#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1i1w h ALA 3 N 0.00 1.22 -3.10 0.00 0.00 -2.03 -3.41 119.26 111.94 1i1w h ALA 3 Ca 0.00 -0.03 -0.64 0.00 0.00 0.00 0.00 54.91 54.24 1i1w h ALA 3 Cb 0.00 -0.30 -0.13 0.00 0.00 0.00 0.00 17.79 17.36 1i1w h ALA 3 CO 0.00 0.42 -0.54 -0.65 0.00 0.00 0.00 179.25 178.48 1i1w s GLN 4 N -6.08 3.68 -0.26 0.00 -0.21 -1.26 -5.09 119.66 110.44 1i1w s GLN 4 Ca -0.13 -0.27 -0.15 0.00 0.02 0.00 0.00 55.36 54.83 1i1w s GLN 4 Cb 0.18 -3.16 -0.04 0.00 1.00 0.00 0.00 33.01 30.99 1i1w s GLN 4 CO 0.80 0.50 0.39 0.45 -2.12 0.00 0.00 175.29 175.31 1i1w s SER 5 N -0.26 6.29 0.47 5.90 0.15 -1.26 -4.91 113.70 120.07 1i1w s SER 5 Ca 0.09 0.34 0.16 0.00 0.70 0.00 0.00 55.95 57.24 1i1w s SER 5 Cb -0.12 -2.22 1.09 0.00 -1.71 0.00 0.00 66.02 63.07 1i1w s SER 5 CO 0.01 -0.18 2.03 -0.37 1.20 0.00 0.00 173.24 175.93 1i1w h VAL 6 N 5.34 1.06 -0.17 4.45 -1.51 -1.89 -1.63 116.25 121.90 1i1w h VAL 6 Ca -0.32 -0.49 -0.03 0.00 -1.23 0.00 0.00 66.70 64.62 1i1w h VAL 6 Cb 1.16 1.27 -0.01 0.00 -2.13 0.00 0.00 31.29 31.58 1i1w h VAL 6 CO 0.66 0.14 -0.02 -0.78 -1.23 0.00 0.00 177.57 176.34 1i1w h ASP 7 N 0.00 0.31 -0.73 4.19 3.58 -1.71 -0.10 116.42 121.97 1i1w h ASP 7 Ca -0.00 -0.34 0.02 0.00 0.42 0.00 0.00 57.03 57.13 1i1w h ASP 7 Cb 0.26 -0.09 -0.04 0.00 1.72 0.00 0.00 39.33 41.18 1i1w h ASP 7 CO 0.02 0.58 0.47 1.56 -2.88 0.00 0.00 179.24 178.99 1i1w h GLN 8 N 0.04 0.90 -0.50 0.28 4.20 -1.75 -0.92 115.11 117.37 1i1w h GLN 8 Ca 0.04 -0.05 -0.10 0.00 0.06 0.00 0.00 58.65 58.61 1i1w h GLN 8 Cb 0.44 -0.20 -0.02 0.00 0.30 0.00 0.00 27.48 27.99 1i1w h GLN 8 CO 0.01 0.60 -0.07 -0.07 -0.67 0.00 0.00 178.83 178.63 1i1w h LEU 9 N 0.93 0.87 -0.42 1.46 3.38 -1.20 -1.47 115.31 118.87 1i1w h LEU 9 Ca 0.28 -0.26 -0.18 0.00 0.09 0.00 0.00 57.88 57.82 1i1w h LEU 9 Cb -0.03 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.47 1i1w h LEU 9 CO -0.09 0.98 -0.78 -0.29 0.09 0.00 0.00 178.44 178.35 1i1w h ILE 10 N 0.80 1.46 -0.50 1.22 2.10 -0.77 -2.82 117.51 119.01 1i1w h ILE 10 Ca 0.14 -2.41 -0.03 0.00 1.08 0.00 0.00 64.86 63.64 1i1w h ILE 10 Cb 0.58 2.31 -0.02 0.00 -1.09 0.00 0.00 36.82 38.60 1i1w h ILE 10 CO 0.04 0.70 0.18 0.11 -1.08 0.00 0.00 178.15 178.10 1i1w h LYS 11 N 0.12 0.73 0.00 2.19 1.57 -0.90 -1.75 116.57 118.53 1i1w h LYS 11 Ca -0.03 -0.11 0.00 0.00 -1.87 0.00 0.00 60.65 58.64 1i1w h LYS 11 Cb 1.36 -0.13 0.00 0.00 0.08 0.00 0.00 32.23 33.54 1i1w h LYS 11 CO 0.12 0.62 0.00 0.00 -0.57 0.00 0.00 179.45 179.62 1i1w n ALA 12 N -2.46 1.67 0.25 3.86 0.00 -0.58 -1.11 120.51 122.15 1i1w n ALA 12 Ca 0.04 0.06 0.11 0.00 0.00 0.00 0.00 53.44 53.65 1i1w n ALA 12 Cb 0.17 -1.36 0.27 0.00 0.00 0.00 0.00 19.45 18.53 1i1w n ALA 12 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1i1w n ARG 13 N -2.12 2.39 -0.33 0.00 1.74 -0.71 -4.95 116.66 112.69 1i1w n ARG 13 Ca 0.02 -2.14 0.00 0.00 -0.77 0.00 0.00 57.85 54.96 1i1w n ARG 13 Cb 0.22 -1.49 0.00 0.00 -1.02 0.00 0.00 32.46 30.18 1i1w n ARG 13 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1i1w n GLY 14 N 1.46 0.76 3.91 -0.13 0.00 -0.27 -5.07 105.19 105.86 1i1w n GLY 14 Ca 0.20 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.95 1i1w n GLY 14 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1i1w s LYS 15 N -0.67 2.76 -0.03 1.61 -0.14 -0.88 -4.99 119.74 117.39 1i1w s LYS 15 Ca 0.00 0.06 -0.17 0.00 -1.36 0.00 0.00 55.97 54.50 1i1w s LYS 15 Cb 0.00 -2.19 -0.32 0.00 -1.68 0.00 0.00 37.83 33.64 1i1w s LYS 15 CO 0.00 -0.89 0.83 0.28 -0.76 0.00 0.00 175.35 174.81 1i1w h VAL 16 N -0.38 1.23 -2.60 3.17 2.07 -1.12 -3.36 116.25 115.27 1i1w h VAL 16 Ca -0.45 -2.57 0.06 0.00 0.82 0.00 0.00 66.70 64.55 1i1w h VAL 16 Cb 1.27 2.98 -0.13 0.00 -1.52 0.00 0.00 31.29 33.88 1i1w h VAL 16 CO 0.61 0.78 0.37 -0.72 0.02 0.00 0.00 177.57 178.63 1i1w s TYR 17 N -2.53 -0.42 -0.15 1.57 -0.85 -1.17 -4.88 117.35 108.91 1i1w s TYR 17 Ca -0.13 0.24 0.00 0.00 -0.52 0.00 0.00 57.07 56.66 1i1w s TYR 17 Cb 0.03 0.55 0.03 0.00 0.38 0.00 0.00 41.96 42.96 1i1w s TYR 17 CO 0.87 -0.69 -0.10 0.12 -1.52 0.00 0.00 175.55 174.23 1i1w s PHE 18 N -3.41 1.96 0.05 -3.49 2.19 -1.26 -2.61 117.98 111.42 1i1w s PHE 18 Ca 0.04 -1.15 0.01 0.00 0.33 0.00 0.00 56.93 56.15 1i1w s PHE 18 Cb -0.01 -1.46 -0.00 0.00 -1.31 0.00 0.00 43.02 40.24 1i1w s PHE 18 CO -0.10 -0.64 0.02 0.41 1.83 0.00 0.00 175.22 176.74 1i1w n GLY 19 N 4.82 3.99 3.19 13.12 0.00 0.85 -0.54 105.19 130.61 1i1w n GLY 19 Ca -0.14 -1.93 -0.11 0.00 0.00 0.00 0.00 46.02 43.84 1i1w n GLY 19 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1i1w s VAL 20 N -1.76 0.10 0.30 1.61 0.11 -0.58 -0.98 120.40 119.21 1i1w s VAL 20 Ca 0.03 -0.86 -0.29 0.00 -2.93 0.00 0.00 61.98 57.93 1i1w s VAL 20 Cb 0.00 -0.89 -0.10 0.00 -1.53 0.00 0.00 36.38 33.86 1i1w s VAL 20 CO 0.02 -0.47 1.16 0.00 -3.33 0.00 0.00 175.10 172.48 1i1w s ALA 21 N -2.50 3.41 0.15 1.54 0.00 -0.37 -1.71 121.76 122.28 1i1w s ALA 21 Ca -0.06 1.00 -0.06 0.00 0.00 0.00 0.00 51.96 52.84 1i1w s ALA 21 Cb -0.01 -3.37 0.02 0.00 0.00 0.00 0.00 23.12 19.76 1i1w s ALA 21 CO -0.03 -0.31 0.32 -2.37 0.00 0.00 0.00 175.76 173.36 1i1w n THR 22 N 0.98 0.00 -3.74 0.00 5.66 -0.33 -3.89 114.28 112.96 1i1w n THR 22 Ca -0.00 -0.39 0.01 0.00 -3.05 0.00 0.00 64.05 60.62 1i1w n THR 22 Cb 0.44 0.39 0.00 0.00 -1.55 0.00 0.00 70.33 69.61 1i1w n THR 22 CO 0.00 0.00 0.00 -1.81 -3.05 0.00 0.00 175.07 170.21 1i1w s ASP 23 N -1.84 -0.04 0.27 1.09 1.01 -1.26 -0.69 116.67 115.21 1i1w s ASP 23 Ca 0.07 -0.21 -0.00 0.00 0.71 0.00 0.00 52.55 53.11 1i1w s ASP 23 Cb -0.02 0.20 0.58 0.00 1.01 0.00 0.00 42.92 44.69 1i1w s ASP 23 CO 0.05 -0.38 1.73 -0.61 0.21 0.00 0.00 175.17 176.17 1i1w h GLN 24 N 2.00 0.49 -0.71 8.23 4.15 -1.95 0.23 115.11 127.56 1i1w h GLN 24 Ca -0.28 -0.03 0.05 0.00 0.77 0.00 0.00 58.65 59.16 1i1w h GLN 24 Cb 1.20 -0.11 -0.04 0.00 0.21 0.00 0.00 27.48 28.74 1i1w h GLN 24 CO 0.30 0.33 0.46 -2.95 -1.93 0.00 0.00 178.83 175.04 1i1w h ASN 25 N 0.51 0.68 0.11 -0.69 -1.07 -1.97 -1.74 115.58 111.40 1i1w h ASN 25 Ca 0.48 -0.00 -0.15 0.00 0.07 0.00 0.00 56.30 56.70 1i1w h ASN 25 Cb 0.77 -0.15 0.02 0.00 -2.07 0.00 0.00 38.32 36.89 1i1w h ASN 25 CO -0.43 0.45 -0.64 0.03 0.07 0.00 0.00 177.43 176.92 1i1w h ARG 26 N 0.78 0.25 0.00 4.14 2.47 -1.55 -3.36 114.38 117.11 1i1w h ARG 26 Ca 0.29 -0.41 -0.01 0.00 -1.26 0.00 0.00 59.98 58.60 1i1w h ARG 26 Cb 0.17 0.15 -0.00 0.00 -1.65 0.00 0.00 29.97 28.64 1i1w h ARG 26 CO -0.09 1.19 -0.05 -0.07 0.56 0.00 0.00 179.97 181.51 1i1w h LEU 27 N -0.48 0.00 -3.18 3.04 3.38 -0.69 -2.49 115.31 114.90 1i1w h LEU 27 Ca -0.11 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.86 1i1w h LEU 27 Cb 1.50 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.25 1i1w h LEU 27 CO 0.12 0.05 0.00 0.35 0.09 0.00 0.00 178.44 179.05 1i1w n THR 28 N -3.92 1.92 -3.98 0.22 -2.24 -0.68 -4.22 114.28 101.39 1i1w n THR 28 Ca -0.03 -1.22 -0.09 0.00 -2.27 0.00 0.00 64.05 60.45 1i1w n THR 28 Cb 0.14 0.10 -0.08 0.00 -2.10 0.00 0.00 70.33 68.38 1i1w n THR 28 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 1i1w s THR 29 N -1.92 0.13 0.00 4.28 -1.32 -0.94 -5.07 115.64 110.80 1i1w s THR 29 Ca 0.52 -1.48 0.00 0.00 -1.21 0.00 0.00 61.69 59.52 1i1w s THR 29 Cb 0.34 -1.62 0.00 0.00 -1.51 0.00 0.00 72.50 69.71 1i1w s THR 29 CO 0.24 -0.60 0.00 0.61 -2.21 0.00 0.00 174.62 172.66 1i1w n GLY 30 N -0.07 1.65 0.65 6.08 0.00 -1.26 -3.40 105.19 108.83 1i1w n GLY 30 Ca -0.11 -0.50 0.07 0.00 0.00 0.00 0.00 46.02 45.48 1i1w n GLY 30 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1i1w n LYS 31 N 5.63 2.75 0.02 1.61 5.02 -1.26 -4.76 118.16 127.16 1i1w n LYS 31 Ca 0.00 -2.44 -0.11 0.00 -2.02 0.00 0.00 58.31 53.74 1i1w n LYS 31 Cb 0.00 -1.55 -0.06 0.00 -0.02 0.00 0.00 35.03 33.40 1i1w n LYS 31 CO 0.00 0.00 0.00 -0.91 -0.52 0.00 0.00 177.40 175.97 1i1w h ASN 32 N 1.55 0.04 -0.33 4.39 2.35 -1.77 -2.00 115.58 119.81 1i1w h ASN 32 Ca 0.00 0.00 0.02 0.00 -0.55 0.00 0.00 56.30 55.77 1i1w h ASN 32 Cb 1.08 -0.00 -0.02 0.00 0.05 0.00 0.00 38.32 39.42 1i1w h ASN 32 CO 0.11 0.03 0.18 0.00 -1.65 0.00 0.00 177.43 176.10 1i1w h ALA 33 N 1.03 0.41 -0.78 -0.83 0.00 -1.79 -0.74 119.26 116.56 1i1w h ALA 33 Ca 0.02 0.00 -0.05 0.00 0.00 0.00 0.00 54.91 54.89 1i1w h ALA 33 Cb 0.01 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 17.69 1i1w h ALA 33 CO -0.02 -0.19 0.29 0.00 0.00 0.00 0.00 179.25 179.33 1i1w h ALA 34 N 1.16 1.02 -0.32 0.00 0.00 -1.88 0.98 119.26 120.22 1i1w h ALA 34 Ca 0.14 -0.21 -0.00 0.00 0.00 0.00 0.00 54.91 54.83 1i1w h ALA 34 Cb 0.03 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.50 1i1w h ALA 34 CO -0.08 0.67 0.20 0.82 0.00 0.00 0.00 179.25 180.86 1i1w h ILE 35 N 1.15 1.11 -0.39 0.00 2.04 -1.07 -1.18 117.51 119.17 1i1w h ILE 35 Ca 0.26 -0.24 -0.03 0.00 1.00 0.00 0.00 64.86 65.85 1i1w h ILE 35 Cb 0.25 0.68 -0.02 0.00 -0.74 0.00 0.00 36.82 37.00 1i1w h ILE 35 CO -0.02 0.10 0.11 0.40 0.00 0.00 0.00 178.15 178.75 1i1w h ILE 36 N 0.42 1.22 -0.37 -0.67 2.04 -0.78 0.25 117.51 119.62 1i1w h ILE 36 Ca 0.12 -0.73 0.07 0.00 1.00 0.00 0.00 64.86 65.32 1i1w h ILE 36 Cb -0.00 0.96 -0.07 0.00 -0.74 0.00 0.00 36.82 36.97 1i1w h ILE 36 CO -0.02 0.25 -0.07 1.56 0.00 0.00 0.00 178.15 179.87 1i1w h GLN 37 N 0.48 0.02 -0.18 2.37 4.20 -0.73 -2.61 115.11 118.66 1i1w h GLN 37 Ca 0.12 -0.00 -0.20 0.00 0.06 0.00 0.00 58.65 58.63 1i1w h GLN 37 Cb 0.28 -0.00 0.01 0.00 0.30 0.00 0.00 27.48 28.06 1i1w h GLN 37 CO -0.00 0.01 -0.67 0.00 -0.67 0.00 0.00 178.83 177.50 1i1w h ALA 38 N 1.36 0.32 0.00 3.87 0.00 -0.85 -3.41 119.26 120.56 1i1w h ALA 38 Ca 0.18 -0.56 0.00 0.00 0.00 0.00 0.00 54.91 54.53 1i1w h ALA 38 Cb 0.27 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.03 1i1w h ALA 38 CO -0.37 0.62 -0.40 0.09 0.00 0.00 0.00 179.25 179.20 1i1w n ASN 39 N -4.01 1.27 -4.33 0.00 5.03 0.04 -4.56 115.26 108.71 1i1w n ASN 39 Ca -0.07 -0.41 -0.20 0.00 0.87 0.00 0.00 54.58 54.77 1i1w n ASN 39 Cb 0.69 1.03 -0.11 0.00 -1.02 0.00 0.00 39.78 40.38 1i1w n ASN 39 CO 0.00 0.00 0.00 -0.36 -1.83 0.00 0.00 177.26 175.07 1i1w s PHE 40 N -1.51 1.76 0.00 3.10 0.08 -0.99 -2.44 117.98 117.98 1i1w s PHE 40 Ca 0.00 -0.51 0.00 0.00 0.12 0.00 0.00 56.93 56.55 1i1w s PHE 40 Cb 0.02 -0.85 