74 0.00 0.00 36.82 37.35 1i0b h ILE 215 CO -0.05 0.37 0.22 -0.26 0.00 0.00 0.00 178.15 178.42 1i0b h PHE 216 N 0.41 0.40 -0.36 1.37 0.05 -0.58 -2.25 116.94 115.99 1i0b h PHE 216 Ca 0.08 0.01 -0.06 0.00 3.82 0.00 0.00 57.97 61.82 1i0b h PHE 216 Cb 0.58 -0.13 -0.02 0.00 2.00 0.00 0.00 35.95 38.38 1i0b h PHE 216 CO 0.05 0.24 -0.03 0.93 -0.18 0.00 0.00 178.31 179.32 1i0b h GLU 217 N 0.44 0.58 0.00 1.51 5.08 -0.76 -1.70 114.58 119.73 1i0b h GLU 217 Ca 0.15 -0.14 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1i0b h GLU 217 Cb 0.00 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.18 1i0b h GLU 217 CO -0.07 0.63 0.00 -1.13 -1.00 0.00 0.00 179.01 177.44 1i0b n SER 218 N -4.24 0.24 -0.84 1.42 3.41 -0.56 -0.50 113.62 112.54 1i0b n SER 218 Ca 0.02 0.57 0.09 0.00 -0.26 0.00 0.00 58.87 59.29 1i0b n SER 218 Cb 0.28 -0.62 0.14 0.00 -0.26 0.00 0.00 64.21 63.75 1i0b n SER 218 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1i0b n GLU 219 N -1.78 2.00 -1.00 4.33 -0.58 -0.69 -4.98 120.64 117.93 1i0b n GLU 219 Ca 0.02 -1.89 -0.00 0.00 -0.42 0.00 0.00 57.16 54.87 1i0b n GLU 219 Cb 0.14 -1.38 -0.00 0.00 -0.57 0.00 0.00 31.44 29.63 1i0b n GLU 219 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1i0b n GLY 220 N 1.05 0.46 3.76 0.62 0.00 0.34 -4.90 105.19 106.52 1i0b n GLY 220 Ca 0.14 -0.03 -0.40 0.00 0.00 0.00 0.00 46.02 45.73 1i0b n GLY 220 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1i0b s LEU 221 N -0.01 4.46 0.15 0.99 2.96 -0.88 -5.00 118.68 121.35 1i0b s LEU 221 Ca 0.00 2.32 -0.29 0.00 -0.22 0.00 0.00 54.13 55.94 1i0b s LEU 221 Cb 0.00 -3.73 -0.07 0.00 0.50 0.00 0.00 46.19 42.89 1i0b s LEU 221 CO 0.00 -0.30 0.92 -0.55 -1.32 0.00 0.00 176.35 175.10 1i0b s SER 222 N -0.91 7.51 0.59 3.68 0.15 -1.26 -4.49 113.70 118.97 1i0b s SER 222 Ca 0.48 1.79 0.29 0.00 0.70 0.00 0.00 55.95 59.21 1i0b s SER 222 Cb -0.32 -2.57 1.61 0.00 -1.71 0.00 0.00 66.02 63.03 1i0b s SER 222 CO 0.41 0.04 2.04 -0.65 1.20 0.00 0.00 173.24 176.29 1i0b h PRO 223 N 5.02 0.00 0.00 5.44 0.11 -1.85 0.14 132.00 140.86 1i0b h PRO 223 Ca -0.44 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.67 1i0b h PRO 223 Cb 1.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.32 1i0b h PRO 223 CO 0.70 0.00 0.00 -1.13 -0.21 0.00 0.00 178.00 177.36 1i0b n SER 224 N -3.76 0.21 -1.03 -2.05 3.41 -1.20 -1.64 113.62 107.55 1i0b n SER 224 Ca 0.03 0.55 0.11 0.00 -0.26 0.00 0.00 58.87 59.30 1i0b n SER 224 Cb 0.41 -0.59 0.26 0.00 -0.26 0.00 0.00 64.21 64.03 1i0b n SER 224 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1i0b n ARG 225 N -1.73 2.34 -4.83 4.33 5.12 0.48 -4.90 116.66 117.47 1i0b n ARG 225 Ca 0.03 -2.04 -0.27 0.00 -1.93 0.00 0.00 57.85 53.65 1i0b n ARG 225 Cb 0.20 -1.48 -0.16 0.00 -1.16 0.00 0.00 32.46 29.85 1i0b n ARG 225 CO 0.00 0.00 0.00 0.08 -1.93 0.00 0.00 177.63 175.78 1i0b s VAL 226 N -1.47 1.44 -0.22 1.55 1.01 -0.65 -0.14 120.40 121.92 1i0b s VAL 226 Ca 0.38 -0.70 -0.02 0.00 0.00 0.00 0.00 61.98 61.64 1i0b s VAL 226 Cb 0.21 -1.26 0.01 0.00 0.00 0.00 0.00 36.38 35.34 1i0b s VAL 226 CO 0.30 0.42 -0.08 0.00 0.00 0.00 0.00 175.10 175.73 1i0b s ILE 228 N 1.40 4.52 0.78 0.00 -1.09 -0.19 -0.47 121.20 126.15 1i0b s ILE 228 Ca 0.04 -0.22 -0.12 0.00 -2.23 0.00 0.00 60.65 58.13 1i0b s ILE 228 Cb -0.15 -4.52 0.06 0.00 -1.58 0.00 0.00 42.46 36.28 1i0b s ILE 228 CO -0.06 -1.15 1.15 -0.83 -1.23 0.00 0.00 174.94 172.83 1i0b s GLY 229 N 3.14 1.60 -1.57 6.18 0.00 -0.59 -0.36 107.32 115.72 1i0b s GLY 229 Ca 0.22 -0.59 0.00 0.00 0.00 0.00 0.00 44.72 44.35 1i0b s GLY 229 CO 0.13 -0.13 0.00 1.42 0.00 0.00 0.00 173.10 174.52 1i0b n HIS 230 N -3.23 -0.95 0.32 1.90 8.25 -1.13 -3.71 115.22 116.68 1i0b n HIS 230 Ca 0.08 0.00 0.16 0.00 -0.26 0.00 0.00 57.72 57.70 1i0b n HIS 230 Cb 0.60 -3.39 0.66 0.00 1.12 0.00 0.00 29.99 28.98 1i0b n HIS 230 CO 0.00 0.00 0.00 0.77 0.64 0.00 0.00 176.34 177.75 1i0b h SER 231 N 0.00 0.00 0.07 0.41 0.02 -1.41 -2.40 113.55 110.25 1i0b h SER 231 Ca -0.40 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.55 1i0b h SER 231 Cb 1.27 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.81 1i0b h SER 231 CO 0.50 0.00 0.00 -0.90 -1.14 0.00 0.00 176.83 175.29 1i0b n ASP 232 N -2.82 0.00 0.07 3.07 3.85 -1.26 -3.16 116.55 116.31 1i0b n ASP 232 Ca 0.01 -0.87 0.12 0.00 -0.71 0.00 0.00 54.79 53.34 1i0b n ASP 232 Cb 0.27 -0.04 0.46 0.00 -1.35 0.00 0.00 41.12 40.46 1i0b n ASP 232 CO 0.00 0.00 0.00 0.47 -1.01 0.00 0.00 177.20 176.66 1i0b n ASP 233 N -1.04 0.49 -4.53 -1.12 10.43 -0.90 -4.78 116.55 115.10 1i0b n ASP 233 Ca 0.22 0.57 -0.28 0.00 2.57 0.00 0.00 54.79 57.88 1i0b n ASP 233 Cb 0.12 -0.69 -0.10 0.00 1.84 0.00 0.00 41.12 42.29 1i0b n ASP 233 CO 0.00 0.00 0.00 0.28 -1.07 0.00 0.00 177.20 176.41 1i0b s THR 234 N -3.12 3.00 -2.21 -3.53 -1.32 -1.19 -4.61 115.64 102.66 1i0b s THR 234 Ca 0.09 -1.63 0.22 0.00 -1.21 0.00 0.00 61.69 59.15 1i0b s THR 234 Cb 0.13 -2.44 0.44 0.00 -1.51 0.00 0.00 72.50 69.11 1i0b s THR 234 CO 0.48 -0.03 1.39 0.47 -2.21 0.00 0.00 174.62 174.72 1i0b n ASP 235 N 0.33 3.45 -4.52 8.08 10.43 -1.26 -4.84 