#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1i0b s ARG 36 N 0.00 0.26 -0.11 0.11 0.52 -1.26 -3.35 118.95 115.11 1i0b s ARG 36 Ca 0.00 -0.42 0.01 0.00 -0.52 0.00 0.00 55.73 54.80 1i0b s ARG 36 Cb 0.00 -0.01 -0.02 0.00 0.52 0.00 0.00 34.95 35.45 1i0b s ARG 36 CO 0.00 -0.01 -0.15 0.42 0.02 0.00 0.00 175.30 175.58 1i0b s ILE 37 N -0.94 2.92 0.03 1.52 1.01 0.47 -4.48 121.20 121.72 1i0b s ILE 37 Ca -0.09 -0.72 -0.29 0.00 0.00 0.00 0.00 60.65 59.54 1i0b s ILE 37 Cb -0.07 -2.19 -0.04 0.00 0.01 0.00 0.00 42.46 40.17 1i0b s ILE 37 CO -0.00 0.54 0.95 0.20 0.00 0.00 0.00 174.94 176.62 1i0b s ASN 38 N 0.13 7.37 0.32 3.58 0.02 -1.26 0.01 114.94 125.10 1i0b s ASN 38 Ca -0.07 1.65 0.04 0.00 -1.02 0.00 0.00 52.86 53.46 1i0b s ASN 38 Cb -0.15 -2.56 -0.06 0.00 0.02 0.00 0.00 41.25 38.50 1i0b s ASN 38 CO 0.05 -0.19 0.05 0.42 0.02 0.00 0.00 177.10 177.45 1i0b s THR 39 N 0.69 1.22 -1.19 1.60 -4.23 -0.10 -4.33 115.64 109.30 1i0b s THR 39 Ca 0.49 -2.01 0.10 0.00 -1.18 0.00 0.00 61.69 59.09 1i0b s THR 39 Cb -0.21 -2.76 0.12 0.00 1.34 0.00 0.00 72.50 70.99 1i0b s THR 39 CO 0.28 -0.03 1.26 1.33 -0.54 0.00 0.00 174.62 176.91 1i0b n VAL 40 N -0.67 1.09 0.35 2.29 0.24 0.13 -0.95 118.33 120.81 1i0b n VAL 40 Ca -0.03 0.27 0.06 0.00 -2.04 0.00 0.00 64.34 62.61 1i0b n VAL 40 Cb 0.66 -1.11 0.08 0.00 -1.47 0.00 0.00 33.84 32.00 1i0b n VAL 40 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 1i0b n ARG 41 N -1.41 1.25 0.00 7.34 1.74 -1.26 -4.74 116.66 119.59 1i0b n ARG 41 Ca 0.03 -1.46 0.00 0.00 -0.77 0.00 0.00 57.85 55.65 1i0b n ARG 41 Cb 0.10 -1.26 0.00 0.00 -1.02 0.00 0.00 32.46 30.28 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 0.69 0.39 3.79 -0.13 0.00 -0.12 -5.05 105.19 104.76 1i0b n GLY 42 Ca 0.09 -2.30 -0.35 0.00 0.00 0.00 0.00 46.02 43.45 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 4.04 0.17 1.61 0.04 -1.26 -0.92 135.00 138.39 1i0b s PRO 43 Ca 0.00 1.42 0.07 0.00 0.04 0.00 0.00 61.00 62.52 1i0b s PRO 43 Cb 0.00 -2.35 -0.04 0.00 0.04 0.00 0.00 34.50 32.15 1i0b s PRO 43 CO 0.00 -0.23 -0.13 0.96 0.04 0.00 0.00 177.00 177.63 1i0b s ILE 44 N -1.82 1.52 0.48 0.56 -4.36 0.10 -4.90 121.20 112.78 1i0b s ILE 44 Ca 0.62 -2.07 -0.19 0.00 -0.26 0.00 0.00 60.65 58.74 1i0b s ILE 44 Cb -0.19 -1.89 -0.09 0.00 1.25 0.00 0.00 42.46 41.54 1i0b s ILE 44 CO 0.23 -0.59 0.99 0.42 0.24 0.00 0.00 174.94 176.24 1i0b s THR 45 N -2.87 4.19 0.49 8.37 -4.23 -1.26 -0.39 115.64 119.94 1i0b s THR 45 Ca 0.18 1.25 0.27 0.00 -1.18 0.00 0.00 61.69 62.22 1i0b s THR 45 Cb -0.01 -3.56 0.46 0.00 1.34 0.00 0.00 72.50 70.73 1i0b s THR 45 CO 0.04 -0.40 1.84 0.40 -0.54 0.00 0.00 174.62 175.96 1i0b h ILE 46 N 1.41 0.53 0.00 2.99 1.08 -1.92 0.11 117.51 121.72 1i0b h ILE 46 Ca -0.48 -0.05 -0.06 0.00 -0.39 0.00 0.00 64.86 63.88 1i0b h ILE 46 Cb 1.20 0.36 -0.01 0.00 -3.07 0.00 0.00 36.82 35.30 1i0b h ILE 46 CO 0.60 0.03 -0.27 0.77 -0.69 0.00 0.00 178.15 178.59 1i0b h SER 47 N 0.16 0.00 1.54 1.72 4.64 -1.91 -3.08 113.55 116.61 1i0b h SER 47 Ca 0.50 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.82 1i0b h SER 47 Cb 1.70 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.79 1i0b h SER 47 CO -0.10 0.27 0.00 -0.33 -0.87 0.00 0.00 176.83 175.80 1i0b h GLU 48 N 0.00 0.00 -0.79 4.77 5.08 -1.33 -3.28 114.58 119.02 1i0b h GLU 48 Ca -0.00 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.34 1i0b h GLU 48 Cb 0.83 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 30.04 1i0b h GLU 48 CO 0.03 0.00 0.41 0.00 -1.00 0.00 0.00 179.01 178.46 1i0b h ALA 49 N 2.17 1.02 -0.80 3.43 0.00 -1.55 -3.47 119.26 120.06 1i0b h ALA 49 Ca 0.00 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.77 1i0b h ALA 49 Cb 0.77 -0.32 0.00 0.00 0.00 0.00 0.00 17.79 18.24 1i0b h ALA 49 CO 0.00 0.56 0.00 0.41 0.00 0.00 0.00 179.25 180.22 1i0b n GLY 50 N -1.05 1.00 3.62 0.00 0.00 -1.24 -3.64 105.19 103.87 1i0b n GLY 50 Ca 0.07 -0.61 -0.45 0.00 0.00 0.00 0.00 46.02 45.03 1i0b n GLY 50 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1i0b n PHE 51 N 0.00 2.15 -4.87 1.61 -0.00 -1.26 -4.56 117.46 110.53 1i0b n PHE 51 Ca 0.00 -0.10 -0.26 0.00 -0.00 0.00 0.00 57.45 57.09 1i0b n PHE 51 Cb 0.00 -2.70 -0.15 0.00 -0.00 0.00 0.00 39.48 36.63 1i0b n PHE 51 CO 0.00 0.00 0.00 0.99 -0.00 0.00 0.00 176.76 177.75 1i0b s THR 52 N 6.08 1.57 -0.39 -2.13 2.01 -0.52 -1.14 115.64 121.11 1i0b s THR 52 Ca 0.97 -0.92 -0.15 0.00 0.31 0.00 0.00 61.69 61.90 1i0b s THR 52 Cb -0.53 -1.32 0.01 0.00 0.01 0.00 0.00 72.50 70.67 1i0b s THR 52 CO 0.43 0.38 0.31 -0.76 -0.69 0.00 0.00 174.62 174.29 1i0b s LEU 53 N -0.64 4.92 0.00 4.42 1.43 -0.43 -4.86 118.68 123.52 1i0b s LEU 53 Ca 0.07 -0.74 0.26 0.00 -1.03 0.00 0.00 54.13 52.70 1i0b s LEU 53 Cb -0.08 -2.19 1.18 0.00 0.03 0.00 0.00 46.19 45.13 1i0b s LEU 53 CO -0.00 -0.42 1.81 0.35 0.23 0.00 0.00 176.35 178.32 1i0b n THR 54 N 5.19 0.05 -3.38 5.49 -2.24 -1.25 -0.51 114.28 117.62 1i0b n THR 54 Ca -0.11 -0.19 -0.17 0.00 -2.27 0.00 0.00 64.05 61.32 1i0b n THR 54 Cb 0.48 0.16 -0.08 0.00 -2.10 0.00 0.00 70.33 68.78 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 -1.95 -0.41 0.34 4.78 5.65 -1.25 -4.71 115.29 117.73 1i0b s HIS 55 Ca 0.38 -0.45 -0.02 0.00 0.25 0.00 0.00 55.06 55.22 1i0b s HIS 55 Cb 0.19 -0.42 -0.00 0.00 -1.18 0.00 0.00 32.58 31.17 1i0b s HIS 55 CO 0.31 -0.95 0.45 -1.21 -0.65 0.00 0.00 174.74 172.69 1i0b s GLU 56 N 1.94 1.87 -0.05 2.88 0.41 -0.61 -1.08 118.70 124.05 1i0b s GLU 56 Ca 0.13 -1.76 -0.17 0.00 -0.41 0.00 0.00 54.97 52.76 1i0b s GLU 56 Cb -0.14 0.43 0.03 0.00 -1.78 0.00 0.00 34.13 32.67 1i0b s GLU 56 CO -0.19 -0.76 0.37 -1.01 -0.49 0.00 0.00 175.26 173.18 1i0b s HIS 57 N -3.15 -0.30 -0.09 1.61 3.76 -0.61 -1.60 115.29 114.91 1i0b s HIS 57 Ca 0.31 0.56 -0.18 0.00 -0.15 0.00 0.00 55.06 55.60 1i0b s HIS 57 Cb 0.00 0.15 -0.28 0.00 1.11 0.00 0.00 32.58 33.55 1i0b s HIS 57 CO 0.20 -0.37 0.67 0.82 -0.85 0.00 0.00 174.74 175.21 1i0b h ILE 58 N 3.91 1.22 -3.11 0.60 1.08 -1.94 -3.33 117.51 115.93 1i0b h ILE 58 Ca -0.29 -2.44 -0.17 0.00 -0.39 0.00 0.00 64.86 61.57 1i0b h ILE 58 Cb 1.17 2.89 -0.27 0.00 -3.07 0.00 0.00 36.82 37.54 1i0b h ILE 58 CO 0.36 0.69 -0.45 0.00 -0.69 0.00 0.00 178.15 178.07 1i0b s GLY 60 N 0.47 2.01 0.00 0.00 0.00 -0.17 -4.79 107.32 104.84 1i0b s GLY 60 Ca -0.03 -2.16 0.00 0.00 0.00 0.00 0.00 44.72 42.53 1i0b s GLY 60 CO -0.02 1.02 0.00 -1.26 0.00 0.00 0.00 173.10 172.84 1i0b n SER 61 N 5.06 0.78 -4.04 1.64 2.88 0.11 0.39 113.62 120.44 1i0b n SER 61 Ca -0.11 0.00 -0.08 0.00 -1.33 0.00 0.00 58.87 57.35 1i0b n SER 61 Cb 0.43 0.00 -0.10 0.00 -0.75 0.00 0.00 64.21 63.79 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 1.19 0.38 0.15 -3.46 0.01 -1.21 -3.91 113.70 106.85 1i0b s SER 62 Ca 0.00 -0.82 -0.34 0.00 1.31 0.00 0.00 55.95 56.10 1i0b s SER 62 Cb 0.00 0.18 -0.15 0.00 0.21 0.00 0.00 66.02 66.27 1i0b s SER 62 CO 0.00 -0.52 1.50 0.00 0.41 0.00 0.00 173.24 174.62 1i0b n ALA 63 N 0.54 0.68 -0.42 1.44 0.00 -1.24 -1.30 120.51 120.20 1i0b n ALA 63 Ca -0.17 0.46 0.00 0.00 0.00 0.00 0.00 53.44 53.73 1i0b n ALA 63 Cb 0.59 -2.27 0.00 0.00 0.00 0.00 0.00 19.45 17.78 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 3.08 0.80 0.12 0.00 0.00 -1.26 -4.89 105.19 103.03 1i0b n GLY 64 Ca 0.17 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.09 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 0.29 -0.38 1.61 3.04 -1.56 -0.78 116.94 119.16 1i0b h PHE 65 Ca 0.00 -0.01 -0.01 0.00 3.98 0.00 0.00 57.97 61.93 1i0b h PHE 65 Cb 0.00 -0.09 -0.02 0.00 2.56 0.00 0.00 35.95 38.40 1i0b h PHE 65 CO 0.00 0.29 0.21 1.25 -2.02 0.00 0.00 178.31 178.04 1i0b h LEU 66 N 0.22 0.46 0.00 0.59 5.85 -1.87 0.07 115.31 120.63 1i0b h LEU 66 Ca 0.07 -0.03 -0.13 0.00 0.84 0.00 0.00 57.88 58.64 1i0b h LEU 66 Cb 0.10 -0.12 -0.02 0.00 0.37 0.00 0.00 40.66 40.99 1i0b h LEU 66 CO -0.01 0.37 -0.77 0.03 -0.34 0.00 0.00 178.44 177.72 1i0b h ARG 67 N 0.53 0.00 0.00 1.25 2.47 -1.90 -2.82 114.38 113.91 1i0b h ARG 67 Ca 0.14 0.00 -0.23 0.00 -1.26 0.00 0.00 59.98 58.63 1i0b h ARG 67 Cb 0.01 0.00 -0.04 0.00 -1.65 0.00 0.00 29.97 28.29 1i0b h ARG 67 CO -0.02 0.48 -1.25 0.00 0.56 0.00 0.00 179.97 179.73 1i0b h ALA 68 N 1.45 0.56 -1.70 0.04 0.00 -0.34 -3.41 119.26 115.87 1i0b h ALA 68 Ca -0.04 -1.07 -0.46 0.00 0.00 0.00 0.00 54.91 53.34 1i0b h ALA 68 Cb 1.46 0.13 -0.36 0.00 0.00 0.00 0.00 17.79 19.02 1i0b h ALA 68 CO 0.06 1.29 -1.07 1.87 0.00 0.00 0.00 179.25 181.40 1i0b n TRP 69 N -3.18 -0.41 0.01 0.00 -0.00 -0.06 -4.94 117.44 108.85 1i0b n TRP 69 Ca -0.07 -3.50 0.16 0.00 -0.00 0.00 0.00 57.50 54.09 1i0b n TRP 69 Cb 0.95 -0.10 0.62 0.00 -0.00 0.00 0.00 31.31 32.79 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 3.25 0.12 0.00 5.87 0.13 -1.68 -1.31 132.00 138.39 1i0b h PRO 70 Ca 0.06 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 65.18 1i0b h PRO 70 Cb 0.97 -0.03 0.00 0.00 0.13 0.00 0.00 31.00 32.07 1i0b h PRO 70 CO 0.44 0.08 0.00 0.93 -0.23 0.00 0.00 178.00 179.22 1i0b h GLU 71 N 0.12 0.00 0.00 0.86 3.07 -1.89 0.12 114.58 116.86 1i0b h GLU 71 Ca 0.22 0.00 -0.01 0.00 -0.50 0.00 0.00 59.36 59.08 1i0b h GLU 71 Cb 0.72 0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 28.63 1i0b h GLU 71 CO -0.03 0.00 -0.03 0.35 -1.40 0.00 0.00 179.01 177.91 1i0b h PHE 72 N 0.00 0.00 -0.32 4.33 3.57 -1.64 -0.25 116.94 122.63 1i0b h PHE 72 Ca 0.00 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.50 1i0b h PHE 72 Cb 0.08 0.00 0.00 0.00 2.79 0.00 0.00 35.95 38.82 1i0b h PHE 72 CO 0.00 0.03 0.00 1.19 -2.23 0.00 0.00 178.31 177.30 1i0b n PHE 73 N -3.82 0.98 0.00 0.41 3.01 0.02 -4.94 117.46 113.13 1i0b n PHE 73 Ca -0.03 -0.79 0.00 0.00 1.01 0.00 0.00 57.45 57.64 1i0b n PHE 73 Cb 0.12 -0.28 0.00 0.00 -0.01 0.00 0.00 39.48 39.30 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 -0.19 2.23 3.56 1.37 0.00 -0.11 -4.31 105.19 107.75 1i0b n GLY 74 Ca 0.20 -0.49 -0.06 0.00 0.00 0.00 0.00 46.02 45.68 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 -0.23 0.20 1.61 1.04 -1.19 -4.26 113.70 110.87 1i0b s SER 75 Ca 0.00 -0.01 -0.10 0.00 0.48 0.00 0.00 55.95 56.32 1i0b s SER 75 Cb 0.00 0.25 0.13 0.00 0.10 0.00 0.00 66.02 66.50 1i0b s SER 75 CO 0.00 -0.41 1.79 -0.09 0.98 0.00 0.00 173.24 175.51 1i0b h ARG 76 N 2.00 1.04 -0.73 4.02 2.43 -1.88 -0.83 114.38 120.43 1i0b h ARG 76 Ca -0.15 -0.15 0.00 0.00 -0.81 0.00 0.00 59.98 58.86 1i0b h ARG 76 Cb 1.20 -0.19 -0.04 0.00 -0.42 0.00 0.00 29.97 30.53 1i0b h ARG 76 CO 0.26 0.81 0.46 -0.22 -1.51 0.00 0.00 179.97 179.77 1i0b h LYS 77 N 1.01 0.97 -0.30 0.20 3.64 -1.95 -0.54 116.57 119.61 1i0b h LYS 77 Ca 0.25 -0.07 -0.00 0.00 -1.27 0.00 0.00 60.65 59.55 1i0b h LYS 77 Cb 0.12 -0.21 -0.01 0.00 -0.41 0.00 0.00 32.23 31.72 1i0b h LYS 77 CO -0.03 0.67 0.17 0.00 -2.27 0.00 0.00 179.45 177.98 1i0b h ALA 78 N 1.25 0.38 -0.42 5.00 0.00 -1.74 -1.11 119.26 122.61 1i0b h ALA 78 Ca 0.26 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.11 