#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2w2l n PRO 2 N 0.00 1.76 -3.21 0.03 -0.04 -1.26 -4.78 135.00 127.49 2w2l n PRO 2 Ca 0.00 0.00 -0.15 0.00 -0.04 0.00 0.00 63.50 63.31 2w2l n PRO 2 Cb 0.00 0.00 0.02 0.00 -0.04 0.00 0.00 33.50 33.48 2w2l n PRO 2 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 2w2l n ARG 3 N 0.00 -1.49 -0.84 0.54 1.74 -1.26 -4.94 116.66 110.41 2w2l n ARG 3 Ca 0.00 1.40 -0.32 0.00 -0.77 0.00 0.00 57.85 58.15 2w2l n ARG 3 Cb 0.00 -2.39 0.14 0.00 -1.02 0.00 0.00 32.46 29.19 2w2l n ARG 3 CO 0.00 0.00 0.00 -2.30 -1.52 0.00 0.00 177.63 173.81 2w2l n PRO 4 N 0.52 -0.22 -4.12 5.56 -0.02 -1.26 -4.47 135.00 130.99 2w2l n PRO 4 Ca -0.02 -0.00 -0.34 0.00 -2.02 0.00 0.00 63.50 61.12 2w2l n PRO 4 Cb 0.50 -2.20 -0.11 0.00 -0.02 0.00 0.00 33.50 31.67 2w2l n PRO 4 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 2w2l s ARG 5 N -4.10 3.84 -0.13 -0.52 0.52 -1.26 -1.57 118.95 115.73 2w2l s ARG 5 Ca 0.65 -0.42 0.02 0.00 -0.52 0.00 0.00 55.73 55.46 2w2l s ARG 5 Cb -0.25 -3.12 -0.00 0.00 0.52 0.00 0.00 34.95 32.10 2w2l s ARG 5 CO 0.59 0.22 -0.19 0.08 0.02 0.00 0.00 175.30 176.02 2w2l s VAL 6 N 0.48 2.47 -0.09 3.52 1.01 0.33 -0.47 120.40 127.64 2w2l s VAL 6 Ca 0.01 -0.86 -0.29 0.00 0.00 0.00 0.00 61.98 60.84 2w2l s VAL 6 Cb -0.13 -2.00 -0.02 0.00 0.00 0.00 0.00 36.38 34.23 2w2l s VAL 6 CO 0.01 0.54 0.97 -0.22 0.00 0.00 0.00 175.10 176.41 2w2l s LEU 7 N 0.53 4.26 -0.33 3.92 2.96 0.09 0.33 118.68 130.44 2w2l s LEU 7 Ca -0.12 1.50 -0.15 0.00 -0.22 0.00 0.00 54.13 55.15 2w2l s LEU 7 Cb -0.16 -3.51 -0.02 0.00 0.50 0.00 0.00 46.19 43.00 2w2l s LEU 7 CO 0.04 -0.40 0.35 -0.22 -1.32 0.00 0.00 176.35 174.80 2w2l s LEU 8 N 1.83 4.39 -0.74 -0.68 2.96 0.24 -1.35 118.68 125.32 2w2l s LEU 8 Ca 0.48 -0.19 -0.24 0.00 -0.22 0.00 0.00 54.13 53.96 2w2l s LEU 8 Cb -0.18 -2.33 0.06 0.00 0.50 0.00 0.00 46.19 44.24 2w2l s LEU 8 CO 0.19 -0.31 1.13 -0.76 -1.32 0.00 0.00 176.35 175.28 2w2l s LEU 9 N 2.00 3.95 0.00 -0.68 1.43 -0.04 -2.10 118.68 123.23 2w2l s LEU 9 Ca 0.12 -0.94 0.00 0.00 -1.03 0.00 0.00 54.13 52.27 2w2l s LEU 9 Cb -0.16 -2.48 0.00 0.00 0.03 0.00 0.00 46.19 43.58 2w2l s LEU 9 CO 0.11 -1.55 0.00 0.61 0.23 0.00 0.00 176.35 175.75 2w2l n GLY 10 N 5.50 0.49 3.82 -3.19 0.00 -1.26 -3.55 105.19 107.00 2w2l n GLY 10 Ca 0.04 -1.38 -0.33 0.00 0.00 0.00 0.00 46.02 44.36 2w2l n GLY 10 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2w2l s ASP 11 N -4.00 6.47 1.22 1.61 1.01 -1.26 -4.82 116.67 116.91 2w2l s ASP 11 Ca 0.00 1.74 -0.18 0.00 0.71 0.00 0.00 52.55 54.82 2w2l s ASP 11 Cb 0.00 -2.54 0.27 0.00 1.01 0.00 0.00 42.92 41.66 2w2l s ASP 11 CO 0.00 -0.69 0.95 -0.81 0.21 0.00 0.00 175.17 174.83 2w2l n PRO 12 N -1.25 -2.92 -1.93 8.23 -0.04 -1.26 -4.70 135.00 131.13 2w2l n PRO 12 Ca 0.08 -1.53 -0.40 0.00 -0.04 0.00 0.00 63.50 61.61 2w2l n PRO 12 Cb 0.53 -1.44 0.00 0.00 -0.04 0.00 0.00 33.50 32.55 2w2l n PRO 12 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2w2l s ALA 13 N -2.99 3.36 -0.12 0.55 0.00 -1.26 -4.96 121.76 116.34 2w2l s ALA 13 Ca 0.62 1.39 0.07 0.00 0.00 0.00 0.00 51.96 54.04 2w2l s ALA 13 Cb -0.06 -3.55 -0.09 0.00 0.00 0.00 0.00 23.12 19.42 2w2l s ALA 13 CO 0.48 -0.96 0.20 0.54 0.00 0.00 0.00 175.76 176.01 2w2l n ARG 14 N 0.21 1.96 0.00 0.00 1.74 -1.26 -4.88 116.66 114.43 2w2l n ARG 14 Ca 0.03 -0.04 0.00 0.00 -0.77 0.00 0.00 57.85 57.07 2w2l n ARG 14 Cb 0.42 -1.03 0.00 0.00 -1.02 0.00 0.00 32.46 30.83 2w2l n ARG 14 CO 0.00 0.00 0.00 0.72 -1.52 0.00 0.00 177.63 176.83 2w2l n HIS 15 N -1.51 0.00 -2.38 -1.55 8.25 -1.26 -4.82 115.22 111.95 2w2l n HIS 15 Ca -0.00 0.00 -0.41 0.00 -0.26 0.00 0.00 57.72 57.05 2w2l n HIS 15 Cb 0.15 0.03 0.01 0.00 1.12 0.00 0.00 29.99 31.29 2w2l n HIS 15 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 2w2l n LEU 16 N -2.76 7.60 -0.32 2.41 4.77 -1.26 -4.84 117.00 122.60 2w2l n LEU 16 Ca 0.00 -5.15 0.22 0.00 -0.03 0.00 0.00 56.01 51.05 2w2l n LEU 16 Cb 0.46 -1.26 0.43 0.00 -2.33 0.00 0.00 43.42 40.72 2w2l n LEU 16 CO 0.00 2.02 1.00 0.44 -1.33 0.00 0.00 177.39 179.52 2w2l h ASP 17 N 4.47 0.15 1.21 -1.43 3.32 -1.90 -0.40 116.42 121.84 2w2l h ASP 17 Ca 0.59 0.23 -0.16 0.00 0.02 0.00 0.00 57.03 57.71 2w2l h ASP 17 Cb 0.33 0.27 -0.02 0.00 0.22 0.00 0.00 39.33 40.13 2w2l h ASP 17 CO 1.32 -0.27 -0.80 0.44 -1.72 0.00 0.00 179.24 178.21 2w2l h ASP 18 N 0.15 0.00 -0.18 6.45 3.32 -2.00 -1.41 116.42 122.75 2w2l h ASP 18 Ca 0.70 0.00 -0.21 0.00 0.02 0.00 0.00 57.03 57.54 2w2l h ASP 18 Cb 1.63 0.00 0.01 0.00 0.22 0.00 0.00 39.33 41.18 2w2l h ASP 18 CO -0.72 0.75 -0.69 0.25 -1.72 0.00 0.00 179.24 177.10 2w2l h LEU 19 N 0.00 0.92 -1.48 1.55 5.85 -1.83 -2.73 115.31 117.59 2w2l h LEU 19 Ca -0.02 -0.61 -0.06 0.00 0.84 0.00 0.00 57.88 58.04 2w2l h LEU 19 Cb 1.59 -0.27 -0.01 0.00 0.37 0.00 0.00 40.66 42.34 2w2l h LEU 19 CO 0.09 1.37 -0.26 -0.25 -0.34 0.00 0.00 178.44 179.05 2w2l h TRP 20 N 0.53 0.00 0.35 1.25 2.91 -0.98 -0.13 115.95 119.87 2w2l h TRP 20 Ca -0.04 0.00 -0.02 0.00 1.13 0.00 0.00 58.89 59.97 2w2l h TRP 20 Cb 1.32 0.00 0.00 0.00 -0.51 0.00 0.00 29.16 29.97 2w2l h TRP 20 CO 0.09 0.26 -0.17 0.77 -1.03 0.00 0.00 178.44 178.37 2w2l h SER 21 N 0.00 -0.39 -0.75 2.65 0.02 -1.19 -2.63 113.55 111.26 2w2l h SER 21 Ca -0.00 -0.16 0.11 0.00 -0.84 0.00 0.00 61.79 60.90 2w2l h SER 21 Cb 0.51 0.10 -0.05 0.00 0.14 0.00 0.00 62.40 63.10 2w2l h SER 21 CO 0.03 -0.01 0.49 -0.78 -1.14 0.00 0.00 176.83 175.43 2w2l h ASP 22 N -0.84 0.53 -0.49 3.07 3.58 -1.31 -1.08 116.42 119.88 2w2l h ASP 22 Ca -0.05 0.02 -0.02 0.00 0.42 0.00 0.00 57.03 57.40 2w2l h ASP 22 Cb 0.53 -0.09 -0.03 0.00 1.72 0.00 0.00 39.33 41.46 2w2l h ASP 22 CO 0.08 0.30 0.25 0.15 -2.88 0.00 0.00 179.24 177.14 2w2l h PHE 23 N 0.58 0.73 0.14 0.28 3.57 -0.96 -1.33 116.94 119.95 2w2l h PHE 23 Ca 0.35 -0.02 -0.35 0.00 3.53 0.00 0.00 57.97 61.48 2w2l h PHE 23 Cb 0.58 -0.23 -0.01 0.00 2.79 0.00 0.00 35.95 39.08 2w2l h PHE 23 CO -0.00 0.54 -1.87 1.96 -2.23 0.00 0.00 178.31 176.71 2w2l h GLN 24 N 0.74 0.30 0.00 1.11 4.20 -0.81 -1.28 115.11 119.37 2w2l h GLN 24 Ca 0.18 -0.52 0.00 0.00 0.06 0.00 0.00 58.65 58.38 2w2l h GLN 24 Cb 0.08 0.19 0.00 0.00 0.30 0.00 0.00 27.48 28.06 2w2l h GLN 24 CO -0.02 1.25 0.00 0.94 -0.67 0.00 0.00 178.83 180.32 2w2l n GLN 25 N -3.57 0.00 0.21 1.46 -0.06 -1.13 -3.44 117.38 110.84 2w2l n GLN 25 Ca -0.29 0.00 0.13 0.00 -2.00 0.00 0.00 57.00 54.84 2w2l n GLN 25 Cb 1.04 0.00 0.29 0.00 -4.06 0.00 0.00 30.24 27.51 2w2l n GLN 25 CO 0.00 0.00 0.00 0.87 -0.20 0.00 0.00 177.06 177.73 2w2l h LYS 26 N 0.00 0.00 -3.80 3.69 1.57 -0.28 -3.46 116.57 114.29 2w2l h LYS 26 Ca 0.00 0.00 -0.18 0.00 -1.87 0.00 0.00 60.65 58.60 2w2l h LYS 26 Cb 0.00 0.00 -0.23 0.00 0.08 0.00 0.00 32.23 32.08 2w2l h LYS 26 CO 0.00 0.00 -0.66 -0.06 -0.57 0.00 0.00 179.45 178.16 2w2l s PHE 27 N -3.26 0.13 -0.47 -1.35 0.08 -0.58 -4.08 117.98 108.46 2w2l s PHE 27 Ca 0.07 -0.27 -0.24 0.00 0.12 0.00 0.00 56.93 56.60 2w2l s PHE 27 Cb 0.07 -0.10 0.03 0.00 -0.57 0.00 0.00 43.02 42.44 2w2l s PHE 27 CO 0.63 -0.15 0.87 -2.00 -0.10 0.00 0.00 175.22 174.47 2w2l s GLU 28 N -0.99 3.45 -0.31 0.44 2.12 -0.61 -4.53 118.70 118.27 2w2l s GLU 28 Ca -0.11 -0.01 -0.14 0.00 0.36 0.00 0.00 54.97 55.08 2w2l s GLU 28 Cb -0.07 -3.95 -0.03 0.00 0.26 0.00 0.00 34.13 30.35 2w2l s GLU 28 CO -0.00 -1.21 0.29 0.08 -0.54 0.00 0.00 175.26 173.88 2w2l s VAL 29 N 3.58 5.23 -0.23 3.70 1.01 -1.26 -0.51 120.40 131.92 2w2l s VAL 29 Ca 0.33 0.10 -0.04 0.00 0.00 0.00 0.00 61.98 62.37 2w2l s VAL 29 Cb -0.11 -3.70 -0.00 0.00 0.00 0.00 0.00 36.38 32.56 2w2l s VAL 29 CO 0.24 0.06 -0.03 -0.63 0.00 0.00 0.00 175.10 174.74 2w2l s ILE 30 N 1.89 3.41 0.11 2.22 1.01 0.15 -4.92 121.20 125.07 2w2l s ILE 30 Ca 0.10 -0.56 -0.31 0.00 0.00 0.00 0.00 60.65 59.88 2w2l s ILE 30 Cb -0.16 -2.60 -0.07 0.00 0.01 0.00 0.00 42.46 39.64 2w2l s ILE 30 CO 0.11 0.36 1.28 -2.84 0.00 0.00 0.00 174.94 173.84 2w2l s PRO 31 N 1.47 4.40 0.30 2.79 0.02 -1.26 0.80 135.00 143.52 2w2l s PRO 31 Ca 0.05 1.92 0.26 0.00 0.02 0.00 0.00 61.00 63.25 2w2l s PRO 31 Cb -0.15 -3.28 0.96 0.00 0.02 0.00 0.00 34.50 32.05 2w2l s PRO 31 CO -0.03 -0.29 1.76 0.00 -0.33 0.00 0.00 177.00 178.12 2w2l h ALA 32 N 6.40 1.00 -6.55 -1.55 0.00 -1.74 -3.46 119.26 113.35 2w2l h ALA 32 Ca -0.43 0.00 -0.35 0.00 0.00 0.00 0.00 54.91 54.14 2w2l h ALA 32 Cb 1.21 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 19.00 2w2l h ALA 32 CO 0.81 0.00 -0.69 0.09 0.00 0.00 0.00 179.25 179.46 2w2l n ASN 33 N -2.43 -2.89 -4.77 0.00 3.02 -1.26 -4.77 115.26 102.16 2w2l n ASN 33 Ca 0.03 -0.72 -0.40 0.00 -0.03 0.00 0.00 54.58 53.46 2w2l n ASN 33 Cb 0.31 -1.02 -0.02 0.00 -0.61 0.00 0.00 39.78 38.45 2w2l n ASN 33 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 2w2l s LEU 34 N -5.01 4.35 0.00 3.41 1.43 -1.26 -4.97 118.68 116.63 2w2l s LEU 34 Ca 0.13 2.68 0.00 0.00 -1.03 0.00 0.00 54.13 55.91 2w2l s LEU 34 Cb -0.07 -3.74 0.00 0.00 0.03 0.00 0.00 46.19 42.41 2w2l s LEU 34 CO 0.60 -0.64 0.00 0.35 0.23 0.00 0.00 176.35 176.88 2w2l n THR 35 N 0.56 0.00 -4.39 5.49 -2.24 -1.26 -5.06 114.28 107.38 2w2l n THR 35 Ca 0.01 0.00 -0.21 0.00 -2.27 0.00 0.00 64.05 61.58 2w2l n THR 35 Cb 0.42 -0.79 -0.09 0.00 -2.10 0.00 0.00 70.33 67.77 2w2l n THR 35 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 2w2l s THR 36 N 0.00 0.44 0.11 4.28 -4.23 -1.26 -4.89 115.64 110.09 2w2l s THR 36 Ca 0.00 -2.00 -0.33 0.00 -1.18 0.00 0.00 61.69 58.18 2w2l s THR 36 Cb 0.00 -2.48 -0.12 0.00 1.34 0.00 0.00 72.50 71.24 2w2l s THR 36 CO 0.00 0.00 1.58 -0.74 -0.54 0.00 0.00 174.62 174.92 2w2l h HIS 37 N 2.07 -1.30 -0.25 3.99 2.76 -1.51 0.23 115.15 121.15 2w2l h HIS 37 Ca -0.34 0.03 0.03 0.00 -2.20 0.00 0.00 60.37 57.89 2w2l h HIS 37 Cb 1.25 0.55 -0.03 0.00 1.55 0.00 0.00 27.41 30.73 2w2l h HIS 37 CO 1.21 -0.56 0.06 -0.44 -1.30 0.00 0.00 177.93 176.90 2w2l h ASP 38 N -0.72 0.04 -1.03 3.26 3.32 -1.93 -0.12 116.42 119.24 2w2l h ASP 38 Ca 0.00 0.03 0.32 0.00 0.02 0.00 0.00 57.03 57.41 2w2l h ASP 38 Cb 0.73 0.04 -0.14 0.00 0.22 0.00 0.00 39.33 40.17 2w2l h ASP 38 CO -0.24 0.05 0.60 1.23 -1.72 0.00 0.00 179.24 179.16 2w2l h GLY 39 N 0.16 1.97 0.79 2.75 0.00 -1.81 -0.08 103.07 106.84 2w2l h GLY 39 Ca 0.11 -0.23 -0.16 0.00 0.00 0.00 0.00 47.33 47.04 2w2l h GLY 39 CO -0.14 -0.45 -0.65 -2.75 0.00 0.00 0.00 176.54 172.55 2w2l h PHE 40 N 0.33 0.62 -0.97 5.60 3.57 0.72 -2.23 116.94 124.58 2w2l h PHE 40 Ca 0.73 -0.35 0.29 0.00 3.53 0.00 0.00 57.97 62.17 2w2l h PHE 40 Cb 1.70 -0.07 -0.15 0.00 2.79 0.00 0.00 35.95 40.23 2w2l h PHE 40 CO -0.01 1.18 0.47 -0.22 -2.23 0.00 0.00 178.31 177.50 2w2l h LYS 41 N -0.12 0.29 0.09 1.11 3.64 -0.18 -1.63 116.57 119.78 2w2l h LYS 41 Ca -0.09 -0.02 -0.27 0.00 -1.27 0.00 0.00 60.65 59.00 2w2l h LYS 41 Cb 1.37 -0.07 0.02 0.00 -0.41 0.00 0.00 32.23 33.14 2w2l h LYS 41 CO 0.13 0.19 -1.16 1.96 -2.27 0.00 0.00 179.45 178.30 2w2l h GLN 42 N 0.30 0.46 -0.63 1.90 1.08 -0.92 -2.33 115.11 114.97 2w2l h GLN 42 Ca 0.68 -0.62 0.02 0.00 -1.45 0.00 0.00 58.65 57.28 2w2l h GLN 42 Cb 1.49 0.21 -0.04 0.00 -0.05 0.00 0.00 27.48 29.09 2w2l h GLN 42 CO -0.62 1.26 0.40 0.00 -0.95 0.00 0.00 178.83 178.92 2w2l h ALA 43 N 0.50 0.82 -0.44 3.87 0.00 -1.08 -2.26 119.26 120.67 2w2l h ALA 43 Ca -0.14 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.72 2w2l h ALA 43 Cb 1.84 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 19.40 2w2l h ALA 43 CO 0.21 0.17 0.20 -0.07 0.00 0.00 0.00 179.25 179.75 2w2l h LEU 44 N 0.79 0.55 0.09 0.00 3.38 -1.20 0.13 115.31 119.05 2w2l h LEU 44 Ca 0.25 -0.05 -0.00 0.00 0.09 0.00 0.00 57.88 58.17 2w2l h LEU 44 Cb -0.01 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 40.60 2w2l h LEU 44 CO -0.09 0.48 -0.04 0.03 0.09 0.00 0.00 178.44 178.91 2w2l h ARG 