#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1tm1 s GLN 2 N 0.00 4.22 0.02 0.00 0.74 -1.12 -4.05 119.66 119.46 1tm1 s GLN 2 Ca 0.00 0.98 0.07 0.00 0.05 0.00 0.00 55.36 56.46 1tm1 s GLN 2 Cb 0.00 -2.45 -0.03 0.00 1.10 0.00 0.00 33.01 31.64 1tm1 s GLN 2 CO 0.00 0.13 -0.21 -1.12 -0.55 0.00 0.00 175.29 173.54 1tm1 s SER 3 N -2.05 3.55 -0.41 6.67 0.01 -0.17 -4.97 113.70 116.33 1tm1 s SER 3 Ca 0.55 -0.44 -0.14 0.00 1.31 0.00 0.00 55.95 57.23 1tm1 s SER 3 Cb -0.12 -0.52 0.03 0.00 0.21 0.00 0.00 66.02 65.62 1tm1 s SER 3 CO 0.17 0.28 0.29 -0.69 0.41 0.00 0.00 173.24 173.70 1tm1 s VAL 4 N -0.82 5.04 0.51 3.43 1.01 -1.26 -2.58 120.40 125.73 1tm1 s VAL 4 Ca 0.13 -0.79 -0.22 0.00 0.00 0.00 0.00 61.98 61.09 1tm1 s VAL 4 Cb -0.10 -3.85 -0.08 0.00 0.00 0.00 0.00 36.38 32.36 1tm1 s VAL 4 CO 0.03 -0.33 1.06 -2.65 0.00 0.00 0.00 175.10 173.20 1tm1 n PRO 5 N 5.11 1.28 -0.06 2.72 -0.02 -1.26 -4.85 135.00 137.93 1tm1 n PRO 5 Ca -0.11 0.47 0.10 0.00 -2.02 0.00 0.00 63.50 61.94 1tm1 n PRO 5 Cb 0.46 -2.19 0.49 0.00 -0.02 0.00 0.00 33.50 32.24 1tm1 n PRO 5 CO 0.00 0.00 0.00 0.10 1.98 0.00 0.00 175.50 177.58 1tm1 h TYR 6 N 1.17 0.44 -0.17 6.00 -0.00 -1.95 -1.80 116.97 120.66 1tm1 h TYR 6 Ca -0.47 0.01 -0.08 0.00 0.00 0.00 0.00 58.73 58.19 1tm1 h TYR 6 Cb 1.34 -0.14 -0.01 0.00 0.00 0.00 0.00 36.73 37.91 1tm1 h TYR 6 CO 0.42 0.23 -0.26 0.78 -0.00 0.00 0.00 178.16 179.32 1tm1 h GLY 7 N 0.43 0.34 1.05 0.10 0.00 -1.95 0.23 103.07 103.27 1tm1 h GLY 7 Ca 0.24 -0.27 -0.08 0.00 0.00 0.00 0.00 47.33 47.23 1tm1 h GLY 7 CO -0.06 0.24 0.07 -2.08 0.00 0.00 0.00 176.54 174.71 1tm1 h VAL 8 N 0.28 1.26 -0.40 4.60 2.07 -1.68 -2.34 116.25 120.04 1tm1 h VAL 8 Ca 0.04 -1.04 -0.13 0.00 0.82 0.00 0.00 66.70 66.39 1tm1 h VAL 8 Cb 0.61 0.75 -0.01 0.00 -1.52 0.00 0.00 31.29 31.12 1tm1 h VAL 8 CO 0.04 0.38 -0.26 0.28 0.02 0.00 0.00 177.57 178.04 1tm1 h SER 9 N 0.92 0.86 0.03 0.57 0.02 -1.34 -2.52 113.55 112.09 1tm1 h SER 9 Ca 0.18 -0.33 -0.06 0.00 -0.84 0.00 0.00 61.79 60.74 1tm1 h SER 9 Cb 0.46 -0.24 -0.01 0.00 0.14 0.00 0.00 62.40 62.75 1tm1 h SER 9 CO 0.02 1.07 -0.17 -0.61 -1.14 0.00 0.00 176.83 176.00 1tm1 h GLN 10 N 0.72 0.28 -0.09 3.45 4.15 -0.18 -1.14 115.11 122.30 1tm1 h GLN 10 Ca 0.09 -0.08 0.00 0.00 0.77 0.00 0.00 58.65 59.43 1tm1 h GLN 10 Cb 0.80 -0.03 0.00 0.00 0.21 0.00 0.00 27.48 28.45 1tm1 h GLN 10 CO 0.07 0.45 0.00 0.44 -1.93 0.00 0.00 178.83 177.86 1tm1 n ILE 11 N -4.22 0.11 -1.89 2.39 -5.35 -0.92 -4.92 119.36 104.56 1tm1 n ILE 11 Ca -0.01 -0.25 -0.08 0.00 -0.27 0.00 0.00 62.75 62.15 1tm1 n ILE 11 Cb 0.31 0.25 -0.01 0.00 -1.74 0.00 0.00 39.64 38.45 1tm1 n ILE 11 CO 0.00 0.00 0.00 0.29 -1.76 0.00 0.00 176.55 175.08 1tm1 n LYS 12 N 0.04 -0.61 -0.31 6.28 5.02 -0.43 -0.85 118.16 127.30 1tm1 n LYS 12 Ca 0.17 0.49 0.05 0.00 -2.02 0.00 0.00 58.31 57.01 1tm1 n LYS 12 Cb 0.28 -4.40 0.25 0.00 -0.02 0.00 0.00 35.03 31.14 1tm1 n LYS 12 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1tm1 h ALA 13 N 0.27 1.54 0.00 7.82 0.00 -1.66 -2.54 119.26 124.69 1tm1 h ALA 13 Ca -0.18 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.71 1tm1 h ALA 13 Cb 0.96 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 18.50 1tm1 h ALA 13 CO 0.23 0.30 -0.00 -1.35 0.00 0.00 0.00 179.25 178.43 1tm1 h PRO 14 N 1.00 0.00 -0.75 0.00 0.11 -1.88 -0.66 132.00 129.82 1tm1 h PRO 14 Ca 0.41 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 66.49 1tm1 h PRO 14 Cb 0.27 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 31.35 1tm1 h PRO 14 CO -0.16 0.00 0.35 0.00 -0.21 0.00 0.00 178.00 177.97 1tm1 h ALA 15 N 2.00 1.20 -0.27 -0.75 0.00 -1.85 0.26 119.26 119.85 1tm1 h ALA 15 Ca -0.00 -0.15 -0.10 0.00 0.00 0.00 0.00 54.91 54.65 1tm1 h ALA 15 Cb 0.00 -0.30 -0.00 0.00 0.00 0.00 0.00 17.79 17.49 1tm1 h ALA 15 CO 0.00 0.60 -0.23 -0.07 0.00 0.00 0.00 179.25 179.55 1tm1 h LEU 16 N 1.07 0.68 -0.91 0.00 -0.00 -1.24 -2.66 115.31 112.24 1tm1 h LEU 16 Ca 0.26 -0.46 0.06 0.00 -0.00 0.00 0.00 57.88 57.74 1tm1 h LEU 16 Cb 0.12 -0.19 -0.06 0.00 -0.00 0.00 0.00 40.66 40.53 1tm1 h LEU 16 CO -0.03 0.99 0.58 0.45 -0.00 0.00 0.00 178.44 180.43 1tm1 h HIS 17 N 0.37 1.07 0.00 1.13 3.86 -0.96 -1.37 115.15 119.25 1tm1 h HIS 17 Ca 0.05 0.03 -0.08 0.00 -1.16 0.00 0.00 60.37 59.20 1tm1 h HIS 17 Cb 0.79 -0.35 -0.01 0.00 1.06 0.00 0.00 27.41 28.89 1tm1 h HIS 17 CO 0.07 0.57 -0.40 0.66 0.86 0.00 0.00 177.93 