0.00 0.00 -0.57 0.00 0.00 43.02 41.62 1i1w s PHE 40 CO 0.11 0.34 0.77 0.41 -0.10 0.00 0.00 175.22 176.75 1i1w n GLY 41 N 0.03 1.06 3.50 4.36 0.00 0.30 -4.71 105.19 109.73 1i1w n GLY 41 Ca -0.11 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.74 1i1w n GLY 41 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1i1w s GLN 42 N -0.57 1.00 0.03 1.61 -0.44 -1.25 -1.32 119.66 118.72 1i1w s GLN 42 Ca 0.00 0.27 0.03 0.00 -2.50 0.00 0.00 55.36 53.16 1i1w s GLN 42 Cb 0.00 0.47 -0.02 0.00 -1.64 0.00 0.00 33.01 31.82 1i1w s GLN 42 CO 0.00 -0.30 -0.10 0.14 0.50 0.00 0.00 175.29 175.53 1i1w s VAL 43 N -1.09 0.74 -0.11 1.34 -7.23 0.44 -1.53 120.40 112.95 1i1w s VAL 43 Ca -0.10 -0.86 0.03 0.00 -1.81 0.00 0.00 61.98 59.23 1i1w s VAL 43 Cb -0.01 -0.71 -0.00 0.00 0.56 0.00 0.00 36.38 36.22 1i1w s VAL 43 CO 0.09 -0.12 -0.21 -0.89 -0.31 0.00 0.00 175.10 173.66 1i1w s THR 44 N -0.89 2.35 0.08 5.32 2.01 -0.69 -1.59 115.64 122.23 1i1w s THR 44 Ca -0.03 -0.91 -0.31 0.00 0.31 0.00 0.00 61.69 60.75 1i1w s THR 44 Cb -0.07 -1.93 -0.09 0.00 0.01 0.00 0.00 72.50 70.42 1i1w s THR 44 CO 0.01 0.55 1.79 -2.16 -0.69 0.00 0.00 174.62 174.12 1i1w s PRO 45 N 0.39 4.16 0.25 4.92 0.04 -1.26 -1.19 135.00 142.31 1i1w s PRO 45 Ca -0.16 2.50 -0.01 0.00 0.04 0.00 0.00 61.00 63.38 1i1w s PRO 45 Cb -0.17 -3.71 0.32 0.00 0.04 0.00 0.00 34.50 30.97 1i1w s PRO 45 CO 0.07 -0.83 1.69 1.49 0.04 0.00 0.00 177.00 179.46 1i1w h GLU 46 N 8.91 0.62 0.00 4.56 4.81 -1.25 -3.41 114.58 128.82 1i1w h GLU 46 Ca -0.45 -0.23 0.00 0.00 -0.13 0.00 0.00 59.36 58.55 1i1w h GLU 46 Cb 1.21 -0.04 0.00 0.00 0.63 0.00 0.00 28.75 30.56 1i1w h GLU 46 CO 0.94 0.79 0.00 0.09 -0.73 0.00 0.00 179.01 180.10 1i1w n ASN 47 N -4.13 0.00 0.04 1.04 3.02 -1.26 -4.96 115.26 109.02 1i1w n ASN 47 Ca 0.00 0.00 0.10 0.00 -0.03 0.00 0.00 54.58 54.65 1i1w n ASN 47 Cb 0.41 0.00 0.41 0.00 -0.61 0.00 0.00 39.78 39.98 1i1w n ASN 47 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 1i1w n SER 48 N -0.29 0.22 -0.75 6.41 3.41 -1.26 -1.97 113.62 119.39 1i1w n SER 48 Ca 0.00 0.55 0.07 0.00 -0.26 0.00 0.00 58.87 59.23 1i1w n SER 48 Cb 0.00 -0.60 0.17 0.00 -0.26 0.00 0.00 64.21 63.52 1i1w n SER 48 CO 0.00 0.00 0.00 0.23 -0.16 0.00 0.00 175.04 175.11 1i1w n MET 49 N -1.74 2.48 -1.35 4.33 2.81 -1.25 -4.10 117.12 118.29 1i1w n MET 49 Ca 0.04 -2.02 -0.30 0.00 -1.81 0.00 0.00 57.70 53.61 1i1w n MET 49 Cb 0.23 -1.32 0.12 0.00 -0.71 0.00 0.00 33.22 31.54 1i1w n MET 49 CO 0.00 0.00 0.00 0.15 1.51 0.00 0.00 175.97 177.63 1i1w s LYS 50 N -1.03 1.55 0.16 0.03 1.02 -0.83 -3.52 119.74 117.12 1i1w s LYS 50 Ca 0.26 0.72 -0.11 0.00 0.02 0.00 0.00 55.97 56.87 1i1w s LYS 50 Cb 0.14 -1.85 0.04 0.00 -0.52 0.00 0.00 37.83 35.64 1i1w s LYS 50 CO 0.19 -2.01 1.63 2.35 -0.92 0.00 0.00 175.35 176.59 1i1w h TRP 51 N -1.38 1.03 -0.75 3.18 2.91 -1.76 -1.32 115.95 117.85 1i1w h TRP 51 Ca -0.49 -0.17 0.02 0.00 1.13 0.00 0.00 58.89 59.38 1i1w h TRP 51 Cb 1.28 -0.27 -0.04 0.00 -0.51 0.00 0.00 29.16 29.62 1i1w h TRP 51 CO 0.43 0.93 0.50 0.38 -1.03 0.00 0.00 178.44 179.65 1i1w h ASP 52 N 0.83 0.84 0.08 2.65 2.03 -1.57 0.21 116.42 121.49 1i1w h ASP 52 Ca 0.16 -0.02 -0.25 0.00 -0.73 0.00 0.00 57.03 56.19 1i1w h ASP 52 Cb 0.50 -0.21 0.01 0.00 -0.83 0.00 0.00 39.33 38.81 1i1w h ASP 52 CO 0.02 0.60 -0.97 0.00 -1.03 0.00 0.00 179.24 177.87 1i1w h ALA 53 N 1.54 0.24 0.00 4.15 0.00 -1.71 -3.29 119.26 120.19 1i1w h ALA 53 Ca 0.28 -0.68 -0.31 0.00 0.00 0.00 0.00 54.91 54.20 1i1w h ALA 53 Cb -0.06 0.02 -0.06 0.00 0.00 0.00 0.00 17.79 17.69 1i1w h ALA 53 CO -0.07 0.72 -1.95 0.25 0.00 0.00 0.00 179.25 178.20 1i1w n THR 54 N -3.84 1.50 -3.18 0.00 -2.24 -0.54 -4.35 114.28 101.63 1i1w n THR 54 Ca -0.09 -0.81 -0.22 0.00 -2.27 0.00 0.00 64.05 60.66 1i1w n THR 54 Cb 0.84 -0.81 -0.05 0.00 -2.10 0.00 0.00 70.33 68.22 1i1w n THR 54 CO 0.00 0.00 0.00 1.21 -0.57 0.00 0.00 175.07 175.71 1i1w n GLU 55 N -2.92 1.27 0.21 -0.78 2.13 0.04 -0.53 120.64 120.05 1i1w n GLU 55 Ca -0.22 -3.60 0.05 0.00 0.66 0.00 0.00 57.16 54.05 1i1w n GLU 55 Cb 1.08 -1.65 0.46 0.00 0.27 0.00 0.00 31.44 31.60 1i1w n GLU 55 CO 0.00 0.00 0.00 -1.00 -0.41 0.00 0.00 177.13 175.72 1i1w h PRO 56 N 3.40 0.00 -5.76 5.31 0.13 -1.69 -3.41 132.00 129.98 1i1w h PRO 56 Ca 0.10 0.00 -0.51 0.00 -0.87 0.00 0.00 66.00 64.72 1i1w h PRO 56 Cb 0.86 0.00 -0.24 0.00 0.13 0.00 0.00 31.00 31.76 1i1w h PRO 56 CO 0.55 0.27 -0.81 -1.12 -0.23 0.00 0.00 178.00 176.66 1i1w s SER 57 N -6.80 2.13 0.15 1.44 0.01 -1.26 -4.94 113.70 104.43 1i1w s SER 57 Ca -0.03 -0.55 -0.34 0.00 1.31 0.00 0.00 55.95 56.34 1i1w s SER 57 Cb 0.14 -0.14 -0.13 0.00 0.21 0.00 0.00 66.02 66.10 1i1w s SER 57 CO 0.69 0.07 1.62 1.67 0.41 0.00 0.00 173.24 177.69 1i1w n GLN 58 N 1.61 2.22 -0.85 12.44 7.27 -1.26 -1.35 117.38 137.46 1i1w n GLN 58 Ca -0.18 0.80 0.00 0.00 0.07 0.00 0.00 57.00 57.69 1i1w n GLN 58 Cb 0.54 -2.59 0.00 0.00 2.41 0.00 0.00 30.24 30.60 1i1w n GLN 58 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1i1w n GLY 59 N 3.55 0.44 2.97 1.69 0.00 -1.26 -4.92 105.19 107.65 1i1w n GLY 59 Ca 0.17 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.88 1i1w n GLY 59 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1i1w s ASN 60 N -2.34 4.96 0.46 1.61 2.47 -0.46 -5.08 114.94 116.57 1i1w s ASN 60 Ca 0.00 -3.52 -0.20 0.00 0.42 0.00 0.00 52.86 49.56 1i1w s ASN 60 Cb 0.00 -1.71 -0.10 0.00 -1.45 0.00 0.00 41.25 37.99 1i1w s ASN 60 CO 0.00 -0.17 0.98 -0.36 -3.72 0.00 0.00 177.10 173.83 1i1w s PHE 61 N -1.01 3.25 -0.29 0.43 0.40 -1.26 -4.02 117.98 115.48 1i1w s PHE 61 Ca 0.23 1.58 -0.00 0.00 -0.60 0.00 0.00 56.93 58.13 1i1w s PHE 61 Cb -0.12 -2.90 0.09 0.00 0.51 0.00 0.00 43.02 40.60 1i1w s PHE 61 CO -0.10 -0.36 0.06 1.21 0.70 0.00 0.00 175.22 176.73 1i1w s ASN 62 N -2.31 3.98 0.00 1.36 3.84 0.31 -4.98 114.94 117.14 1i1w s ASN 62 Ca 0.63 -1.54 0.18 0.00 0.21 0.00 0.00 52.86 52.33 1i1w s ASN 62 Cb -0.11 -0.99 0.40 0.00 -0.55 0.00 0.00 41.25 40.00 1i1w s ASN 62 CO 0.19 -0.37 1.33 0.49 -2.79 0.00 0.00 177.10 175.94 1i1w n PHE 63 N 4.76 0.55 -0.02 0.43 3.72 -1.26 -4.14 117.46 121.49 1i1w n PHE 63 Ca -0.04 -0.36 -0.11 0.00 -0.05 0.00 0.00 57.45 56.90 1i1w n PHE 63 Cb 0.43 -0.01 -0.05 0.00 -0.94 0.00 0.00 39.48 38.92 1i1w n PHE 63 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1i1w h ALA 64 N 3.45 0.18 -0.34 4.37 0.00 -1.93 0.24 119.26 125.23 1i1w h ALA 64 Ca 0.00 -0.03 -0.14 0.00 0.00 0.00 0.00 54.91 54.75 1i1w h ALA 64 Cb 0.85 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.58 1i1w h ALA 64 CO 0.00 -0.31 -0.32 0.78 0.00 0.00 0.00 179.25 179.39 1i1w h GLY 65 N 0.17 0.89 1.00 0.00 0.00 -1.89 -1.70 103.07 101.55 1i1w h GLY 65 Ca 0.05 -0.90 -0.05 0.00 0.00 0.00 0.00 47.33 46.43 1i1w h GLY 65 CO -0.01 0.81 0.17 0.00 0.00 0.00 0.00 176.54 177.51 1i1w h ALA 66 N 0.74 0.76 -0.64 3.60 0.00 -1.66 -2.18 119.26 119.89 1i1w h ALA 66 Ca 0.06 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.76 1i1w h ALA 66 Cb 0.90 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 18.44 1i1w h ALA 66 CO 0.08 0.44 0.40 -0.44 0.00 0.00 0.00 179.25 179.73 1i1w h ASP 67 N 0.82 0.75 -0.24 0.00 3.32 -0.45 -0.74 116.42 119.88 1i1w h ASP 67 Ca 0.19 -0.04 0.04 0.00 0.02 0.00 0.00 57.03 57.23 1i1w h ASP 67 Cb 0.31 -0.19 -0.03 0.00 0.22 0.00 0.00 39.33 39.64 1i1w h ASP 67 CO -0.00 0.57 0.03 0.22 -1.72 0.00 0.00 179.24 178.33 1i1w h TYR 68 N 0.86 0.05 -0.14 4.55 5.03 -0.93 -0.43 116.97 125.96 1i1w h TYR 68 Ca 0.23 0.02 -0.00 0.00 2.58 0.00 0.00 58.73 61.56 1i1w h TYR 68 Cb -0.06 0.01 -0.01 0.00 1.55 0.00 0.00 36.73 38.23 1i1w h TYR 68 CO -0.02 0.00 0.08 1.25 -1.32 0.00 0.00 178.16 178.15 1i1w h LEU 69 N 0.12 0.17 -0.44 2.82 5.85 -1.03 -0.29 115.31 122.52 1i1w h LEU 69 Ca 0.11 -0.05 -0.01 0.00 0.84 0.00 0.00 57.88 58.77 1i1w h LEU 69 Cb 0.12 -0.04 -0.02 0.00 0.37 0.00 0.00 40.66 41.09 1i1w h LEU 69 CO -0.16 0.17 0.24 0.58 -0.34 0.00 0.00 178.44 178.93 1i1w h VAL 70 N 0.15 1.16 -0.53 1.05 2.07 -0.92 0.58 116.25 119.81 1i1w h VAL 70 Ca 0.05 -0.41 -0.05 0.00 0.82 0.00 0.00 66.70 67.12 1i1w h VAL 70 Cb 0.04 0.63 -0.02 0.00 -1.52 0.00 0.00 31.29 30.41 1i1w h VAL 70 CO -0.01 0.17 0.16 -1.13 0.02 0.00 0.00 177.57 176.77 1i1w h ASN 71 N 0.58 0.79 -0.41 0.57 -1.24 -1.01 -0.92 115.58 113.93 1i1w h ASN 71 Ca 0.15 -0.21 -0.00 0.00 0.71 0.00 0.00 56.30 56.95 1i1w h ASN 71 Cb 0.05 -0.21 -0.02 0.00 0.73 0.00 0.00 38.32 38.88 1i1w h ASN 71 CO -0.03 0.79 0.25 -0.25 -1.29 0.00 0.00 177.43 176.91 1i1w h TRP 72 N 0.74 0.54 -0.19 0.67 7.01 -0.80 0.12 115.95 124.04 1i1w h TRP 72 Ca 0.17 -0.00 0.01 0.00 2.11 0.00 0.00 58.89 61.18 1i1w h TRP 72 Cb 0.30 -0.18 -0.02 0.00 -2.10 0.00 0.00 29.16 27.16 1i1w h TRP 72 CO 0.02 0.38 0.09 0.00 -2.79 0.00 0.00 178.44 176.14 1i1w h ALA 73 N 1.11 0.23 -0.39 2.65 0.00 -0.69 -1.41 119.26 120.77 1i1w h ALA 73 Ca 0.15 0.01 0.02 0.00 0.00 0.00 0.00 54.91 55.09 1i1w h ALA 73 Cb -0.01 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 17.73 1i1w h ALA 73 CO -0.03 -0.33 0.21 1.96 0.00 0.00 0.00 179.25 181.06 1i1w h GLN 74 N 0.20 0.42 -0.70 0.00 4.20 -0.86 0.47 115.11 118.84 1i1w h GLN 74 Ca 0.08 -0.03 0.10 0.00 0.06 0.00 0.00 58.65 58.86 1i1w h GLN 74 Cb 0.02 -0.09 -0.05 0.00 0.30 0.00 0.00 27.48 27.66 1i1w h GLN 74 CO -0.06 0.28 0.46 1.96 -0.67 0.00 0.00 178.83 180.80 1i1w h GLN 75 N 0.43 0.55 -0.45 1.46 4.20 -0.64 -2.82 115.11 117.84 1i1w h GLN 75 Ca 0.16 -0.03 0.00 0.00 0.06 0.00 0.00 58.65 58.83 1i1w h GLN 75 Cb 0.04 -0.12 0.00 0.00 0.30 0.00 0.00 27.48 27.69 1i1w h GLN 75 CO -0.09 0.37 0.00 0.09 -0.67 0.00 0.00 178.83 178.53 1i1w n ASN 76 N -4.49 3.30 -1.26 1.46 3.02 -0.56 -4.98 115.26 111.75 1i1w n ASN 76 Ca 0.11 -1.95 -0.10 0.00 -0.03 0.00 0.00 54.58 52.62 1i1w n ASN 76 Cb 0.35 -0.30 0.00 0.00 -0.61 0.00 0.00 39.78 39.22 1i1w n ASN 76 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1i1w n GLY 77 N 1.13 0.01 3.60 7.41 0.00 -0.42 -4.98 105.19 111.94 1i1w n GLY 77 Ca 0.17 -0.44 -0.34 0.00 0.00 0.00 0.00 46.02 45.41 1i1w n GLY 77 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1i1w s LYS 78 N -4.68 3.72 0.79 1.61 -0.14 0.03 -4.86 119.74 116.21 1i1w s LYS 78 Ca 0.05 -0.41 -0.11 0.00 -1.36 0.00 0.00 55.97 54.14 1i1w s LYS 78 Cb -0.02 -3.05 0.07 0.00 -1.68 