45 N 0.61 -0.12 0.00 1.13 3.08 -1.14 -2.69 114.38 115.26 2w2l h ARG 45 Ca 0.15 0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.21 2w2l h ARG 45 Cb 0.09 0.03 0.00 0.00 0.08 0.00 0.00 29.97 30.16 2w2l h ARG 45 CO -0.02 0.36 0.00 0.39 -1.07 0.00 0.00 179.97 179.63 2w2l n GLU 46 N -4.90 0.14 -2.95 0.04 1.02 -0.88 -4.86 120.64 108.25 2w2l n GLU 46 Ca -0.08 0.00 -0.21 0.00 -0.02 0.00 0.00 57.16 56.85 2w2l n GLU 46 Cb 0.27 -1.48 0.01 0.00 -0.02 0.00 0.00 31.44 30.22 2w2l n GLU 46 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 2w2l n LYS 47 N -0.98 -3.70 -0.20 3.49 5.02 -0.92 -4.88 118.16 115.99 2w2l n LYS 47 Ca 0.03 0.76 0.22 0.00 -2.02 0.00 0.00 58.31 57.30 2w2l n LYS 47 Cb 0.01 -5.52 0.60 0.00 -0.02 0.00 0.00 35.03 30.10 2w2l n LYS 47 CO 0.00 0.00 0.00 -0.09 -0.52 0.00 0.00 177.40 176.79 2w2l h ARG 48 N -0.90 0.23 -0.07 1.97 2.43 -1.02 -1.01 114.38 116.01 2w2l h ARG 48 Ca -0.46 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 58.69 2w2l h ARG 48 Cb 1.32 -0.05 0.00 0.00 -0.42 0.00 0.00 29.97 30.82 2w2l h ARG 48 CO 0.53 0.15 0.00 0.66 -1.51 0.00 0.00 179.97 179.80 2w2l n TYR 49 N -4.42 0.05 -3.68 2.20 4.01 -1.26 -5.09 117.16 108.97 2w2l n TYR 49 Ca 0.18 -0.03 0.05 0.00 -0.16 0.00 0.00 57.90 57.94 2w2l n TYR 49 Cb 0.77 -0.00 -0.01 0.00 -0.31 0.00 0.00 39.34 39.79 2w2l n TYR 49 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2w2l n GLY 50 N 1.24 -1.41 3.77 2.72 0.00 -0.39 -4.67 105.19 106.44 2w2l n GLY 50 Ca 0.13 -1.13 -0.40 0.00 0.00 0.00 0.00 46.02 44.63 2w2l n GLY 50 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2w2l s ASP 51 N -4.66 6.93 0.18 1.61 1.01 -1.26 -4.92 116.67 115.56 2w2l s ASP 51 Ca 0.00 2.47 0.03 0.00 0.71 0.00 0.00 52.55 55.76 2w2l s ASP 51 Cb 0.00 -2.63 -0.05 0.00 1.01 0.00 0.00 42.92 41.25 2w2l s ASP 51 CO 0.00 -0.40 -0.03 0.72 0.21 0.00 0.00 175.17 175.67 2w2l s PHE 52 N -1.19 1.33 -0.12 4.23 -0.12 -1.26 -4.87 117.98 115.97 2w2l s PHE 52 Ca 0.48 -0.91 0.11 0.00 -0.05 0.00 0.00 56.93 56.56 2w2l s PHE 52 Cb -0.35 -0.74 -0.17 0.00 -0.63 0.00 0.00 43.02 41.13 2w2l s PHE 52 CO 0.46 -0.07 0.30 0.39 -0.05 0.00 0.00 175.22 176.24 2w2l n GLU 53 N -0.28 0.99 -3.89 1.99 4.71 0.38 -2.21 120.64 122.32 2w2l n GLU 53 Ca -0.07 -0.08 -0.10 0.00 -0.01 0.00 0.00 57.16 56.89 2w2l n GLU 53 Cb 0.63 -1.22 -0.10 0.00 -1.01 0.00 0.00 31.44 29.74 2w2l n GLU 53 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 2w2l s ALA 54 N -2.63 -0.23 -0.04 0.62 0.00 -1.16 -0.46 121.76 117.85 2w2l s ALA 54 Ca -0.02 -0.29 0.05 0.00 0.00 0.00 0.00 51.96 51.70 2w2l s ALA 54 Cb 0.08 0.16 -0.02 0.00 0.00 0.00 0.00 23.12 23.33 2w2l s ALA 54 CO 0.47 -0.24 -0.18 0.42 0.00 0.00 0.00 175.76 176.22 2w2l s ILE 55 N -1.79 2.72 -0.06 0.00 1.01 -0.55 -0.73 121.20 121.81 2w2l s ILE 55 Ca -0.12 -0.85 0.05 0.00 0.00 0.00 0.00 60.65 59.73 2w2l s ILE 55 Cb -0.06 -2.03 -0.00 0.00 0.01 0.00 0.00 42.46 40.38 2w2l s ILE 55 CO -0.01 0.59 -0.20 -0.51 0.00 0.00 0.00 174.94 174.82 2w2l s ILE 56 N -0.66 1.64 -0.18 2.92 2.07 -0.46 -1.45 121.20 125.08 2w2l s ILE 56 Ca 0.10 -0.82 -0.01 0.00 -1.41 0.00 0.00 60.65 58.51 2w2l s ILE 56 Cb -0.11 -1.41 0.05 0.00 0.13 0.00 0.00 42.46 41.12 2w2l s ILE 56 CO 0.00 0.47 -0.01 -0.75 -1.91 0.00 0.00 174.94 172.74 2w2l s LYS 57 N 0.08 1.05 0.00 3.50 2.20 -0.90 -0.86 119.74 124.81 2w2l s LYS 57 Ca -0.07 -0.50 0.23 0.00 -0.36 0.00 0.00 55.97 55.27 2w2l s LYS 57 Cb -0.13 -2.07 0.07 0.00 -1.51 0.00 0.00 37.83 34.19 2w2l s LYS 57 CO 0.04 -0.54 1.12 1.28 -0.36 0.00 0.00 175.35 176.88 2w2l n LEU 58 N 4.94 1.31 -3.80 5.43 4.77 -1.26 -0.34 117.00 128.04 2w2l n LEU 58 Ca -0.10 -0.50 -0.12 0.00 -0.03 0.00 0.00 56.01 55.26 2w2l n LEU 58 Cb 0.47 -0.05 -0.09 0.00 -2.33 0.00 0.00 43.42 41.42 2w2l n LEU 58 CO 0.15 0.27 -0.05 0.00 -1.33 0.00 0.00 177.39 176.42 2w2l s ALA 59 N -2.75 -0.60 0.28 -1.18 0.00 -1.26 -4.40 121.76 111.84 2w2l s ALA 59 Ca 0.14 0.16 0.01 0.00 0.00 0.00 0.00 51.96 52.27 2w2l s ALA 59 Cb 0.17 0.08 0.58 0.00 0.00 0.00 0.00 23.12 23.95 2w2l s ALA 59 CO 0.70 -0.24 1.80 0.28 0.00 0.00 0.00 175.76 178.30 2w2l h VAL 60 N 4.04 0.83 -0.15 0.00 2.07 -1.89 -2.40 116.25 118.74 2w2l h VAL 60 Ca -0.30 -0.29 0.00 0.00 0.82 0.00 0.00 66.70 66.93 2w2l h VAL 60 Cb 1.18 -0.09 0.00 0.00 -1.52 0.00 0.00 31.29 30.86 2w2l h VAL 60 CO 0.40 0.15 0.00 -1.84 0.02 0.00 0.00 177.57 176.30 2w2l n GLU 61 N -4.72 1.67 -2.41 1.57 0.00 -1.26 -4.86 120.64 110.63 2w2l n GLU 61 Ca 0.19 -1.00 -0.32 0.00 0.00 0.00 0.00 57.16 56.03 2w2l n GLU 61 Cb 0.41 -1.39 -0.03 0.00 0.00 0.00 0.00 31.44 30.44 2w2l n GLU 61 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.13 176.33 2w2l s ASN 62 N -1.57 6.60 0.00 -1.84 -0.87 -0.91 -4.15 114.94 112.21 2w2l s ASN 62 Ca 0.32 1.53 0.00 0.00 -1.57 0.00 0.00 52.86 53.14 2w2l s ASN 62 Cb 0.17 -2.49 0.00 0.00 -0.02 0.00 0.00 41.25 38.91 2w2l s ASN 62 CO 0.26 -0.58 0.00 0.61 -2.57 0.00 0.00 177.10 174.81 2w2l n GLY 63 N -1.60 0.00 0.49 0.66 0.00 -1.23 -4.83 105.19 98.68 2w2l n GLY 63 Ca 0.06 0.00 0.30 0.00 0.00 0.00 0.00 46.02 46.38 2w2l n GLY 63 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 2w2l h THR 64 N 0.00 0.31 -0.44 2.61 1.35 -1.90 0.83 112.91 115.67 2w2l h THR 64 Ca 0.00 0.00 0.13 0.00 -0.55 0.00 0.00 66.41 65.99 2w2l h THR 64 Cb 0.44 0.40 -0.02 0.00 -1.73 0.00 0.00 68.15 67.24 2w2l h THR 64 CO 0.00 0.00 0.51 -0.33 -0.25 0.00 0.00 175.52 175.45 2w2l h GLU 65 N 0.00 0.00 0.00 4.72 3.07 -1.90 -0.18 114.58 120.29 2w2l h GLU 65 Ca 0.44 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.30 2w2l h GLU 65 Cb 2.05 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.96 2w2l h GLU 65 CO -0.00 0.00 -0.08 -1.13 -1.40 0.00 0.00 179.01 176.40 2w2l n SER 66 N -3.63 0.53 -4.77 1.42 3.41 0.29 -1.40 113.62 109.46 2w2l n SER 66 Ca 0.08 0.47 -0.40 0.00 -0.26 0.00 0.00 58.87 58.77 2w2l n SER 66 Cb 0.69 -0.57 -0.02 0.00 -0.26 0.00 0.00 64.21 64.05 2w2l n SER 66 CO 0.00 0.00 0.00 -0.31 -0.16 0.00 0.00 175.04 174.57 2w2l s TYR 67 N -3.07 2.99 0.32 7.33 4.12 -0.08 -4.23 117.35 124.72 2w2l s TYR 67 Ca 0.11 1.45 -0.17 0.00 0.02 0.00 0.00 57.07 58.48 2w2l s TYR 67 Cb 0.15 -3.61 -0.09 0.00 -1.52 0.00 0.00 41.96 36.89 2w2l s TYR 67 CO 0.59 -1.79 0.77 -1.25 0.02 0.00 0.00 175.55 173.89 2w2l s PRO 68 N -2.04 4.11 -1.29 -1.71 0.04 -1.26 -4.69 135.00 128.16 2w2l s PRO 68 Ca 0.53 0.80 -0.16 0.00 0.04 0.00 0.00 61.00 62.21 2w2l s PRO 68 Cb -0.37 -2.50 0.09 0.00 0.04 0.00 0.00 34.50 31.76 2w2l s PRO 68 CO 0.48 0.18 1.72 0.91 0.04 0.00 0.00 177.00 180.34 2w2l n TRP 69 N -0.14 4.58 -2.90 0.56 7.02 0.23 -4.87 117.44 121.92 2w2l n TRP 69 Ca 0.03 -2.97 -0.19 0.00 -1.02 0.00 0.00 57.50 53.35 2w2l n TRP 69 Cb 0.53 -2.51 0.03 0.00 -2.42 0.00 0.00 31.31 26.94 2w2l n TRP 69 CO 0.00 0.00 0.00 0.54 -2.02 0.00 0.00 177.69 176.21 2w2l s ASN 70 N 3.72 5.37 0.34 -0.99 2.20 -1.26 0.73 114.94 125.06 2w2l s ASN 70 Ca 0.50 -0.41 0.03 0.00 -0.94 0.00 0.00 52.86 52.05 2w2l s ASN 70 Cb 0.04 -0.48 0.64 0.00 -2.00 0.00 0.00 41.25 39.45 2w2l s ASN 70 CO 0.05 -1.04 1.97 0.00 -2.94 0.00 0.00 177.10 175.14 2w2l h ALA 71 N 0.34 1.59 -0.68 3.54 0.00 -1.93 -0.63 119.26 121.49 2w2l h ALA 71 Ca -0.38 -0.03 -0.07 0.00 0.00 0.00 0.00 54.91 54.43 2w2l h ALA 71 Cb 1.28 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 18.81 2w2l h ALA 71 CO 0.45 0.33 0.16 0.22 0.00 0.00 0.00 179.25 180.41 2w2l h ASP 72 N 0.87 1.04 -0.16 0.00 3.58 -1.97 -0.70 116.42 119.08 2w2l h ASP 72 Ca 0.29 -0.24 -0.05 0.00 0.42 0.00 0.00 57.03 57.45 2w2l h ASP 72 Cb 0.08 -0.27 -0.00 0.00 1.72 0.00 0.00 39.33 40.85 2w2l h ASP 72 CO -0.08 1.01 -0.10 0.25 -2.88 0.00 0.00 179.24 177.43 2w2l h LEU 73 N 1.02 0.37 -2.16 2.28 5.85 -1.80 -3.20 115.31 117.69 2w2l h LEU 73 Ca 0.21 -0.44 -0.01 0.00 0.84 0.00 0.00 57.88 58.48 2w2l h LEU 73 Cb 0.38 -0.10 -0.00 0.00 0.37 0.00 0.00 40.66 41.30 2w2l h LEU 73 CO 0.00 0.73 -0.06 0.40 -0.34 0.00 0.00 178.44 179.17 2w2l h ILE 74 N 0.02 0.62 0.00 4.05 2.04 -0.92 -2.31 117.51 121.02 2w2l h ILE 74 Ca 0.03 -0.26 0.00 0.00 1.00 0.00 0.00 64.86 65.63 2w2l h ILE 74 Cb 0.60 1.16 0.00 0.00 -0.74 0.00 0.00 36.82 37.84 2w2l h ILE 74 CO 0.03 0.06 0.00 -1.54 0.00 0.00 0.00 178.15 176.70 2w2l n SER 75 N -3.85 0.00 -0.82 1.72 3.41 -0.29 -2.67 113.62 111.13 2w2l n SER 75 Ca -0.02 -0.12 0.09 0.00 -0.26 0.00 0.00 58.87 58.56 2w2l n SER 75 Cb 0.16 -0.27 0.11 0.00 -0.26 0.00 0.00 64.21 63.95 2w2l n SER 75 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 2w2l n HIS 76 N -1.27 0.16 -1.85 7.33 8.25 -0.87 -5.03 115.22 121.94 2w2l n HIS 76 Ca 0.13 -0.10 -0.35 0.00 -0.26 0.00 0.00 57.72 57.13 2w2l n HIS 76 Cb 0.20 -0.00 0.05 0.00 1.12 0.00 0.00 29.99 31.35 2w2l n HIS 76 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 2w2l s LEU 77 N -1.45 3.55 0.46 2.41 1.43 -1.09 -4.55 118.68 119.45 2w2l s LEU 77 Ca 0.25 2.33 -0.24 0.00 -1.03 0.00 0.00 54.13 55.44 2w2l s LEU 77 Cb 0.17 -4.59 -0.07 0.00 0.03 0.00 0.00 46.19 41.72 2w2l s LEU 77 CO 0.24 -1.74 1.28 -2.16 0.23 0.00 0.00 176.35 174.20 2w2l s PRO 78 N -3.56 3.69 0.00 1.29 0.04 -1.26 -4.87 135.00 130.32 2w2l s PRO 78 Ca 0.75 2.08 0.18 0.00 0.04 0.00 0.00 61.00 64.05 2w2l s PRO 78 Cb -0.29 -2.53 0.99 0.00 0.04 0.00 0.00 34.50 32.72 2w2l s PRO 78 CO 0.37 -0.70 1.48 0.43 0.04 0.00 0.00 177.00 178.61 2w2l n SER 79 N -0.35 0.00 0.07 6.66 7.64 -1.26 -1.54 113.62 124.84 2w2l n SER 79 Ca 0.06 -0.34 0.12 0.00 1.01 0.00 0.00 58.87 59.72 2w2l n SER 79 Cb 0.45 -0.10 0.12 0.00 -1.01 0.00 0.00 64.21 63.67 2w2l n SER 79 CO 0.00 0.00 0.00 0.77 -3.01 0.00 0.00 175.04 172.80 2w2l h SER 80 N 0.00 0.00 -2.43 6.43 4.64 -1.90 -3.47 113.55 116.82 2w2l h SER 80 Ca 0.00 -0.18 -0.54 0.00 -0.47 0.00 0.00 61.79 60.60 2w2l h SER 80 Cb 0.06 0.00 0.04 0.00 -0.31 0.00 0.00 62.40 62.19 2w2l h SER 80 CO 0.00 0.09 1.11 -0.11 -0.87 0.00 0.00 176.83 177.05 2w2l n LEU 81 N -2.23 3.96 -0.00 5.97 7.94 -0.59 -4.38 117.00 127.67 2w2l n LEU 81 Ca 0.02 0.98 0.02 0.00 -1.11 0.00 0.00 56.01 55.93 2w2l n LEU 81 Cb 0.46 -1.52 -0.04 0.00 0.53 0.00 0.00 43.42 42.85 2w2l n LEU 81 CO 0.37 0.14 -0.56 0.29 -1.11 0.00 0.00 177.39 176.52 2w2l n LYS 82 N 5.80 0.20 -3.66 1.96 5.02 0.39 -4.48 118.16 123.38 2w2l n LYS 82 Ca 0.19 -0.04 -0.15 0.00 -2.02 0.00 0.00 58.31 56.28 2w2l n LYS 82 Cb 0.37 -1.12 -0.08 0.00 -0.02 0.00 0.00 35.03 34.18 2w2l n LYS 82 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 2w2l s VAL 83 N -2.34 0.02 -0.17 -0.18 0.11 -1.00 -0.18 120.40 116.66 2w2l s VAL 83 Ca -0.02 -0.13 -0.02 0.00 -2.93 0.00 0.00 61.98 58.89 2w2l s VAL 83 Cb 0.03 -0.79 0.05 0.00 -1.53 0.00 0.00 36.38 34.15 2w2l s VAL 83 CO 0.21 -0.07 0.00 0.12 -3.33 0.00 0.00 175.10 172.03 2w2l s PHE 84 N -0.57 1.25 -0.11 1.54 5.99 0.94 -1.48 117.98 125.54 2w2l s PHE 84 Ca -0.07 -0.88 -0.02 0.00 0.00 0.00 0.00 56.93 55.96 2w2l s PHE 84 Cb -0.03 -1.11 -0.03 0.00 0.00 0.00 0.00 43.02 41.85 2w2l s PHE 84 CO 0.04 -0.58 -0.03 0.00 -0.00 0.00 0.00 175.22 174.65 2w2l s ALA 85 N 1.78 3.10 0.03 11.12 0.00 -0.53 -1.70 121.76 135.57 2w2l s ALA 85 Ca 0.00 -0.83 0.02 0.00 0.00 0.00 0.00 51.96 51.15 2w2l s ALA 85 Cb -0.16 -1.46 -0.02 0.00 0.00 0.00 0.00 23.12 21.48 2w2l s ALA 85 CO -0.07 0.43 -0.08 0.00 0.00 0.00 0.00 175.76 176.04 2w2l s ALA 86 N -0.34 0.58 0.65 0.00 0.00 0.59 -2.12 121.76 121.11 2w2l s ALA 86 Ca 0.06 -0.63 -0.17 0.00 0.00 0.00 0.00 51.96 51.22 2w2l s ALA 86 Cb -0.12 -0.01 -0.00 0.00 0.00 0.00 0.00 23.12 22.98 2w2l s ALA 86 CO 0.02 0.03 1.20 0.00 0.00 0.00 0.00 175.76 177.01 2w2l s ALA 87 N -1.02 2.38 0.00 0.00 0.00 0.54 -2.81 121.76 120.84 2w2l s ALA 87 Ca -0.06 0.92 0.00 0.00 0.00 0.00 0.00 51.96 52.82 2w2l s ALA 87 Cb -0.08 -3.45 0.00 0.00 0.00 0.00 0.00 23.12 19.60 2w2l s ALA 87 CO 0.00 -1.45 0.00 0.41 0.00 0.00 0.00 175.76 174.72 2w2l n GLY 88 N 0.36 