179.69 1tm1 h SER 18 N 1.07 0.00 0.75 2.45 4.64 -0.89 -0.60 113.55 120.96 1tm1 h SER 18 Ca 0.39 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.71 1tm1 h SER 18 Cb 0.13 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.22 1tm1 h SER 18 CO -0.16 0.40 0.00 0.00 -0.87 0.00 0.00 176.83 176.20 1tm1 n GLN 19 N -3.69 0.14 0.00 4.77 6.02 -0.74 -4.91 117.38 118.98 1tm1 n GLN 19 Ca -0.01 0.34 0.00 0.00 -0.01 0.00 0.00 57.00 57.32 1tm1 n GLN 19 Cb 0.49 -1.75 0.00 0.00 1.02 0.00 0.00 30.24 30.00 1tm1 n GLN 19 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1tm1 n GLY 20 N 0.19 1.11 3.29 1.08 0.00 -0.23 -5.10 105.19 105.53 1tm1 n GLY 20 Ca 0.03 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.72 1tm1 n GLY 20 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1tm1 s TYR 21 N -2.00 2.78 0.00 1.61 2.02 -0.60 -4.96 117.35 116.20 1tm1 s TYR 21 Ca 0.00 -0.94 0.00 0.00 -0.37 0.00 0.00 57.07 55.76 1tm1 s TYR 21 Cb 0.00 -1.87 0.00 0.00 -0.40 0.00 0.00 41.96 39.69 1tm1 s TYR 21 CO 0.00 -0.41 0.68 0.25 -1.57 0.00 0.00 175.55 174.50 1tm1 n THR 22 N 3.90 0.00 -0.56 -0.71 -2.24 -1.26 -2.97 114.28 110.45 1tm1 n THR 22 Ca -0.19 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.59 1tm1 n THR 22 Cb 0.52 0.79 0.00 0.00 -2.10 0.00 0.00 70.33 69.54 1tm1 n THR 22 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1tm1 n GLY 23 N 0.00 0.69 3.68 3.38 0.00 -1.26 -0.73 105.19 110.95 1tm1 n GLY 23 Ca 0.00 -0.30 -0.44 0.00 0.00 0.00 0.00 46.02 45.28 1tm1 n GLY 23 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1tm1 n SER 24 N 0.55 2.97 -0.01 1.61 2.88 -1.26 -1.87 113.62 118.49 1tm1 n SER 24 Ca 0.00 1.14 -0.00 0.00 -1.33 0.00 0.00 58.87 58.67 1tm1 n SER 24 Cb 0.00 -1.45 -0.00 0.00 -0.75 0.00 0.00 64.21 62.01 1tm1 n SER 24 CO 0.00 0.00 0.00 0.59 -1.23 0.00 0.00 175.04 174.40 1tm1 n ASN 25 N 2.32 -4.53 -4.76 -3.46 3.02 -1.26 -4.76 115.26 101.84 1tm1 n ASN 25 Ca 0.12 0.00 -0.36 0.00 -0.03 0.00 0.00 54.58 54.31 1tm1 n ASN 25 Cb 0.32 -2.03 -0.07 0.00 -0.61 0.00 0.00 39.78 37.38 1tm1 n ASN 25 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1tm1 s VAL 26 N -1.50 5.33 -0.28 2.41 1.01 -0.78 -4.91 120.40 121.69 1tm1 s VAL 26 