#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1c1x h ILE 2 N 0.00 0.80 0.14 -1.33 1.08 -1.97 0.18 117.51 116.41 1c1x h ILE 2 Ca 0.00 -0.29 0.02 0.00 -0.39 0.00 0.00 64.86 64.19 1c1x h ILE 2 Cb 0.00 -0.13 -0.05 0.00 -3.07 0.00 0.00 36.82 33.58 1c1x h ILE 2 CO 0.00 0.16 -0.44 0.44 -0.69 0.00 0.00 178.15 177.61 1c1x h ASP 3 N 0.86 -1.31 0.46 1.72 5.19 -2.01 0.66 116.42 121.99 1c1x h ASP 3 Ca 0.53 0.14 -0.12 0.00 -0.62 0.00 0.00 57.03 56.96 1c1x h ASP 3 Cb 0.69 0.49 -0.01 0.00 0.18 0.00 0.00 39.33 40.67 1c1x h ASP 3 CO -0.33 -0.51 -0.54 0.77 -3.12 0.00 0.00 179.24 175.51 1c1x h SER 4 N -0.69 0.10 0.69 6.45 4.64 -1.46 -1.13 113.55 122.15 1c1x h SER 4 Ca 0.01 -0.05 -0.04 0.00 -0.47 0.00 0.00 61.79 61.24 1c1x h SER 4 Cb 0.71 -0.03 -0.01 0.00 -0.31 0.00 0.00 62.40 62.76 1c1x h SER 4 CO -0.24 0.63 -0.18 0.00 -0.87 0.00 0.00 176.83 176.16 1c1x h ALA 5 N 1.38 1.12 -0.00 5.18 0.00 -0.17 -1.74 119.26 125.02 1c1x h ALA 5 Ca -0.00 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.74 1c1x h ALA 5 Cb 0.99 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.75 1c1x h ALA 5 CO 0.08 0.23 -0.03 1.28 0.00 0.00 0.00 179.25 180.80 1c1x n LEU 6 N -3.48 0.04 -0.90 0.00 4.77 0.22 -3.58 117.00 114.07 1c1x n LEU 6 Ca -0.01 0.45 -0.01 0.00 -0.03 0.00 0.00 56.01 56.41 1c1x n LEU 6 Cb 0.35 -0.47 0.03 0.00 -2.33 0.00 0.00 43.42 41.01 1c1x n LEU 6 CO 0.32 0.01 0.46 0.59 -1.33 0.00 0.00 177.39 177.43 1c1x n ASN 7 N -1.48 2.32 -4.78 -1.43 5.03 -0.65 -4.89 115.26 109.38 1c1x n ASN 7 Ca 0.07 -2.14 -0.37 0.00 0.87 0.00 0.00 54.58 53.02 1c1x n ASN 7 Cb 0.33 -0.53 -0.02 0.00 -1.02 0.00 0.00 39.78 38.54 1c1x n ASN 7 CO 0.00 0.00 0.00 0.86 -1.83 0.00 0.00 177.26 176.29 1c1x s TRP 8 N -0.78 3.02 -2.19 3.10 -0.00 -1.23 -4.96 118.94 115.89 1c1x s TRP 8 Ca 0.06 1.58 0.21 0.00 -0.00 0.00 0.00 56.10 57.95 1c1x s TRP 8 Cb 0.05 -3.26 0.54 0.00 -0.00 0.00 0.00 33.47 30.80 1c1x s TRP 8 CO 0.02 -1.13 1.46 -0.40 -0.00 0.00 0.00 176.95 176.89 1c1x n ASP 9 N -0.40 3.24 -4.15 5.86 3.85 -1.26 -4.97 116.55 118.70 1c1x n ASP 9 Ca 0.07 -1.97 -0.30 0.00 -0.71 0.00 0.00 54.79 51.88 1c1x n ASP 9 Cb 0.49 -0.33 0.21 0.00 -1.35 0.00 0.00 41.12 40.14 1c1x n ASP 9 CO 0.00 0.00 0.00 -0.83 -1.01 0.00 0.00 177.20 175.36 1c1x s GLY 10 N -1.22 1.60 0.24 6.12 0.00 -1.26 -4.97 107.32 107.82 1c1x s GLY 10 Ca 0.40 -0.81 -0.02 0.00 0.00 0.00 0.00 44.72 44.28 1c1x s GLY 10 CO 0.30 -0.04 1.68 0.83 0.00 0.00 0.00 173.10 175.86 1c1x h GLU 11 N -2.19 0.71 -1.67 2.90 5.08 -0.78 -3.47 114.58 115.16 1c1x h GLU 11 Ca -0.48 -0.26 0.04 0.00 -1.00 0.00 0.00 59.36 57.67 1c1x h GLU 11 Cb 1.30 -0.05 -0.23 0.00 0.50 0.00 0.00 28.75 30.27 1c1x h GLU 11 CO 0.43 0.85 0.43 1.41 -1.00 0.00 0.00 179.01 181.13 1c1x s MET 12 N -4.66 0.65 -0.09 2.33 0.00 -0.98 -5.01 119.30 111.55 1c1x s MET 12 Ca -0.09 0.39 0.04 0.00 0.00 0.00 0.00 55.69 56.03 1c1x s MET 12 Cb 0.13 0.31 0.00 0.00 0.00 0.00 0.00 34.83 35.28 1c1x s MET 12 CO 0.82 -0.16 -0.21 0.99 0.00 0.00 0.00 175.02 176.46 1c1x s THR 13 N -0.53 1.82 -0.11 10.11 2.01 -1.26 -0.30 115.64 127.38 1c1x s THR 13 Ca -0.01 -0.88 0.02 0.00 0.31 0.00 0.00 61.69 61.12 1c1x s THR 13 Cb -0.02 -1.59 -0.01 0.00 0.01 0.00 0.00 72.50 70.89 1c1x s THR 13 CO 0.00 0.51 -0.17 -0.69 -0.69 0.00 0.00 174.62 173.58 1c1x s VAL 14 N 0.41 2.72 0.15 3.82 1.01 0.14 -4.98 120.40 123.67 1c1x s VAL 14 Ca -0.18 -0.79 0.05 0.00 0.00 0.00 0.00 61.98 61.06 1c1x s VAL 14 Cb -0.17 -2.10 -0.04 0.00 0.00 0.00 0.00 36.38 34.06 1c1x s VAL 14 CO 0.08 0.54 -0.11 0.42 0.00 0.00 0.00 175.10 176.03 1c1x s THR 15 N 0.22 1.24 -0.09 3.92 -4.23 -1.26 -0.38 115.64 115.07 1c1x s THR 15 Ca -0.11 -2.04 -0.28 0.00 -1.18 0.00 0.00 61.69 58.08 1c1x s THR 15 Cb -0.16 -1.83 0.07 0.00 1.34 0.00 0.00 72.50 71.91 1c1x s THR 15 CO 0.06 -0.70 0.65 -0.60 -0.54 0.00 0.00 174.62 173.49 1c1x s ARG 16 N -3.63 0.98 -0.09 3.99 3.52 -0.61 -4.96 118.95 118.14 1c1x s ARG 16 Ca 0.16 0.35 0.02 0.00 -0.13 0.00 0.00 55.73 56.14 1c1x s ARG 16 Cb 0.01 0.46 0.01 0.00 -1.56 0.00 0.00 34.95 33.88 1c1x s ARG 16 CO 0.01 -0.27 -0.15 0.12 -0.81 0.00 0.00 175.30 174.20 1c1x s PHE 17 N -0.91 1.82 -0.45 5.12 2.19 -1.26 -0.30 117.98 124.19 1c1x s PHE 17 Ca -0.09 -0.76 -0.08 0.00 0.33 0.00 0.00 56.93 56.33 1c1x s PHE 17 Cb -0.01 -1.30 0.11 0.00 -1.31 0.00 0.00 43.02 40.50 1c1x s PHE 17 CO 0.08 -0.38 0.30 0.34 1.83 0.00 0.00 175.22 177.39 1c1x s ASP 18 N 0.77 5.59 0.19 6.13 3.68 -0.43 -4.98 116.67 127.62 1c1x s ASP 18 Ca -0.12 -1.86 -0.12 0.00 2.13 0.00 0.00 52.55 52.58 1c1x s ASP 18 Cb -0.16 -1.97 0.21 0.00 -1.45 0.00 0.00 42.92 39.56 1c1x s ASP 18 CO 0.02 -0.63 1.72 0.28 0.13 0.00 0.00 175.17 176.69 1c1x h SER 19 N 8.36 0.05 -0.69 -0.34 0.02 -1.93 0.54 113.55 119.55 1c1x h SER 19 Ca -0.20 0.09 0.14 0.00 -0.84 0.00 0.00 61.79 60.98 1c1x h SER 19 Cb 1.07 0.11 -0.10 0.00 0.14 0.00 0.00 62.40 63.62 1c1x h SER 19 CO 0.81 0.05 0.18 -0.03 -1.14 0.00 0.00 176.83 176.70 1c1x h MET 20 N 0.27 0.29 0.00 3.45 1.85 -1.97 -2.30 114.93 116.53 1c1x h MET 20 Ca 0.26 -0.02 0.00 0.00 -0.61 0.00 0.00 59.70 59.34 1c1x h MET 20 Cb 0.35 -0.07 0.00 0.00 0.43 0.00 0.00 31.60 32.31 1c1x h MET 20 CO -0.33 0.19 -1.50 0.25 -0.40 0.00 0.00 176.91 175.13 1c1x n THR 21 N -5.12 0.19 -1.03 -0.77 -2.24 -1.05 -4.98 114.28 99.29 1c1x n THR 21 Ca 0.12 -0.43 -0.01 0.00 -2.27 0.00 0.00 64.05 61.46 1c1x n THR 21 Cb 0.40 0.01 -0.00 0.00 -2.10 0.00 0.00 70.33 68.64 1c1x n THR 21 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1c1x n GLY 22 N 1.27 0.47 3.82 3.38 0.00 0.19 -4.74 105.19 109.57 1c1x n GLY 22 Ca -0.01 -0.19 -0.34 0.00 0.00 0.00 0.00 46.02 45.47 1c1x n GLY 22 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1c1x s ALA 23 N -1.88 3.19 0.05 4.61 0.00 -1.17 -4.46 121.76 122.11 1c1x s ALA 23 Ca 0.00 0.28 0.05 0.00 0.00 0.00 0.00 51.96 52.30 1c1x s ALA 23 Cb 0.00 -3.00 -0.04 0.00 0.00 0.00 0.00 23.12 20.08 1c1x s ALA 23 CO 0.00 0.22 -0.10 -1.01 0.00 0.00 0.00 175.76 174.87 1c1x s HIS 24 N -1.96 2.77 -0.05 0.00 3.76 -0.76 -1.32 115.29 117.74 1c1x s HIS 24 Ca 0.56 -0.13 0.05 0.00 -0.15 0.00 0.00 55.06 55.39 1c1x s HIS 24 Cb -0.12 -1.51 -0.01 0.00 1.11 0.00 0.00 32.58 32.05 1c1x s HIS 24 CO 0.17 0.37 -0.20 -0.06 -0.85 0.00 0.00 174.74 174.17 1c1x s PHE 25 N -1.07 2.00 -0.03 1.40 0.40 0.59 -0.70 117.98 120.56 1c1x s PHE 25 Ca 0.18 -0.57 0.02 0.00 -0.60 0.00 0.00 56.93 55.96 1c1x s PHE 25 Cb -0.11 -1.33 0.01 0.00 0.51 0.00 0.00 43.02 42.10 1c1x s PHE 25 CO 0.10 -0.18 -0.06 0.08 0.70 0.00 0.00 175.22 175.85 1c1x s VAL 26 N -0.06 0.60 -0.10 -0.44 1.01 -0.11 -1.58 120.40 119.72 1c1x s VAL 26 Ca -0.03 -0.23 0.01 0.00 0.00 0.00 0.00 61.98 61.73 1c1x s VAL 26 Cb -0.12 -0.57 0.02 0.00 0.00 0.00 0.00 36.38 35.71 1c1x s VAL 26 CO 0.03 0.21 -0.11 -0.63 0.00 0.00 0.00 175.10 174.60 1c1x s ILE 27 N 0.44 1.18 -0.15 2.22 1.01 0.48 -0.35 121.20 126.04 1c1x s ILE 27 Ca -0.06 -0.44 0.01 0.00 0.00 0.00 0.00 60.65 60.17 1c1x s ILE 27 Cb -0.10 -1.13 0.00 0.00 0.01 0.00 0.00 42.46 41.25 1c1x s ILE 27 CO 0.00 0.38 -0.18 -0.13 0.00 0.00 0.00 174.94 175.01 1c1x s ARG 28 N 1.21 3.13 -0.42 2.79 0.52 -0.13 0.23 118.95 126.28 1c1x s ARG 28 Ca -0.04 -0.80 -0.10 0.00 -0.52 0.00 0.00 55.73 54.28 1c1x s ARG 28 Cb -0.14 -2.53 0.07 0.00 0.52 0.00 0.00 34.95 32.87 1c1x s ARG 28 CO -0.03 0.01 0.27 -0.51 0.02 0.00 0.00 175.30 175.06 1c1x s LEU 29 N 0.79 5.16 0.00 2.53 1.43 0.59 -0.99 118.68 128.19 1c1x s LEU 29 Ca -0.07 -1.46 -0.22 0.00 -1.03 0.00 0.00 54.13 51.36 1c1x s LEU 29 Cb -0.16 -2.00 -0.18 0.00 0.03 0.00 0.00 46.19 43.88 1c1x s LEU 29 CO -0.00 -0.54 1.22 -0.78 0.23 0.00 0.00 176.35 176.48 1c1x h ASP 30 N 8.43 0.31 -4.65 2.29 3.58 -0.79 -0.81 116.42 124.79 1c1x h ASP 30 Ca -0.23 -0.59 -0.10 0.00 0.42 0.00 0.00 57.03 56.52 1c1x h ASP 30 Cb 1.09 -0.09 -0.21 0.00 1.72 0.00 0.00 39.33 41.84 1c1x h ASP 30 CO 0.76 0.85 -0.10 -0.55 -2.88 0.00 0.00 179.24 177.32 1c1x s SER 31 N -6.20 -0.42 -0.08 2.28 0.15 -1.08 -2.37 113.70 105.98 1c1x s SER 31 Ca -0.15 0.55 0.11 0.00 0.70 0.00 0.00 55.95 57.17 1c1x s SER 31 Cb 0.03 0.60 0.17 0.00 -1.71 0.00 0.00 66.02 65.12 1c1x s SER 31 CO 0.75 -0.40 1.08 0.35 1.20 0.00 0.00 173.24 176.21 1c1x n THR 32 N 1.67 1.45 -0.12 6.45 -2.24 -1.26 -1.57 114.28 118.66 1c1x n THR 32 Ca -0.18 -1.68 -0.07 0.00 -2.27 0.00 0.00 64.05 59.85 1c1x n THR 32 Cb 0.56 0.07 0.02 0.00 -2.10 0.00 0.00 70.33 68.88 1c1x n THR 32 CO 0.00 0.00 0.00 -0.61 -0.57 0.00 0.00 175.07 173.89 1c1x h GLN 33 N 0.00 0.43 0.00 -0.78 4.15 -1.94 -3.05 115.11 113.91 1c1x h GLN 33 Ca 0.00 -0.03 0.00 0.00 0.77 0.00 0.00 58.65 59.39 1c1x h GLN 33 Cb 0.86 -0.10 0.00 0.00 0.21 0.00 0.00 27.48 28.46 1c1x h GLN 33 CO 0.00 0.28 -0.43 1.28 -1.93 0.00 0.00 178.83 178.04 1c1x n LEU 34 N -4.89 0.64 0.00 -2.39 4.77 -1.26 -5.01 117.00 108.85 1c1x n LEU 34 Ca 0.01 0.29 0.00 0.00 -0.03 0.00 0.00 56.01 56.28 1c1x n LEU 34 Cb 0.08 -0.25 0.00 0.00 -2.33 0.00 0.00 43.42 40.92 1c1x n LEU 34 CO 0.31 -0.05 0.00 0.61 -1.33 0.00 0.00 177.39 176.93 1c1x n GLY 35 N 1.37 -1.99 3.71 -0.72 0.00 -1.15 -3.66 105.19 102.74 1c1x n GLY 35 Ca 0.04 -1.19 -0.36 0.00 0.00 0.00 0.00 46.02 44.51 1c1x n GLY 35 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1c1x n PRO 36 N -0.42 0.85 -2.38 1.61 -0.02 -1.26 -2.35 135.00 131.04 1c1x n PRO 36 Ca 0.00 0.35 -0.38 0.00 -2.02 0.00 0.00 63.50 61.46 1c1x n PRO 36 Cb 0.00 -2.47 -0.03 0.00 -0.02 0.00 0.00 33.50 30.98 1c1x n PRO 36 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1c1x s ALA 37 N -1.58 3.12 -0.03 3.55 0.00 -0.08 0.14 121.76 126.88 1c1x s ALA 37 Ca 0.80 0.88 -0.06 0.00 0.00 0.00 0.00 51.96 53.57 1c1x s ALA 37 Cb -0.36 -3.34 0.01 0.00 0.00 0.00 0.00 23.12 19.42 1c1x s ALA 37 CO 0.43 -0.43 0.15 0.00 0.00 0.00 0.00 175.76 175.91 1c1x s ALA 38 N -1.49 -0.35 0.00 0.00 0.00 -0.75 -0.96 121.76 118.20 1c1x s ALA 38 Ca 0.58 0.17 0.00 0.00 0.00 0.00 0.00 51.96 52.71 1c1x s ALA 38 Cb -0.28 -0.09 0.00 0.00 0.00 0.00 0.00 23.12 22.75 1c1x s ALA 38 CO 0.35 -0.14 0.00 0.41 0.00 0.00 0.00 175.76 176.38 1c1x n GLY 39 N 2.29 1.22 3.69 0.00 0.00 -1.00 -1.64 105.19 109.75 1c1x n GLY 39 Ca -0.17 -0.55 -0.30 0.00 0.00 0.00 0.00 46.02 45.00 1c1x n GLY 39 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1c1x s GLY 40 N 0.00 1.61 -0.25 -0.02 0.00 -1.26 -3.33 107.32 104.07 1c1x s GLY 40 Ca 0.00 -0.81 -0.05 0.00 0.00 0.00 0.00 44.72 43.86 1c1x s GLY 40 CO 0.00 -0.05 0.01 -1.59 0.00 0.00 0.00 173.10 171.47 1c1x s THR 41 N -3.18 3.65 -0.16 0.90 2.01 -0.18 -1.69 115.64 116.99 1c1x s THR 41 Ca 0.69 -0.55 -0.07 0.00 0.31 0.00 0.00 61.69 62.08 1c1x s THR 41 Cb -0.11 -2.75 -0.04 0.00 0.01 0.00 0.00 72.50 69.60 1c1x s THR 41 CO 0.55 0.29 0.07 -0.60 -0.69 0.00 0.00 174.62 174.24 1c1x s ARG 42 N 1.49 3.81 -0.11 4.92 3.52 -0.30 -2.95 118.95 129.32 1c1x s ARG 42 Ca 0.04 -0.31 0.02 0.00 -0.13 0.00 0.00 55.73 55.35 1c1x s ARG 42 Cb -0.15 -3.18 0.01 0.00 -1.56 0.00 0.00 34.95 30.07 1c1x s ARG 42 CO -0.01 0.40 -0.18 0.00 -0.81 0.00 0.00 175.30 174.70 1c1x s ALA 43 N 0.03 1.86 0.20 6.12 0.00 -0.35 -0.03 121.76 129.58 1c1x s ALA 43 Ca 0.06 -0.83 -0.23 0.00 0.00 0.00 0.00 51.96 50.97 1c1x s ALA 43 Cb -0.12 -0.85 0.06 0.00 0.00 0.00 0.00 23.12 22.21 1c1x s ALA 43 CO 0.01 -0.00 0.94 0.00 0.00 0.00 0.00 175.76 176.70 1c1x s ALA 44 N 0.83 -1.49 0.15 0.00 0.00 -0.78 -4.49 121.76 115.99 1c1x s ALA 44 Ca -0.09 -0.13 -0.12 0.00 0.00 0.00 0.00 51.96 51.62 1c1x s ALA 44 Cb -0.16 0.70 -0.07 0.00 0.00 0.00 0.00 23.12 23.59 1c1x s ALA 44 CO 0.00 -1.04 0.51 -0.65 0.00 0.00 0.00 175.76 174.58 1c1x s GLN 45 N -2.97 3.88 0.05 0.00 -0.21 -1.26 -1.06 119.66 118.08 1c1x s GLN 45 Ca 0.15 0.35 0.04 0.00 0.02 0.00 0.00 55.36 55.92 1c1x s GLN 45 Cb -0.03 -2.88 -0.02 0.00 1.00 0.00 0.00 33.01 31.08 1c1x s GLN 45 CO 0.05 0.46 -0.12 0.71 -2.12 0.00 0.00 175.29 174.27 1c1x s TYR 46 N -1.54 1.00 0.11 0.91 1.51 -1.26 -4.95 117.35 113.13 1c1x s TYR 46 Ca 0.39 -0.43 -0.15 0.00 -1.01 0.00 0.00 57.07 55.87 1c1x s TYR 46 Cb -0.14 -0.58 -0.06 0.00 -0.11 0.00 0.00 41.96 41.07 1c1x s TYR 46 CO 0.20 0.00 1.47 0.77 -1.11 0.00 0.00 175.55 176.88 1c1x h SER 47 N 4.60 0.73 -4.93 2.29 0.02 -1.98 -3.45 113.55 110.82 1c1x h SER 47 Ca -0.38 -0.42 -0.19 0.00 -0.84 0.00 0.00 61.79 59.96 1c1x h SER 47 Cb 1.19 -0.20 -0.19 0.00 0.14 0.00 0.00 62.40 63.34 1c1x h SER 47 CO 0.42 0.99 -0.70 0.20 -1.14 0.00 0.00 176.83 176.59 1c1x s ASN 48 N -6.43 0.58 0.34 3.07 -0.87 -1.26 -5.02 114.94 105.34 1c1x s ASN 48 Ca -0.13 -0.70 0.05 0.00 -1.57 0.00 0.00 52.86 50.52 1c1x s ASN 48 Cb 0.09 0.11 0.69 0.00 -0.02 0.00 0.00 41.25 42.12 1c1x s ASN 48 CO 0.82 -0.37 1.92 0.25 -2.57 0.00 0.00 177.10 177.15 1c1x h LEU 49 N 4.04 0.74 -1.38 0.60 5.85 -2.01 -1.01 115.31 122.14 1c1x h LEU 49 Ca -0.34 0.01 0.12 0.00 0.84 0.00 0.00 57.88 58.51 1c1x h LEU 49 Cb 1.19 -0.14 -0.06 0.00 0.37 0.00 0.00 40.66 42.01 1c1x h LEU 49 CO 0.50 0.46 0.53 0.00 -0.34 0.00 0.00 178.44 179.58 1c1x h ALA 50 N 1.57 1.85 -0.28 1.25 0.00 -1.95 0.37 119.26 122.07 1c1x h ALA 50 Ca 0.37 -0.00 -0.13 0.00 0.00 0.00 0.00 54.91 55.15 1c1x h ALA 50 Cb 0.34 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 1c1x h ALA 50 CO -0.14 -0.04 -0.36 -0.44 0.00 0.00 0.00 179.25 178.28 1c1x h ASP 51 N 0.66 0.65 -0.62 0.00 3.45 -1.58 0.69 116.42 119.67 1c1x h ASP 51 Ca 0.38 -0.27 -0.09 0.00 0.43 0.00 0.00 57.03 57.48 1c1x h ASP 51 Cb 0.59 -0.18 -0.02 0.00 -0.56 0.00 0.00 39.33 39.15 1c1x h ASP 51 CO -0.15 0.95 0.04 0.00 -1.57 0.00 0.00 179.24 178.51 1c1x h ALA 52 N 1.09 0.88 -0.31 3.45 0.00 -0.89 0.60 119.26 124.08 1c1x h ALA 52 Ca 0.05 -0.30 -0.05 0.00 0.00 0.00 0.00 54.91 54.61 1c1x h ALA 52 Cb 0.86 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.40 1c1x h ALA 52 CO 0.07 0.67 -0.01 -0.07 0.00 0.00 0.00 179.25 179.91 1c1x h LEU 53 N 1.00 0.55 -0.48 0.00 3.38 -0.87 0.72 115.31 119.61 1c1x h LEU 53 Ca 0.18 -0.32 0.01 0.00 0.09 0.00 0.00 57.88 57.85 1c1x h LEU 53 Cb 0.51 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 41.09 1c1x h LEU 53 CO 0.02 0.74 0.30 0.74 0.09 0.00 0.00 178.44 180.33 1c1x h THR 54 N 0.35 1.09 -0.11 0.22 2.02 -0.64 -0.95 112.91 114.89 1c1x h THR 54 Ca 0.09 -0.21 -0.00 0.00 0.77 0.00 0.00 66.41 67.06 1c1x h THR 54 Cb 0.46 0.43 -0.01 0.00 -1.74 0.00 0.00 68.15 67.29 1c1x h THR 54 CO 0.02 0.11 0.07 -0.78 0.37 0.00 0.00 175.52 175.31 1c1x h ASP 55 N 0.61 0.14 -0.91 4.18 1.82 -0.79 -1.26 116.42 120.21 1c1x h ASP 55 Ca 0.18 -0.05 0.09 0.00 -0.39 0.00 0.00 57.03 56.86 1c1x h ASP 55 Cb -0.04 -0.03 -0.07 0.00 0.68 0.00 0.00 39.33 39.87 1c1x h ASP 55 CO -0.06 0.15 0.56 0.00 -1.61 0.00 0.00 179.24 178.28 1c1x h ALA 56 N 1.00 1.30 -0.47 -0.78 0.00 -0.40 0.15 119.26 120.05 1c1x h ALA 56 Ca 0.04 0.01 -0.06 0.00 0.00 0.00 0.00 54.91 54.90 1c1x h ALA 56 Cb 0.04 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.60 1c1x h ALA 56 CO -0.01 0.23 0.06 0.78 0.00 0.00 0.00 179.25 180.31 1c1x h GLY 57 N 0.95 0.86 1.29 0.00 0.00 -0.78 0.24 103.07 105.63 1c1x h GLY 57 Ca 0.42 -0.59 -0.19 0.00 0.00 0.00 0.00 47.33 46.98 1c1x h GLY 57 CO -0.22 0.54 -0.61 0.50 0.00 0.00 0.00 176.54 176.75 1c1x h LYS 58 N 0.66 0.73 -0.39 4.80 1.57 -0.65 -0.45 116.57 122.84 1c1x h LYS 58 Ca 0.14 -0.50 -0.13 0.00 -1.87 0.00 0.00 60.65 58.29 1c1x h LYS 58 Cb 0.42 0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.79 1c1x h LYS 58 CO 0.01 1.12 -0.29 -0.07 -0.57 0.00 0.00 179.45 179.66 1c1x h LEU 59 N 0.55 0.87 -0.56 2.94 3.38 -0.58 -1.46 115.31 120.46 1c1x h LEU 59 Ca -0.00 -0.35 -0.04 0.00 0.09 0.00 0.00 57.88 57.57 1c1x h LEU 59 Cb 1.20 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 41.69 1c1x h LEU 59 CO 0.13 1.10 0.18 0.00 0.09 0.00 0.00 178.44 179.93 1c1x h ALA 60 N 0.96 0.73 -0.40 1.53 0.00 -0.40 -1.46 119.26 120.21 1c1x h ALA 60 Ca 0.08 -0.19 -0.09 0.00 0.00 0.00 0.00 54.91 54.72 1c1x h ALA 60 Cb 0.83 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.39 1c1x h ALA 60 CO 0.07 0.39 -0.10 0.78 0.00 0.00 0.00 179.25 180.39 1c1x h GLY 61 N 0.77 0.77 1.57 0.00 0.00 -0.94 -1.49 103.07 103.76 1c1x h GLY 61 Ca 0.18 -0.56 -0.08 0.00 0.00 0.00 0.00 47.33 46.88 1c1x h GLY 61 CO -0.01 0.51 -0.14 0.00 0.00 0.00 0.00 176.54 176.91 1c1x h ALA 62 N 1.24 1.21 -0.44 3.60 0.00 -0.99 -2.48 119.26 121.40 1c1x h ALA 62 Ca 0.11 -0.28 -0.07 0.00 0.00 0.00 0.00 54.91 54.67 1c1x h ALA 62 Cb 0.55 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.18 1c1x h ALA 62 CO 0.03 0.51 -0.01 0.52 0.00 0.00 0.00 179.25 180.31 1c1x h MET 63 N 0.47 0.73 -0.16 0.00 2.86 -0.49 0.71 114.93 119.05 1c1x h MET 63 Ca 0.09 -0.19 0.03 0.00 -2.06 0.00 0.00 59.70 57.56 1c1x h MET 63 Cb 0.52 -0.09 -0.03 0.00 0.06 0.00 0.00 31.60 32.07 1c1x h MET 63 CO 0.03 0.74 -0.01 1.15 1.06 0.00 0.00 176.91 179.89 1c1x h THR 64 N 0.68 0.88 -0.38 2.22 2.02 -0.85 -1.39 112.91 116.09 1c1x h THR 64 Ca 0.14 -0.01 -0.12 0.00 0.77 0.00 0.00 66.41 67.18 1c1x h THR 64 Cb 0.43 0.84 -0.01 0.00 -1.74 0.00 0.00 68.15 67.66 1c1x h THR 64 CO 0.02 0.01 -0.26 -0.07 0.37 0.00 0.00 175.52 175.58 1c1x h LEU 65 N 0.04 0.81 -0.39 2.58 3.38 -1.26 -2.50 115.31 117.96 1c1x h LEU 65 Ca 0.07 -0.31 0.04 0.00 0.09 0.00 0.00 57.88 57.78 1c1x h LEU 65 Cb 0.09 -0.22 -0.04 0.00 0.09 0.00 0.00 40.66 40.58 1c1x h LEU 65 CO -0.13 1.03 0.16 0.50 0.09 0.00 0.00 178.44 180.08 1c1x h LYS 66 N 0.68 0.32 -0.22 1.13 3.64 -0.45 0.38 116.57 122.05 1c1x h LYS 66 Ca 0.09 -0.02 -0.03 0.00 -1.27 0.00 0.00 60.65 59.42 1c1x h LYS 66 Cb 0.79 -0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 32.52 1c1x h LYS 66 CO 0.06 0.21 0.03 0.52 -2.27 0.00 0.00 179.45 178.01 1c1x h MET 67 N 0.33 0.36 0.32 1.90 2.86 -1.23 -0.79 114.93 118.68 1c1x h MET 67 Ca 0.18 -0.10 -0.00 0.00 -2.06 0.00 0.00 59.70 57.72 1c1x h MET 67 Cb 0.13 -0.04 -0.02 0.00 0.06 0.00 0.00 31.60 31.73 1c1x h MET 67 CO -0.16 0.51 -0.29 0.00 1.06 0.00 0.00 176.91 178.02 1c1x h ALA 68 N 0.84 -0.64 0.00 6.32 0.00 -1.15 0.22 119.26 124.85 1c1x h ALA 68 Ca 0.07 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1c1x h ALA 68 Cb 0.32 0.41 0.00 0.00 0.00 0.00 0.00 17.79 18.53 1c1x h ALA 68 CO 0.00 -0.89 0.00 -0.24 0.00 0.00 0.00 179.25 178.13 1c1x h VAL 69 N -0.64 0.00 -0.52 0.00 3.04 -0.24 -2.11 116.25 115.79 1c1x h VAL 69 Ca -0.02 -0.39 0.00 0.00 -1.01 0.00 0.00 66.70 65.28 1c1x h VAL 69 Cb 0.57 1.38 0.00 0.00 -2.01 0.00 0.00 31.29 31.23 1c1x h VAL 69 CO -0.04 0.00 0.00 -1.20 -1.01 0.00 0.00 177.57 175.32 1c1x n SER 70 N -3.06 3.66 -2.92 3.17 7.64 -0.31 -4.95 113.62 116.85 1c1x n SER 70 Ca -0.00 -1.99 -0.20 0.00 1.01 0.00 0.00 58.87 57.68 1c1x n SER 70 Cb 0.25 -0.34 0.05 0.00 -1.01 0.00 0.00 64.21 63.16 1c1x n SER 70 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 1c1x n ASN 71 N 1.55 -5.67 -4.59 6.43 5.03 -0.31 -5.00 115.26 112.70 1c1x n ASN 71 Ca 0.21 -0.36 -0.34 0.00 0.87 0.00 0.00 54.58 54.96 1c1x n ASN 71 Cb 0.61 -4.39 -0.11 0.00 -1.02 0.00 0.00 39.78 34.88 1c1x n ASN 71 CO 0.00 0.00 0.00 -0.76 -1.83 0.00 0.00 177.26 174.67 1c1x s LEU 72 N -6.16 3.54 -1.58 3.41 1.43 0.62 -5.01 118.68 114.94 1c1x s LEU 72 Ca 0.39 0.01 -0.10 0.00 -1.03 0.00 0.00 54.13 53.41 1c1x s LEU 72 Cb -0.17 -1.86 -0.08 0.00 0.03 0.00 0.00 46.19 44.10 1c1x s LEU 72 CO 0.49 0.22 2.89 -0.81 0.23 0.00 0.00 176.35 179.36 1c1x n PRO 73 N 3.22 3.58 -4.00 1.29 -0.04 -1.26 -4.35 135.00 133.43 1c1x n PRO 73 Ca -0.17 -2.18 -0.08 0.00 -0.04 0.00 0.00 63.50 61.03 1c1x n PRO 73 Cb 0.53 -2.80 -0.09 0.00 -0.04 0.00 0.00 33.50 31.09 1c1x n PRO 73 CO 0.00 0.00 0.00 -1.64 -0.04 0.00 0.00 175.50 173.82 1c1x s MET 74 N 2.29 0.67 0.17 0.54 -1.94 -1.24 -4.12 119.30 115.67 1c1x s MET 74 Ca 0.67 -1.08 -0.01 0.00 -1.71 0.00 0.00 55.69 53.56 1c1x s MET 74 Cb 0.17 0.25 0.03 0.00 2.01 0.00 0.00 34.83 37.30 1c1x s MET 74 CO -0.06 -0.16 0.23 0.41 -0.01 0.00 0.00 175.02 175.43 1c1x n GLY 75 N 0.15 0.43 3.26 -0.03 0.00 0.12 -4.36 105.19 104.76 1c1x n GLY 75 Ca -0.15 -1.93 -0.32 0.00 0.00 0.00 0.00 46.02 43.63 1c1x n GLY 75 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1c1x s GLY 76 N -3.08 1.33 0.26 -0.02 0.00 -0.61 -1.81 107.32 103.40 1c1x s GLY 76 Ca 0.15 -1.00 -0.09 0.00 0.00 0.00 0.00 44.72 43.77 1c1x s GLY 76 CO 0.10 -0.48 0.43 -0.32 0.00 0.00 0.00 173.10 172.83 1c1x s GLY 77 N 0.08 0.84 -0.10 0.20 0.00 -0.65 -0.14 107.32 107.55 1c1x s GLY 77 Ca -0.11 -1.12 -0.30 0.00 0.00 0.00 0.00 44.72 43.20 1c1x s GLY 77 CO 0.06 -0.81 0.74 1.25 0.00 0.00 0.00 173.10 174.34 1c1x s LYS 78 N -3.84 0.95 0.04 2.90 2.47 -0.16 -3.10 119.74 119.00 1c1x s LYS 78 Ca 0.26 0.34 0.09 0.00 -1.56 0.00 0.00 55.97 55.10 1c1x s LYS 78 Cb 0.01 0.45 -0.03 0.00 -1.46 0.00 0.00 37.83 36.80 1c1x s LYS 78 CO 0.11 -0.27 -0.24 -1.12 0.16 0.00 0.00 175.35 173.99 1c1x s SER 79 N -0.95 3.37 -0.08 1.43 0.01 -0.68 -0.96 113.70 115.84 1c1x s SER 79 Ca -0.08 -0.53 0.00 0.00 1.31 0.00 0.00 55.95 56.65 1c1x s SER 79 Cb -0.01 -0.39 0.02 0.00 0.21 0.00 0.00 66.02 65.85 1c1x s SER 79 CO 0.07 0.26 -0.05 -0.69 0.41 0.00 0.00 173.24 173.24 1c1x s VAL 80 N -0.84 0.75 -0.30 3.43 1.01 0.53 -1.15 120.40 123.83 1c1x s VAL 80 Ca 0.13 -0.17 -0.08 0.00 0.00 0.00 0.00 61.98 61.85 1c1x s VAL 80 Cb -0.10 -0.79 -0.00 0.00 0.00 0.00 0.00 36.38 35.49 1c1x s VAL 80 CO 0.03 0.30 0.12 -0.63 0.00 0.00 0.00 175.10 174.92 1c1x s ILE 81 N 1.43 4.34 -0.53 2.22 1.01 0.95 -0.94 121.20 129.68 1c1x s ILE 81 Ca -0.02 -0.52 -0.23 0.00 0.00 0.00 0.00 60.65 59.88 1c1x s ILE 81 Cb -0.13 -3.21 0.04 0.00 0.01 0.00 0.00 42.46 39.17 1c1x s ILE 81 CO -0.04 0.08 0.86 0.00 0.00 0.00 0.00 174.94 175.84 1c1x s ALA 82 N 1.57 3.22 0.40 9.38 0.00 0.12 -1.86 121.76 134.59 1c1x s ALA 82 Ca 0.04 -1.33 -0.25 0.00 0.00 0.00 0.00 51.96 50.42 1c1x s ALA 82 Cb -0.17 -3.63 -0.08 0.00 0.00 0.00 0.00 23.12 19.24 1c1x s ALA 82 CO 0.05 -2.26 1.20 -0.51 0.00 0.00 0.00 175.76 174.23 1c1x s LEU 83 N 3.60 4.20 0.09 0.00 1.43 -0.22 -1.83 118.68 125.94 1c1x s LEU 83 Ca 0.27 2.41 0.27 0.00 -1.03 0.00 0.00 54.13 56.05 1c1x s LEU 83 Cb -0.14 -3.99 1.03 0.00 0.03 0.00 0.00 46.19 43.12 1c1x s LEU 83 CO 0.18 -0.71 1.83 -0.81 0.23 0.00 0.00 176.35 177.07 1c1x n PRO 84 N 0.10 0.10 -3.82 1.29 -0.04 -1.26 -4.59 135.00 126.78 1c1x n PRO 84 Ca 0.04 0.12 -0.06 0.00 -0.04 0.00 0.00 63.50 63.56 1c1x n PRO 84 Cb 0.46 -1.63 -0.00 0.00 -0.04 0.00 0.00 33.50 32.29 1c1x n PRO 84 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1c1x s ALA 85 N -3.05 -1.24 0.39 0.55 0.00 -1.26 -5.09 121.76 112.05 1c1x s ALA 85 Ca 0.12 -0.33 -0.27 0.00 0.00 0.00 0.00 51.96 51.47 1c1x s ALA 85 Cb 0.15 0.74 -0.10 0.00 0.00 0.00 0.00 23.12 23.92 1c1x s ALA 85 CO 0.52 -1.03 1.40 -2.14 0.00 0.00 0.00 175.76 174.51 1c1x s PRO 86 N -3.09 4.05 0.35 0.00 0.02 -1.26 -4.74 135.00 130.33 1c1x s PRO 86 Ca 0.14 2.38 0.15 0.00 0.02 0.00 0.00 61.00 63.68 1c1x s PRO 86 Cb -0.04 -2.89 1.13 0.00 0.02 0.00 0.00 34.50 32.72 1c1x s PRO 86 CO 0.07 -0.50 1.61 -0.09 -0.33 0.00 0.00 177.00 177.76 1c1x h ARG 87 N 2.89 0.12 0.00 5.54 9.65 -1.97 0.13 114.38 130.74 1c1x h ARG 87 Ca -0.50 -0.01 0.00 0.00 -1.10 0.00 0.00 59.98 58.37 1c1x h ARG 87 Cb 1.24 -0.03 0.00 0.00 -1.39 0.00 0.00 29.97 29.80 1c1x h ARG 87 CO 0.63 0.08 0.00 0.45 2.80 0.00 0.00 179.97 183.94 1c1x h HIS 88 N 0.13 0.00 -0.00 2.20 3.86 -2.02 -2.99 115.15 116.32 1c1x h HIS 88 Ca 0.75 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.96 1c1x h HIS 88 Cb 1.83 0.00 0.00 0.00 1.06 0.00 0.00 27.41 30.30 1c1x h HIS 88 CO -0.10 0.00 -0.30 -1.13 0.86 