2.42 0.14 0.00 0.00 -1.26 -4.56 105.19 102.28 2w2l n GLY 88 Ca 0.13 -1.94 -0.20 0.00 0.00 0.00 0.00 46.02 44.01 2w2l n GLY 88 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2w2l n ALA 89 N 1.18 1.07 -2.08 4.61 0.00 -1.26 -1.12 120.51 122.91 2w2l n ALA 89 Ca 0.00 -0.77 -0.27 0.00 0.00 0.00 0.00 53.44 52.40 2w2l n ALA 89 Cb 0.00 -0.47 0.03 0.00 0.00 0.00 0.00 19.45 19.01 2w2l n ALA 89 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 2w2l s GLY 90 N -5.88 1.60 -0.39 0.00 0.00 -1.26 -4.85 107.32 96.54 2w2l s GLY 90 Ca -0.27 -0.65 0.10 0.00 0.00 0.00 0.00 44.72 43.90 2w2l s GLY 90 CO 0.70 -0.37 1.38 1.97 0.00 0.00 0.00 173.10 176.78 2w2l n PHE 91 N -2.59 -2.24 0.28 1.90 1.16 -1.26 -4.94 117.46 109.77 2w2l n PHE 91 Ca 0.04 -1.92 0.17 0.00 -1.87 0.00 0.00 57.45 53.88 2w2l n PHE 91 Cb 0.57 1.51 0.86 0.00 -1.61 0.00 0.00 39.48 40.82 2w2l n PHE 91 CO 0.00 0.00 0.00 -0.44 -1.87 0.00 0.00 176.76 174.45 2w2l h ASP 92 N 1.87 0.00 -0.19 5.98 3.32 -2.02 -2.09 116.42 123.29 2w2l h ASP 92 Ca -0.30 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.75 2w2l h ASP 92 Cb 1.30 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.85 2w2l h ASP 92 CO -0.07 0.00 0.00 -2.67 -1.72 0.00 0.00 179.24 174.78 2w2l n TRP 93 N -3.18 0.23 -5.16 4.55 4.27 -1.26 -4.83 117.44 112.06 2w2l n TRP 93 Ca -0.00 -0.11 -0.31 0.00 -3.89 0.00 0.00 57.50 53.18 2w2l n TRP 93 Cb 0.37 0.00 -0.17 0.00 -1.36 0.00 0.00 31.31 30.15 2w2l n TRP 93 CO 0.00 0.00 0.00 -1.17 -2.29 0.00 0.00 177.69 174.23 2w2l s LEU 94 N -1.73 2.05 -0.99 5.67 2.96 -0.79 0.77 118.68 126.63 2w2l s LEU 94 Ca 0.34 -0.53 -0.21 0.00 -0.22 0.00 0.00 54.13 53.51 2w2l s LEU 94 Cb 0.21 -1.35 0.08 0.00 0.50 0.00 0.00 46.19 45.64 2w2l s LEU 94 CO 0.30 0.16 1.32 -0.62 -1.32 0.00 0.00 176.35 176.20 2w2l s ASP 95 N 0.29 6.56 0.20 3.68 -1.08 0.22 -4.90 116.67 121.64 2w2l s ASP 95 Ca -0.16 -1.71 -0.10 0.00 -0.52 0.00 0.00 52.55 50.06 2w2l s ASP 95 Cb -0.17 -2.50 0.20 0.00 -1.46 0.00 0.00 42.92 38.99 2w2l s ASP 95 CO 0.08 -1.32 1.81 0.25 0.52 0.00 0.00 175.17 176.51 2w2l h LEU 96 N 11.82 0.55 -1.30 -1.34 5.85 -1.89 -2.09 115.31 126.92 2w2l h LEU 96 Ca 0.19 0.02 -0.02 0.00 0.84 0.00 0.00 57.88 58.91 2w2l h LEU 96 Cb 1.01 -0.09 -0.02 0.00 0.37 0.00 0.00 40.66 41.93 2w2l h LEU 96 CO 1.30 0.37 0.22 0.44 -0.34 0.00 0.00 178.44 180.42 2w2l h ASP 97 N 0.68 0.63 0.05 1.25 3.32 -1.99 -1.97 116.42 118.38 2w2l h ASP 97 Ca 0.28 -0.06 -0.15 0.00 0.02 0.00 0.00 57.03 57.12 2w2l h ASP 97 Cb 0.13 -0.16 -0.01 0.00 0.22 0.00 0.00 39.33 39.51 2w2l h ASP 97 CO -0.16 0.56 -0.49 0.00 -1.72 0.00 0.00 179.24 177.43 2w2l h ALA 98 N 1.54 0.79 -0.30 3.45 0.00 -1.81 -1.05 119.26 121.90 2w2l h ALA 98 Ca 0.17 -0.48 -0.03 0.00 0.00 0.00 0.00 54.91 54.57 2w2l h ALA 98 Cb 0.11 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 2w2l h ALA 98 CO -0.02 0.67 0.08 1.25 0.00 0.00 0.00 179.25 181.23 2w2l h LEU 99 N 0.40 0.44 -1.80 0.00 5.85 -1.01 -1.95 115.31 117.24 2w2l h LEU 99 Ca 0.02 -0.22 0.00 0.00 0.84 0.00 0.00 57.88 58.52 2w2l h LEU 99 Cb 1.01 -0.12 -0.01 0.00 0.37 0.00 0.00 40.66 41.91 2w2l h LEU 99 CO 0.09 0.55 0.12 0.78 -0.34 0.00 0.00 178.44 179.64 2w2l h ASN 100 N 0.32 0.22 0.27 1.25 -0.26 -1.27 -1.08 115.58 115.02 2w2l h ASN 100 Ca 0.09 -0.01 0.00 0.00 -0.56 0.00 0.00 56.30 55.83 2w2l h ASN 100 Cb 0.27 -0.06 0.00 0.00 -1.06 0.00 0.00 38.32 37.47 2w2l h ASN 100 CO -0.00 0.17 0.00 -0.62 -1.06 0.00 0.00 177.43 175.92 2w2l n GLU 101 N -4.50 0.09 -0.34 0.81 -0.58 -0.41 -2.26 120.64 113.45 2w2l n GLU 101 Ca -0.00 0.47 0.09 0.00 -0.42 0.00 0.00 57.16 57.30 2w2l n GLU 101 Cb 0.08 -1.72 0.22 0.00 -0.57 0.00 0.00 31.44 29.45 2w2l n GLU 101 CO 0.00 0.00 0.00 0.54 -0.48 0.00 0.00 177.13 177.19 2w2l n ARG 102 N -1.90 2.34 -0.97 3.49 1.74 -0.42 -4.96 116.66 115.99 2w2l n ARG 102 Ca 0.01 -2.78 0.00 0.00 -0.77 0.00 0.00 57.85 54.31 2w2l n ARG 102 Cb 0.10 -1.73 0.00 0.00 -1.02 0.00 0.00 32.46 29.80 2w2l n ARG 102 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2w2l n GLY 103 N -0.84 0.42 3.64 -0.13 0.00 -0.96 -4.98 105.19 102.34 2w2l n GLY 103 Ca 0.20 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.79 2w2l n GLY 103 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2w2l s VAL 104 N -1.98 4.61 0.33 1.61 1.01 -1.19 -4.73 120.40 120.06 2w2l s VAL 104 Ca 0.00 1.68 -0.28 0.00 0.00 0.00 0.00 61.98 63.38 2w2l s VAL 104 Cb 0.00 -4.33 -0.09 0.00 0.00 0.00 0.00 36.38 31.96 2w2l s VAL 104 CO 0.00 -0.36 1.15 0.00 0.00 0.00 0.00 175.10 175.89 2w2l s ALA 105 N 3.39 3.34 0.04 5.51 0.00 0.75 -4.11 121.76 130.68 2w2l s ALA 105 Ca 0.42 0.96 0.09 0.00 0.00 0.00 0.00 51.96 53.43 2w2l s ALA 105 Cb -0.13 -3.36 -0.03 0.00 0.00 0.00 0.00 23.12 19.60 2w2l s ALA 105 CO 0.13 -0.33 -0.24 0.12 0.00 0.00 0.00 175.76 175.44 2w2l s PHE 106 N -1.26 2.39 -0.03 0.00 5.36 -1.26 -0.04 117.98 123.14 2w2l s PHE 106 Ca 0.49 -0.37 -0.01 0.00 -0.96 0.00 0.00 56.93 56.09 2w2l s PHE 106 Cb -0.32 -1.41 0.03 0.00 -0.34 0.00 0.00 43.02 40.98 2w2l s PHE 106 CO 0.41 0.16 0.04 0.00 -1.46 0.00 0.00 175.22 174.38 2w2l s ALA 107 N -0.84 0.10 0.00 11.12 0.00 -0.69 -1.68 121.76 129.77 2w2l s ALA 107 Ca 0.13 0.30 0.00 0.00 0.00 0.00 0.00 51.96 52.39 2w2l s ALA 107 Cb -0.10 -0.34 0.00 0.00 0.00 0.00 0.00 23.12 22.68 2w2l s ALA 107 CO 0.03 -0.20 0.00 0.27 0.00 0.00 0.00 175.76 175.86 2w2l n ASN 108 N 4.44 0.03 -1.97 0.00 6.94 -0.95 -0.30 115.26 123.45 2w2l n ASN 108 Ca -0.22 -0.33 -0.24 0.00 -0.02 0.00 0.00 54.58 53.77 2w2l n ASN 108 Cb 0.50 0.00 0.06 0.00 -2.36 0.00 0.00 39.78 37.98 2w2l n ASN 108 CO 0.00 0.00 0.00 -1.20 -1.03 0.00 0.00 177.26 175.03 2w2l n SER 109 N -0.97 5.29 -4.64 0.53 7.64 -0.28 -4.69 113.62 116.51 2w2l n SER 109 Ca 0.00 -3.77 -0.46 0.00 1.01 0.00 0.00 58.87 55.65 2w2l n SER 109 Cb 0.00 -0.56 -0.03 0.00 -1.01 0.00 0.00 64.21 62.61 2w2l n SER 109 CO 0.00 0.00 0.00 -1.14 -3.01 0.00 0.00 175.04 170.89 2w2l n ARG 110 N -0.83 1.77 0.00 1.43 0.63 -1.26 -2.17 116.66 116.23 2w2l n ARG 110 Ca 0.47 0.63 0.00 0.00 -0.92 0.00 0.00 57.85 58.04 2w2l n ARG 110 Cb 0.89 -2.27 0.00 0.00 0.45 0.00 0.00 32.46 31.54 2w2l n ARG 110 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2w2l n GLY 111 N 2.33 3.12 0.32 5.14 0.00 -1.26 -4.92 105.19 109.91 2w2l n GLY 111 Ca 0.14 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.31 2w2l n GLY 111 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2w2l h ALA 112 N 0.00 1.56 -0.77 4.61 0.00 -1.79 -1.33 119.26 121.54 2w2l h ALA 112 Ca 0.00 0.16 -0.39 0.00 0.00 0.00 0.00 54.91 54.68 2w2l h ALA 112 Cb 0.00 0.13 -0.23 0.00 0.00 0.00 0.00 17.79 17.69 2w2l h ALA 112 CO 0.00 -0.36 0.39 0.41 0.00 0.00 0.00 179.25 179.69 2w2l n GLY 113 N -1.33 4.59 0.04 0.00 0.00 -1.26 -4.48 105.19 102.75 2w2l n GLY 113 Ca 0.24 -1.13 -0.12 0.00 0.00 0.00 0.00 46.02 45.01 2w2l n GLY 113 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2w2l h ASP 114 N 1.09 0.01 -0.01 1.61 3.32 -1.64 -0.85 116.42 119.94 2w2l h ASP 114 Ca 0.48 -0.02 0.02 0.00 0.02 0.00 0.00 57.03 57.53 2w2l h ASP 114 Cb 2.45 -0.00 -0.03 0.00 0.22 0.00 0.00 39.33 41.96 2w2l h ASP 114 CO 0.85 0.03 -0.14 0.74 -1.72 0.00 0.00 179.24 179.00 2w2l h THR 115 N -0.01 0.65 -0.04 0.35 2.02 -1.84 -1.66 112.91 112.38 2w2l h THR 115 Ca 0.00 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.19 2w2l h THR 115 Cb 0.02 0.65 -0.00 0.00 -1.74 0.00 0.00 68.15 67.08 2w2l h THR 115 CO -0.00 0.00 0.01 0.00 0.37 0.00 0.00 175.52 175.90 2w2l h ALA 116 N 0.73 0.04 -0.10 6.16 0.00 -1.79 -2.44 119.26 121.85 2w2l h ALA 116 Ca 0.05 0.00 -0.21 0.00 0.00 0.00 0.00 54.91 54.75 2w2l h ALA 116 Cb 0.29 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.09 2w2l h ALA 116 CO -0.14 -0.47 -0.79 1.15 0.00 0.00 0.00 179.25 178.99 2w2l h THR 117 N 0.03 1.33 -0.71 0.00 2.02 -0.90 -1.76 112.91 112.92 2w2l h THR 117 Ca 0.01 -2.10 -0.02 0.00 0.77 0.00 0.00 66.41 65.08 2w2l h THR 117 Cb 0.01 2.09 -0.03 0.00 -1.74 0.00 0.00 68.15 68.48 2w2l h THR 117 CO -0.02 0.65 0.37 0.77 0.37 0.00 0.00 175.52 177.66 2w2l h SER 118 N 0.40 0.90 -0.27 4.18 4.64 -1.29 -2.19 113.55 119.93 2w2l h SER 118 Ca -0.05 -0.11 -0.06 0.00 -0.47 0.00 0.00 61.79 61.10 2w2l h SER 118 Cb 1.40 -0.23 -0.02 0.00 -0.31 0.00 0.00 62.40 63.24 2w2l h SER 118 CO 0.15 0.76 -0.01 0.44 -0.87 0.00 0.00 176.83 177.30 2w2l h ASP 119 N 0.98 0.57 0.92 4.97 3.32 -1.21 -1.15 116.42 124.82 2w2l h ASP 119 Ca 0.25 -0.12 -0.08 0.00 0.02 0.00 0.00 57.03 57.09 2w2l h ASP 119 Cb 0.07 -0.15 -0.01 0.00 0.22 0.00 0.00 39.33 39.46 2w2l h ASP 119 CO -0.04 0.65 -0.40 0.25 -1.72 0.00 0.00 179.24 177.98 2w2l h LEU 120 N 0.57 0.00 0.17 1.55 7.12 -0.99 -1.52 115.31 122.21 2w2l h LEU 120 Ca 0.12 0.00 -0.27 0.00 0.13 0.00 0.00 57.88 57.86 2w2l h LEU 120 Cb 0.38 0.00 0.03 0.00 -0.53 0.00 0.00 40.66 40.54 2w2l h LEU 120 CO 0.01 0.40 -1.14 0.00 -0.13 0.00 0.00 178.44 177.58 2w2l h ALA 121 N 1.60 -0.10 -0.42 1.25 0.00 -0.66 -1.97 119.26 118.97 2w2l h ALA 121 Ca -0.00 -0.77 0.07 0.00 0.00 0.00 0.00 54.91 54.21 2w2l h ALA 121 Cb 0.97 0.13 -0.06 0.00 0.00 0.00 0.00 17.79 18.82 2w2l h ALA 121 CO 0.05 0.55 0.05 1.25 0.00 0.00 0.00 179.25 181.15 2w2l h LEU 122 N -0.03 -0.08 -0.65 0.00 5.85 -1.19 0.48 115.31 119.69 2w2l h LEU 122 Ca -0.19 0.08 0.14 0.00 0.84 0.00 0.00 57.88 58.75 2w2l h LEU 122 Cb 1.88 0.13 -0.10 0.00 0.37 0.00 0.00 40.66 42.94 2w2l h LEU 122 CO 0.22 -0.00 0.08 0.22 -0.34 0.00 0.00 178.44 178.61 2w2l h TYR 123 N 0.16 0.10 -0.13 1.25 3.20 -1.21 0.16 116.97 120.50 2w2l h TYR 123 Ca 0.21 0.04 -0.14 0.00 3.14 0.00 0.00 58.73 61.98 2w2l h TYR 123 Cb 0.28 0.06 -0.01 0.00 1.54 0.00 0.00 36.73 38.59 2w2l h TYR 123 CO -0.24 -0.12 -0.54 -0.07 -1.64 0.00 0.00 178.16 175.56 2w2l h LEU 124 N 0.19 0.43 -0.05 2.82 3.38 -0.27 0.12 115.31 121.93 2w2l h LEU 124 Ca 0.35 -0.22 -0.00 0.00 0.09 0.00 0.00 57.88 58.09 2w2l h LEU 124 Cb 0.57 -0.12 -0.00 0.00 0.09 0.00 0.00 40.66 41.20 2w2l h LEU 124 CO -0.50 0.88 0.02 0.40 0.09 0.00 0.00 178.44 179.34 2w2l h ILE 125 N 0.30 1.13 -0.78 1.22 2.04 0.12 -0.67 117.51 120.87 2w2l h ILE 125 Ca 0.01 -0.39 0.14 0.00 1.00 0.00 0.00 64.86 65.62 2w2l h ILE 125 Cb 1.04 1.29 -0.09 0.00 -0.74 0.00 0.00 36.82 38.32 2w2l h ILE 125 CO 0.09 0.11 0.35 -0.07 0.00 0.00 0.00 178.15 178.63 2w2l h LEU 126 N -0.07 0.39 -1.17 1.44 3.38 -0.57 -0.81 115.31 117.90 2w2l h LEU 126 Ca 0.02 0.10 -0.05 0.00 0.09 0.00 0.00 57.88 58.03 2w2l h LEU 126 Cb 0.15 0.05 -0.02 0.00 0.09 0.00 0.00 40.66 40.93 2w2l h LEU 126 CO -0.00 0.16 0.04 -1.28 0.09 0.00 0.00 178.44 177.45 2w2l h SER 127 N 0.52 0.58 0.86 -0.43 0.87 -0.14 -2.11 113.55 113.70 2w2l h SER 127 Ca 0.42 -0.11 0.00 0.00 -1.23 0.00 0.00 61.79 60.87 2w2l h SER 127 Cb 0.60 -0.15 0.00 0.00 -0.44 0.00 0.00 62.40 62.41 2w2l h SER 127 CO -0.37 0.62 -0.92 1.33 -0.53 0.00 0.00 176.83 176.96 2w2l n VAL 128 N -4.28 0.47 0.11 2.23 0.24 -0.34 -1.21 118.33 115.56 2w2l n VAL 128 Ca 0.02 -0.43 -0.03 0.00 -2.04 0.00 0.00 64.34 61.87 2w2l n VAL 128 Cb 0.24 -0.19 0.06 0.00 -1.47 0.00 0.00 33.84 32.47 2w2l n VAL 128 CO 0.00 0.00 0.00 -0.26 -2.14 0.00 0.00 176.83 174.43 2w2l h PHE 129 N 0.00 0.00 -0.01 6.34 0.04 -1.00 -3.39 116.94 118.92 2w2l h PHE 129 Ca 0.00 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.77 2w2l h PHE 129 Cb 0.89 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.04 2w2l h PHE 129 CO 0.00 0.74 -0.08 0.54 -0.60 0.00 0.00 178.31 178.90 2w2l n ARG 130 N -3.55 1.26 -3.88 1.51 5.12 -0.81 -0.65 116.66 115.65 2w2l n ARG 130 Ca -0.00 -0.74 -0.26 0.00 -1.93 0.00 0.00 57.85 54.92 2w2l n ARG 130 Cb 0.74 -1.08 0.01 0.00 -1.16 0.00 0.00 32.46 30.97 2w2l n ARG 130 CO 0.00 0.00 0.00 1.28 -1.93 0.00 0.00 177.63 176.98 2w2l n LEU 131 N 0.05 -2.55 0.09 0.55 4.77 -0.35 -4.86 117.00 114.70 2w2l n LEU 131 Ca 0.04 -0.89 -0.07 