0.00 0.00 37.83 33.15 1i1w s LYS 78 CO 0.06 0.34 1.11 -0.51 -0.76 0.00 0.00 175.35 175.59 1i1w s LEU 79 N 0.15 3.05 -0.06 3.17 1.43 -0.44 -4.32 118.68 121.67 1i1w s LEU 79 Ca 0.02 1.97 0.04 0.00 -1.03 0.00 0.00 54.13 55.13 1i1w s LEU 79 Cb -0.13 -4.54 0.00 0.00 0.03 0.00 0.00 46.19 41.55 1i1w s LEU 79 CO 0.01 -2.26 -0.18 -0.63 0.23 0.00 0.00 176.35 173.53 1i1w s ILE 80 N -2.71 1.49 -0.27 -0.59 1.01 -1.26 -0.42 121.20 118.45 1i1w s ILE 80 Ca 0.64 -0.73 -0.07 0.00 0.00 0.00 0.00 60.65 60.50 1i1w s ILE 80 Cb -0.20 -1.30 -0.01 0.00 0.01 0.00 0.00 42.46 40.97 1i1w s ILE 80 CO 0.54 0.43 0.06 -0.13 0.00 0.00 0.00 174.94 175.84 1i1w s ARG 81 N 0.20 3.31 0.30 2.79 0.52 -0.62 -1.29 118.95 124.17 1i1w s ARG 81 Ca -0.08 -0.70 -0.28 0.00 -0.52 0.00 0.00 55.73 54.14 1i1w s ARG 81 Cb -0.13 -3.31 -0.09 0.00 0.52 0.00 0.00 34.95 31.94 1i1w s ARG 81 CO 0.04 -0.33 1.09 0.20 0.02 0.00 0.00 175.30 176.32 1i1w s GLY 82 N 1.53 3.01 -0.23 -3.53 0.00 0.65 -4.06 107.32 104.71 1i1w s GLY 82 Ca 0.04 0.87 -0.05 0.00 0.00 0.00 0.00 44.72 45.58 1i1w s GLY 82 CO 0.02 1.44 0.43 -1.58 0.00 0.00 0.00 173.10 173.41 1i1w s HIS 83 N -1.25 -0.89 -0.07 1.90 5.04 -1.26 -0.88 115.29 117.89 1i1w s HIS 83 Ca 0.47 1.34 -0.12 0.00 -1.54 0.00 0.00 55.06 55.20 1i1w s HIS 83 Cb -0.30 0.25 0.03 0.00 0.04 0.00 0.00 32.58 32.59 1i1w s HIS 83 CO 0.39 -0.60 0.30 -0.08 -2.34 0.00 0.00 174.74 172.41 1i1w s THR 84 N 2.62 0.03 -0.03 0.89 -1.32 -1.23 -3.41 115.64 113.18 1i1w s THR 84 Ca 0.05 -0.25 -0.19 0.00 -1.21 0.00 0.00 61.69 60.09 1i1w s THR 84 Cb -0.13 -0.51 -0.32 0.00 -1.51 0.00 0.00 72.50 70.02 1i1w s THR 84 CO -0.15 -0.14 0.87 -0.07 -2.21 0.00 0.00 174.62 172.93 1i1w h LEU 85 N 4.81 0.57 -7.61 9.08 3.38 -1.39 -3.39 115.31 120.76 1i1w h LEU 85 Ca -0.28 -0.93 -0.58 0.00 0.09 0.00 0.00 57.88 56.18 1i1w h LEU 85 Cb 1.18 -0.19 -0.38 0.00 0.09 0.00 0.00 40.66 41.37 1i1w h LEU 85 CO 0.35 1.53 -0.79 -0.69 0.09 0.00 0.00 178.44 178.93 1i1w s VAL 86 N -2.49 1.27 -0.13 1.22 1.01 -0.27 -4.86 120.40 116.16 1i1w s VAL 86 Ca -0.13 -0.88 -0.29 0.00 0.00 0.00 0.00 61.98 60.67 1i1w s VAL 86 Cb 0.02 -1.50 0.08 0.00 0.00 0.00 0.00 36.38 34.98 1i1w s VAL 86 CO 0.86 0.02 0.74 0.86 0.00 0.00 0.00 175.10 177.58 1i1w s TRP 87 N 1.54 -0.65 -0.31 5.22 -0.00 -1.26 -1.25 118.94 122.22 1i1w s TRP 87 Ca -0.02 1.29 0.21 0.00 -0.00 0.00 0.00 56.10 57.57 1i1w s TRP 87 Cb -0.17 0.38 0.17 0.00 -0.00 0.00 0.00 33.47 33.85 1i1w s TRP 87 CO -0.07 -0.51 1.39 1.12 -0.00 0.00 0.00 176.95 178.88 1i1w h HIS 88 N 3.52 0.00 -3.52 5.86 2.07 -1.92 -3.43 115.15 117.73 1i1w h HIS 88 Ca -0.27 0.00 -0.50 0.00 -2.85 0.00 0.00 60.37 56.75 1i1w h HIS 88 Cb 1.15 0.00 0.01 0.00 2.57 0.00 0.00 27.41 31.13 1i1w h HIS 88 CO 0.37 0.14 0.04 0.45 -3.07 0.00 0.00 177.93 175.86 1i1w s SER 89 N -6.03 6.46 -1.59 3.10 0.15 -1.26 -4.17 113.70 110.36 1i1w s SER 89 Ca 0.04 0.97 -0.15 0.00 0.70 0.00 0.00 55.95 57.51 1i1w s SER 89 Cb 0.07 -2.26 0.11 0.00 -1.71 0.00 0.00 66.02 62.23 1i1w s SER 89 CO 0.72 -0.37 0.91 0.00 1.20 0.00 0.00 173.24 175.71 1i1w n GLN 90 N -1.35 -4.74 -3.85 5.44 6.02 -1.26 -4.87 117.38 112.77 1i1w n GLN 90 Ca 0.01 0.52 -0.36 0.00 -0.01 0.00 0.00 57.00 57.16 1i1w n GLN 90 Cb 0.54 -5.35 -0.13 0.00 1.02 0.00 0.00 30.24 26.32 1i1w n GLN 90 CO 0.00 0.00 0.00 -1.17 -1.01 0.00 0.00 177.06 174.88 1i1w s LEU 91 N -7.27 3.15 0.64 1.08 2.96 -1.26 -1.53 118.68 116.45 1i1w s LEU 91 Ca 0.68 -0.40 -0.18 0.00 -0.22 0.00 0.00 54.13 54.01 1i1w s LEU 91 Cb -0.35 -1.80 -0.02 0.00 0.50 0.00 0.00 46.19 44.52 1i1w s LEU 91 CO 0.86 -0.05 1.11 -2.65 -1.32 0.00 0.00 176.35 174.31 1i1w n PRO 92 N 4.83 0.94 0.26 0.98 -0.02 -1.26 -4.81 135.00 135.91 1i1w n PRO 92 Ca -0.17 0.37 0.11 0.00 -2.02 0.00 0.00 63.50 61.79 1i1w n PRO 92 Cb 0.50 -2.34 0.69 0.00 -0.02 0.00 0.00 33.50 32.33 1i1w n PRO 92 CO 0.00 0.00 0.00 0.77 1.98 0.00 0.00 175.50 178.25 1i1w h SER 93 N 0.40 0.00 0.05 2.55 0.02 -1.98 -1.02 113.55 113.56 1i1w h SER 93 Ca -0.50 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 60.45 1i1w h SER 93 Cb 1.35 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.89 1i1w h SER 93 CO 0.51 0.14 -0.04 4.11 -1.14 0.00 0.00 176.83 180.41 1i1w h TRP 94 N 0.00 0.00 0.00 3.45 5.08 -1.92 -1.65 115.95 120.91 1i1w h TRP 94 Ca -0.00 0.00 -0.00 0.00 1.08 0.00 0.00 58.89 59.97 1i1w h TRP 94 Cb 0.35 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.51 1i1w h TRP 94 CO 0.00 0.04 -0.00 0.28 -1.28 0.00 0.00 178.44 177.48 1i1w h VAL 95 N 0.00 1.36 0.00 0.12 2.07 -1.54 -3.38 116.25 114.88 1i1w h VAL 95 Ca -0.00 -2.01 0.00 0.00 0.82 0.00 0.00 66.70 65.51 1i1w h VAL 95 Cb 0.07 2.57 0.00 0.00 -1.52 0.00 0.00 31.29 32.41 1i1w h VAL 95 CO 0.01 0.46 0.00 -1.54 0.02 0.00 0.00 177.57 176.52 1i1w n SER 96 N -4.65 0.72 0.01 0.57 3.41 -1.06 -1.88 113.62 110.74 1i1w n SER 96 Ca -0.08 0.67 0.13 0.00 -0.26 0.00 0.00 58.87 59.34 1i1w n SER 96 Cb 0.36 -0.83 0.46 0.00 -0.26 0.00 0.00 64.21 63.94 1i1w n SER 96 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1i1w n SER 97 N -2.29 0.28 -4.73 4.04 7.64 -0.64 -4.89 113.62 113.02 1i1w n SER 97 Ca 0.02 0.26 -0.41 0.00 1.01 0.00 0.00 58.87 59.75 1i1w n SER 97 Cb 0.24 -0.26 -0.03 0.00 -1.01 0.00 0.00 64.21 63.15 1i1w n SER 97 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 1i1w s ILE 98 N -3.02 3.62 -0.06 0.44 1.01 -0.79 -4.93 121.20 117.47 1i1w s ILE 98 Ca 0.12 1.32 0.01 0.00 0.00 0.00 0.00 60.65 62.10 1i1w s ILE 98 Cb 0.18 -3.85 0.01 0.00 0.01 0.00 0.00 42.46 38.81 1i1w s ILE 98 CO 0.60 0.19 0.69 0.35 0.00 0.00 0.00 174.94 176.78 1i1w n THR 99 N 2.76 0.35 -3.83 2.92 -2.24 -1.26 -4.94 114.28 108.03 1i1w n THR 99 Ca 0.05 -0.68 -0.35 0.00 -2.27 0.00 0.00 64.05 60.81 1i1w n THR 99 Cb 0.45 0.83 -0.09 0.00 -2.10 0.00 0.00 70.33 69.42 1i1w n THR 99 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1i1w s ASP 100 N -0.38 5.91 0.10 3.42 2.15 -1.26 -4.96 116.67 121.64 1i1w s ASP 100 Ca 0.01 0.13 -0.25 0.00 0.43 0.00 0.00 52.55 52.87 1i1w s ASP 100 Cb 0.01 -2.03 -0.13 0.00 -0.30 0.00 0.00 42.92 40.47 1i1w s ASP 100 CO 0.01 0.15 1.70 0.50 -0.17 0.00 0.00 175.17 177.36 1i1w h LYS 101 N 6.89 -0.22 -0.64 4.34 3.64 -1.96 -1.16 116.57 127.46 1i1w h LYS 101 Ca -0.39 0.01 -0.02 0.00 -1.27 0.00 0.00 60.65 58.99 1i1w h LYS 101 Cb 1.16 0.05 -0.03 0.00 -0.41 0.00 0.00 32.23 33.00 1i1w h LYS 101 CO 0.71 -0.15 0.31 -0.91 -2.27 0.00 0.00 179.45 177.15 1i1w h ASN 102 N -0.23 0.84 0.00 4.20 2.35 -1.95 0.35 115.58 121.13 1i1w h ASN 102 Ca 0.00 -0.13 0.03 0.00 -0.55 0.00 0.00 56.30 55.65 1i1w h ASN 102 Cb 0.22 -0.21 -0.04 0.00 0.05 0.00 0.00 38.32 38.34 1i1w h ASN 102 CO -0.03 0.73 -0.19 0.74 -1.65 0.00 0.00 177.43 177.03 1i1w h THR 103 N 0.88 0.55 -0.26 2.81 2.02 -1.93 -0.80 112.91 116.19 1i1w h THR 103 Ca 0.22 0.00 -0.14 0.00 0.77 0.00 0.00 66.41 67.26 1i1w h THR 103 Cb 0.11 0.55 -0.01 0.00 -1.74 0.00 0.00 68.15 67.06 1i1w h THR 103 CO -0.03 0.00 -0.42 0.25 0.37 0.00 0.00 175.52 175.69 1i1w h LEU 104 N -0.31 0.66 -0.35 2.58 5.85 -1.02 -0.98 115.31 121.74 1i1w h LEU 104 Ca 0.06 -0.30 0.03 0.00 0.84 0.00 0.00 57.88 58.50 1i1w h LEU 104 Cb 0.38 -0.19 -0.03 0.00 0.37 0.00 0.00 40.66 41.19 1i1w h LEU 104 CO -0.17 0.99 0.16 0.74 -0.34 0.00 0.00 178.44 179.82 1i1w h THR 105 N 0.51 0.96 -0.54 1.05 2.02 -0.74 0.76 112.91 116.93 1i1w h THR 105 Ca 0.04 -0.11 -0.10 0.00 0.77 0.00 0.00 66.41 67.00 1i1w h THR 105 Cb 0.94 0.60 -0.02 0.00 -1.74 0.00 0.00 68.15 67.92 1i1w h THR 105 CO 0.08 0.06 -0.07 0.78 0.37 0.00 0.00 175.52 176.74 1i1w h ASN 106 N 0.33 0.98 -0.27 4.18 2.35 -0.94 -0.42 115.58 121.79 1i1w h ASN 106 Ca 0.15 -0.30 0.01 0.00 -0.55 0.00 0.00 56.30 55.60 1i1w h ASN 106 Cb 0.08 -0.27 -0.01 0.00 0.05 0.00 0.00 38.32 38.17 1i1w h ASN 106 CO -0.12 1.07 0.17 0.58 -1.65 0.00 0.00 177.43 177.49 1i1w h VAL 107 N 0.89 1.06 -0.15 2.81 2.07 -0.85 -0.57 116.25 121.51 1i1w h VAL 107 Ca 0.15 -0.12 -0.01 0.00 0.82 0.00 0.00 66.70 67.54 1i1w h VAL 107 Cb 0.62 0.67 -0.01 0.00 -1.52 0.00 0.00 31.29 31.05 1i1w h VAL 107 CO 0.04 0.07 0.06 -0.03 0.02 0.00 0.00 177.57 177.72 1i1w h MET 108 N 0.36 0.23 -0.63 1.57 1.85 -0.62 -0.45 114.93 117.24 1i1w h MET 108 Ca 0.10 -0.04 -0.00 0.00 -0.61 0.00 0.00 59.70 59.15 1i1w h MET 108 Cb -0.03 -0.04 -0.03 0.00 0.43 0.00 0.00 31.60 31.93 1i1w h MET 108 CO -0.03 0.32 0.39 0.87 -0.40 0.00 0.00 176.91 178.06 1i1w h LYS 109 N 0.09 0.84 -0.61 0.39 1.57 -1.01 -1.07 116.57 116.77 1i1w h LYS 109 Ca 0.05 -0.07 -0.06 0.00 -1.87 0.00 0.00 60.65 58.70 1i1w h LYS 109 Cb 0.18 -0.18 -0.03 0.00 0.08 0.00 0.00 32.23 32.28 1i1w h LYS 109 CO -0.00 0.59 0.13 -0.97 -0.57 0.00 0.00 179.45 178.62 1i1w h ASN 110 N 0.85 0.91 -0.21 0.86 -1.24 -0.90 0.16 115.58 116.01 1i1w h ASN 110 Ca 0.23 -0.19 -0.01 0.00 0.71 0.00 0.00 56.30 57.04 1i1w h ASN 110 Cb -0.05 -0.24 -0.01 0.00 0.73 0.00 0.00 38.32 38.75 1i1w h ASN 110 CO -0.04 0.90 0.10 -0.74 -1.29 0.00 0.00 177.43 176.35 1i1w h HIS 111 N 0.92 0.29 0.42 0.67 2.76 -0.70 -0.30 115.15 119.22 1i1w h HIS 111 Ca 0.19 -0.01 -0.01 0.00 -2.20 0.00 0.00 60.37 58.33 1i1w h HIS 111 Cb 0.36 -0.09 -0.00 0.00 1.55 0.00 0.00 27.41 29.22 1i1w h HIS 111 CO 0.02 0.30 -0.25 0.82 -1.30 0.00 0.00 177.93 177.52 1i1w h ILE 112 N 0.21 0.48 -0.68 6.26 2.04 -1.00 -2.41 117.51 122.40 1i1w h ILE 112 Ca 0.07 0.00 -0.08 0.00 1.00 0.00 0.00 64.86 65.85 1i1w h ILE 112 Cb 0.11 0.48 -0.03 0.00 -0.74 0.00 0.00 36.82 36.64 1i1w h ILE 112 CO -0.01 0.00 0.13 0.74 0.00 0.00 0.00 178.15 179.01 1i1w h THR 113 N -0.64 1.26 -0.14 -0.27 2.02 -0.92 -1.15 112.91 113.07 1i1w h THR 113 Ca -0.05 -1.02 -0.01 0.00 0.77 0.00 0.00 66.41 66.10 1i1w h THR 113 Cb 0.52 0.60 -0.01 0.00 -1.74 0.00 0.00 68.15 67.53 1i1w h THR 113 CO 0.05 0.39 0.04 0.74 0.37 0.00 0.00 175.52 177.11 1i1w h THR 114 N 1.05 1.18 -0.20 3.16 2.02 -1.01 -0.39 112.91 118.72 1i1w h THR 114 Ca 0.21 -0.57 -0.02 0.00 0.77 0.00 0.00 66.41 66.80 1i1w h THR 114 Cb 0.42 1.30 -0.01 0.00 -1.74 0.00 0.00 68.15 68.12 1i1w h THR 114 CO 0.01 0.17 0.06 -0.07 0.37 0.00 0.00 175.52 176.06 1i1w h LEU 115 N 0.04 0.30 -0.72 2.58 4.07 -1.31 -2.43 115.31 117.84 1i1w h LEU 115 Ca 0.05 -0.21 -0.14 0.00 0.08 0.00 0.00 57.88 57.66 1i1w h LEU 115 Cb 0.23 -0.08 -0.01 0.00 1.08 0.00 0.00 40.66 41.88 1i1w h LEU 115 CO -0.00 