0.00 0.00 177.93 177.26 1c1x n SER 89 N -2.75 0.50 -4.66 2.45 3.41 0.43 -4.88 113.62 108.12 1c1x n SER 89 Ca 0.04 -0.29 -0.42 0.00 -0.26 0.00 0.00 58.87 57.94 1c1x n SER 89 Cb 0.44 0.04 -0.04 0.00 -0.26 0.00 0.00 64.21 64.39 1c1x n SER 89 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 1c1x s ILE 90 N -2.82 4.82 0.71 -1.33 1.01 -1.13 -4.98 121.20 117.48 1c1x s ILE 90 Ca 0.17 1.73 -0.14 0.00 0.00 0.00 0.00 60.65 62.41 1c1x s ILE 90 Cb 0.19 -4.18 0.03 0.00 0.01 0.00 0.00 42.46 38.50 1c1x s ILE 90 CO 0.60 -0.04 1.12 1.51 0.00 0.00 0.00 174.94 178.13 1c1x s ASP 91 N 1.21 4.73 0.44 3.58 1.47 -1.26 -4.76 116.67 122.06 1c1x s ASP 91 Ca 0.39 2.03 0.12 0.00 1.18 0.00 0.00 52.55 56.27 1c1x s ASP 91 Cb -0.16 -2.55 1.00 0.00 -0.34 0.00 0.00 42.92 40.87 1c1x s ASP 91 CO 0.10 -1.89 2.02 -0.65 0.68 0.00 0.00 175.17 175.43 1c1x h PRO 92 N -0.36 0.40 -0.39 2.11 0.11 -1.99 -0.50 132.00 131.40 1c1x h PRO 92 Ca -0.46 -0.02 -0.12 0.00 0.11 0.00 0.00 66.00 65.51 1c1x h PRO 92 Cb 1.25 -0.09 -0.01 0.00 0.11 0.00 0.00 31.00 32.26 1c1x h PRO 92 CO 0.52 0.27 -0.22 0.77 -0.21 0.00 0.00 178.00 179.13 1c1x h SER 93 N 0.42 0.86 -0.35 -2.05 0.02 -1.99 0.58 113.55 111.04 1c1x h SER 93 Ca 0.22 -0.42 -0.02 0.00 -0.84 0.00 0.00 61.79 60.73 1c1x h SER 93 Cb 0.33 -0.24 -0.02 0.00 0.14 0.00 0.00 62.40 62.62 1c1x h SER 93 CO -0.06 1.09 0.14 0.74 -1.14 0.00 0.00 176.83 177.60 1c1x h THR 94 N 0.63 1.19 -0.43 -2.27 2.02 -1.71 -0.51 112.91 111.83 1c1x h THR 94 Ca 0.08 -0.58 0.01 0.00 0.77 0.00 0.00 66.41 66.68 1c1x h THR 94 Cb 0.78 0.92 -0.02 0.00 -1.74 0.00 0.00 68.15 68.08 1c1x h THR 94 CO 0.06 0.21 0.28 -0.25 0.37 0.00 0.00 175.52 176.19 1c1x h TRP 95 N 0.42 0.53 -0.92 3.16 2.91 -1.03 0.12 115.95 121.15 1c1x h TRP 95 Ca 0.12 0.01 0.03 0.00 1.13 0.00 0.00 58.89 60.18 1c1x h TRP 95 Cb 0.19 -0.18 -0.05 0.00 -0.51 0.00 0.00 29.16 28.61 1c1x h TRP 95 CO -0.00 0.33 0.60 0.00 -1.03 0.00 0.00 178.44 178.34 1c1x h ALA 96 N 1.16 1.21 -0.32 2.65 0.00 -0.55 -0.35 119.26 123.07 1c1x h ALA 96 Ca 0.16 -0.05 -0.18 0.00 0.00 0.00 0.00 54.91 54.85 1c1x h ALA 96 Cb -0.06 -0.34 -0.00 0.00 0.00 0.00 0.00 17.79 17.39 1c1x h ALA 96 CO -0.04 0.50 -0.50 -0.09 0.00 0.00 0.00 179.25 179.12 1c1x h ARG 97 N 1.19 0.88 -0.62 0.00 2.43 -0.61 -1.04 114.38 116.61 1c1x h ARG 97 Ca 0.36 -0.53 0.04 0.00 -0.81 0.00 0.00 59.98 59.04 1c1x h ARG 97 Cb -0.04 0.05 -0.05 0.00 -0.42 0.00 0.00 29.97 29.51 1c1x h ARG 97 CO -0.11 1.17 0.36 0.82 -1.51 0.00 0.00 179.97 180.70 1c1x h ILE 98 N 0.69 1.02 -0.31 1.20 2.04 -0.17 -0.34 117.51 121.64 1c1x h ILE 98 Ca 0.03 -0.24 -0.11 0.00 1.00 0.00 0.00 64.86 65.54 1c1x h ILE 98 Cb 1.10 0.27 -0.01 0.00 -0.74 0.00 0.00 36.82 37.44 1c1x h ILE 98 CO 0.11 0.13 -0.26 -0.07 0.00 0.00 0.00 178.15 178.06 1c1x h LEU 99 N 0.69 0.63 -0.37 1.44 3.38 -0.98 -0.83 115.31 119.27 1c1x h LEU 99 Ca 0.26 -0.23 -0.02 0.00 0.09 0.00 0.00 57.88 57.98 1c1x h LEU 99 Cb 0.09 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.65 1c1x h LEU 99 CO -0.14 0.87 0.16 -0.09 0.09 0.00 0.00 178.44 179.34 1c1x h ARG 100 N 0.54 0.55 -0.42 1.13 2.43 0.09 -0.62 114.38 118.07 1c1x h ARG 100 Ca 0.07 -0.09 -0.03 0.00 -0.81 0.00 0.00 59.98 59.12 1c1x h ARG 100 Cb 0.73 -0.09 -0.02 0.00 -0.42 0.00 0.00 29.97 30.17 1c1x h ARG 100 CO 0.06 0.51 0.14 0.82 -1.51 0.00 0.00 179.97 179.98 1c1x h ILE 101 N 0.46 1.22 -0.62 1.20 2.04 -0.96 -1.35 117.51 119.49 1c1x h ILE 101 Ca 0.13 -0.70 0.07 0.00 1.00 0.00 0.00 64.86 65.36 1c1x h ILE 101 Cb 0.16 0.88 -0.06 0.00 -0.74 0.00 0.00 36.82 37.06 1c1x h ILE 101 CO -0.01 0.25 0.30 -0.74 0.00 0.00 0.00 178.15 177.95 1c1x h HIS 102 N 0.54 0.55 -0.64 1.37 2.76 -0.88 -1.84 115.15 116.99 1c1x h HIS 102 Ca 0.14 0.03 -0.02 0.00 -2.20 0.00 0.00 60.37 58.31 1c1x h HIS 102 Cb 0.25 -0.15 -0.03 0.00 1.55 0.00 0.00 27.41 29.03 1c1x h HIS 102 CO 0.01 0.22 0.32 0.00 -1.30 0.00 0.00 177.93 177.18 1c1x h ALA 103 N 1.37 1.36 -0.61 5.26 0.00 -0.70 -0.70 119.26 125.24 1c1x h ALA 103 Ca 0.29 -0.12 -0.06 0.00 0.00 0.00 0.00 54.91 55.03 1c1x h ALA 103 Cb 0.27 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.77 1c1x h ALA 103 CO -0.23 0.51 0.15 0.93 0.00 0.00 0.00 179.25 180.61 1c1x h GLU 104 N 0.90 0.95 -0.15 0.00 5.08 -0.48 0.55 114.58 121.42 1c1x h GLU 104 Ca 0.22 -0.21 -0.03 0.00 -1.00 0.00 0.00 59.36 58.35 1c1x h GLU 104 Cb 0.07 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.18 1c1x h GLU 104 CO -0.03 0.84 -0.01 -0.91 -1.00 0.00 0.00 179.01 177.91 1c1x h ASN 105 N 0.91 0.26 -0.70 1.42 2.35 -0.59 -2.36 115.58 116.88 1c1x h ASN 105 Ca 0.20 -0.32 0.04 0.00 -0.55 0.00 0.00 56.30 55.66 1c1x h ASN 105 Cb 0.32 -0.07 -0.05 0.00 0.05 0.00 0.00 38.32 38.57 1c1x h ASN 105 CO -0.00 0.52 0.43 0.40 -1.65 0.00 0.00 177.43 177.13 1c1x h ILE 106 N -0.00 1.06 -0.91 2.81 2.04 -1.03 -2.73 117.51 118.75 1c1x h ILE 106 Ca 0.04 -0.28 0.06 0.00 1.00 0.00 0.00 64.86 65.68 1c1x h ILE 106 Cb 0.39 0.17 -0.06 0.00 -0.74 0.00 0.00 36.82 36.58 1c1x h ILE 106 CO 0.01 0.15 0.59 -0.78 0.00 0.00 0.00 178.15 178.12 1c1x h ASP 107 N 0.82 0.92 0.19 1.72 -0.00 -0.58 -1.49 116.42 118.00 1c1x h ASP 107 Ca 0.29 0.01 -0.02 0.00 -0.00 0.00 0.00 57.03 57.30 1c1x h ASP 107 Cb 0.06 -0.19 -0.00 0.00 -0.00 0.00 0.00 39.33 39.20 1c1x h ASP 107 CO -0.13 0.59 -0.11 0.11 -0.00 0.00 0.00 179.24 179.70 1c1x h LYS 108 N 1.04 0.00 0.00 0.28 1.57 -1.11 -0.36 116.57 117.99 1c1x h LYS 108 Ca 0.39 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.17 1c1x h LYS 108 Cb 0.19 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.50 1c1x h LYS 108 CO -0.15 0.11 0.00 1.28 -0.57 0.00 0.00 179.45 180.13 1c1x n LEU 109 N -4.01 0.00 -4.16 2.94 4.77 -0.57 -4.92 117.00 111.05 1c1x n LEU 109 Ca -0.02 0.47 -0.32 0.00 -0.03 0.00 0.00 56.01 56.10 1c1x n LEU 109 Cb 0.20 -0.47 -0.05 0.00 -2.33 0.00 0.00 43.42 40.77 1c1x n LEU 109 CO 0.32 -0.11 -0.35 -1.20 -1.33 0.00 0.00 177.39 174.73 1c1x n SER 110 N -1.47 -0.53 0.00 -1.43 7.64 -0.14 -1.10 113.62 116.58 1c1x n SER 110 Ca 0.06 -1.21 0.00 0.00 1.01 0.00 0.00 58.87 58.74 1c1x n SER 110 Cb 0.25 -2.04 0.00 0.00 -1.01 0.00 0.00 64.21 61.41 1c1x n SER 110 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1c1x n GLY 111 N -2.32 0.69 0.03 0.23 0.00 -1.26 -4.90 105.19 97.66 1c1x n GLY 111 Ca -0.28 0.00 0.14 0.00 0.00 0.00 0.00 46.02 45.88 1c1x n GLY 111 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1c1x n ASN 112 N 0.00 0.26 -3.76 1.61 3.02 -0.26 -4.73 115.26 111.40 1c1x n ASN 112 Ca 0.00 0.45 -0.14 0.00 -0.03 0.00 0.00 54.58 54.86 1c1x n ASN 112 Cb 0.00 -0.49 -0.15 0.00 -0.61 0.00 0.00 39.78 38.53 1c1x n ASN 112 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 1c1x s TYR 113 N -3.03 -0.06 -0.08 3.10 6.14 -1.26 -0.90 117.35 121.26 1c1x s TYR 113 Ca 0.13 0.30 0.04 0.00 0.64 0.00 0.00 57.07 58.17 1c1x s TYR 113 Cb 0.17 -0.15 0.00 0.00 0.42 0.00 0.00 41.96 42.40 1c1x s TYR 113 CO 0.57 -0.12 -0.20 -1.58 0.64 0.00 0.00 175.55 174.85 1c1x s TRP 114 N 1.07 2.19 0.46 4.97 0.52 -0.13 -4.84 118.94 123.17 1c1x s TRP 114 Ca -0.09 -0.85 0.07 0.00 0.02 0.00 0.00 56.10 55.26 1c1x s TRP 114 Cb -0.12 -1.49 0.07 0.00 -1.15 0.00 0.00 33.47 30.79 1c1x s TRP 114 CO -0.04 -0.35 0.62 -2.37 0.02 0.00 0.00 176.95 174.83 1c1x n THR 115 N 3.53 0.00 -3.88 2.01 5.66 -0.81 -2.36 114.28 118.43 1c1x n THR 115 Ca -0.20 -1.54 -0.04 0.00 -3.05 0.00 0.00 64.05 59.22 1c1x n THR 115 Cb 0.53 -0.59 0.02 0.00 -1.55 0.00 0.00 70.33 68.74 1c1x n THR 115 CO 0.00 0.00 0.00 -0.83 -3.05 0.00 0.00 175.07 171.19 1c1x s GLY 116 N -4.06 0.19 0.59 1.09 0.00 -1.21 -0.05 107.32 103.87 1c1x s GLY 116 Ca 0.47 -0.46 -0.14 0.00 0.00 0.00 0.00 44.72 44.59 1c1x s GLY 116 CO 0.30 2.19 1.02 2.56 0.00 0.00 0.00 173.10 179.17 1c1x s PRO 117 N -2.09 3.57 0.00 2.90 0.05 -1.26 -1.00 135.00 137.16 1c1x s PRO 117 Ca 0.22 0.96 0.00 0.00 0.05 0.00 0.00 61.00 62.22 1c1x s PRO 117 Cb -0.03 -2.08 0.00 0.00 0.05 0.00 0.00 34.50 32.44 1c1x s PRO 117 CO 0.07 -0.59 0.00 -3.47 0.05 0.00 0.00 177.00 173.06 1c1x n ASP 118 N -2.20 0.00 -4.67 6.66 2.03 -1.15 -4.43 116.55 112.78 1c1x n ASP 118 Ca 0.07 0.00 -0.48 0.00 0.52 0.00 0.00 54.79 54.90 1c1x n ASP 118 Cb 0.54 0.00 -0.05 0.00 -0.72 0.00 0.00 41.12 40.89 1c1x n ASP 118 CO 0.00 0.00 0.00 0.52 -1.92 0.00 0.00 177.20 175.80 1c1x n VAL 119 N 0.00 0.28 -1.25 5.18 0.31 -1.26 -1.73 118.33 119.87 1c1x n VAL 119 Ca 0.00 -0.05 -0.08 0.00 -0.01 0.00 0.00 64.34 64.19 1c1x n VAL 119 Cb 0.00 -1.65 -0.04 0.00 -0.91 0.00 0.00 33.84 31.25 1c1x n VAL 119 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 1c1x n ASN 120 N 4.95 -4.73 -4.09 4.52 3.02 -1.26 -1.21 115.26 116.45 1c1x n ASN 120 Ca 0.20 0.21 -0.18 0.00 -0.03 0.00 0.00 54.58 54.78 1c1x n ASN 120 Cb 0.28 -2.98 -0.13 0.00 -0.61 0.00 0.00 39.78 36.34 1c1x n ASN 120 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 1c1x s THR 121 N -2.07 0.86 0.22 3.41 -4.23 -0.71 -4.74 115.64 108.38 1c1x s THR 121 Ca 0.00 -0.87 0.04 0.00 -1.18 0.00 0.00 61.69 59.68 1c1x s THR 121 Cb 0.00 -0.80 -0.01 0.00 1.34 0.00 0.00 72.50 73.02 1c1x s THR 121 CO 0.00 -0.06 0.14 -0.46 -0.54 0.00 0.00 174.62 173.71 1c1x n ASN 122 N 2.00 0.07 -0.21 3.99 0.23 -1.26 -3.66 115.26 116.42 1c1x n ASN 122 Ca -0.18 -2.33 0.06 0.00 -0.53 0.00 0.00 54.58 51.60 1c1x n ASN 122 Cb 0.55 0.89 0.33 0.00 -2.08 0.00 0.00 39.78 39.47 1c1x n ASN 122 CO 0.00 0.00 0.00 0.28 -0.93 0.00 0.00 177.26 176.61 1c1x h SER 123 N 1.16 0.71 -0.73 0.53 0.02 -1.95 -1.26 113.55 112.04 1c1x h SER 123 Ca -0.16 0.00 -0.03 0.00 -0.84 0.00 0.00 61.79 60.76 1c1x h SER 123 Cb 0.73 -0.15 -0.03 0.00 0.14 0.00 0.00 62.40 63.09 1c1x h SER 123 CO 0.24 0.46 0.32 0.00 -1.14 0.00 0.00 176.83 176.71 1c1x h ALA 124 N 1.59 0.94 -0.33 3.77 0.00 -1.96 0.18 119.26 123.45 1c1x h ALA 124 Ca 0.33 -0.17 -0.07 0.00 0.00 0.00 0.00 54.91 55.00 1c1x h ALA 124 Cb 0.25 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 1c1x h ALA 124 CO -0.11 0.54 -0.09 -0.44 0.00 0.00 0.00 179.25 179.14 1c1x h ASP 125 N 1.03 0.53 -0.60 0.00 3.45 -1.68 -1.44 116.42 117.71 1c1x h ASP 125 Ca 0.25 -0.13 -0.04 0.00 0.43 0.00 0.00 57.03 57.54 1c1x h ASP 125 Cb 0.17 -0.14 -0.03 0.00 -0.56 0.00 0.00 39.33 38.77 1c1x h ASP 125 CO -0.03 0.66 0.23 0.24 -1.57 0.00 0.00 179.24 178.78 1c1x h MET 126 N 0.51 0.90 -0.61 3.56 2.86 -0.43 0.69 114.93 122.40 1c1x h MET 126 Ca 0.10 -0.17 -0.00 0.00 -2.06 0.00 0.00 59.70 57.57 1c1x h MET 126 Cb 0.47 -0.14 -0.03 0.00 0.06 0.00 0.00 31.60 31.95 1c1x h MET 126 CO 0.03 0.77 0.37 -0.44 1.06 0.00 0.00 176.91 178.70 1c1x h ASP 127 N 0.83 0.74 -0.34 1.22 3.45 -0.25 -0.19 116.42 121.89 1c1x h ASP 127 Ca 0.20 -0.06 0.00 0.00 0.43 0.00 0.00 57.03 57.60 1c1x h ASP 127 Cb 0.21 -0.19 -0.02 0.00 -0.56 0.00 0.00 39.33 38.78 1c1x h ASP 127 CO -0.02 0.58 0.22 0.74 -1.57 0.00 0.00 179.24 179.19 1c1x h THR 128 N 0.83 1.09 -0.99 0.35 2.02 -0.96 -1.89 112.91 113.36 1c1x h THR 128 Ca 0.22 -0.19 0.02 0.00 0.77 0.00 0.00 66.41 67.23 1c1x h THR 128 Cb -0.02 0.62 -0.05 0.00 -1.74 0.00 0.00 68.15 66.96 1c1x h THR 128 CO -0.04 0.09 0.66 -0.07 0.37 0.00 0.00 175.52 176.53 1c1x h LEU 129 N 0.45 1.13 -0.50 2.58 3.38 -0.42 -1.10 115.31 120.83 1c1x h LEU 129 Ca 0.12 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.07 1c1x h LEU 129 Cb -0.04 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 40.44 1c1x h LEU 129 CO -0.03 0.80 0.00 -3.20 0.09 0.00 0.00 178.44 176.11 1c1x n ASN 130 N -4.40 0.30 0.23 -0.43 4.05 -0.12 -0.75 115.26 114.14 1c1x n ASN 130 Ca 0.12 0.60 0.12 0.00 0.45 0.00 0.00 54.58 55.87 1c1x n ASN 130 Cb 0.03 -0.65 0.51 0.00 1.23 0.00 0.00 39.78 40.90 1c1x n ASN 130 CO 0.00 0.00 0.00 0.44 -3.05 0.00 0.00 177.26 174.65 1c1x h ASP 131 N 0.00 0.00 0.00 1.20 