0.00 -0.03 0.00 0.00 56.01 55.06 2w2l n LEU 131 Cb 0.18 -2.44 0.05 0.00 -2.33 0.00 0.00 43.42 38.88 2w2l n LEU 131 CO 0.07 0.42 0.35 0.00 -1.33 0.00 0.00 177.39 176.90 2w2l h ALA 132 N 0.88 0.66 -0.13 -1.18 0.00 -1.77 -2.26 119.26 115.46 2w2l h ALA 132 Ca -0.61 -0.65 0.01 0.00 0.00 0.00 0.00 54.91 53.67 2w2l h ALA 132 Cb 1.37 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 19.06 2w2l h ALA 132 CO 0.63 0.84 0.03 1.03 0.00 0.00 0.00 179.25 181.78 2w2l h SER 133 N 0.13 0.03 -0.28 0.00 0.87 -1.90 0.61 113.55 113.01 2w2l h SER 133 Ca -0.03 0.02 0.06 0.00 -1.23 0.00 0.00 61.79 60.61 2w2l h SER 133 Cb 1.33 0.02 -0.07 0.00 -0.44 0.00 0.00 62.40 63.25 2w2l h SER 133 CO 0.12 0.04 -0.15 0.22 -0.53 0.00 0.00 176.83 176.53 2w2l h TYR 134 N 0.10 -0.36 -0.89 2.24 3.20 -1.67 -2.36 116.97 117.23 2w2l h TYR 134 Ca 0.06 0.03 0.02 0.00 3.14 0.00 0.00 58.73 61.98 2w2l h TYR 134 Cb 0.04 0.20 -0.05 0.00 1.54 0.00 0.00 36.73 38.46 2w2l h TYR 134 CO -0.11 -0.22 0.58 1.03 -1.64 0.00 0.00 178.16 177.80 2w2l h SER 135 N -0.11 0.98 -0.13 -2.11 0.87 -0.66 -1.51 113.55 110.88 2w2l h SER 135 Ca 0.15 -0.02 0.04 0.00 -1.23 0.00 0.00 61.79 60.73 2w2l h SER 135 Cb 0.33 -0.23 -0.04 0.00 -0.44 0.00 0.00 62.40 62.02 2w2l h SER 135 CO -0.35 0.69 -0.11 -0.33 -0.53 0.00 0.00 176.83 176.20 2w2l h GLU 136 N 1.16 -0.12 -0.85 2.24 5.08 0.48 -0.39 114.58 122.17 2w2l h GLU 136 Ca 0.34 0.01 0.03 0.00 -1.00 0.00 0.00 59.36 58.74 2w2l h GLU 136 Cb -0.06 0.03 -0.05 0.00 0.50 0.00 0.00 28.75 29.17 2w2l h GLU 136 CO -0.10 -0.08 0.55 0.00 -1.00 0.00 0.00 179.01 178.38 2w2l h ARG 137 N -0.13 1.05 -0.57 2.33 3.08 -1.17 -1.92 114.38 117.05 2w2l h ARG 137 Ca 0.09 -0.06 0.05 0.00 0.07 0.00 0.00 59.98 60.12 2w2l h ARG 137 Cb 0.25 -0.24 -0.05 0.00 0.08 0.00 0.00 29.97 30.02 2w2l h ARG 137 CO -0.21 0.69 0.30 0.00 -1.07 0.00 0.00 179.97 179.69 2w2l h ALA 138 N 1.35 0.74 -0.72 0.04 0.00 -1.09 -2.55 119.26 117.03 2w2l h ALA 138 Ca 0.33 0.02 0.01 0.00 0.00 0.00 0.00 54.91 55.27 2w2l h ALA 138 Cb -0.02 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 17.64 2w2l h ALA 138 CO -0.11 -0.03 0.47 0.00 0.00 0.00 0.00 179.25 179.58 2w2l h ALA 139 N 1.30 1.50 -0.00 0.00 0.00 -0.30 -3.15 119.26 118.61 2w2l h ALA 139 Ca 0.25 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.11 2w2l h ALA 139 Cb 0.15 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 17.65 2w2l h ALA 139 CO -0.16 0.46 -0.09 0.54 0.00 0.00 0.00 179.25 180.00 2w2l n ARG 140 N -4.43 0.81 0.20 0.00 1.74 -0.93 -1.76 116.66 112.29 2w2l n ARG 140 Ca 0.08 -0.27 0.04 0.00 -0.77 0.00 0.00 57.85 56.92 2w2l n ARG 140 Cb 0.04 -1.49 0.42 0.00 -1.02 0.00 0.00 32.46 30.41 2w2l n ARG 140 CO 0.00 0.00 0.00 1.79 -1.52 0.00 0.00 177.63 177.90 2w2l h THR 141 N 0.67 1.20 -1.21 0.55 1.35 -1.48 -3.46 112.91 110.52 2w2l h THR 141 Ca 0.00 -1.04 -0.43 0.00 -0.55 0.00 0.00 66.41 64.40 2w2l h THR 141 Cb 0.33 1.56 -0.15 0.00 -1.73 0.00 0.00 68.15 68.16 2w2l h THR 141 CO 0.00 0.29 -0.40 0.61 -0.25 0.00 0.00 175.52 175.77 2w2l n GLY 142 N -0.65 1.71 3.44 5.82 0.00 -0.72 -4.95 105.19 109.84 2w2l n GLY 142 Ca -0.02 -0.01 -0.41 0.00 0.00 0.00 0.00 46.02 45.58 2w2l n GLY 142 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2w2l s ASP 143 N -2.70 5.85 0.32 1.61 2.15 -1.26 -5.00 116.67 117.64 2w2l s ASP 143 Ca 0.00 -0.79 0.08 0.00 0.43 0.00 0.00 52.55 52.27 2w2l s ASP 143 Cb 0.00 -2.08 0.92 0.00 -0.30 0.00 0.00 42.92 41.46 2w2l s ASP 143 CO 0.00 -0.34 1.63 -0.65 -0.17 0.00 0.00 175.17 175.63 2w2l h PRO 144 N 8.48 0.17 -0.25 4.34 0.11 -1.96 -1.57 132.00 141.33 2w2l h PRO 144 Ca -0.28 -0.01 -0.06 0.00 0.11 0.00 0.00 66.00 65.76 2w2l h PRO 144 Cb 1.12 -0.04 -0.01 0.00 0.11 0.00 0.00 31.00 32.19 2w2l h PRO 144 CO 0.67 0.11 -0.07 0.93 -0.21 0.00 0.00 178.00 179.43 2w2l h GLU 145 N 0.17 0.48 -0.21 1.05 4.39 -2.00 -2.35 114.58 116.11 2w2l h GLU 145 Ca 0.65 -0.19 0.05 0.00 0.34 0.00 0.00 59.36 60.21 2w2l h GLU 145 Cb 1.45 -0.02 -0.06 0.00 -0.10 0.00 0.00 28.75 30.02 2w2l h GLU 145 CO -0.70 0.72 -0.15 1.15 -1.16 0.00 0.00 179.01 178.87 2w2l h THR 146 N 0.22 0.58 -0.64 1.13 2.02 -1.73 0.72 112.91 115.21 2w2l h THR 146 Ca 0.06 0.00 0.06 0.00 0.77 0.00 0.00 66.41 67.30 2w2l h THR 146 Cb 0.55 0.58 -0.09 0.00 -1.74 0.00 0.00 68.15 67.45 2w2l h THR 146 CO 0.03 0.00 -0.48 0.15 0.37 0.00 0.00 175.52 175.59 2w2l h PHE 147 N -0.14 -1.51 -0.70 3.16 3.57 -1.21 0.36 116.94 120.47 2w2l h PHE 147 Ca 0.12 0.09 -0.05 0.00 3.53 0.00 0.00 57.97 61.66 2w2l h PHE 147 Cb 0.33 0.74 -0.03 0.00 2.79 0.00 0.00 35.95 39.78 2w2l h PHE 147 CO -0.30 -0.34 0.23 -0.91 -2.23 0.00 0.00 178.31 174.75 2w2l h ASN 148 N -0.12 1.01 -0.69 0.41 2.35 -1.08 -0.02 115.58 117.43 2w2l h ASN 148 Ca 0.10 -0.20 -0.06 0.00 -0.55 0.00 0.00 56.30 55.59 2w2l h ASN 148 Cb 0.39 -0.26 -0.03 0.00 0.05 0.00 0.00 38.32 38.47 2w2l h ASN 148 CO -0.67 0.94 0.22 -0.09 -1.65 0.00 0.00 177.43 176.18 2w2l h ARG 149 N 1.02 1.09 0.10 0.81 2.43 -0.40 -1.65 114.38 117.79 2w2l h ARG 149 Ca 0.23 -0.23 -0.28 0.00 -0.81 0.00 0.00 59.98 58.89 2w2l h ARG 149 Cb 0.29 -0.16 0.02 0.00 -0.42 0.00 0.00 29.97 29.70 2w2l h ARG 149 CO -0.01 0.93 -1.19 0.28 -1.51 0.00 0.00 179.97 178.48 2w2l h VAL 150 N 1.05 1.35 -0.71 0.20 2.07 -0.84 0.46 116.25 119.83 2w2l h VAL 150 Ca 0.23 -2.58 0.12 0.00 0.82 0.00 0.00 66.70 65.29 2w2l h VAL 150 Cb 0.30 2.69 -0.13 0.00 -1.52 0.00 0.00 31.29 32.63 2w2l h VAL 150 CO -0.01 0.78 -0.31 -0.74 0.02 0.00 0.00 177.57 177.30 2w2l h HIS 151 N 0.22 -0.84 -0.36 1.57 -0.00 -0.89 0.74 115.15 115.59 2w2l h HIS 151 Ca -0.16 0.08 -0.15 0.00 -0.00 0.00 0.00 60.37 60.14 2w2l h HIS 151 Cb 1.86 0.47 -0.01 0.00 -0.00 0.00 0.00 27.41 29.74 2w2l h HIS 151 CO 0.09 -0.38 -0.38 -0.07 -0.00 0.00 0.00 177.93 177.20 2w2l h LEU 152 N -0.10 0.95 -1.01 0.26 3.38 -1.09 -3.19 115.31 114.52 2w2l h LEU 152 Ca 0.28 -0.47 -0.07 0.00 0.09 0.00 0.00 57.88 57.71 2w2l h LEU 152 Cb 0.56 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 41.03 2w2l h LEU 152 CO -0.76 1.23 -0.08 -0.08 0.09 0.00 0.00 178.44 178.84 2w2l h GLU 153 N 0.70 0.62 0.00 1.13 4.81 0.85 -2.09 114.58 120.59 2w2l h GLU 153 Ca 0.05 -0.18 -0.06 0.00 -0.13 0.00 0.00 59.36 59.05 2w2l h GLU 153 Cb 0.97 -0.07 -0.01 0.00 0.63 0.00 0.00 28.75 30.27 2w2l h GLU 153 CO 0.09 0.70 -0.29 0.82 -0.73 0.00 0.00 179.01 179.60 2w2l h ILE 154 N 0.58 1.16 -0.01 2.32 2.04 -0.93 -2.67 117.51 120.00 2w2l h ILE 154 Ca 0.11 -1.01 0.00 0.00 1.00 0.00 0.00 64.86 64.96 2w2l h ILE 154 Cb 0.48 1.55 -0.00 0.00 -0.74 0.00 0.00 36.82 38.11 2w2l h ILE 154 CO 0.03 0.28 0.02 1.23 0.00 0.00 0.00 178.15 179.71 2w2l h GLY 155 N 0.93 0.00 2.00 5.37 0.00 -1.36 -1.49 103.07 108.51 2w2l h GLY 155 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2w2l h GLY 155 CO 0.04 0.00 0.00 0.50 0.00 0.00 0.00 176.54 177.08 2w2l h LYS 156 N 0.00 0.00 0.00 4.80 1.57 -1.56 -3.39 116.57 117.98 2w2l h LYS 156 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2w2l h LYS 156 Cb 0.05 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.36 2w2l h LYS 156 CO -0.00 0.00 0.00 0.43 -0.57 0.00 0.00 179.45 179.31 2w2l n SER 157 N -2.39 0.00 -4.78 0.86 7.64 -0.96 -5.10 113.62 108.89 2w2l n SER 157 Ca 0.02 0.00 -0.36 0.00 1.01 0.00 0.00 58.87 59.55 2w2l n SER 157 Cb 0.27 0.00 -0.02 0.00 -1.01 0.00 0.00 64.21 63.45 2w2l n SER 157 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2w2l s ALA 158 N -0.11 2.89 -0.00 -0.43 0.00 -0.60 -4.95 121.76 118.56 2w2l s ALA 158 Ca 0.00 0.78 -0.07 0.00 0.00 0.00 0.00 51.96 52.67 2w2l s ALA 158 Cb 0.00 -3.32 0.00 0.00 0.00 0.00 0.00 23.12 19.80 2w2l s ALA 158 CO 0.00 -0.52 0.13 -1.01 0.00 0.00 0.00 175.76 174.36 2w2l s HIS 159 N -1.73 0.04 0.22 0.00 3.76 0.17 -4.99 115.29 112.76 2w2l s HIS 159 Ca 0.66 -0.11 -0.30 0.00 -0.15 0.00 0.00 55.06 55.16 2w2l s HIS 159 Cb -0.23 -0.05 -0.08 0.00 1.11 0.00 0.00 32.58 33.33 2w2l s HIS 159 CO 0.28 -0.27 1.14 -0.80 -0.85 0.00 0.00 174.74 174.24 2w2l s ASN 160 N -1.28 7.19 0.62 1.40 0.01 -1.26 -4.35 114.94 117.26 2w2l s ASN 160 Ca -0.14 2.22 0.31 0.00 -0.71 0.00 0.00 52.86 54.54 2w2l s ASN 160 Cb -0.07 -2.61 1.69 0.00 0.41 0.00 0.00 41.25 40.66 2w2l s ASN 160 CO 0.01 -0.26 2.03 -0.65 -1.51 0.00 0.00 177.10 176.73 2w2l h PRO 161 N 4.66 0.00 -6.68 -0.60 0.11 -1.91 -3.43 132.00 124.14 2w2l h PRO 161 Ca -0.45 0.00 -0.56 0.00 0.11 0.00 0.00 66.00 65.10 2w2l h PRO 161 Cb 1.21 0.00 0.09 0.00 0.11 0.00 0.00 31.00 32.41 2w2l h PRO 161 CO 0.71 0.00 0.72 -2.13 -0.21 0.00 0.00 178.00 177.09 2w2l n ARG 162 N -3.43 2.32 0.00 1.05 0.63 -1.23 -1.43 116.66 114.57 2w2l n ARG 162 Ca 0.01 0.82 0.00 0.00 -0.92 0.00 0.00 57.85 57.77 2w2l n ARG 162 Cb 0.39 -2.53 0.00 0.00 0.45 0.00 0.00 32.46 30.77 2w2l n ARG 162 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2w2l n GLY 163 N 2.07 1.97 3.90 5.14 0.00 0.20 -4.91 105.19 113.57 2w2l n GLY 163 Ca 0.10 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.83 2w2l n GLY 163 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2w2l s HIS 164 N -1.33 2.96 -0.22 1.61 3.76 -0.51 -4.62 115.29 116.94 2w2l s HIS 164 Ca 0.00 0.71 -0.08 0.00 -0.15 0.00 0.00 55.06 55.54 2w2l s HIS 164 Cb 0.00 -3.43 -0.04 0.00 1.11 0.00 0.00 32.58 30.22 2w2l s HIS 164 CO 0.00 -1.69 0.09 0.08 -0.85 0.00 0.00 174.74 172.36 2w2l s VAL 165 N -3.52 4.71 -0.33 -0.90 1.01 -1.26 0.27 120.40 120.38 2w2l s VAL 165 Ca 0.62 -0.05 -0.18 0.00 0.00 0.00 0.00 61.98 62.37 2w2l s VAL 165 Cb -0.11 -3.17 -0.01 0.00 0.00 0.00 0.00 36.38 33.09 2w2l s VAL 165 CO 0.48 0.38 0.52 -0.22 0.00 0.00 0.00 175.10 176.26 2w2l s LEU 166 N 1.04 4.26 -0.47 3.92 2.96 0.31 0.00 118.68 130.70 2w2l s LEU 166 Ca 0.05 0.12 -0.18 0.00 -0.22 0.00 0.00 54.13 53.90 2w2l s LEU 166 Cb -0.14 -2.61 0.05 0.00 0.50 0.00 0.00 46.19 43.99 2w2l s LEU 166 CO 0.03 -0.43 0.54 -0.83 -1.32 0.00 0.00 176.35 174.34 2w2l s GLY 167 N 1.71 1.85 -0.41 7.98 0.00 0.26 -1.92 107.32 116.79 2w2l s GLY 167 Ca 0.20 -1.71 -0.29 0.00 0.00 0.00 0.00 44.72 42.92 2w2l s GLY 167 CO 0.12 1.33 1.15 0.00 0.00 0.00 0.00 173.10 175.70 2w2l s ALA 168 N 2.35 3.27 -0.50 3.20 0.00 -0.08 -0.10 121.76 129.91 2w2l s ALA 168 Ca 0.13 -0.28 -0.20 0.00 0.00 0.00 0.00 51.96 51.61 2w2l s ALA 168 Cb -0.19 -3.82 0.05 0.00 0.00 0.00 0.00 23.12 19.16 2w2l s ALA 168 CO 0.12 -1.98 0.65 0.08 0.00 0.00 0.00 175.76 174.63 2w2l s VAL 169 N 4.25 4.83 0.00 0.00 1.01 -0.38 -1.30 120.40 128.80 2w2l s VAL 169 Ca 0.49 -0.33 0.00 0.00 0.00 0.00 0.00 61.98 62.14 2w2l s VAL 169 Cb -0.10 -4.30 0.00 0.00 0.00 0.00 0.00 36.38 31.98 2w2l s VAL 169 CO 0.26 -0.80 0.00 0.61 0.00 0.00 0.00 175.10 175.17 2w2l n GLY 170 N 5.15 -1.21 2.55 4.51 0.00 -0.41 -1.57 105.19 114.21 2w2l n GLY 170 Ca -0.05 -1.22 -0.17 0.00 0.00 0.00 0.00 46.02 44.58 2w2l n GLY 170 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2w2l n LEU 171 N -0.45 2.39 0.00 0.99 7.94 -1.26 -4.72 117.00 121.89 2w2l n LEU 171 Ca 0.00 -4.55 0.00 0.00 -1.11 0.00 0.00 56.01 50.35 2w2l n LEU 171 Cb 0.00 0.18 0.00 0.00 0.53 0.00 0.00 43.42 44.13 2w2l n LEU 171 CO 0.00 1.96 0.00 0.61 -1.11 0.00 0.00 177.39 178.85 2w2l n GLY 172 N -0.11 -0.69 0.36 -3.96 0.00 -1.26 -4.69 105.19 94.84 2w2l n GLY 172 Ca 0.22 -1.66 0.01 0.00 0.00 0.00 0.00 46.02 44.58 2w2l n GLY 172 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2w2l h ALA 173 N -1.92 1.45 -0.06 4.61 0.00 -1.99 -1.46 119.26 119.89 2w2l h ALA 173 Ca 0.00 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 54.83 2w2l h ALA 173 Cb 0.00 -0.31 -0.00 0.00 0.00 0.00 0.00 17.79 17.48 2w2l h ALA 173 CO 0.00 0.49 -0.09 0.82 0.00 0.00 0.00 179.25 180.47 2w2l h ILE 174 N 1.06 1.40 -1.00 0.00 2.04 -1.93 -3.07 117.51 116.01 2w2l h ILE 174 Ca 0.31 -1.35 0.03 0.00 1.00 0.00 0.00 64.86 64.85 2w2l h ILE 174 Cb -0.07 2.16 -0.06 0.00 -0.74 0.00 0.00 36.82 