0.42 -0.57 0.24 -1.08 0.00 0.00 178.44 177.45 1i1w h MET 116 N 0.15 0.21 -0.31 1.13 2.86 -1.15 -2.87 114.93 114.96 1i1w h MET 116 Ca 0.07 -0.14 -0.13 0.00 -2.06 0.00 0.00 59.70 57.44 1i1w h MET 116 Cb 0.23 0.02 -0.01 0.00 0.06 0.00 0.00 31.60 31.90 1i1w h MET 116 CO -0.00 0.72 -0.35 0.00 1.06 0.00 0.00 176.91 178.34 1i1w h THR 117 N 0.16 1.29 -0.84 2.22 1.03 -1.05 -2.17 112.91 113.54 1i1w h THR 117 Ca -0.00 -1.50 0.03 0.00 -0.01 0.00 0.00 66.41 64.93 1i1w h THR 117 Cb 1.05 1.42 -0.05 0.00 -1.07 0.00 0.00 68.15 69.51 1i1w h THR 117 CO 0.09 0.48 0.56 -0.09 -0.01 0.00 0.00 175.52 176.55 1i1w h ARG 118 N 0.58 1.05 -0.43 0.00 2.43 -1.20 -2.51 114.38 114.29 1i1w h ARG 118 Ca 0.06 -0.06 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 1i1w h ARG 118 Cb 0.87 -0.24 0.00 0.00 -0.42 0.00 0.00 29.97 30.18 1i1w h ARG 118 CO 0.08 0.69 0.00 0.66 -1.51 0.00 0.00 179.97 179.89 1i1w n TYR 119 N -4.43 1.47 -1.64 2.20 4.01 -1.15 -5.03 117.16 112.57 1i1w n TYR 119 Ca 0.11 -0.79 -0.47 0.00 -0.16 0.00 0.00 57.90 56.59 1i1w n TYR 119 Cb 0.08 -0.39 -0.04 0.00 -0.31 0.00 0.00 39.34 38.68 1i1w n TYR 119 CO 0.00 0.00 0.00 1.17 -0.46 0.00 0.00 176.86 177.57 1i1w n LYS 120 N 0.12 1.79 0.00 -0.72 4.81 -0.83 -1.03 118.16 122.30 1i1w n LYS 120 Ca 0.24 0.64 0.00 0.00 -0.87 0.00 0.00 58.31 58.33 1i1w n LYS 120 Cb 1.02 -2.32 0.00 0.00 0.02 0.00 0.00 35.03 33.74 1i1w n LYS 120 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1i1w n GLY 121 N 2.71 2.55 0.00 3.14 0.00 -1.26 -4.85 105.19 107.48 1i1w n GLY 121 Ca 0.16 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.28 1i1w n GLY 121 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1i1w n LYS 122 N -2.00 0.03 -3.87 1.61 5.02 -0.20 -4.92 118.16 113.84 1i1w n LYS 122 Ca 0.00 -0.01 -0.36 0.00 -2.02 0.00 0.00 58.31 55.93 1i1w n LYS 122 Cb 0.00 -1.50 -0.14 0.00 -0.02 0.00 0.00 35.03 33.37 1i1w n LYS 122 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1i1w s ILE 123 N -3.02 3.45 0.13 -0.18 -1.09 -1.25 -4.56 121.20 114.69 1i1w s ILE 123 Ca 0.08 -0.73 -0.16 0.00 -2.23 0.00 0.00 60.65 57.61 1i1w s ILE 123 Cb 0.16 -2.71 -0.01 0.00 -1.58 0.00 0.00 42.46 38.33 1i1w s ILE 123 CO 0.84 0.22 1.71 -0.09 -1.23 0.00 0.00 174.94 176.39 1i1w h ARG 124 N 8.13 0.56 -3.06 2.79 9.65 -1.55 -3.39 114.38 127.51 1i1w h ARG 124 Ca -0.35 -0.09 -0.12 0.00 -1.10 0.00 0.00 59.98 58.32 1i1w h ARG 124 Cb 1.13 -0.10 -0.21 0.00 -1.39 0.00 0.00 29.97 29.40 1i1w h ARG 124 CO 0.59 0.50 -0.31 0.00 2.80 0.00 0.00 179.97 183.56 1i1w s ALA 125 N -5.69 -0.75 -0.05 2.80 0.00 -1.21 -1.18 121.76 115.69 1i1w s ALA 125 Ca -0.13 0.39 0.06 0.00 0.00 0.00 0.00 51.96 52.27 1i1w s ALA 125 Cb 0.10 -0.03 -0.02 0.00 0.00 0.00 0.00 23.12 23.18 1i1w s ALA 125 CO 0.74 -0.24 -0.22 -1.58 0.00 0.00 0.00 175.76 174.47 1i1w s TRP 126 N -1.07 2.50 -0.91 0.00 0.52 -0.06 -0.25 118.94 119.67 1i1w s TRP 126 Ca -0.11 -0.51 -0.24 0.00 0.02 0.00 0.00 56.10 55.26 1i1w s TRP 126 Cb -0.05 -1.60 0.05 0.00 -1.15 0.00 0.00 33.47 30.72 1i1w s TRP 126 CO 0.03 -0.07 1.36 -0.51 0.02 0.00 0.00 176.95 177.78 1i1w s ASP 127 N -0.38 6.38 -0.02 2.95 1.01 -0.06 -0.62 116.67 125.93 1i1w s ASP 127 Ca 0.03 -1.11 -0.25 0.00 0.71 0.00 0.00 52.55 51.94 1i1w s ASP 127 Cb -0.12 -2.55 -0.20 0.00 1.01 0.00 0.00 42.92 41.06 1i1w s ASP 127 CO 0.02 -1.61 1.24 0.58 0.21 0.00 0.00 175.17 175.61 1i1w h VAL 128 N 6.46 1.42 -3.40 -1.27 2.07 -1.30 -1.81 116.25 118.42 1i1w h VAL 128 Ca 0.01 -1.31 -0.61 0.00 0.82 0.00 0.00 66.70 65.62 1i1w h VAL 128 Cb 1.03 2.22 -0.33 0.00 -1.52 0.00 0.00 31.29 32.69 1i1w h VAL 128 CO 1.36 0.35 -0.85 -0.69 0.02 0.00 0.00 177.57 177.76 1i1w s VAL 129 N -4.06 1.66 -0.08 2.57 1.01 -1.20 -1.11 120.40 119.20 1i1w s VAL 129 Ca -0.16 -0.79 0.05 0.00 0.00 0.00 0.00 61.98 61.08 1i1w s VAL 129 Cb 0.02 -1.46 -0.01 0.00 0.00 0.00 0.00 36.38 34.93 1i1w s VAL 129 CO 0.70 0.47 -0.22 0.21 0.00 0.00 0.00 175.10 176.26 1i1w s ASN 130 N 0.45 3.28 -1.30 3.32 2.47 -0.38 -1.36 114.94 121.43 1i1w s ASN 130 Ca -0.17 -0.47 -0.05 0.00 0.42 0.00 0.00 52.86 52.60 1i1w s ASN 130 Cb -0.17 -1.06 0.01 0.00 -1.45 0.00 0.00 41.25 38.58 1i1w s ASN 130 CO 0.07 0.23 1.04 -0.62 -3.72 0.00 0.00 177.10 174.09 1i1w n GLU 131 N 3.09 -6.88 0.05 0.43 1.02 -0.08 -4.59 120.64 113.68 1i1w n GLU 131 Ca -0.18 0.80 0.12 0.00 -0.02 0.00 0.00 57.16 57.88 1i1w n GLU 131 Cb 0.52 -5.77 0.49 0.00 -0.02 0.00 0.00 31.44 26.66 1i1w n GLU 131 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1i1w n ALA 132 N -4.53 2.15 -2.62 0.62 0.00 -1.26 -4.81 120.51 110.06 1i1w n ALA 132 Ca -0.15 -0.04 -0.34 0.00 0.00 0.00 0.00 53.44 52.90 1i1w n ALA 132 Cb 0.62 -1.43 -0.11 0.00 0.00 0.00 0.00 19.45 18.53 1i1w n ALA 132 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 1i1w s PHE 133 N -3.07 3.01 0.90 0.00 0.40 -1.26 -0.35 117.98 117.60 1i1w s PHE 133 Ca 0.11 0.07 -0.13 0.00 -0.60 0.00 0.00 56.93 56.38 1i1w s PHE 133 Cb 0.14 -1.72 0.13 0.00 0.51 0.00 0.00 43.02 42.08 1i1w s PHE 133 CO 0.50 0.38 1.16 -0.80 0.70 0.00 0.00 175.22 177.17 1i1w s ASN 134 N -0.92 3.62 0.48 1.36 0.01 0.82 -4.63 114.94 115.69 1i1w s ASN 134 Ca 0.13 0.85 0.30 0.00 -0.71 0.00 0.00 52.86 53.44 1i1w s ASN 134 Cb -0.11 -1.36 1.08 0.00 0.41 0.00 0.00 41.25 41.28 1i1w s ASN 134 CO 0.03 -2.47 1.87 -0.33 -1.51 0.00 0.00 177.10 174.68 1i1w h GLU 135 N -1.44 0.00 -0.02 -0.60 4.39 -2.00 -1.88 114.58 113.03 1i1w h GLU 135 Ca -0.49 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.21 1i1w h GLU 135 Cb 1.32 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.97 1i1w h GLU 135 CO 0.60 0.00 0.00 -0.40 -1.16 0.00 0.00 179.01 178.05 1i1w n ASP 136 N -2.97 0.95 0.00 1.42 5.75 -1.26 -3.84 116.55 116.60 1i1w n ASP 136 Ca 0.02 -1.35 0.00 0.00 -0.01 0.00 0.00 54.79 53.45 1i1w n ASP 136 Cb 0.35 -0.01 0.00 0.00 -1.03 0.00 0.00 41.12 40.43 1i1w n ASP 136 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1i1w n GLY 137 N 1.10 1.55 3.73 6.12 0.00 -0.71 -4.74 105.19 112.23 1i1w n GLY 137 Ca 0.20 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.92 1i1w n GLY 137 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1i1w s SER 138 N -3.04 3.61 0.12 1.61 1.04 -1.26 -4.77 113.70 111.00 1i1w s SER 138 Ca 0.00 1.51 -0.30 0.00 0.48 0.00 0.00 55.95 57.64 1i1w s SER 138 Cb 0.00 -2.20 -0.06 0.00 0.10 0.00 0.00 66.02 63.86 1i1w s SER 138 CO 0.00 -2.55 0.98 -0.76 0.98 0.00 0.00 173.24 171.89 1i1w s LEU 139 N -6.17 4.50 0.19 2.42 1.43 -1.26 -0.12 118.68 119.66 1i1w s LEU 139 Ca 0.63 1.83 -0.32 0.00 -1.03 0.00 0.00 54.13 55.25 1i1w s LEU 139 Cb -0.18 -3.59 -0.11 0.00 0.03 0.00 0.00 46.19 42.34 1i1w s LEU 139 CO 0.57 -0.08 1.72 -0.60 0.23 0.00 0.00 176.35 178.18 1i1w s ARG 140 N -0.06 4.14 -1.43 1.70 3.52 0.52 -4.66 118.95 122.68 1i1w s ARG 140 Ca 0.47 2.57 -0.12 0.00 -0.13 0.00 0.00 55.73 58.53 1i1w s ARG 140 Cb -0.24 -3.16 0.06 0.00 -1.56 0.00 0.00 34.95 30.04 1i1w s ARG 140 CO 0.30 -0.75 2.25 1.04 -0.81 0.00 0.00 175.30 177.34 1i1w n GLN 141 N 4.24 3.24 -2.16 5.12 3.00 -1.26 -4.66 117.38 124.90 1i1w n GLN 141 Ca 0.16 -2.81 -0.27 0.00 -0.01 0.00 0.00 57.00 54.07 1i1w n GLN 141 Cb 0.36 -3.11 0.11 0.00 0.00 0.00 0.00 30.24 27.60 1i1w n GLN 141 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.06 178.01 1i1w s THR 142 N 2.17 2.15 0.36 5.09 -4.23 -1.26 -4.78 115.64 115.14 1i1w s THR 142 Ca 0.49 -0.22 0.06 0.00 -1.18 0.00 0.00 61.69 60.83 1i1w s THR 142 Cb 0.14 -2.93 0.29 0.00 1.34 0.00 0.00 72.50 71.34 1i1w s THR 142 CO -0.06 0.00 1.96 1.62 -0.54 0.00 0.00 174.62 177.59 1i1w h VAL 143 N -0.90 1.02 -0.20 2.29 3.04 -1.92 0.11 116.25 119.69 1i1w h VAL 143 Ca -0.43 -0.26 -0.02 0.00 -1.01 0.00 0.00 66.70 64.98 1i1w h VAL 143 Cb 1.29 0.19 -0.01 0.00 -2.01 0.00 0.00 31.29 30.75 1i1w h VAL 143 CO 0.52 0.14 0.06 -0.26 -1.01 0.00 0.00 177.57 177.02 1i1w h PHE 144 N 0.76 0.34 -0.51 3.17 0.04 -1.94 -0.32 116.94 118.47 1i1w h PHE 144 Ca 0.32 -0.04 -0.07 0.00 2.80 0.00 0.00 57.97 60.98 1i1w h PHE 144 Cb 0.27 -0.10 -0.02 0.00 2.20 0.00 0.00 35.95 38.30 1i1w h PHE 144 CO -0.00 0.43 0.06 1.25 -0.60 0.00 0.00 178.31 179.45 1i1w h LEU 145 N 0.15 0.83 -0.84 1.54 5.85 -1.63 -0.39 115.31 120.82 1i1w h LEU 145 Ca 0.06 -0.27 -0.11 0.00 0.84 0.00 0.00 57.88 58.40 1i1w h LEU 145 Cb 0.25 -0.22 -0.01 0.00 0.37 0.00 0.00 40.66 41.05 1i1w h LEU 145 CO -0.00 0.89 -0.32 0.78 -0.34 0.00 0.00 178.44 179.45 1i1w h ASN 146 N 0.74 0.50 0.00 1.25 2.35 -0.62 -1.38 115.58 118.42 1i1w h ASN 146 Ca 0.15 -0.19 -0.36 0.00 -0.55 0.00 0.00 56.30 55.35 1i1w h ASN 146 Cb 0.43 -0.14 -0.06 0.00 0.05 0.00 0.00 38.32 38.60 1i1w h ASN 146 CO 0.01 0.80 -2.31 0.52 -1.65 0.00 0.00 177.43 174.80 1i1w n VAL 147 N -4.08 1.30 0.10 2.81 0.31 -0.15 -4.58 118.33 114.05 1i1w n VAL 147 Ca -0.01 -0.45 -0.20 0.00 -0.01 0.00 0.00 64.34 63.67 1i1w n VAL 147 Cb 0.45 -1.46 -0.15 0.00 -0.91 0.00 0.00 33.84 31.77 1i1w n VAL 147 CO 0.00 0.00 0.00 0.40 -1.32 0.00 0.00 176.83 175.91 1i1w h ILE 148 N -0.27 1.22 0.00 2.52 2.04 -1.23 -3.37 117.51 118.43 1i1w h ILE 148 Ca -0.54 -2.77 0.00 0.00 1.00 0.00 0.00 64.86 62.55 1i1w h ILE 148 Cb 1.71 2.89 0.00 0.00 -0.74 0.00 0.00 36.82 40.68 1i1w h ILE 148 CO -0.17 0.84 0.00 0.61 0.00 0.00 0.00 178.15 179.43 1i1w n GLY 149 N 1.69 -1.80 0.45 5.37 0.00 -0.52 -4.44 105.19 105.93 1i1w n GLY 149 Ca -0.17 -1.86 0.26 0.00 0.00 0.00 0.00 46.02 44.25 1i1w n GLY 149 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1i1w h GLU 150 N 0.00 0.10 0.00 1.61 4.39 -1.90 -0.96 114.58 117.83 1i1w h GLU 150 Ca 0.00 -0.01 0.00 0.00 0.34 0.00 0.00 59.36 59.69 1i1w h GLU 150 Cb 0.00 -0.02 0.00 0.00 -0.10 0.00 0.00 28.75 28.63 1i1w h GLU 150 CO 0.00 0.07 0.00 -0.44 -1.16 0.00 0.00 179.01 177.48 1i1w h ASP 151 N 0.11 0.00 -0.47 1.42 3.32 -1.96 -3.22 116.42 115.62 1i1w h ASP 151 Ca 0.44 0.00 0.01 0.00 0.02 0.00 0.00 57.03 57.50 1i1w h ASP 151 Cb 1.55 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 41.08 1i1w h ASP 151 CO -0.06 0.00 0.31 0.10 -1.72 0.00 0.00 179.24 177.88 1i1w h TYR 152 N 0.00 0.57 0.17 4.55 -0.00 -1.43 0.04 116.97 120.87 1i1w h TYR 152 Ca 0.00 0.01 -0.01 0.00 0.00 0.00 0.00 58.73 58.74 1i1w h TYR 152 Cb 0.18 -0.19 0.00 0.00 0.00 0.00 0.00 36.73 36.72 1i1w h TYR 152 CO 0.00 0.35 -0.08 0.82 -0.00 0.00 0.00 178.16 