3.45 -0.59 -3.32 116.42 117.16 1c1x h ASP 131 Ca 0.00 0.00 -0.22 0.00 0.43 0.00 0.00 57.03 57.24 1c1x h ASP 131 Cb 0.17 0.00 -0.04 0.00 -0.56 0.00 0.00 39.33 38.90 1c1x h ASP 131 CO 0.00 0.17 -1.82 0.41 -1.57 0.00 0.00 179.24 176.44 1c1x n THR 132 N -3.34 0.82 -4.06 0.35 -1.04 0.07 -5.05 114.28 102.03 1c1x n THR 132 Ca 0.00 -0.38 -0.12 0.00 -2.04 0.00 0.00 64.05 61.51 1c1x n THR 132 Cb 0.40 -0.90 -0.11 0.00 -1.82 0.00 0.00 70.33 67.90 1c1x n THR 132 CO 0.00 0.00 0.00 0.28 -0.64 0.00 0.00 175.07 174.71 1c1x s THR 133 N -2.29 0.48 0.05 12.58 -1.32 -0.38 -4.93 115.64 119.84 1c1x s THR 133 Ca -0.15 -1.14 0.14 0.00 -1.21 0.00 0.00 61.69 59.33 1c1x s THR 133 Cb 0.04 -0.66 0.01 0.00 -1.51 0.00 0.00 72.50 70.38 1c1x s THR 133 CO 0.39 -0.45 1.51 -0.08 -2.21 0.00 0.00 174.62 173.77 1c1x h GLU 134 N 4.37 0.00 -3.37 7.08 4.81 -1.87 -3.35 114.58 122.25 1c1x h GLU 134 Ca -0.35 0.00 -0.69 0.00 -0.13 0.00 0.00 59.36 58.19 1c1x h GLU 134 Cb 1.20 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.57 1c1x h GLU 134 CO 0.43 0.60 3.47 1.19 -0.73 0.00 0.00 179.01 183.97 1c1x n PHE 135 N -3.40 2.86 -4.07 0.92 3.01 -1.26 -4.86 117.46 110.65 1c1x n PHE 135 Ca 0.01 -3.03 -0.19 0.00 1.01 0.00 0.00 57.45 55.25 1c1x n PHE 135 Cb 0.71 -2.47 -0.16 0.00 -0.01 0.00 0.00 39.48 37.54 1c1x n PHE 135 CO 0.00 0.00 0.00 0.08 1.01 0.00 0.00 176.76 177.85 1c1x s VAL 136 N 2.34 0.39 0.27 -4.37 1.01 -1.26 -1.92 120.40 116.86 1c1x s VAL 136 Ca 0.60 -0.04 0.07 0.00 0.00 0.00 0.00 61.98 62.61 1c1x s VAL 136 Cb 0.16 -0.44 -0.03 0.00 0.00 0.00 0.00 36.38 36.06 1c1x s VAL 136 CO -0.07 0.19 0.22 -0.36 0.00 0.00 0.00 175.10 175.08 1c1x s PHE 137 N 0.94 3.06 0.00 5.22 0.08 0.93 -4.64 117.98 123.57 1c1x s PHE 137 Ca -0.11 -0.15 0.00 0.00 0.12 0.00 0.00 56.93 56.79 1c1x s PHE 137 Cb -0.14 -1.49 0.00 0.00 -0.57 0.00 0.00 43.02 40.82 1c1x s PHE 137 CO -0.01 0.44 0.00 0.41 -0.10 0.00 0.00 175.22 175.97 1c1x n GLY 138 N -1.22 0.55 3.75 4.36 0.00 -1.26 -4.26 105.19 107.10 1c1x n GLY 138 Ca -0.06 -0.59 -0.31 0.00 0.00 0.00 0.00 46.02 45.06 1c1x n GLY 138 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1c1x s ARG 139 N -1.14 1.98 0.87 1.61 0.52 -1.26 -4.27 118.95 117.27 1c1x s ARG 139 Ca 0.00 1.28 -0.12 0.00 -0.52 0.00 0.00 55.73 56.37 1c1x s ARG 139 Cb 0.00 -1.86 0.11 0.00 0.52 0.00 0.00 34.95 33.72 1c1x s ARG 139 CO 0.00 -1.86 1.07 -1.13 0.02 0.00 0.00 175.30 173.39 1c1x n SER 140 N -3.63 0.28 -0.36 0.23 3.41 -1.26 -1.32 113.62 110.97 1c1x n SER 140 Ca 0.10 0.48 0.04 0.00 -0.26 0.00 0.00 58.87 59.23 1c1x n SER 140 Cb 0.53 -1.45 0.19 0.00 -0.26 0.00 0.00 64.21 63.22 1c1x n SER 140 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 1c1x h LEU 141 N -1.43 0.98 -1.50 1.04 3.38 -1.91 0.17 115.31 116.04 1c1x h LEU 141 Ca -0.44 0.02 -0.03 0.00 0.09 0.00 0.00 57.88 57.52 1c1x h LEU 141 Cb 1.29 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 41.84 1c1x h LEU 141 CO 0.42 0.59 -0.03 -0.33 0.09 0.00 0.00 178.44 179.18 1c1x h GLU 142 N 1.10 0.28 -0.06 1.13 3.07 -1.89 -1.36 114.58 116.86 1c1x h GLU 142 Ca 0.45 -0.05 0.00 0.00 -0.50 0.00 0.00 59.36 59.26 1c1x h GLU 142 Cb 0.28 -0.05 0.00 0.00 -0.84 0.00 0.00 28.75 28.14 1c1x h GLU 142 CO -0.21 0.34 0.00 0.54 -1.40 0.00 0.00 179.01 178.28 1c1x n ARG 143 N -4.34 1.44 -0.03 2.33 5.12 -0.62 -4.90 116.66 115.65 1c1x n ARG 143 Ca -0.00 -0.65 0.00 0.00 -1.93 0.00 0.00 57.85 55.27 1c1x n ARG 143 Cb 0.21 -1.42 0.00 0.00 -1.16 0.00 0.00 32.46 30.08 1c1x n ARG 143 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1c1x n GLY 144 N 1.06 0.82 2.80 -0.13 0.00 -0.51 -4.90 105.19 104.33 1c1x n GLY 144 Ca 0.18 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 46.04 1c1x n GLY 144 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1c1x n GLY 145 N -2.02 0.96 0.98 -0.02 0.00 -0.05 -4.93 105.19 100.12 1c1x n GLY 145 Ca 0.00 -2.05 0.10 0.00 0.00 0.00 0.00 46.02 44.07 1c1x n GLY 145 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1c1x n ALA 146 N -2.84 2.43 -0.80 4.61 0.00 -1.17 -4.01 120.51 118.73 1c1x n ALA 146 Ca -0.11 -0.91 0.00 0.00 0.00 0.00 0.00 53.44 52.42 1c1x n ALA 146 Cb 0.43 -0.96 0.00 0.00 0.00 0.00 0.00 19.45 18.92 1c1x n ALA 146 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1c1x n GLY 147 N 1.38 0.54 3.72 0.00 0.00 -0.44 -4.80 105.19 105.59 1c1x n GLY 147 Ca 0.18 -0.87 -0.42 0.00 0.00 0.00 0.00 46.02 44.91 1c1x n GLY 147 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1c1x n SER 148 N -2.35 3.80 -0.73 1.61 2.88 -1.26 -4.68 113.62 112.88 1c1x n SER 148 Ca 0.00 1.10 0.08 0.00 -1.33 0.00 0.00 58.87 58.72 1c1x n SER 148 Cb 0.00 -1.56 0.12 0.00 -0.75 0.00 0.00 64.21 62.02 1c1x n SER 148 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 1c1x n SER 149 N 3.15 2.67 -0.14 -3.46 3.41 -1.26 -4.66 113.62 113.33 1c1x n SER 149 Ca 0.13 -1.78 -0.03 0.00 -0.26 0.00 0.00 58.87 56.93 1c1x n SER 149 Cb 0.35 -0.12 0.05 0.00 -0.26 0.00 0.00 64.21 64.23 1c1x n SER 149 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1c1x h ALA 150 N 3.02 0.43 -0.68 7.33 0.00 -1.92 -1.12 119.26 126.32 1c1x h ALA 150 Ca 0.00 0.14 -0.07 0.00 0.00 0.00 0.00 54.91 54.97 1c1x h ALA 150 Cb 0.72 0.23 -0.03 0.00 0.00 0.00 0.00 17.79 18.71 1c1x h ALA 150 CO 0.00 -0.39 0.15 0.35 0.00 0.00 0.00 179.25 179.36 1c1x h PHE 151 N 0.11 1.16 -0.87 0.00 3.04 -1.83 -1.45 116.94 117.10 1c1x h PHE 151 Ca 0.23 -0.14 -0.03 0.00 3.98 0.00 0.00 57.97 62.01 1c1x h PHE 151 Cb 0.34 -0.33 -0.04 0.00 2.56 0.00 0.00 35.95 38.49 1c1x h PHE 151 CO -0.30 0.95 0.43 1.15 -2.02 0.00 0.00 178.31 178.53 1c1x h THR 152 N 1.04 1.26 -0.67 4.41 2.02 -1.76 -0.40 112.91 118.82 1c1x h THR 152 Ca 0.21 -0.71 -0.02 0.00 0.77 0.00 0.00 66.41 66.66 1c1x h THR 152 Cb 0.39 0.13 -0.03 0.00 -1.74 0.00 0.00 68.15 66.91 1c1x h THR 152 CO 0.01 0.31 0.35 0.74 0.37 0.00 0.00 175.52 177.29 1c1x h THR 153 N 1.23 1.22 -0.58 3.16 2.02 -0.83 -1.63 112.91 117.50 1c1x h THR 153 Ca 0.30 -0.57 0.00 0.00 0.77 0.00 0.00 66.41 66.91 1c1x h THR 153 Cb 0.10 0.37 -0.03 0.00 -1.74 0.00 0.00 68.15 66.85 1c1x h THR 153 CO -0.04 0.24 0.37 0.00 0.37 0.00 0.00 175.52 176.46 1c1x h ALA 154 N 1.17 0.74 -0.30 6.16 0.00 -0.46 0.54 119.26 127.10 1c1x h ALA 154 Ca 0.23 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.09 1c1x h ALA 154 Cb 0.07 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.61 1c1x h ALA 154 CO -0.03 0.19 0.19 0.28 0.00 0.00 0.00 179.25 179.88 1c1x h VAL 155 N 0.79 1.09 -0.53 0.00 2.07 -0.87 0.19 116.25 118.99 1c1x h VAL 155 Ca 0.21 -0.18 0.01 0.00 0.82 0.00 0.00 66.70 67.56 1c1x h VAL 155 Cb -0.06 0.67 -0.03 0.00 -1.52 0.00 0.00 31.29 30.34 1c1x h VAL 155 CO -0.04 0.09 0.34 1.23 0.02 0.00 0.00 177.57 179.20 1c1x h GLY 156 N 0.40 0.75 1.19 2.17 0.00 -0.76 -0.17 103.07 106.65 1c1x h GLY 156 Ca 0.11 -0.27 -0.08 0.00 0.00 0.00 0.00 47.33 47.09 1c1x h GLY 156 CO -0.02 0.25 0.03 -2.08 0.00 0.00 0.00 176.54 174.71 1c1x h VAL 157 N 0.69 1.26 -0.52 4.60 2.07 -0.56 0.17 116.25 123.96 1c1x h VAL 157 Ca 0.20 -1.07 -0.04 0.00 0.82 0.00 0.00 66.70 66.61 1c1x h VAL 157 Cb -0.05 0.78 -0.02 0.00 -1.52 0.00 0.00 31.29 30.48 1c1x h VAL 157 CO -0.06 0.39 0.16 0.15 0.02 0.00 0.00 177.57 178.23 1c1x h PHE 158 N 0.90 0.84 -0.29 1.57 3.57 -0.55 0.31 116.94 123.28 1c1x h PHE 158 Ca 0.17 -0.09 -0.10 0.00 3.53 0.00 0.00 57.97 61.48 1c1x h PHE 158 Cb 0.49 -0.24 -0.01 0.00 2.79 0.00 0.00 35.95 38.97 1c1x h PHE 158 CO 0.03 0.72 -0.24 0.93 -2.23 0.00 0.00 178.31 177.53 1c1x h GLU 159 N 0.71 0.56 -0.13 1.11 4.39 -0.72 -0.91 114.58 119.60 1c1x h GLU 159 Ca 0.17 -0.21 -0.00 0.00 0.34 0.00 0.00 59.36 59.65 1c1x h GLU 159 Cb 0.28 -0.03 -0.01 0.00 -0.10 0.00 0.00 28.75 28.89 1c1x h GLU 159 CO -0.00 0.76 0.07 0.00 -1.16 0.00 0.00 179.01 178.67 1c1x h ALA 160 N 1.25 0.16 -0.36 3.43 0.00 0.08 -0.86 119.26 122.97 1c1x h ALA 160 Ca 0.07 -0.05 0.04 0.00 0.00 0.00 0.00 54.91 54.97 1c1x h ALA 160 Cb 0.68 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 18.38 1c1x h ALA 160 CO 0.05 -0.31 0.13 1.98 0.00 0.00 0.00 179.25 181.10 1c1x h MET 161 N 0.11 0.27 -0.57 0.00 1.85 -0.11 0.48 114.93 116.96 1c1x h MET 161 Ca 0.04 -0.02 -0.01 0.00 -0.61 0.00 0.00 59.70 59.11 1c1x h MET 161 Cb 0.07 -0.06 -0.03 0.00 0.43 0.00 0.00 31.60 32.01 1c1x h MET 161 CO -0.01 0.18 0.32 0.87 -0.40 0.00 0.00 176.91 177.87 1c1x h LYS 162 N 0.28 0.79 -0.58 0.39 1.57 -0.96 -0.02 116.57 118.04 1c1x h LYS 162 Ca 0.16 -0.09 -0.08 0.00 -1.87 0.00 0.00 60.65 58.78 1c1x h LYS 162 Cb 0.13 -0.16 -0.02 0.00 0.08 0.00 0.00 32.23 32.26 1c1x h LYS 162 CO -0.16 0.60 0.06 0.00 -0.57 0.00 0.00 179.45 179.37 1c1x h ALA 163 N 1.15 1.00 -0.20 3.86 0.00 -0.77 -2.21 119.26 122.09 1c1x h ALA 163 Ca 0.20 -0.27 -0.08 0.00 0.00 0.00 0.00 54.91 54.76 1c1x h ALA 163 Cb 0.03 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 17.59 1c1x h ALA 163 CO -0.03 0.62 -0.20 1.15 0.00 0.00 0.00 179.25 180.79 1c1x h THR 164 N 0.90 1.33 -0.48 0.00 2.02 -0.44 -1.56 112.91 114.67 1c1x h THR 164 Ca 0.18 -1.36 -0.06 0.00 0.77 0.00 0.00 66.41 65.94 1c1x h THR 164 Cb 0.45 1.75 -0.02 0.00 -1.74 0.00 0.00 68.15 68.59 1c1x h THR 164 CO 0.02 0.42 0.07 -0.37 0.37 0.00 0.00 175.52 176.02 1c1x h VAL 165 N 0.17 1.22 -0.21 3.16 -1.51 -0.98 -0.39 116.25 117.72 1c1x h VAL 165 Ca 0.03 -0.86 -0.02 0.00 -1.23 0.00 0.00 66.70 64.63 1c1x h VAL 165 Cb 0.75 0.79 -0.01 0.00 -2.13 0.00 0.00 31.29 30.68 1c1x h VAL 165 CO 0.05 0.31 0.06 0.00 -1.23 0.00 0.00 177.57 176.76 1c1x h ALA 166 N 1.36 0.27 0.00 5.19 0.00 -1.31 -0.54 119.26 124.23 1c1x h ALA 166 Ca 0.15 -0.14 -0.04 0.00 0.00 0.00 0.00 54.91 54.89 1c1x h ALA 166 Cb 0.34 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 1c1x h ALA 166 CO 0.01 -0.10 -0.18 1.25 0.00 0.00 0.00 179.25 180.22 1c1x h HIS 167 N 0.17 0.00 0.00 0.00 6.17 -0.96 -0.73 115.15 119.80 1c1x h HIS 167 Ca 0.07 0.00 0.00 0.00 0.71 0.00 0.00 60.37 61.15 1c1x h HIS 167 Cb 0.23 0.00 0.00 0.00 2.52 0.00 0.00 27.41 30.16 1c1x h HIS 167 CO 0.00 0.18 0.00 -2.13 0.71 0.00 0.00 177.93 176.69 1c1x n ARG 168 N -4.07 0.04 -0.62 5.26 3.00 -0.18 -4.89 116.66 115.19 1c1x n ARG 168 Ca -0.02 0.05 0.00 0.00 -0.00 0.00 0.00 57.85 57.88 1c1x n ARG 168 Cb 0.26 -1.50 0.00 0.00 0.00 0.00 0.00 32.46 31.22 1c1x n ARG 168 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1c1x n GLY 169 N 1.17 0.69 0.69 5.14 0.00 -0.28 -4.96 105.19 107.64 1c1x n GLY 169 Ca 0.07 -0.61 0.11 0.00 0.00 0.00 0.00 46.02 45.59 1c1x n GLY 169 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1c1x n LEU 170 N 0.00 2.43 0.00 0.99 4.77 -0.26 -5.04 117.00 119.89 1c1x n LEU 170 Ca 0.00 -0.86 0.00 0.00 -0.03 0.00 0.00 56.01 55.12 1c1x n LEU 170 Cb 0.02 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.11 1c1x n LEU 170 CO 0.00 0.43 0.00 0.61 -1.33 0.00 0.00 177.39 177.10 1c1x n GLY 171 N 1.39 -0.05 3.94 -0.72 0.00 -1.25 -4.89 105.19 103.61 1c1x n GLY 171 Ca 0.11 -1.41 -0.24 0.00 0.00 0.00 0.00 46.02 44.47 1c1x n GLY 171 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1c1x s SER 172 N -4.00 5.47 0.36 1.61 1.04 -1.26 -3.65 113.70 113.27 1c1x s SER 172 Ca 0.00 0.41 0.27 0.00 0.48 0.00 0.00 55.95 57.11 1c1x s SER 172 Cb 0.00 -1.39 1.15 0.00 0.10 0.00 0.00 66.02 65.88 1c1x s SER 172 CO 0.00 -1.06 1.81 -0.07 0.98 0.00 0.00 173.24 174.89 1c1x h LEU 173 N -0.03 0.00 -8.84 2.42 3.38 -1.90 -3.42 115.31 106.92 1c1x h LEU 173 Ca -0.45 0.00 -0.64 0.00 0.09 0.00 0.00 57.88 56.88 1c1x h LEU 173 Cb 1.27 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.02 1c1x h LEU 173 CO 0.58 0.00 1.36 -0.67 0.09 0.00 0.00 178.44 179.80 1c1x n ASP 174 N -2.50 2.74 0.00 -0.43 4.64 -1.16 -0.09 116.55 119.75 1c1x n ASP 174 Ca 0.01 0.49 0.00 0.00 -1.38 0.00 0.00 