38.12 2w2l h ILE 174 CO -0.08 0.37 0.66 -0.61 0.00 0.00 0.00 178.15 178.49 2w2l h GLN 175 N -0.31 1.25 -0.56 2.37 5.75 -1.85 -0.55 115.11 121.20 2w2l h GLN 175 Ca 0.01 -0.08 0.02 0.00 -0.15 0.00 0.00 58.65 58.45 2w2l h GLN 175 Cb 0.65 -0.28 -0.03 0.00 1.07 0.00 0.00 27.48 28.89 2w2l h GLN 175 CO 0.02 0.83 0.37 0.87 -2.65 0.00 0.00 178.83 178.27 2w2l h LYS 176 N 1.28 0.66 -0.01 1.69 1.57 -1.27 1.24 116.57 121.74 2w2l h LYS 176 Ca 0.40 -0.04 -0.19 0.00 -1.87 0.00 0.00 60.65 58.95 2w2l h LYS 176 Cb -0.02 -0.15 -0.01 0.00 0.08 0.00 0.00 32.23 32.13 2w2l h LYS 176 CO -0.12 0.44 -0.83 0.93 -0.57 0.00 0.00 179.45 179.30 2w2l h GLU 177 N 0.68 0.18 -0.15 3.15 4.39 -1.25 -1.25 114.58 120.33 2w2l h GLU 177 Ca 0.22 -0.18 -0.03 0.00 0.34 0.00 0.00 59.36 59.70 2w2l h GLU 177 Cb 0.04 0.05 -0.00 0.00 -0.10 0.00 0.00 28.75 28.73 2w2l h GLU 177 CO -0.06 0.91 -0.04 0.82 -1.16 0.00 0.00 179.01 179.48 2w2l h ILE 178 N 0.10 1.29 0.13 3.13 2.04 0.66 -2.12 117.51 122.75 2w2l h ILE 178 Ca -0.03 -1.00 0.00 0.00 1.00 0.00 0.00 64.86 64.83 2w2l h ILE 178 Cb 1.44 1.66 -0.01 0.00 -0.74 0.00 0.00 36.82 39.16 2w2l h ILE 178 CO 0.12 0.29 -0.10 0.00 0.00 0.00 0.00 178.15 178.46 2w2l h ALA 179 N 0.70 -0.22 -0.63 1.87 0.00 0.14 0.38 119.26 121.50 2w2l h ALA 179 Ca 0.04 -0.04 0.13 0.00 0.00 0.00 0.00 54.91 55.04 2w2l h ALA 179 Cb 0.47 0.14 -0.11 0.00 0.00 0.00 0.00 17.79 18.29 2w2l h ALA 179 CO 0.02 -0.64 0.01 -0.09 0.00 0.00 0.00 179.25 178.55 2w2l h ARG 180 N -0.24 0.12 -0.35 0.00 2.43 -1.19 1.01 114.38 116.15 2w2l h ARG 180 Ca -0.00 -0.01 -0.13 0.00 -0.81 0.00 0.00 59.98 59.03 2w2l h ARG 180 Cb 0.22 -0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 29.73 2w2l h ARG 180 CO -0.01 0.08 -0.29 0.87 -1.51 0.00 0.00 179.97 179.10 2w2l h LYS 181 N 0.12 0.75 0.07 0.20 1.57 -1.23 -1.62 116.57 116.42 2w2l h LYS 181 Ca 0.33 -0.34 -0.22 0.00 -1.87 0.00 0.00 60.65 58.56 2w2l h LYS 181 Cb 0.54 -0.02 0.02 0.00 0.08 0.00 0.00 32.23 32.85 2w2l h LYS 181 CO -0.54 0.95 -0.89 0.00 -0.57 0.00 0.00 179.45 178.40 2w2l h ALA 182 N 1.03 0.02 0.19 3.86 0.00 0.76 -1.14 119.26 123.97 2w2l h ALA 182 Ca 0.08 -0.67 -0.01 0.00 0.00 0.00 0.00 54.91 54.30 2w2l h ALA 182 Cb 0.82 0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.68 2w2l h ALA 182 CO 0.07 0.49 -0.09 0.28 0.00 0.00 0.00 179.25 180.00 2w2l h VAL 183 N 0.01 0.00 0.00 0.00 2.07 0.95 -1.59 116.25 117.69 2w2l h VAL 183 Ca -0.13 -0.19 -0.07 0.00 0.82 0.00 0.00 66.70 67.14 2w2l h VAL 183 Cb 1.61 0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 31.37 2w2l h VAL 183 CO 0.17 0.00 -0.48 0.45 0.02 0.00 0.00 177.57 177.73 2w2l h HIS 184 N -0.45 0.00 0.10 1.57 3.86 -1.48 -1.01 115.15 117.74 2w2l h HIS 184 Ca -0.03 0.00 -0.00 0.00 -1.16 0.00 0.00 60.37 59.18 2w2l h HIS 184 Cb 0.20 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.67 2w2l h HIS 184 CO 0.07 0.29 -0.05 0.78 0.86 0.00 0.00 177.93 179.89 2w2l h GLY 185 N 3.74 -0.14 1.38 2.45 0.00 -1.26 -3.40 103.07 105.84 2w2l h GLY 185 Ca -0.02 0.05 0.00 0.00 0.00 0.00 0.00 47.33 47.36 2w2l h GLY 185 CO 0.04 -0.05 -0.51 1.41 0.00 0.00 0.00 176.54 177.43 2w2l h LEU 186 N -0.28 0.00 0.15 3.11 3.38 -0.90 -3.48 115.31 117.29 2w2l h LEU 186 Ca -0.01 -0.11 -0.03 0.00 0.09 0.00 0.00 57.88 57.82 2w2l h LEU 186 Cb 0.10 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.85 2w2l h LEU 186 CO 0.02 0.06 -0.03 0.61 0.09 0.00 0.00 178.44 179.19 2w2l n GLY 187 N 1.28 0.36 3.88 0.83 0.00 -0.38 -3.55 105.19 107.61 2w2l n GLY 187 Ca 0.03 -0.89 -0.30 0.00 0.00 0.00 0.00 46.02 44.86 2w2l n GLY 187 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2w2l s MET 188 N -3.50 2.99 0.17 1.61 -1.94 -0.67 0.61 119.30 118.58 2w2l s MET 188 Ca 0.00 0.51 0.05 0.00 -1.71 0.00 0.00 55.69 54.54 2w2l s MET 188 Cb 0.00 -2.03 -0.04 0.00 2.01 0.00 0.00 34.83 34.77 2w2l s MET 188 CO 0.00 -0.95 0.15 0.15 -0.01 0.00 0.00 175.02 174.35 2w2l s LYS 189 N -5.33 2.93 -0.14 2.03 1.02 0.14 -4.34 119.74 116.05 2w2l s LYS 189 Ca 0.58 -0.87 0.00 0.00 0.02 0.00 0.00 55.97 55.70 2w2l s LYS 189 Cb -0.11 -2.65 0.02 0.00 -0.52 0.00 0.00 37.83 34.57 2w2l s LYS 189 CO 0.52 0.48 -0.12 -1.17 -0.92 0.00 0.00 175.35 174.14 2w2l s LEU 190 N -3.15 1.58 0.10 3.17 2.96 -1.26 0.11 118.68 122.20 2w2l s LEU 190 Ca 0.31 -0.47 0.07 0.00 -0.22 0.00 0.00 54.13 53.82 2w2l s LEU 190 Cb -0.10 -1.09 -0.04 0.00 0.50 0.00 0.00 46.19 45.47 2w2l s LEU 190 CO 0.24 -0.08 -0.09 0.68 -1.32 0.00 0.00 176.35 175.78 2w2l s VAL 191 N 1.55 3.46 0.07 1.68 -7.23 -0.81 -2.23 120.40 116.89 2w2l s VAL 191 Ca 0.05 -1.23 -0.01 0.00 -1.81 0.00 0.00 61.98 58.97 2w2l s VAL 191 Cb -0.13 -2.63 -0.04 0.00 0.56 0.00 0.00 36.38 34.15 2w2l s VAL 191 CO -0.10 0.11 0.00 -0.72 -0.31 0.00 0.00 175.10 174.08 2w2l s TYR 192 N -1.23 0.58 -0.12 2.82 -0.85 -0.20 -0.90 117.35 117.45 2w2l s TYR 192 Ca 0.22 -1.08 -0.04 0.00 -0.52 0.00 0.00 57.07 55.65 2w2l s TYR 192 Cb -0.11 -0.39 0.05 0.00 0.38 0.00 0.00 41.96 41.89 2w2l s TYR 192 CO 0.14 -0.42 0.10 -0.47 -1.52 0.00 0.00 175.55 173.38 2w2l s TYR 193 N -3.95 0.06 -0.11 -3.49 5.04 -0.42 -0.66 117.35 113.82 2w2l s TYR 193 Ca 0.11 0.02 -0.09 0.00 -2.44 0.00 0.00 57.07 54.66 2w2l s TYR 193 Cb 0.08 -0.55 0.03 0.00 0.35 0.00 0.00 41.96 41.87 2w2l s TYR 193 CO -0.07 -0.40 0.28 0.34 -1.34 0.00 0.00 175.55 174.36 2w2l s ASP 194 N 2.19 -0.30 0.57 4.32 3.68 -1.26 -1.29 116.67 124.58 2w2l s ASP 194 Ca 0.04 0.57 0.27 0.00 2.13 0.00 0.00 52.55 55.56 2w2l s ASP 194 Cb -0.14 0.57 1.58 0.00 -1.45 0.00 0.00 42.92 43.47 2w2l s ASP 194 CO -0.07 -0.11 2.08 -0.37 0.13 0.00 0.00 175.17 176.83 2w2l h VAL 195 N 4.81 0.55 -3.93 1.11 -1.51 -2.00 -3.39 116.25 111.88 2w2l h VAL 195 Ca -0.27 0.00 -0.68 0.00 -1.23 0.00 0.00 66.70 64.51 2w2l h VAL 195 Cb 1.19 0.82 -0.22 0.00 -2.13 0.00 0.00 31.29 30.96 2w2l h VAL 195 CO 0.33 0.00 -0.78 0.00 -1.23 0.00 0.00 177.57 175.90 2w2l s ALA 196 N -4.73 2.69 0.82 5.19 0.00 -1.26 -5.13 121.76 119.34 2w2l s ALA 196 Ca -0.05 -1.10 -0.11 0.00 0.00 0.00 0.00 51.96 50.70 2w2l s ALA 196 Cb 0.16 -0.87 0.08 0.00 0.00 0.00 0.00 23.12 22.49 2w2l s ALA 196 CO 0.58 0.58 1.09 -1.25 0.00 0.00 0.00 175.76 176.76 2w2l s PRO 197 N -1.24 1.88 0.11 0.00 0.04 -1.26 -4.98 135.00 129.56 2w2l s PRO 197 Ca 0.14 1.03 0.06 0.00 0.04 0.00 0.00 61.00 62.28 2w2l s PRO 197 Cb -0.11 -1.86 -0.04 0.00 0.04 0.00 0.00 34.50 32.53 2w2l s PRO 197 CO 0.04 -1.87 -0.05 0.00 0.04 0.00 0.00 177.00 175.17 2w2l s ALA 198 N -2.92 3.12 0.94 8.56 0.00 -1.26 -5.12 121.76 125.08 2w2l s ALA 198 Ca 0.62 -1.21 -0.11 0.00 0.00 0.00 0.00 51.96 51.25 2w2l s ALA 198 Cb -0.17 -1.02 0.15 0.00 0.00 0.00 0.00 23.12 22.08 2w2l s ALA 198 CO 0.56 0.65 1.09 0.16 0.00 0.00 0.00 175.76 178.22 2w2l s ASP 199 N -2.35 3.00 0.00 0.00 1.47 -1.26 -4.67 116.67 112.87 2w2l s ASP 199 Ca 0.24 1.66 -0.00 0.00 1.18 0.00 0.00 52.55 55.63 2w2l s ASP 199 Cb -0.11 -2.30 -0.00 0.00 -0.34 0.00 0.00 42.92 40.16 2w2l s ASP 199 CO 0.16 -2.96 0.95 0.00 0.68 0.00 0.00 175.17 174.00 2w2l n ALA 200 N -4.11 -0.01 -0.31 2.11 0.00 -1.26 -1.35 120.51 115.58 2w2l n ALA 200 Ca 0.07 0.01 0.24 0.00 0.00 0.00 0.00 53.44 53.77 2w2l n ALA 200 Cb 0.54 0.46 0.45 0.00 0.00 0.00 0.00 19.45 20.90 2w2l n ALA 200 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2w2l n GLU 201 N -2.98 -0.06 0.23 0.00 1.02 -1.26 -0.56 120.64 117.02 2w2l n GLU 201 Ca 0.00 1.33 -0.10 0.00 -0.02 0.00 0.00 57.16 58.37 2w2l n GLU 201 Cb 0.00 -2.28 -0.05 0.00 -0.02 0.00 0.00 31.44 29.09 2w2l n GLU 201 CO 0.00 0.00 0.00 1.15 1.18 0.00 0.00 177.13 179.46 2w2l h THR 202 N 0.00 0.07 -0.41 2.62 2.02 -1.83 -2.97 112.91 112.42 2w2l h THR 202 Ca 0.71 -0.55 -0.03 0.00 0.77 0.00 0.00 66.41 67.32 2w2l h THR 202 Cb 1.75 0.11 -0.02 0.00 -1.74 0.00 0.00 68.15 68.24 2w2l h THR 202 CO -0.78 0.02 0.14 -0.33 0.37 0.00 0.00 175.52 174.93 2w2l h GLU 203 N -1.15 0.58 -0.32 6.66 5.08 0.18 0.05 114.58 125.67 2w2l h GLU 203 Ca -0.07 -0.08 -0.15 0.00 -1.00 0.00 0.00 59.36 58.06 2w2l h GLU 203 Cb 0.51 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.65 2w2l h GLU 203 CO 0.11 0.51 -0.41 -0.22 -1.00 0.00 0.00 179.01 177.99 2w2l h LYS 204 N 0.58 0.80 -0.15 2.33 1.63 -0.99 0.19 116.57 120.95 2w2l h LYS 204 Ca 0.14 -0.43 -0.02 0.00 -0.85 0.00 0.00 60.65 59.49 2w2l h LYS 204 Cb 0.16 0.02 -0.01 0.00 -0.60 0.00 0.00 32.23 31.80 2w2l h LYS 204 CO -0.01 1.06 0.01 0.00 -3.45 0.00 0.00 179.45 177.06 2w2l h ALA 205 N 0.88 0.20 -0.12 5.00 0.00 -1.02 -3.22 119.26 120.98 2w2l h ALA 205 Ca 0.05 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.78 2w2l h ALA 205 Cb 0.98 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.71 2w2l h ALA 205 CO 0.09 -0.12 0.00 1.28 0.00 0.00 0.00 179.25 180.51 2w2l n LEU 206 N -4.77 1.83 -4.08 0.00 4.77 -0.13 -4.92 117.00 109.70 2w2l n LEU 206 Ca -0.05 -0.71 -0.33 0.00 -0.03 0.00 0.00 56.01 54.89 2w2l n LEU 206 Cb 0.20 -0.07 -0.00 0.00 -2.33 0.00 0.00 43.42 41.22 2w2l n LEU 206 CO 0.36 0.35 0.03 0.61 -1.33 0.00 0.00 177.39 177.41 2w2l n GLY 207 N 1.19 -0.46 3.72 -0.72 0.00 -0.18 -4.70 105.19 104.04 2w2l n GLY 207 Ca 0.17 0.16 -0.42 0.00 0.00 0.00 0.00 46.02 45.94 2w2l n GLY 207 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2w2l s ALA 208 N -3.31 3.30 -0.26 4.61 0.00 0.48 -4.58 121.76 121.99 2w2l s ALA 208 Ca 0.69 0.71 0.03 0.00 0.00 0.00 0.00 51.96 53.39 2w2l s ALA 208 Cb -0.36 -3.36 0.06 0.00 0.00 0.00 0.00 23.12 19.45 2w2l s ALA 208 CO 0.88 -0.25 -0.10 -2.00 0.00 0.00 0.00 175.76 174.30 2w2l s GLU 209 N 0.49 2.11 0.15 0.00 2.12 -0.95 -4.84 118.70 117.78 2w2l s GLU 209 Ca 0.52 -1.31 -0.30 0.00 0.36 0.00 0.00 54.97 54.25 2w2l s GLU 209 Cb -0.26 -2.85 -0.07 0.00 0.26 0.00 0.00 34.13 31.21 2w2l s GLU 209 CO 0.30 -0.59 0.96 0.50 -0.54 0.00 0.00 175.26 175.90 2w2l s ARG 210 N 1.14 4.74 0.43 4.30 3.52 -1.26 -1.03 118.95 130.80 2w2l s ARG 210 Ca -0.08 1.47 0.06 0.00 -0.13 0.00 0.00 55.73 57.05 2w2l s ARG 210 Cb -0.20 -3.34 -0.06 0.00 -1.56 0.00 0.00 34.95 29.79 2w2l s ARG 210 CO -0.05 0.30 0.03 0.14 -0.81 0.00 0.00 175.30 174.90 2w2l s VAL 211 N -0.36 1.84 -0.08 7.11 -7.23 0.16 -4.88 120.40 116.96 2w2l s VAL 211 Ca 0.45 -1.97 0.19 0.00 -1.81 0.00 0.00 61.98 58.84 2w2l s VAL 211 Cb -0.24 -2.81 -0.28 0.00 0.56 0.00 0.00 36.38 33.60 2w2l s VAL 211 CO 0.31 0.00 0.44 0.47 -0.31 0.00 0.00 175.10 176.00 2w2l n ASP 212 N -1.06 0.74 -4.21 4.85 8.00 -1.26 -4.57 116.55 119.03 2w2l n ASP 212 Ca -0.08 -0.07 -0.12 0.00 0.71 0.00 0.00 54.79 55.23 2w2l n ASP 212 Cb 0.67 1.79 -0.10 0.00 -0.02 0.00 0.00 41.12 43.46 2w2l n ASP 212 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 2w2l s SER 213 N -4.05 0.71 0.31 -2.24 1.04 -1.26 -5.01 113.70 103.19 2w2l s SER 213 Ca -0.06 -1.26 -0.01 0.00 0.48 0.00 0.00 55.95 55.10 2w2l s SER 213 Cb 0.12 0.23 0.48 0.00 0.10 0.00 0.00 66.02 66.95 2w2l s SER 213 CO 0.77 -0.70 1.95 -0.07 0.98 0.00 0.00 173.24 176.18 2w2l h LEU 214 N 2.69 0.87 0.22 2.42 3.38 -1.98 -2.07 115.31 120.83 2w2l h LEU 214 Ca -0.36 -0.05 -0.01 0.00 0.09 0.00 0.00 57.88 57.55 2w2l h LEU 214 Cb 1.22 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 41.75 2w2l h LEU 214 CO 0.59 0.67 -0.10 -0.08 0.09 0.00 0.00 178.44 179.61 2w2l h GLU 215 N 1.00 -0.28 0.00 1.13 4.81 -1.95 0.96 114.58 120.25 2w2l h GLU 215 Ca 0.26 0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.51 2w2l h GLU 215 Cb -0.04 0.06 0.00 0.00 0.63 0.00 0.00 28.75 29.40 2w2l h GLU 215 CO -0.05 0.01 0.00 0.39 -0.73 0.00 0.00 179.01 178.63 2w2l n GLU 216 N -5.09 0.00 -0.35 1.92 1.02 -1.17 -2.37 120.64 114.60 2w2l n GLU 216 Ca -0.09 0.78 0.15 0.00 -0.02 0.00 0.00 57.16 57.98 2w2l n GLU 216 Cb 0.23 -1.31 0.30 0.00 -0.02 0.00 0.00 31.44 30.63 2w2l n GLU 216 CO 0.00 0.00 0.00 -0.11 1.18 0.00 0.00 177.13 178.20 2w2l n LEU 217 N -2.19 -0.11 0.06 -4.62 7.94 -0.79 