179.25 1i1w h ILE 153 N 0.61 0.93 -0.60 -0.90 2.04 -1.81 -0.59 117.51 117.19 1i1w h ILE 153 Ca 0.18 -0.95 0.12 0.00 1.00 0.00 0.00 64.86 65.21 1i1w h ILE 153 Cb -0.03 1.46 -0.09 0.00 -0.74 0.00 0.00 36.82 37.43 1i1w h ILE 153 CO -0.04 0.20 0.09 -0.65 0.00 0.00 0.00 178.15 177.75 1i1w h PRO 154 N -0.73 0.20 -0.33 2.37 0.11 -1.71 -1.58 132.00 130.33 1i1w h PRO 154 Ca -0.02 -0.01 0.01 0.00 0.11 0.00 0.00 66.00 66.09 1i1w h PRO 154 Cb 0.51 -0.05 -0.02 0.00 0.11 0.00 0.00 31.00 31.55 1i1w h PRO 154 CO 0.04 0.13 0.19 0.82 -0.21 0.00 0.00 178.00 178.98 1i1w h ILE 155 N 0.21 1.04 -0.14 4.15 2.04 -0.95 -0.26 117.51 123.60 1i1w h ILE 155 Ca 0.31 -0.14 0.02 0.00 1.00 0.00 0.00 64.86 66.06 1i1w h ILE 155 Cb 0.48 0.61 -0.02 0.00 -0.74 0.00 0.00 36.82 37.15 1i1w h ILE 155 CO -0.44 0.07 0.01 0.00 0.00 0.00 0.00 178.15 177.79 1i1w h ALA 156 N 1.15 0.12 -0.55 1.87 0.00 -0.55 -0.06 119.26 121.24 1i1w h ALA 156 Ca 0.13 0.03 -0.08 0.00 0.00 0.00 0.00 54.91 54.99 1i1w h ALA 156 Cb -0.00 0.05 -0.02 0.00 0.00 0.00 0.00 17.79 17.82 1i1w h ALA 156 CO -0.06 -0.44 0.02 0.74 0.00 0.00 0.00 179.25 179.51 1i1w h PHE 157 N 0.06 1.03 -0.67 0.00 0.04 -1.13 -0.99 116.94 115.28 1i1w h PHE 157 Ca 0.06 -0.17 -0.07 0.00 2.80 0.00 0.00 57.97 60.60 1i1w h PHE 157 Cb 0.07 -0.27 -0.03 0.00 2.20 0.00 0.00 35.95 37.92 1i1w h PHE 157 CO -0.14 0.93 0.16 1.96 -0.60 0.00 0.00 178.31 180.62 1i1w h GLN 158 N 0.84 1.06 -0.54 1.51 4.20 -0.87 -0.38 115.11 120.92 1i1w h GLN 158 Ca 0.16 -0.25 -0.05 0.00 0.06 0.00 0.00 58.65 58.58 1i1w h GLN 158 Cb 0.50 -0.14 -0.02 0.00 0.30 0.00 0.00 27.48 28.12 1i1w h GLN 158 CO 0.02 0.94 0.15 1.15 -0.67 0.00 0.00 178.83 180.42 1i1w h THR 159 N 1.01 1.24 -0.41 -0.54 2.02 -0.89 -2.27 112.91 113.06 1i1w h THR 159 Ca 0.21 -0.83 -0.02 0.00 0.77 0.00 0.00 66.41 66.55 1i1w h THR 159 Cb 0.36 0.75 -0.02 0.00 -1.74 0.00 0.00 68.15 67.50 1i1w h THR 159 CO 0.00 0.31 0.20 0.00 0.37 0.00 0.00 175.52 176.39 1i1w h ALA 160 N 1.02 0.53 -0.71 6.16 0.00 -0.90 -1.75 119.26 123.62 1i1w h ALA 160 Ca 0.17 -0.11 0.03 0.00 0.00 0.00 0.00 54.91 55.00 1i1w h ALA 160 Cb 0.31 -0.16 -0.04 0.00 0.00 0.00 0.00 17.79 17.89 1i1w h ALA 160 CO -0.00 0.10 0.45 -0.09 0.00 0.00 0.00 179.25 179.70 1i1w h ARG 161 N 0.52 0.86 -0.44 0.00 9.65 -0.90 -1.88 114.38 122.20 1i1w h ARG 161 Ca 0.14 -0.05 -0.08 0.00 -1.10 0.00 0.00 59.98 58.89 1i1w h ARG 161 Cb 0.12 -0.19 -0.02 0.00 -1.39 0.00 0.00 29.97 28.49 1i1w h ARG 161 CO -0.02 0.57 -0.05 0.00 2.80 0.00 0.00 179.97 183.27 1i1w h ALA 162 N 1.30 1.09 -0.36 2.80 0.00 -1.20 -2.45 119.26 120.44 1i1w h ALA 162 Ca 0.28 -0.28 -0.16 0.00 0.00 0.00 0.00 54.91 54.75 1i1w h ALA 162 Cb -0.00 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 1i1w h ALA 162 CO -0.10 0.57 -0.39 0.00 0.00 0.00 0.00 179.25 179.33 1i1w h ALA 163 N 1.25 0.62 -1.86 0.00 0.00 -0.61 -3.40 119.26 115.27 1i1w h ALA 163 Ca 0.13 -0.45 -0.33 0.00 0.00 0.00 0.00 54.91 54.26 1i1w h ALA 163 Cb 0.50 -0.12 -0.30 0.00 0.00 0.00 0.00 17.79 17.87 1i1w h ALA 163 CO 0.03 0.67 -0.65 0.34 0.00 0.00 0.00 179.25 179.64 1i1w s ASP 164 N -6.85 0.89 0.17 0.00 -1.08 -0.77 -4.53 116.67 104.49 1i1w s ASP 164 Ca -0.10 -1.41 0.16 0.00 -0.52 0.00 0.00 52.55 50.68 1i1w s ASP 164 Cb 0.11 0.72 0.74 0.00 -1.46 0.00 0.00 42.92 43.03 1i1w s ASP 164 CO 0.87 -0.26 1.48 -2.65 0.52 0.00 0.00 175.17 175.13 1i1w n PRO 165 N 4.36 0.09 0.15 4.34 -0.02 -0.93 -2.20 135.00 140.80 1i1w n PRO 165 Ca 0.10 0.47 0.04 0.00 -2.02 0.00 0.00 63.50 62.09 1i1w n PRO 165 Cb 0.47 -1.74 0.05 0.00 -0.02 0.00 0.00 33.50 32.25 1i1w n PRO 165 CO 0.00 0.00 0.00 -0.97 1.98 0.00 0.00 175.50 176.51 1i1w h ASN 166 N 0.00 0.00 -3.85 2.55 -1.24 -1.95 -3.46 115.58 107.63 1i1w h ASN 166 Ca 0.00 0.00 -0.48 0.00 0.71 0.00 0.00 56.30 56.53 1i1w h ASN 166 Cb 0.14 0.00 -0.01 0.00 0.73 0.00 0.00 38.32 39.19 1i1w h ASN 166 CO 0.00 0.43 0.38 0.00 -1.29 0.00 0.00 177.43 176.95 1i1w s ALA 167 N -3.00 3.25 -0.11 1.57 0.00 -0.93 -4.95 121.76 117.59 1i1w s ALA 167 Ca 0.04 0.63 -0.30 0.00 0.00 0.00 0.00 51.96 52.34 1i1w s ALA 167 Cb 0.07 -3.22 -0.02 0.00 0.00 0.00 0.00 23.12 19.95 1i1w s ALA 167 CO 0.73 0.07 1.08 0.15 0.00 0.00 0.00 175.76 177.80 1i1w s LYS 168 N -1.83 4.37 -0.28 0.00 -0.14 -0.32 -4.90 119.74 116.64 1i1w s LYS 168 Ca 0.48 1.49 -0.13 0.00 -1.36 0.00 0.00 55.97 56.45 1i1w s LYS 168 Cb -0.23 -3.57 -0.04 0.00 -1.68 0.00 0.00 37.83 32.31 1i1w s LYS 168 CO 0.29 -0.41 0.30 -0.51 -0.76 0.00 0.00 175.35 174.26 1i1w s LEU 169 N 2.28 4.07 0.04 3.17 1.43 -1.26 -0.88 118.68 127.52 1i1w s LEU 169 Ca 0.50 0.13 0.04 0.00 -1.03 0.00 0.00 54.13 53.77 1i1w s LEU 169 Cb -0.20 -2.30 -0.04 0.00 0.03 0.00 0.00 46.19 43.69 1i1w s LEU 169 CO 0.18 -0.14 -0.06 -0.31 0.23 0.00 0.00 176.35 176.24 1i1w s TYR 170 N 1.94 2.88 -0.17 0.29 1.51 0.21 -0.41 117.35 123.60 1i1w s TYR 170 Ca 0.12 -0.06 -0.09 0.00 -1.01 0.00 0.00 57.07 56.03 1i1w s TYR 170 Cb -0.16 -1.56 -0.05 0.00 -0.11 0.00 0.00 41.96 40.08 1i1w s TYR 170 CO 0.10 0.40 0.14 -1.50 -1.11 0.00 0.00 175.55 173.59 1i1w s ILE 171 N -1.10 5.44 0.01 2.71 2.07 -0.68 -0.83 121.20 128.82 1i1w s ILE 171 Ca 0.20 0.20 0.08 0.00 -1.41 0.00 0.00 60.65 59.72 1i1w s ILE 171 Cb -0.11 -3.45 -0.02 0.00 0.13 0.00 0.00 42.46 39.00 1i1w s ILE 171 CO 0.11 0.50 -0.24 0.21 -1.91 0.00 0.00 174.94 173.61 1i1w s ASN 172 N -0.09 2.80 0.22 4.50 2.47 -0.47 -0.50 114.94 123.88 1i1w s ASN 172 Ca 0.10 -0.49 -0.21 0.00 0.42 0.00 0.00 52.86 52.68 1i1w s ASN 172 Cb -0.11 -0.28 0.04 0.00 -1.45 0.00 0.00 41.25 39.45 1i1w s ASN 172 CO 0.00 0.25 0.65 -0.62 -3.72 0.00 0.00 177.10 173.66 1i1w s ASP 173 N -0.89 -0.38 0.41 -4.21 -1.08 -0.35 -0.90 116.67 109.28 1i1w s ASP 173 Ca 0.09 -0.36 0.07 0.00 -0.52 0.00 0.00 52.55 51.84 1i1w s ASP 173 Cb -0.09 0.66 -0.05 0.00 -1.46 0.00 0.00 42.92 41.98 1i1w s ASP 173 CO 0.01 -1.17 0.21 -0.72 0.52 0.00 0.00 175.17 174.02 1i1w s TYR 174 N -3.85 2.63 -1.30 -5.34 1.13 -1.26 -0.45 117.35 108.90 1i1w s TYR 174 Ca 0.07 -0.56 -0.08 0.00 -1.41 0.00 0.00 57.07 55.09 1i1w s TYR 174 Cb -0.03 -1.98 0.01 0.00 -1.10 0.00 0.00 41.96 38.86 1i1w s TYR 174 CO -0.02 0.14 1.14 0.09 -2.51 0.00 0.00 175.55 174.39 1i1w n ASN 175 N -1.28 -6.12 -1.62 -0.18 3.02 -1.26 -4.91 115.26 102.90 1i1w n ASN 175 Ca -0.00 -0.52 -0.15 0.00 -0.03 0.00 0.00 54.58 53.87 1i1w n ASN 175 Cb 0.64 -4.86 0.14 0.00 -0.61 0.00 0.00 39.78 35.09 1i1w n ASN 175 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 1i1w n LEU 176 N -4.82 5.09 -0.61 3.41 4.77 -1.26 -4.32 117.00 119.26 1i1w n LEU 176 Ca 0.00 -4.07 0.10 0.00 -0.03 0.00 0.00 56.01 52.02 1i1w n LEU 176 Cb 0.56 -0.65 0.03 0.00 -2.33 0.00 0.00 43.42 41.03 1i1w n LEU 176 CO 0.62 1.47 0.40 0.47 -1.33 0.00 0.00 177.39 179.02 1i1w n ASP 177 N -1.01 2.25 -4.21 -1.43 8.00 -1.26 -4.74 116.55 114.15 1i1w n ASP 177 Ca 0.43 -1.62 -0.28 0.00 0.71 0.00 0.00 54.79 54.03 1i1w n ASP 177 Cb 1.01 0.31 -0.16 0.00 -0.02 0.00 0.00 41.12 42.27 1i1w n ASP 177 CO 0.00 0.00 0.00 -0.44 -0.39 0.00 0.00 177.20 176.37 1i1w s SER 178 N -2.16 2.48 0.51 -2.24 0.01 -1.26 -3.09 113.70 107.95 1i1w s SER 178 Ca 0.20 -0.40 0.32 0.00 1.31 0.00 0.00 55.95 57.38 1i1w s SER 178 Cb 0.17 -0.47 1.27 0.00 0.21 0.00 0.00 66.02 67.20 1i1w s SER 178 CO 0.44 0.22 1.93 0.00 0.41 0.00 0.00 173.24 176.25 1i1w h ALA 179 N 5.89 1.00 -0.01 1.44 0.00 -1.83 -3.01 119.26 122.74 1i1w h ALA 179 Ca -0.36 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.55 1i1w h ALA 179 Cb 1.16 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.94 1i1w h ALA 179 CO 0.48 0.00 -0.29 0.45 0.00 0.00 0.00 179.25 179.88 1i1w n SER 180 N -2.97 2.00 -4.74 0.00 2.88 -1.26 -4.66 113.62 104.86 1i1w n SER 180 Ca 0.01 -3.58 -0.38 0.00 -1.33 0.00 0.00 58.87 53.59 1i1w n SER 180 Cb 0.31 -0.49 0.05 0.00 -0.75 0.00 0.00 64.21 63.32 1i1w n SER 180 CO 0.00 0.00 0.00 -0.31 -1.23 0.00 0.00 175.04 173.50 1i1w s TYR 181 N -3.10 2.21 0.19 0.66 1.51 -1.14 -4.92 117.35 112.77 1i1w s TYR 181 Ca 0.36 1.40 -0.12 0.00 -1.01 0.00 0.00 57.07 57.70 1i1w s TYR 181 Cb 0.34 -3.78 0.18 0.00 -0.11 0.00 0.00 41.96 38.59 1i1w s TYR 181 CO -0.03 -2.93 1.77 -1.35 -1.11 0.00 0.00 175.55 171.90 1i1w h PRO 182 N 1.18 0.46 -0.98 -1.71 0.11 -1.92 -2.97 132.00 126.16 1i1w h PRO 182 Ca -0.51 -0.03 0.09 0.00 0.11 0.00 0.00 66.00 65.66 1i1w h PRO 182 Cb 1.31 -0.10 -0.07 0.00 0.11 0.00 0.00 31.00 32.25 1i1w h PRO 182 CO 0.56 0.30 0.62 -0.22 -0.21 0.00 0.00 178.00 179.05 1i1w h LYS 183 N 0.47 1.04 -0.13 1.05 3.64 -1.84 -2.71 116.57 118.09 1i1w h LYS 183 Ca 0.25 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.57 1i1w h LYS 183 Cb 0.22 -0.23 -0.01 0.00 -0.41 0.00 0.00 32.23 31.79 1i1w h LYS 183 CO -0.21 0.69 0.09 1.15 -2.27 0.00 0.00 179.45 178.90 1i1w h THR 184 N 1.07 1.05 -0.71 1.00 2.02 -1.71 -0.71 112.91 114.92 1i1w h THR 184 Ca 0.45 -0.11 -0.03 0.00 0.77 0.00 0.00 66.41 67.49 1i1w h THR 184 Cb 0.29 0.88 -0.03 0.00 -1.74 0.00 0.00 68.15 67.55 1i1w h THR 184 CO -0.21 0.05 0.32 1.56 0.37 0.00 0.00 175.52 177.61 1i1w h GLN 185 N 0.17 1.01 -0.36 6.66 4.20 -1.46 -2.56 115.11 122.77 1i1w h GLN 185 Ca 0.05 -0.15 -0.06 0.00 0.06 0.00 0.00 58.65 58.55 1i1w h GLN 185 Cb 0.00 -0.18 -0.01 0.00 0.30 0.00 0.00 27.48 27.58 1i1w h GLN 185 CO -0.01 0.79 -0.02 0.00 -0.67 0.00 0.00 178.83 178.93 1i1w h ALA 186 N 1.35 0.48 -0.46 3.87 0.00 -1.22 -1.25 119.26 122.03 1i1w h ALA 186 Ca 0.24 -0.26 -0.06 0.00 0.00 0.00 0.00 54.91 54.84 1i1w h ALA 186 Cb 0.12 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.76 1i1w h ALA 186 CO -0.03 0.26 0.06 0.97 0.00 0.00 0.00 179.25 180.51 1i1w h ILE 187 N 0.45 1.22 -0.25 0.00 2.10 -1.02 0.17 117.51 120.18 1i1w h ILE 187 Ca 0.10 -0.85 -0.02 0.00 1.08 0.00 0.00 64.86 65.17 1i1w h ILE 187 Cb 0.49 0.81 -0.01 0.00 -1.09 0.00 0.00 36.82 37.01 1i1w h ILE 187 CO 0.02 0.31 0.09 0.58 -1.08 0.00 0.00 178.15 178.07 1i1w h VAL 188 N 0.69 1.18 -0.28 2.19 2.07 -1.31 0.38 116.25 121.18 1i1w h VAL 188 Ca 0.15 -0.56 -0.01 0.00 0.82 0.00 0.00 66.70 67.10 1i1w h VAL 188 Cb 0.35 1.09 -0.01 0.00 -1.52 0.00 0.00 31.29 31.19 1i1w h VAL 188 CO 0.01 0.19 0.14 -1.13 0.02 0.00 0.00 177.57 176.80 1i1w h ASN 189 N 0.24 0.36 -0.06 0.57 -1.24 -0.84 -1.07 115.58 113.55 1i1w h ASN 189 Ca 0.08 -0.11 -0.15 0.00 0.71 0.00 0.00 56.30 