116.55 128.23 1i0b n ASP 235 Ca -0.13 -1.97 -0.42 0.00 2.57 0.00 0.00 54.79 54.84 1i0b n ASP 235 Cb 0.54 -0.28 -0.03 0.00 1.84 0.00 0.00 41.12 43.20 1i0b n ASP 235 CO 0.00 0.00 0.00 -0.62 -1.07 0.00 0.00 177.20 175.51 1i0b s ASP 236 N -1.33 6.58 0.44 -2.24 3.68 -1.26 -4.81 116.67 117.73 1i0b s ASP 236 Ca 0.38 -1.77 0.18 0.00 2.13 0.00 0.00 52.55 53.46 1i0b s ASP 236 Cb 0.22 -2.50 1.00 0.00 -1.45 0.00 0.00 42.92 40.19 1i0b s ASP 236 CO 0.30 -1.30 1.94 0.25 0.13 0.00 0.00 175.17 176.49 1i0b h LEU 237 N 11.80 0.00 -0.57 -1.34 5.85 -1.99 -2.60 115.31 126.46 1i0b h LEU 237 Ca 0.20 0.00 -0.03 0.00 0.84 0.00 0.00 57.88 58.89 1i0b h LEU 237 Cb 1.00 0.00 -0.03 0.00 0.37 0.00 0.00 40.66 42.01 1i0b h LEU 237 CO 1.31 0.24 0.24 0.28 -0.34 0.00 0.00 178.44 180.17 1i0b h SER 238 N 0.00 0.78 -0.14 1.25 0.02 -1.99 0.21 113.55 113.68 1i0b h SER 238 Ca -0.00 -0.16 -0.00 0.00 -0.84 0.00 0.00 61.79 60.78 1i0b h SER 238 Cb 0.48 -0.20 -0.01 0.00 0.14 0.00 0.00 62.40 62.81 1i0b h SER 238 CO 0.03 0.73 0.07 0.22 -1.14 0.00 0.00 176.83 176.74 1i0b h TYR 239 N 0.78 0.19 -0.05 3.45 5.03 -1.88 -1.84 116.97 122.65 1i0b h TYR 239 Ca 0.19 -0.00 -0.01 0.00 2.58 0.00 0.00 58.73 61.49 1i0b h TYR 239 Cb 0.18 -0.06 -0.00 0.00 1.55 0.00 0.00 36.73 38.40 1i0b h TYR 239 CO 0.01 0.20 0.00 -0.07 -1.32 0.00 0.00 178.16 176.97 1i0b h LEU 240 N 0.12 0.09 -1.87 2.82 3.38 -1.26 -2.51 115.31 116.08 1i0b h LEU 240 Ca 0.05 -0.31 -0.02 0.00 0.09 0.00 0.00 57.88 57.69 1i0b h LEU 240 Cb 0.07 -0.02 -0.00 0.00 0.09 0.00 0.00 40.66 40.79 1i0b h LEU 240 CO -0.01 0.37 -0.10 0.71 0.09 0.00 0.00 178.44 179.51 1i0b h THR 241 N -0.20 0.97 -0.34 0.22 1.35 -0.58 -0.60 112.91 113.73 1i0b h THR 241 Ca 0.01 -0.35 -0.14 0.00 -0.55 0.00 0.00 66.41 65.39 1i0b h THR 241 Cb 0.33 1.19 -0.01 0.00 -1.73 0.00 0.00 68.15 67.93 1i0b h THR 241 CO 0.00 0.10 -0.34 0.00 -0.25 0.00 0.00 175.52 175.03 1i0b h ALA 242 N 1.90 0.76 -0.21 6.62 0.00 -1.17 0.54 119.26 127.71 1i0b h ALA 242 Ca -0.00 -0.42 -0.08 0.00 0.00 0.00 0.00 54.91 54.41 1i0b h ALA 242 Cb 0.19 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 17.84 1i0b h ALA 242 CO 0.01 0.65 -0.18 -0.07 0.00 0.00 0.00 179.25 179.67 1i0b h LEU 243 N 0.64 0.51 -1.56 0.00 3.38 -0.99 -2.93 115.31 114.37 1i0b h LEU 243 Ca 0.07 -0.46 0.02 0.00 0.09 0.00 0.00 57.88 57.59 1i0b h LEU 243 Cb 0.88 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 41.46 1i0b h LEU 243 CO 0.08 0.87 0.32 0.00 0.09 0.00 0.00 178.44 179.79 1i0b h ALA 244 N 0.66 1.72 -0.36 1.53 0.00 -0.87 -1.45 119.26 120.48 1i0b h ALA 244 Ca 0.04 -0.03 -0.04 0.00 0.00 0.00 0.00 54.91 54.88 1i0b h ALA 244 Cb 0.71 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.31 1i0b h ALA 244 CO 0.05 0.24 0.04 0.00 0.00 0.00 0.00 179.25 179.58 1i0b h ALA 245 N 1.71 1.40 -0.00 0.00 0.00 -0.83 -0.97 119.26 120.58 1i0b h ALA 245 Ca 0.18 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.92 1i0b h ALA 245 Cb 0.01 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 17.64 1i0b h ALA 245 CO -0.04 0.42 -0.02 0.54 0.00 0.00 0.00 179.25 180.15 1i0b n ARG 246 N -4.30 0.92 -0.02 0.00 1.74 -0.58 -4.91 116.66 109.52 1i0b n ARG 246 Ca 0.02 -0.15 0.00 0.00 -0.77 0.00 0.00 57.85 56.95 1i0b n ARG 246 Cb 0.22 -1.50 0.00 0.00 -1.02 0.00 0.00 32.46 30.16 1i0b n ARG 246 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1i0b n GLY 247 N 1.12 0.73 3.82 -0.13 0.00 -0.37 -4.73 105.19 105.63 1i0b n GLY 247 Ca 0.20 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.90 1i0b n GLY 247 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1i0b s TYR 248 N -2.02 3.17 0.12 1.61 1.51 -0.99 -3.23 117.35 117.53 1i0b s TYR 248 Ca 0.00 1.48 -0.16 0.00 -1.01 0.00 0.00 57.07 57.38 1i0b s TYR 248 Cb 0.00 -2.92 -0.07 0.00 -0.11 0.00 0.00 41.96 38.86 1i0b s TYR 248 CO 0.00 -0.85 0.56 -0.51 -1.11 0.00 0.00 175.55 173.64 1i0b s LEU 249 N -4.42 4.40 -0.24 -1.29 1.02 0.28 -4.38 118.68 114.04 1i0b s LEU 249 Ca 0.61 1.15 -0.05 0.00 0.02 0.00 0.00 54.13 55.86 1i0b s LEU 249 Cb -0.14 -3.14 -0.01 0.00 0.02 0.00 0.00 46.19 42.92 1i0b s LEU 249 CO 0.36 0.16 0.01 -0.63 0.02 0.00 0.00 176.35 176.27 1i0b s ILE 250 N -1.34 3.69 -0.39 -0.59 -1.09 0.15 -1.03 121.20 120.61 1i0b s ILE 250 Ca 0.35 -0.48 -0.17 0.00 -2.23 0.00 0.00 60.65 58.12 1i0b s ILE 250 Cb -0.17 -2.75 0.01 0.00 -1.58 0.00 0.00 42.46 37.97 1i0b s ILE 250 CO 0.19 0.32 0.46 -0.83 -1.23 0.00 0.00 174.94 173.85 1i0b s GLY 251 N 1.51 1.86 -1.12 6.18 0.00 0.51 -1.09 107.32 115.17 1i0b s GLY 251 Ca 0.05 -1.30 -0.09 0.00 0.00 0.00 0.00 44.72 43.38 1i0b s GLY 251 CO -0.01 1.18 1.15 1.04 0.00 0.00 0.00 173.10 176.46 1i0b n LEU 252 N 5.64 5.59 -0.50 0.66 4.77 0.48 -1.40 117.00 132.25 1i0b n LEU 252 Ca -0.07 -5.05 0.05 0.00 -0.03 0.00 0.00 56.01 50.91 1i0b n LEU 252 Cb 0.48 -1.47 0.11 0.00 -2.33 0.00 0.00 43.42 40.22 1i0b n LEU 252 CO 0.45 1.37 0.58 -0.90 -1.33 0.00 0.00 177.39 177.55 1i0b n ASP 253 N 2.61 2.61 -0.77 -1.43 3.85 -1.26 -2.27 116.55 119.90 1i0b n ASP 253 Ca 0.24 -1.91 0.04 0.00 -0.71 0.00 0.00 54.79 52.45 1i0b n ASP 253 Cb 0.39 -0.16 0.21 0.00 -1.35 0.00 