0.16 117.00 117.44 2w2l n LEU 217 Ca 0.00 1.70 0.18 0.00 -1.11 0.00 0.00 56.01 56.78 2w2l n LEU 217 Cb 0.00 -0.62 0.69 0.00 0.53 0.00 0.00 43.42 44.02 2w2l n LEU 217 CO 0.00 -1.72 1.16 0.00 -1.11 0.00 0.00 177.39 175.72 2w2l h ALA 218 N 2.00 2.38 0.00 1.96 0.00 -0.43 -2.64 119.26 122.53 2w2l h ALA 218 Ca 0.61 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.50 2w2l h ALA 218 Cb 1.26 0.03 -0.00 0.00 0.00 0.00 0.00 17.79 19.08 2w2l h ALA 218 CO -0.94 -0.53 -0.79 -0.09 0.00 0.00 0.00 179.25 176.91 2w2l h ARG 219 N 0.00 0.00 -0.40 0.00 2.43 0.20 -3.27 114.38 113.34 2w2l h ARG 219 Ca 0.20 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.37 2w2l h ARG 219 Cb 0.82 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.37 2w2l h ARG 219 CO -0.00 0.00 0.00 0.54 -1.51 0.00 0.00 179.97 179.00 2w2l n ARG 220 N -2.77 2.39 -4.40 0.20 1.74 -1.01 -4.68 116.66 108.14 2w2l n ARG 220 Ca 0.01 -2.18 -0.34 0.00 -0.77 0.00 0.00 57.85 54.57 2w2l n ARG 220 Cb 0.55 -1.44 -0.11 0.00 -1.02 0.00 0.00 32.46 30.44 2w2l n ARG 220 CO 0.00 0.00 0.00 -1.12 -1.52 0.00 0.00 177.63 174.99 2w2l s SER 221 N -1.24 5.02 -0.11 0.55 0.01 -1.14 -4.79 113.70 112.00 2w2l s SER 221 Ca 0.34 0.02 0.12 0.00 1.31 0.00 0.00 55.95 57.74 2w2l s SER 221 Cb 0.20 -1.56 -0.24 0.00 0.21 0.00 0.00 66.02 64.62 2w2l s SER 221 CO 0.27 0.29 0.41 0.47 0.41 0.00 0.00 173.24 175.09 2w2l n ASP 222 N 2.73 0.78 -3.73 2.44 8.00 0.10 -4.54 116.55 122.34 2w2l n ASP 222 Ca -0.18 0.24 -0.14 0.00 0.71 0.00 0.00 54.79 55.43 2w2l n ASP 222 Cb 0.53 0.17 -0.14 0.00 -0.02 0.00 0.00 41.12 41.66 2w2l n ASP 222 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2w2l s VAL 224 N 1.38 5.09 -0.40 0.00 1.01 -0.02 -0.57 120.40 126.89 2w2l s VAL 224 Ca -0.07 0.87 -0.14 0.00 0.00 0.00 0.00 61.98 62.64 2w2l s VAL 224 Cb -0.11 -3.82 0.02 0.00 0.00 0.00 0.00 36.38 32.47 2w2l s VAL 224 CO -0.07 0.13 0.27 -0.55 0.00 0.00 0.00 175.10 174.88 2w2l s SER 225 N 1.40 6.00 -0.23 3.32 0.15 0.85 -0.73 113.70 124.47 2w2l s SER 225 Ca 0.21 -0.94 -0.20 0.00 0.70 0.00 0.00 55.95 55.72 2w2l s SER 225 Cb -0.15 -2.12 -0.02 0.00 -1.71 0.00 0.00 66.02 62.01 2w2l s SER 225 CO 0.09 -0.44 0.59 -0.69 1.20 0.00 0.00 173.24 174.00 2w2l s VAL 226 N 1.64 5.03 -0.46 4.45 1.01 0.19 -1.25 120.40 131.01 2w2l s VAL 226 Ca 0.04 1.08 0.06 0.00 0.00 0.00 0.00 61.98 63.16 2w2l s VAL 226 Cb -0.19 -3.91 0.21 0.00 0.00 0.00 0.00 36.38 32.49 2w2l s VAL 226 CO 0.09 0.08 0.62 -0.24 0.00 0.00 0.00 175.10 175.66 2w2l n SER 227 N 5.34 -1.75 -4.30 3.32 2.88 -0.61 -2.87 113.62 115.64 2w2l n SER 227 Ca -0.02 -2.82 -0.23 0.00 -1.33 0.00 0.00 58.87 54.47 2w2l n SER 227 Cb 0.49 0.64 -0.12 0.00 -0.75 0.00 0.00 64.21 64.48 2w2l n SER 227 CO 0.00 0.00 0.00 0.68 -1.23 0.00 0.00 175.04 174.49 2w2l s VAL 228 N 0.16 1.72 0.70 2.46 -7.23 -1.26 -4.44 120.40 112.51 2w2l s VAL 228 Ca 0.32 -1.69 -0.16 0.00 -1.81 0.00 0.00 61.98 58.64 2w2l s VAL 228 Cb 0.11 -1.65 0.01 0.00 0.56 0.00 0.00 36.38 35.40 2w2l s VAL 228 CO -0.15 -0.18 1.09 -2.65 -0.31 0.00 0.00 175.10 172.90 2w2l n PRO 229 N 0.75 0.67 -3.75 4.82 -0.02 -1.26 -4.47 135.00 131.73 2w2l n PRO 229 Ca -0.17 0.29 -0.37 0.00 -2.02 0.00 0.00 63.50 61.23 2w2l n PRO 229 Cb 0.55 -2.34 -0.13 0.00 -0.02 0.00 0.00 33.50 31.57 2w2l n PRO 229 CO 0.00 0.00 0.00 -0.47 1.98 0.00 0.00 175.50 177.01 2w2l s TYR 230 N -1.71 3.13 0.00 6.00 5.04 -1.26 -4.73 117.35 123.82 2w2l s TYR 230 Ca 0.76 -0.85 0.00 0.00 -2.44 0.00 0.00 57.07 54.54 2w2l s TYR 230 Cb -0.35 -2.26 0.00 0.00 0.35 0.00 0.00 41.96 39.70 2w2l s TYR 230 CO 0.47 -0.53 0.00 -1.33 -1.34 0.00 0.00 175.55 172.82 2w2l n MET 231 N 4.88 0.00 0.06 4.97 2.81 -1.26 -5.01 117.12 123.57 2w2l n MET 231 Ca -0.15 0.00 -0.08 0.00 -1.81 0.00 0.00 57.70 55.66 2w2l n MET 231 Cb 0.49 0.00 -0.05 0.00 -0.71 0.00 0.00 33.22 32.94 2w2l n MET 231 CO 0.00 0.00 0.00 1.57 1.51 0.00 0.00 175.97 179.05 2w2l h LYS 232 N 0.00 -0.24 -0.93 0.03 -0.00 -1.97 -3.25 116.57 110.21 2w2l h LYS 232 Ca 0.00 0.02 0.15 0.00 -0.00 0.00 0.00 60.65 60.81 2w2l h LYS 232 Cb 0.00 0.05 -0.09 0.00 -0.00 0.00 0.00 32.23 32.19 2w2l h LYS 232 CO 0.00 0.06 0.54 -0.07 -0.00 0.00 0.00 179.45 179.98 2w2l h LEU 233 N -0.99 0.71 -1.53 7.07 4.07 -1.97 -2.71 115.31 119.95 2w2l h LEU 233 Ca -0.03 0.08 0.00 0.00 0.08 0.00 0.00 57.88 58.01 2w2l h LEU 233 Cb 0.41 -0.05 0.00 0.00 1.08 0.00 0.00 40.66 42.10 2w2l h LEU 233 CO 0.04 0.32 0.00 0.35 -1.08 0.00 0.00 178.44 178.07 2w2l n THR 234 N -4.77 0.15 -1.92 0.22 -2.24 -1.26 -4.74 114.28 99.71 2w2l n THR 234 Ca 0.19 -0.44 -0.42 0.00 -2.27 0.00 0.00 64.05 61.11 2w2l n THR 234 Cb 0.44 0.84 -0.03 0.00 -2.10 0.00 0.00 70.33 69.48 2w2l n THR 234 CO 0.00 0.00 0.00 -2.28 -0.57 0.00 0.00 175.07 172.22 2w2l s HIS 235 N -1.85 3.03 -1.00 4.78 5.04 -1.03 -2.40 115.29 121.86 2w2l s HIS 235 Ca 0.34 0.68 0.00 0.00 -1.54 0.00 0.00 55.06 54.54 2w2l s HIS 235 Cb 0.20 -3.93 0.00 0.00 0.04 0.00 0.00 32.58 28.89 2w2l s HIS 235 CO 0.30 -3.37 0.00 0.72 -2.34 0.00 0.00 174.74 170.06 2w2l n HIS 236 N 3.59 -1.09 -0.34 3.88 8.25 -0.01 -4.84 115.22 124.66 2w2l n HIS 236 Ca 0.12 0.00 0.08 0.00 -0.26 0.00 0.00 57.72 57.66 2w2l n HIS 236 Cb 0.38 -2.42 0.24 0.00 1.12 0.00 0.00 29.99 29.32 2w2l n HIS 236 CO 0.00 0.00 0.00 1.25 0.64 0.00 0.00 176.34 178.23 2w2l h LEU 237 N 0.00 0.81 -8.16 2.41 5.85 -1.08 -3.25 115.31 111.88 2w2l h LEU 237 Ca -0.24 0.06 -0.69 0.00 0.84 0.00 0.00 57.88 57.85 2w2l h LEU 237 Cb 0.99 -0.09 -0.19 0.00 0.37 0.00 0.00 40.66 41.74 2w2l h LEU 237 CO 0.31 0.40 0.19 -0.63 -0.34 0.00 0.00 178.44 178.37 2w2l s ILE 238 N -5.95 4.76 0.15 4.05 -1.09 -0.55 -4.89 121.20 117.68 2w2l s ILE 238 Ca -0.12 -0.95 0.00 0.00 -2.23 0.00 0.00 60.65 57.35 2w2l s ILE 238 Cb 0.22 -4.53 -0.00 0.00 -1.58 0.00 0.00 42.46 36.58 2w2l s ILE 238 CO 0.80 -1.18 0.00 -0.67 -1.23 0.00 0.00 174.94 172.66 2w2l n ASP 239 N 6.49 2.39 -0.34 3.58 -0.08 -1.23 -1.62 116.55 125.74 2w2l n ASP 239 Ca -0.07 -1.66 0.19 0.00 -1.51 0.00 0.00 54.79 51.74 2w2l n ASP 239 Cb 0.43 0.11 0.41 0.00 2.34 0.00 0.00 41.12 44.41 2w2l n ASP 239 CO 0.00 0.00 0.00 -0.08 0.12 0.00 0.00 177.20 177.24 2w2l h GLU 240 N 0.00 0.49 -0.74 -0.67 4.81 -1.91 -0.24 114.58 116.32 2w2l h GLU 240 Ca -0.12 -0.03 -0.01 0.00 -0.13 0.00 0.00 59.36 59.07 2w2l h GLU 240 Cb 0.38 -0.11 -0.04 0.00 0.63 0.00 0.00 28.75 29.61 2w2l h GLU 240 CO 0.21 0.32 0.43 0.00 -0.73 0.00 0.00 179.01 179.24 2w2l h ALA 241 N 1.77 1.36 0.25 2.92 0.00 -1.97 0.05 119.26 123.64 2w2l h ALA 241 Ca 0.67 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 55.47 2w2l h ALA 241 Cb 1.36 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 18.85 2w2l h ALA 241 CO -0.52 0.54 -0.12 0.35 0.00 0.00 0.00 179.25 179.50 2w2l h PHE 242 N 1.02 -0.32 -0.54 0.00 3.57 -1.40 -2.86 116.94 116.42 2w2l h PHE 242 Ca 0.26 -0.01 0.08 0.00 3.53 0.00 0.00 57.97 61.84 2w2l h PHE 242 Cb -0.01 0.10 -0.03 0.00 2.79 0.00 0.00 35.95 38.80 2w2l h PHE 242 CO 0.01 0.05 0.36 0.74 -2.23 0.00 0.00 178.31 177.23 2w2l h PHE 243 N -0.78 0.41 -0.96 0.41 0.04 -1.37 -0.76 116.94 113.92 2w2l h PHE 243 Ca -0.03 0.01 0.04 0.00 2.80 0.00 0.00 57.97 60.79 2w2l h PHE 243 Cb 0.51 -0.13 -0.06 0.00 2.20 0.00 0.00 35.95 38.46 2w2l h PHE 243 CO 0.04 0.21 0.63 0.00 -0.60 0.00 0.00 178.31 178.59 2w2l h ALA 244 N 1.72 1.39 -0.10 2.45 0.00 -0.95 -3.03 119.26 120.74 2w2l h ALA 244 Ca 0.24 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.11 2w2l h ALA 244 Cb 0.44 -0.33 0.00 0.00 0.00 0.00 0.00 17.79 17.90 2w2l h ALA 244 CO -0.06 0.50 0.00 0.00 0.00 0.00 0.00 179.25 179.69 2w2l n ALA 245 N -2.38 2.56 -2.42 0.00 0.00 -0.30 -4.92 120.51 113.04 2w2l n ALA 245 Ca 0.13 -0.39 -0.36 0.00 0.00 0.00 0.00 53.44 52.83 2w2l n ALA 245 Cb 0.12 -1.17 -0.06 0.00 0.00 0.00 0.00 19.45 18.34 2w2l n ALA 245 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 2w2l s MET 246 N -1.87 3.95 0.48 0.00 1.00 -1.15 -2.83 119.30 118.88 2w2l s MET 246 Ca 0.32 0.45 -0.22 0.00 0.00 0.00 0.00 55.69 56.23 2w2l s MET 246 Cb 0.16 -3.06 -0.09 0.00 0.00 0.00 0.00 34.83 31.85 2w2l s MET 246 CO 0.26 0.57 0.96 1.63 0.00 0.00 0.00 175.02 178.43 2w2l n LYS 247 N 1.19 1.18 -1.75 2.03 5.02 -1.23 -4.90 118.16 119.70 2w2l n LYS 247 Ca -0.09 0.43 -0.40 0.00 -2.02 0.00 0.00 58.31 56.23 2w2l n LYS 247 Cb 0.52 -2.05 0.01 0.00 -0.02 0.00 0.00 35.03 33.50 2w2l n LYS 247 CO 0.00 0.00 0.00 -2.30 -0.52 0.00 0.00 177.40 174.58 2w2l n PRO 248 N -0.14 2.23 -2.02 1.97 -0.02 -1.26 -2.77 135.00 132.99 2w2l n PRO 248 Ca 0.10 0.79 -0.16 0.00 -2.02 0.00 0.00 63.50 62.22 2w2l n PRO 248 Cb 0.42 -2.56 -0.03 0.00 -0.02 0.00 0.00 33.50 31.31 2w2l n PRO 248 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2w2l n GLY 249 N 0.63 0.35 1.30 -1.23 0.00 -0.17 -5.00 105.19 101.07 2w2l n GLY 249 Ca 0.05 -0.24 -0.09 0.00 0.00 0.00 0.00 46.02 45.74 2w2l n GLY 249 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2w2l n SER 250 N -0.86 0.29 -3.88 1.61 3.41 -1.11 -4.28 113.62 108.80 2w2l n SER 250 Ca -0.18 -1.29 -0.09 0.00 -0.26 0.00 0.00 58.87 57.05 2w2l n SER 250 Cb 0.60 -0.27 -0.08 0.00 -0.26 0.00 0.00 64.21 64.20 2w2l n SER 250 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 2w2l s ARG 251 N -3.57 0.75 -0.13 4.33 0.52 -1.13 -0.14 118.95 119.59 2w2l s ARG 251 Ca 0.23 -0.87 -0.13 0.00 -0.52 0.00 0.00 55.73 54.44 2w2l s ARG 251 Cb -0.01 0.30 0.04 0.00 0.52 0.00 0.00 34.95 35.80 2w2l s ARG 251 CO 0.16 -0.22 0.37 -1.50 0.02 0.00 0.00 175.30 174.13 2w2l s ILE 252 N -3.38 0.01 -0.02 1.52 2.07 -1.20 -0.84 121.20 119.35 2w2l s ILE 252 Ca 0.01 -0.04 0.04 0.00 -1.41 0.00 0.00 60.65 59.25 2w2l s ILE 252 Cb 0.03 -0.54 -0.01 0.00 0.13 0.00 0.00 42.46 42.08 2w2l s ILE 252 CO -0.08 -0.02 -0.14 0.68 -1.91 0.00 0.00 174.94 173.47 2w2l s VAL 253 N 0.05 1.10 -0.20 4.00 -7.23 0.10 -0.72 120.40 117.50 2w2l s VAL 253 Ca -0.01 -0.57 -0.01 0.00 -1.81 0.00 0.00 61.98 59.58 2w2l s VAL 253 Cb -0.03 -0.94 0.01 0.00 0.56 0.00 0.00 36.38 35.98 2w2l s VAL 253 CO 0.01 0.32 -0.14 0.21 -0.31 0.00 0.00 175.10 175.19 2w2l s ASN 254 N -0.12 3.60 0.00 4.85 2.47 -0.30 -0.64 114.94 124.80 2w2l s ASN 254 Ca 0.01 -0.59 0.01 0.00 0.42 0.00 0.00 52.86 52.72 2w2l s ASN 254 Cb -0.08 -1.58 0.02 0.00 -1.45 0.00 0.00 41.25 38.17 2w2l s ASN 254 CO 0.00 -0.02 0.85 0.35 -3.72 0.00 0.00 177.10 174.57 2w2l n THR 255 N 4.68 0.64 0.00 -5.21 -2.24 -1.14 -2.17 114.28 108.84 2w2l n THR 255 Ca -0.20 -0.82 0.00 0.00 -2.27 0.00 0.00 64.05 60.76 2w2l n THR 255 Cb 0.50 0.69 0.00 0.00 -2.10 0.00 0.00 70.33 69.42 2w2l n THR 255 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2w2l n ALA 256 N -0.23 0.00 -2.92 6.98 0.00 -1.25 -4.91 120.51 118.18 2w2l n ALA 256 Ca 0.01 0.00 -0.10 0.00 0.00 0.00 0.00 53.44 53.35 2w2l n ALA 256 Cb 0.18 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.53 2w2l n ALA 256 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 2w2l s ARG 257 N 0.00 0.51 0.15 0.00 6.06 -1.26 -4.97 118.95 119.44 2w2l s ARG 257 Ca 0.00 -0.59 -0.31 0.00 -2.50 0.00 0.00 55.73 52.33 2w2l s ARG 257 Cb 0.00 0.20 -0.08 0.00 0.06 0.00 0.00 34.95 35.14 2w2l s ARG 257 CO 0.00 -0.12 1.53 0.78 -2.50 0.00 0.00 175.30 174.99 2w2l h GLY 258 N 4.05 -0.90 0.86 8.12 0.00 -1.81 -2.37 103.07 111.03 2w2l h GLY 258 Ca -0.32 0.79 0.00 0.00 0.00 0.00 0.00 47.33 47.81 2w2l h GLY 258 CO 0.45 0.00 -0.01 -1.05 0.00 0.00 0.00 176.54 175.93 2w2l n PRO 259 N -5.23 0.99 0.32 4.80 -0.02 -1.26 -3.27 135.00 131.32 2w2l n PRO 259 Ca 0.01 -0.15 0.17 0.00 -2.02 0.00 0.00 63.50 61.51 2w2l n PRO 259 Cb 0.27 -1.50 0.92 0.00 -0.02 0.00 0.00 33.50 33.17 2w2l n PRO 259 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 2w2l h VAL 260 N 0.37 0.00 -3.28 -1.45 2.07 -1.62 0.01 116.25 112.36 2w2l h VAL 260 Ca 0.00 0.00 -0.55 0.00 0.82 0.00 0.00 66.70 66.97 2w2l h VAL 260 Cb 