54.79 53.91 1c1x n ASP 174 Cb 0.23 -1.36 0.00 0.00 -1.04 0.00 0.00 41.12 38.95 1c1x n ASP 174 CO 0.00 0.00 0.00 0.61 -0.82 0.00 0.00 177.20 176.99 1c1x n GLY 175 N 5.81 1.67 3.86 0.27 0.00 -0.12 -4.91 105.19 111.77 1c1x n GLY 175 Ca 0.34 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 46.04 1c1x n GLY 175 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1c1x s LEU 176 N 0.00 3.38 -0.18 0.99 1.43 0.88 -4.72 118.68 120.45 1c1x s LEU 176 Ca 0.00 1.46 -0.16 0.00 -1.03 0.00 0.00 54.13 54.40 1c1x s LEU 176 Cb 0.00 -4.47 -0.04 0.00 0.03 0.00 0.00 46.19 41.71 1c1x s LEU 176 CO 0.00 -0.76 0.39 -0.89 0.23 0.00 0.00 176.35 175.32 1c1x s THR 177 N -2.97 5.22 -0.14 5.49 2.01 -1.26 -0.66 115.64 123.33 1c1x s THR 177 Ca 0.56 0.71 0.02 0.00 0.31 0.00 0.00 61.69 63.29 1c1x s THR 177 Cb -0.11 -3.72 0.01 0.00 0.01 0.00 0.00 72.50 68.70 1c1x s THR 177 CO 0.45 0.28 -0.19 -0.69 -0.69 0.00 0.00 174.62 173.79 1c1x s VAL 178 N 1.08 1.81 -0.39 3.82 1.01 -0.08 -1.14 120.40 126.52 1c1x s VAL 178 Ca 0.19 -0.82 -0.14 0.00 0.00 0.00 0.00 61.98 61.21 1c1x s VAL 178 Cb -0.14 -1.63 0.01 0.00 0.00 0.00 0.00 36.38 34.62 1c1x s VAL 178 CO 0.07 0.50 0.27 -0.22 0.00 0.00 0.00 175.10 175.73 1c1x s LEU 179 N 1.01 4.92 -0.34 3.92 2.96 0.44 -1.64 118.68 129.96 1c1x s LEU 179 Ca -0.04 -0.81 -0.14 0.00 -0.22 0.00 0.00 54.13 52.93 1c1x s LEU 179 Cb -0.15 -2.14 -0.02 0.00 0.50 0.00 0.00 46.19 44.39 1c1x s LEU 179 CO -0.04 -0.39 0.28 -0.69 -1.32 0.00 0.00 176.35 174.18 1c1x s VAL 180 N 1.67 5.25 -0.41 1.68 1.01 -0.21 -0.46 120.40 128.93 1c1x s VAL 180 Ca 0.05 -0.09 -0.16 0.00 0.00 0.00 0.00 61.98 61.78 1c1x s VAL 180 Cb -0.19 -3.74 0.02 0.00 0.00 0.00 0.00 36.38 32.48 1c1x s VAL 180 CO 0.10 -0.02 0.37 -1.58 0.00 0.00 0.00 175.10 173.97 1c1x s GLN 181 N 1.83 3.05 0.00 2.72 0.74 -0.74 -1.91 119.66 125.36 1c1x s GLN 181 Ca 0.08 -0.87 0.00 0.00 0.05 0.00 0.00 55.36 54.62 1c1x s GLN 181 Cb -0.17 -3.97 0.00 0.00 1.10 0.00 0.00 33.01 29.97 1c1x s GLN 181 CO 0.11 -0.79 0.00 0.41 -0.55 0.00 0.00 175.29 174.47 1c1x n GLY 182 N 5.13 0.94 2.58 2.59 0.00 0.16 0.12 105.19 116.72 1c1x n GLY 182 Ca -0.09 -1.03 -0.33 0.00 0.00 0.00 0.00 46.02 44.56 1c1x n GLY 182 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1c1x n LEU 183 N 0.00 6.40 0.00 0.99 4.77 -1.26 -4.10 117.00 123.81 1c1x n LEU 183 Ca 0.00 -4.85 0.00 0.00 -0.03 0.00 0.00 56.01 51.13 1c1x n LEU 183 Cb 0.00 -0.78 0.00 0.00 -2.33 0.00 0.00 43.42 40.31 1c1x n LEU 183 CO 0.00 1.90 0.00 0.61 -1.33 0.00 0.00 177.39 178.57 1c1x n GLY 184 N -0.61 0.37 0.35 -0.72 0.00 -1.26 -4.19 105.19 99.13 1c1x n GLY 184 Ca 0.50 -1.70 0.06 0.00 0.00 0.00 0.00 46.02 44.88 1c1x n GLY 184 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1c1x h ALA 185 N -1.73 1.42 0.00 4.61 0.00 -1.95 0.71 119.26 122.32 1c1x h ALA 185 Ca 0.00 0.02 -0.10 0.00 0.00 0.00 0.00 54.91 54.83 1c1x h ALA 185 Cb 0.00 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.58 1c1x h ALA 185 CO 0.00 0.22 -0.56 0.28 0.00 0.00 0.00 179.25 179.19 1c1x h VAL 186 N 0.96 1.41 -0.98 0.00 2.07 -1.92 -3.32 116.25 114.47 1c1x h VAL 186 Ca 0.47 -2.27 0.07 0.00 0.82 0.00 0.00 66.70 65.79 1c1x h VAL 186 Cb 0.43 2.88 -0.07 0.00 -1.52 0.00 0.00 31.29 33.00 1c1x h VAL 186 CO -0.25 0.48 0.63 1.23 0.02 0.00 0.00 177.57 179.68 1c1x h GLY 187 N -1.00 1.51 1.00 2.17 0.00 -1.68 0.65 103.07 105.72 1c1x h GLY 187 Ca -0.16 -0.46 -0.03 0.00 0.00 0.00 0.00 47.33 46.69 1c1x h GLY 187 CO -0.09 0.30 0.29 -1.33 0.00 0.00 0.00 176.54 175.71 1c1x h GLY 188 N 1.12 0.98 1.15 4.60 0.00 -1.02 0.18 103.07 110.08 1c1x h GLY 188 Ca 0.43 -0.50 -0.15 0.00 0.00 0.00 0.00 47.33 47.11 1c1x h GLY 188 CO -0.19 0.47 -0.35 1.76 0.00 0.00 0.00 176.54 178.24 1c1x h SER 189 N 0.87 1.00 -0.65 0.19 0.02 -1.47 -2.13 113.55 111.39 1c1x h SER 189 Ca 0.22 -0.44 -0.04 0.00 -0.84 0.00 0.00 61.79 60.69 1c1x h SER 189 Cb 0.14 -0.28 -0.03 0.00 0.14 0.00 0.00 62.40 62.37 1c1x h SER 189 CO -0.03 1.24 0.26 0.25 -1.14 0.00 0.00 176.83 177.41 1c1x h LEU 190 N 0.78 0.89 -1.26 5.07 5.85 -0.66 -0.95 115.31 125.03 1c1x h LEU 190 Ca 0.07 -0.17 -0.02 0.00 0.84 0.00 0.00 57.88 58.60 1c1x h LEU 190 Cb 0.93 -0.23 -0.03 0.00 0.37 0.00 0.00 40.66 41.71 1c1x h LEU 190 CO 0.09 0.82 0.26 0.00 -0.34 0.00 0.00 178.44 179.27 1c1x h ALA 191 N 1.11 1.43 -0.19 1.25 0.00 -0.82 0.19 119.26 122.23 1c1x h ALA 191 Ca 0.22 -0.12 -0.21 0.00 0.00 0.00 0.00 54.91 54.80 1c1x h ALA 191 Cb 0.20 -0.22 0.01 0.00 0.00 0.00 0.00 17.79 17.78 1c1x h ALA 191 CO -0.02 0.45 -0.71 0.77 0.00 0.00 0.00 179.25 179.75 1c1x h SER 192 N 0.77 0.92 -0.61 0.00 0.02 -0.83 -1.61 113.55 112.21 1c1x h SER 192 Ca 0.19 -0.57 -0.02 0.00 -0.84 0.00 0.00 61.79 60.55 1c1x h SER 192 Cb 0.09 -0.27 -0.03 0.00 0.14 0.00 0.00 62.40 62.33 1c1x h SER 192 CO -0.03 1.37 0.30 -0.07 -1.14 0.00 0.00 176.83 177.26 1c1x h LEU 193 N 0.56 0.80 -0.24 5.07 3.38 -0.76 -0.77 115.31 123.34 1c1x h LEU 193 Ca -0.03 -0.12 -0.03 0.00 0.09 0.00 0.00 57.88 57.78 1c1x h LEU 193 Cb 1.33 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 41.86 1c1x h LEU 193 CO 0.15 0.70 0.03 0.00 0.09 0.00 0.00 178.44 179.40 1c1x h ALA 194 N 1.13 0.32 -0.72 1.53 0.00 -0.96 -2.10 119.26 118.47 1c1x h ALA 194 Ca 0.21 -0.19 0.02 0.00 0.00 0.00 0.00 54.91 54.95 1c1x h ALA 194 Cb 0.11 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 17.77 1c1x h ALA 194 CO -0.03 0.01 0.46 0.00 0.00 0.00 0.00 179.25 179.70 1c1x h ALA 195 N 0.84 0.92 0.00 0.00 0.00 -1.15 -0.49 119.26 119.38 1c1x h ALA 195 Ca 0.07 -0.04 -0.04 0.00 0.00 0.00 0.00 54.91 54.91 1c1x h ALA 195 Cb 0.35 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 1c1x h ALA 195 CO 0.01 0.28 -0.18 1.49 0.00 0.00 0.00 179.25 180.85 1c1x h GLU 196 N 0.93 0.00 -0.02 0.00 4.81 -0.99 -0.39 114.58 118.92 1c1x h GLU 196 Ca 0.27 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.50 1c1x h GLU 196 Cb -0.05 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.33 1c1x h GLU 196 CO -0.08 0.18 0.00 0.00 -0.73 0.00 0.00 179.01 178.38 1c1x n ALA 197 N -2.39 2.62 -0.17 2.92 0.00 -0.30 -4.88 120.51 118.31 1c1x n ALA 197 Ca -0.02 -0.28 0.00 0.00 0.00 0.00 0.00 53.44 53.14 1c1x n ALA 197 Cb 0.26 -1.34 0.00 0.00 0.00 0.00 0.00 19.45 18.38 1c1x n ALA 197 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1c1x n GLY 198 N 1.01 0.68 3.81 0.00 0.00 -0.16 -3.00 105.19 107.53 1c1x n GLY 198 Ca 0.20 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.90 1c1x n GLY 198 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1c1x s ALA 199 N -2.24 2.67 -0.26 4.61 0.00 -0.55 -0.95 121.76 125.05 1c1x s ALA 199 Ca 0.00 0.20 -0.12 0.00 0.00 0.00 0.00 51.96 52.04 1c1x s ALA 199 Cb 0.00 -3.20 -0.05 0.00 0.00 0.00 0.00 23.12 19.87 1c1x s ALA 199 CO 0.00 -1.12 0.22 -0.65 0.00 0.00 0.00 175.76 174.21 1c1x s GLN 200 N -4.70 4.02 -0.17 0.00 -1.52 0.17 -4.45 119.66 113.00 1c1x s GLN 200 Ca 0.60 -0.22 -0.07 0.00 -1.95 0.00 0.00 55.36 53.72 1c1x s GLN 200 Cb -0.15 -3.60 -0.04 0.00 -0.22 0.00 0.00 33.01 29.00 1c1x s GLN 200 CO 0.49 -0.09 0.07 -0.51 -0.25 0.00 0.00 175.29 175.00 1c1x s LEU 201 N 1.49 3.90 -0.09 2.90 1.43 -1.26 -0.90 118.68 126.14 1c1x s LEU 201 Ca 0.09 0.14 -0.02 0.00 -1.03 0.00 0.00 54.13 53.31 1c1x s LEU 201 Cb -0.15 -1.98 -0.03 0.00 0.03 0.00 0.00 46.19 44.06 1c1x s LEU 201 CO 0.08 0.21 -0.01 -0.76 0.23 0.00 0.00 176.35 176.10 1c1x s LEU 202 N 0.14 3.50 0.03 1.79 1.43 -0.65 -0.84 118.68 124.08 1c1x s LEU 202 Ca 0.05 0.09 -0.01 0.00 -1.03 0.00 0.00 54.13 53.24 1c1x s LEU 202 Cb -0.12 -1.80 -0.03 0.00 0.03 0.00 0.00 46.19 44.27 1c1x s LEU 202 CO 0.00 0.35 -0.02 0.68 0.23 0.00 0.00 176.35 177.59 1c1x s VAL 203 N -0.71 0.16 -0.04 -1.59 -7.23 0.49 -1.04 120.40 110.42 1c1x s VAL 203 Ca 0.11 -1.29 -0.10 0.00 -1.81 0.00 0.00 61.98 58.89 1c1x s VAL 203 Cb -0.12 -0.82 0.02 0.00 0.56 0.00 0.00 36.38 36.02 1c1x s VAL 203 CO 0.02 -0.71 0.23 0.00 -0.31 0.00 0.00 175.10 174.33 1c1x s ALA 204 N -2.54 -0.57 -0.15 1.32 0.00 -0.80 -0.46 121.76 118.56 1c1x s ALA 204 Ca -0.06 0.35 -0.29 0.00 0.00 0.00 0.00 51.96 51.96 1c1x s ALA 204 Cb -0.02 -0.13 0.10 0.00 0.00 0.00 0.00 23.12 23.08 1c1x s ALA 204 CO -0.05 -0.18 0.88 0.34 0.00 0.00 0.00 175.76 176.75 1c1x s ASP 205 N -0.70 -0.50 0.43 0.00 2.15 -1.26 -0.66 116.67 116.13 1c1x s ASP 205 Ca -0.08 0.63 0.24 0.00 0.43 0.00 0.00 52.55 53.77 1c1x s ASP 205 Cb -0.04 0.53 0.68 0.00 -0.30 0.00 0.00 42.92 43.78 1c1x s ASP 205 CO 0.02 -0.40 1.72 0.71 -0.17 0.00 0.00 175.17 177.05 1c1x h THR 206 N 2.92 0.33 -2.70 1.71 1.35 -2.01 -3.40 112.91 111.11 1c1x h THR 206 Ca -0.23 -1.17 -0.58 0.00 -0.55 0.00 0.00 66.41 63.88 1c1x h THR 206 Cb 1.16 1.91 -0.11 0.00 -1.73 0.00 0.00 68.15 69.38 1c1x h THR 206 CO 0.29 0.16 0.80 -0.62 -0.25 0.00 0.00 175.52 175.90 1c1x s ASP 207 N -6.14 6.23 0.52 5.36 3.68 -1.26 -4.90 116.67 120.15 1c1x s ASP 207 Ca 0.03 -0.54 0.17 0.00 2.13 0.00 0.00 52.55 54.35 1c1x s ASP 207 Cb 0.08 -2.49 1.27 0.00 -1.45 0.00 0.00 42.92 40.33 1c1x s ASP 207 CO 0.65 -1.56 2.11 0.71 0.13 0.00 0.00 175.17 177.21 1c1x h THR 208 N 6.03 0.95 -0.62 1.71 1.35 -2.00 -1.40 112.91 118.92 1c1x h THR 208 Ca -0.28 -0.01 -0.08 0.00 -0.55 0.00 0.00 66.41 65.50 1c1x h THR 208 Cb 1.06 0.92 -0.02 0.00 -1.73 0.00 0.00 68.15 68.38 1c1x h THR 208 CO 1.20 0.01 0.08 -0.08 -0.25 0.00 0.00 175.52 176.48 1c1x h GLU 209 N 0.03 1.05 -0.62 4.72 4.81 -1.96 0.14 114.58 122.75 1c1x h GLU 209 Ca 0.06 -0.29 -0.09 0.00 -0.13 0.00 0.00 59.36 58.91 1c1x h GLU 209 Cb 0.20 -0.12 -0.02 0.00 0.63 0.00 0.00 28.75 29.44 1c1x h GLU 209 CO -0.00 0.99 0.05 0.00 -0.73 0.00 0.00 179.01 179.31 1c1x h ARG 210 N 0.96 1.05 -0.64 1.92 3.08 -1.66 -0.15 114.38 118.94 1c1x h ARG 210 Ca 0.19 -0.30 -0.09 0.00 0.07 0.00 0.00 59.98 59.85 1c1x h ARG 210 Cb 0.46 -0.11 -0.02 0.00 0.08 0.00 0.00 29.97 30.37 1c1x h ARG 210 CO 0.02 1.00 0.05 0.28 -1.07 0.00 0.00 179.97 180.24 1c1x h VAL 211 N 0.97 1.27 -0.65 2.04 2.07 -1.26 -0.27 116.25 120.43 1c1x h VAL 211 Ca 0.18 -1.11 -0.02 0.00 0.82 0.00 0.00 66.70 66.58 1c1x h VAL 211 Cb 0.49 0.72 -0.03 0.00 -1.52 0.00 0.00 31.29 30.96 1c1x h VAL 211 CO 0.02 0.41 0.34 0.00 0.02 0.00 0.00 177.57 178.36 1c1x h ALA 212 N 1.02 0.83 -0.18 1.67 0.00 -0.43 0.25 119.26 122.41 1c1x h ALA 212 Ca 0.19 -0.12 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 1c1x h ALA 212 Cb 0.51 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 1c1x h ALA 212 CO 0.02 0.37 0.09 1.25 0.00 0.00 0.00 179.25 180.98 1c1x h HIS 213 N 0.89 0.26 -0.94 0.00 6.17 -0.77 0.14 115.15 120.90 1c1x h HIS 213 Ca 0.23 -0.01 0.07 0.00 0.71 0.00 0.00 60.37 61.36 1c1x h HIS 213 Cb 0.07 -0.08 -0.07 0.00 2.52 0.00 0.00 27.41 29.86 1c1x h HIS 213 CO -0.00 0.27 0.60 0.00 0.71 0.00 0.00 177.93 179.51 1c1x h ALA 214 N 0.97 1.30 -0.59 5.26 0.00 -0.56 -1.54 119.26 124.10 1c1x h ALA 214 Ca 0.06 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 54.92 1c1x h ALA 214 Cb 0.10 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 17.60 1c1x h ALA 214 CO -0.01 0.36 0.22 0.28 0.00 0.00 0.00 179.25 180.10 1c1x h VAL 215 N 1.08 1.23 -0.01 0.00 2.07 -0.67 -0.08 116.25 119.87 1c1x h VAL 215 Ca 0.41 -0.74 0.00 0.00 0.82 0.00 0.00 66.70 67.19 1c1x h VAL 215 Cb 0.18 0.61 -0.00 0.00 -1.52 0.00 0.00 31.29 30.56 1c1x h VAL 215 CO -0.18 0.29 0.02 0.00 0.02 0.00 0.00 177.57 177.72 1c1x h ALA 216 N 1.07 1.56 -0.11 1.67 0.00 -0.10 0.19 119.26 123.54 1c1x h ALA 216 Ca 0.19 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.10 1c1x h ALA 216 Cb 0.23 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.02 1c1x h ALA 216 CO -0.01 -0.02 0.00 1.28 0.00 0.00 0.00 179.25 180.49 1c1x n LEU 217 N -3.85 1.39 0.00 0.00 4.77 -0.16 -4.91 117.00 114.24 1c1x n