1i0b h ALA 78 Cb -0.07 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.58 1i0b h ALA 78 CO -0.05 -0.10 0.27 1.25 0.00 0.00 0.00 179.25 180.62 1i0b h LEU 79 N 0.37 0.50 -0.23 0.00 5.85 -0.88 -1.06 115.31 119.84 1i0b h LEU 79 Ca 0.10 -0.03 0.01 0.00 0.84 0.00 0.00 57.88 58.80 1i0b h LEU 79 Cb 0.05 -0.12 -0.02 0.00 0.37 0.00 0.00 40.66 40.94 1i0b h LEU 79 CO -0.02 0.38 0.14 0.00 -0.34 0.00 0.00 178.44 178.60 1i0b h ALA 80 N 1.14 0.29 -0.78 1.25 0.00 -0.88 -0.53 119.26 119.74 1i0b h ALA 80 Ca 0.15 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.06 1i0b h ALA 80 Cb -0.04 -0.07 -0.04 0.00 0.00 0.00 0.00 17.79 17.65 1i0b h ALA 80 CO -0.03 -0.26 0.49 0.93 0.00 0.00 0.00 179.25 180.38 1i0b h GLU 81 N 0.28 1.05 -0.57 0.00 5.08 -0.98 0.26 114.58 119.71 1i0b h GLU 81 Ca 0.09 -0.08 -0.01 0.00 -1.00 0.00 0.00 59.36 58.36 1i0b h GLU 81 Cb -0.01 -0.23 -0.03 0.00 0.50 0.00 0.00 28.75 28.99 1i0b h GLU 81 CO -0.04 0.72 0.32 -0.22 -1.00 0.00 0.00 179.01 178.79 1i0b h LYS 82 N 1.07 0.80 -0.39 2.33 3.64 -0.88 -0.20 116.57 122.94 1i0b h LYS 82 Ca 0.28 -0.09 -0.07 0.00 -1.27 0.00 0.00 60.65 59.50 1i0b h LYS 82 Cb -0.07 -0.16 -0.01 0.00 -0.41 0.00 0.00 32.23 31.58 1i0b h LYS 82 CO -0.06 0.61 -0.02 0.00 -2.27 0.00 0.00 179.45 177.71 1i0b h ALA 83 N 1.14 0.53 -0.64 5.00 0.00 -0.60 -0.88 119.26 123.81 1i0b h ALA 83 Ca 0.20 -0.27 0.01 0.00 0.00 0.00 0.00 54.91 54.85 1i0b h ALA 83 Cb 0.04 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.65 1i0b h ALA 83 CO -0.03 0.33 0.42 0.28 0.00 0.00 0.00 179.25 180.25 1i0b h VAL 84 N 0.53 1.15 -0.20 0.00 2.07 -0.06 0.45 116.25 120.19 1i0b h VAL 84 Ca 0.11 -0.29 0.00 0.00 0.82 0.00 0.00 66.70 67.34 1i0b h VAL 84 Cb 0.51 0.22 -0.01 0.00 -1.52 0.00 0.00 31.29 30.49 1i0b h VAL 84 CO 0.02 0.16 0.13 0.03 0.02 0.00 0.00 177.57 177.93 1i0b h ARG 85 N 0.85 0.26 -0.37 1.57 3.08 -0.82 0.20 114.38 119.16 1i0b h ARG 85 Ca 0.24 -0.02 -0.02 0.00 0.07 0.00 0.00 59.98 60.25 1i0b h ARG 85 Cb -0.08 -0.06 -0.02 0.00 0.08 0.00 0.00 29.97 29.90 1i0b h ARG 85 CO -0.06 0.19 0.14 0.78 -1.07 0.00 0.00 179.97 179.95 1i0b h GLY 86 N 0.26 0.59 1.29 0.04 0.00 -0.79 -1.19 103.07 103.27 1i0b h GLY 86 Ca 0.07 -0.33 -0.04 0.00 0.00 0.00 0.00 47.33 47.04 1i0b h GLY 86 CO -0.01 0.31 0.24 1.41 0.00 0.00 0.00 176.54 178.48 1i0b h LEU 87 N 0.45 0.83 -0.87 3.11 3.38 0.17 -1.18 115.31 121.19 1i0b h LEU 87 Ca 0.12 -0.11 -0.06 0.00 0.09 0.00 0.00 57.88 57.92 1i0b h LEU 87 Cb 0.20 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 40.71 1i0b h LEU 87 CO -0.01 0.75 0.19 0.03 0.09 0.00 0.00 178.44 179.49 1i0b h ARG 88 N 0.89 1.02 -0.39 1.13 3.08 -0.24 -0.04 114.38 119.84 1i0b h ARG 88 Ca 0.21 -0.22 -0.08 0.00 0.07 0.00 0.00 59.98 59.96 1i0b h ARG 88 Cb 0.19 -0.15 -0.01 0.00 0.08 0.00 0.00 29.97 30.08 1i0b h ARG 88 CO -0.02 0.89 -0.08 0.00 -1.07 0.00 0.00 179.97 179.69 1i0b h ARG 89 N 0.98 0.74 -0.40 0.04 3.08 -0.87 0.94 114.38 118.89 1i0b h ARG 89 Ca 0.21 -0.28 -0.11 0.00 0.07 0.00 0.00 59.98 59.88 1i0b h ARG 89 Cb 0.31 -0.05 -0.02 0.00 0.08 0.00 0.00 29.97 30.29 1i0b h ARG 89 CO -0.00 0.88 -0.19 0.00 -1.07 0.00 0.00 179.97 179.58 1i0b h ALA 90 N 0.84 0.91 -0.61 0.04 0.00 -1.04 -2.17 119.26 117.22 1i0b h ALA 90 Ca 0.10 -0.36 -0.01 0.00 0.00 0.00 0.00 54.91 54.64 1i0b h ALA 90 Cb 0.59 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 18.20 1i0b h ALA 90 CO 0.04 0.62 0.34 -0.09 0.00 0.00 0.00 179.25 180.16 1i0b h ARG 91 N 0.68 0.85 -0.43 0.00 2.43 -0.77 -0.57 114.38 116.57 1i0b h ARG 91 Ca 0.10 -0.10 0.08 0.00 -0.81 0.00 0.00 59.98 59.25 1i0b h ARG 91 Cb 0.70 -0.17 -0.02 0.00 -0.42 0.00 0.00 29.97 30.05 1i0b h ARG 91 CO 0.05 0.64 0.30 0.00 -1.51 0.00 0.00 179.97 179.45 1i0b h ALA 92 N 1.16 2.08 -0.00 2.80 0.00 -0.31 0.31 119.26 125.30 1i0b h ALA 92 Ca 0.22 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.11 1i0b h ALA 92 Cb 0.03 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.77 1i0b h ALA 92 CO -0.04 -0.17 -0.02 0.00 0.00 0.00 0.00 179.25 179.02 1i0b n ALA 93 N -2.54 2.56 0.00 0.00 0.00 -0.30 -4.90 120.51 115.33 1i0b n ALA 93 Ca 0.06 -0.17 0.00 0.00 0.00 0.00 0.00 53.44 53.33 1i0b n ALA 93 Cb 0.32 -1.47 0.00 0.00 0.00 0.00 0.00 19.45 18.30 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 1.23 1.07 3.67 0.00 0.00 0.10 -4.86 105.19 106.40 1i0b n GLY 94 Ca 0.16 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.76 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 -2.01 4.11 -0.20 1.61 1.01 -0.73 -4.51 120.40 119.67 1i0b s VAL 95 Ca 0.00 1.37 0.13 0.00 0.00 0.00 0.00 61.98 63.48 1i0b s VAL 95 Cb 0.00 -3.89 -0.22 0.00 0.00 0.00 0.00 36.38 32.28 1i0b s VAL 95 CO 0.00 -0.09 -0.01 0.54 0.00 0.00 0.00 175.10 175.54 1i0b n ARG 96 N 6.32 0.79 -3.93 2.72 5.12 -0.30 -4.04 116.66 123.35 1i0b n ARG 96 Ca 0.14 0.03 -0.10 0.00 -1.93 0.00 0.00 57.85 55.99 1i0b n ARG 96 Cb 0.45 -1.49 -0.11 0.00 -1.16 0.00 0.00 32.46 30.14 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 -2.47 0.09 0.02 0.55 2.01 -0.91 -1.61 115.64 113.32 1i0b s THR 97 Ca -0.16 -0.71 0.05 0.00 0.31 0.00 0.00 61.69 61.18 1i0b s THR 97 Cb 0.06 -0.27 -0.02 0.00 0.01 0.00 0.00 72.50 72.28 1i0b s THR 97 CO 0.73 -0.39 -0.14 0.27 -0.69 0.00 0.00 174.62 174.40 1i0b s ILE 98 N -1.21 1.09 -0.39 1.82 -4.36 -0.02 -1.31 121.20 116.82 1i0b s ILE 98 Ca -0.13 -0.81 -0.12 0.00 -0.26 0.00 0.00 60.65 59.33 1i0b s ILE 98 Cb -0.08 -0.95 0.03 0.00 1.25 0.00 0.00 42.46 42.71 1i0b s ILE 98 CO -0.00 0.14 0.24 -0.69 0.24 0.00 0.00 174.94 174.87 1i0b s VAL 99 N -0.61 4.78 -0.60 8.37 1.01 0.33 -1.09 120.40 132.59 1i0b s VAL 99 Ca 0.03 -0.82 -0.22 0.00 0.00 0.00 0.00 61.98 60.97 1i0b s VAL 99 Cb -0.07 -3.68 0.06 0.00 0.00 0.00 0.00 36.38 32.70 1i0b s VAL 99 CO 0.00 -0.27 0.88 -0.62 0.00 0.00 0.00 175.10 175.09 1i0b s ASP 100 N 1.61 6.23 -0.04 3.32 3.68 0.45 -1.58 116.67 130.33 1i0b s ASP 100 Ca 0.03 -0.85 0.01 0.00 2.13 0.00 0.00 52.55 53.87 1i0b s ASP 100 Cb -0.19 -2.39 0.09 0.00 -1.45 0.00 0.00 42.92 38.98 1i0b s ASP 100 CO 0.08 -1.26 0.85 1.33 0.13 0.00 0.00 175.17 176.30 1i0b n VAL 101 N 5.91 0.74 -2.73 1.11 0.24 -0.63 -2.98 118.33 119.99 1i0b n VAL 101 Ca -0.03 -0.19 -0.42 0.00 -2.04 0.00 0.00 64.34 61.65 1i0b n VAL 101 Cb 0.46 -0.68 -0.03 0.00 -1.47 0.00 0.00 33.84 32.12 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 0.26 7.14 0.73 -1.34 0.01 -1.26 -4.86 113.70 114.38 1i0b s SER 102 Ca 0.07 1.41 0.00 0.00 1.31 0.00 0.00 55.95 58.74 1i0b s SER 102 Cb 0.05 -2.53 0.14 0.00 0.21 0.00 0.00 66.02 63.89 1i0b s SER 102 CO 0.02 -0.48 1.00 0.42 0.41 0.00 0.00 173.24 174.60 1i0b s THR 103 N 2.29 2.06 0.22 1.44 -4.23 -1.26 -4.27 115.64 111.88 1i0b s THR 103 Ca 0.45 -0.65 -0.12 0.00 -1.18 0.00 0.00 61.69 60.19 1i0b s THR 103 Cb -0.17 -2.41 0.25 0.00 1.34 0.00 0.00 72.50 71.50 1i0b s THR 103 CO 0.14 0.00 1.63 0.15 -0.54 0.00 0.00 174.62 176.00 1i0b h PHE 104 N -0.51 -0.29 0.00 3.99 3.57 -1.86 0.29 116.94 122.13 1i0b h PHE 104 Ca -0.34 0.06 0.00 0.00 3.53 0.00 0.00 57.97 61.21 1i0b h PHE 104 Cb 1.26 0.23 0.00 0.00 2.79 0.00 0.00 35.95 40.24 1i0b h PHE 104 CO -0.20 -0.27 0.00 -0.40 -2.23 0.00 0.00 178.31 175.21 1i0b n ASP 105 N -5.42 0.00 -0.68 0.41 3.85 -1.26 -1.17 116.55 112.28 1i0b n ASP 105 Ca 0.09 0.13 0.13 0.00 -0.71 0.00 0.00 54.79 54.43 1i0b n ASP 105 Cb 0.36 -0.35 0.36 0.00 -1.35 0.00 0.00 41.12 40.13 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 -1.35 0.07 -1.43 2.12 5.41 0.06 -4.07 119.36 120.17 1i0b n ILE 106 Ca 0.09 -0.37 0.00 0.00 1.00 0.00 0.00 62.75 63.47 1i0b n ILE 106 Cb 0.20 0.81 0.00 0.00 -0.71 0.00 0.00 39.64 39.95 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 1.25 0.39 3.62 7.39 0.00 -0.32 -0.71 105.19 116.81 1i0b n GLY 107 Ca 0.17 -0.99 -0.47 0.00 0.00 0.00 0.00 46.02 44.74 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 -2.08 1.56 -3.82 1.61 0.63 -1.03 -4.73 116.66 108.79 1i0b n ARG 108 Ca 0.00 0.55 -0.30 0.00 -0.92 0.00 0.00 57.85 57.19 1i0b n ARG 108 Cb 0.22 -2.11 -0.13 0.00 0.45 0.00 0.00 32.46 30.89 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 0.08 3.96 0.41 6.15 -1.08 -1.26 -4.90 116.67 120.02 1i0b s ASP 109 Ca 0.70 -2.81 0.15 0.00 -0.52 0.00 0.00 52.55 50.07 1i0b s ASP 109 Cb -0.75 -1.31 1.02 0.00 -1.46 0.00 0.00 42.92 40.42 1i0b s ASP 109 CO 0.52 -0.25 1.87 1.62 0.52 0.00 0.00 175.17 179.44 1i0b h VAL 110 N 5.35 0.73 -0.70 1.11 3.04 -1.97 -0.47 116.25 123.34 1i0b h VAL 110 Ca -0.04 -0.16 -0.01 0.00 -1.01 0.00 0.00 66.70 65.48 1i0b h VAL 110 Cb 0.91 0.22 -0.03 0.00 -2.01 0.00 0.00 31.29 30.37 1i0b h VAL 110 CO 0.58 0.09 0.38 0.28 -1.01 0.00 0.00 177.57 177.89 1i0b h SER 111 N 0.47 0.86 -0.39 3.17 0.02 -1.98 0.34 113.55 116.03 1i0b h SER 111 Ca 0.45 -0.07 -0.07 0.00 -0.84 0.00 0.00 61.79 61.26 1i0b h SER 111 Cb 1.03 -0.22 -0.01 0.00 0.14 0.00 0.00 62.40 63.34 1i0b h SER 111 CO -0.18 0.69 -0.04 0.25 -1.14 0.00 0.00 176.83 176.41 1i0b h LEU 112 N 0.97 0.71 -0.21 5.07 5.85 -1.53 -0.84 115.31 125.33 1i0b h LEU 112 Ca 0.25 -0.33 0.03 0.00 0.84 0.00 0.00 57.88 58.67 1i0b h LEU 112 Cb 0.02 -0.19 -0.03 0.00 0.37 0.00 0.00 40.66 40.83 1i0b h LEU 112 CO -0.04 0.87 0.02 -0.07 -0.34 0.00 0.00 178.44 178.88 1i0b h LEU 113 N 0.53 -0.03 -0.47 2.25 4.07 -0.81 -0.20 115.31 120.64 1i0b h LEU 113 Ca 0.11 0.04 -0.01 0.00 0.08 0.00 0.00 57.88 58.09 1i0b h LEU 113 Cb 0.53 0.06 -0.02 0.00 1.08 0.00 0.00 40.66 42.31 1i0b h LEU 113 CO 0.03 0.01 0.24 0.00 -1.08 0.00 0.00 178.44 177.64 1i0b h ALA 114 N 1.16 0.61 -0.09 1.53 0.00 -0.80 -0.31 119.26 121.36 1i0b h ALA 114 Ca 0.09 -0.10 -0.00 0.00 0.00 0.00 0.00 54.91 54.90 1i0b h ALA 114 Cb 0.10 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 17.70 1i0b h ALA 114 CO -0.14 0.15 0.05 1.49 0.00 0.00 0.00 179.25 180.80 1i0b h GLU 115 N 0.62 0.12 -0.03 0.00 4.81 -0.75 -1.91 114.58 117.45 1i0b h GLU 115 Ca 0.16 -0.01 -0.10 0.00 -0.13 0.00 0.00 59.36 59.28 1i0b h GLU 115 Cb 0.08 -0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.42 1i0b h GLU 115 CO -0.02 0.14 -0.45 -0.39 -0.73 0.00 0.00 179.01 177.55 1i0b h VAL 116 N 0.07 1.33 -0.44 0.32 -1.51 -0.94 -1.44 116.25 113.64 1i0b h VAL 116 Ca 0.03 -1.58 -0.03 0.00 -1.23 0.00 0.00 66.70 63.89 1i0b h VAL 116 Cb 0.05 1.82 -0.02 0.00 -2.13 0.00 0.00 31.29 31.01 1i0b h VAL 116 CO -0.01 0.46 0.16 -1.28 -1.23 0.00 0.00 177.57 175.67 1i0b h SER 117 N 0.06 0.62 0.08 4.19 0.87 -0.79 -0.55 113.55 118.02 1i0b h SER 117 Ca 0.00 -0.18 -0.00 0.00 -1.23 0.00 0.00 61.79 60.37 1i0b h SER 117 Cb 0.83 -0.16 0.00 0.00 -0.44 0.00 0.00 62.40 62.63 1i0b h SER 117 CO 0.06 0.63 -0.04 0.03 -0.53 0.00 0.00 176.83 176.99 1i0b h ARG 118 N 0.56 -0.10 -0.66 2.24 3.08 -1.25 0.23 114.38 118.48 1i0b h ARG 118 Ca 0.14 0.01 -0.04 0.00 0.07 0.00 0.00 59.98 60.16 1i0b h ARG 118 Cb 0.22 0.02 -0.03 0.00 0.08 0.00 0.00 29.97 30.26 1i0b h ARG 118 CO -0.01 0.17 0.25 0.00 -1.07 0.00 0.00 179.97 179.31 1i0b h ALA 119 N 0.53 1.19 0.00 0.04 0.00 -1.16 -3.02 119.26 