0.14 0.74 -0.35 0.00 -1.52 0.00 0.00 31.29 30.30 2w2l h VAL 260 CO 0.00 0.00 -0.82 -0.63 0.02 0.00 0.00 177.57 176.14 2w2l s ILE 261 N -4.04 1.26 -0.16 4.57 1.01 -1.23 -1.48 121.20 121.12 2w2l s ILE 261 Ca -0.04 -0.49 -0.29 0.00 0.00 0.00 0.00 60.65 59.83 2w2l s ILE 261 Cb 0.10 -1.18 -0.04 0.00 0.01 0.00 0.00 42.46 41.34 2w2l s ILE 261 CO 0.31 0.39 1.72 -0.55 0.00 0.00 0.00 174.94 176.81 2w2l s SER 262 N 1.11 6.35 0.32 3.58 0.15 -0.64 -4.78 113.70 119.79 2w2l s SER 262 Ca -0.05 1.87 0.04 0.00 0.70 0.00 0.00 55.95 58.51 2w2l s SER 262 Cb -0.14 -2.53 0.66 0.00 -1.71 0.00 0.00 66.02 62.30 2w2l s SER 262 CO -0.02 -1.25 1.87 -0.61 1.20 0.00 0.00 173.24 174.43 2w2l h GLN 263 N 10.93 0.84 0.00 5.44 4.15 -1.91 -0.86 115.11 133.72 2w2l h GLN 263 Ca -0.37 -0.05 -0.23 0.00 0.77 0.00 0.00 58.65 58.77 2w2l h GLN 263 Cb 1.17 -0.19 0.00 0.00 0.21 0.00 0.00 27.48 28.68 2w2l h GLN 263 CO 0.98 0.56 -0.95 -0.44 -1.93 0.00 0.00 178.83 177.05 2w2l h ASP 264 N 0.87 0.53 -0.49 -0.69 3.32 -1.98 -0.72 116.42 117.25 2w2l h ASP 264 Ca 0.44 -0.42 -0.07 0.00 0.02 0.00 0.00 57.03 57.00 2w2l h ASP 264 Cb 0.50 -0.16 -0.02 0.00 0.22 0.00 0.00 39.33 39.86 2w2l h ASP 264 CO -0.20 1.23 0.07 0.00 -1.72 0.00 0.00 179.24 178.61 2w2l h ALA 265 N 0.74 1.09 -0.05 3.45 0.00 -1.85 -1.95 119.26 120.70 2w2l h ALA 265 Ca -0.08 -0.25 -0.01 0.00 0.00 0.00 0.00 54.91 54.58 2w2l h ALA 265 Cb 1.59 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 19.16 2w2l h ALA 265 CO 0.16 0.59 0.00 1.25 0.00 0.00 0.00 179.25 181.25 2w2l h LEU 266 N 0.83 0.08 0.18 0.00 5.85 -1.03 -0.57 115.31 120.66 2w2l h LEU 266 Ca 0.17 -0.31 0.01 0.00 0.84 0.00 0.00 57.88 58.59 2w2l h LEU 266 Cb 0.40 -0.02 -0.03 0.00 0.37 0.00 0.00 40.66 41.38 2w2l h LEU 266 CO 0.01 0.37 -0.27 0.40 -0.34 0.00 0.00 178.44 178.61 2w2l h ILE 267 N -0.21 0.41 -0.14 4.05 2.04 -1.05 0.06 117.51 122.67 2w2l h ILE 267 Ca 0.01 0.00 0.03 0.00 1.00 0.00 0.00 64.86 65.90 2w2l h ILE 267 Cb 0.33 0.41 -0.05 0.00 -0.74 0.00 0.00 36.82 36.77 2w2l h ILE 267 CO 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 178.15 177.73 2w2l h ALA 268 N 0.15 -0.77 -0.81 1.87 0.00 -1.35 0.23 119.26 118.58 2w2l h ALA 268 Ca 0.01 -0.04 0.18 0.00 0.00 0.00 0.00 54.91 55.07 2w2l h ALA 268 Cb 0.52 0.93 -0.12 0.00 0.00 0.00 0.00 17.79 19.13 2w2l h ALA 268 CO -0.12 -0.93 0.28 0.00 0.00 0.00 0.00 179.25 178.48 2w2l h ALA 269 N -0.52 1.16 -0.55 0.00 0.00 -0.95 0.64 119.26 119.04 2w2l h ALA 269 Ca 0.03 0.16 -0.01 0.00 0.00 0.00 0.00 54.91 55.09 2w2l h ALA 269 Cb 0.51 0.19 -0.03 0.00 0.00 0.00 0.00 17.79 18.46 2w2l h ALA 269 CO -0.36 -0.32 0.29 -0.07 0.00 0.00 0.00 179.25 178.79 2w2l h LEU 270 N 0.34 0.69 -0.62 0.00 3.38 -0.08 -2.14 115.31 116.89 2w2l h LEU 270 Ca 0.48 -0.10 -0.11 0.00 0.09 0.00 0.00 57.88 58.23 2w2l h LEU 270 Cb 0.85 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 41.40 2w2l h LEU 270 CO -0.51 0.60 -0.14 0.11 0.09 0.00 0.00 178.44 178.59 2w2l h LYS 271 N 0.74 0.95 0.00 1.13 1.57 0.34 -1.72 116.57 119.58 2w2l h LYS 271 Ca 0.19 -0.36 0.00 0.00 -1.87 0.00 0.00 60.65 58.62 2w2l h LYS 271 Cb 0.06 -0.06 0.00 0.00 0.08 0.00 0.00 32.23 32.31 2w2l h LYS 271 CO -0.03 1.02 0.00 0.66 -0.57 0.00 0.00 179.45 180.53 2w2l h SER 272 N 0.84 0.00 0.00 0.86 4.64 -0.39 -3.45 113.55 116.05 2w2l h SER 272 Ca 0.13 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.45 2w2l h SER 272 Cb 0.69 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.78 2w2l h SER 272 CO 0.05 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.62 2w2l n GLY 273 N -0.80 0.61 0.34 -0.77 0.00 -0.65 -4.93 105.19 98.99 2w2l n GLY 273 Ca -0.02 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.95 2w2l n GLY 273 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 2w2l h LYS 274 N 1.52 1.19 -5.55 1.61 1.63 -1.63 -3.29 116.57 112.05 2w2l h LYS 274 Ca 0.00 -0.15 -0.61 0.00 -0.85 0.00 0.00 60.65 59.03 2w2l h LYS 274 Cb 0.00 -0.22 -0.09 0.00 -0.60 0.00 0.00 32.23 31.31 2w2l h LYS 274 CO 0.00 0.89 -0.38 -0.51 -3.45 0.00 0.00 179.45 176.00 2w2l s LEU 275 N -9.89 4.30 0.00 5.20 1.43 -0.86 -1.00 118.68 117.87 2w2l s LEU 275 Ca -0.13 0.50 -0.21 0.00 -1.03 0.00 0.00 54.13 53.27 2w2l s LEU 275 Cb 0.16 -2.27 -0.21 0.00 0.03 0.00 0.00 46.19 43.90 2w2l s LEU 275 CO 0.82 0.22 1.14 0.25 0.23 0.00 0.00 176.35 179.02 2w2l h LEU 276 N 6.01 0.43 -7.75 1.79 5.85 -0.72 -3.42 115.31 117.51 2w2l h LEU 276 Ca -0.46 -0.70 0.02 0.00 0.84 0.00 0.00 57.88 57.58 2w2l h LEU 276 Cb 1.18 -0.13 -0.08 0.00 0.37 0.00 0.00 40.66 42.00 2w2l h LEU 276 CO 0.70 1.06 0.14 -0.94 -0.34 0.00 0.00 178.44 179.06 2w2l s SER 277 N -6.51 -0.30 0.15 1.25 1.04 -1.24 -4.73 113.70 103.37 2w2l s SER 277 Ca -0.14 -0.49 -0.23 0.00 0.48 0.00 0.00 55.95 55.56 2w2l s SER 277 Cb 0.03 0.65 0.07 0.00 0.10 0.00 0.00 66.02 66.87 2w2l s SER 277 CO 0.79 -1.18 0.63 0.00 0.98 0.00 0.00 173.24 174.46 2w2l s ALA 278 N -3.88 -1.61 -0.07 5.32 0.00 -0.93 -3.26 121.76 117.33 2w2l s ALA 278 Ca 0.10 0.51 -0.00 0.00 0.00 0.00 0.00 51.96 52.56 2w2l s ALA 278 Cb -0.03 0.85 0.03 0.00 0.00 0.00 0.00 23.12 23.97 2w2l s ALA 278 CO 0.01 -0.77 -0.02 0.20 0.00 0.00 0.00 175.76 175.18 2w2l s GLY 279 N -2.73 0.49 -0.14 0.00 0.00 0.11 0.27 107.32 105.31 2w2l s GLY 279 Ca 0.02 -0.13 0.01 0.00 0.00 0.00 0.00 44.72 44.62 2w2l s GLY 279 CO -0.12 0.89 -0.17 1.08 0.00 0.00 0.00 173.10 174.78 2w2l s LEU 280 N 1.60 1.83 -0.09 0.66 1.43 0.30 -1.15 118.68 123.27 2w2l s LEU 280 Ca -0.00 -0.51 0.11 0.00 -1.03 0.00 0.00 54.13 52.70 2w2l s LEU 280 Cb -0.13 -1.24 -0.24 0.00 0.03 0.00 0.00 46.19 44.62 2w2l s LEU 280 CO -0.04 0.00 0.47 -0.67 0.23 0.00 0.00 176.35 176.34 2w2l n ASP 281 N 4.43 0.90 -4.49 2.29 2.03 -0.92 -0.97 116.55 119.81 2w2l n ASP 281 Ca -0.19 0.28 -0.31 0.00 0.52 0.00 0.00 54.79 55.09 2w2l n ASP 281 Cb 0.51 0.04 -0.12 0.00 -0.72 0.00 0.00 41.12 40.83 2w2l n ASP 281 CO 0.00 0.00 0.00 0.68 -1.92 0.00 0.00 177.20 175.96 2w2l s VAL 282 N -2.57 3.02 -0.02 5.18 -7.23 -1.25 -0.93 120.40 116.60 2w2l s VAL 282 Ca -0.09 -1.05 0.03 0.00 -1.81 0.00 0.00 61.98 59.06 2w2l s VAL 282 Cb 0.07 -2.28 -0.00 0.00 0.56 0.00 0.00 36.38 34.74 2w2l s VAL 282 CO 0.81 0.37 -0.11 -1.00 -0.31 0.00 0.00 175.10 174.86 2w2l s HIS 283 N -0.93 1.06 0.22 2.82 3.76 -1.26 -4.58 115.29 116.39 2w2l s HIS 283 Ca 0.15 -0.24 -0.19 0.00 -0.15 0.00 0.00 55.06 54.63 2w2l s HIS 283 Cb -0.11 -0.72 0.20 0.00 1.11 0.00 0.00 32.58 33.06 2w2l s HIS 283 CO 0.05 -0.07 1.55 1.49 -0.85 0.00 0.00 174.74 176.92 2w2l h GLU 284 N 6.12 -0.01 -0.74 1.40 4.81 -1.85 -0.79 114.58 123.51 2w2l h GLU 284 Ca -0.33 0.00 -0.23 0.00 -0.13 0.00 0.00 59.36 58.68 2w2l h GLU 284 Cb 1.17 0.00 -0.13 0.00 0.63 0.00 0.00 28.75 30.42 2w2l h GLU 284 CO 0.49 -0.00 0.28 1.19 -0.73 0.00 0.00 179.01 180.23 2w2l n PHE 285 N -5.44 2.45 -1.48 0.92 3.01 -1.26 -4.45 117.46 111.20 2w2l n PHE 285 Ca 0.09 -1.23 -0.58 0.00 1.01 0.00 0.00 57.45 56.73 2w2l n PHE 285 Cb 0.38 -0.69 -0.08 0.00 -0.01 0.00 0.00 39.48 39.08 2w2l n PHE 285 CO 0.00 0.00 0.00 -1.91 1.01 0.00 0.00 176.76 175.86 2w2l n GLU 286 N -0.21 0.00 -0.05 -1.08 2.13 -0.30 0.55 120.64 121.68 2w2l n GLU 286 Ca 0.41 0.00 0.07 0.00 0.66 0.00 0.00 57.16 58.30 2w2l n GLU 286 Cb 1.39 -1.45 0.31 0.00 0.27 0.00 0.00 31.44 31.96 2w2l n GLU 286 CO 0.00 0.00 0.00 -0.35 -0.41 0.00 0.00 177.13 176.37 2w2l n PRO 287 N 1.78 1.31 -2.88 5.31 -0.04 -1.26 -5.05 135.00 134.17 2w2l n PRO 287 Ca 0.21 -0.47 -0.42 0.00 -0.04 0.00 0.00 63.50 62.78 2w2l n PRO 287 Cb 0.06 -1.24 -0.04 0.00 -0.04 0.00 0.00 33.50 32.24 2w2l n PRO 287 CO 0.00 0.00 0.00 -1.14 -0.04 0.00 0.00 175.50 174.32 2w2l s GLN 288 N -1.87 3.85 0.16 0.54 2.00 0.19 -5.03 119.66 119.49 2w2l s GLN 288 Ca 0.21 0.52 -0.27 0.00 -2.00 0.00 0.00 55.36 53.82 2w2l s GLN 288 Cb 0.11 -3.79 -0.08 0.00 0.80 0.00 0.00 33.01 30.05 2w2l s GLN 288 CO 0.16 -0.85 0.83 0.08 -0.50 0.00 0.00 175.29 175.01 2w2l s VAL 289 N 3.25 4.36 -0.32 1.34 1.01 -1.26 -3.98 120.40 124.80 2w2l s VAL 289 Ca 0.35 1.82 -0.42 0.00 0.00 0.00 0.00 61.98 63.73 2w2l s VAL 289 Cb -0.13 -4.20 -0.17 0.00 0.00 0.00 0.00 36.38 31.88 2w2l s VAL 289 CO 0.17 0.47 1.69 -0.24 0.00 0.00 0.00 175.10 177.19 2w2l n SER 290 N 1.87 2.04 0.24 3.32 2.88 -1.26 -4.87 113.62 117.84 2w2l n SER 290 Ca -0.04 1.11 0.13 0.00 -1.33 0.00 0.00 58.87 58.74 2w2l n SER 290 Cb 0.49 -1.07 0.44 0.00 -0.75 0.00 0.00 64.21 63.31 2w2l n SER 290 CO 0.00 0.00 0.00 0.11 -1.23 0.00 0.00 175.04 173.92 2w2l h LYS 291 N 6.52 0.00 0.26 -1.46 1.57 -1.99 -1.58 116.57 119.89 2w2l h LYS 291 Ca -0.46 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.31 2w2l h LYS 291 Cb 1.33 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.65 2w2l h LYS 291 CO 0.96 0.09 -0.12 0.93 -0.57 0.00 0.00 179.45 180.73 2w2l h GLU 292 N 0.00 -0.33 -0.99 3.15 4.39 -2.01 -3.03 114.58 115.76 2w2l h GLU 292 Ca -0.00 0.02 0.36 0.00 0.34 0.00 0.00 59.36 60.08 2w2l h GLU 292 Cb 0.77 0.08 -0.17 0.00 -0.10 0.00 0.00 28.75 29.33 2w2l h GLU 292 CO 0.01 -0.04 0.48 -0.07 -1.16 0.00 0.00 179.01 178.23 2w2l h LEU 293 N -1.00 0.28 -0.55 1.33 3.38 -1.93 -1.30 115.31 115.52 2w2l h LEU 293 Ca -0.04 0.24 -0.03 0.00 0.09 0.00 0.00 57.88 58.14 2w2l h LEU 293 Cb 0.45 0.25 -0.02 0.00 0.09 0.00 0.00 40.66 41.42 2w2l h LEU 293 CO 0.06 -0.31 0.21 0.40 0.09 0.00 0.00 178.44 178.88 2w2l h ILE 294 N 0.12 1.22 0.00 1.22 2.04 -1.29 -2.77 117.51 118.05 2w2l h ILE 294 Ca 0.77 -0.71 -0.02 0.00 1.00 0.00 0.00 64.86 65.90 2w2l h ILE 294 Cb 1.89 0.66 -0.00 0.00 -0.74 0.00 0.00 36.82 38.63 2w2l h ILE 294 CO -0.72 0.27 -0.12 -0.33 0.00 0.00 0.00 178.15 177.25 2w2l h GLU 295 N 0.75 0.00 -6.44 2.37 3.07 -1.11 -3.44 114.58 109.77 2w2l h GLU 295 Ca 0.18 0.00 -0.54 0.00 -0.50 0.00 0.00 59.36 58.50 2w2l h GLU 295 Cb 0.22 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.13 2w2l h GLU 295 CO -0.01 0.12 0.72 -1.64 -1.40 0.00 0.00 179.01 176.80 2w2l s MET 296 N -3.74 4.34 0.26 2.33 -1.94 -1.05 -4.95 119.30 114.56 2w2l s MET 296 Ca 0.00 1.92 -0.01 0.00 -1.71 0.00 0.00 55.69 55.89 2w2l s MET 296 Cb 0.10 -3.43 0.56 0.00 2.01 0.00 0.00 34.83 34.07 2w2l s MET 296 CO 0.59 -0.45 1.72 0.87 -0.01 0.00 0.00 175.02 177.74 2w2l h LYS 297 N 7.27 0.44 -0.77 2.03 1.57 -1.87 -3.16 116.57 122.08 2w2l h LYS 297 Ca -0.40 -0.03 -0.21 0.00 -1.87 0.00 0.00 60.65 58.15 2w2l h LYS 297 Cb 1.19 -0.10 -0.12 0.00 0.08 0.00 0.00 32.23 33.28 2w2l h LYS 297 CO 0.87 0.29 0.27 0.72 -0.57 0.00 0.00 179.45 181.02 2w2l n HIS 298 N -5.00 2.40 -4.27 -1.35 8.25 -1.26 -3.95 115.22 110.03 2w2l n HIS 298 Ca 0.17 -1.16 -0.34 0.00 -0.26 0.00 0.00 57.72 56.14 2w2l n HIS 298 Cb 0.50 -0.68 -0.15 0.00 1.12 0.00 0.00 29.99 30.79 2w2l n HIS 298 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 2w2l s VAL 299 N -2.88 2.65 -0.13 1.59 1.01 -1.20 -2.20 120.40 119.25 2w2l s VAL 299 Ca 0.53 -0.76 -0.16 0.00 0.00 0.00 0.00 61.98 61.59 2w2l s VAL 299 Cb 0.42 -2.14 -0.04 0.00 0.00 0.00 0.00 36.38 34.62 2w2l s VAL 299 CO 0.13 0.50 0.40 -0.89 0.00 0.00 0.00 175.10 175.24 2w2l s THR 300 N 1.10 5.23 -0.07 3.92 2.01 0.14 -4.91 115.64 123.06 2w2l s THR 300 Ca 0.00 0.78 0.01 0.00 0.31 0.00 0.00 61.69 62.80 2w2l s THR 300 Cb -0.14 -3.74 0.02 0.00 0.01 0.00 0.00 72.50 68.65 2w2l s THR 300 CO -0.05 0.37 -0.09 -0.76 -0.69 0.00 0.00 174.62 173.40 2w2l s LEU 301 N 0.47 1.44 0.21 4.42 1.43 -1.26 -0.54 118.68 124.85 2w2l s LEU 301 Ca 0.22 -0.25 0.09 0.00 -1.03 0.00 0.00 54.13 53.16 2w2l s LEU 301 Cb -0.14 -0.72 -0.05 0.00 0.03 0.00 0.00 46.19 45.31 2w2l s LEU 301 CO 0.08 -0.03 -0.16 0.42 0.23 0.00 0.00 176.35 176.89 2w2l s THR 302 N 0.98 1.89 -1.52 5.49 -4.23 -0.14 -5.00 115.64 113.11 2w2l s THR 302 Ca -0.09 -2.21 -0.11 0.00 -1.18 0.00 0.00 61.69 58.11 2w2l s THR 302 Cb -0.15 -2.06 -0.01 0.00 1.34 0.00 0.00 72.50 71.62 2w2l s THR 