LEU 217 Ca -0.03 -0.56 0.00 0.00 -0.03 0.00 0.00 56.01 55.40 1c1x n LEU 217 Cb 0.10 -0.07 0.00 0.00 -2.33 0.00 0.00 43.42 41.12 1c1x n LEU 217 CO 0.27 0.28 0.00 0.61 -1.33 0.00 0.00 177.39 177.22 1c1x n GLY 218 N 1.10 0.61 3.95 -0.72 0.00 0.67 -5.08 105.19 105.72 1c1x n GLY 218 Ca 0.17 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.94 1c1x n GLY 218 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1c1x s HIS 219 N -2.09 2.70 -0.12 1.61 3.76 -0.50 -4.89 115.29 115.76 1c1x s HIS 219 Ca 0.00 0.25 0.00 0.00 -0.15 0.00 0.00 55.06 55.17 1c1x s HIS 219 Cb 0.00 -3.12 -0.01 0.00 1.11 0.00 0.00 32.58 30.56 1c1x s HIS 219 CO 0.00 -1.37 -0.14 0.99 -0.85 0.00 0.00 174.74 173.37 1c1x s THR 220 N -3.15 2.97 0.43 1.30 2.01 -0.02 -4.19 115.64 114.98 1c1x s THR 220 Ca 0.61 -0.70 -0.22 0.00 0.31 0.00 0.00 61.69 61.69 1c1x s THR 220 Cb -0.10 -2.23 -0.09 0.00 0.01 0.00 0.00 72.50 70.09 1c1x s THR 220 CO 0.44 0.53 1.04 0.00 -0.69 0.00 0.00 174.62 175.94 1c1x s ALA 221 N 0.28 3.01 -0.06 7.40 0.00 -1.26 -0.38 121.76 130.74 1c1x s ALA 221 Ca -0.10 0.65 0.03 0.00 0.00 0.00 0.00 51.96 52.54 1c1x s ALA 221 Cb -0.16 -3.26 0.01 0.00 0.00 0.00 0.00 23.12 19.71 1c1x s ALA 221 CO 0.06 -0.23 -0.16 0.08 0.00 0.00 0.00 175.76 175.51 1c1x s VAL 222 N -1.80 1.39 0.36 0.00 1.01 0.40 -4.81 120.40 116.94 1c1x s VAL 222 Ca 0.61 -0.65 -0.27 0.00 0.00 0.00 0.00 61.98 61.68 1c1x s VAL 222 Cb -0.19 -1.23 -0.09 0.00 0.00 0.00 0.00 36.38 34.87 1c1x s VAL 222 CO 0.24 0.41 1.16 0.00 0.00 0.00 0.00 175.10 176.91 1c1x s ALA 223 N 0.41 3.27 0.27 5.51 0.00 -1.26 -4.50 121.76 125.46 1c1x s ALA 223 Ca -0.12 0.98 -0.03 0.00 0.00 0.00 0.00 51.96 52.79 1c1x s ALA 223 Cb -0.15 -3.37 0.56 0.00 0.00 0.00 0.00 23.12 20.16 1c1x s ALA 223 CO 0.04 -0.42 1.65 -0.07 0.00 0.00 0.00 175.76 176.95 1c1x h LEU 224 N 3.07 -0.15 -1.51 0.00 3.38 -1.95 0.66 115.31 118.81 1c1x h LEU 224 Ca -0.48 0.19 0.00 0.00 0.09 0.00 0.00 57.88 57.68 1c1x h LEU 224 Cb 1.23 0.29 0.00 0.00 0.09 0.00 0.00 40.66 42.27 1c1x h LEU 224 CO 0.64 -0.15 0.00 1.05 0.09 0.00 0.00 178.44 180.07 1c1x h GLU 225 N 0.17 0.00 -0.01 1.13 4.11 -2.03 -2.05 114.58 115.90 1c1x h GLU 225 Ca 0.48 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.91 1c1x h GLU 225 Cb 0.90 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.15 1c1x h GLU 225 CO -0.64 0.00 -0.28 -0.25 0.07 0.00 0.00 179.01 177.91 1c1x n ASP 226 N -2.44 1.81 -0.11 3.06 10.43 0.23 -4.67 116.55 124.87 1c1x n ASP 226 Ca -0.01 -1.41 -0.06 0.00 2.57 0.00 0.00 54.79 55.89 1c1x n ASP 226 Cb 0.10 0.38 0.01 0.00 1.84 0.00 0.00 41.12 43.45 1c1x n ASP 226 CO 0.00 0.00 0.00 0.58 -1.07 0.00 0.00 177.20 176.71 1c1x h VAL 227 N 2.15 0.46 0.00 2.53 2.07 -0.95 -1.40 116.25 121.11 1c1x h VAL 227 Ca 0.00 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.52 1c1x h VAL 227 Cb 0.60 0.46 0.00 0.00 -1.52 0.00 0.00 31.29 30.82 1c1x h VAL 227 CO 0.00 0.00 0.00 0.18 0.02 0.00 0.00 177.57 177.77 1c1x n LEU 228 N -5.36 0.00 -0.46 2.57 4.77 -1.26 -2.97 117.00 114.29 1c1x n LEU 228 Ca 0.02 0.23 0.06 0.00 -0.03 0.00 0.00 56.01 56.28 1c1x n LEU 228 Cb 0.27 -0.23 0.05 0.00 -2.33 0.00 0.00 43.42 41.18 1c1x n LEU 228 CO 0.13 -0.03 0.44 -1.20 -1.33 0.00 0.00 177.39 175.39 1c1x n SER 229 N -1.23 1.99 -4.66 -1.43 7.64 -0.61 -4.61 113.62 110.71 1c1x n SER 229 Ca 0.14 -1.50 -0.42 0.00 1.01 0.00 0.00 58.87 58.10 1c1x n SER 229 Cb 0.19 -0.01 -0.04 0.00 -1.01 0.00 0.00 64.21 63.33 1c1x n SER 229 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 1c1x s THR 230 N -0.94 4.84 0.35 0.44 2.01 -0.72 -4.92 115.64 116.71 1c1x s THR 230 Ca 0.14 1.64 -0.28 0.00 0.31 0.00 0.00 61.69 63.50 1c1x s THR 230 Cb 0.09 -4.14 -0.10 0.00 0.01 0.00 0.00 72.50 68.37 1c1x s THR 230 CO 0.14 -0.04 1.28 -2.84 -0.69 0.00 0.00 174.62 172.47 1c1x s PRO 231 N 2.58 4.26 0.22 4.92 0.02 -1.26 -4.70 135.00 141.04 1c1x s PRO 231 Ca 0.37 2.13 -0.23 0.00 0.02 0.00 0.00 61.00 63.30 1c1x s PRO 231 Cb -0.16 -2.97 0.04 0.00 0.02 0.00 0.00 34.50 31.43 1c1x s PRO 231 CO 0.09 -0.24 0.81 0.00 -0.33 0.00 0.00 177.00 177.33 1c1x h ASP 233 N 2.00 0.36 -3.33 0.00 5.19 -1.43 -3.33 116.42 115.89 1c1x h ASP 233 Ca -0.22 -0.86 -0.66 0.00 -0.62 0.00 0.00 57.03 54.68 1c1x h ASP 233 Cb 1.25 -0.12 -0.33 0.00 0.18 0.00 0.00 39.33 40.31 1c1x h ASP 233 CO 0.25 1.55 -0.87 -0.69 -3.12 0.00 0.00 179.24 176.36 1c1x s VAL 234 N -2.45 1.97 -0.23 -1.35 1.01 -0.65 -0.74 120.40 117.96 1c1x s VAL 234 Ca -0.19 -0.96 -0.07 0.00 0.00 0.00 0.00 61.98 60.76 1c1x s VAL 234 Cb 0.04 -1.71 -0.03 0.00 0.00 0.00 0.00 36.38 34.68 1c1x s VAL 234 CO 0.76 0.54 0.05 0.12 0.00 0.00 0.00 175.10 176.58 1c1x s PHE 235 N 0.43 3.10 -0.55 5.22 5.36 -0.22 -0.42 117.98 130.89 1c1x s PHE 235 Ca -0.17 -0.35 0.04 0.00 -0.96 0.00 0.00 56.93 55.49 1c1x s PHE 235 Cb -0.18 -2.18 0.14 0.00 -0.34 0.00 0.00 43.02 40.46 1c1x s PHE 235 CO 0.07 -0.25 0.30 0.00 -1.46 0.00 0.00 175.22 173.88 1c1x s ALA 236 N 1.29 3.40 -0.23 11.12 0.00 0.39 -1.23 121.76 136.50 1c1x s ALA 236 Ca 0.05 -3.37 -0.29 0.00 0.00 0.00 0.00 51.96 48.35 1c1x s ALA 236 Cb -0.15 -2.18 -0.02 0.00 0.00 0.00 0.00 23.12 20.78 1c1x s ALA 236 CO 0.03 -2.03 1.50 -1.25 0.00 0.00 0.00 175.76 174.01 1c1x s PRO 237 N -0.47 3.88 -0.08 0.00 0.04 -1.26 -1.79 135.00 135.32 1c1x s PRO 237 Ca 0.18 1.57 0.17 0.00 0.04 0.00 0.00 61.00 62.97 1c1x s PRO 237 Cb -0.23 -3.97 0.36 0.00 0.04 0.00 0.00 34.50 30.70 1c1x s PRO 237 CO -0.03 -1.18 1.16 0.00 0.04 0.00 0.00 177.00 177.00 1c1x n ALA 239 N -0.30 0.00 -2.09 0.00 0.00 -1.00 -4.61 120.51 112.51 1c1x n ALA 239 Ca 0.11 0.00 -0.29 0.00 0.00 0.00 0.00 53.44 53.26 1c1x n ALA 239 Cb 0.89 0.00 0.01 0.00 0.00 0.00 0.00 19.45 20.34 1c1x n ALA 239 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1c1x s MET 240 N 2.55 3.54 0.79 0.00 0.00 -1.26 -4.68 119.30 120.24 1c1x s MET 240 Ca 0.00 0.43 -0.08 0.00 0.00 0.00 0.00 55.69 56.04 1c1x s MET 240 Cb 0.00 -2.24 0.17 0.00 0.00 0.00 0.00 34.83 32.76 1c1x s MET 240 CO 0.00 -0.38 1.07 0.41 0.00 0.00 0.00 175.02 176.12 1c1x n GLY 241 N -2.49 -0.44 2.45 3.16 0.00 -1.25 -4.42 105.19 102.19 1c1x n GLY 241 Ca 0.03 -1.86 -0.17 0.00 0.00 0.00 0.00 46.02 44.02 1c1x n GLY 241 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1c1x n GLY 242 N -2.52 1.13 0.16 -0.02 0.00 0.23 -4.92 105.19 99.25 1c1x n GLY 242 Ca 0.15 -0.20 -0.13 0.00 0.00 0.00 0.00 46.02 45.84 1c1x n GLY 242 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 1c1x h VAL 243 N 0.00 1.40 -2.88 1.61 -1.51 -1.62 -3.40 116.25 109.85 1c1x h VAL 243 Ca -0.36 -2.40 -0.72 0.00 -1.23 0.00 0.00 66.70 61.99 1c1x h VAL 243 Cb 1.16 2.38 -0.20 0.00 -2.13 0.00 0.00 31.29 32.50 1c1x h VAL 243 CO 0.50 0.72 0.52 -0.63 -1.23 0.00 0.00 177.57 177.45 1c1x s ILE 244 N -3.31 4.97 0.78 7.19 1.01 -0.77 -4.86 121.20 126.21 1c1x s ILE 244 Ca -0.06 -1.70 -0.08 0.00 0.00 0.00 0.00 60.65 58.81 1c1x s ILE 244 Cb 0.09 -4.65 0.12 0.00 0.01 0.00 0.00 42.46 38.02 1c1x s ILE 244 CO 0.87 -1.32 1.10 0.42 0.00 0.00 0.00 174.94 176.00 1c1x s THR 245 N 2.03 2.16 0.22 2.92 -4.23 -1.26 -0.70 115.64 116.78 1c1x s THR 245 Ca 0.25 -0.27 -0.08 0.00 -1.18 0.00 0.00 61.69 60.41 1c1x s THR 245 Cb -0.09 -2.89 0.16 0.00 1.34 0.00 0.00 72.50 71.02 1c1x s THR 245 CO -0.07 0.00 1.79 0.74 -0.54 0.00 0.00 174.62 176.54 1c1x h THR 246 N -0.88 0.89 -0.27 3.99 2.02 -1.92 0.55 112.91 117.29 1c1x h THR 246 Ca -0.42 -0.21 -0.01 0.00 0.77 0.00 0.00 66.41 66.53 1c1x h THR 246 Cb 1.28 0.22 -0.01 0.00 -1.74 0.00 0.00 68.15 67.90 1c1x h THR 246 CO 0.49 0.11 0.11 -0.33 0.37 0.00 0.00 175.52 176.27 1c1x h GLU 247 N 0.61 0.40 -0.61 6.66 3.07 -1.98 -2.44 114.58 120.28 1c1x h GLU 247 Ca 0.32 -0.07 -0.05 0.00 -0.50 0.00 0.00 59.36 59.07 1c1x h GLU 247 Cb 0.30 -0.06 -0.03 0.00 -0.84 0.00 0.00 28.75 28.12 1c1x h GLU 247 CO -0.24 0.42 0.19 0.28 -1.40 0.00 0.00 179.01 178.27 1c1x h VAL 248 N 0.28 1.23 -0.11 3.13 2.07 -1.80 -2.62 116.25 118.43 1c1x h VAL 248 Ca 0.09 -0.80 -0.00 0.00 0.82 0.00 0.00 66.70 66.81 1c1x h VAL 248 Cb 0.17 0.56 -0.01 0.00 -1.52 0.00 0.00 31.29 30.50 1c1x h VAL 248 CO -0.01 0.31 0.05 0.00 0.02 0.00 0.00 177.57 177.94 1c1x h ALA 249 N 1.31 1.88 0.00 1.67 0.00 -0.43 0.97 119.26 124.66 1c1x h ALA 249 Ca 0.20 -0.03 -0.08 0.00 0.00 0.00 0.00 54.91 55.00 1c1x h ALA 249 Cb 0.26 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.99 1c1x h ALA 249 CO -0.01 0.10 -0.39 0.00 0.00 0.00 0.00 179.25 178.96 1c1x h ARG 250 N 0.15 0.00 -0.00 0.00 3.08 -1.12 -3.34 114.38 113.15 1c1x h ARG 250 Ca 0.04 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.09 1c1x h ARG 250 Cb 0.03 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.08 1c1x h ARG 250 CO -0.01 0.39 -0.31 0.25 -1.07 0.00 0.00 179.97 179.22 1c1x n THR 251 N -3.39 0.00 -1.65 2.04 -2.24 -0.77 -5.01 114.28 103.27 1c1x n THR 251 Ca 0.01 -0.34 -0.49 0.00 -2.27 0.00 0.00 64.05 60.96 1c1x n THR 251 Cb 0.57 1.05 -0.05 0.00 -2.10 0.00 0.00 70.33 69.80 1c1x n THR 251 CO 0.00 0.00 0.00 -0.11 -0.57 0.00 0.00 175.07 174.39 1c1x n LEU 252 N -0.78 2.64 -3.81 3.22 7.94 0.26 -4.90 117.00 121.58 1c1x n LEU 252 Ca 0.03 1.08 -0.38 0.00 -1.11 0.00 0.00 56.01 55.63 1c1x n LEU 252 Cb 0.16 -1.33 -0.02 0.00 0.53 0.00 0.00 43.42 42.76 1c1x n LEU 252 CO 0.15 -0.51 0.78 -0.67 -1.11 0.00 0.00 177.39 176.03 1c1x n ASP 253 N 3.55 5.54 -4.05 1.96 4.64 -1.26 -4.99 116.55 121.94 1c1x n ASP 253 Ca 0.18 -3.43 -0.11 0.00 -1.38 0.00 0.00 54.79 50.06 1c1x n ASP 253 Cb 0.25 -1.07 -0.07 0.00 -1.04 0.00 0.00 41.12 39.19 1c1x n ASP 253 CO 0.00 0.00 0.00 0.00 -0.82 0.00 0.00 177.20 176.38 1c1x n SER 255 N -0.39 0.24 -4.00 0.00 7.64 0.08 -4.79 113.62 112.41 1c1x n SER 255 Ca 0.00 0.00 -0.12 0.00 1.01 0.00 0.00 58.87 59.76 1c1x n SER 255 Cb 0.64 1.55 -0.12 0.00 -1.01 0.00 0.00 64.21 65.26 1c1x n SER 255 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 1c1x s VAL 256 N -3.04 0.35 -0.17 0.44 1.01 -0.48 -1.20 120.40 117.31 1c1x s VAL 256 Ca -0.08 -0.74 0.00 0.00 0.00 0.00 0.00 61.98 61.16 1c1x s VAL 256 Cb 0.10 -0.40 0.03 0.00 0.00 0.00 0.00 36.38 36.11 1c1x s VAL 256 CO 0.83 -0.27 -0.12 -0.69 0.00 0.00 0.00 175.10 174.86 1c1x s VAL 257 N -0.99 1.55 -0.27 2.92 1.01 -0.53 -1.06 120.40 123.04 1c1x s VAL 257 Ca -0.08 -0.79 -0.01 0.00 0.00 0.00 0.00 61.98 61.11 1c1x s VAL 257 Cb -0.07 -1.55 0.16 0.00 0.00 0.00 0.00 36.38 34.91 1c1x s VAL 257 CO -0.00 0.30 0.45 0.00 0.00 0.00 0.00 175.10 175.86 1c1x s ALA 258 N 1.47 -1.50 0.17 5.51 0.00 -0.37 -0.65 121.76 126.39 1c1x s ALA 258 Ca 0.02 1.06 0.01 0.00 0.00 0.00 0.00 51.96 53.06 1c1x s ALA 258 Cb -0.14 -1.92 -0.00 0.00 0.00 0.00 0.00 23.12 21.05 1c1x s ALA 258 CO -0.09 -1.39 0.19 0.41 0.00 0.00 0.00 175.76 174.88 1c1x n GLY 259 N 5.38 3.05 0.05 0.00 0.00 -1.26 -4.13 105.19 108.28 1c1x n GLY 259 Ca -0.02 -1.63 0.11 0.00 0.00 0.00 0.00 46.02 44.48 1c1x n GLY 259 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1c1x n ALA 260 N -1.88 2.98 -1.75 4.61 0.00 -0.35 -4.46 120.51 119.65 1c1x n ALA 260 Ca -0.06 -0.38 -0.40 0.00 0.00 0.00 0.00 53.44 52.59 1c1x n ALA 260 Cb 0.29 -0.95 0.01 0.00 0.00 0.00 0.00 19.45 18.80 1c1x n ALA 260 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1c1x n ALA 261 N -2.05 1.96 -2.00 0.00 0.00 -0.23 -4.81 120.51 113.39 1c1x n ALA 261 Ca -0.00 0.27 -0.32 0.00 0.00 0.00 0.00 53.44 53.39 1c1x n ALA 261 Cb 0.51 -2.37 -0.06 0.00 0.00 0.00 0.00 19.45 17.53 1c1x n ALA 261 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 1c1x s ASN 262 N -0.41 6.78 -1.28 0.00 0.01 -1.26 -4.22 114.94 114.56 1c1x s ASN 262 Ca 0.59 1.44 -0.19 0.00 -0.71 0.00 0.00 52.86 54.00 1c1x s ASN 262 Cb -0.47 -2.44 0.01 0.00 0.41 0.00 0.00 41.25 38.77 1c1x s ASN 262 CO 0.59 -0.33 0.57 0.59 -1.51 0.00 