56.84 1i1w h ASN 189 Cb 0.20 -0.09 -0.01 0.00 0.73 0.00 0.00 38.32 39.15 1i1w h ASN 189 CO -0.00 0.36 -0.46 0.03 -1.29 0.00 0.00 177.43 176.07 1i1w h ARG 190 N 0.33 0.61 -0.50 6.67 2.47 -0.60 -1.44 114.38 121.91 1i1w h ARG 190 Ca 0.10 -0.34 -0.03 0.00 -1.26 0.00 0.00 59.98 58.45 1i1w h ARG 190 Cb 0.09 0.02 -0.02 0.00 -1.65 0.00 0.00 29.97 28.41 1i1w h ARG 190 CO -0.01 0.94 0.20 0.28 0.56 0.00 0.00 179.97 181.94 1i1w h VAL 191 N 0.49 1.21 -0.52 2.04 2.07 -0.82 0.15 116.25 120.86 1i1w h VAL 191 Ca 0.03 -0.65 0.06 0.00 0.82 0.00 0.00 66.70 66.96 1i1w h VAL 191 Cb 0.99 0.70 -0.05 0.00 -1.52 0.00 0.00 31.29 31.40 1i1w h VAL 191 CO 0.09 0.25 0.22 0.11 0.02 0.00 0.00 177.57 178.26 1i1w h LYS 192 N 0.67 0.41 -0.37 1.57 1.57 -0.95 -0.10 116.57 119.38 1i1w h LYS 192 Ca 0.17 -0.02 -0.10 0.00 -1.87 0.00 0.00 60.65 58.82 1i1w h LYS 192 Cb 0.19 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 32.40 1i1w h LYS 192 CO -0.01 0.27 -0.18 0.87 -0.57 0.00 0.00 179.45 179.83 1i1w h LYS 193 N 0.43 0.76 -0.23 3.15 1.79 -0.89 -0.83 116.57 120.75 1i1w h LYS 193 Ca 0.25 -0.33 -0.00 0.00 -2.18 0.00 0.00 60.65 58.38 1i1w h LYS 193 Cb 0.23 -0.02 -0.01 0.00 -1.58 0.00 0.00 32.23 30.85 1i1w h LYS 193 CO -0.22 0.95 0.13 -1.49 -1.08 0.00 0.00 179.45 177.75 1i1w h TRP 194 N 0.55 0.30 -0.58 -1.35 6.55 -0.52 -1.67 115.95 119.24 1i1w h TRP 194 Ca 0.08 -0.00 -0.06 0.00 0.95 0.00 0.00 58.89 59.86 1i1w h TRP 194 Cb 0.72 -0.10 -0.03 0.00 -0.86 0.00 0.00 29.16 28.90 1i1w h TRP 194 CO 0.06 0.24 0.12 0.00 -1.05 0.00 0.00 178.44 177.81 1i1w h ARG 195 N 0.28 0.90 0.00 0.49 3.08 -0.94 -0.39 114.38 117.80 1i1w h ARG 195 Ca 0.08 -0.20 -0.03 0.00 0.07 0.00 0.00 59.98 59.90 1i1w h ARG 195 Cb 0.03 -0.13 -0.00 0.00 0.08 0.00 0.00 29.97 29.95 1i1w h ARG 195 CO -0.01 0.82 -0.12 0.00 -1.07 0.00 0.00 179.97 179.58 1i1w h ALA 196 N 1.27 1.36 -0.00 0.04 0.00 -0.84 -0.80 119.26 120.28 1i1w h ALA 196 Ca 0.18 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.98 1i1w h ALA 196 Cb 0.34 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.11 1i1w h ALA 196 CO 0.00 0.16 -0.07 0.00 0.00 0.00 0.00 179.25 179.34 1i1w n ALA 197 N -2.32 2.71 -0.21 0.00 0.00 -0.65 -4.92 120.51 115.11 1i1w n ALA 197 Ca -0.02 -0.28 0.00 0.00 0.00 0.00 0.00 53.44 53.14 1i1w n ALA 197 Cb 0.23 -1.35 0.00 0.00 0.00 0.00 0.00 19.45 18.33 1i1w n ALA 197 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1i1w n GLY 198 N 1.21 0.90 3.73 0.00 0.00 -0.31 -5.07 105.19 105.64 1i1w n GLY 198 Ca 0.17 -0.01 -0.42 0.00 0.00 0.00 0.00 46.02 45.76 1i1w n GLY 198 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1i1w s VAL 199 N -2.00 3.69 -1.20 1.61 1.01 -0.23 -4.93 120.40 118.34 1i1w s VAL 199 Ca 0.00 1.31 -0.17 0.00 0.00 0.00 0.00 61.98 63.12 1i1w s VAL 199 Cb 0.00 -3.84 0.11 0.00 0.00 0.00 0.00 36.38 32.66 1i1w s VAL 199 CO 0.00 0.15 1.54 -2.16 0.00 0.00 0.00 175.10 174.63 1i1w s PRO 200 N 0.44 3.96 -0.38 2.72 0.04 -1.26 -4.21 135.00 136.30 1i1w s PRO 200 Ca 0.57 -2.12 -0.10 0.00 0.04 0.00 0.00 61.00 59.39 1i1w s PRO 200 Cb -0.32 -5.28 0.04 0.00 0.04 0.00 0.00 34.50 28.97 1i1w s PRO 200 CO 0.33 -2.02 0.20 0.42 0.04 0.00 0.00 177.00 175.97 1i1w s ILE 201 N 3.13 4.42 -0.22 0.56 1.01 -1.26 -4.77 121.20 124.06 1i1w s ILE 201 Ca 0.47 -0.97 0.21 0.00 0.00 0.00 0.00 60.65 60.36 1i1w s ILE 201 Cb 0.00 -3.51 -0.02 0.00 0.01 0.00 0.00 42.46 38.95 1i1w s ILE 201 CO 0.02 -0.27 1.02 0.44 0.00 0.00 0.00 174.94 176.14 1i1w h ASP 202 N 8.40 0.00 -4.73 3.58 3.32 -1.09 -3.44 116.42 122.47 1i1w h ASP 202 Ca -0.25 0.00 -0.13 0.00 0.02 0.00 0.00 57.03 56.67 1i1w h ASP 202 Cb 1.10 0.00 -0.21 0.00 0.22 0.00 0.00 39.33 40.43 1i1w h ASP 202 CO 0.67 0.12 -0.34 -0.83 -1.72 0.00 0.00 179.24 177.14 1i1w s GLY 203 N -4.45 -0.12 -0.20 2.75 0.00 -0.53 -1.55 107.32 103.21 1i1w s GLY 203 Ca -0.01 0.34 -0.05 0.00 0.00 0.00 0.00 44.72 45.00 1i1w s GLY 203 CO 0.79 0.17 0.00 -0.42 0.00 0.00 0.00 173.10 173.64 1i1w s ILE 204 N -1.01 3.95 -0.19 0.90 1.01 -1.06 -1.68 121.20 123.12 1i1w s ILE 204 Ca -0.11 -0.31 -0.09 0.00 0.00 0.00 0.00 60.65 60.13 1i1w s ILE 204 Cb -0.05 -2.79 -0.05 0.00 0.01 0.00 0.00 42.46 39.58 1i1w s ILE 204 CO 0.03 0.42 0.13 -0.83 0.00 0.00 0.00 174.94 174.69 1i1w s GLY 205 N 1.06 2.04 -0.30 6.18 0.00 0.34 -1.91 107.32 114.74 1i1w s GLY 205 Ca 0.02 -0.69 -0.04 0.00 0.00 0.00 0.00 44.72 44.02 1i1w s GLY 205 CO 0.02 0.07 0.03 -0.45 0.00 0.00 0.00 173.10 172.76 1i1w s SER 206 N 0.20 4.93 0.19 1.64 0.15 -0.19 -1.20 113.70 119.41 1i1w s SER 206 Ca 0.08 -1.10 -0.12 0.00 0.70 0.00 0.00 55.95 55.52 1i1w s SER 206 Cb -0.11 -1.76 0.15 0.00 -1.71 0.00 0.00 66.02 62.58 1i1w s SER 206 CO -0.01 -0.24 1.83 1.56 1.20 0.00 0.00 173.24 177.57 1i1w h GLN 207 N 8.09 0.72 -4.34 5.44 4.20 -1.06 -1.00 115.11 127.15 1i1w h GLN 207 Ca -0.25 -0.04 -0.21 0.00 0.06 0.00 0.00 58.65 58.21 1i1w h GLN 207 Cb 1.08 -0.16 0.11 0.00 0.30 0.00 0.00 27.48 28.81 1i1w h GLN 207 CO 0.57 0.48 -0.49 2.41 -0.67 0.00 0.00 178.83 181.12 1i1w n THR 208 N -4.73 -3.98 -2.88 -0.54 -1.04 -1.26 -1.05 114.28 98.80 1i1w n THR 208 Ca 0.06 -0.35 -0.43 0.00 -2.04 0.00 0.00 64.05 61.28 1i1w n THR 208 Cb 0.08 -4.17 -0.04 0.00 -1.82 0.00 0.00 70.33 64.38 1i1w n THR 208 CO 0.00 0.00 0.00 -1.00 -0.64 0.00 0.00 175.07 173.43 1i1w s HIS 209 N -3.23 2.74 0.16 -1.42 3.76 -1.26 -2.60 115.29 113.43 1i1w s HIS 209 Ca 0.02 -0.68 0.04 0.00 -0.15 0.00 0.00 55.06 54.29 1i1w s HIS 209 Cb -0.00 -4.28 -0.04 0.00 1.11 0.00 0.00 32.58 29.37 1i1w s HIS 209 CO 0.47 -1.61 0.19 -0.51 -0.85 0.00 0.00 174.74 172.42 1i1w s LEU 210 N 3.83 4.01 0.45 0.89 1.43 -0.26 -4.90 118.68 124.13 1i1w s LEU 210 Ca 0.23 -0.01 0.03 0.00 -1.03 0.00 0.00 54.13 53.35 1i1w s LEU 210 Cb -0.16 -2.61 0.01 0.00 0.03 0.00 0.00 46.19 43.47 1i1w s LEU 210 CO 0.07 0.06 0.65 -0.44 0.23 0.00 0.00 176.35 176.92 1i1w s SER 211 N -3.14 5.68 0.19 2.29 0.01 -1.26 -1.30 113.70 116.17 1i1w s SER 211 Ca 0.32 0.00 -0.31 0.00 1.31 0.00 0.00 55.95 57.28 1i1w s SER 211 Cb -0.10 -1.16 -0.10 0.00 0.21 0.00 0.00 66.02 64.86 1i1w s SER 211 CO 0.25 -0.78 1.54 0.00 0.41 0.00 0.00 173.24 174.67 1i1w s ALA 212 N -2.51 3.75 0.00 1.44 0.00 -1.23 -1.86 121.76 121.35 1i1w s ALA 212 Ca 0.51 1.38 0.00 0.00 0.00 0.00 0.00 51.96 53.85 1i1w s ALA 212 Cb -0.10 -3.61 0.00 0.00 0.00 0.00 0.00 23.12 19.41 1i1w s ALA 212 CO 0.36 -0.79 0.00 0.41 0.00 0.00 0.00 175.76 175.74 1i1w n GLY 213 N 3.33 1.19 0.10 0.00 0.00 -1.26 -4.94 105.19 103.60 1i1w n GLY 213 Ca 0.12 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.26 1i1w n GLY 213 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 1i1w h GLN 214 N 3.41 0.00 -0.55 1.61 4.15 -1.77 -3.36 115.11 118.60 1i1w h GLN 214 Ca 0.00 0.00 0.10 0.00 0.77 0.00 0.00 58.65 59.52 1i1w h GLN 214 Cb 0.00 0.00 -0.03 0.00 0.21 0.00 0.00 27.48 27.66 1i1w h GLN 214 CO 0.00 0.00 0.37 0.78 -1.93 0.00 0.00 178.83 178.05 1i1w h GLY 215 N 4.42 0.44 0.93 2.39 0.00 -1.81 -2.00 103.07 107.44 1i1w h GLY 215 Ca 0.00 -0.13 0.13 0.00 0.00 0.00 0.00 47.33 47.33 1i1w h GLY 215 CO 0.00 0.08 0.41 0.00 0.00 0.00 0.00 176.54 177.03 1i1w h ALA 216 N 1.72 2.21 0.00 3.60 0.00 -1.87 -1.19 119.26 123.74 1i1w h ALA 216 Ca 0.26 -0.01 -0.05 0.00 0.00 0.00 0.00 54.91 55.11 1i1w h ALA 216 Cb 0.60 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.35 1i1w h ALA 216 CO -0.06 -0.37 -0.22 0.66 0.00 0.00 0.00 179.25 179.26 1i1w h SER 217 N 0.26 0.00 0.37 0.00 4.64 -1.60 -2.66 113.55 114.55 1i1w h SER 217 Ca 0.29 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.56 1i1w h SER 217 Cb 0.78 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.86 1i1w h SER 217 CO -0.06 0.22 -0.20 0.58 -0.87 0.00 0.00 176.83 176.49 1i1w h VAL 218 N 0.00 0.85 -0.16 0.95 2.07 -1.14 -1.09 116.25 117.73 1i1w h VAL 218 Ca -0.00 -0.78 0.04 0.00 0.82 0.00 0.00 66.70 66.78 1i1w h VAL 218 Cb 0.54 1.46 -0.01 0.00 -1.52 0.00 0.00 31.29 31.76 1i1w h VAL 218 CO 0.03 0.20 0.11 -0.07 0.02 0.00 0.00 177.57 177.86 1i1w h LEU 219 N 0.00 0.03 0.03 2.57 3.38 -1.59 -1.08 115.31 118.65 1i1w h LEU 219 Ca -0.00 -0.00 -0.36 0.00 0.09 0.00 0.00 57.88 57.61 1i1w h LEU 219 Cb 0.44 -0.01 -0.05 0.00 0.09 0.00 0.00 40.66 41.13 1i1w h LEU 219 CO 0.03 0.02 -2.17 0.00 0.09 0.00 0.00 178.44 176.40 1i1w n GLN 220 N -4.50 0.68 -0.07 1.13 3.00 -0.81 -4.47 117.38 112.34 1i1w n GLN 220 Ca 0.01 0.17 -0.12 0.00 -0.01 0.00 0.00 57.00 57.05 1i1w n GLN 220 Cb 0.22 -1.63 0.01 0.00 0.00 0.00 0.00 30.24 28.85 1i1w n GLN 220 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1i1w h ALA 221 N 0.50 0.63 -0.38 -1.58 0.00 -0.93 -3.03 119.26 114.47 1i1w h ALA 221 Ca -0.47 -0.47 -0.09 0.00 0.00 0.00 0.00 54.91 53.87 1i1w h ALA 221 Cb 2.05 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 19.72 1i1w h ALA 221 CO 0.02 0.67 -0.12 1.25 0.00 0.00 0.00 179.25 181.07 1i1w h LEU 222 N 0.64 0.76 -1.57 0.00 5.85 -1.44 -0.10 115.31 119.44 1i1w h LEU 222 Ca 0.04 -0.38 -0.01 0.00 0.84 0.00 0.00 57.88 58.37 1i1w h LEU 222 Cb 1.02 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 41.82 1i1w h LEU 222 CO 0.10 0.97 0.12 -0.65 -0.34 0.00 0.00 178.44 178.64 1i1w h PRO 223 N 0.55 0.40 -0.43 5.25 0.11 -1.78 -0.92 132.00 135.18 1i1w h PRO 223 Ca 0.09 -0.04 -0.05 0.00 0.11 0.00 0.00 66.00 66.11 1i1w h PRO 223 Cb 0.65 -0.08 -0.02 0.00 0.11 0.00 0.00 31.00 31.66 1i1w h PRO 223 CO 0.04 0.34 0.07 1.25 -0.21 0.00 0.00 178.00 179.49 1i1w h LEU 224 N 0.41 0.69 -0.98 2.35 5.85 -1.24 -2.16 115.31 120.23 1i1w h LEU 224 Ca 0.10 -0.26 0.06 0.00 0.84 0.00 0.00 57.88 58.62 1i1w h LEU 224 Cb 0.08 -0.18 -0.06 0.00 0.37 0.00 0.00 40.66 40.86 1i1w h LEU 224 CO -0.01 0.78 0.63 -0.07 -0.34 0.00 0.00 178.44 179.43 1i1w h LEU 225 N 0.58 1.03 -2.17 2.25 3.38 -0.44 -1.31 115.31 118.63 1i1w h LEU 225 Ca 0.13 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.10 1i1w h LEU 225 Cb 0.38 -0.22 -0.00 0.00 0.09 0.00 0.00 40.66 40.92 1i1w h LEU 225 CO 0.01 0.67 -0.03 0.00 0.09 0.00 0.00 178.44 179.18 1i1w h ALA 226 N 1.43 1.07 0.00 1.53 0.00 -0.86 -2.53 119.26 119.90 1i1w h ALA 226 Ca 0.41 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.30 1i1w h ALA 226 Cb 0.11 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.90 1i1w h ALA 226 CO -0.16 0.04 0.00 -1.13 0.00 0.00 0.00 