0.00 41.12 40.20 1i0b n ASP 253 CO 0.00 0.00 0.00 1.41 -1.01 0.00 0.00 177.20 177.60 1i0b n HIS 254 N 0.35 0.68 -0.30 2.11 8.25 -1.26 -2.26 115.22 122.79 1i0b n HIS 254 Ca 0.09 -1.21 0.01 0.00 -0.26 0.00 0.00 57.72 56.34 1i0b n HIS 254 Cb 0.37 -0.33 0.07 0.00 1.12 0.00 0.00 29.99 31.22 1i0b n HIS 254 CO 0.00 0.00 0.00 0.82 0.64 0.00 0.00 176.34 177.80 1i0b h ILE 255 N 1.05 0.12 -0.00 1.59 1.08 -1.80 -0.80 117.51 118.74 1i0b h ILE 255 Ca 0.07 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.54 1i0b h ILE 255 Cb 1.37 0.12 0.00 0.00 -3.07 0.00 0.00 36.82 35.24 1i0b h ILE 255 CO 0.21 0.00 -0.00 -0.81 -0.69 0.00 0.00 178.15 176.85 1i0b n PRO 256 N -5.51 0.93 -2.37 2.37 -0.04 -1.26 -4.29 135.00 124.83 1i0b n PRO 256 Ca 0.10 -0.06 -0.43 0.00 -0.04 0.00 0.00 63.50 63.08 1i0b n PRO 256 Cb 0.41 -1.50 -0.02 0.00 -0.04 0.00 0.00 33.50 32.35 1i0b n PRO 256 CO 0.00 0.00 0.00 -1.01 -0.04 0.00 0.00 175.50 174.45 1i0b s HIS 257 N -2.10 2.48 -0.28 0.54 3.76 -0.31 -4.83 115.29 114.55 1i0b s HIS 257 Ca 0.44 0.72 -0.18 0.00 -0.15 0.00 0.00 55.06 55.89 1i0b s HIS 257 Cb 0.22 -4.21 0.10 0.00 1.11 0.00 0.00 32.58 29.80 1i0b s HIS 257 CO 0.39 -1.90 0.81 0.45 -0.85 0.00 0.00 174.74 173.63 1i0b s SER 258 N 3.59 -0.75 -0.02 1.40 0.15 -1.24 -4.76 113.70 112.07 1i0b s SER 258 Ca 0.60 1.24 0.20 0.00 0.70 0.00 0.00 55.95 58.69 1i0b s SER 258 Cb -0.14 1.30 0.62 0.00 -1.71 0.00 0.00 66.02 66.08 1i0b s SER 258 CO 0.30 -0.20 1.52 0.00 1.20 0.00 0.00 173.24 176.06 1i0b n ALA 259 N 3.72 2.51 -1.68 5.45 0.00 0.14 -4.94 120.51 125.72 1i0b n ALA 259 Ca -0.18 -1.25 -0.48 0.00 0.00 0.00 0.00 53.44 51.53 1i0b n ALA 259 Cb 0.58 -0.96 -0.05 0.00 0.00 0.00 0.00 19.45 19.02 1i0b n ALA 259 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 1i0b n ILE 260 N 1.43 0.52 -0.06 0.00 5.41 -1.26 0.10 119.36 125.49 1i0b n ILE 260 Ca 0.23 -0.09 0.00 0.00 1.00 0.00 0.00 62.75 63.89 1i0b n ILE 260 Cb 0.63 -1.84 0.00 0.00 -0.71 0.00 0.00 39.64 37.72 1i0b n ILE 260 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1i0b n GLY 261 N 4.29 0.90 1.77 7.39 0.00 -1.26 -4.92 105.19 113.36 1i0b n GLY 261 Ca 0.22 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.25 1i0b n GLY 261 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1i0b n LEU 262 N 0.00 0.68 0.04 0.99 4.77 0.28 -4.91 117.00 118.85 1i0b n LEU 262 Ca 0.00 -2.28 0.11 0.00 -0.03 0.00 0.00 56.01 53.81 1i0b n LEU 262 Cb 0.00 0.11 0.56 0.00 -2.33 0.00 0.00 43.42 41.75 1i0b n LEU 262 CO 0.00 0.83 1.15 -0.33 -1.33 0.00 0.00 177.39 177.71 1i0b h GLU 263 N 1.19 0.25 0.00 3.23 3.07 -1.91 -1.41 114.58 118.99 1i0b h GLU 263 Ca -0.28 -0.01 -0.02 0.00 -0.50 0.00 0.00 59.36 58.55 1i0b h GLU 263 Cb 1.66 -0.06 -0.00 0.00 -0.84 0.00 0.00 28.75 29.51 1i0b h GLU 263 CO 0.04 0.16 -0.10 0.38 -1.40 0.00 0.00 179.01 178.10 1i0b h ASP 264 N 0.25 0.00 -2.82 1.42 3.04 -1.92 -3.38 116.42 113.01 1i0b h ASP 264 Ca 0.18 0.00 -0.71 0.00 -3.24 0.00 0.00 57.03 53.26 1i0b h ASP 264 Cb 0.37 0.00 -0.19 0.00 -1.04 0.00 0.00 39.33 38.47 1i0b h ASP 264 CO -0.03 0.10 0.50 0.21 -2.04 0.00 0.00 179.24 177.97 1i0b s ASN 265 N -6.45 6.51 0.13 4.15 3.84 -0.53 -4.95 114.94 117.64 1i0b s ASN 265 Ca -0.04 -1.93 -0.29 0.00 0.21 0.00 0.00 52.86 50.82 1i0b s ASN 265 Cb 0.15 -2.34 -0.05 0.00 -0.55 0.00 0.00 41.25 38.45 1i0b s ASN 265 CO 0.61 -1.02 1.59 0.00 -2.79 0.00 0.00 177.10 175.49 1i0b h ALA 266 N 8.78 -0.56 -0.87 1.71 0.00 -1.82 -0.34 119.26 126.16 1i0b h ALA 266 Ca 0.00 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.88 1i0b h ALA 266 Cb 1.05 0.75 -0.04 0.00 0.00 0.00 0.00 17.79 19.55 1i0b h ALA 266 CO 1.04 -0.90 0.46 0.66 0.00 0.00 0.00 179.25 180.51 1i0b h SER 267 N -0.48 1.10 -0.53 0.00 4.64 -1.95 0.19 113.55 116.51 1i0b h SER 267 Ca 0.08 -0.11 -0.11 0.00 -0.47 0.00 0.00 61.79 61.18 1i0b h SER 267 Cb 0.62 -0.28 -0.02 0.00 -0.31 0.00 0.00 62.40 62.41 1i0b h SER 267 CO -0.38 0.89 -0.08 0.00 -0.87 0.00 0.00 176.83 176.39 1i0b h ALA 268 N 1.28 0.82 -0.59 5.18 0.00 -1.87 -1.20 119.26 122.87 1i0b h ALA 268 Ca 0.30 -0.34 -0.02 0.00 0.00 0.00 0.00 54.91 54.86 1i0b h ALA 268 Cb 0.05 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.61 1i0b h ALA 268 CO -0.05 0.66 0.30 0.77 0.00 0.00 0.00 179.25 180.94 1i0b h SER 269 N 0.91 0.76 -0.13 0.00 0.02 -0.33 0.17 113.55 114.95 1i0b h SER 269 Ca 0.15 -0.12 -0.07 0.00 -0.84 0.00 0.00 61.79 60.91 1i0b h SER 269 Cb 0.63 -0.19 -0.02 0.00 0.14 0.00 0.00 62.40 62.96 1i0b h SER 269 CO 0.04 0.66 -0.12 0.00 -1.14 0.00 0.00 176.83 176.27 1i0b h ALA 270 N 1.13 1.26 0.02 3.77 0.00 -0.83 -0.18 119.26 124.43 1i0b h ALA 270 Ca 0.21 -0.27 -0.00 0.00 0.00 0.00 0.00 54.91 54.85 1i0b h ALA 270 Cb 0.09 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.75 1i0b h ALA 270 CO -0.03 0.49 -0.01 1.25 0.00 0.00 0.00 179.25 180.95 1i0b h LEU 271 N 0.45 -0.02 0.00 0.00 5.85 -0.71 -3.40 115.31 117.47 1i0b h LEU 271 Ca 0.08 -0.64 -0.02 0.00 0.84 0.00 0.00 57.88 58.14 1i0b h LEU 271 Cb 0.49 0.01 -0.00 0.00 0.37 0.00 0.00 40.66 41.52 1i0b h LEU 271 CO 0.03 0.77 -1.05 -0.07 -0.34 0.00 0.00 178.44 177.78 1i0b h LEU 