116.84 1i0b h ALA 119 Ca -0.01 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.72 1i0b h ALA 119 Cb 0.32 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 17.84 1i0b h ALA 119 CO 0.02 0.58 -0.84 0.00 0.00 0.00 0.00 179.25 179.02 1i0b n ALA 120 N -2.45 3.94 -3.26 0.00 0.00 -0.23 -4.98 120.51 113.53 1i0b n ALA 120 Ca 0.06 -0.46 -0.15 0.00 0.00 0.00 0.00 53.44 52.89 1i0b n ALA 120 Cb 0.19 -0.95 0.08 0.00 0.00 0.00 0.00 19.45 18.76 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 -1.63 -4.75 -3.96 0.00 2.03 0.77 -4.69 116.55 104.32 1i0b n ASP 121 Ca 0.04 -0.65 -0.21 0.00 0.52 0.00 0.00 54.79 54.49 1i0b n ASP 121 Cb 0.36 -5.02 -0.16 0.00 -0.72 0.00 0.00 41.12 35.59 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 -3.36 0.73 0.24 5.18 1.01 -0.98 -5.05 120.40 118.17 1i0b s VAL 122 Ca 0.27 -0.28 -0.30 0.00 0.00 0.00 0.00 61.98 61.68 1i0b s VAL 122 Cb -0.04 -0.69 -0.09 0.00 0.00 0.00 0.00 36.38 35.56 1i0b s VAL 122 CO 0.71 0.25 1.30 -1.00 0.00 0.00 0.00 175.10 176.36 1i0b s HIS 123 N 0.57 3.23 -0.10 5.22 3.76 -0.63 -4.57 115.29 122.77 1i0b s HIS 123 Ca -0.09 1.29 0.00 0.00 -0.15 0.00 0.00 55.06 56.12 1i0b s HIS 123 Cb -0.12 -3.60 0.02 0.00 1.11 0.00 0.00 32.58 29.99 1i0b s HIS 123 CO 0.01 -1.80 -0.09 0.42 -0.85 0.00 0.00 174.74 172.43 1i0b s ILE 124 N -0.28 1.06 -0.19 0.60 1.01 -1.26 -0.84 121.20 121.30 1i0b s ILE 124 Ca 0.54 -0.33 -0.15 0.00 0.00 0.00 0.00 60.65 60.71 1i0b s ILE 124 Cb -0.37 -1.05 -0.04 0.00 0.01 0.00 0.00 42.46 41.01 1i0b s ILE 124 CO 0.42 0.37 0.33 -0.69 0.00 0.00 0.00 174.94 175.37 1i0b s VAL 125 N 1.48 5.26 0.37 2.92 1.01 -0.25 -0.69 120.40 130.49 1i0b s VAL 125 Ca 0.01 0.60 -0.03 0.00 0.00 0.00 0.00 61.98 62.56 1i0b s VAL 125 Cb -0.13 -3.67 -0.04 0.00 0.00 0.00 0.00 36.38 32.54 1i0b s VAL 125 CO -0.06 0.32 0.62 0.00 0.00 0.00 0.00 175.10 175.98 1i0b s ALA 126 N 0.93 3.59 0.32 5.51 0.00 -1.26 -0.41 121.76 130.44 1i0b s ALA 126 Ca 0.17 -0.69 0.10 0.00 0.00 0.00 0.00 51.96 51.54 1i0b s ALA 126 Cb -0.14 -2.30 -0.06 0.00 0.00 0.00 0.00 23.12 20.62 1i0b s ALA 126 CO 0.06 -0.04 -0.13 0.00 0.00 0.00 0.00 175.76 175.66 1i0b s ALA 127 N -2.37 2.87 0.00 0.00 0.00 -1.16 0.70 121.76 121.81 1i0b s ALA 127 Ca 0.43 -2.02 0.00 0.00 0.00 0.00 0.00 51.96 50.37 1i0b s ALA 127 Cb -0.10 -0.11 0.00 0.00 0.00 0.00 0.00 23.12 22.91 1i0b s ALA 127 CO 0.37 0.14 0.00 -2.37 0.00 0.00 0.00 175.76 173.89 1i0b n THR 128 N -0.73 0.00 0.00 0.00 5.66 0.26 -4.70 114.28 114.77 1i0b n THR 128 Ca -0.05 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.95 1i0b n THR 128 Cb 0.62 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.40 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 4.22 -1.47 3.08 1.09 0.00 -1.26 -0.68 105.19 110.19 1i0b n GLY 129 Ca 0.00 -2.09 -0.13 0.00 0.00 0.00 0.00 46.02 43.81 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 0.81 0.00 0.99 1.43 -0.54 -4.24 118.68 117.13 1i0b s LEU 130 Ca 0.00 0.48 0.00 0.00 -1.03 0.00 0.00 54.13 53.58 1i0b s LEU 130 Cb 0.00 0.76 0.00 0.00 0.03 0.00 0.00 46.19 46.98 1i0b s LEU 130 CO 0.00 -0.12 0.00 1.87 0.23 0.00 0.00 176.35 178.33 1i0b n TRP 131 N 3.52 0.00 -0.99 0.29 -0.00 -1.26 -3.76 117.44 115.24 1i0b n TRP 131 Ca -0.18 0.00 0.02 0.00 -0.00 0.00 0.00 57.50 57.34 1i0b n TRP 131 Cb 0.56 0.00 0.35 0.00 -0.00 0.00 0.00 31.31 32.22 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 0.00 2.04 -2.50 5.87 1.16 -1.26 -4.41 117.46 118.36 1i0b n PHE 132 Ca 0.00 -0.94 -0.16 0.00 -1.87 0.00 0.00 57.45 54.47 1i0b n PHE 132 Cb 0.00 -0.55 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 3.26 -4.75 5.98 4.64 -1.26 -5.09 116.55 119.46 1i0b n ASP 133 Ca 0.32 -3.12 -0.41 0.00 -1.38 0.00 0.00 54.79 50.20 1i0b n ASP 133 Cb 1.22 -0.46 -0.03 0.00 -1.04 0.00 0.00 41.12 40.82 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 -3.49 4.41 0.86 -0.67 0.04 -1.26 -4.89 135.00 130.00 1i0b s PRO 134 Ca 0.39 2.09 -0.13 0.00 0.04 0.00 0.00 61.00 63.39 1i0b s PRO 134 Cb 0.40 -3.14 0.12 0.00 0.04 0.00 0.00 34.50 31.92 1i0b s PRO 134 CO -0.05 -0.15 1.22 -1.25 0.04 0.00 0.00 177.00 176.81 1i0b s PRO 135 N -1.05 1.55 0.37 0.56 0.04 -1.26 -4.67 135.00 130.54 1i0b s PRO 135 Ca 0.51 -0.02 0.15 0.00 0.04 0.00 0.00 61.00 61.69 1i0b s PRO 135 Cb -0.37 -1.91 1.02 0.00 0.04 0.00 0.00 34.50 33.28 1i0b s PRO 135 CO 0.45 -1.86 1.77 -0.07 0.04 0.00 0.00 177.00 177.33 1i0b h LEU 136 N -1.25 0.52 -2.00 -3.56 3.38 -1.97 -0.16 115.31 110.27 1i0b h LEU 136 Ca -0.46 0.09 -0.02 0.00 0.09 0.00 0.00 57.88 57.59 1i0b h LEU 136 Cb 1.30 0.01 -0.00 0.00 0.09 0.00 0.00 40.66 42.06 1i0b h LEU 136 CO 0.58 0.11 -0.09 0.28 0.09 0.00 0.00 178.44 179.41 1i0b h SER 137 N 0.47 0.00 0.03 -0.43 0.02 -2.00 -2.07 113.55 109.57 1i0b h SER 137 Ca 0.60 0.00 -0.32 0.00 -0.84 0.00 0.00 61.79 61.23 1i0b h SER 137 Cb 1.38 0.00 -0.04 0.00 0.14 0.00 0.00 62.40 63.87 1i0b h SER 137 CO -0.33 0.09 -1.77 0.23 -1.14 0.00 0.00 176.83 173.91 1i0b n MET 138 N -3.60 0.62 0.28 3.45 2.81 -0.19 -4.39 117.12 116.09 1i0b n MET 138 Ca -0.02 0.42 0.17 0.00 -1.81 0.00 0.00 57.70 56.46 1i0b n MET 138 Cb 0.22 -1.67 0.93 0.00 -0.71 0.00 0.00 33.22 31.99 1i0b n MET 138 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1i0b h ARG 139 N -0.71 0.00 -0.02 0.03 3.08 -1.05 -1.42 114.38 114.29 1i0b h ARG 139 Ca -0.46 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.59 1i0b h ARG 139 Cb 1.56 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.61 1i0b h ARG 139 CO -0.19 0.00 -0.02 1.28 -1.07 0.00 0.00 179.97 179.98 1i0b n LEU 140 N -3.67 1.60 -4.84 3.04 4.77 -0.79 -4.94 117.00 112.17 1i0b n LEU 140 Ca -0.01 -0.53 -0.32 0.00 -0.03 0.00 0.00 56.01 55.12 1i0b n LEU 140 Cb 0.17 -0.01 0.01 0.00 -2.33 0.00 0.00 43.42 41.26 1i0b n LEU 140 CO 0.26 0.27 0.71 -0.13 -1.33 0.00 0.00 177.39 177.16 1i0b s ARG 141 N -2.03 3.47 0.55 3.23 1.81 -0.54 -5.07 118.95 120.37 1i0b s ARG 141 Ca 0.36 0.95 -0.02 0.00 -1.72 0.00 0.00 55.73 55.30 1i0b s ARG 141 Cb 0.21 -2.06 0.02 0.00 -0.45 0.00 0.00 34.95 32.66 1i0b s ARG 141 CO 0.34 -0.67 0.82 -1.54 -0.68 0.00 0.00 175.30 173.57 1i0b s SER 142 N -3.51 5.50 0.30 0.23 1.04 -1.26 -4.91 113.70 111.09 1i0b s SER 142 Ca 0.59 0.39 -0.02 0.00 0.48 0.00 0.00 55.95 57.39 1i0b s SER 142 Cb -0.12 -1.40 0.43 0.00 0.10 0.00 0.00 66.02 65.03 1i0b s SER 142 CO 0.45 -1.03 1.96 1.62 0.98 0.00 0.00 173.24 177.22 1i0b h VAL 143 N 0.01 1.21 -0.30 5.02 3.04 -1.98 -1.39 116.25 121.86 1i0b h VAL 143 Ca -0.45 -0.39 -0.02 0.00 -1.01 0.00 0.00 66.70 64.83 1i0b h VAL 143 Cb 1.27 -0.02 -0.01 0.00 -2.01 0.00 0.00 31.29 30.51 1i0b h VAL 143 CO 0.58 0.21 0.11 -0.33 -1.01 0.00 0.00 177.57 177.13 1i0b h GLU 144 N 1.14 0.45 0.03 4.17 3.07 -1.95 -1.21 114.58 120.28 1i0b h GLU 144 Ca 0.31 -0.08 -0.00 0.00 -0.50 0.00 0.00 59.36 59.08 1i0b h GLU 144 Cb -0.12 -0.07 0.00 0.00 -0.84 0.00 0.00 28.75 27.72 1i0b h GLU 144 CO -0.07 0.47 -0.01 0.93 -1.40 0.00 0.00 179.01 178.93 1i0b h GLU 145 N 0.33 -0.04 -0.70 2.33 5.08 -1.84 -1.91 114.58 117.83 1i0b h GLU 145 Ca 0.10 0.00 0.07 0.00 -1.00 0.00 0.00 59.36 58.53 1i0b h GLU 145 Cb 0.20 0.01 -0.04 0.00 0.50 0.00 0.00 28.75 29.41 1i0b h GLU 145 CO -0.01 0.06 0.46 -0.07 -1.00 0.00 0.00 179.01 178.46 1i0b h LEU 146 N -0.13 0.61 -0.60 1.33 3.38 -1.24 -0.91 115.31 117.75 1i0b h LEU 146 Ca -0.00 0.01 -0.02 0.00 0.09 0.00 0.00 57.88 57.96 1i0b h LEU 146 Cb 0.12 -0.12 -0.03 0.00 0.09 0.00 0.00 40.66 40.71 1i0b h LEU 146 CO 0.01 0.39 0.32 0.74 0.09 0.00 0.00 178.44 179.98 1i0b h THR 147 N 0.69 1.20 -0.14 0.22 2.02 -0.79 -0.05 112.91 116.06 1i0b h THR 147 Ca 0.31 -0.53 -0.08 0.00 0.77 0.00 0.00 66.41 66.88 1i0b h THR 147 Cb 0.32 0.45 -0.01 0.00 -1.74 0.00 0.00 68.15 67.16 1i0b h THR 147 CO -0.10 0.22 -0.27 1.56 0.37 0.00 0.00 175.52 177.30 1i0b h GLN 148 N 0.82 0.25 -0.18 6.66 1.08 -0.42 -0.17 115.11 123.15 1i0b h GLN 148 Ca 0.21 -0.09 -0.07 0.00 -1.45 0.00 0.00 58.65 57.26 1i0b h GLN 148 Cb 0.07 -0.02 -0.00 0.00 -0.05 0.00 0.00 27.48 27.48 1i0b h GLN 148 CO -0.03 0.51 -0.15 0.35 -0.95 0.00 0.00 178.83 178.56 1i0b h PHE 149 N 0.23 0.50 -0.82 2.96 3.04 -0.52 -1.28 116.94 121.05 1i0b h PHE 149 Ca 0.04 -0.14 -0.02 0.00 3.98 0.00 0.00 57.97 61.82 1i0b h PHE 149 Cb 0.60 -0.11 -0.04 0.00 2.56 0.00 0.00 35.95 38.96 1i0b h PHE 149 CO 0.01 0.77 0.45 0.74 -2.02 0.00 0.00 178.31 178.26 1i0b h PHE 150 N 0.08 1.13 -0.67 0.41 0.04 -0.86 -2.17 116.94 114.91 1i0b h PHE 150 Ca 0.03 -0.03 -0.03 0.00 2.80 0.00 0.00 57.97 60.74 1i0b h PHE 150 Cb 0.68 -0.36 -0.03 0.00 2.20 0.00 0.00 35.95 38.43 1i0b h PHE 150 CO 0.08 0.79 0.29 -0.07 -0.60 0.00 0.00 178.31 178.80 1i0b h LEU 151 N 1.15 0.89 -0.36 1.54 3.38 -0.93 -1.99 115.31 118.99 1i0b h LEU 151 Ca 0.29 -0.11 0.04 0.00 0.09 0.00 0.00 57.88 58.18 1i0b h LEU 151 Cb 0.04 -0.23 -0.04 0.00 0.09 0.00 0.00 40.66 40.52 1i0b h LEU 151 CO -0.05 0.78 0.13 -0.09 0.09 0.00 0.00 178.44 179.31 1i0b h ARG 152 N 0.97 0.28 0.00 1.13 2.43 -0.61 0.35 114.38 118.93 1i0b h ARG 152 Ca 0.23 -0.02 -0.08 0.00 -0.81 0.00 0.00 59.98 59.31 1i0b h ARG 152 Cb 0.16 -0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 29.63 1i0b h ARG 152 CO -0.02 0.19 -0.36 0.93 -1.51 0.00 0.00 179.97 179.19 1i0b h GLU 153 N 0.29 0.00 0.01 0.20 5.08 -1.10 0.18 114.58 119.24 1i0b h GLU 153 Ca 0.16 0.00 -0.09 0.00 -1.00 0.00 0.00 59.36 58.43 1i0b h GLU 153 Cb 0.13 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.37 1i0b h GLU 153 CO -0.16 0.36 -0.49 0.82 -1.00 0.00 0.00 179.01 178.54 1i0b h ILE 154 N 0.00 1.47 0.09 3.13 2.04 -0.90 0.00 117.51 123.35 1i0b h ILE 154 Ca -0.00 -2.30 -0.13 0.00 1.00 0.00 0.00 64.86 63.42 1i0b h ILE 154 Cb 0.72 2.98 0.01 0.00 -0.74 0.00 0.00 36.82 39.79 1i0b h ILE 154 CO 0.05 0.52 -0.60 1.56 0.00 0.00 0.00 178.15 179.68 1i0b h GLN 155 N -0.95 0.20 0.00 2.37 4.20 -0.35 -3.37 115.11 117.21 1i0b h GLN 155 Ca -0.13 -0.34 -0.36 0.00 0.06 0.00 0.00 58.65 57.88 1i0b h GLN 155 Cb 1.15 0.13 -0.05 0.00 0.30 0.00 0.00 27.48 29.01 1i0b h GLN 155 CO -0.06 1.16 -1.98 0.66 -0.67 0.00 0.00 178.83 177.94 1i0b n TYR 156 N -4.27 0.47 0.00 2.96 0.53 -0.12 -5.01 117.16 111.72 1i0b n TYR 156 Ca -0.14 0.20 0.00 0.00 -1.02 0.00 0.00 57.90 56.94 1i0b n TYR 156 Cb 0.72 -1.05 0.00 0.00 -1.03 0.00 0.00 39.34 37.98 1i0b n TYR 156 CO 0.00 0.00 0.00 0.41 -1.02 0.00 0.00 176.86 176.25 1i0b n GLY 157 N 1.37 3.99 3.70 2.72 0.00 0.43 -4.46 105.19 112.95 1i0b n GLY 157 Ca -0.44 -1.17 -0.41 0.00 0.00 0.00 0.00 46.02 43.99 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 4.91 0.00 -0.61 1.01 0.81 -4.22 121.20 121.10 1i0b s ILE 158 Ca 0.00 1.82 0.00 0.00 0.00 0.00 0.00 60.65 62.47 1i0b s ILE 158 Cb 0.00 -4.21 0.00 0.00 0.01 0.00 0.00 42.46 38.26 1i0b s ILE 158 CO 0.00 0.14 0.00 -0.62 0.00 0.00 0.00 174.94 174.46 1i0b n GLU 159 N 4.24 0.00 -0.76 2.79 1.02 -1.26 -1.67 120.64 124.99 1i0b n GLU 159 Ca 0.04 0.00 0.06 0.00 -0.02 0.00 0.00 57.16 57.24 1i0b n GLU 159 Cb 0.50 0.00 0.35 0.00 -0.02 0.00 0.00 31.44 32.27 