302 CO 0.00 -0.52 2.61 0.35 -0.54 0.00 0.00 174.62 176.52 2w2l n THR 303 N -0.33 4.14 -4.14 3.99 -2.24 -1.26 -4.41 114.28 110.03 2w2l n THR 303 Ca -0.08 -3.00 -0.32 0.00 -2.27 0.00 0.00 64.05 58.38 2w2l n THR 303 Cb 0.60 -2.55 -0.03 0.00 -2.10 0.00 0.00 70.33 66.25 2w2l n THR 303 CO 0.00 0.00 0.00 1.57 -0.57 0.00 0.00 175.07 176.07 2w2l n HIS 304 N 4.21 -1.68 -0.02 4.78 -0.00 -0.11 -4.85 115.22 117.56 2w2l n HIS 304 Ca 0.66 0.77 0.06 0.00 0.46 0.00 0.00 57.72 59.67 2w2l n HIS 304 Cb 0.29 -3.20 0.25 0.00 -0.12 0.00 0.00 29.99 27.21 2w2l n HIS 304 CO 0.00 0.00 0.00 0.44 0.46 0.00 0.00 176.34 177.24 2w2l n ILE 305 N -4.41 1.44 -0.05 3.57 -5.35 -1.26 -4.63 119.36 108.67 2w2l n ILE 305 Ca -0.08 -0.83 -0.02 0.00 -0.27 0.00 0.00 62.75 61.54 2w2l n ILE 305 Cb 0.57 -0.13 -0.02 0.00 -1.74 0.00 0.00 39.64 38.32 2w2l n ILE 305 CO 0.00 0.00 0.00 1.23 -1.76 0.00 0.00 176.55 176.02 2w2l h GLY 306 N 4.55 -2.08 -0.18 3.28 0.00 -1.90 -2.62 103.07 104.12 2w2l h GLY 306 Ca 0.00 0.96 0.00 0.00 0.00 0.00 0.00 47.33 48.29 2w2l h GLY 306 CO 0.22 -0.74 -0.01 0.61 0.00 0.00 0.00 176.54 176.62 2w2l n GLY 307 N -1.06 -0.20 3.57 4.60 0.00 -1.26 -2.61 105.19 108.22 2w2l n GLY 307 Ca -0.00 -0.40 -0.40 0.00 0.00 0.00 0.00 46.02 45.22 2w2l n GLY 307 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2w2l s VAL 308 N -2.03 3.94 -0.00 1.61 1.01 -0.99 -4.65 120.40 119.29 2w2l s VAL 308 Ca 0.39 -1.19 -0.04 0.00 0.00 0.00 0.00 61.98 61.14 2w2l s VAL 308 Cb 0.21 -5.00 -0.00 0.00 0.00 0.00 0.00 36.38 31.59 2w2l s VAL 308 CO 0.35 -1.84 0.08 0.00 0.00 0.00 0.00 175.10 173.69 2w2l s ALA 309 N 5.47 -0.18 0.26 5.51 0.00 -1.26 -5.01 121.76 126.55 2w2l s ALA 309 Ca 0.52 -0.17 -0.02 0.00 0.00 0.00 0.00 51.96 52.30 2w2l s ALA 309 Cb 0.01 0.06 0.51 0.00 0.00 0.00 0.00 23.12 23.69 2w2l s ALA 309 CO -0.01 -0.16 1.75 0.82 0.00 0.00 0.00 175.76 178.17 2w2l h ILE 310 N 4.55 0.71 -0.29 0.00 2.04 -2.01 -0.78 117.51 121.73 2w2l h ILE 310 Ca -0.30 -0.19 0.02 0.00 1.00 0.00 0.00 64.86 65.39 2w2l h ILE 310 Cb 1.20 0.09 -0.02 0.00 -0.74 0.00 0.00 36.82 37.36 2w2l h ILE 310 CO 0.42 0.10 0.20 -0.33 0.00 0.00 0.00 178.15 178.54 2w2l h GLU 311 N 0.56 0.32 -0.20 2.37 3.07 -1.97 -1.42 114.58 117.32 2w2l h GLU 311 Ca 0.45 -0.02 -0.00 0.00 -0.50 0.00 0.00 59.36 59.28 2w2l h GLU 311 Cb 0.64 -0.07 -0.01 0.00 -0.84 0.00 0.00 28.75 28.47 2w2l h GLU 311 CO -0.37 0.21 0.11 1.15 -1.40 0.00 0.00 179.01 178.70 2w2l h THR 312 N 0.33 1.11 0.00 1.13 2.02 -1.36 -1.11 112.91 115.03 2w2l h THR 312 Ca 0.12 -0.29 -0.10 0.00 0.77 0.00 0.00 66.41 66.90 2w2l h THR 312 Cb 0.07 0.94 -0.01 0.00 -1.74 0.00 0.00 68.15 67.40 2w2l h THR 312 CO -0.03 0.10 -0.50 -0.26 0.37 0.00 0.00 175.52 175.21 2w2l h PHE 313 N 0.21 0.00 -0.75 3.16 0.04 -1.22 0.78 116.94 119.15 2w2l h PHE 313 Ca 0.07 0.00 0.05 0.00 2.80 0.00 0.00 57.97 60.89 2w2l h PHE 313 Cb 0.07 0.00 -0.05 0.00 2.20 0.00 0.00 35.95 38.17 2w2l h PHE 313 CO -0.04 0.50 0.45 0.45 -0.60 0.00 0.00 178.31 179.08 2w2l h HIS 314 N 0.00 0.84 0.00 -0.55 3.86 -0.97 -3.00 115.15 115.33 2w2l h HIS 314 Ca -0.00 0.03 -0.12 0.00 -1.16 0.00 0.00 60.37 59.11 2w2l h HIS 314 Cb 0.89 -0.27 -0.02 0.00 1.06 0.00 0.00 27.41 29.07 2w2l h HIS 314 CO 0.00 0.44 -0.58 1.49 0.86 0.00 0.00 177.93 180.14 2w2l h GLU 315 N 0.85 0.00 0.08 2.45 4.57 0.40 -1.96 114.58 120.98 2w2l h GLU 315 Ca 0.32 0.00 0.02 0.00 -1.18 0.00 0.00 59.36 58.52 2w2l h GLU 315 Cb 0.12 0.00 -0.04 0.00 -0.16 0.00 0.00 28.75 28.67 2w2l h GLU 315 CO -0.15 0.58 -0.26 0.74 -1.18 0.00 0.00 179.01 178.73 2w2l h PHE 316 N 0.00 -0.71 -0.66 0.92 0.04 -1.07 0.04 116.94 115.49 2w2l h PHE 316 Ca -0.01 0.02 0.02 0.00 2.80 0.00 0.00 57.97 60.80 2w2l h PHE 316 Cb 1.30 0.30 -0.04 0.00 2.20 0.00 0.00 35.95 39.72 2w2l h PHE 316 CO 0.00 -0.36 0.42 0.93 -0.60 0.00 0.00 178.31 178.70 2w2l h GLU 317 N -0.45 0.82 0.06 1.51 5.08 -1.42 0.50 114.58 120.67 2w2l h GLU 317 Ca 0.04 -0.05 0.02 0.00 -1.00 0.00 0.00 59.36 58.37 2w2l h GLU 317 Cb 0.50 -0.19 -0.04 0.00 0.50 0.00 0.00 28.75 29.53 2w2l h GLU 317 CO -0.18 0.54 -0.23 -0.09 -1.00 0.00 0.00 179.01 178.06 2w2l h ARG 318 N 0.85 -0.37 -0.01 2.33 2.43 -0.85 -2.39 114.38 116.36 2w2l h ARG 318 Ca 0.26 0.03 -0.00 0.00 -0.81 0.00 0.00 59.98 59.45 2w2l h ARG 318 Cb -0.03 0.09 -0.00 0.00 -0.42 0.00 0.00 29.97 29.60 2w2l h ARG 318 CO -0.08 -0.25 0.00 -0.07 -1.51 0.00 0.00 179.97 178.06 2w2l h LEU 319 N -0.39 0.02 -0.08 3.80 3.38 -0.79 0.17 115.31 121.42 2w2l h LEU 319 Ca 0.04 -0.28 0.03 0.00 0.09 0.00 0.00 57.88 57.77 2w2l h LEU 319 Cb 0.44 -0.01 -0.03 0.00 0.09 0.00 0.00 40.66 41.15 2w2l h LEU 319 CO -0.17 0.29 -0.11 0.71 0.09 0.00 0.00 178.44 179.26 2w2l h THR 320 N -0.25 0.70 -0.57 0.22 1.35 -0.90 0.27 112.91 113.73 2w2l h THR 320 Ca 0.00 0.00 -0.03 0.00 -0.55 0.00 0.00 66.41 65.84 2w2l h THR 320 Cb 0.28 0.70 -0.03 0.00 -1.73 0.00 0.00 68.15 67.37 2w2l h THR 320 CO 0.00 0.00 0.24 0.24 -0.25 0.00 0.00 175.52 175.75 2w2l h MET 321 N -0.15 0.82 0.01 4.72 2.86 -1.34 -3.01 114.93 118.83 2w2l h MET 321 Ca 0.07 -0.12 -0.20 0.00 -2.06 0.00 0.00 59.70 57.39 2w2l h MET 321 Cb 0.25 -0.15 -0.03 0.00 0.06 0.00 0.00 31.60 31.73 2w2l h MET 321 CO -0.17 0.66 -0.94 1.15 1.06 0.00 0.00 176.91 178.67 2w2l h THR 322 N 0.81 1.66 -0.69 2.22 2.02 0.11 -2.88 112.91 116.15 2w2l h THR 322 Ca 0.20 -3.16 -0.04 0.00 0.77 0.00 0.00 66.41 64.17 2w2l h THR 322 Cb 0.14 2.72 -0.03 0.00 -1.74 0.00 0.00 68.15 69.24 2w2l h THR 322 CO -0.02 0.91 0.28 0.78 0.37 0.00 0.00 175.52 177.83 2w2l h ASN 323 N 0.01 0.94 0.36 4.18 -0.26 -0.37 -1.47 115.58 118.97 2w2l h ASN 323 Ca -0.02 -0.17 -0.26 0.00 -0.56 0.00 0.00 56.30 55.30 2w2l h ASN 323 Cb 1.66 -0.24 0.01 0.00 -1.06 0.00 0.00 38.32 38.68 2w2l h ASN 323 CO 0.13 0.86 -1.10 0.40 -1.06 0.00 0.00 177.43 176.65 2w2l h ILE 324 N 0.98 1.40 -0.45 2.81 2.04 -1.53 -2.73 117.51 120.02 2w2l h ILE 324 Ca 0.23 -2.61 -0.01 0.00 1.00 0.00 0.00 64.86 63.47 2w2l h ILE 324 Cb 0.20 2.63 -0.02 0.00 -0.74 0.00 0.00 36.82 38.89 2w2l h ILE 324 CO -0.02 0.78 0.24 -0.78 0.00 0.00 0.00 178.15 178.36 2w2l h ASP 325 N 0.20 0.58 0.36 1.72 1.82 -1.42 -1.69 116.42 117.99 2w2l h ASP 325 Ca -0.12 -0.11 -0.02 0.00 -0.39 0.00 0.00 57.03 56.39 2w2l h ASP 325 Cb 1.77 -0.15 0.00 0.00 0.68 0.00 0.00 39.33 41.63 2w2l h ASP 325 CO 0.19 0.52 -0.17 0.03 -1.61 0.00 0.00 179.24 178.20 2w2l h ARG 326 N 0.59 -0.46 0.00 0.28 3.08 -1.29 0.22 114.38 116.80 2w2l h ARG 326 Ca 0.16 0.03 -0.02 0.00 0.07 0.00 0.00 59.98 60.22 2w2l h ARG 326 Cb 0.08 0.11 -0.00 0.00 0.08 0.00 0.00 29.97 30.23 2w2l h ARG 326 CO -0.02 -0.21 -0.12 0.35 -1.07 0.00 0.00 179.97 178.90 2w2l h PHE 327 N -0.65 0.00 0.00 3.04 3.57 -1.38 -1.35 116.94 120.17 2w2l h PHE 327 Ca -0.05 0.00 -0.11 0.00 3.53 0.00 0.00 57.97 61.34 2w2l h PHE 327 Cb 0.47 0.00 -0.02 0.00 2.79 0.00 0.00 35.95 39.18 2w2l h PHE 327 CO -0.01 0.12 -1.42 1.28 -2.23 0.00 0.00 178.31 176.04 2w2l n LEU 328 N -4.24 0.12 -0.01 0.59 4.77 -0.64 -2.88 117.00 114.72 2w2l n LEU 328 Ca -0.03 -0.00 0.04 0.00 -0.03 0.00 0.00 56.01 55.99 2w2l n LEU 328 Cb 0.19 0.13 -0.07 0.00 -2.33 0.00 0.00 43.42 41.34 2w2l n LEU 328 CO 0.34 0.17 -0.62 0.18 -1.33 0.00 0.00 177.39 176.13 2w2l n LEU 329 N -2.25 0.00 -0.52 2.23 4.77 0.73 -3.88 117.00 118.08 2w2l n LEU 329 Ca -0.10 0.00 0.05 0.00 -0.03 0.00 0.00 56.01 55.93 2w2l n LEU 329 Cb 0.70 0.02 0.12 0.00 -2.33 0.00 0.00 43.42 41.92 2w2l n LEU 329 CO 0.13 0.02 0.58 0.00 -1.33 0.00 0.00 177.39 176.79 2w2l n GLN 330 N -1.86 2.55 -0.91 3.23 6.02 -0.57 -4.75 117.38 121.09 2w2l n GLN 330 Ca -0.03 -1.85 0.00 0.00 -0.01 0.00 0.00 57.00 55.11 2w2l n GLN 330 Cb 0.28 -1.22 0.00 0.00 1.02 0.00 0.00 30.24 30.32 2w2l n GLN 330 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2w2l n GLY 331 N 0.39 0.09 3.87 1.08 0.00 -0.90 -4.96 105.19 104.76 2w2l n GLY 331 Ca 0.09 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.84 2w2l n GLY 331 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2w2l s LYS 332 N -1.54 3.18 0.79 1.61 1.02 -0.86 -4.53 119.74 119.41 2w2l s LYS 332 Ca 0.00 -0.69 -0.11 0.00 0.02 0.00 0.00 55.97 55.19 2w2l s LYS 332 Cb 0.00 -2.83 0.08 0.00 -0.52 0.00 0.00 37.83 34.56 2w2l s LYS 332 CO 0.00 0.52 1.14 -1.25 -0.92 0.00 0.00 175.35 174.84 2w2l s PRO 333 N -3.04 1.93 0.81 -1.68 0.04 -1.26 -2.99 135.00 128.81 2w2l s PRO 333 Ca 0.33 -0.03 -0.13 0.00 0.04 0.00 0.00 61.00 61.20 2w2l s PRO 333 Cb -0.11 -2.00 0.08 0.00 0.04 0.00 0.00 34.50 32.51 2w2l s PRO 333 CO 0.26 -1.56 1.19 1.28 0.04 0.00 0.00 177.00 178.21 2w2l n LEU 334 N -3.24 4.38 0.07 -3.56 4.77 -1.26 -4.72 117.00 113.44 2w2l n LEU 334 Ca 0.09 0.59 -0.16 0.00 -0.03 0.00 0.00 56.01 56.49 2w2l n LEU 334 Cb 0.61 -1.51 -0.14 0.00 -2.33 0.00 0.00 43.42 40.05 2w2l n LEU 334 CO 0.55 -1.71 -0.28 -0.07 -1.33 0.00 0.00 177.39 174.54 2w2l h LEU 335 N -0.90 0.39 -5.85 2.23 3.38 -1.93 -3.41 115.31 109.22 2w2l h LEU 335 Ca -0.46 -0.51 -0.55 0.00 0.09 0.00 0.00 57.88 56.44 2w2l h LEU 335 Cb 1.30 -0.13 -0.41 0.00 0.09 0.00 0.00 40.66 41.52 2w2l h LEU 335 CO 0.46 1.42 -0.89 0.35 0.09 0.00 0.00 178.44 179.87 2w2l n THR 336 N -3.46 1.17 -1.41 0.22 -2.24 -1.26 -5.10 114.28 102.20 2w2l n THR 336 Ca -0.15 -4.87 -0.33 0.00 -2.27 0.00 0.00 64.05 56.43 2w2l n THR 336 Cb 1.04 -1.36 0.09 0.00 -2.10 0.00 0.00 70.33 67.99 2w2l n THR 336 CO 0.00 0.00 0.00 -2.16 -0.57 0.00 0.00 175.07 172.34 2w2l s PRO 337 N -2.45 2.27 -0.09 -0.78 0.04 -1.26 -2.25 135.00 130.47 2w2l s PRO 337 Ca 0.41 1.44 -0.04 0.00 0.04 0.00 0.00 61.00 62.86 2w2l s PRO 337 Cb 0.25 -1.88 0.05 0.00 0.04 0.00 0.00 34.50 32.95 2w2l s PRO 337 CO -0.09 -1.67 0.19 0.00 0.04 0.00 0.00 177.00 175.47 2w2l s ALA 338 N -2.44 -0.33 0.00 8.56 0.00 -0.67 -4.76 121.76 122.12 2w2l s ALA 338 Ca 0.67 0.74 0.00 0.00 0.00 0.00 0.00 51.96 53.37 2w2l s ALA 338 Cb -0.22 -0.71 0.00 0.00 0.00 0.00 0.00 23.12 22.20 2w2l s ALA 338 CO 0.48 -0.38 0.00 0.41 0.00 0.00 0.00 175.76 176.27 2w2l n GLY 339 N 4.78 0.33 3.73 0.00 0.00 -1.26 -4.43 105.19 108.34 2w2l n GLY 339 Ca -0.15 -1.77 -0.42 0.00 0.00 0.00 0.00 46.02 43.68 2w2l n GLY 339 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2w2l s LYS 340 N 0.00 4.22 0.04 1.61 3.01 -1.26 -5.02 119.74 122.35 2w2l s LYS 340 Ca 0.00 2.36 -0.21 0.00 -1.01 0.00 0.00 55.97 57.11 2w2l s LYS 340 Cb 0.00 -3.13 -0.06 0.00 -1.01 0.00 0.00 37.83 33.63 2w2l s LYS 340 CO 0.00 -0.55 0.61 0.08 0.51 0.00 0.00 175.35 175.99 2w2l s VAL 341 N 0.72 4.79 0.26 3.17 1.01 -1.26 -4.57 120.40 124.51 2w2l s VAL 341 Ca 0.66 1.29 0.07 0.00 0.00 0.00 0.00 61.98 64.00 2w2l s VAL 341 Cb -0.43 -3.94 -0.05 0.00 0.00 0.00 0.00 36.38 31.95 2w2l s VAL 341 CO 0.36 0.48 -0.08 -0.36 0.00 0.00 0.00 175.10 175.49 2w2l s PHE 342 N -0.63 1.90 0.26 5.22 0.40 -1.26 -5.11 117.98 118.75 2w2l s PHE 342 Ca 0.31 -0.66 -0.30 0.00 -0.60 0.00 0.00 56.93 55.69 2w2l s PHE 342 Cb -0.19 -1.02 -0.09 0.00 0.51 0.00 0.00 43.02 42.22 2w2l s PHE 342 CO 0.19 0.31 0.99 0.00 0.70 0.00 0.00 175.22 177.41 2w2l s ALA 343 N -2.99 3.35 1.00 5.36 0.00 -1.26 -4.91 121.76 122.31 2w2l s ALA 343 Ca 0.28 0.70 0.00 0.00 0.00 0.00 0.00 51.96 52.93 2w2l s ALA 343 Cb 0.02 -3.24 0.00 0.00 0.00 0.00 0.00 23.12 19.90 2w2l s ALA 343 CO 0.11 0.10 0.00 -0.35 0.00 0.00 0.00 175.76 175.61 2w2l n PRO 344 N 1.35 0.94 -3.56 0.00 -0.04 -1.26 -5.11 135.00 127.32 2w2l n PRO 344 Ca -0.02 0.00 -0.06 0.00 -0.04 0.00 0.00 63.50 63.39 2w2l n PRO 344 Cb 0.46 0.00 -0.02 0.00 -0.04 0.00 0.00 33.50 33.91 2w2l n PRO 344 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 2w2l s SER 345 N -1.39 -0.24 0.00 3.54 1.04 -1.14 -5.03 113.70 110.49 2w2l s SER 345 Ca 0.00 -0.03 0.00 0.00 0.48 0.00 0.00 55.95 56.40 2w2l s SER 345 Cb 0.00 0.28 0.00 0.00 0.10 0.00 0.00 66.02 66.40 2w2l s SER 345 CO 0.00 -0.45 0.00 -1.54 0.98 0.00 0.00 173.24 172.23