272 N -0.96 0.00 0.00 2.25 3.38 -0.72 -3.50 115.31 115.77 1i0b h LEU 272 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1i0b h LEU 272 Cb 0.66 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.41 1i0b h LEU 272 CO 0.00 0.08 0.00 0.61 0.09 0.00 0.00 178.44 179.23 1i0b n GLY 273 N 1.21 -1.23 0.34 0.83 0.00 -0.08 -3.65 105.19 102.61 1i0b n GLY 273 Ca -0.01 -1.58 0.07 0.00 0.00 0.00 0.00 46.02 44.49 1i0b n GLY 273 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1i0b n ILE 274 N -1.16 1.63 -3.44 -0.61 -5.35 -1.26 0.26 119.36 109.42 1i0b n ILE 274 Ca 0.00 -1.66 -0.34 0.00 -0.27 0.00 0.00 62.75 60.48 1i0b n ILE 274 Cb 0.00 0.06 -0.05 0.00 -1.74 0.00 0.00 39.64 37.90 1i0b n ILE 274 CO 0.00 0.00 0.00 -0.13 -1.76 0.00 0.00 176.55 174.66 1i0b s ARG 275 N -2.11 3.85 0.73 6.28 0.52 -1.26 -4.76 118.95 122.20 1i0b s ARG 275 Ca 0.25 0.32 -0.11 0.00 -0.52 0.00 0.00 55.73 55.67 1i0b s ARG 275 Cb 0.20 -2.85 0.03 0.00 0.52 0.00 0.00 34.95 32.85 1i0b s ARG 275 CO 0.06 0.44 1.08 -1.54 0.02 0.00 0.00 175.30 175.36 1i0b s SER 276 N -1.98 5.13 0.34 0.23 1.04 -1.26 -4.61 113.70 112.59 1i0b s SER 276 Ca 0.40 1.39 0.07 0.00 0.48 0.00 0.00 55.95 58.29 1i0b s SER 276 Cb -0.13 -2.22 0.63 0.00 0.10 0.00 0.00 66.02 64.40 1i0b s SER 276 CO 0.20 -1.57 1.84 4.11 0.98 0.00 0.00 173.24 178.79 1i0b h TRP 277 N -0.81 0.36 -0.70 5.02 5.08 -1.87 -2.38 115.95 120.65 1i0b h TRP 277 Ca -0.45 -0.05 -0.07 0.00 1.08 0.00 0.00 58.89 59.40 1i0b h TRP 277 Cb 1.24 -0.10 -0.03 0.00 -3.00 0.00 0.00 29.16 27.27 1i0b h TRP 277 CO 0.54 0.50 0.18 1.96 -1.28 0.00 0.00 178.44 180.34 1i0b h GLN 278 N 0.31 1.11 -0.37 0.12 7.50 -1.93 0.11 115.11 121.97 1i0b h GLN 278 Ca 0.06 -0.26 -0.01 0.00 0.50 0.00 0.00 58.65 58.93 1i0b h GLN 278 Cb 0.49 -0.15 -0.02 0.00 0.05 0.00 0.00 27.48 27.85 1i0b h GLN 278 CO 0.03 0.98 0.18 1.15 -1.50 0.00 0.00 178.83 179.67 1i0b h THR 279 N 1.05 1.17 -0.26 -0.54 2.02 -1.84 0.80 112.91 115.30 1i0b h THR 279 Ca 0.22 -0.47 -0.02 0.00 0.77 0.00 0.00 66.41 66.91 1i0b h THR 279 Cb 0.36 0.80 -0.01 0.00 -1.74 0.00 0.00 68.15 67.55 1i0b h THR 279 CO 0.00 0.18 0.07 0.03 0.37 0.00 0.00 175.52 176.16 1i0b h ARG 280 N 0.46 0.42 -0.57 6.66 3.08 -1.08 -2.54 114.38 120.81 1i0b h ARG 280 Ca 0.13 -0.10 0.06 0.00 0.07 0.00 0.00 59.98 60.14 1i0b h ARG 280 Cb 0.12 -0.06 -0.03 0.00 0.08 0.00 0.00 29.97 30.08 1i0b h ARG 280 CO -0.02 0.51 0.38 0.00 -1.07 0.00 0.00 179.97 179.77 1i0b h ALA 281 N 0.89 1.86 0.00 0.04 0.00 -0.56 -1.49 119.26 120.00 1i0b h ALA 281 Ca 0.08 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.97 1i0b h ALA 281 Cb 0.27 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.94 1i0b h ALA 281 CO 0.00 0.04 0.00 -0.07 0.00 0.00 0.00 179.25 179.22 1i0b h LEU 282 N 0.52 0.00 -1.16 0.00 3.38 -0.39 -0.90 115.31 116.76 1i0b h LEU 282 Ca 0.25 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 58.14 1i0b h LEU 282 Cb 0.31 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.05 1i0b h LEU 282 CO -0.07 0.00 -0.37 -0.07 0.09 0.00 0.00 178.44 178.02 1i0b h LEU 283 N 0.00 0.00 -0.29 1.67 3.38 -1.28 0.17 115.31 118.96 1i0b h LEU 283 Ca 0.00 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.93 1i0b h LEU 283 Cb 0.15 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.89 1i0b h LEU 283 CO 0.00 0.37 0.03 0.40 0.09 0.00 0.00 178.44 179.33 1i0b h ILE 284 N 0.00 1.24 -0.47 1.22 2.04 -1.26 -1.13 117.51 119.15 1i0b h ILE 284 Ca -0.00 -0.85 -0.02 0.00 1.00 0.00 0.00 64.86 64.99 1i0b h ILE 284 Cb 0.76 1.24 -0.02 0.00 -0.74 0.00 0.00 36.82 38.06 1i0b h ILE 284 CO 0.05 0.27 0.20 0.50 0.00 0.00 0.00 178.15 179.18 1i0b h LYS 285 N 0.29 0.68 -0.47 2.37 3.64 -1.43 -1.23 116.57 120.43 1i0b h LYS 285 Ca 0.08 -0.11 0.08 0.00 -1.27 0.00 0.00 60.65 59.43 1i0b h LYS 285 Cb 0.37 -0.12 -0.07 0.00 -0.41 0.00 0.00 32.23 32.01 1i0b h LYS 285 CO 0.01 0.60 0.08 0.00 -2.27 0.00 0.00 179.45 177.87 1i0b h ALA 286 N 1.05 0.51 -0.31 5.00 0.00 -0.42 0.30 119.26 125.39 1i0b h ALA 286 Ca 0.16 0.10 -0.10 0.00 0.00 0.00 0.00 54.91 55.07 1i0b h ALA 286 Cb 0.16 0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 1i0b h ALA 286 CO -0.02 -0.32 -0.22 -0.07 0.00 0.00 0.00 179.25 178.63 1i0b h LEU 287 N 0.22 0.59 -0.16 0.00 3.38 -0.99 -1.61 115.31 116.73 1i0b h LEU 287 Ca 0.23 -0.19 -0.01 0.00 0.09 0.00 0.00 57.88 58.00 1i0b h LEU 287 Cb 0.31 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.89 1i0b h LEU 287 CO -0.31 0.80 0.07 0.40 0.09 0.00 0.00 178.44 179.49 1i0b h ILE 288 N 0.52 1.15 0.00 1.22 2.04 0.01 -0.92 117.51 121.53 1i0b h ILE 288 Ca 0.08 -0.44 -0.01 0.00 1.00 0.00 0.00 64.86 65.49 1i0b h ILE 288 Cb 0.66 1.14 -0.00 0.00 -0.74 0.00 0.00 36.82 37.88 1i0b h ILE 288 CO 0.05 0.14 -0.05 0.44 0.00 0.00 0.00 178.15 178.73 1i0b h ASP 289 N 0.12 0.00 -0.00 1.72 3.45 -0.10 -1.75 116.42 119.86 1i0b h ASP 289 Ca 0.05 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.51 1i0b h ASP 289 Cb 0.16 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 38.93 1i0b h ASP 289 CO -0.01 0.05 -0.00 0.00 -1.57 0.00 0.00 179.24 177.71 1i0b n GLN 290 N -3.66 1.42 -0.41 