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 0.17 5.01 0.08 1.62 3.85 -1.26 -4.50 116.55 121.52 1i0b n ASP 160 Ca 0.00 -3.01 0.12 0.00 -0.71 0.00 0.00 54.79 51.19 1i0b n ASP 160 Cb 0.00 -0.65 0.07 0.00 -1.35 0.00 0.00 41.12 39.19 1i0b n ASP 160 CO 0.00 0.00 0.00 0.71 -1.01 0.00 0.00 177.20 176.90 1i0b h THR 161 N 3.11 0.00 -0.02 2.12 1.35 -1.66 -3.48 112.91 114.34 1i0b h THR 161 Ca 0.03 -0.76 -0.01 0.00 -0.55 0.00 0.00 66.41 65.12 1i0b h THR 161 Cb 1.84 1.28 -0.00 0.00 -1.73 0.00 0.00 68.15 69.54 1i0b h THR 161 CO 0.43 0.00 -0.01 0.61 -0.25 0.00 0.00 175.52 176.30 1i0b n GLY 162 N 1.25 0.33 3.64 5.82 0.00 -1.25 -4.93 105.19 110.05 1i0b n GLY 162 Ca 0.01 -0.03 -0.42 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 -1.62 4.76 -0.08 -0.61 1.01 -1.26 -4.72 121.20 118.68 1i0b s ILE 163 Ca 0.00 1.57 -0.17 0.00 0.00 0.00 0.00 60.65 62.05 1i0b s ILE 163 Cb 0.00 -4.19 -0.05 0.00 0.01 0.00 0.00 42.46 38.23 1i0b s ILE 163 CO 0.00 -0.18 0.45 -0.13 0.00 0.00 0.00 174.94 175.09 1i0b s ARG 164 N 3.02 4.22 0.36 2.79 0.52 -1.26 -0.13 118.95 128.46 1i0b s ARG 164 Ca 0.37 0.44 -0.28 0.00 -0.52 0.00 0.00 55.73 55.74 1i0b s ARG 164 Cb -0.15 -3.37 -0.10 0.00 0.52 0.00 0.00 34.95 31.86 1i0b s ARG 164 CO 0.09 0.34 1.30 0.00 0.02 0.00 0.00 175.30 177.05 1i0b s ALA 165 N 0.04 3.41 -1.44 2.13 0.00 -0.01 -4.51 121.76 121.39 1i0b s ALA 165 Ca 0.25 1.25 0.13 0.00 0.00 0.00 0.00 51.96 53.59 1i0b s ALA 165 Cb -0.16 -3.48 0.24 0.00 0.00 0.00 0.00 23.12 19.73 1i0b s ALA 165 CO 0.11 -0.70 1.12 0.41 0.00 0.00 0.00 175.76 176.71 1i0b n GLY 166 N 0.74 1.32 3.46 0.00 0.00 0.22 -4.61 105.19 106.32 1i0b n GLY 166 Ca 0.01 -0.43 -0.10 0.00 0.00 0.00 0.00 46.02 45.50 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 -1.07 0.00 -0.22 -0.61 2.07 -1.17 -4.47 121.20 115.73 1i0b s ILE 167 Ca 0.22 0.00 -0.01 0.00 -1.41 0.00 0.00 60.65 59.46 1i0b s ILE 167 Cb 0.13 -1.00 0.02 0.00 0.13 0.00 0.00 42.46 41.74 1i0b s ILE 167 CO 0.18 0.00 -0.12 -0.63 -1.91 0.00 0.00 174.94 172.47 1i0b s ILE 168 N -3.38 2.60 -0.19 2.00 1.01 -0.43 -0.57 121.20 122.24 1i0b s ILE 168 Ca 0.03 -0.93 -0.10 0.00 0.00 0.00 0.00 60.65 59.65 1i0b s ILE 168 Cb -0.01 -2.22 -0.05 0.00 0.01 0.00 0.00 42.46 40.19 1i0b s ILE 168 CO -0.11 0.36 0.15 -0.75 0.00 0.00 0.00 174.94 174.60 1i0b s LYS 169 N 1.33 4.11 0.36 2.79 2.47 0.15 -0.56 119.74 130.39 1i0b s LYS 169 Ca 0.03 -0.18 0.06 0.00 -1.56 0.00 0.00 55.97 54.31 1i0b s LYS 169 Cb -0.15 -3.39 -0.03 0.00 -1.46 0.00 0.00 37.83 32.80 1i0b s LYS 169 CO -0.08 0.35 0.21 0.14 0.16 0.00 0.00 175.35 176.13 1i0b s VAL 170 N 0.21 0.24 -0.16 4.02 -7.23 -0.71 -1.47 120.40 115.30 1i0b s VAL 170 Ca 0.10 -2.00 -0.32 0.00 -1.81 0.00 0.00 61.98 57.95 1i0b s VAL 170 Cb -0.11 -2.42 0.14 0.00 0.56 0.00 0.00 36.38 34.54 1i0b s VAL 170 CO -0.01 0.00 1.11 0.00 -0.31 0.00 0.00 175.10 175.90 1i0b s ALA 171 N -3.36 -1.99 0.05 1.32 0.00 -1.25 -1.66 121.76 114.87 1i0b s ALA 171 Ca 0.33 1.53 -0.04 0.00 0.00 0.00 0.00 51.96 53.78 1i0b s ALA 171 Cb 0.02 -0.39 -0.02 0.00 0.00 0.00 0.00 23.12 22.73 1i0b s ALA 171 CO 0.22 -0.48 0.07 0.95 0.00 0.00 0.00 175.76 176.51 1i0b s THR 172 N -1.98 0.16 -0.46 0.00 -4.23 -1.14 -4.77 115.64 103.21 1i0b s THR 172 Ca 0.05 -1.32 0.06 0.00 -1.18 0.00 0.00 61.69 59.30 1i0b s THR 172 Cb -0.01 -1.14 0.21 0.00 1.34 0.00 0.00 72.50 72.90 1i0b s THR 172 CO -0.04 -0.73 0.47 0.35 -0.54 0.00 0.00 174.62 174.12 1i0b n THR 173 N 0.44 -0.36 -0.38 3.99 -2.24 -1.26 -4.08 114.28 110.39 1i0b n THR 173 Ca -0.17 -3.98 0.00 0.00 -2.27 0.00 0.00 64.05 57.63 1i0b n THR 173 Cb 0.60 -1.87 0.00 0.00 -2.10 0.00 0.00 70.33 66.96 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 1.99 -2.02 3.07 3.38 0.00 -1.26 -4.94 105.19 105.40 1i0b n GLY 174 Ca 0.25 -2.00 -0.51 0.00 0.00 0.00 0.00 46.02 43.77 1i0b n GLY 174 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1i0b n LYS 175 N -0.01 0.00 -2.14 1.61 4.81 -1.26 -4.79 118.16 116.38 1i0b n LYS 175 Ca 0.00 0.00 -0.37 0.00 -0.87 0.00 0.00 58.31 57.07 1i0b n LYS 175 Cb 0.00 -1.27 0.01 0.00 0.02 0.00 0.00 35.03 33.78 1i0b n LYS 175 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1i0b s ALA 176 N -0.09 2.85 0.77 3.14 0.00 -1.26 -5.00 121.76 122.17 1i0b s ALA 176 Ca 0.78 1.00 -0.12 0.00 0.00 0.00 0.00 51.96 53.62 1i0b s ALA 176 Cb -1.09 -3.42 0.06 0.00 0.00 0.00 0.00 23.12 18.67 1i0b s ALA 176 CO 0.50 -0.87 1.14 0.95 0.00 0.00 0.00 175.76 177.48 1i0b s THR 177 N -1.54 2.63 0.22 0.00 -4.23 -1.26 -4.84 115.64 106.62 1i0b s THR 177 Ca 0.68 0.21 -0.08 0.00 -1.18 0.00 0.00 61.69 61.31 1i0b s THR 177 Cb -0.30 -3.18 0.17 0.00 1.34 0.00 0.00 72.50 70.52 1i0b s THR 177 CO 0.36 -0.27 1.85 -0.65 -0.54 0.00 0.00 174.62 175.36 1i0b h PRO 178 N -0.92 0.85 -0.51 3.99 0.11 -2.00 -1.28 132.00 132.24 1i0b h PRO 178 Ca -0.46 -0.05 -0.06 0.00 0.11 0.00 0.00 66.00 65.54 1i0b h PRO 178 Cb 1.30 -0.19 -0.02 0.00 0.11 0.00 0.00 31.00 32.19 1i0b h PRO 178 CO 0.65 0.57 0.08 0.35 -0.21 0.00 0.00 178.00 179.43 1i0b h PHE 179 N 0.88 0.91 -0.54 0.65 3.57 -1.93 -2.63 116.94 117.85 1i0b h PHE 179 Ca 0.31 -0.13 0.03 0.00 3.53 0.00 0.00 57.97 61.71 1i0b h PHE 179 Cb 0.08 -0.25 -0.03 0.00 2.79 0.00 0.00 35.95 38.54 1i0b h PHE 179 CO -0.04 0.83 0.36 1.96 -2.23 0.00 0.00 178.31 179.18 1i0b h GLN 180 N 0.74 0.61 -0.72 1.11 4.20 -1.77 -1.04 115.11 118.25 1i0b h GLN 180 Ca 0.16 -0.04 -0.05 0.00 0.06 0.00 0.00 58.65 58.78 1i0b h GLN 180 Cb 0.41 -0.14 -0.03 0.00 0.30 0.00 0.00 27.48 28.02 1i0b h GLN 180 CO 0.01 0.40 0.23 0.93 -0.67 0.00 0.00 178.83 179.74 1i0b h GLU 181 N 0.62 1.09 -0.74 1.46 5.08 -0.89 -1.59 114.58 119.62 1i0b h GLU 181 Ca 0.22 -0.22 -0.05 0.00 -1.00 0.00 0.00 59.36 58.30 1i0b h GLU 181 Cb 0.09 -0.17 -0.03 0.00 0.50 0.00 0.00 28.75 29.14 1i0b h GLU 181 CO -0.06 0.92 0.25 -0.07 -1.00 0.00 0.00 179.01 179.06 1i0b h LEU 182 N 1.06 1.06 -0.37 1.33 3.38 -1.04 -2.15 115.31 118.58 1i0b h LEU 182 Ca 0.23 -0.19 -0.02 0.00 0.09 0.00 0.00 57.88 58.00 1i0b h LEU 182 Cb 0.28 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.74 1i0b h LEU 182 CO -0.01 0.97 0.16 0.58 0.09 0.00 0.00 178.44 180.23 1i0b h VAL 183 N 1.10 1.18 -0.87 1.22 2.07 -0.64 -0.71 116.25 119.61 1i0b h VAL 183 Ca 0.24 -0.55 0.04 0.00 0.82 0.00 0.00 66.70 67.25 1i0b h VAL 183 Cb 0.27 0.86 -0.05 0.00 -1.52 0.00 0.00 31.29 30.85 1i0b h VAL 183 CO -0.01 0.20 0.57 -0.07 0.02 0.00 0.00 177.57 178.28 1i0b h LEU 184 N 0.45 0.92 -0.33 2.57 4.07 -1.11 0.73 115.31 122.62 1i0b h LEU 184 Ca 0.12 -0.01 -0.09 0.00 0.08 0.00 0.00 57.88 57.99 1i0b h LEU 184 Cb 0.16 -0.21 -0.01 0.00 1.08 0.00 0.00 40.66 41.69 1i0b h LEU 184 CO -0.01 0.63 -0.13 0.11 -1.08 0.00 0.00 178.44 177.95 1i0b h LYS 185 N 1.06 0.66 -0.43 1.13 1.57 -1.06 -0.67 116.57 118.83 1i0b h LYS 185 Ca 0.35 -0.28 -0.09 0.00 -1.87 0.00 0.00 60.65 58.76 1i0b h LYS 185 Cb 0.05 -0.02 -0.02 0.00 0.08 0.00 0.00 32.23 32.32 1i0b h LYS 185 CO -0.11 0.86 -0.09 0.00 -0.57 0.00 0.00 179.45 179.55 1i0b h ALA 186 N 0.78 1.03 -0.45 3.86 0.00 -0.56 -0.32 119.26 123.60 1i0b h ALA 186 Ca 0.08 -0.30 -0.04 0.00 0.00 0.00 0.00 54.91 54.64 1i0b h ALA 186 Cb 0.65 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.25 1i0b h ALA 186 CO 0.04 0.59 0.11 0.00 0.00 0.00 0.00 179.25 179.99 1i0b h ALA 187 N 1.21 0.59 -0.13 0.00 0.00 -0.75 0.96 119.26 121.13 1i0b h ALA 187 Ca 0.12 -0.20 0.01 0.00 0.00 0.00 0.00 54.91 54.84 1i0b h ALA 187 Cb 0.56 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 1i0b h ALA 187 CO 0.03 0.27 0.05 0.00 0.00 0.00 0.00 179.25 179.60 1i0b h ALA 188 N 0.97 0.14 -0.89 0.00 0.00 -0.79 0.21 119.26 118.91 1i0b h ALA 188 Ca 0.14 0.01 0.10 0.00 0.00 0.00 0.00 54.91 55.16 1i0b h ALA 188 Cb 0.31 -0.01 -0.08 0.00 0.00 0.00 0.00 17.79 18.02 1i0b h ALA 188 CO 0.00 -0.40 0.53 0.00 0.00 0.00 0.00 179.25 179.38 1i0b h ARG 189 N 0.12 0.85 -0.48 0.00 3.08 -0.63 0.12 114.38 117.43 1i0b h ARG 189 Ca 0.05 -0.05 -0.13 0.00 0.07 0.00 0.00 59.98 59.92 1i0b h ARG 189 Cb 0.02 -0.19 -0.01 0.00 0.08 0.00 0.00 29.97 29.87 1i0b h ARG 189 CO -0.05 0.56 -0.21 0.00 -1.07 0.00 0.00 179.97 179.20 1i0b h ALA 190 N 1.48 0.70 -0.37 0.04 0.00 -0.40 -1.76 119.26 118.95 1i0b h ALA 190 Ca 0.43 -0.39 -0.02 0.00 0.00 0.00 0.00 54.91 54.93 1i0b h ALA 190 Cb 0.39 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.00 1i0b h ALA 190 CO -0.25 0.68 0.15 1.03 0.00 0.00 0.00 179.25 180.86 1i0b h SER 191 N 0.86 0.50 -0.69 0.00 0.87 0.12 -0.77 113.55 114.43 1i0b h SER 191 Ca 0.11 -0.16 -0.01 0.00 -1.23 0.00 0.00 61.79 60.50 1i0b h SER 191 Cb 0.79 -0.13 -0.03 0.00 -0.44 0.00 0.00 62.40 62.59 1i0b h SER 191 CO 0.07 0.53 0.41 -0.07 -0.53 0.00 0.00 176.83 177.23 1i0b h LEU 192 N 0.45 0.85 0.00 2.23 3.38 -0.70 0.53 115.31 122.04 1i0b h LEU 192 Ca 0.12 -0.05 -0.17 0.00 0.09 0.00 0.00 57.88 57.87 1i0b h LEU 192 Cb 0.18 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.69 1i0b h LEU 192 CO -0.01 0.67 -0.81 0.00 0.09 0.00 0.00 178.44 178.38 1i0b h ALA 193 N 1.47 0.50 0.00 1.53 0.00 -1.07 -3.39 119.26 118.31 1i0b h ALA 193 Ca 0.25 -0.72 0.00 0.00 0.00 0.00 0.00 54.91 54.44 1i0b h ALA 193 Cb -0.01 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.67 1i0b h ALA 193 CO -0.04 0.98 -1.41 0.25 0.00 0.00 0.00 179.25 179.02 1i0b n THR 194 N -3.28 0.00 -0.42 0.00 -2.24 -0.32 -5.01 114.28 103.02 1i0b n THR 194 Ca 0.00 -0.25 0.00 0.00 -2.27 0.00 0.00 64.05 61.53 1i0b n THR 194 Cb 0.85 0.31 0.00 0.00 -2.10 0.00 0.00 70.33 69.40 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 1.83 1.41 3.75 3.38 0.00 0.18 -4.65 105.19 111.09 1i0b n GLY 195 Ca -0.02 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.60 1i0b n GLY 195 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1i0b s VAL 196 N -3.13 3.65 0.86 1.61 1.01 -1.25 -0.08 120.40 123.06 1i0b s VAL 196 Ca 0.00 1.63 -0.12 0.00 0.00 0.00 0.00 61.98 63.49 1i0b s VAL 196 Cb 0.00 -4.04 0.11 0.00 0.00 0.00 0.00 36.38 32.45 1i0b s VAL 196 CO 0.00 0.38 1.11 -2.16 0.00 0.00 0.00 175.10 174.43 1i0b s PRO 197 N -1.27 1.57 -0.06 2.72 0.04 -1.26 -4.43 135.00 132.30 1i0b s PRO 197 Ca 0.44 0.52 0.04 0.00 0.04 0.00 0.00 61.00 62.05 1i0b s PRO 197 Cb -0.30 -1.87 -0.02 0.00 0.04 0.00 0.00 34.50 32.35 1i0b s PRO 197 CO 0.39 -1.95 -0.19 0.08 0.04 0.00 0.00 177.00 175.37 1i0b s VAL 198 N -3.17 2.65 0.03 -0.36 1.01 0.76 -1.31 120.40 120.01 1i0b s VAL 198 Ca 0.62 -0.86 0.05 0.00 0.00 0.00 0.00 61.98 61.80 1i0b s VAL 198 Cb -0.15 -2.02 -0.02 0.00 0.00 0.00 0.00 36.38 34.19 1i0b s VAL 198 CO 0.54 0.57 -0.15 0.28 0.00 0.00 0.00 175.10 176.34 1i0b s THR 199 N -0.35 1.20 0.17 3.92 -1.32 0.27 -0.92 115.64 118.61 1i0b s THR 199 Ca 0.03 -0.94 0.05 0.00 -1.21 0.00 0.00 61.69 59.62 1i0b s THR 199 Cb -0.12 -1.06 -0.05 0.00 -1.51 0.00 0.00 72.50 69.76 1i0b s THR 199 CO 0.02 0.11 -0.11 0.42 -2.21 0.00 0.00 174.62 172.85 1i0b s THR 200 N -0.72 1.33 -0.15 5.08 -4.23 -0.17 -1.74 115.64 115.04 1i0b s THR 200 Ca 0.03 -2.10 -0.10 0.00 -1.18 0.00 0.00 61.69 