179.25 178.00 1i1w n SER 227 N -3.23 0.00 0.09 0.00 3.41 -0.49 -2.46 113.62 110.94 1i1w n SER 227 Ca -0.01 0.27 0.11 0.00 -0.26 0.00 0.00 58.87 58.98 1i1w n SER 227 Cb 0.20 -0.40 0.44 0.00 -0.26 0.00 0.00 64.21 64.20 1i1w n SER 227 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1i1w n ALA 228 N -1.40 1.75 -0.59 7.33 0.00 -0.95 -4.90 120.51 121.75 1i1w n ALA 228 Ca 0.06 0.03 0.00 0.00 0.00 0.00 0.00 53.44 53.54 1i1w n ALA 228 Cb 0.18 -1.36 0.00 0.00 0.00 0.00 0.00 19.45 18.26 1i1w n ALA 228 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1i1w n GLY 229 N 0.19 0.70 3.77 0.00 0.00 -1.03 -4.38 105.19 104.44 1i1w n GLY 229 Ca 0.03 -0.03 -0.36 0.00 0.00 0.00 0.00 46.02 45.66 1i1w n GLY 229 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1i1w s THR 230 N -2.00 3.03 0.50 2.61 -4.23 -1.26 -4.92 115.64 109.37 1i1w s THR 230 Ca 0.00 0.66 0.15 0.00 -1.18 0.00 0.00 61.69 61.32 1i1w s THR 230 Cb 0.00 -3.28 0.28 0.00 1.34 0.00 0.00 72.50 70.84 1i1w s THR 230 CO 0.00 -0.12 2.12 -0.65 -0.54 0.00 0.00 174.62 175.43 1i1w h PRO 231 N 1.25 0.10 -5.28 3.99 0.10 -1.79 -3.43 132.00 126.93 1i1w h PRO 231 Ca -0.50 -0.01 -0.39 0.00 0.10 0.00 0.00 66.00 65.20 1i1w h PRO 231 Cb 1.27 -0.02 -0.19 0.00 0.10 0.00 0.00 31.00 32.16 1i1w h PRO 231 CO 0.57 0.07 -0.75 -1.21 0.10 0.00 0.00 178.00 176.77 1i1w s GLU 232 N -5.14 0.95 0.25 1.05 2.02 -0.60 -4.76 118.70 112.47 1i1w s GLU 232 Ca -0.06 -1.18 0.04 0.00 0.02 0.00 0.00 54.97 53.79 1i1w s GLU 232 Cb 0.17 -0.79 -0.05 0.00 0.10 0.00 0.00 34.13 33.56 1i1w s GLU 232 CO 0.69 0.15 -0.00 0.14 0.02 0.00 0.00 175.26 176.25 1i1w s VAL 233 N -2.11 1.15 0.01 2.63 -7.23 0.01 -2.56 120.40 112.29 1i1w s VAL 233 Ca 0.07 -2.04 -0.23 0.00 -1.81 0.00 0.00 61.98 57.96 1i1w s VAL 233 Cb -0.05 -2.44 0.05 0.00 0.56 0.00 0.00 36.38 34.50 1i1w s VAL 233 CO 0.02 -0.26 0.52 0.00 -0.31 0.00 0.00 175.10 175.07 1i1w s ALA 234 N -3.34 -1.34 -0.39 1.32 0.00 -0.80 -1.77 121.76 115.44 1i1w s ALA 234 Ca 0.30 0.74 -0.21 0.00 0.00 0.00 0.00 51.96 52.79 1i1w s ALA 234 Cb 0.06 0.21 0.01 0.00 0.00 0.00 0.00 23.12 23.40 1i1w s ALA 234 CO 0.10 -0.42 0.67 0.42 0.00 0.00 0.00 175.76 176.54 1i1w s ILE 235 N -1.86 4.83 -0.09 0.00 -1.09 -0.94 -1.02 121.20 121.02 1i1w s ILE 235 Ca -0.09 0.49 0.17 0.00 -2.23 0.00 0.00 60.65 59.00 1i1w s ILE 235 Cb -0.01 -4.15 -0.25 0.00 -1.58 0.00 0.00 42.46 36.47 1i1w s ILE 235 CO 0.03 -0.44 0.24 0.35 -1.23 0.00 0.00 174.94 173.89 1i1w n THR 236 N 5.73 0.54 -2.75 2.92 -2.24 -0.38 -0.72 114.28 117.39 1i1w n THR 236 Ca -0.00 -0.56 -0.04 0.00 -2.27 0.00 0.00 64.05 61.18 1i1w n THR 236 Cb 0.48 -0.21 0.06 0.00 -2.10 0.00 0.00 70.33 68.56 1i1w n THR 236 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1i1w n GLU 237 N -2.36 1.45 -1.92 -0.78 1.02 -0.22 -4.51 120.64 113.32 1i1w n GLU 237 Ca -0.15 -2.89 -0.42 0.00 -0.02 0.00 0.00 57.16 53.69 1i1w n GLU 237 Cb 0.74 -1.01 -0.03 0.00 -0.02 0.00 0.00 31.44 31.13 1i1w n GLU 237 CO 0.00 0.00 0.00 -1.17 1.18 0.00 0.00 177.13 177.14 1i1w s LEU 238 N -3.60 4.37 0.14 -4.62 2.96 -0.04 -4.29 118.68 113.60 1i1w s LEU 238 Ca 0.24 2.70 -0.19 0.00 -0.22 0.00 0.00 54.13 56.65 1i1w s LEU 238 Cb 0.39 -3.61 0.05 0.00 0.50 0.00 0.00 46.19 43.52 1i1w s LEU 238 CO -0.04 -0.81 0.50 1.51 -1.32 0.00 0.00 176.35 176.19 1i1w s ASP 239 N 0.78 -0.40 -0.08 3.68 1.47 -1.07 -0.71 116.67 120.34 1i1w s ASP 239 Ca 0.66 -0.16 -0.03 0.00 1.18 0.00 0.00 52.55 54.20 1i1w s ASP 239 Cb -0.44 0.53 0.05 0.00 -0.34 0.00 0.00 42.92 42.72 1i1w s ASP 239 CO 0.38 -0.91 0.14 -0.69 0.68 0.00 0.00 175.17 174.77 1i1w s VAL 240 N -3.76 -0.22 0.09 2.11 1.01 -0.71 -1.11 120.40 117.80 1i1w s VAL 240 Ca 0.02 0.33 -0.35 0.00 0.00 0.00 0.00 61.98 61.98 1i1w s VAL 240 Cb 0.00 -0.29 -0.15 0.00 0.00 0.00 0.00 36.38 35.95 1i1w s VAL 240 CO -0.12 0.12 1.56 0.00 0.00 0.00 0.00 175.10 176.65 1i1w n ALA 241 N 5.32 0.56 0.00 5.51 0.00 -0.42 -0.37 120.51 131.11 1i1w n ALA 241 Ca -0.04 0.44 0.00 0.00 0.00 0.00 0.00 53.44 53.84 1i1w n ALA 241 Cb 0.50 -2.28 0.00 0.00 0.00 0.00 0.00 19.45 17.66 1i1w n ALA 241 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1i1w n GLY 242 N 3.32 3.03 3.78 0.00 0.00 0.08 -3.50 105.19 111.90 1i1w n GLY 242 Ca 0.19 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.93 1i1w n GLY 242 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1i1w n ALA 243 N -0.44 -1.32 -1.82 4.61 0.00 0.51 -4.91 120.51 117.14 1i1w n ALA 243 Ca 0.00 0.27 -0.41 0.00 0.00 0.00 0.00 53.44 53.30 1i1w n ALA 243 Cb 0.00 -4.85 -0.02 0.00 0.00 0.00 0.00 19.45 14.58 1i1w n ALA 243 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1i1w s SER 244 N -3.34 6.55 0.43 0.00 0.15 -1.26 -4.45 113.70 111.78 1i1w s SER 244 Ca 0.62 2.80 0.14 0.00 0.70 0.00 0.00 55.95 60.20 1i1w s SER 244 Cb -0.29 -2.64 1.02 0.00 -1.71 0.00 0.00 66.02 62.40 1i1w s SER 244 CO 0.79 -0.75 1.97 0.28 1.20 0.00 0.00 173.24 176.72 1i1w h SER 245 N 4.42 0.39 -0.44 5.45 0.02 -1.91 -1.95 113.55 119.53 1i1w h SER 245 Ca -0.47 0.01 -0.03 0.00 -0.84 0.00 0.00 61.79 60.46 1i1w h SER 245 Cb 1.22 -0.07 -0.02 0.00 0.14 0.00 0.00 62.40 63.67 1i1w h SER 245 CO 0.74 0.23 0.16 0.74 -1.14 0.00 0.00 176.83 177.56 1i1w h THR 246 N 0.43 1.21 -0.13 -2.27 2.02 -1.98 0.22 112.91 112.41 1i1w h THR 246 Ca 0.29 -0.68 -0.01 0.00 0.77 0.00 0.00 66.41 66.79 1i1w h THR 246 Cb 0.58 0.82 -0.01 0.00 -1.74 0.00 0.00 68.15 67.81 1i1w h THR 246 CO -0.09 0.25 0.05 0.44 0.37 0.00 0.00 175.52 176.54 1i1w h ASP 247 N 0.58 0.19 -0.33 4.18 3.32 -1.80 -1.92 116.42 120.63 1i1w h ASP 247 Ca 0.15 -0.18 -0.02 0.00 0.02 0.00 0.00 57.03 57.00 1i1w h ASP 247 Cb 0.23 -0.05 -0.01 0.00 0.22 0.00 0.00 39.33 39.71 1i1w h ASP 247 CO -0.01 0.32 0.14 1.88 -1.72 0.00 0.00 179.24 179.84 1i1w h TYR 248 N 0.04 0.49 -0.66 4.55 0.05 -1.25 -2.00 116.97 118.19 1i1w h TYR 248 Ca 0.04 -0.03 -0.03 0.00 0.05 0.00 0.00 58.73 58.76 1i1w h TYR 248 Cb 0.19 -0.15 -0.03 0.00 1.01 0.00 0.00 36.73 37.75 1i1w h TYR 248 CO -0.01 0.45 0.28 0.28 -1.05 0.00 0.00 178.16 178.12 1i1w h VAL 249 N 0.38 1.22 -0.60 -2.88 2.07 -0.97 -1.55 116.25 113.92 1i1w h VAL 249 Ca 0.11 -0.68 -0.00 0.00 0.82 0.00 0.00 66.70 66.95 1i1w h VAL 249 Cb 0.17 0.42 -0.03 0.00 -1.52 0.00 0.00 31.29 30.32 1i1w h VAL 249 CO -0.01 0.28 0.37 0.78 0.02 0.00 0.00 177.57 179.00 1i1w h ASN 250 N 0.94 0.72 -0.48 0.57 2.35 -1.03 0.45 115.58 119.10 1i1w h ASN 250 Ca 0.23 -0.06 -0.08 0.00 -0.55 0.00 0.00 56.30 55.84 1i1w h ASN 250 Cb 0.15 -0.18 -0.02 0.00 0.05 0.00 0.00 38.32 38.32 1i1w h ASN 250 CO -0.02 0.56 0.00 0.58 -1.65 0.00 0.00 177.43 176.90 1i1w h VAL 251 N 0.81 1.26 -0.34 2.81 2.07 -1.00 -0.35 116.25 121.51 1i1w h VAL 251 Ca 0.22 -1.06 0.02 0.00 0.82 0.00 0.00 66.70 66.70 1i1w h VAL 251 Cb -0.03 1.00 -0.03 0.00 -1.52 0.00 0.00 31.29 30.71 1i1w h VAL 251 CO -0.04 0.37 0.18 0.58 0.02 0.00 0.00 177.57 178.68 1i1w h VAL 252 N 0.70 1.00 -0.50 2.57 2.07 -1.04 -1.83 116.25 119.21 1i1w h VAL 252 Ca 0.14 -0.13 -0.05 0.00 0.82 0.00 0.00 66.70 67.48 1i1w h VAL 252 Cb 0.50 0.60 -0.02 0.00 -1.52 0.00 0.00 31.29 30.85 1i1w h VAL 252 CO 0.02 0.07 0.11 0.78 0.02 0.00 0.00 177.57 178.57 1i1w h ASN 253 N 0.37 0.72 -0.36 0.57 2.35 -0.70 -0.29 115.58 118.24 1i1w h ASN 253 Ca 0.14 -0.13 0.03 0.00 -0.55 0.00 0.00 56.30 55.79 1i1w h ASN 253 Cb 0.04 -0.19 -0.03 0.00 0.05 0.00 0.00 38.32 38.19 1i1w h ASN 253 CO -0.09 0.72 0.17 0.00 -1.65 0.00 0.00 177.43 176.58 1i1w h ALA 254 N 1.38 0.44 -0.52 -0.83 0.00 -0.65 0.64 119.26 119.71 1i1w h ALA 254 Ca 0.16 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.08 1i1w h ALA 254 Cb 0.30 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.02 1i1w h ALA 254 CO 0.00 -0.20 0.28 0.00 0.00 0.00 0.00 179.25 179.33 1i1w h LEU 256 N 0.70 0.88 -1.20 0.00 3.38 -0.66 -2.36 115.31 116.06 1i1w h LEU 256 Ca 0.18 0.01 -0.03 0.00 0.09 0.00 0.00 57.88 58.14 1i1w h LEU 256 Cb 0.06 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 40.63 1i1w h LEU 256 CO -0.03 0.54 -0.15 0.78 0.09 0.00 0.00 178.44 179.67 1i1w h ASN 257 N 0.99 0.00 -3.51 -0.43 2.35 -0.35 -3.41 115.58 111.22 1i1w h ASN 257 Ca 0.41 0.00 -0.71 0.00 -0.55 0.00 0.00 56.30 55.44 1i1w h ASN 257 Cb 0.29 0.00 -0.26 0.00 0.05 0.00 0.00 38.32 38.39 1i1w h ASN 257 CO -0.17 0.15 -0.48 -0.69 -1.65 0.00 0.00 177.43 174.59 1i1w s VAL 258 N -3.66 4.41 0.40 2.81 1.01 -0.89 -4.97 120.40 119.51 1i1w s VAL 258 Ca 0.01 -1.15 0.06 0.00 0.00 0.00 0.00 61.98 60.91 1i1w s VAL 258 Cb 0.10 -3.59 0.25 0.00 0.00 0.00 0.00 36.38 33.14 1i1w s VAL 258 CO 0.61 -0.39 2.03 -1.28 0.00 0.00 0.00 175.10 176.07 1i1w h SER 259 N 8.43 0.48 0.41 3.32 0.87 -1.81 -0.59 113.55 124.67 1i1w h SER 259 Ca -0.24 -0.03 0.00 0.00 -1.23 0.00 0.00 61.79 60.29 1i1w h SER 259 Cb 1.09 -0.12 0.00 0.00 -0.44 0.00 0.00 62.40 62.93 1i1w h SER 259 CO 0.72 0.38 0.00 -1.54 -0.53 0.00 0.00 176.83 175.87 1i1w n SER 260 N -4.44 0.00 -4.61 6.23 3.41 -1.26 -4.63 113.62 108.32 1i1w n SER 260 Ca 0.03 -0.16 -0.43 0.00 -0.26 0.00 0.00 58.87 58.05 1i1w n SER 260 Cb 0.09 -0.25 -0.02 0.00 -0.26 0.00 0.00 64.21 63.77 1i1w n SER 260 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1i1w h VAL 262 N 6.30 0.19 0.00 0.00 -1.51 -1.61 -3.46 116.25 116.16 1i1w h VAL 262 Ca -0.27 -1.28 0.00 0.00 -1.23 0.00 0.00 66.70 63.93 1i1w h VAL 262 Cb 1.10 2.00 0.00 0.00 -2.13 0.00 0.00 31.29 32.27 1i1w h VAL 262 CO 1.07 0.11 0.00 0.61 -1.23 0.00 0.00 177.57 178.13 1i1w n GLY 263 N 1.15 -1.91 3.01 5.19 0.00 -1.26 -0.53 105.19 110.84 1i1w n GLY 263 Ca 0.02 -1.16 -0.21 0.00 0.00 0.00 0.00 46.02 44.68 1i1w n GLY 263 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1i1w s ILE 264 N -2.38 0.82 -0.12 -0.61 1.01 -1.07 -2.22 121.20 116.63 1i1w s ILE 264 Ca 0.00 -0.38 0.03 0.00 0.00 0.00 0.00 60.65 60.30 1i1w s ILE 264 Cb 0.00 -0.73 0.00 0.00 0.01 0.00 0.00 42.46 41.74 1i1w s ILE 264 CO 0.00 0.26 -0.21 -0.89 0.00 0.00 0.00 174.94 174.09 1i1w s THR 265 N 0.20 2.21 0.01 2.92 2.01 0.11 -0.11 115.64 122.99 1i1w s THR 265 Ca -0.03 -0.95 -0.12 0.00 0.31 0.00 0.00 61.69 60.90 1i1w s THR 265 Cb -0.09 -1.87 -0.05 0.00 0.01 0.00 0.00 72.50 70.49 1i1w s THR 265 CO 0.01 0.55 0.37 0.68 -0.69 0.00 0.00 174.62 175.54 1i1w s VAL 266 N 0.54 5.11 -1.36 3.82 -7.23 -0.15 -0.86 120.40 120.28 1i1w s VAL 266 Ca -0.13 0.62 -0.08 0.00 -1.81 0.00 0.00 61.98 60.58 1i1w s VAL 266 Cb -0.17 -3.65 0.10 0.00 0.56 0.00 0.00 36.38 33.23 1i1w s VAL 266 CO 0.04 0.48 2.27 1.87 -0.31 0.00 0.00 175.10 179.45 1i1w n TRP 267 N 1.51 2.75 0.00 2.82 -0.00 0.11 -1.24 117.44 123.39 1i1w n TRP 267 Ca -0.13 -2.85 0.00 0.00 -0.00 0.00 0.00 57.50 54.52 1i1w n TRP 267 Cb 0.53 -2.01 0.00 0.00 -0.00 0.00 0.00 31.31 29.83 1i1w n TRP 267 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 177.69 178.10 1i1w n GLY 268 N 2.49 2.11 0.00 5.87 0.00 -1.25 -4.73 105.19 109.69 1i1w n GLY 268 Ca 0.56 -2.12 -0.00 0.00 0.00 0.00 0.00 46.02 44.46 1i1w n GLY 268 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1i1w n VAL 269 N -1.22 0.02 -4.38 1.61 0.31 -1.26 -4.70 118.33 108.70 1i1w n VAL 269 Ca 0.00 0.50 -0.35 0.00 -0.01 0.00 0.00 64.34 64.48 1i1w n VAL 269 Cb 0.00 -1.51 -0.10 0.00 -0.91 0.00 0.00 33.84 31.32 1i1w n VAL 269 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1i1w s ALA 270 N -3.00 3.27 0.27 3.52 0.00 -1.26 -2.69 121.76 121.87 1i1w s ALA 270 Ca -0.00 -0.82 -0.08 0.00 0.00 0.00 0.00 51.96 51.06 1i1w s ALA 270 Cb 0.00 -1.46 0.45 0.00 0.00 0.00 0.00 23.12 22.11 1i1w s ALA 270 CO 0.00 0.59 1.58 -0.44 0.00 0.00 0.00 175.76 177.49 1i1w h ASP 271 N 5.11 -0.79 0.51 0.00 3.32 -1.29 -0.01 116.42 123.27 1i1w h ASP 271 Ca -0.51 0.27 0.00 0.00 0.02 0.00 0.00 57.03 56.82 1i1w h ASP 271 Cb 1.19 0.55 0.00 0.00 0.22 0.00 0.00 39.33 41.29 1i1w h ASP 271 CO 0.54 -0.30 0.00 -0.65 -1.72 0.00 0.00 179.24 177.11 1i1w h PRO 272 N 0.01 0.00 -0.02 3.56 0.11 -1.88 -1.54 132.00 132.24 1i1w h PRO 272 Ca 0.46 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.57 1i1w h PRO 272 Cb 0.73 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.84 1i1w h PRO 272 CO -0.93 0.00 -0.13 -0.25 -0.21 0.00 0.00 178.00 176.48 1i1w n ASP 273 N -2.36 1.78 -4.77 -2.05 8.00 -0.02 -4.83 116.55 112.30 1i1w n ASP 273 Ca 0.01 -1.46 -0.37 0.00 0.71 0.00 0.00 54.79 53.68 1i1w n ASP 273 Cb 0.17 0.10 0.01 0.00 -0.02 0.00 0.00 41.12 41.38 1i1w n ASP 273 CO 0.00 0.00 0.00 -0.55 -0.39 0.00 0.00 177.20 176.26 1i1w s SER 274 N -2.19 5.83 0.38 -2.24 0.15 -0.58 -4.90 113.70 110.15 1i1w s SER 274 Ca 0.30 2.38 0.26 0.00 0.70 0.00 0.00 55.95 59.59 1i1w s SER 274 Cb 0.20 -2.61 1.38 0.00 -1.71 0.00 0.00 66.02 63.29 1i1w s SER 274 CO 0.40 -1.16 1.79 4.11 1.20 0.00 0.00 173.24 179.59 1i1w h TRP 275 N 1.69 0.00 -1.55 3.44 5.08 -1.89 -2.62 115.95 120.10 1i1w h TRP 275 Ca -0.50 0.00 -0.50 0.00 1.08 0.00 0.00 58.89 58.97 1i1w h TRP 275 Cb 1.26 0.00 -0.41 0.00 -3.00 0.00 0.00 29.16 27.01 1i1w h TRP 275 CO 0.51 0.00 -0.93 0.54 -1.28 0.00 0.00 178.44 177.28 1i1w n ARG 276 N -2.40 2.32 -0.28 0.12 1.74 -1.26 -4.96 116.66 111.93 1i1w n ARG 276 Ca -0.02 -4.01 0.10 0.00 -0.77 0.00 0.00 57.85 53.16 1i1w n ARG 276 Cb 0.05 -1.85 0.34 0.00 -1.02 0.00 0.00 32.46 29.98 1i1w n ARG 276 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1i1w h ALA 277 N 2.84 1.73 0.00 7.54 0.00 -1.67 -1.46 119.26 128.24 1i1w h ALA 277 Ca 0.12 0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.03 1i1w h ALA 277 Cb 0.94 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.57 1i1w h ALA 277 CO 0.68 0.05 0.00 0.66 0.00 0.00 0.00 179.25 180.64 1i1w h SER 278 N 0.78 0.00 -0.22 0.00 4.64 -1.89 -1.23 113.55 115.64 1i1w h SER 278 Ca 0.43 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.75 1i1w h SER 278 Cb 0.57 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.66 1i1w h SER 278 CO -0.20 0.00 0.00 0.35 -0.87 0.00 0.00 176.83 176.11 1i1w n THR 279 N -2.96 0.28 -3.75 2.95 -2.24 -0.55 -4.99 114.28 103.02 1i1w n THR 279 Ca -0.02 -0.46 -0.28 0.00 -2.27 0.00 0.00 64.05 61.02 1i1w n THR 279 Cb 0.10 0.57 0.01 0.00 -2.10 0.00 0.00 70.33 68.91 1i1w n THR 279 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1i1w n THR 280 N 0.66 -2.26 -0.10 4.28 -2.24 -0.46 -0.74 114.28 113.42 1i1w n THR 280 Ca 0.17 -0.22 0.11 0.00 -2.27 0.00 0.00 64.05 61.84 1i1w n THR 280 Cb 0.41 -1.97 0.26 0.00 -2.10 0.00 0.00 70.33 66.93 1i1w n THR 280 CO 0.00 0.00 0.00 -0.81 -0.57 0.00 0.00 175.07 173.69 1i1w n PRO 281 N -3.12 2.62 -3.20 -0.78 -0.04 -1.26 -3.82 135.00 125.38 1i1w n PRO 281 Ca -0.17 -2.44 -0.20 0.00 -0.04 0.00 0.00 63.50 60.65 1i1w n PRO 281 Cb 0.49 -1.51 0.02 0.00 -0.04 0.00 0.00 33.50 32.46 1i1w n PRO 281 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 1i1w n LEU 282 N 1.45 0.00 -0.03 1.53 4.77 -1.26 -1.74 117.00 121.72 1i1w n LEU 282 Ca 0.21 -2.28 0.11 0.00 -0.03 0.00 0.00 56.01 54.02 1i1w n LEU 282 Cb 0.59 -0.12 0.04 0.00 -2.33 0.00 0.00 43.42 41.60 1i1w n LEU 282 CO 0.15 -0.57 0.18 0.18 -1.33 0.00 0.00 177.39 176.00 1i1w n LEU 283 N 0.00 0.86 -4.26 2.23 4.77 -1.26 -4.86 117.00 114.49 1i1w n LEU 283 Ca 0.02 -0.32 -0.27 0.00 -0.03 0.00 0.00 56.01 55.41 1i1w n LEU 283 Cb 0.51 -0.10 -0.15 0.00 -2.33 0.00 0.00 43.42 41.36 1i1w n LEU 283 CO 0.31 0.21 -0.53 -0.36 -1.33 0.00 0.00 177.39 175.68 1i1w s PHE 284 N -2.96 1.94 0.60 -1.77 0.40 -1.09 -0.77 117.98 114.33 1i1w s PHE 284 Ca 0.10 -0.38 -0.07 0.00 -0.60 0.00 0.00 56.93 55.99 1i1w s PHE 284 Cb 0.17 -1.20 0.13 0.00 0.51 0.00 0.00 43.02 42.63 1i1w s PHE 284 CO 0.78 0.04 0.82 -0.40 0.70 0.00 0.00 175.22 177.17 1i1w n ASP 285 N 2.13 0.43 0.20 1.36 5.68 -0.38 -1.11 116.55 124.87 1i1w n ASP 285 Ca -0.16 -1.52 0.15 0.00 -0.50 0.00 0.00 54.79 52.75 1i1w n ASP 285 Cb 0.53 -0.59 0.64 0.00 -1.14 0.00 0.00 41.12 40.55 1i1w n ASP 285 CO 0.00 0.00 0.00 1.23 -1.33 0.00 0.00 177.20 177.10 1i1w h GLY 286 N -0.87 0.00 -2.19 6.12 0.00 -1.92 -0.10 103.07 104.10 1i1w h GLY 286 Ca -0.27 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.06 1i1w h GLY 286 CO 0.22 0.00 0.00 -2.01 0.00 0.00 0.00 176.54 174.75 1i1w n ASN 287 N -2.61 3.27 -1.66 0.19 5.15 -1.26 -4.93 115.26 113.41 1i1w n ASN 287 Ca 0.01 -2.22 -0.17 0.00 -0.60 0.00 0.00 54.58 51.60 1i1w n ASN 287 Cb 0.22 -0.44 -0.03 0.00 -0.53 0.00 0.00 39.78 39.00 1i1w n ASN 287 CO 0.00 0.00 0.00 0.49 1.40 0.00 0.00 177.26 179.15 1i1w n PHE 288 N 0.81 -0.49 -3.93 1.20 3.72 -0.05 -5.01 117.46 113.70 1i1w n PHE 288 Ca 0.18 0.00 -0.31 0.00 -0.05 0.00 0.00 57.45 57.27 1i1w n PHE 288 Cb 0.59 -3.17 -0.04 0.00 -0.94 0.00 0.00 39.48 35.92 1i1w n PHE 288 CO 0.00 0.00 0.00 -0.80 -0.05 0.00 0.00 176.76 175.91 1i1w s ASN 289 N -2.47 6.29 0.35 4.37 0.02 -1.26 -4.84 114.94 117.40 1i1w s ASN 289 Ca 0.00 0.25 -0.28 0.00 -1.02 0.00 0.00 52.86 51.81 1i1w s ASN 289 Cb 0.00 -1.92 -0.10 0.00 0.02 0.00 0.00 41.25 39.25 1i1w s ASN 289 CO 0.00 0.18 1.27 -2.16 0.02 0.00 0.00 177.10 176.41 1i1w s PRO 290 N -2.47 4.29 0.62 -0.60 0.04 -1.26 -1.25 135.00 134.37 1i1w s PRO 290 Ca 0.34 2.14 -0.04 0.00 0.04 0.00 0.00 61.00 63.48 1i1w s PRO 290 Cb -0.13 -2.99 0.04 0.00 0.04 0.00 0.00 34.50 31.46 1i1w s PRO 290 CO 0.27 -0.21 0.90 0.15 0.04 0.00 0.00 177.00 178.15 1i1w s LYS 291 N -1.88 2.46 0.30 4.56 1.02 0.05 -4.85 119.74 121.39 1i1w s LYS 291 Ca 0.51 -0.41 0.05 0.00 0.02 0.00 0.00 55.97 56.14 1i1w s LYS 291 Cb -0.38 -2.31 0.70 0.00 -0.52 0.00 0.00 37.83 35.32 1i1w s LYS 291 CO 0.50 -0.94 1.79 -1.35 -0.92 0.00 0.00 175.35 174.43 1i1w h PRO 292 N -0.26 0.80 -0.16 -1.68 0.11 -1.92 0.01 132.00 128.90 1i1w h PRO 292 Ca -0.44 -0.05 -0.07 0.00 0.11 0.00 0.00 66.00 65.55 1i1w h PRO 292 Cb 1.30 -0.18 -0.01 0.00 0.11 0.00 0.00 31.00 32.22 1i1w h PRO 292 CO 0.57 0.53 -0.21 0.00 -0.21 0.00 0.00 178.00 178.68 1i1w h ALA 293 N 1.62 1.35 -0.17 -0.75 0.00 -1.90 0.30 119.26 119.71 1i1w h ALA 293 Ca 0.56 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 55.20 1i1w h ALA 293 Cb 0.80 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.49 1i1w h ALA 293 CO -0.35 0.45 0.11 -0.92 0.00 0.00 0.00 179.25 178.53 1i1w h TYR 294 N 0.25 0.20 -0.30 0.00 5.03 -1.21 -1.08 116.97 119.87 1i1w h TYR 294 Ca 0.04 0.01 -0.05 0.00 2.58 0.00 0.00 58.73 61.31 1i1w h TYR 294 Cb 0.53 -0.07 -0.02 0.00 1.55 0.00 0.00 36.73 38.72 1i1w h TYR 294 CO 0.01 0.12 -0.05 -0.91 -1.32 0.00 0.00 178.16 176.02 1i1w h ASN 295 N 0.22 0.45 -0.42 -2.11 2.35 -1.05 -1.02 115.58 113.99 1i1w h ASN 295 Ca 0.06 -0.09 -0.12 0.00 -0.55 0.00 0.00 56.30 55.61 1i1w h ASN 295 Cb -0.02 -0.12 -0.02 0.00 0.05 0.00 0.00 38.32 38.22 1i1w h ASN 295 CO -0.02 0.55 -0.17 0.00 -1.65 0.00 0.00 177.43 176.14 1i1w h ALA 296 N 1.51 0.82 -0.17 -0.83 0.00 -0.69 -0.93 119.26 118.97 1i1w h ALA 296 Ca 0.09 -0.36 -0.02 0.00 0.00 0.00 0.00 54.91 54.62 1i1w h ALA 296 Cb 0.37 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 1i1w h ALA 296 CO 0.02 0.65 0.03 0.82 0.00 0.00 0.00 179.25 180.76 1i1w h ILE 297 N 0.79 1.22 -0.36 0.00 2.04 -0.73 -0.36 117.51 120.11 1i1w h ILE 297 Ca 0.12 -0.72 0.08 0.00 1.00 0.00 0.00 64.86 65.33 1i1w h ILE 297 Cb 0.71 1.37 -0.08 0.00 -0.74 0.00 0.00 36.82 38.08 1i1w h ILE 297 CO 0.05 0.22 -0.18 0.58 0.00 0.00 0.00 178.15 178.82 1i1w h VAL 298 N 0.07 0.46 -0.61 1.67 2.07 -1.04 -0.66 116.25 118.22 1i1w h VAL 298 Ca 0.05 0.00 -0.10 0.00 0.82 0.00 0.00 66.70 67.47 1i1w h VAL 298 Cb 0.31 0.46 -0.02 0.00 -1.52 0.00 0.00 31.29 30.51 1i1w h VAL 298 CO 0.00 0.00 -0.01 -0.61 0.02 0.00 0.00 177.57 176.98 1i1w h GLN 299 N -0.13 1.08 -0.91 1.57 -0.00 -1.05 -1.47 115.11 114.20 1i1w h GLN 299 Ca 0.18 -0.35 0.04 0.00 -0.00 0.00 0.00 58.65 58.52 1i1w h GLN 299 Cb 0.40 -0.10 -0.05 0.00 0.00 0.00 0.00 27.48 27.73 1i1w h GLN 299 CO -0.44 1.05 0.60 -0.97 0.00 0.00 0.00 178.83 179.07 1i1w h ASN 300 N 0.98 0.98 1.84 -0.69 -1.24 -0.63 -2.76 115.58 114.05 1i1w h ASN 300 Ca 0.17 -0.01 -0.02 0.00 0.71 0.00 0.00 56.30 57.15 1i1w h ASN 300 Cb 0.57 -0.22 -0.00 0.00 0.73 0.00 0.00 38.32 39.40 1i1w h ASN 300 CO 0.03 0.67 -0.12 -0.07 -1.29 0.00 0.00 177.43 176.65 1i1w h LEU 301 N 1.13 0.00 -9.92 0.34 3.38 -0.59 -3.46 115.31 106.19 1i1w h LEU 301 Ca 0.36 0.00 -0.56 0.00 0.09 0.00 0.00 57.88 57.77 1i1w h LEU 301 Cb 0.03 0.00 0.15 0.00 0.09 0.00 0.00 40.66 40.94 1i1w h LEU 301 CO -0.11 0.12 0.33 0.00 0.09 0.00 0.00 178.44 178.87 1i1w n GLN 302 N -3.13 1.21 0.00 1.13 6.02 -0.60 -4.89 117.38 117.11 1i1w n GLN 302 Ca 0.03 0.46 0.06 0.00 -0.01 0.00 0.00 57.00 57.54 1i1w n GLN 302 Cb 0.57 -2.34 0.05 0.00 1.02 0.00 0.00 30.24 29.54 1i1w n GLN 302 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 177.06 177.09