3.56 1.13 -0.64 -4.92 117.38 113.86 1i0b n GLN 290 Ca -0.02 -0.62 0.00 0.00 -1.94 0.00 0.00 57.00 54.41 1i0b n GLN 290 Cb 0.14 -1.49 0.00 0.00 0.11 0.00 0.00 30.24 29.01 1i0b n GLN 290 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1i0b n GLY 291 N 1.12 0.78 1.63 1.08 0.00 -0.66 -5.00 105.19 104.14 1i0b n GLY 291 Ca 0.21 -0.11 -0.10 0.00 0.00 0.00 0.00 46.02 46.01 1i0b n GLY 291 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1i0b n TYR 292 N -2.41 1.96 -0.22 1.61 4.01 -0.39 -4.63 117.16 117.09 1i0b n TYR 292 Ca 0.00 -1.58 0.26 0.00 -0.16 0.00 0.00 57.90 56.42 1i0b n TYR 292 Cb 0.00 -0.66 0.65 0.00 -0.31 0.00 0.00 39.34 39.01 1i0b n TYR 292 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1i0b h MET 293 N 1.30 0.14 0.00 -0.72 -0.00 -1.78 0.32 114.93 114.19 1i0b h MET 293 Ca 0.35 -0.01 0.00 0.00 -0.00 0.00 0.00 59.70 60.05 1i0b h MET 293 Cb 2.16 -0.03 0.00 0.00 -0.00 0.00 0.00 31.60 33.73 1i0b h MET 293 CO 0.67 0.09 0.00 1.63 -0.00 0.00 0.00 176.91 179.31 1i0b n LYS 294 N -4.36 0.73 -0.15 -0.10 5.02 -1.26 -3.32 118.16 114.71 1i0b n LYS 294 Ca 0.20 0.01 0.06 0.00 -2.02 0.00 0.00 58.31 56.56 1i0b n LYS 294 Cb 0.90 -1.50 0.13 0.00 -0.02 0.00 0.00 35.03 34.54 1i0b n LYS 294 CO 0.00 0.00 0.00 1.04 -0.52 0.00 0.00 177.40 177.92 1i0b n GLN 295 N -1.08 2.31 -3.96 1.97 6.02 0.11 -4.90 117.38 117.85 1i0b n GLN 295 Ca 0.18 -2.29 -0.36 0.00 -0.01 0.00 0.00 57.00 54.53 1i0b n GLN 295 Cb 0.13 -1.42 -0.08 0.00 1.02 0.00 0.00 30.24 29.89 1i0b n GLN 295 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 1i0b s ILE 296 N -2.12 5.15 -0.08 5.09 1.01 -1.21 0.30 121.20 129.35 1i0b s ILE 296 Ca 0.25 0.08 0.02 0.00 0.00 0.00 0.00 60.65 61.00 1i0b s ILE 296 Cb 0.20 -3.26 0.01 0.00 0.01 0.00 0.00 42.46 39.42 1i0b s ILE 296 CO 0.05 0.56 -0.14 -0.76 0.00 0.00 0.00 174.94 174.65 1i0b s LEU 297 N -0.52 1.69 0.04 2.97 1.43 -0.25 -4.85 118.68 119.19 1i0b s LEU 297 Ca 0.11 -0.35 0.08 0.00 -1.03 0.00 0.00 54.13 52.94 1i0b s LEU 297 Cb -0.12 -0.93 -0.03 0.00 0.03 0.00 0.00 46.19 45.14 1i0b s LEU 297 CO 0.02 0.04 -0.21 -0.69 0.23 0.00 0.00 176.35 175.74 1i0b s VAL 298 N 0.71 2.57 0.14 -1.59 1.01 -1.26 -0.38 120.40 121.59 1i0b s VAL 298 Ca -0.13 -1.23 -0.05 0.00 0.00 0.00 0.00 61.98 60.56 1i0b s VAL 298 Cb -0.16 -2.05 0.02 0.00 0.00 0.00 0.00 36.38 34.19 1i0b s VAL 298 CO 0.03 0.36 0.28 -0.24 0.00 0.00 0.00 175.10 175.53 1i0b n SER 299 N 1.68 -0.80 -0.00 3.32 2.88 -0.96 -3.92 113.62 115.82 1i0b n SER 299 Ca -0.16 -1.55 0.01 0.00 -1.33 0.00 0.00 58.87 55.84 1i0b n SER 299 Cb 0.52 1.33 -0.02 0.00 -0.75 0.00 0.00 64.21 65.29 1i0b n SER 299 CO 0.00 0.00 0.00 0.59 -1.23 0.00 0.00 175.04 174.40 1i0b n ASN 300 N -1.18 1.82 -3.78 -3.46 3.02 -1.20 -3.88 115.26 106.60 1i0b n ASN 300 Ca -0.03 -0.34 -0.24 0.00 -0.03 0.00 0.00 54.58 53.94 1i0b n ASN 300 Cb 0.21 1.06 0.03 0.00 -0.61 0.00 0.00 39.78 40.46 1i0b n ASN 300 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 1i0b n ASP 301 N -1.29 -2.12 -4.96 6.41 4.64 -0.62 -4.63 116.55 113.98 1i0b n ASP 301 Ca 0.00 -0.82 -0.23 0.00 -1.38 0.00 0.00 54.79 52.36 1i0b n ASP 301 Cb 0.06 -3.94 0.04 0.00 -1.04 0.00 0.00 41.12 36.24 1i0b n ASP 301 CO 0.00 0.00 0.00 0.86 -0.82 0.00 0.00 177.20 177.24 1i0b s TRP 302 N -3.59 2.94 0.21 -0.67 -0.11 -1.26 -4.88 118.94 111.58 1i0b s TRP 302 Ca 0.19 0.16 -0.22 0.00 1.22 0.00 0.00 56.10 57.45 1i0b s TRP 302 Cb -0.09 -2.80 0.05 0.00 -1.50 0.00 0.00 33.47 29.13 1i0b s TRP 302 CO 0.82 -0.93 0.65 -0.48 -4.62 0.00 0.00 176.95 172.40 1i0b s LEU 303 N -4.86 -0.43 -0.03 5.86 0.05 -1.25 -1.15 118.68 116.87 1i0b s LEU 303 Ca 0.57 -0.27 0.15 0.00 0.05 0.00 0.00 54.13 54.62 1i0b s LEU 303 Cb -0.10 2.65 -0.23 0.00 -2.05 0.00 0.00 46.19 46.46 1i0b s LEU 303 CO 0.40 -1.14 0.31 0.49 -0.55 0.00 0.00 176.35 175.86 1i0b n PHE 304 N -0.42 0.00 -3.90 3.48 3.72 0.15 -4.99 117.46 115.51 1i0b n PHE 304 Ca -0.11 0.00 -0.11 0.00 -0.05 0.00 0.00 57.45 57.18 1i0b n PHE 304 Cb 0.62 -0.36 -0.11 0.00 -0.94 0.00 0.00 39.48 38.70 1i0b n PHE 304 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 176.76 176.91 1i0b s GLY 305 N -3.77 0.09 -0.31 1.37 0.00 -1.21 -4.94 107.32 98.55 1i0b s GLY 305 Ca -0.06 -0.22 0.02 0.00 0.00 0.00 0.00 44.72 44.46 1i0b s GLY 305 CO 0.62 -0.31 0.37 -0.12 0.00 0.00 0.00 173.10 173.66 1i0b s PHE 306 N -1.13 -0.70 -0.09 1.90 5.36 -1.26 -0.83 117.98 121.23 1i0b s PHE 306 Ca -0.12 -0.10 0.21 0.00 -0.96 0.00 0.00 56.93 55.96 1i0b s PHE 306 Cb -0.07 -0.30 -0.27 0.00 -0.34 0.00 0.00 43.02 42.05 1i0b s PHE 306 CO 0.00 -0.97 0.51 -1.13 -1.46 0.00 0.00 175.22 172.17 1i0b n SER 307 N 5.06 0.17 -0.74 6.13 3.41 0.20 -4.45 113.62 123.39 1i0b n SER 307 Ca 0.03 0.07 0.00 0.00 -0.26 0.00 0.00 58.87 58.70 1i0b n SER 307 Cb 0.48 1.51 0.00 0.00 -0.26 0.00 0.00 64.21 65.94 1i0b n SER 307 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1i0b n SER 308 N -2.44 1.24 -1.02 4.04 3.41 -1.13 -4.78 113.62 112.94 1i0b n SER 308 Ca -0.09 -1.26 -0.00 0.00 -0.26 0.00 0.00 58.87 57.26 1i0b n SER 308 Cb 0.68 -0.32 -0.00 0.00 -0.26 0.00 0.00 64.21 64.32 1i0b n SER 308 