58.34 1i0b s THR 200 Cb -0.07 -1.93 -0.05 0.00 1.34 0.00 0.00 72.50 71.79 1i0b s THR 200 CO 0.01 -0.68 0.18 -2.28 -0.54 0.00 0.00 174.62 171.31 1i0b s HIS 201 N -3.23 3.52 0.15 3.99 2.46 -0.66 -1.01 115.29 120.51 1i0b s HIS 201 Ca 0.19 0.51 -0.00 0.00 0.47 0.00 0.00 55.06 56.22 1i0b s HIS 201 Cb 0.02 -2.12 -0.04 0.00 -0.13 0.00 0.00 32.58 30.31 1i0b s HIS 201 CO 0.03 0.48 0.05 0.95 -2.47 0.00 0.00 174.74 173.78 1i0b s THR 202 N -0.27 0.23 -0.83 0.89 -4.23 -1.21 -2.90 115.64 107.33 1i0b s THR 202 Ca 0.13 -1.93 -0.11 0.00 -1.18 0.00 0.00 61.69 58.60 1i0b s THR 202 Cb -0.12 -2.11 0.22 0.00 1.34 0.00 0.00 72.50 71.82 1i0b s THR 202 CO 0.03 -0.42 0.75 0.00 -0.54 0.00 0.00 174.62 174.44 1i0b s ALA 203 N -3.97 4.09 0.30 3.99 0.00 -1.26 -4.81 121.76 120.09 1i0b s ALA 203 Ca 0.26 -3.41 0.04 0.00 0.00 0.00 0.00 51.96 48.85 1i0b s ALA 203 Cb 0.07 -3.34 0.67 0.00 0.00 0.00 0.00 23.12 20.52 1i0b s ALA 203 CO 0.03 -2.24 1.80 0.00 0.00 0.00 0.00 175.76 175.36 1i0b h ALA 204 N 7.42 1.62 -0.35 0.00 0.00 -1.88 -1.69 119.26 124.38 1i0b h ALA 204 Ca 0.10 0.06 0.08 0.00 0.00 0.00 0.00 54.91 55.14 1i0b h ALA 204 Cb 0.99 -0.13 -0.08 0.00 0.00 0.00 0.00 17.79 18.57 1i0b h ALA 204 CO 0.78 0.06 -0.25 0.66 0.00 0.00 0.00 179.25 180.50 1i0b h SER 205 N 0.85 -0.82 0.25 0.00 4.64 -1.92 0.69 113.55 117.24 1i0b h SER 205 Ca 0.55 0.16 0.00 0.00 -0.47 0.00 0.00 61.79 62.03 1i0b h SER 205 Cb 0.74 0.40 0.00 0.00 -0.31 0.00 0.00 62.40 63.24 1i0b h SER 205 CO -0.34 -0.27 0.00 0.00 -0.87 0.00 0.00 176.83 175.35 1i0b n GLN 206 N -5.39 0.46 -2.65 4.77 6.02 -0.67 -4.90 117.38 115.02 1i0b n GLN 206 Ca 0.01 0.05 -0.16 0.00 -0.01 0.00 0.00 57.00 56.89 1i0b n GLN 206 Cb 0.30 -1.50 0.02 0.00 1.02 0.00 0.00 30.24 30.08 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 -1.17 -2.88 -0.20 -1.09 1.74 0.23 -4.87 116.66 108.42 1i0b n ARG 207 Ca 0.13 0.71 0.24 0.00 -0.77 0.00 0.00 57.85 58.16 1i0b n ARG 207 Cb 0.13 -5.08 0.63 0.00 -1.02 0.00 0.00 32.46 27.12 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 -0.70 0.17 -0.67 0.55 3.45 -1.77 -1.32 116.42 116.14 1i0b h ASP 208 Ca -0.39 0.02 0.17 0.00 0.43 0.00 0.00 57.03 57.26 1i0b h ASP 208 Cb 1.27 -0.01 -0.03 0.00 -0.56 0.00 0.00 39.33 40.00 1i0b h ASP 208 CO 0.43 0.06 0.46 1.23 -1.57 0.00 0.00 179.24 179.86 1i0b h GLY 209 N 0.17 0.25 0.92 2.75 0.00 -1.89 -1.49 103.07 103.78 1i0b h GLY 209 Ca 0.44 -0.06 -0.09 0.00 0.00 0.00 0.00 47.33 47.61 1i0b h GLY 209 CO -0.08 0.02 -0.19 0.83 0.00 0.00 0.00 176.54 177.11 1i0b h GLU 210 N 0.15 0.64 -0.27 4.80 5.08 -1.61 -1.38 114.58 121.97 1i0b h GLU 210 Ca 0.32 -0.30 -0.11 0.00 -1.00 0.00 0.00 59.36 58.27 1i0b h GLU 210 Cb 1.07 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 30.30 1i0b h GLU 210 CO -0.05 0.89 -0.29 0.37 -1.00 0.00 0.00 179.01 178.93 1i0b h GLN 211 N 0.38 0.56 -0.08 2.33 4.15 -1.52 -1.15 115.11 119.78 1i0b h GLN 211 Ca 0.06 -0.24 -0.00 0.00 0.77 0.00 0.00 58.65 59.24 1i0b h GLN 211 Cb 0.73 -0.02 -0.00 0.00 0.21 0.00 0.00 27.48 28.39 1i0b h GLN 211 CO 0.05 0.79 0.03 1.96 -1.93 0.00 0.00 178.83 179.74 1i0b h GLN 212 N 0.48 0.11 -0.72 1.69 4.20 -1.24 -1.47 115.11 118.17 1i0b h GLN 212 Ca 0.06 -0.02 0.04 0.00 0.06 0.00 0.00 58.65 58.79 1i0b h GLN 212 Cb 0.75 -0.02 -0.04 0.00 0.30 0.00 0.00 27.48 28.47 1i0b h GLN 212 CO 0.06 0.21 0.47 0.00 -0.67 0.00 0.00 178.83 178.91 1i0b h ALA 213 N 0.89 1.59 0.35 3.87 0.00 -1.12 0.91 119.26 125.75 1i0b h ALA 213 Ca 0.03 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 1i0b h ALA 213 Cb 0.14 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 17.69 1i0b h ALA 213 CO -0.00 0.33 -0.19 0.00 0.00 0.00 0.00 179.25 179.39 1i0b h ALA 214 N 1.58 -0.50 -0.47 0.00 0.00 -0.68 -0.41 119.26 118.78 1i0b h ALA 214 Ca 0.29 -0.10 -0.00 0.00 0.00 0.00 0.00 54.91 55.09 1i0b h ALA 214 Cb 0.07 0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.05 1i0b h ALA 214 CO -0.08 -0.78 0.28 0.82 0.00 0.00 0.00 179.25 179.49 1i0b h ILE 215 N -0.50 1.15 -0.33 0.00 2.04 -0.76 -1.77 117.51 117.33 1i0b h ILE 215 Ca -0.04 -0.33 0.03 0.00 1.00 0.00 0.00 64.86 65.52 1i0b h ILE 215 Cb 0.40 0.52 -0.03 0.00 -0.74 0.00 0.00 36.82 36.96 1i0b h ILE 215 CO 0.06 0.15 0.15 -0.26 0.00 0.00 0.00 178.15 178.25 1i0b h PHE 216 N 0.62 0.27 -0.14 1.37 0.05 -0.63 -2.58 116.94 115.90 1i0b h PHE 216 Ca 0.17 0.01 -0.04 0.00 3.82 0.00 0.00 57.97 61.93 1i0b h PHE 216 Cb -0.01 -0.07 -0.01 0.00 2.00 0.00 0.00 35.95 37.86 1i0b h PHE 216 CO -0.03 0.14 -0.12 0.93 -0.18 0.00 0.00 178.31 179.05 1i0b h GLU 217 N 0.31 0.22 0.00 1.51 5.08 -0.84 -0.87 114.58 119.98 1i0b h GLU 217 Ca 0.14 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.46 1i0b h GLU 217 Cb 0.07 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.29 1i0b h GLU 217 CO -0.11 0.34 0.00 -1.13 -1.00 0.00 0.00 179.01 177.11 1i0b n SER 218 N -4.30 0.00 -0.64 1.42 3.41 -0.68 -0.79 113.62 112.04 1i0b n SER 218 Ca -0.01 0.35 0.08 0.00 -0.26 0.00 0.00 58.87 59.04 1i0b n SER 218 Cb 0.25 -0.43 0.06 0.00 -0.26 0.00 0.00 64.21 63.83 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 -1.43 1.39 -0.66 4.33 -0.58 -0.37 -4.96 120.64 118.36 1i0b n GLU 219 Ca 0.05 -1.43 0.00 0.00 -0.42 0.00 0.00 57.16 55.36 1i0b n GLU 219 Cb 0.17 -1.32 0.00 0.00 -0.57 0.00 0.00 31.44 29.72 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 0.98 0.67 3.74 0.62 0.00 0.03 -4.91 105.19 106.31 1i0b n GLY 220 Ca 0.10 -0.02 -0.41 0.00 0.00 0.00 0.00 46.02 45.69 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 0.00 4.49 0.14 0.99 2.96 -0.96 -5.00 118.68 121.31 1i0b s LEU 221 Ca 0.00 2.11 -0.30 0.00 -0.22 0.00 0.00 54.13 55.72 1i0b s LEU 221 Cb 0.00 -3.61 -0.07 0.00 0.50 0.00 0.00 46.19 43.02 1i0b s LEU 221 CO 0.00 -0.23 0.97 -0.44 -1.32 0.00 0.00 176.35 175.34 1i0b s SER 222 N -0.15 7.50 0.56 3.68 0.01 -1.26 -4.39 113.70 119.66 1i0b s SER 222 Ca 0.49 1.86 0.25 0.00 1.31 0.00 0.00 55.95 59.86 1i0b s SER 222 Cb -0.30 -2.59 1.53 0.00 0.21 0.00 0.00 66.02 64.87 1i0b s SER 222 CO 0.35 -0.04 2.12 -0.65 0.41 0.00 0.00 173.24 175.43 1i0b h PRO 223 N 5.24 0.00 0.00 12.44 0.11 -1.86 -0.65 132.00 147.29 1i0b h PRO 223 Ca -0.43 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.68 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 0.71 0.00 0.00 -1.13 -0.21 0.00 0.00 178.00 177.37 1i0b n SER 224 N -4.12 0.34 -0.91 -2.05 3.41 -1.17 -1.08 113.62 108.05 1i0b n SER 224 Ca 0.01 0.60 0.12 0.00 -0.26 0.00 0.00 58.87 59.35 1i0b n SER 224 Cb 0.28 -0.67 0.23 0.00 -0.26 0.00 0.00 64.21 63.79 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 -1.90 2.23 -5.24 4.33 5.12 -0.25 -4.87 116.66 116.08 1i0b n ARG 225 Ca 0.02 -1.82 -0.31 0.00 -1.93 0.00 0.00 57.85 53.81 1i0b n ARG 225 Cb 0.15 -1.47 -0.16 0.00 -1.16 0.00 0.00 32.46 29.81 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 -1.80 1.99 -0.24 1.55 1.01 -0.24 -0.17 120.40 122.50 1i0b s VAL 226 Ca 0.34 -1.05 -0.02 0.00 0.00 0.00 0.00 61.98 61.25 1i0b s VAL 226 Cb 0.21 -1.67 0.02 0.00 0.00 0.00 0.00 36.38 34.94 1i0b s VAL 226 CO 0.31 0.56 -0.07 0.00 0.00 0.00 0.00 175.10 175.90 1i0b s ILE 228 N 1.33 4.48 0.58 0.00 -1.09 0.56 -1.00 121.20 126.06 1i0b s ILE 228 Ca 0.01 -0.07 -0.14 0.00 -2.23 0.00 0.00 60.65 58.21 1i0b s ILE 228 Cb -0.16 -4.53 -0.05 0.00 -1.58 0.00 0.00 42.46 36.14 1i0b s ILE 228 CO -0.05 -1.14 1.02 -0.83 -1.23 0.00 0.00 174.94 172.71 1i0b s GLY 229 N 3.05 1.94 -1.62 6.18 0.00 -0.18 -0.50 107.32 116.20 1i0b s GLY 229 Ca 0.25 0.17 0.00 0.00 0.00 0.00 0.00 44.72 45.14 1i0b s GLY 229 CO 0.15 0.46 0.00 1.42 0.00 0.00 0.00 173.10 175.13 1i0b n HIS 230 N -2.15 -0.79 0.28 1.90 8.25 -1.00 -3.28 115.22 118.42 1i0b n HIS 230 Ca 0.07 0.00 0.16 0.00 -0.26 0.00 0.00 57.72 57.69 1i0b n HIS 230 Cb 0.54 -3.58 0.80 0.00 1.12 0.00 0.00 29.99 28.86 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 0.00 0.41 0.02 -1.26 -1.94 113.55 110.78 1i0b h SER 231 Ca -0.43 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.52 1i0b h SER 231 Cb 1.31 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.85 1i0b h SER 231 CO 0.52 0.07 0.00 -0.90 -1.14 0.00 0.00 176.83 175.39 1i0b n ASP 232 N -3.38 0.00 -0.08 3.07 3.85 -1.25 -2.99 116.55 115.77 1i0b n ASP 232 Ca -0.01 -1.48 0.14 0.00 -0.71 0.00 0.00 54.79 52.73 1i0b n ASP 232 Cb 0.24 0.00 0.67 0.00 -1.35 0.00 0.00 41.12 40.68 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 -0.73 0.31 -4.13 -1.12 10.43 -0.73 -4.81 116.55 115.77 1i0b n ASP 233 Ca 0.11 -0.48 -0.20 0.00 2.57 0.00 0.00 54.79 56.79 1i0b n ASP 233 Cb 0.05 -0.13 -0.14 0.00 1.84 0.00 0.00 41.12 42.75 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 -2.47 1.06 -2.07 -3.53 -1.32 -1.16 -4.66 115.64 101.49 1i0b s THR 234 Ca 0.30 -0.91 0.26 0.00 -1.21 0.00 0.00 61.69 60.13 1i0b s THR 234 Cb 0.20 -0.95 0.28 0.00 -1.51 0.00 0.00 72.50 70.52 1i0b s THR 234 CO 0.46 0.04 1.51 0.47 -2.21 0.00 0.00 174.62 174.89 1i0b n ASP 235 N 2.05 1.45 -4.56 8.08 10.43 -1.26 -4.81 116.55 127.93 1i0b n ASP 235 Ca -0.17 -1.22 -0.26 0.00 2.57 0.00 0.00 54.79 55.71 1i0b n ASP 235 Cb 0.55 0.15 -0.05 0.00 1.84 0.00 0.00 41.12 43.61 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 -2.34 4.42 0.32 -2.24 -1.08 -1.26 -4.75 116.67 109.73 1i0b s ASP 236 Ca 0.27 0.32 0.25 0.00 -0.52 0.00 0.00 52.55 52.87 1i0b s ASP 236 Cb 0.20 -2.53 1.09 0.00 -1.46 0.00 0.00 42.92 40.21 1i0b s ASP 236 CO 0.47 -3.20 1.77 0.25 0.52 0.00 0.00 175.17 174.97 1i0b h LEU 237 N 20.16 0.00 0.08 -1.34 5.85 -2.00 -2.88 115.31 135.18 1i0b h LEU 237 Ca -0.10 0.00 -0.00 0.00 0.84 0.00 0.00 57.88 58.62 1i0b h LEU 237 Cb 1.11 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.14 1i0b h LEU 237 CO 1.11 0.00 -0.04 0.28 -0.34 0.00 0.00 178.44 179.46 1i0b h SER 238 N 0.00 -0.09 0.04 1.25 0.02 -1.99 -1.53 113.55 111.25 1i0b h SER 238 Ca 0.00 -0.39 0.03 0.00 -0.84 0.00 0.00 61.79 60.58 1i0b h SER 238 Cb 0.36 0.02 -0.04 0.00 0.14 0.00 0.00 62.40 62.88 1i0b h SER 238 CO 0.00 0.37 -0.27 0.22 -1.14 0.00 0.00 176.83 176.00 1i0b h TYR 239 N -0.57 -0.73 -0.62 3.45 -0.00 -1.91 -1.32 116.97 115.27 1i0b h TYR 239 Ca -0.01 0.02 -0.02 0.00 -0.00 0.00 0.00 58.73 58.72 1i0b h TYR 239 Cb 0.48 0.32 -0.03 0.00 -0.00 0.00 0.00 36.73 37.50 1i0b h TYR 239 CO 0.07 -0.37 0.29 -0.07 -0.00 0.00 0.00 178.16 178.09 1i0b h LEU 240 N -0.44 0.82 -0.90 2.82 3.38 -1.58 -2.77 115.31 116.64 1i0b h LEU 240 Ca 0.05 -0.14 -0.10 0.00 0.09 0.00 0.00 57.88 57.79 1i0b h LEU 240 Cb 0.50 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 41.03 1i0b h LEU 240 CO -0.21 0.73 -0.46 0.00 0.09 0.00 0.00 178.44 178.59 1i0b h THR 241 N 0.85 1.09 -0.55 0.22 1.03 -1.13 -1.57 112.91 112.86 1i0b h THR 241 Ca 0.21 -1.71 -0.11 0.00 -0.01 0.00 0.00 66.41 64.79 1i0b h THR 241 Cb 0.13 1.99 -0.02 0.00 -1.07 0.00 0.00 68.15 69.18 1i0b h THR 241 CO -0.03 0.45 -0.09 0.00 -0.01 0.00 0.00 175.52 175.84 1i0b h ALA 242 N 1.54 0.80 -0.03 0.00 0.00 -1.07 -1.56 119.26 118.94 1i0b h ALA 242 Ca -0.00 -0.34 -0.24 0.00 0.00 0.00 0.00 54.91 54.32 1i0b h ALA 242 Cb 0.95 -0.20 0.01 0.00 0.00 0.00 0.00 17.79 18.55 1i0b h ALA 242 CO 0.06 0.67 -0.95 -0.07 0.00 0.00 0.00 179.25 178.96 1i0b h LEU 243 N 0.91 0.79 -1.32 0.00 3.38 -1.39 -3.04 115.31 114.65 1i0b h LEU 243 Ca 0.14 -0.60 -0.02 0.00 0.09 0.00 0.00 57.88 57.49 1i0b h LEU 243 Cb 0.66 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 41.14 1i0b h LEU 243 CO 0.05 1.40 0.19 0.00 0.09 0.00 0.00 178.44 180.16 1i0b h ALA 244 N 0.56 1.46 -0.74 1.53 0.00 -1.18 -2.31 119.26 118.59 1i0b h ALA 244 Ca -0.10 -0.12 -0.04 0.00 0.00 0.00 0.00 54.91 54.66 1i0b h ALA 244 Cb 1.58 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 19.15 1i0b h ALA 244 CO 0.18 0.41 0.32 0.00 0.00 0.00 0.00 179.25 180.17 1i0b h ALA 245 N 1.56 0.96 0.00 0.00 0.00 -1.30 -1.97 119.26 118.50 1i0b h ALA 245 Ca 0.16 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1i0b h ALA 245 Cb 0.13 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 17.63 1i0b h ALA 245 CO -0.02 0.55 0.00 0.54 0.00 0.00 0.00 179.25 180.33 1i0b n ARG 246 N -4.37 0.15 0.00 0.00 1.74 -0.95 -4.89 116.66 108.35 1i0b n ARG 246 Ca 0.06 0.26 0.00 0.00 -0.77 0.00 0.00 57.85 57.40 1i0b n ARG 246 Cb 0.16 -1.73 0.00 0.00 -1.02 0.00 0.00 32.46 29.87 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 0.66 0.87 3.78 -0.13 0.00 -0.74 -4.78 105.19 104.85 1i0b n GLY 247 Ca 0.04 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.76 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 -2.00 2.73 -0.11 1.61 1.51 -0.91 -3.02 117.35 117.15 1i0b s TYR 248 Ca 0.00 1.40 -0.07 0.00 -1.01 0.00 0.00 57.07 57.39 1i0b s TYR 248 Cb 0.00 -3.03 -0.04 0.00 -0.11 0.00 0.00 41.96 38.78 1i0b s TYR 248 CO 0.00 -1.73 0.16 -0.51 -1.11 0.00 0.00 175.55 172.35 1i0b s LEU 249 N -5.84 4.39 -0.22 -1.29 1.02 0.36 -4.51 118.68 112.60 1i0b s LEU 249 Ca 0.61 0.50 -0.05 0.00 0.02 0.00 0.00 54.13 55.20 1i0b s LEU 249 Cb -0.16 -2.10 -0.02 0.00 0.02 0.00 0.00 46.19 43.92 1i0b s LEU 249 CO 0.56 0.40 0.01 -0.63 0.02 0.00 0.00 176.35 176.71 1i0b s ILE 250 N -1.04 3.92 -0.57 -0.59 -1.09 0.34 -0.33 121.20 121.85 1i0b s ILE 250 Ca 0.16 -0.32 -0.21 0.00 -2.23 0.00 0.00 60.65 58.05 1i0b s ILE 250 Cb -0.12 -2.79 0.06 0.00 -1.58 0.00 0.00 42.46 38.03 1i0b s ILE 250 CO 0.05 0.40 0.82 -0.83 -1.23 0.00 0.00 174.94 174.15 1i0b s GLY 251 N 1.25 1.56 -1.13 6.18 0.00 0.34 -1.98 107.32 113.55 1i0b s GLY 251 Ca 0.04 -1.69 -0.10 0.00 0.00 0.00 0.00 44.72 42.97 1i0b s GLY 251 CO 0.01 1.81 1.17 1.08 0.00 0.00 0.00 173.10 177.17 1i0b s LEU 252 N 3.41 6.15 -0.10 0.66 1.43 0.47 -1.07 118.68 129.63 1i0b s LEU 252 Ca 0.21 -3.53 0.14 0.00 -1.03 0.00 0.00 54.13 49.92 1i0b s LEU 252 Cb -0.17 -2.24 0.32 0.00 0.03 0.00 0.00 46.19 44.13 1i0b s LEU 252 CO 0.13 -0.35 1.23 -0.90 0.23 0.00 0.00 176.35 176.69 1i0b n ASP 253 N 3.11 2.90 -0.01 2.29 3.85 -1.26 -1.80 116.55 125.64 1i0b n ASP 253 Ca 0.26 -2.70 0.02 0.00 -0.71 0.00 0.00 54.79 51.66 1i0b n ASP 253 Cb 0.40 -0.36 0.02 0.00 -1.35 0.00 0.00 41.12 39.83 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 -0.64 0.00 -0.25 2.11 8.25 -1.24 -2.18 115.22 121.26 1i0b n HIS 254 Ca 0.14 -0.58 -0.02 0.00 -0.26 0.00 0.00 57.72 57.00 1i0b n HIS 254 Cb 0.62 -0.07 0.00 0.00 1.12 0.00 0.00 29.99 31.67 1i0b n HIS 254 CO 0.00 0.00 0.00 -0.89 0.64 0.00 0.00 176.34 176.09 1i0b n ILE 255 N -0.64 -0.37 1.65 1.59 2.08 -1.25 0.51 119.36 122.92 1i0b n ILE 255 Ca 0.02 1.53 0.14 0.00 0.56 0.00 0.00 62.75 65.01 1i0b n ILE 255 Cb 0.31 -1.99 0.81 0.00 -0.75 0.00 0.00 39.64 38.02 1i0b n ILE 255 CO 0.00 0.00 0.00 -0.81 0.56 0.00 0.00 176.55 176.30 1i0b n PRO 256 N -4.92 0.76 -2.50 0.38 -0.04 -1.26 -4.23 135.00 123.19 1i0b n PRO 256 Ca 0.05 0.01 -0.43 0.00 -0.04 0.00 0.00 63.50 63.09 1i0b n PRO 256 Cb 0.24 -1.50 -0.02 0.00 -0.04 0.00 0.00 33.50 32.18 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 -2.16 2.73 -0.21 0.54 3.76 0.18 -4.80 115.29 115.33 1i0b s HIS 257 Ca 0.38 0.82 -0.15 0.00 -0.15 0.00 0.00 55.06 55.96 1i0b s HIS 257 Cb 0.19 -4.16 0.06 0.00 1.11 0.00 0.00 32.58 29.79 1i0b s HIS 257 CO 0.35 -1.49 0.52 0.45 -0.85 0.00 0.00 174.74 173.73 1i0b s SER 258 N 2.80 -0.63 -0.10 1.40 0.15 -1.25 -4.74 113.70 111.34 1i0b s SER 258 Ca 0.53 1.11 0.17 0.00 0.70 0.00 0.00 55.95 58.46 1i0b s SER 258 Cb -0.12 1.04 0.62 0.00 -1.71 0.00 0.00 66.02 65.86 1i0b s SER 258 CO 0.27 -0.20 1.54 0.00 1.20 0.00 0.00 173.24 176.05 1i0b n ALA 259 N 3.64 2.88 -1.71 5.45 0.00 0.11 -4.91 120.51 125.96 1i0b n ALA 259 Ca -0.18 -1.60 -0.43 0.00 0.00 0.00 0.00 53.44 51.23 1i0b n ALA 259 Cb 0.57 -0.87 -0.03 0.00 0.00 0.00 0.00 19.45 19.12 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 0.84 0.18 -0.19 0.00 5.41 -1.26 -0.67 119.36 123.68 1i0b n ILE 260 Ca 0.23 -0.05 0.00 0.00 1.00 0.00 0.00 62.75 63.93 1i0b n ILE 260 Cb 0.80 -1.89 0.00 0.00 -0.71 0.00 0.00 39.64 37.83 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 3.55 1.00 0.75 7.39 0.00 -1.26 -4.81 105.19 111.81 1i0b n GLY 261 Ca 0.15 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.22 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 1.42 -0.03 0.99 4.32 0.16 -4.80 117.00 119.05 1i0b n LEU 262 Ca 0.00 -2.41 0.24 0.00 -0.02 0.00 0.00 56.01 53.82 1i0b n LEU 262 Cb 0.00 -0.21 0.64 0.00 -1.62 0.00 0.00 43.42 42.23 1i0b n LEU 262 CO 0.00 0.69 1.21 -0.33 -1.22 0.00 0.00 177.39 177.75 1i0b h GLU 263 N 0.54 0.00 0.00 3.23 3.07 -1.85 0.90 114.58 120.48 1i0b h GLU 263 Ca -0.07 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.79 1i0b h GLU 263 Cb 1.38 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.29 1i0b h GLU 263 CO 0.03 0.00 0.00 -0.40 -1.40 0.00 0.00 179.01 177.24 1i0b n ASP 264 N -3.53 0.00 -4.06 1.42 5.68 -1.26 -4.44 116.55 110.35 1i0b n ASP 264 Ca 0.14 -0.94 -0.35 0.00 -0.50 0.00 0.00 54.79 53.14 1i0b n ASP 264 Cb 0.97 0.00 -0.10 0.00 -1.14 0.00 0.00 41.12 40.85 1i0b n ASP 264 CO 0.00 0.00 0.00 0.21 -1.33 0.00 0.00 177.20 176.08 1i0b s ASN 265 N -1.99 5.20 0.27 -1.12 3.84 0.31 -4.96 114.94 116.49 1i0b s ASN 265 Ca 0.44 -3.14 -0.08 0.00 0.21 0.00 0.00 52.86 50.30 1i0b s ASN 265 Cb 0.20 -1.81 0.46 0.00 -0.55 0.00 0.00 41.25 39.55 1i0b s ASN 265 CO 0.34 -0.29 1.58 0.00 -2.79 0.00 0.00 177.10 175.94 1i0b h ALA 266 N 6.61 0.70 -0.39 1.71 0.00 -1.81 0.11 119.26 126.18 1i0b h ALA 266 Ca 0.02 0.35 -0.08 0.00 0.00 0.00 0.00 54.91 55.20 1i0b h ALA 266 Cb 0.90 0.67 -0.02 0.00 0.00 0.00 0.00 17.79 19.34 1i0b h ALA 266 CO 0.73 -0.42 -0.09 0.66 0.00 0.00 0.00 179.25 180.14 1i0b h SER 267 N 0.01 0.66 -0.09 0.00 4.64 -1.95 -1.60 113.55 115.21 1i0b h SER 267 Ca 0.46 -0.18 -0.15 0.00 -0.47 0.00 0.00 61.79 61.45 1i0b h SER 267 Cb 0.75 -0.18 0.01 0.00 -0.31 0.00 0.00 62.40 62.68 1i0b h SER 267 CO -0.93 0.79 -0.54 0.00 -0.87 0.00 0.00 176.83 175.28 1i0b h ALA 268 N 1.28 0.19 -0.69 5.18 0.00 -1.30 -2.32 119.26 121.60 1i0b h ALA 268 Ca 0.11 -0.52 -0.03 0.00 0.00 0.00 0.00 54.91 54.47 1i0b h ALA 268 Cb 0.53 -0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.28 1i0b h ALA 268 CO 0.03 0.40 0.30 0.77 0.00 0.00 0.00 179.25 180.75 1i0b h SER 269 N 0.12 0.90 -0.85 0.00 0.02 -0.85 0.38 113.55 113.27 1i0b h SER 269 Ca -0.04 -0.11 0.01 0.00 -0.84 0.00 0.00 61.79 60.81 1i0b h SER 269 Cb 1.19 -0.23 -0.04 0.00 0.14 0.00 0.00 62.40 63.46 1i0b h SER 269 CO 0.11 0.79 0.56 0.00 -1.14 0.00 0.00 176.83 177.15 1i0b h ALA 270 N 1.35 1.08 0.22 3.77 0.00 -1.26 0.15 119.26 124.58 1i0b h ALA 270 Ca 0.23 -0.06 -0.32 0.00 0.00 0.00 0.00 54.91 54.76 1i0b h ALA 270 Cb 0.15 -0.34 0.03 0.00 0.00 0.00 0.00 17.79 17.62 1i0b h ALA 270 CO -0.03 0.48 -1.50 1.25 0.00 0.00 0.00 179.25 179.46 1i0b h LEU 271 N 1.15 0.72 0.00 0.00 5.85 -0.74 -3.39 115.31 118.90 1i0b h LEU 271 Ca 0.31 -0.93 -0.24 0.00 0.84 0.00 0.00 57.88 57.87 1i0b h LEU 271 Cb -0.12 -0.24 -0.04 0.00 0.37 0.00 0.00 40.66 40.63 1i0b h LEU 271 CO -0.07 1.70 -1.58 0.18 -0.34 0.00 0.00 178.44 178.33 1i0b n LEU 272 N -3.74 0.88 0.00 2.25 4.77 0.12 -5.04 117.00 116.25 1i0b n LEU 272 Ca -0.19 0.41 0.00 0.00 -0.03 0.00 0.00 56.01 56.19 1i0b n LEU 272 Cb 1.06 0.13 0.00 0.00 -2.33 0.00 0.00 43.42 42.28 1i0b n LEU 272 CO 0.56 0.29 0.00 0.61 -1.33 0.00 0.00 177.39 177.51 1i0b n GLY 273 N 1.49 -2.69 0.03 -0.72 0.00 0.54 -3.82 105.19 100.01 1i0b n GLY 273 Ca -0.14 -1.66 0.03 0.00 0.00 0.00 0.00 46.02 44.25 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 -0.71 1.15 -3.08 -0.61 -5.35 -1.26 0.05 119.36 109.55 1i0b n ILE 274 Ca 0.00 -1.24 -0.35 0.00 -0.27 0.00 0.00 62.75 60.89 1i0b n ILE 274 Cb 0.00 0.34 -0.06 0.00 -1.74 0.00 0.00 39.64 38.18 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 -1.39 4.22 0.68 6.28 0.52 -1.26 -4.76 118.95 123.24 1i0b s ARG 275 Ca 0.08 0.87 -0.11 0.00 -0.52 0.00 0.00 55.73 56.05 1i0b s ARG 275 Cb 0.07 -2.76 -0.00 0.00 0.52 0.00 0.00 34.95 32.78 1i0b s ARG 275 CO 0.01 0.33 1.06 -1.54 0.02 0.00 0.00 175.30 175.17 1i0b s SER 276 N -1.79 5.59 0.33 0.23 1.04 -1.26 -4.58 113.70 113.26 1i0b s SER 276 Ca 0.46 1.48 0.03 0.00 0.48 0.00 0.00 55.95 58.40 1i0b s SER 276 Cb -0.15 -2.40 0.56 0.00 0.10 0.00 0.00 66.02 64.13 1i0b s SER 276 CO 0.20 -1.29 1.89 4.11 0.98 0.00 0.00 173.24 179.13 1i0b h TRP 277 N -0.61 0.66 -0.55 5.02 5.08 -1.85 -2.03 115.95 121.66 1i0b h TRP 277 Ca -0.44 -0.05 -0.07 0.00 1.08 0.00 0.00 58.89 59.41 1i0b h TRP 277 Cb 1.21 -0.20 -0.02 0.00 -3.00 0.00 0.00 29.16 27.15 1i0b h TRP 277 CO 0.61 0.57 0.07 1.96 -1.28 0.00 0.00 178.44 180.37 1i0b h GLN 278 N 0.63 0.89 -0.21 0.12 7.50 -1.92 0.28 115.11 122.40 1i0b h GLN 278 Ca 0.14 -0.22 -0.00 0.00 0.50 0.00 0.00 58.65 59.07 1i0b h GLN 278 Cb 0.25 -0.11 -0.01 0.00 0.05 0.00 0.00 27.48 27.66 1i0b h GLN 278 CO -0.00 0.85 0.13 1.15 -1.50 0.00 0.00 178.83 179.45 1i0b h THR 279 N 0.84 1.09 -0.13 -0.54 2.02 -1.81 0.21 112.91 114.60 1i0b h THR 279 Ca 0.17 -0.22 -0.01 0.00 0.77 0.00 0.00 66.41 67.12 1i0b h THR 279 Cb 0.41 0.85 -0.01 0.00 -1.74 0.00 0.00 68.15 67.66 1i0b h THR 279 CO 0.01 0.09 0.05 0.03 0.37 0.00 0.00 175.52 176.07 1i0b h ARG 280 N 0.26 0.20 -0.98 6.66 3.08 -1.06 -2.75 114.38 119.80 1i0b h ARG 280 Ca 0.08 -0.04 0.10 0.00 0.07 0.00 0.00 59.98 60.19 1i0b h ARG 280 Cb 0.03 -0.03 -0.07 0.00 0.08 0.00 0.00 29.97 29.97 1i0b h ARG 280 CO -0.01 0.32 0.62 0.00 -1.07 0.00 0.00 179.97 179.83 1i0b h ALA 281 N 0.88 1.52 -0.09 0.04 0.00 -0.17 0.39 119.26 121.83 1i0b h ALA 281 Ca 0.04 0.00 0.03 0.00 0.00 0.00 0.00 54.91 54.98 1i0b h ALA 281 Cb 0.19 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 17.74 1i0b h ALA 281 CO -0.00 0.27 0.19 -0.07 0.00 0.00 0.00 179.25 179.64 1i0b h LEU 282 N 1.01 0.00 -1.63 0.00 3.38 -0.26 -0.37 115.31 117.43 1i0b h LEU 282 Ca 0.46 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.41 1i0b h LEU 282 Cb 0.39 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.13 1i0b h LEU 282 CO -0.22 0.00 0.02 -0.07 0.09 0.00 0.00 178.44 178.26 1i0b h LEU 283 N 0.00 0.22 -0.15 1.67 3.38 -0.89 -1.85 115.31 117.70 1i0b h LEU 283 Ca 0.04 -0.02 -0.00 0.00 0.09 0.00 0.00 57.88 57.99 1i0b h LEU 283 Cb 0.43 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 41.11 1i0b h LEU 283 CO -0.00 0.25 0.08 0.40 0.09 0.00 0.00 178.44 179.26 1i0b h ILE 284 N 0.25 1.11 -0.55 1.22 2.04 -1.19 -0.94 117.51 119.45 1i0b h ILE 284 Ca 0.06 -0.31 -0.03 0.00 1.00 0.00 0.00 64.86 65.57 1i0b h ILE 284 Cb 0.14 1.05 -0.02 0.00 -0.74 0.00 0.00 36.82 37.24 1i0b h ILE 284 CO 0.00 0.10 0.22 0.50 0.00 0.00 0.00 178.15 178.97 1i0b h LYS 285 N 0.13 0.82 -0.42 2.37 3.64 -1.51 0.33 116.57 121.94 1i0b h LYS 285 Ca 0.05 -0.15 0.05 0.00 -1.27 0.00 0.00 60.65 59.33 1i0b h LYS 285 Cb 0.10 -0.13 -0.04 0.00 -0.41 0.00 0.00 32.23 31.74 1i0b h LYS 285 CO -0.01 0.72 0.17 0.00 -2.27 0.00 0.00 179.45 178.06 1i0b h ALA 286 N 1.07 0.50 -0.52 5.00 0.00 -1.20 0.55 119.26 124.65 1i0b h ALA 286 Ca 0.18 0.04 -0.09 0.00 0.00 0.00 0.00 54.91 55.04 1i0b h ALA 286 Cb 0.20 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.97 1i0b h ALA 286 CO -0.01 -0.21 -0.03 -0.07 0.00 0.00 0.00 179.25 178.92 1i0b h LEU 287 N 0.35 0.89 -0.10 0.00 3.38 -0.91 -1.02 115.31 117.90 1i0b h LEU 287 Ca 0.19 -0.25 0.00 0.00 0.09 0.00 0.00 57.88 57.91 1i0b h LEU 287 Cb 0.15 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.66 1i0b h LEU 287 CO -0.17 0.97 0.07 0.40 0.09 0.00 0.00 178.44 179.79 1i0b h ILE 288 N 0.84 1.02 -0.35 1.22 2.04 0.43 -0.20 117.51 122.51 1i0b h ILE 288 Ca 0.15 -0.05 0.03 0.00 1.00 0.00 0.00 64.86 66.00 1i0b h ILE 288 Cb 0.54 0.87 -0.02 0.00 -0.74 0.00 0.00 36.82 37.48 1i0b h ILE 288 CO 0.03 0.02 0.23 0.44 0.00 0.00 0.00 178.15 178.88 1i0b h ASP 289 N 0.14 0.29 -0.01 1.72 3.45 0.43 -0.40 116.42 122.03 1i0b h ASP 289 Ca 0.04 -0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.50 1i0b h ASP 289 Cb -0.01 -0.07 0.00 0.00 -0.56 0.00 0.00 39.33 38.69 1i0b h ASP 289 CO -0.01 0.20 0.00 0.00 -1.57 0.00 0.00 179.24 177.86 1i0b n GLN 290 N -4.49 1.14 -0.68 3.56 1.13 -0.42 -4.91 117.38 112.72 1i0b n GLN 290 Ca 0.03 -0.20 0.00 0.00 -1.94 0.00 0.00 57.00 54.89 1i0b n GLN 290 Cb 0.17 -1.42 0.00 0.00 0.11 0.00 0.00 30.24 29.10 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 0.97 0.63 2.16 1.08 0.00 -0.16 -5.01 105.19 104.86 1i0b n GLY 291 Ca 0.20 -0.29 -0.29 0.00 0.00 0.00 0.00 46.02 45.64 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 -2.68 2.94 0.28 1.61 4.01 -0.11 -4.72 117.16 118.49 1i0b n TYR 292 Ca 0.00 -2.62 0.13 0.00 -0.16 0.00 0.00 57.90 55.24 1i0b n TYR 292 Cb 0.00 -1.06 0.80 0.00 -0.31 0.00 0.00 39.34 38.77 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 1.89 0.00 -0.02 -0.72 -0.00 -1.78 -1.51 114.93 112.78 1i0b h MET 293 Ca 0.52 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 60.22 1i0b h MET 293 Cb 1.24 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 32.84 1i0b h MET 293 CO 1.25 0.05 0.00 1.63 -0.00 0.00 0.00 176.91 179.84 1i0b n LYS 294 N -3.92 1.14 -0.02 -0.10 5.02 -1.26 -3.45 118.16 115.57 1i0b n LYS 294 Ca -0.03 -0.20 0.02 0.00 -2.02 0.00 0.00 58.31 56.08 1i0b n LYS 294 Cb 0.14 -1.36 0.03 0.00 -0.02 0.00 0.00 35.03 33.82 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 -0.63 2.60 -3.93 1.97 1.13 -0.57 -4.90 117.38 113.04 1i0b n GLN 295 Ca 0.17 -1.75 -0.36 0.00 -1.94 0.00 0.00 57.00 53.11 1i0b n GLN 295 Cb 0.13 -1.12 -0.07 0.00 0.11 0.00 0.00 30.24 29.29 1i0b n GLN 295 CO 0.00 0.00 0.00 0.42 -1.44 0.00 0.00 177.06 176.04 1i0b s ILE 296 N -1.44 5.33 -0.08 5.09 1.01 -1.22 -0.50 121.20 129.39 1i0b s ILE 296 Ca 0.08 0.14 0.02 0.00 0.00 0.00 0.00 60.65 60.88 1i0b s ILE 296 Cb 0.07 -3.32 0.02 0.00 0.01 0.00 0.00 42.46 39.23 1i0b s ILE 296 CO 0.01 0.60 -0.11 -0.76 0.00 0.00 0.00 174.94 174.67 1i0b s LEU 297 N -0.84 1.56 0.01 2.97 1.43 -0.84 -4.83 118.68 118.15 1i0b s LEU 297 Ca 0.14 -0.31 0.06 0.00 -1.03 0.00 0.00 54.13 52.99 1i0b s LEU 297 Cb -0.12 -0.84 -0.03 0.00 0.03 0.00 0.00 46.19 45.23 1i0b s LEU 297 CO 0.03 0.00 -0.15 -0.69 0.23 0.00 0.00 176.35 175.77 1i0b s VAL 298 N 0.89 3.00 0.21 -1.59 1.01 -1.26 -0.40 120.40 122.27 1i0b s VAL 298 Ca -0.10 -1.01 -0.11 0.00 0.00 0.00 0.00 61.98 60.76 1i0b s VAL 298 Cb -0.15 -2.25 0.04 0.00 0.00 0.00 0.00 36.38 34.02 1i0b s VAL 298 CO 0.01 0.40 0.57 -0.24 0.00 0.00 0.00 175.10 175.84 1i0b n SER 299 N 1.72 -1.39 -0.00 3.32 2.88 -0.74 -3.96 113.62 115.44 1i0b n SER 299 Ca -0.16 -1.90 0.03 0.00 -1.33 0.00 0.00 58.87 55.52 1i0b n SER 299 Cb 0.52 2.30 -0.05 0.00 -0.75 0.00 0.00 64.21 66.23 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 -1.25 3.03 -3.69 -3.46 3.02 -1.22 -3.70 115.26 107.99 1i0b n ASN 300 Ca -0.04 -0.08 -0.23 0.00 -0.03 0.00 0.00 54.58 54.20 1i0b n ASN 300 Cb 0.39 1.28 0.05 0.00 -0.61 0.00 0.00 39.78 40.88 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 -1.67 -2.71 -4.84 6.41 4.64 -0.24 -4.57 116.55 113.56 1i0b n ASP 301 Ca -0.01 -0.75 -0.22 0.00 -1.38 0.00 0.00 54.79 52.44 1i0b n ASP 301 Cb 0.17 -4.31 0.07 0.00 -1.04 0.00 0.00 41.12 36.01 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 -3.50 2.05 0.11 -0.67 -0.11 -1.26 -4.89 118.94 110.68 1i0b s TRP 302 Ca 0.22 -0.25 -0.26 0.00 1.22 0.00 0.00 56.10 57.03 1i0b s TRP 302 Cb -0.10 -2.78 0.07 0.00 -1.50 0.00 0.00 33.47 29.16 1i0b s TRP 302 CO 0.79 -1.29 0.86 -0.48 -4.62 0.00 0.00 176.95 172.21 1i0b s LEU 303 N -4.91 -0.31 -0.01 5.86 0.05 -1.25 -1.58 118.68 116.54 1i0b s LEU 303 Ca 0.62 -0.23 0.14 0.00 0.05 0.00 0.00 54.13 54.71 1i0b s LEU 303 Cb -0.07 2.23 -0.18 0.00 -2.05 0.00 0.00 46.19 46.12 1i0b s LEU 303 CO 0.41 -0.86 0.53 0.49 -0.55 0.00 0.00 176.35 176.37 1i0b n PHE 304 N -0.38 0.00 -3.78 3.48 3.72 -0.18 -4.98 117.46 115.34 1i0b n PHE 304 Ca -0.08 0.00 -0.13 0.00 -0.05 0.00 0.00 57.45 57.19 1i0b n PHE 304 Cb 0.61 -0.10 -0.10 0.00 -0.94 0.00 0.00 39.48 38.96 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 -2.76 -0.15 -0.33 1.37 0.00 -1.21 -4.93 107.32 99.31 1i0b s GLY 305 Ca 0.02 0.46 0.03 0.00 0.00 0.00 0.00 44.72 45.23 1i0b s GLY 305 CO 0.60 0.30 0.41 -0.12 0.00 0.00 0.00 173.10 174.29 1i0b s PHE 306 N -0.75 -0.78 -0.28 1.90 5.36 -1.25 -1.00 117.98 121.18 1i0b s PHE 306 Ca -0.08 -0.15 0.22 0.00 -0.96 0.00 0.00 56.93 55.96 1i0b s PHE 306 Cb -0.04 -0.22 -0.21 0.00 -0.34 0.00 0.00 43.02 42.20 1i0b s PHE 306 CO 0.02 -1.00 0.71 -1.13 -1.46 0.00 0.00 175.22 172.36 1i0b n SER 307 N 4.84 0.35 -0.70 6.13 3.41 0.16 -4.36 113.62 123.46 1i0b n SER 307 Ca 0.05 -0.11 0.00 0.00 -0.26 0.00 0.00 58.87 58.55 1i0b n SER 307 Cb 0.48 1.44 0.00 0.00 -0.26 0.00 0.00 64.21 65.87 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 -2.18 1.64 -1.32 4.04 3.41 -1.19 -4.79 113.62 113.23 1i0b n SER 308 Ca -0.01 -1.84 -0.02 0.00 -0.26 0.00 0.00 58.87 56.73 1i0b n SER 308 Cb 0.51 -0.46 -0.01 0.00 -0.26 0.00 0.00 64.21 64.00 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 0.24 -0.46 -1.46 7.33 9.36 -1.26 -5.07 117.16 125.83 1i0b n TYR 309 Ca 0.00 -0.38 -0.34 0.00 3.32 0.00 0.00 57.90 60.50 1i0b n TYR 309 Cb 0.32 0.07 0.09 0.00 -0.63 0.00 0.00 39.34 39.19 1i0b n TYR 309 CO 0.00 0.00 0.00 0.14 0.22 0.00 0.00 176.86 177.22 1i0b s VAL 310 N -2.41 2.30 0.32 2.97 -7.23 -1.26 -4.91 120.40 110.18 1i0b s VAL 310 Ca 0.05 0.15 -0.29 0.00 -1.81 0.00 0.00 61.98 60.08 1i0b s VAL 310 Cb -0.00 -2.75 -0.12 0.00 0.56 0.00 0.00 36.38 34.08 1i0b s VAL 310 CO 0.04 -0.08 1.53 0.41 -0.31 0.00 0.00 175.10 176.69 1i0b n THR 311 N -2.65 1.40 -0.58 5.32 -1.04 -1.26 -2.59 114.28 112.88 1i0b n THR 311 Ca 0.14 -0.35 0.00 0.00 -2.04 0.00 0.00 64.05 61.80 1i0b n THR 311 Cb 0.50 -1.92 0.00 0.00 -1.82 0.00 0.00 70.33 67.09 1i0b n THR 311 CO 0.00 0.00 0.00 0.59 -0.64 0.00 0.00 175.07 175.02 1i0b n ASN 312 N 1.52 0.00 -0.25 8.00 5.03 -1.26 -4.90 115.26 123.40 1i0b n ASN 312 Ca 0.06 0.00 0.13 0.00 0.87 0.00 0.00 54.58 55.64 1i0b n ASN 312 Cb 0.37 0.00 0.41 0.00 -1.02 0.00 0.00 39.78 39.54 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 0.80 -0.74 2.41 6.09 -1.82 -0.17 117.51 124.09 1i0b h ILE 313 Ca 0.00 -0.21 0.07 0.00 -1.37 0.00 0.00 64.86 63.35 1i0b h ILE 313 Cb 0.00 0.13 -0.06 0.00 0.47 0.00 0.00 36.82 37.36 1i0b h ILE 313 CO 0.00 0.11 0.42 -0.03 -3.07 0.00 0.00 178.15 175.59 1i0b h MET 314 N 0.62 0.74 -0.52 2.19 4.05 -1.85 0.10 114.93 120.25 1i0b h MET 314 Ca 0.44 -0.04 -0.10 0.00 -0.28 0.00 0.00 59.70 59.72 1i0b h MET 314 Cb 0.80 -0.17 -0.02 0.00 -0.80 0.00 0.00 31.60 31.42 1i0b h MET 314 CO -0.19 0.49 -0.06 -0.44 0.23 0.00 0.00 176.91 176.94 1i0b h ASP 315 N 0.76 0.92 -0.22 1.39 3.32 -1.45 0.55 116.42 121.69 1i0b h ASP 315 Ca 0.34 -0.27 -0.02 0.00 0.02 0.00 0.00 57.03 57.10 1i0b h ASP 315 Cb 0.23 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 39.52 1i0b h ASP 315 CO -0.20 1.01 0.07 0.58 -1.72 0.00 0.00 179.24 178.99 1i0b h VAL 316 N 0.85 1.18 -0.67 -1.35 2.07 -0.86 -2.24 116.25 115.23 1i0b h VAL 316 Ca 0.15 -0.56 -0.02 0.00 0.82 0.00 0.00 66.70 67.09 1i0b h VAL 316 Cb 0.58 1.15 -0.03 0.00 -1.52 0.00 0.00 31.29 31.47 1i0b h VAL 316 CO 0.04 0.18 0.36 0.24 0.02 0.00 0.00 177.57 178.40 1i0b h MET 317 N 0.18 0.94 0.00 1.57 2.86 -0.52 -1.66 114.93 118.30 1i0b h MET 317 Ca 0.07 -0.12 -0.04 0.00 -2.06 0.00 0.00 59.70 57.56 1i0b h MET 317 Cb 0.21 -0.18 -0.01 0.00 0.06 0.00 0.00 31.60 31.68 1i0b h MET 317 CO -0.00 0.72 -0.18 -0.44 1.06 0.00 0.00 176.91 178.06 1i0b h ASP 318 N 0.92 0.00 -0.03 1.22 3.45 -0.77 -0.55 116.42 120.66 1i0b h ASP 318 Ca 0.23 0.00 -0.23 0.00 0.43 0.00 0.00 57.03 57.46 1i0b h ASP 318 Cb 0.06 0.00 0.01 0.00 -0.56 0.00 0.00 39.33 38.84 1i0b h ASP 318 CO -0.04 0.18 -0.86 0.03 -1.57 0.00 0.00 179.24 176.98 1i0b h ARG 319 N 0.00 0.71 -0.28 3.56 3.08 -0.76 -2.52 114.38 118.17 1i0b h ARG 319 Ca -0.00 -0.64 -0.02 0.00 0.07 0.00 0.00 59.98 59.39 1i0b h ARG 319 Cb 0.35 0.15 -0.01 0.00 0.08 0.00 0.00 29.97 30.54 1i0b h ARG 319 CO 0.02 1.24 0.09 0.28 -1.07 0.00 0.00 179.97 180.53 1i0b h VAL 320 N 0.46 1.19 -2.75 2.04 2.07 -0.77 -3.38 116.25 115.11 1i0b h VAL 320 Ca -0.08 -0.62 -0.60 0.00 0.82 0.00 0.00 66.70 66.22 1i0b h VAL 320 Cb 1.50 1.08 -0.40 0.00 -1.52 0.00 0.00 31.29 31.95 1i0b h VAL 320 CO 0.17 0.21 -0.80 0.21 0.02 0.00 0.00 177.57 177.38 1i0b s ASN 321 N -5.76 3.06 0.57 0.57 2.47 -0.26 -4.96 114.94 110.63 1i0b s ASN 321 Ca -0.13 -3.01 0.35 0.00 0.42 0.00 0.00 52.86 50.48 1i0b s ASN 321 Cb 0.08 -0.89 1.59 0.00 -1.45 0.00 0.00 41.25 40.58 1i0b s ASN 321 CO 0.73 -0.20 2.08 -0.65 -3.72 0.00 0.00 177.10 175.34 1i0b h PRO 322 N 6.08 0.00 0.00 0.43 0.11 -1.64 -2.01 132.00 134.97 1i0b h PRO 322 Ca 0.13 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.24 1i0b h PRO 322 Cb 0.89 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.00 1i0b h PRO 322 CO 0.47 0.04 0.00 -0.44 -0.21 0.00 0.00 178.00 177.86 1i0b h ASP 323 N 0.00 0.00 0.00 -2.05 3.45 -1.93 -3.48 116.42 112.42 1i0b h ASP 323 Ca -0.00 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.46 1i0b h ASP 323 Cb 0.39 