0.00 177.10 177.01 1c1x n ASN 263 N -0.73 -3.02 -0.16 -1.22 3.02 -1.26 -3.83 115.26 108.06 1c1x n ASN 263 Ca 0.05 -1.15 -0.08 0.00 -0.03 0.00 0.00 54.58 53.37 1c1x n ASN 263 Cb 0.54 -2.49 0.01 0.00 -0.61 0.00 0.00 39.78 37.22 1c1x n ASN 263 CO 0.00 0.00 0.00 0.58 -2.62 0.00 0.00 177.26 175.22 1c1x h VAL 264 N -2.13 1.15 -3.31 2.41 2.07 -1.92 0.67 116.25 115.19 1c1x h VAL 264 Ca -0.67 -0.35 -0.59 0.00 0.82 0.00 0.00 66.70 65.90 1c1x h VAL 264 Cb 1.38 0.54 -0.08 0.00 -1.52 0.00 0.00 31.29 31.61 1c1x h VAL 264 CO 0.55 0.15 0.57 -0.63 0.02 0.00 0.00 177.57 178.24 1c1x s ILE 265 N -5.96 4.73 0.15 4.57 -1.09 -1.26 -1.84 121.20 120.50 1c1x s ILE 265 Ca -0.13 1.53 0.02 0.00 -2.23 0.00 0.00 60.65 59.85 1c1x s ILE 265 Cb 0.11 -4.22 -0.17 0.00 -1.58 0.00 0.00 42.46 36.60 1c1x s ILE 265 CO 0.74 -0.24 1.35 0.00 -1.23 0.00 0.00 174.94 175.56 1c1x h ALA 266 N 7.90 0.47 -3.10 9.38 0.00 -1.15 -3.44 119.26 129.30 1c1x h ALA 266 Ca -0.22 -0.76 -0.26 0.00 0.00 0.00 0.00 54.91 53.67 1c1x h ALA 266 Cb 1.08 -0.08 -0.21 0.00 0.00 0.00 0.00 17.79 18.59 1c1x h ALA 266 CO 0.93 0.95 -0.73 0.16 0.00 0.00 0.00 179.25 180.56 1c1x s ASP 267 N -6.93 0.77 0.42 0.00 1.47 -1.26 -5.03 116.67 106.12 1c1x s ASP 267 Ca -0.03 -0.56 0.08 0.00 1.18 0.00 0.00 52.55 53.23 1c1x s ASP 267 Cb 0.10 0.05 0.91 0.00 -0.34 0.00 0.00 42.92 43.64 1c1x s ASP 267 CO 0.83 -0.23 2.07 -0.08 0.68 0.00 0.00 175.17 178.44 1c1x h GLU 268 N 4.46 0.47 -0.70 2.11 4.81 -1.97 -1.28 114.58 122.49 1c1x h GLU 268 Ca -0.35 -0.03 0.02 0.00 -0.13 0.00 0.00 59.36 58.87 1c1x h GLU 268 Cb 1.20 -0.11 -0.04 0.00 0.63 0.00 0.00 28.75 30.44 1c1x h GLU 268 CO 0.42 0.31 0.46 0.00 -0.73 0.00 0.00 179.01 179.47 1c1x h ALA 269 N 1.78 1.56 -0.84 2.92 0.00 -1.99 -0.78 119.26 121.90 1c1x h ALA 269 Ca 0.13 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.98 1c1x h ALA 269 Cb -0.05 -0.26 -0.04 0.00 0.00 0.00 0.00 17.79 17.44 1c1x h ALA 269 CO -0.03 0.39 0.46 0.00 0.00 0.00 0.00 179.25 180.07 1c1x h ALA 270 N 1.58 1.23 -0.34 0.00 0.00 -1.53 0.06 119.26 120.26 1c1x h ALA 270 Ca 0.27 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 55.05 1c1x h ALA 270 Cb -0.02 -0.34 -0.02 0.00 0.00 0.00 0.00 17.79 17.42 1c1x h ALA 270 CO -0.07 0.62 0.22 1.03 0.00 0.00 0.00 179.25 181.05 1c1x h SER 271 N 1.17 0.39 -0.70 0.00 0.87 -1.09 -0.97 113.55 113.23 1c1x h SER 271 Ca 0.30 -0.02 -0.02 0.00 -1.23 0.00 0.00 61.79 60.81 1c1x h SER 271 Cb 0.03 -0.10 -0.03 0.00 -0.44 0.00 0.00 62.40 61.85 1c1x h SER 271 CO -0.05 0.30 0.35 0.44 -0.53 0.00 0.00 176.83 177.34 1c1x h ASP 272 N 0.45 0.90 -0.01 6.23 3.32 -0.76 -2.37 116.42 124.18 1c1x h ASP 272 Ca 0.12 -0.12 -0.00 0.00 0.02 0.00 0.00 57.03 57.05 1c1x h ASP 272 Cb -0.03 -0.23 -0.00 0.00 0.22 0.00 0.00 39.33 39.29 1c1x h ASP 272 CO -0.03 0.76 0.00 0.40 -1.72 0.00 0.00 179.24 178.66 1c1x h ILE 273 N 0.97 1.17 -0.61 0.35 2.04 -0.82 0.50 117.51 121.11 1c1x h ILE 273 Ca 0.24 -0.50 0.06 0.00 1.00 0.00 0.00 64.86 65.66 1c1x h ILE 273 Cb 0.09 1.49 -0.06 0.00 -0.74 0.00 0.00 36.82 37.60 1c1x h ILE 273 CO -0.03 0.13 0.31 -0.07 0.00 0.00 0.00 178.15 178.49 1c1x h LEU 274 N -0.19 0.42 -0.27 1.44 3.38 -1.14 0.16 115.31 119.12 1c1x h LEU 274 Ca 0.00 0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.02 1c1x h LEU 274 Cb 0.21 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 40.91 1c1x h LEU 274 CO -0.00 0.27 0.17 -0.74 0.09 0.00 0.00 178.44 178.23 1c1x h HIS 275 N 0.56 0.32 -0.05 1.13 2.76 -1.23 -0.69 115.15 117.95 1c1x h HIS 275 Ca 0.28 0.01 -0.08 0.00 -2.20 0.00 0.00 60.37 58.38 1c1x h HIS 275 Cb 0.22 -0.11 -0.01 0.00 1.55 0.00 0.00 27.41 29.06 1c1x h HIS 275 CO -0.11 0.20 -0.34 0.00 -1.30 0.00 0.00 177.93 176.39 1c1x h ALA 276 N 1.10 1.34 0.00 5.26 0.00 -0.33 -2.23 119.26 124.40 1c1x h ALA 276 Ca 0.10 -0.33 0.00 0.00 0.00 0.00 0.00 54.91 54.68 1c1x h ALA 276 Cb -0.03 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.69 1c1x h ALA 276 CO -0.03 0.47 0.00 0.54 0.00 0.00 0.00 179.25 180.23 1c1x n ARG 277 N -4.11 0.18 -0.83 0.00 1.74 -0.01 -4.92 116.66 108.71 1c1x n ARG 277 Ca -0.02 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.07 1c1x n ARG 277 Cb 0.40 -1.50 0.00 0.00 -1.02 0.00 0.00 32.46 30.34 1c1x n ARG 277 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1c1x n GLY 278 N 1.39 0.50 3.50 -0.13 0.00 -0.83 -5.01 105.19 104.61 1c1x n GLY 278 Ca 0.10 -0.78 -0.42 0.00 0.00 0.00 0.00 46.02 44.92 1c1x n GLY 278 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1c1x s ILE 279 N -2.00 5.12 -0.35 -0.61 1.01 -0.33 -4.89 121.20 119.15 1c1x s ILE 279 Ca 0.00 -0.21 -0.29 0.00 0.00 0.00 0.00 60.65 60.15 1c1x s ILE 279 Cb 0.00 -3.96 0.02 0.00 0.01 0.00 0.00 42.46 38.52 1c1x s ILE 279 CO 0.00 -0.31 1.13 -0.22 0.00 0.00 0.00 174.94 175.54 1c1x s LEU 280 N 2.09 3.86 -0.20 2.97 2.96 -0.34 -4.13 118.68 125.90 1c1x s LEU 280 Ca 0.12 0.96 -0.08 0.00 -0.22 0.00 0.00 54.13 54.91 1c1x s LEU 280 Cb -0.17 -3.54 -0.04 0.00 0.50 0.00 0.00 46.19 42.93 1c1x s LEU 280 CO 0.13 -0.99 0.09 -0.47 -1.32 0.00 0.00 176.35 173.79 1c1x s TYR 281 N 3.94 3.29 -0.39 5.38 6.04 -1.26 -1.45 117.35 132.90 1c1x s TYR 281 Ca 0.48 0.14 -0.20 0.00 0.04 0.00 0.00 57.07 57.53 1c1x s TYR 281 Cb -0.12 -2.13 0.01 0.00 -1.04 0.00 0.00 41.96 38.69 1c1x s TYR 281 CO 0.20 0.16 0.59 0.00 -1.54 0.00 0.00 175.55 174.96 1c1x s ALA 282 N 0.48 3.41 0.09 3.97 0.00 0.18 -4.77 121.76 125.12 1c1x s ALA 282 Ca 0.05 -1.09 -0.35 0.00 0.00 0.00 0.00 51.96 50.56 1c1x s ALA 282 Cb -0.12 -3.17 -0.15 0.00 0.00 0.00 0.00 23.12 19.68 1c1x s ALA 282 CO 0.00 -1.51 1.52 -2.30 0.00 0.00 0.00 175.76 173.48 1c1x n PRO 283 N 6.01 1.71 -0.25 0.00 -0.02 -1.26 -4.68 135.00 136.52 1c1x n PRO 283 Ca -0.03 0.62 -0.05 0.00 -2.02 0.00 0.00 63.50 62.02 1c1x n PRO 283 Cb 0.48 -2.34 0.00 0.00 -0.02 0.00 0.00 33.50 31.62 1c1x n PRO 283 CO 0.00 0.00 0.00 0.38 1.98 0.00 0.00 175.50 177.86 1c1x h ASP 284 N 5.74 -1.33 0.03 2.55 -0.00 -1.90 0.29 116.42 121.79 1c1x h ASP 284 Ca -0.46 0.25 0.00 0.00 -0.00 0.00 0.00 57.03 56.82 1c1x h ASP 284 Cb 1.29 0.65 0.00 0.00 -0.00 0.00 0.00 39.33 41.27 1c1x h ASP 284 CO 0.85 -0.31 0.00 2.19 -0.00 0.00 0.00 179.24 181.98 1c1x h PHE 285 N -0.14 0.00 0.00 4.15 -5.15 -1.89 0.17 116.94 114.09 1c1x h PHE 285 Ca 0.24 0.00 -0.36 0.00 -0.20 0.00 0.00 57.97 57.65 1c1x h PHE 285 Cb 0.56 0.00 -0.05 0.00 0.22 0.00 0.00 35.95 36.68 1c1x h PHE 285 CO -0.72 0.00 -1.99 0.28 -2.00 0.00 0.00 178.31 173.88 1c1x n VAL 286 N -2.64 1.53 -0.06 0.88 0.31 0.21 -4.34 118.33 114.22 1c1x n VAL 286 Ca -0.02 -0.23 -0.01 0.00 -0.01 0.00 0.00 64.34 64.07 1c1x n VAL 286 Cb 0.06 -1.95 0.26 0.00 -0.91 0.00 0.00 33.84 31.29 1c1x n VAL 286 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1c1x h ALA 287 N -0.78 1.32 -0.68 3.52 0.00 0.28 -3.03 119.26 119.88 1c1x h ALA 287 Ca -0.55 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.17 1c1x h ALA 287 Cb 1.48 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 19.09 1c1x h ALA 287 CO -0.33 0.47 0.00 0.27 0.00 0.00 0.00 179.25 179.66 1c1x n ASN 288 N -4.29 3.60 0.00 0.00 0.23 0.54 -3.17 115.26 112.17 1c1x n ASN 288 Ca 0.03 -2.00 0.01 0.00 -0.53 0.00 0.00 54.58 52.09 1c1x n ASN 288 Cb 0.23 -0.45 0.06 0.00 -2.08 0.00 0.00 39.78 37.54 1c1x n ASN 288 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1c1x n ALA 289 N 1.47 1.22 -0.20 -2.53 0.00 -1.15 -3.36 120.51 115.97 1c1x n ALA 289 Ca 0.23 -0.01 0.09 0.00 0.00 0.00 0.00 53.44 53.74 1c1x n ALA 289 Cb 0.57 -1.05 0.37 0.00 0.00 0.00 0.00 19.45 19.35 1c1x n ALA 289 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 1c1x h GLY 290 N 0.47 0.99 0.93 0.00 0.00 -1.79 0.00 103.07 103.67 1c1x h GLY 290 Ca 0.00 -0.29 -0.02 0.00 0.00 0.00 0.00 47.33 47.02 1c1x h GLY 290 CO 0.00 0.18 0.15 -1.33 0.00 0.00 0.00 176.54 175.53 1c1x h GLY 291 N 0.71 0.55 1.08 4.60 0.00 -1.77 -0.38 103.07 107.85 1c1x h GLY 291 Ca 0.35 -0.29 -0.08 0.00 0.00 0.00 0.00 47.33 47.31 1c1x h GLY 291 CO -0.13 0.27 0.12 0.00 0.00 0.00 0.00 176.54 176.80 1c1x h ALA 292 N 1.00 0.91 -0.76 3.60 0.00 -1.62 -0.15 119.26 122.25 1c1x h ALA 292 Ca 0.12 -0.27 0.01 0.00 0.00 0.00 0.00 54.91 54.77 1c1x h ALA 292 Cb 0.16 -0.26 -0.04 0.00 0.00 0.00 0.00 17.79 17.65 1c1x h ALA 292 CO -0.01 0.67 0.49 0.82 0.00 0.00 0.00 179.25 181.23 1c1x h ILE 293 N 1.06 1.17 0.21 0.00 2.04 -0.71 0.29 117.51 121.56 1c1x h ILE 293 Ca 0.21 -0.34 -0.01 0.00 1.00 0.00 0.00 64.86 65.72 1c1x h ILE 293 Cb 0.44 0.08 0.00 0.00 -0.74 0.00 0.00 36.82 36.60 1c1x h ILE 293 CO 0.01 0.18 -0.10 -0.74 0.00 0.00 0.00 178.15 177.50 1c1x h HIS 294 N 1.00 -0.26 0.52 1.37 2.76 -0.61 0.62 115.15 120.54 1c1x h HIS 294 Ca 0.28 -0.01 -0.03 0.00 -2.20 0.00 0.00 60.37 58.42 1c1x h HIS 294 Cb -0.08 0.09 0.01 0.00 1.55 0.00 0.00 27.41 28.97 1c1x h HIS 294 CO -0.02 0.01 -0.25 -0.07 -1.30 0.00 0.00 177.93 176.29 1c1x h LEU 295 N -0.52 -0.59 -0.29 0.26 3.38 -0.87 -0.39 115.31 116.29 1c1x h LEU 295 Ca -0.03 -0.04 -0.06 0.00 0.09 0.00 0.00 57.88 57.83 1c1x h LEU 295 Cb 0.39 0.15 -0.01 0.00 0.09 0.00 0.00 40.66 41.28 1c1x h LEU 295 CO 0.05 -0.30 -0.06 0.58 0.09 0.00 0.00 178.44 178.79 1c1x h VAL 296 N -0.86 1.28 -0.01 1.22 2.07 -1.05 -0.21 116.25 118.69 1c1x h VAL 296 Ca -0.07 -1.08 0.01 0.00 0.82 0.00 0.00 66.70 66.38 1c1x h VAL 296 Cb 0.60 1.38 -0.02 0.00 -1.52 0.00 0.00 31.29 31.74 1c1x h VAL 296 CO 0.12 0.35 -0.07 1.23 0.02 0.00 0.00 177.57 179.22 1c1x h GLY 297 N 0.33 -0.07 0.53 2.17 0.00 -0.90 0.29 103.07 105.42 1c1x h GLY 297 Ca 0.08 0.08 -0.00 0.00 0.00 0.00 0.00 47.33 47.48 1c1x h GLY 297 CO 0.03 -0.07 -0.03 3.21 0.00 0.00 0.00 176.54 179.67 1c1x h ARG 298 N -0.11 -0.08 0.00 4.80 2.47 -1.08 0.62 114.38 121.00 1c1x h ARG 298 Ca 0.03 0.01 -0.06 0.00 -1.26 0.00 0.00 59.98 58.70 1c1x h ARG 298 Cb 0.15 0.02 -0.01 0.00 -1.65 0.00 0.00 29.97 28.48 1c1x h ARG 298 CO -0.07 0.36 -0.55 0.93 0.56 0.00 0.00 179.97 181.19 1c1x h GLU 299 N -0.56 0.00 0.00 0.04 5.08 -1.04 -3.32 114.58 114.79 1c1x h GLU 299 Ca -0.01 0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 58.32 1c1x h GLU 299 Cb 0.48 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.73 1c1x h GLU 299 CO 0.01 0.20 -1.12 0.28 -1.00 0.00 0.00 179.01 177.39 1c1x n VAL 300 N -3.03 0.12 0.95 3.13 0.31 0.85 -4.76 118.33 115.91 1c1x n VAL 300 Ca 0.01 -0.05 0.12 0.00 -0.01 0.00 0.00 64.34 64.40 1c1x n VAL 300 Cb 0.64 -0.61 0.19 0.00 -0.91 0.00 0.00 33.84 33.16 1c1x n VAL 300 CO 0.00 0.00 0.00 0.18 -1.32 0.00 0.00 176.83 175.69 1c1x n LEU 301 N -2.52 0.57 -0.93 7.52 4.77 -0.20 -4.95 117.00 121.26 1c1x n LEU 301 Ca -0.04 -0.04 -0.09 0.00 -0.03 0.00 0.00 56.01 55.81 1c1x n LEU 301 Cb 0.54 -0.21 -0.01 0.00 -2.33 0.00 0.00 43.42 41.41 1c1x n LEU 301 CO 0.02 0.12 -0.11 0.61 -1.33 0.00 0.00 177.39 176.71 1c1x n GLY 302 N 1.48 0.32 3.79 -0.72 0.00 -0.56 -5.00 105.19 104.51 1c1x n GLY 302 Ca 0.05 -0.54 -0.36 0.00 0.00 0.00 0.00 46.02 45.17 1c1x n GLY 302 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1c1x s TRP 303 N -2.42 3.43 0.89 1.61 0.51 0.10 -4.98 118.94 118.09 1c1x s TRP 303 Ca 0.00 1.69 -0.12 0.00 -2.12 0.00 0.00 56.10 55.55 1c1x s TRP 303 Cb 0.00 -2.98 0.13 0.00 -0.81 0.00 0.00 33.47 29.80 1c1x s TRP 303 CO 0.00 -0.19 1.11 -1.54 -0.51 0.00 0.00 176.95 175.81 1c1x s SER 304 N -1.73 3.60 0.32 2.95 1.04 -1.26 -4.41 113.70 114.21 1c1x s SER 304 Ca 0.56 1.20 0.02 0.00 0.48 0.00 0.00 55.95 58.21 1c1x s SER 304 Cb -0.18 -1.86 0.55 0.00 0.10 0.00 0.00 66.02 64.63 1c1x s SER 304 CO 0.23 -2.52 1.88 -0.33 0.98 0.00 0.00 173.24 173.47 1c1x h GLU 305 N -1.47 0.65 -0.32 4.02 5.08 -1.99 -0.94 114.58 119.61 1c1x h GLU 305 Ca -0.50 -0.12 -0.06 0.00 -1.00 0.00 0.00 59.36 57.68 1c1x h GLU 305 Cb 1.30 