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1i0b n TYR 309 N 0.43 -0.68 -1.66 7.33 9.36 -1.26 -5.07 117.16 125.60 1i0b n TYR 309 Ca 0.00 -0.03 -0.38 0.00 3.32 0.00 0.00 57.90 60.81 1i0b n TYR 309 Cb 0.23 0.01 0.05 0.00 -0.63 0.00 0.00 39.34 39.00 1i0b n TYR 309 CO 0.00 0.00 0.00 1.33 0.22 0.00 0.00 176.86 178.41 1i0b n VAL 310 N -0.01 3.69 -1.89 2.97 0.24 -1.26 -4.91 118.33 117.17 1i0b n VAL 310 Ca -0.00 -0.50 -0.41 0.00 -2.04 0.00 0.00 64.34 61.39 1i0b n VAL 310 Cb 0.01 -1.33 -0.01 0.00 -1.47 0.00 0.00 33.84 31.04 1i0b n VAL 310 CO 0.00 0.00 0.00 -0.89 -2.14 0.00 0.00 176.83 173.80 1i0b s THR 311 N -1.40 2.23 0.00 3.34 2.01 -1.26 -2.22 115.64 118.33 1i0b s THR 311 Ca 0.74 0.23 0.00 0.00 0.31 0.00 0.00 61.69 62.97 1i0b s THR 311 Cb -0.43 -3.15 0.00 0.00 0.01 0.00 0.00 72.50 68.93 1i0b s THR 311 CO 0.48 0.06 0.00 0.59 -0.69 0.00 0.00 174.62 175.06 1i0b n ASN 312 N 0.54 -0.60 0.26 3.53 5.03 -1.26 -4.91 115.26 117.87 1i0b n ASN 312 Ca 0.01 0.00 0.14 0.00 0.87 0.00 0.00 54.58 55.60 1i0b n ASN 312 Cb 0.40 -0.10 0.70 0.00 -1.02 0.00 0.00 39.78 39.76 1i0b n ASN 312 CO 0.00 0.00 0.00 -0.29 -1.83 0.00 0.00 177.26 175.14 1i0b h ILE 313 N 0.00 0.36 -0.25 2.41 6.09 -1.77 -2.78 117.51 121.58 1i0b h ILE 313 Ca 0.00 -0.63 -0.03 0.00 -1.37 0.00 0.00 64.86 62.83 1i0b h ILE 313 Cb 0.00 1.46 -0.01 0.00 0.47 0.00 0.00 36.82 38.74 1i0b h ILE 313 CO 0.00 0.10 0.04 -0.03 -3.07 0.00 0.00 178.15 175.19 1i0b h MET 314 N 0.00 0.41 -0.76 2.19 4.05 -1.85 -1.62 114.93 117.34 1i0b h MET 314 Ca -0.00 -0.11 0.04 0.00 -0.28 0.00 0.00 59.70 59.35 1i0b h MET 314 Cb 0.46 -0.05 -0.05 0.00 -0.80 0.00 0.00 31.60 31.16 1i0b h MET 314 CO 0.01 0.54 0.47 -0.44 0.23 0.00 0.00 176.91 177.73 1i0b h ASP 315 N 0.21 0.75 -0.41 1.39 3.45 -1.92 0.10 116.42 120.00 1i0b h ASP 315 Ca 0.07 0.01 -0.01 0.00 0.43 0.00 0.00 57.03 57.53 1i0b h ASP 315 Cb 0.34 -0.15 -0.02 0.00 -0.56 0.00 0.00 39.33 38.94 1i0b h ASP 315 CO 0.01 0.50 0.22 0.58 -1.57 0.00 0.00 179.24 178.98 1i0b h VAL 316 N 0.89 1.16 -0.30 -1.35 2.07 -1.32 -2.00 116.25 115.40 1i0b h VAL 316 Ca 0.32 -0.42 -0.01 0.00 0.82 0.00 0.00 66.70 67.42 1i0b h VAL 316 Cb 0.09 0.69 -0.01 0.00 -1.52 0.00 0.00 31.29 30.54 1i0b h VAL 316 CO -0.14 0.17 0.16 0.24 0.02 0.00 0.00 177.57 178.02 1i0b h MET 317 N 0.52 0.41 -0.32 1.57 2.86 -0.53 -0.81 114.93 118.63 1i0b h MET 317 Ca 0.14 -0.05 0.07 0.00 -2.06 0.00 0.00 59.70 57.80 1i0b h MET 317 Cb 0.07 -0.08 -0.02 0.00 0.06 0.00 0.00 31.60 31.63 1i0b h MET 317 CO -0.02 0.35 0.22 -0.44 1.06 0.00 0.00 176.91 178.09 1i0b h ASP 318 N 0.36 0.11 -0.09 1.22 3.45 -0.64 0.13 116.42 120.97 1i0b h ASP 318 Ca 0.10 0.00 -0.12 0.00 0.43 0.00 0.00 57.03 57.44 1i0b h ASP 318 Cb 0.06 -0.02 0.01 0.00 -0.56 0.00 0.00 39.33 38.81 1i0b h ASP 318 CO -0.02 0.07 -0.42 0.03 -1.57 0.00 0.00 179.24 177.34 1i0b h ARG 319 N 0.13 0.43 -0.72 3.56 3.08 -0.69 -2.64 114.38 117.53 1i0b h ARG 319 Ca 0.15 -0.35 -0.05 0.00 0.07 0.00 0.00 59.98 59.80 1i0b h ARG 319 Cb 0.42 0.07 -0.03 0.00 0.08 0.00 0.00 29.97 30.51 1i0b h ARG 319 CO -0.02 0.99 0.27 0.28 -1.07 0.00 0.00 179.97 180.41 1i0b h VAL 320 N -0.01 1.25 -2.49 2.04 2.07 -0.18 -3.37 116.25 115.55 1i0b h VAL 320 Ca -0.03 -0.82 -0.60 0.00 0.82 0.00 0.00 66.70 66.08 1i0b h VAL 320 Cb 1.06 0.44 -0.39 0.00 -1.52 0.00 0.00 31.29 30.89 1i0b h VAL 320 CO 0.09 0.32 -0.90 -3.20 0.02 0.00 0.00 177.57 173.90 1i0b n ASN 321 N -4.33 0.30 0.21 0.57 5.15 0.38 -4.98 115.26 112.54 1i0b n ASN 321 Ca 0.06 -2.57 0.15 0.00 -0.60 0.00 0.00 54.58 51.62 1i0b n ASN 321 Cb 0.19 -0.60 0.79 0.00 -0.53 0.00 0.00 39.78 39.63 1i0b n ASN 321 CO 0.00 0.00 0.00 -0.65 1.40 0.00 0.00 177.26 178.01 1i0b h PRO 322 N 5.50 0.00 0.00 1.20 0.11 -1.65 -0.47 132.00 136.69 1i0b h PRO 322 Ca 0.24 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 66.34 1i0b h PRO 322 Cb 0.87 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.98 1i0b h PRO 322 CO 0.45 0.00 -0.01 -0.44 -0.21 0.00 0.00 178.00 177.79 1i0b h ASP 323 N 0.00 0.00 0.00 -2.05 3.45 -1.94 -3.48 116.42 112.40 1i0b h ASP 323 Ca 0.08 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.54 1i0b h ASP 323 Cb 0.37 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.14 1i0b h ASP 323 CO -0.00 0.01 0.00 0.61 -1.57 0.00 0.00 179.24 178.29 1i0b n GLY 324 N 0.29 3.10 0.27 2.75 0.00 -0.19 -1.32 105.19 110.09 1i0b n GLY 324 Ca 0.01 -0.23 0.18 0.00 0.00 0.00 0.00 46.02 45.99 1i0b n GLY 324 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 1i0b h MET 325 N 0.00 0.00 -0.00 1.61 2.86 -1.90 -1.82 114.93 115.68 1i0b h MET 325 Ca 0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 1i0b h MET 325 Cb 0.00 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.66 1i0b h MET 325 CO 0.00 0.00 -0.00 0.00 1.06 0.00 0.00 176.91 177.97 1i0b n ALA 326 N -2.01 2.66 -0.34 6.32 0.00 -0.44 -3.92 120.51 122.78 1i0b n ALA 326 Ca -0.01 -0.20 -0.00 0.00 0.00 0.00 0.00 53.44 53.23 1i0b n ALA 326 Cb 0.15 -1.51 0.13 0.00 0.00 0.00 0.00 19.45 18.23 1i0b n ALA 326 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.50 177.85 1i0b h PHE 327 N 0.06 1.12 0.75 0.00 