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.16 1i0b h ASP 323 CO 0.01 0.00 0.00 0.61 -1.57 0.00 0.00 179.24 178.29 1i0b n GLY 324 N 0.21 2.40 0.34 2.75 0.00 -0.76 -1.14 105.19 108.99 1i0b n GLY 324 Ca 0.02 -0.24 0.20 0.00 0.00 0.00 0.00 46.02 46.00 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 -1.91 -1.10 114.93 116.39 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 -2.09 2.10 -0.29 6.32 0.00 -0.29 -3.89 120.51 122.36 1i0b n ALA 326 Ca -0.02 -0.09 0.07 0.00 0.00 0.00 0.00 53.44 53.39 1i0b n ALA 326 Cb 0.19 -1.37 0.22 0.00 0.00 0.00 0.00 19.45 18.49 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 0.00 0.76 0.39 0.00 3.57 -1.25 0.32 116.94 120.73 1i0b h PHE 327 Ca 0.00 0.03 -0.02 0.00 3.53 0.00 0.00 57.97 61.51 1i0b h PHE 327 Cb 0.30 -0.21 0.00 0.00 2.79 0.00 0.00 35.95 38.83 1i0b h PHE 327 CO 0.00 0.19 -0.19 0.82 -2.23 0.00 0.00 178.31 176.90 1i0b h ILE 328 N 0.62 0.62 -0.03 1.41 1.08 -1.82 -0.00 117.51 119.39 1i0b h ILE 328 Ca 0.45 -0.01 -0.17 0.00 -0.39 0.00 0.00 64.86 64.75 1i0b h ILE 328 Cb 0.63 0.62 -0.01 0.00 -3.07 0.00 0.00 36.82 34.99 1i0b h ILE 328 CO -0.36 0.00 -0.74 1.55 -0.69 0.00 0.00 178.15 177.91 1i0b h PRO 329 N -0.53 0.18 0.16 2.37 0.13 -1.76 -0.65 132.00 131.90 1i0b h PRO 329 Ca -0.05 -0.16 -0.29 0.00 -0.87 0.00 0.00 66.00 64.63 1i0b h PRO 329 Cb 0.40 0.04 0.02 0.00 0.13 0.00 0.00 31.00 31.59 1i0b h PRO 329 CO 0.09 0.84 -1.29 -0.07 -0.23 0.00 0.00 178.00 177.33 1i0b h LEU 330 N 0.12 0.57 0.00 1.56 3.38 -0.93 -3.40 115.31 116.60 1i0b h LEU 330 Ca -0.02 -0.60 -0.10 0.00 0.09 0.00 0.00 57.88 57.25 1i0b h LEU 330 Cb 1.31 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 41.86 1i0b h LEU 330 CO 0.11 1.46 -1.36 0.54 0.09 0.00 0.00 178.44 179.28 1i0b n ARG 331 N -3.61 0.15 0.09 1.13 5.12 -0.09 -4.68 116.66 114.77 1i0b n ARG 331 Ca -0.11 0.04 -0.13 0.00 -1.93 0.00 0.00 57.85 55.72 1i0b n ARG 331 Cb 1.03 -0.99 -0.08 0.00 -1.16 0.00 0.00 32.46 31.26 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 -0.08 0.95 -0.37 1.55 2.07 -0.60 -2.39 116.25 117.39 1i0b h VAL 332 Ca -0.15 -0.51 -0.00 0.00 0.82 0.00 0.00 66.70 66.86 1i0b h VAL 332 Cb 1.19 1.26 -0.02 0.00 -1.52 0.00 0.00 31.29 32.21 1i0b h VAL 332 CO -0.05 0.12 0.22 0.40 0.02 0.00 0.00 177.57 178.28 1i0b h ILE 333 N -0.45 1.12 -0.52 4.57 1.08 -1.36 -1.31 117.51 120.63 1i0b h ILE 333 Ca -0.02 -0.26 -0.07 0.00 -0.39 0.00 0.00 64.86 64.12 1i0b h ILE 333 Cb 0.35 0.63 -0.02 0.00 -3.07 0.00 0.00 36.82 34.71 1i0b h ILE 333 CO 0.04 0.12 0.06 -0.65 -0.69 0.00 0.00 178.15 177.02 1i0b h PRO 334 N 0.48 0.84 0.00 2.37 0.11 -1.78 -0.77 132.00 133.25 1i0b h PRO 334 Ca 0.13 -0.20 -0.00 0.00 0.11 0.00 0.00 66.00 66.04 1i0b h PRO 334 Cb -0.01 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 31.00 1i0b h PRO 334 CO -0.03 0.80 -0.00 0.35 -0.21 0.00 0.00 178.00 178.91 1i0b h PHE 335 N 0.79 -0.00 -0.75 0.65 3.04 -1.05 -1.35 116.94 118.27 1i0b h PHE 335 Ca 0.16 -0.00 -0.03 0.00 3.98 0.00 0.00 57.97 62.09 1i0b h PHE 335 Cb 0.39 0.00 -0.03 0.00 2.56 0.00 0.00 35.95 38.87 1i0b h PHE 335 CO 0.02 0.01 0.37 -0.07 -2.02 0.00 0.00 178.31 176.62 1i0b h LEU 336 N -0.02 0.98 -1.26 0.59 3.38 -1.07 -1.97 115.31 115.93 1i0b h LEU 336 Ca -0.00 -0.13 0.01 0.00 0.09 0.00 0.00 57.88 57.85 1i0b h LEU 336 Cb 0.02 -0.25 -0.04 0.00 0.09 0.00 0.00 40.66 40.48 1i0b h LEU 336 CO 0.00 0.83 0.50 -0.09 0.09 0.00 0.00 178.44 179.77 1i0b h ARG 337 N 1.05 0.98 0.00 1.13 2.43 -0.73 0.33 114.38 119.57 1i0b h ARG 337 Ca 0.26 -0.06 -0.00 0.00 -0.81 0.00 0.00 59.98 59.37 1i0b h ARG 337 Cb 0.11 -0.22 -0.00 0.00 -0.42 0.00 0.00 29.97 29.44 1i0b h ARG 337 CO -0.03 0.65 -0.01 1.05 -1.51 0.00 0.00 179.97 180.11 1i0b h GLU 338 N 1.01 0.00 -0.64 0.20 4.11 -0.69 -2.25 114.58 116.32 1i0b h GLU 338 Ca 0.28 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.71 1i0b h GLU 338 Cb -0.08 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.17 1i0b h GLU 338 CO -0.07 0.01 0.00 1.63 0.07 0.00 0.00 179.01 180.66 1i0b n LYS 339 N -3.11 2.51 -0.07 1.06 4.76 -0.05 -4.86 118.16 118.39 1i0b n LYS 339 Ca 0.02 -1.44 0.00 0.00 -2.87 0.00 0.00 58.31 54.01 1i0b n LYS 339 Cb 0.38 -1.66 0.00 0.00 -1.84 0.00 0.00 35.03 31.91 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 0.58 0.82 3.70 0.72 0.00 -0.85 -5.03 105.19 105.13 1i0b n GLY 340 Ca 0.13 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.73 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 -2.37 3.73 0.56 1.61 1.01 -0.28 -4.97 120.40 119.70 1i0b s VAL 341 Ca 0.00 1.17 -0.19 0.00 0.00 0.00 0.00 61.98 62.96 1i0b s VAL 341 Cb 0.00 -3.75 -0.05 0.00 0.00 0.00 0.00 36.38 32.58 1i0b s VAL 341 CO 0.00 0.03 1.14 -2.16 0.00 0.00 0.00 175.10 174.11 1i0b s PRO 342 N 1.86 3.24 0.17 2.72 0.04 -1.26 -4.10 135.00 137.67 1i0b s PRO 342 Ca 0.62 1.61 -0.20 0.00 0.04 0.00 0.00 61.00 63.08 1i0b s PRO 342 Cb -0.32 -1.99 0.08 0.00 0.04 0.00 0.00 34.50 32.32 1i0b s PRO 342 CO 0.27 -0.94 1.63 0.37 0.04 0.00 0.00 177.00 178.37 1i0b h GLN 343 N 1.03 -0.16 -0.19 4.56 5.75 -1.96 -1.55 115.11 122.59 1i0b h GLN 343 Ca -0.50 0.01 -0.00 0.00 -0.15 0.00 0.00 58.65 58.01 1i0b h GLN 343 Cb 1.26 0.04 -0.01 0.00 1.07 0.00 0.00 27.48 29.84 1i0b h GLN 343 CO 0.56 -0.10 0.10 0.93 -2.65 0.00 0.00 178.83 177.67 1i0b h GLU 344 N -0.16 0.26 -0.15 1.69 3.07 -1.98 0.01 114.58 117.31 1i0b h GLU 344 Ca 0.19 -0.02 -0.20 0.00 -0.50 0.00 0.00 59.36 58.83 1i0b h GLU 344 Cb 0.45 -0.06 0.00 0.00 -0.84 0.00 0.00 28.75 28.31 1i0b h GLU 344 CO -0.48 0.20 -0.70 1.15 -1.40 0.00 0.00 179.01 177.78 1i0b h THR 345 N 0.26 1.31 -0.46 1.13 2.02 -1.70 0.45 112.91 115.92 1i0b h THR 345 Ca 0.07 -1.96 -0.02 0.00 0.77 0.00 0.00 66.41 65.27 1i0b h THR 345 Cb 0.02 1.94 -0.02 0.00 -1.74 0.00 0.00 68.15 68.35 1i0b h THR 345 CO -0.01 0.61 0.21 -0.07 0.37 0.00 0.00 175.52 176.63 1i0b h LEU 346 N 0.46 0.61 -0.86 2.58 3.38 -0.68 0.17 115.31 120.98 1i0b h LEU 346 Ca -0.03 -0.14 -0.10 0.00 0.09 0.00 0.00 57.88 57.70 1i0b h LEU 346 Cb 1.29 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.87 1i0b h LEU 346 CO 0.14 0.58 -0.24 0.00 0.09 0.00 0.00 178.44 179.01 1i0b h ALA 347 N 1.05 1.03 -0.25 1.53 0.00 -0.93 -1.87 119.26 119.83 1i0b h ALA 347 Ca 0.16 -0.35 -0.01 0.00 0.00 0.00 0.00 54.91 54.71 1i0b h ALA 347 Cb 0.14 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 1i0b h ALA 347 CO -0.02 0.58 0.12 0.78 0.00 0.00 0.00 179.25 180.72 1i0b h GLY 348 N 1.01 0.38 1.24 0.00 0.00 -0.31 -1.08 103.07 104.30 1i0b h GLY 348 Ca 0.07 -0.18 -0.13 0.00 0.00 0.00 0.00 47.33 47.09 1i0b h GLY 348 CO 0.05 0.18 -0.25 -2.22 0.00 0.00 0.00 176.54 174.30 1i0b h ILE 349 N 0.27 1.27 0.00 2.60 2.04 -0.87 0.12 117.51 122.95 1i0b h ILE 349 Ca 0.09 -1.39 0.00 0.00 1.00 0.00 0.00 64.86 64.55 1i0b h ILE 349 Cb 0.10 1.21 0.00 0.00 -0.74 0.00 0.00 36.82 37.40 1i0b h ILE 349 CO -0.01 0.47 -0.61 0.71 0.00 0.00 0.00 178.15 178.71 1i0b h THR 350 N 0.74 0.00 0.00 -0.27 1.35 -1.27 -3.39 112.91 110.08 1i0b h THR 350 Ca 0.09 -0.85 0.00 0.00 -0.55 0.00 0.00 66.41 65.10 1i0b h THR 350 Cb 0.79 1.53 0.00 0.00 -1.73 0.00 0.00 68.15 68.74 1i0b h THR 350 CO 0.07 0.00 -0.49 0.52 -0.25 0.00 0.00 175.52 175.36 1i0b n VAL 351 N -2.63 0.50 0.28 6.82 0.31 -0.42 -1.44 118.33 121.74 1i0b n VAL 351 Ca 0.02 0.16 -0.16 0.00 -0.01 0.00 0.00 64.34 64.35 1i0b n VAL 351 Cb 0.51 -1.43 -0.08 0.00 -0.91 0.00 0.00 33.84 31.93 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 0.00 0.37 -0.08 2.52 2.02 -1.30 -2.54 112.91 113.89 1i0b h THR 352 Ca 0.00 0.00 0.02 0.00 0.77 0.00 0.00 66.41 67.20 1i0b h THR 352 Cb 0.49 0.37 -0.02 0.00 -1.74 0.00 0.00 68.15 67.25 1i0b h THR 352 CO 0.00 0.00 -0.04 0.78 0.37 0.00 0.00 175.52 176.63 1i0b h ASN 353 N -0.75 -0.13 -0.96 4.18 2.35 -1.19 -1.73 115.58 117.34 1i0b h ASN 353 Ca -0.05 0.03 -0.00 0.00 -0.55 0.00 0.00 56.30 55.73 1i0b h ASN 353 Cb 0.62 0.08 -0.05 0.00 0.05 0.00 0.00 38.32 39.02 1i0b h ASN 353 CO 0.05 -0.06 0.59 -0.65 -1.65 0.00 0.00 177.43 175.71 1i0b h PRO 354 N -0.04 1.29 -0.20 0.81 0.11 -1.75 0.63 132.00 132.84 1i0b h PRO 354 Ca 0.05 -0.11 0.01 0.00 0.11 0.00 0.00 66.00 66.06 1i0b h PRO 354 Cb 0.11 -0.27 -0.02 0.00 0.11 0.00 0.00 31.00 30.92 1i0b h PRO 354 CO -0.10 0.89 0.10 0.00 -0.21 0.00 0.00 178.00 178.68 1i0b h ALA 355 N 1.33 0.24 -0.37 -0.75 0.00 -1.16 0.27 119.26 118.82 1i0b h ALA 355 Ca 0.34 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.25 1i0b h ALA 355 Cb -0.08 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 17.66 1i0b h ALA 355 CO -0.07 -0.32 0.18 -0.09 0.00 0.00 0.00 179.25 178.96 1i0b h ARG 356 N 0.21 0.53 0.25 0.00 2.43 -0.88 0.21 114.38 117.13 1i0b h ARG 356 Ca 0.08 -0.08 -0.01 0.00 -0.81 0.00 0.00 59.98 59.17 1i0b h ARG 356 Cb 0.02 -0.10 0.00 0.00 -0.42 0.00 0.00 29.97 29.48 1i0b h ARG 356 CO -0.06 0.47 -0.13 0.35 -1.51 0.00 0.00 179.97 179.09 1i0b h PHE 357 N 0.45 -0.34 -0.20 2.20 3.57 -0.61 -3.22 116.94 118.80 1i0b h PHE 357 Ca 0.13 -0.01 -0.07 0.00 3.53 0.00 0.00 57.97 61.55 1i0b h PHE 357 Cb 0.11 0.11 -0.01 0.00 2.79 0.00 0.00 35.95 38.95 1i0b h PHE 357 CO -0.02 -0.21 -0.19 -0.07 -2.23 0.00 0.00 178.31 175.60 1i0b h LEU 358 N -0.35 0.33 -9.06 0.59 3.38 -0.34 -3.40 115.31 106.46 1i0b h LEU 358 Ca -0.03 -0.09 -0.62 0.00 0.09 0.00 0.00 57.88 57.23 1i0b h LEU 358 Cb 0.28 -0.09 0.01 0.00 0.09 0.00 0.00 40.66 40.94 1i0b h LEU 358 CO 0.05 0.54 1.27 -0.24 0.09 0.00 0.00 178.44 180.15 1i0b n SER 359 N -4.19 3.18 -4.67 -0.43 2.88 0.05 -4.76 113.62 105.68 1i0b n SER 359 Ca -0.00 0.67 -0.48 0.00 -1.33 0.00 0.00 58.87 57.72 1i0b n SER 359 Cb 0.34 -1.40 -0.05 0.00 -0.75 0.00 0.00 64.21 62.35 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 7.55 1.99 -3.80 -1.46 -0.02 -1.26 -4.89 135.00 133.12 1i0b n PRO 360 Ca 0.28 0.72 -0.25 0.00 -2.02 0.00 0.00 63.50 62.23 1i0b n PRO 360 Cb 0.32 -2.50 -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 2.34 0.58 0.16 3.45 2.01 0.88 -4.80 115.64 120.26 1i0b s THR 361 Ca 0.86 -0.14 -0.14 0.00 0.31 0.00 0.00 61.69 62.58 1i0b s THR 361 Cb -0.74 -0.78 -0.07 0.00 0.01 0.00 0.00 72.50 70.92 1i0b s THR 361 CO 0.46 0.18 0.55 -0.76 -0.69 0.00 0.00 174.62 174.37 1i0b s LEU 362 N 1.88 4.32 0.54 4.42 1.43 -1.26 -4.33 118.68 125.68 1i0b s LEU 362 Ca 0.04 1.07 -0.20 0.00 -1.03 0.00 0.00 54.13 54.00 1i0b s LEU 362 Cb -0.13 -3.32 -0.05 0.00 0.03 0.00 0.00 46.19 42.72 1i0b s LEU 362 CO -0.07 0.08 1.20 -0.60 0.23 0.00 0.00 176.35 177.20 1i0b s ARG 363 N -2.05 3.26 0.77 1.70 3.52 -1.26 -4.96 118.95 119.93 1i0b s ARG 363 Ca 0.39 1.82 -0.14 0.00 -0.13 0.00 0.00 55.73 57.67 1i0b s ARG 363 Cb -0.15 -2.10 0.06 0.00 -1.56 0.00 0.00 34.95 31.20 1i0b s ARG 363 CO 0.19 -0.97 1.19 0.00 -0.81 0.00 0.00 175.30 174.90 1i0b s ALA 364 N -1.58 1.99 0.00 6.12 0.00 -1.26 -5.20 121.76 121.84 1i0b s ALA 364 Ca 0.72 0.80 0.00 0.00 0.00 0.00 0.00 51.96 53.48 1i0b s ALA 364 Cb -0.30 -3.46 0.00 0.00 0.00 0.00 0.00 23.12 19.36 1i0b s ALA 364 CO 0.34 -2.05 0.48 -1.13 0.00 0.00 0.00 175.76 173.39