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 30.44 1c1x h GLU 305 CO 0.59 0.61 -0.02 1.03 -1.00 0.00 0.00 179.01 180.22 1c1x h SER 306 N 0.63 0.58 -0.72 1.42 0.87 -1.99 -0.67 113.55 113.67 1c1x h SER 306 Ca 0.14 -0.32 -0.06 0.00 -1.23 0.00 0.00 61.79 60.32 1c1x h SER 306 Cb 0.27 -0.16 -0.03 0.00 -0.44 0.00 0.00 62.40 62.04 1c1x h SER 306 CO -0.00 0.76 0.22 0.58 -0.53 0.00 0.00 176.83 177.86 1c1x h VAL 307 N 0.38 1.26 -0.19 2.23 2.07 -1.78 -1.26 116.25 118.96 1c1x h VAL 307 Ca 0.09 -0.91 0.03 0.00 0.82 0.00 0.00 66.70 66.72 1c1x h VAL 307 Cb 0.48 0.48 -0.03 0.00 -1.52 0.00 0.00 31.29 30.71 1c1x h VAL 307 CO 0.02 0.36 0.02 0.58 0.02 0.00 0.00 177.57 178.57 1c1x h VAL 308 N 1.07 0.90 -0.50 2.57 2.07 -1.04 0.28 116.25 121.60 1c1x h VAL 308 Ca 0.23 -0.03 0.08 0.00 0.82 0.00 0.00 66.70 67.80 1c1x h VAL 308 Cb 0.32 0.79 -0.07 0.00 -1.52 0.00 0.00 31.29 30.81 1c1x h VAL 308 CO -0.01 0.02 0.13 -0.74 0.02 0.00 0.00 177.57 177.00 1c1x h HIS 309 N 0.10 0.22 -0.36 1.57 6.17 -0.67 -0.76 115.15 121.42 1c1x h HIS 309 Ca 0.09 0.03 -0.01 0.00 0.71 0.00 0.00 60.37 61.19 1c1x h HIS 309 Cb 0.09 -0.02 -0.02 0.00 2.52 0.00 0.00 27.41 29.98 1c1x h HIS 309 CO -0.15 0.03 0.20 1.49 0.71 0.00 0.00 177.93 180.21 1c1x h GLU 310 N 0.28 0.50 -0.64 5.26 4.81 -0.56 -0.79 114.58 123.44 1c1x h GLU 310 Ca 0.25 -0.06 -0.00 0.00 -0.13 0.00 0.00 59.36 59.42 1c1x h GLU 310 Cb 0.31 -0.10 -0.03 0.00 0.63 0.00 0.00 28.75 29.56 1c1x h GLU 310 CO -0.30 0.40 0.38 0.00 -0.73 0.00 0.00 179.01 178.76 1c1x h ARG 311 N 0.45 0.86 -0.47 1.92 2.47 0.28 -1.13 114.38 118.77 1c1x h ARG 311 Ca 0.13 -0.07 -0.13 0.00 -1.26 0.00 0.00 59.98 58.65 1c1x h ARG 311 Cb 0.05 -0.18 -0.01 0.00 -1.65 0.00 0.00 29.97 28.17 1c1x h ARG 311 CO -0.02 0.61 -0.21 0.00 0.56 0.00 0.00 179.97 180.91 1c1x h ALA 312 N 1.54 0.75 -0.37 0.04 0.00 -0.77 -2.48 119.26 117.97 1c1x h ALA 312 Ca 0.23 -0.38 -0.05 0.00 0.00 0.00 0.00 54.91 54.70 1c1x h ALA 312 Cb -0.03 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.58 1c1x h ALA 312 CO -0.04 0.66 0.01 0.28 0.00 0.00 0.00 179.25 180.16 1c1x h VAL 313 N 0.82 1.21 0.00 0.00 2.07 -0.53 -1.61 116.25 118.21 1c1x h VAL 313 Ca 0.11 -0.81 0.00 0.00 0.82 0.00 0.00 66.70 66.81 1c1x h VAL 313 Cb 0.77 0.92 0.00 0.00 -1.52 0.00 0.00 31.29 31.46 1c1x h VAL 313 CO 0.06 0.28 0.00 0.00 0.02 0.00 0.00 177.57 177.94 1c1x n ALA 314 N -2.48 1.25 0.07 1.67 0.00 -0.49 -1.63 120.51 118.90 1c1x n ALA 314 Ca 0.02 -0.02 0.08 0.00 0.00 0.00 0.00 53.44 53.52 1c1x n ALA 314 Cb 0.25 -1.09 0.53 0.00 0.00 0.00 0.00 19.45 19.14 1c1x n ALA 314 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 1c1x h ILE 315 N 0.00 1.01 -0.77 0.00 2.04 -1.24 0.57 117.51 119.12 1c1x h ILE 315 Ca 0.00 -0.10 -0.01 0.00 1.00 0.00 0.00 64.86 65.75 1c1x h ILE 315 Cb 0.09 0.68 -0.04 0.00 -0.74 0.00 0.00 36.82 36.81 1c1x h ILE 315 CO 0.00 0.06 0.45 1.23 0.00 0.00 0.00 178.15 179.89 1c1x h GLY 316 N 0.30 1.13 1.14 5.37 0.00 -1.52 -0.26 103.07 109.23 1c1x h GLY 316 Ca 0.13 -0.49 -0.10 0.00 0.00 0.00 0.00 47.33 46.88 1c1x h GLY 316 CO -0.03 0.47 -0.01 -1.80 0.00 0.00 0.00 176.54 175.17 1c1x h ASP 317 N 1.06 1.01 -0.88 0.19 1.82 -1.41 0.35 116.42 118.56 1c1x h ASP 317 Ca 0.27 -0.29 0.03 0.00 -0.39 0.00 0.00 57.03 56.65 1c1x h ASP 317 Cb -0.01 -0.27 -0.05 0.00 0.68 0.00 0.00 39.33 39.68 1c1x h ASP 317 CO -0.05 1.07 0.57 0.74 -1.61 0.00 0.00 179.24 179.96 1c1x h THR 318 N 0.94 1.16 -0.53 2.25 2.02 -0.23 -0.92 112.91 117.60 1c1x h THR 318 Ca 0.17 -0.39 -0.08 0.00 0.77 0.00 0.00 66.41 66.88 1c1x h THR 318 Cb 0.56 -0.06 -0.02 0.00 -1.74 0.00 0.00 68.15 66.89 1c1x h THR 318 CO 0.03 0.21 -0.00 -0.07 0.37 0.00 0.00 175.52 176.05 1c1x h LEU 319 N 1.13 0.88 -1.22 2.58 3.38 -0.39 -0.73 115.31 120.94 1c1x h LEU 319 Ca 0.34 -0.23 -0.01 0.00 0.09 0.00 0.00 57.88 58.08 1c1x h LEU 319 Cb -0.03 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 40.45 1c1x h LEU 319 CO -0.11 0.94 0.39 0.78 0.09 0.00 0.00 178.44 180.54 1c1x h ASN 320 N 0.84 0.82 -0.54 -0.43 2.35 -0.07 0.69 115.58 119.25 1c1x h ASN 320 Ca 0.16 -0.05 -0.09 0.00 -0.55 0.00 0.00 56.30 55.77 1c1x h ASN 320 Cb 0.50 -0.21 -0.02 0.00 0.05 0.00 0.00 38.32 38.64 1c1x h ASN 320 CO 0.02 0.65 0.01 1.56 -1.65 0.00 0.00 177.43 178.02 1c1x h GLN 321 N 0.94 0.97 0.11 0.81 4.20 -0.19 -1.51 115.11 120.44 1c1x h GLN 321 Ca 0.24 -0.29 -0.01 0.00 0.06 0.00 0.00 58.65 58.66 1c1x h GLN 321 Cb -0.01 -0.10 0.00 0.00 0.30 0.00 0.00 27.48 27.67 1c1x h GLN 321 CO -0.04 0.95 -0.05 0.28 -0.67 0.00 0.00 178.83 179.30 1c1x h VAL 322 N 0.90 0.95 -0.71 -0.54 2.07 -0.14 -1.79 116.25 116.99 1c1x h VAL 322 Ca 0.17 -0.21 0.03 0.00 0.82 0.00 0.00 66.70 67.51 1c1x h VAL 322 Cb 0.51 1.09 -0.04 0.00 -1.52 0.00 0.00 31.29 31.33 1c1x h VAL 322 CO 0.02 0.05 0.47 -0.26 0.02 0.00 0.00 177.57 177.88 1c1x h PHE 323 N -0.24 0.84 -0.39 1.57 0.04 -0.77 0.17 116.94 118.16 1c1x h PHE 323 Ca -0.01 0.02 -0.02 0.00 2.80 0.00 0.00 57.97 60.76 1c1x h PHE 323 Cb 0.20 -0.28 -0.02 0.00 2.20 0.00 0.00 35.95 38.05 1c1x h PHE 323 CO -0.04 0.49 0.18 1.49 -0.60 0.00 0.00 178.31 179.83 1c1x h GLU 324 N 0.87 0.57 -0.35 1.51 4.81 -1.10 0.17 114.58 121.06 1c1x h GLU 324 Ca 0.28 -0.09 -0.05 0.00 -0.13 0.00 0.00 59.36 59.38 1c1x h GLU 324 Cb 0.05 -0.10 -0.01 0.00 0.63 0.00 0.00 28.75 29.31 1c1x h GLU 324 CO -0.08 0.52 0.04 0.82 -0.73 0.00 0.00 179.01 179.58 1c1x h ILE 325 N 0.49 1.24 -0.40 2.32 2.04 -0.59 -1.79 117.51 120.83 1c1x h ILE 325 Ca 0.13 -0.88 0.04 0.00 1.00 0.00 0.00 64.86 65.15 1c1x h ILE 325 Cb 0.14 1.13 -0.04 0.00 -0.74 0.00 0.00 36.82 37.31 1c1x h ILE 325 CO -0.02 0.29 0.18 -1.28 0.00 0.00 0.00 178.15 177.33 1c1x h SER 326 N 0.43 0.24 -0.31 1.72 0.87 -0.73 0.80 113.55 116.57 1c1x h SER 326 Ca 0.11 0.03 -0.03 0.00 -1.23 0.00 0.00 61.79 60.66 1c1x h SER 326 Cb 0.39 -0.01 -0.01 0.00 -0.44 0.00 0.00 62.40 62.32 1c1x h SER 326 CO 0.01 0.18 0.07 0.44 -0.53 0.00 0.00 176.83 177.00 1c1x h ASP 327 N 0.37 0.47 -0.41 6.23 3.45 -0.59 -0.14 116.42 125.80 1c1x h ASP 327 Ca 0.17 -0.24 -0.12 0.00 0.43 0.00 0.00 57.03 57.27 1c1x h ASP 327 Cb 0.11 -0.12 -0.01 0.00 -0.56 0.00 0.00 39.33 38.74 1c1x h ASP 327 CO -0.14 0.58 -0.23 0.78 -1.57 0.00 0.00 179.24 178.66 1c1x h ASN 328 N 0.34 0.90 0.11 6.45 2.35 -1.01 -3.22 115.58 121.50 1c1x h ASN 328 Ca 0.10 -0.42 0.00 0.00 -0.55 0.00 0.00 56.30 55.43 1c1x h ASN 328 Cb 0.30 -0.25 0.00 0.00 0.05 0.00 0.00 38.32 38.42 1c1x h ASN 328 CO 0.00 1.12 -0.61 0.47 -1.65 0.00 0.00 177.43 176.76 1c1x n ASP 329 N -4.19 1.29 -2.42 5.81 10.43 0.25 -4.99 116.55 122.73 1c1x n ASP 329 Ca -0.01 -1.05 -0.11 0.00 2.57 0.00 0.00 54.79 56.19 1c1x n ASP 329 Cb 0.45 0.55 0.05 0.00 1.84 0.00 0.00 41.12 44.02 1c1x n ASP 329 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 1c1x n GLY 330 N 1.44 -0.01 3.36 0.44 0.00 -0.10 -5.03 105.19 105.29 1c1x n GLY 330 Ca 0.07 -0.13 -0.18 0.00 0.00 0.00 0.00 46.02 45.78 1c1x n GLY 330 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1c1x s VAL 331 N -3.21 1.06 0.91 1.61 -7.23 -0.98 -5.06 120.40 107.50 1c1x s VAL 331 Ca 0.08 -2.03 -0.11 0.00 -1.81 0.00 0.00 61.98 58.11 1c1x s VAL 331 Cb -0.04 -2.46 0.14 0.00 0.56 0.00 0.00 36.38 34.58 1c1x s VAL 331 CO 0.43 -0.23 1.10 0.42 -0.31 0.00 0.00 175.10 176.51 1c1x s THR 332 N -3.40 2.59 0.36 5.32 -4.23 -1.26 -4.54 115.64 110.47 1c1x s THR 332 Ca 0.31 0.19 0.11 0.00 -1.18 0.00 0.00 61.69 61.12 1c1x s THR 332 Cb 0.06 -2.51 0.09 0.00 1.34 0.00 0.00 72.50 71.47 1c1x s THR 332 CO 0.11 -0.25 1.81 -0.65 -0.54 0.00 0.00 174.62 175.09 1c1x h PRO 333 N -1.67 0.08 -0.61 3.99 0.11 -1.92 -0.58 132.00 131.40 1c1x h PRO 333 Ca -0.48 -0.03 -0.04 0.00 0.11 0.00 0.00 66.00 65.56 1c1x h PRO 333 Cb 1.27 -0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.35 1c1x h PRO 333 CO 0.50 0.43 0.23 0.22 -0.21 0.00 0.00 178.00 179.17 1c1x h ASP 334 N 0.07 0.85 -0.54 -2.05 3.58 -1.91 0.12 116.42 116.55 1c1x h ASP 334 Ca 0.01 -0.18 -0.11 0.00 0.42 0.00 0.00 57.03 57.16 1c1x h ASP 334 Cb 0.67 -0.22 -0.02 0.00 1.72 0.00 0.00 39.33 41.48 1c1x h ASP 334 CO 0.05 0.80 -0.11 -0.33 -2.88 0.00 0.00 179.24 176.78 1c1x h GLU 335 N 0.85 1.03 -0.37 0.28 4.39 -1.81 -1.74 114.58 117.21 1c1x h GLU 335 Ca 0.20 -0.38 -0.05 0.00 0.34 0.00 0.00 59.36 59.47 1c1x h GLU 335 Cb 0.23 -0.06 -0.02 0.00 -0.10 0.00 0.00 28.75 28.80 1c1x h GLU 335 CO -0.01 1.07 0.02 0.00 -1.16 0.00 0.00 179.01 178.92 1c1x h ALA 336 N 0.92 1.35 -0.46 3.43 0.00 -0.71 -0.55 119.26 123.24 1c1x h ALA 336 Ca 0.14 -0.20 -0.13 0.00 0.00 0.00 0.00 54.91 54.72 1c1x h ALA 336 Cb 0.68 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.30 1c1x h ALA 336 CO 0.05 0.45 -0.24 0.00 0.00 0.00 0.00 179.25 179.52 1c1x h ALA 337 N 1.48 0.71 -0.47 0.00 0.00 -0.49 -0.42 119.26 120.07 1c1x h ALA 337 Ca 0.12 -0.40 -0.09 0.00 0.00 0.00 0.00 54.91 54.54 1c1x h ALA 337 Cb 0.32 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.94 1c1x h ALA 337 CO 0.01 0.67 -0.08 0.00 0.00 0.00 0.00 179.25 179.85 1c1x h ARG 338 N 0.82 0.84 -0.42 0.00 3.08 -0.97 0.21 114.38 117.95 1c1x h ARG 338 Ca 0.10 -0.27 -0.05 0.00 0.07 0.00 0.00 59.98 59.83 1c1x h ARG 338 Cb 0.81 -0.07 -0.02 0.00 0.08 0.00 0.00 29.97 30.77 1c1x h ARG 338 CO 0.07 0.90 0.07 1.15 -1.07 0.00 0.00 179.97 181.09 1c1x h THR 339 N 0.77 1.24 -0.72 2.04 2.02 -0.75 -1.97 112.91 115.54 1c1x h THR 339 Ca 0.13 -0.87 -0.06 0.00 0.77 0.00 0.00 66.41 66.38 1c1x h THR 339 Cb 0.58 0.99 -0.03 0.00 -1.74 0.00 0.00 68.15 67.95 1c1x h THR 339 CO 0.04 0.30 0.21 0.25 0.37 0.00 0.00 175.52 176.68 1c1x h LEU 340 N 0.55 1.06 -0.56 2.58 5.85 -0.80 -0.82 115.31 123.17 1c1x h LEU 340 Ca 0.13 -0.21 0.03 0.00 0.84 0.00 0.00 57.88 58.67 1c1x h LEU 340 Cb 0.36 -0.28 -0.04 0.00 0.37 0.00 0.00 40.66 41.08 1c1x h LEU 340 CO 0.01 0.99 0.33 0.00 -0.34 0.00 0.00 178.44 179.43 1c1x h ALA 341 N 1.14 0.73 -0.54 1.25 0.00 -0.24 0.20 119.26 121.79 1c1x h ALA 341 Ca 0.23 -0.00 -0.04 0.00 0.00 0.00 0.00 54.91 55.09 1c1x h ALA 341 Cb 0.33 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 1c1x h ALA 341 CO -0.00 0.03 0.17 0.78 0.00 0.00 0.00 179.25 180.23 1c1x h GLY 342 N 0.64 0.90 0.88 0.00 0.00 -0.99 0.18 103.07 104.69 1c1x h GLY 342 Ca 0.23 -0.54 -0.02 0.00 0.00 0.00 0.00 47.33 47.01 1c1x h GLY 342 CO -0.12 0.50 0.08 3.21 0.00 0.00 0.00 176.54 180.21 1c1x h ARG 343 N 0.75 0.35 -0.72 4.80 3.08 -0.68 -1.20 114.38 120.76 1c1x h ARG 343 Ca 0.17 -0.07 -0.04 0.00 0.07 0.00 0.00 59.98 60.11 1c1x h ARG 343 Cb 0.28 -0.05 -0.03 0.00 0.08 0.00 0.00 29.97 30.25 1c1x h ARG 343 CO -0.01 0.43 0.29 0.00 -1.07 0.00 0.00 179.97 179.61 1c1x h ARG 344 N 0.21 1.08 -0.43 0.04 3.08 -0.77 -1.61 114.38 115.97 1c1x h ARG 344 Ca 0.07 -0.20 0.06 0.00 0.07 0.00 0.00 59.98 59.99 1c1x h ARG 344 Cb 0.22 -0.17 -0.05 0.00 0.08 0.00 0.00 29.97 30.05 1c1x h ARG 344 CO -0.00 0.89 0.12 0.00 -1.07 0.00 0.00 179.97 179.90 1c1x h ALA 345 N 1.14 0.49 -0.38 0.04 0.00 -0.32 0.27 119.26 120.49 1c1x h ALA 345 Ca 0.24 0.07 -0.04 0.00 0.00 0.00 0.00 54.91 55.18 1c1x h ALA 345 Cb 0.21 0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.06 1c1x h ALA 345 CO -0.02 -0.28 0.08 0.00 0.00 0.00 0.00 179.25 179.03 1c1x h ARG 346 N 0.26 0.61 -0.76 0.00 3.08 -0.77 -2.75 114.38 114.05 1c1x h ARG 346 Ca 0.21 -0.15 0.06 0.00 0.07 0.00 0.00 59.98 60.16 1c1x h ARG 346 Cb 0.23 -0.08 -0.05 0.00 0.08 0.00 0.00 29.97 30.15 1c1x h ARG 346 CO -0.24 0.65 0.50 0.93 -1.07 0.00 0.00 179.97 180.74 1c1x h GLU 347 N 0.46 0.81 -0.01 0.04 5.08 -0.94 -3.52 114.58 116.50 1c1x h GLU 347 Ca 0.12 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.43 1c1x h GLU 347 Cb 0.32 -0.18 0.00 0.00 0.50 0.00 0.00 28.75 29.39 1c1x h GLU 347 CO 0.00 0.54 0.00 0.00 -1.00 0.00 0.00 179.01 178.55