3.57 -1.41 0.52 116.94 121.55 1i0b h PHE 327 Ca 0.00 0.03 -0.04 0.00 3.53 0.00 0.00 57.97 61.49 1i0b h PHE 327 Cb 0.05 -0.37 0.01 0.00 2.79 0.00 0.00 35.95 38.42 1i0b h PHE 327 CO 0.00 0.63 -0.38 0.82 -2.23 0.00 0.00 178.31 177.16 1i0b h ILE 328 N 1.15 0.23 -0.01 1.41 1.08 -1.82 -0.76 117.51 118.80 1i0b h ILE 328 Ca 0.37 0.00 -0.11 0.00 -0.39 0.00 0.00 64.86 64.74 1i0b h ILE 328 Cb 0.03 0.23 -0.01 0.00 -3.07 0.00 0.00 36.82 34.00 1i0b h ILE 328 CO -0.13 0.00 -0.50 1.55 -0.69 0.00 0.00 178.15 178.38 1i0b h PRO 329 N -1.03 0.02 0.09 2.37 0.13 -1.81 -1.14 132.00 130.63 1i0b h PRO 329 Ca -0.10 -0.01 -0.27 0.00 -0.87 0.00 0.00 66.00 64.75 1i0b h PRO 329 Cb 0.80 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.92 1i0b h PRO 329 CO 0.16 0.51 -1.28 -0.07 -0.23 0.00 0.00 178.00 177.09 1i0b h LEU 330 N 0.01 0.29 0.00 1.56 3.38 -0.88 -3.40 115.31 116.27 1i0b h LEU 330 Ca -0.00 -0.34 -0.00 0.00 0.09 0.00 0.00 57.88 57.62 1i0b h LEU 330 Cb 0.89 -0.10 -0.00 0.00 0.09 0.00 0.00 40.66 41.55 1i0b h LEU 330 CO 0.07 1.27 -1.01 0.54 0.09 0.00 0.00 178.44 179.40 1i0b n ARG 331 N -3.44 0.00 -0.07 1.13 5.12 -0.32 -4.69 116.66 114.39 1i0b n ARG 331 Ca -0.09 0.00 -0.13 0.00 -1.93 0.00 0.00 57.85 55.70 1i0b n ARG 331 Cb 1.01 -0.84 -0.06 0.00 -1.16 0.00 0.00 32.46 31.41 1i0b n ARG 331 CO 0.00 0.00 0.00 0.28 -1.93 0.00 0.00 177.63 175.98 1i0b h VAL 332 N -0.00 1.33 -0.24 1.55 2.07 -1.05 -1.63 116.25 118.27 1i0b h VAL 332 Ca -0.00 -1.33 0.03 0.00 0.82 0.00 0.00 66.70 66.22 1i0b h VAL 332 Cb 1.00 1.76 -0.03 0.00 -1.52 0.00 0.00 31.29 32.50 1i0b h VAL 332 CO -0.00 0.40 0.07 0.40 0.02 0.00 0.00 177.57 178.46 1i0b h ILE 333 N 0.13 0.91 -0.61 4.57 1.08 -1.44 0.80 117.51 122.95 1i0b h ILE 333 Ca 0.03 -0.06 -0.08 0.00 -0.39 0.00 0.00 64.86 64.37 1i0b h ILE 333 Cb 0.71 0.73 -0.02 0.00 -3.07 0.00 0.00 36.82 35.17 1i0b h ILE 333 CO 0.04 0.03 0.07 -0.65 -0.69 0.00 0.00 178.15 176.96 1i0b h PRO 334 N 0.17 1.02 -0.70 2.37 0.11 -1.79 -1.35 132.00 131.83 1i0b h PRO 334 Ca 0.11 -0.28 -0.02 0.00 0.11 0.00 0.00 66.00 65.92 1i0b h PRO 334 Cb 0.09 -0.12 -0.03 0.00 0.11 0.00 0.00 31.00 31.05 1i0b h PRO 334 CO -0.13 0.96 0.35 0.35 -0.21 0.00 0.00 178.00 179.32 1i0b h PHE 335 N 0.95 1.00 -0.55 0.65 3.04 -0.81 -1.70 116.94 119.53 1i0b h PHE 335 Ca 0.19 -0.04 -0.09 0.00 3.98 0.00 0.00 57.97 62.00 1i0b h PHE 335 Cb 0.45 -0.31 -0.02 0.00 2.56 0.00 0.00 35.95 38.63 1i0b h PHE 335 CO 0.03 0.73 -0.02 -0.07 -2.02 0.00 0.00 178.31 176.96 1i0b h LEU 336 N 0.97 0.96 -1.24 0.59 3.38 -0.40 -2.07 115.31 117.51 1i0b h LEU 336 Ca 0.24 -0.32 0.01 0.00 0.09 0.00 0.00 57.88 57.90 1i0b h LEU 336 Cb 0.10 -0.26 -0.04 0.00 0.09 0.00 0.00 40.66 40.55 1i0b h LEU 336 CO -0.03 1.05 0.49 -0.09 0.09 0.00 0.00 178.44 179.95 1i0b h ARG 337 N 0.86 1.00 -0.20 1.13 2.43 -1.09 -0.35 114.38 118.16 1i0b h ARG 337 Ca 0.15 -0.07 -0.08 0.00 -0.81 0.00 0.00 59.98 59.18 1i0b h ARG 337 Cb 0.56 -0.22 -0.01 0.00 -0.42 0.00 0.00 29.97 29.88 1i0b h ARG 337 CO 0.03 0.67 -0.22 0.93 -1.51 0.00 0.00 179.97 179.88 1i0b h GLU 338 N 1.03 0.35 -0.10 0.20 5.08 -1.05 -1.59 114.58 118.51 1i0b h GLU 338 Ca 0.28 -0.11 0.00 0.00 -1.00 0.00 0.00 59.36 58.52 1i0b h GLU 338 Cb -0.10 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.12 1i0b h GLU 338 CO -0.06 0.55 0.00 1.63 -1.00 0.00 0.00 179.01 180.13 1i0b n LYS 339 N -4.17 1.29 0.00 2.33 4.76 -0.59 -4.88 118.16 116.90 1i0b n LYS 339 Ca -0.00 -0.44 0.00 0.00 -2.87 0.00 0.00 58.31 55.00 1i0b n LYS 339 Cb 0.36 -1.20 0.00 0.00 -1.84 0.00 0.00 35.03 32.34 1i0b n LYS 339 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1i0b n GLY 340 N 0.80 0.32 3.69 0.72 0.00 -0.60 -5.05 105.19 105.07 1i0b n GLY 340 Ca 0.09 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.69 1i0b n GLY 340 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1i0b s VAL 341 N -2.00 4.10 0.58 1.61 1.01 -0.24 -4.96 120.40 120.49 1i0b s VAL 341 Ca 0.00 1.45 -0.19 0.00 0.00 0.00 0.00 61.98 63.24 1i0b s VAL 341 Cb 0.00 -3.93 -0.04 0.00 0.00 0.00 0.00 36.38 32.41 1i0b s VAL 341 CO 0.00 0.01 1.19 -2.84 0.00 0.00 0.00 175.10 173.46 1i0b s PRO 342 N 2.15 3.07 0.21 2.72 0.02 -1.26 -4.15 135.00 137.75 1i0b s PRO 342 Ca 0.58 1.77 -0.09 0.00 0.02 0.00 0.00 61.00 63.28 1i0b s PRO 342 Cb -0.27 -1.95 0.30 0.00 0.02 0.00 0.00 34.50 32.60 1i0b s PRO 342 CO 0.24 -1.12 1.72 0.37 -0.33 0.00 0.00 177.00 177.88 1i0b h GLN 343 N 0.96 0.31 -0.29 5.54 4.15 -1.96 -0.87 115.11 122.95 1i0b h GLN 343 Ca -0.50 -0.02 0.02 0.00 0.77 0.00 0.00 58.65 58.92 1i0b h GLN 343 Cb 1.29 -0.07 -0.01 0.00 0.21 0.00 0.00 27.48 28.89 1i0b h GLN 343 CO 0.56 0.20 0.19 0.93 -1.93 0.00 0.00 178.83 178.78 1i0b h GLU 344 N 0.32 0.29 -0.15 1.69 5.08 -1.98 0.29 114.58 120.12 1i0b h GLU 344 Ca 0.32 -0.02 -0.21 0.00 -1.00 0.00 0.00 59.36 58.45 1i0b h GLU 344 Cb 0.45 -0.06 0.01 0.00 0.50 0.00 0.00 28.75 29.64 1i0b h GLU 344 CO -0.37 0.19 -0.72 1.15 -1.00 0.00 0.00 179.01 178.26 1i0b h THR 345 N 0.30 1.29 -0.77 1.13 2.02 -1.56 -0.21 112.91 115.11 1i0b h THR 345 Ca 0.12 -1.93 -0.04 0.00 0.77 0.00 0.00 66.41 65.32 1i0b h THR 345 Cb 0.10 2.01 -0.03 0.00 -1.74 0.00 0.00 68.15 68.49 1i0b h THR 345 CO -0.02 0.61 0.32 -0.07 0.37 0.00 0.00 175.52 176.72 1i0b h LEU 346 N 0.46 1.05 -0.35 2.58 3.38 -0.37 -1.23 115.31 120.83 1i0b h LEU 346 Ca -0.05 -0.17 -0.09 0.00 0.09 0.00 0.00 57.88 57.66 1i0b h LEU 346 Cb 1.35 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 41.82 1i0b h LEU 346 CO 0.15 0.93 -0.14 0.00 0.09 0.00 0.00 178.44 179.47 1i0b h ALA 347 N 1.16 0.48 -0.79 1.53 0.00 -0.40 -2.00 119.26 119.25 1i0b h ALA 347 Ca 0.26 -0.33 0.01 0.00 0.00 0.00 0.00 54.91 54.84 1i0b h ALA 347 Cb 0.20 -0.12 -0.04 0.00 0.00 0.00 0.00 17.79 17.83 1i0b h ALA 347 CO -0.02 0.38 0.52 0.78 0.00 0.00 0.00 179.25 180.91 1i0b h GLY 348 N 0.49 1.12 1.11 0.00 0.00 -0.66 0.12 103.07 105.25 1i0b h GLY 348 Ca 0.08 -0.41 -0.13 0.00 0.00 0.00 0.00 47.33 46.87 1i0b h GLY 348 CO 0.05 0.39 -0.20 -2.22 0.00 0.00 0.00 176.54 174.56 1i0b h ILE 349 N 1.06 1.27 0.00 2.60 2.04 -1.15 0.16 117.51 123.49 1i0b h ILE 349 Ca 0.29 -1.37 -0.02 0.00 1.00 0.00 0.00 64.86 64.77 1i0b h ILE 349 Cb -0.10 1.10 -0.00 0.00 -0.74 0.00 0.00 36.82 37.07 1i0b h ILE 349 CO -0.07 0.48 -0.62 0.71 0.00 0.00 0.00 178.15 178.64 1i0b h THR 350 N 0.88 0.08 0.00 -0.27 1.35 -1.13 -3.39 112.91 110.42 1i0b h THR 350 Ca 0.12 -1.13 -0.00 0.00 -0.55 0.00 0.00 66.41 64.85 1i0b h THR 350 Cb 0.79 1.77 -0.00 0.00 -1.73 0.00 0.00 68.15 68.98 1i0b h THR 350 CO 0.07 0.04 -0.09 0.52 -0.25 0.00 0.00 175.52 175.81 1i0b n VAL 351 N -2.88 1.23 -0.11 6.82 0.31 0.41 -1.74 118.33 122.37 1i0b n VAL 351 Ca 0.01 0.38 -0.09 0.00 -0.01 0.00 0.00 64.34 64.63 1i0b n VAL 351 Cb 0.57 -1.64 -0.01 0.00 -0.91 0.00 0.00 33.84 31.85 1i0b n VAL 351 CO 0.00 0.00 0.00 0.74 -1.32 0.00 0.00 176.83 176.25 1i0b h THR 352 N -0.06 1.15 0.37 2.52 2.02 -1.28 -2.56 112.91 115.07 1i0b h THR 352 Ca -0.00 -0.43 -0.01 0.00 0.77 0.00 0.00 66.41 66.74 1i0b h THR 352 Cb 0.08 0.80 -0.01 0.00 -1.74 0.00 0.00 68.15 67.29 1i0b h THR 352 CO -0.00 0.16 -0.24 0.78 0.37 0.00 0.00 175.52 176.59 1i0b h ASN 353 N 0.43 -0.61 -0.86 4.18 2.35 -0.90 -1.83 115.58 118.34 1i0b h ASN 353 Ca 0.12 0.04 0.02 0.00 -0.55 0.00 0.00 56.30 55.93 1i0b h ASN 353 Cb 0.10 0.18 -0.04 0.00 0.05 0.00 0.00 38.32 38.61 1i0b h ASN 353 CO -0.02 -0.38 0.57 -0.65 -1.65 0.00 0.00 177.43 175.30 1i0b h PRO 354 N -0.59 1.10 -0.36 0.81 0.11 -1.75 -0.87 132.00 130.45 1i0b h PRO 354 Ca -0.04 -0.07 -0.01 0.00 0.11 0.00 0.00 66.00 66.00 1i0b h PRO 354 Cb 0.49 -0.25 -0.02 0.00 0.11 0.00 0.00 31.00 31.34 1i0b h PRO 354 CO 0.03 0.73 0.19 0.00 -0.21 0.00 0.00 178.00 178.75 1i0b h ALA 355 N 1.48 0.46 -0.51 -0.75 0.00 -1.23 0.76 119.26 119.48 1i0b h ALA 355 Ca 0.32 -0.08 -0.04 0.00 0.00 0.00 0.00 54.91 55.11 1i0b h ALA 355 Cb -0.08 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.55 1i0b h ALA 355 CO -0.08 -0.00 0.14 -0.09 0.00 0.00 0.00 179.25 179.22 1i0b h ARG 356 N 0.46 0.80 -0.19 0.00 2.43 -0.98 -0.42 114.38 116.48 1i0b h ARG 356 Ca 0.13 -0.18 -0.01 0.00 -0.81 0.00 0.00 59.98 59.10 1i0b h ARG 356 Cb 0.07 -0.11 -0.01 0.00 -0.42 0.00 0.00 29.97 29.50 1i0b h ARG 356 CO -0.02 0.76 0.06 0.35 -1.51 0.00 0.00 179.97 179.61 1i0b h PHE 357 N 0.69 0.29 -0.03 2.20 3.57 -1.01 -3.21 116.94 119.45 1i0b h PHE 357 Ca 0.16 -0.03 -0.14 0.00 3.53 0.00 0.00 57.97 61.50 1i0b h PHE 357 Cb 0.30 -0.09 -0.02 0.00 2.79 0.00 0.00 35.95 38.94 1i0b h PHE 357 CO 0.02 0.37 -0.61 -0.07 -2.23 0.00 0.00 178.31 175.79 1i0b h LEU 358 N 0.13 0.12 -9.24 0.59 3.38 -0.77 -3.39 115.31 106.12 1i0b h LEU 358 Ca 0.06 -0.07 -0.56 0.00 0.09 0.00 0.00 57.88 57.40 1i0b h LEU 358 Cb 0.21 -0.03 0.01 0.00 0.09 0.00 0.00 40.66 40.94 1i0b h LEU 358 CO -0.00 0.70 1.28 -0.24 0.09 0.00 0.00 178.44 180.26 1i0b n SER 359 N -3.84 3.83 -4.69 -0.43 2.88 -0.18 -4.79 113.62 106.40 1i0b n SER 359 Ca -0.02 0.74 -0.49 0.00 -1.33 0.00 0.00 58.87 57.77 1i0b n SER 359 Cb 0.61 -1.51 -0.05 0.00 -0.75 0.00 0.00 64.21 62.51 1i0b n SER 359 CO 0.00 0.00 0.00 -2.65 -1.23 0.00 0.00 175.04 171.16 1i0b n PRO 360 N 7.71 2.05 -4.00 -1.46 -0.02 -1.26 -4.74 135.00 133.29 1i0b n PRO 360 Ca 0.23 0.75 -0.22 0.00 -2.02 0.00 0.00 63.50 62.24 1i0b n PRO 360 Cb 0.40 -2.58 -0.17 0.00 -0.02 0.00 0.00 33.50 31.13 1i0b n PRO 360 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 1i0b s THR 361 N 4.01 0.60 0.11 3.45 2.01 0.07 -1.45 115.64 124.43 1i0b s THR 361 Ca 0.93 -0.08 -0.05 0.00 0.31 0.00 0.00 61.69 62.80 1i0b s THR 361 Cb -0.74 -0.66 -0.05 0.00 0.01 0.00 0.00 72.50 71.06 1i0b s THR 361 CO 0.53 0.27 0.36 -0.76 -0.69 0.00 0.00 174.62 174.33 1i0b s LEU 362 N 1.42 4.29 0.34 4.42 1.43 -1.26 -4.32 118.68 125.00 1i0b s LEU 362 Ca -0.03 0.59 -0.29 0.00 -1.03 0.00 0.00 54.13 53.38 1i0b s LEU 362 Cb -0.13 -3.17 -0.11 0.00 0.03 0.00 0.00 46.19 42.81 1i0b s LEU 362 CO -0.03 0.10 1.44 -0.60 0.23 0.00 0.00 176.35 177.49 1i0b s ARG 363 N -2.45 4.20 0.00 1.70 3.52 -1.26 -5.09 118.95 119.57 1i0b s ARG 363 Ca 0.38 2.44 0.28 0.00 -0.13 0.00 0.00 55.73 58.70 1i0b s ARG 363 Cb -0.13 -3.02 1.68 0.00 -1.56 0.00 0.00 34.95 31.92 1i0b s ARG 363 CO 0.23 -0.44 2.02 0.00 -0.81 0.00 0.00 175.30 176.31