Ca 0.00 0.44 -0.13 0.00 0.00 0.00 0.00 61.98 62.30 1tm1 s VAL 26 Cb 0.00 -3.57 -0.04 0.00 0.00 0.00 0.00 36.38 32.77 1tm1 s VAL 26 CO 0.00 0.44 0.27 -0.54 0.00 0.00 0.00 175.10 175.27 1tm1 s LYS 27 N 0.13 3.94 -0.17 2.72 1.02 -1.26 -0.55 119.74 125.57 1tm1 s LYS 27 Ca 0.15 -0.20 0.01 0.00 0.02 0.00 0.00 55.97 55.95 1tm1 s LYS 27 Cb -0.13 -3.67 0.02 0.00 -0.52 0.00 0.00 37.83 33.53 1tm1 s LYS 27 CO 0.03 -0.24 -0.20 0.08 -0.92 0.00 0.00 175.35 174.10 1tm1 s VAL 28 N 1.88 2.06 -0.22 3.17 1.01 0.12 -0.67 120.40 127.75 1tm1 s VAL 28 Ca 0.10 -0.95 -0.19 0.00 0.00 0.00 0.00 61.98 60.94 1tm1 s VAL 28 Cb -0.16 -1.85 -0.03 0.00 0.00 0.00 0.00 36.38 34.34 1tm1 s VAL 28 CO 0.11 0.54 0.56 0.00 0.00 0.00 0.00 175.10 176.31 1tm1 s ALA 29 N 1.21 3.57 -0.51 5.51 0.00 0.02 -0.84 121.76 130.72 1tm1 s ALA 29 Ca 0.03 -0.42 -0.19 0.00 0.00 0.00 0.00 51.96 51.38 1tm1 s ALA 29 Cb -0.13 -2.90 0.06 0.00 0.00 0.00 0.00 23.12 20.14 1tm1 s ALA 29 CO -0.11 -0.60 0.64 0.08 0.00 0.00 0.00 175.76 175.77 1tm1 s VAL 30 N 2.00 4.85 -0.49 0.00 1.01 -0.25 -1.03 120.40 126.49 1tm1 s VAL 30 Ca 0.25 -0.44 -0.19 0.00 0.00 0.00 0.00 61.98 61.60 1tm1 s VAL 30 Cb -0.16 -4.31 0.05 0.00 0.00 0.00 0.00 36.38 31.97 1tm1 s VAL 30 CO 0.09 -0.82 0.58 -0.63 0.00 0.00 0.00 175.10 174.32 1tm1 s ILE 31 N 2.69 4.94 0.00 2.22 1.01 -0.58 -1.70 121.20 129.79 1tm1 s ILE 31 Ca 0.16 -0.48 0.00 0.00 0.00 0.00 0.00 60.65 60.33 1tm1 s ILE 31 Cb -0.19 -4.24 0.00 0.00 0.01 0.00 0.00 42.46 38.05 1tm1 s ILE 31 CO 0.12 -0.71 0.00 -0.67 0.00 0.00 0.00 174.94 173.68 1tm1 n ASP 32 N 6.00 0.00 -0.95 3.58 -0.08 -0.59 -4.24 116.55 120.26 1tm1 n ASP 32 Ca -0.07 0.00 0.04 0.00 -1.51 0.00 0.00 54.79 53.25 1tm1 n ASP 32 Cb 0.46 0.00 0.17 0.00 2.34 0.00 0.00 41.12 44.09 1tm1 n ASP 32 CO 0.00 0.00 0.00 -1.54 0.12 0.00 0.00 177.20 175.78 1tm1 n SER 33 N 0.00 2.67 0.00 1.67 3.41 -1.26 -0.39 113.62 119.72 1tm1 n SER 33 Ca 0.00 -2.27 0.00 0.00 -0.26 0.00 0.00 58.87 56.34 1tm1 n SER 33 Cb 0.00 -0.45 0.00 0.00 -0.26 0.00 0.00 64.21 63.50 1tm1 n SER 33 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1tm1 n GLY 34 N 0.57 0.99 2.81 5.00 0.00 -1.26 -4.35 105.19 108.95 1tm1 n GLY 34 Ca 0.12 -2.12 -0.15 0.00 0.00 0.00 0.00 46.02 43.88 1tm1 n GLY 34 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1tm1 s ILE 35 N -1.41 -0.05 -0.73 -0.61 1.01 -0.61 -3.44 121.20 115.37 1tm1 s ILE 35 Ca 0.00 0.20 -0.26 0.00 0.00 0.00 0.00 60.65 60.59 1tm1 s ILE 35 Cb 0.00 -0.11 -0.01 0.00 0.01 0.00 0.00 42.46 42.35 1tm1 s ILE 35 CO 0.00 0.08 1.74 -0.62 0.00 0.00 0.00 174.94 176.15 1tm1 s ASP 36 N 1.04 5.49 0.27 3.58 -1.08 -1.26 -3.97 116.67 120.74 1tm1 s ASP 36 Ca -0.09 -0.16 0.24 0.00 -0.52 0.00 0.00 52.55 52.03 1tm1 s ASP 36 Cb -0.12 -2.54 1.00 0.00 -1.46 0.00 0.00 42.92 39.79 1tm1 s ASP 36 CO -0.03 -2.30 1.72 -1.54 0.52 0.00 0.00 175.17 173.54 1tm1 n SER 37 N 12.12 0.70 0.01 -0.34 3.41 -1.17 -1.96 113.62 126.39 1tm1 n SER 37 Ca 0.22 0.67 0.11 0.00 -0.26 0.00 0.00 58.87 59.62 1tm1 n SER 37 Cb 0.50 -0.82 0.49 0.00 -0.26 0.00 0.00 64.21 64.12 1tm1 n SER 37 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1tm1 n SER 38 N -2.28 0.04 -4.72 4.04 7.64 -1.26 -4.73 113.62 112.36 1tm1 n SER 38 Ca 0.02 0.51 -0.42 0.00 1.01 0.00 0.00 58.87 59.99 1tm1 n SER 38 Cb 0.24 -0.52 -0.03 0.00 -1.01 0.00 0.00 64.21 62.89 1tm1 n SER 38 CO 0.00 0.00 0.00 -2.28 -3.01 0.00 0.00 175.04 169.75 1tm1 s HIS 39 N -3.01 3.09 -0.68 1.43 2.46 -0.83 -4.87 115.29 112.87 1tm1 s HIS 39 Ca 0.11 0.71 0.20 0.00 0.47 0.00 0.00 55.06 56.55 1tm1 s HIS 39 Cb 0.15 -3.85 0.84 0.00 -0.13 0.00 0.00 32.58 29.58 1tm1 s HIS 39 CO 0.43 -3.12 1.61 -0.35 -2.47 0.00 0.00 174.74 170.84 1tm1 n PRO 40 N 4.05 0.12 -0.70 2.88 -0.04 -1.26 -1.99 135.00 138.05 1tm1 n PRO 40 Ca 0.13 0.36 0.08 0.00 -0.04 0.00 0.00 63.50 64.03 1tm1 n PRO 40 Cb 0.40 -1.73 0.37 0.00 -0.04 0.00 0.00 33.50 32.50 1tm1 n PRO 40 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 1tm1 n ASP 41 N -1.95 5.05 -4.11 3.54 2.03 -1.26 -4.91 116.55 114.94 1tm1 n ASP 41 Ca 0.03 -2.67 -0.17 0.00 0.52 0.00 0.00 54.79 52.49 1tm1 n ASP 41 Cb 0.21 -0.61 -0.13 0.00 -0.72 0.00 0.00 41.12 39.87 1tm1 n ASP 41 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 1tm1 s LEU 42 N -2.27 2.19 -0.20 -2.67 1.43 -0.84 -0.74 118.68 115.59 1tm1 s LEU 42 Ca 0.51 -0.47 0.01 0.00 -1.03 0.00 0.00 54.13 53.15 1tm1 s LEU 42 Cb 0.36 -0.44 0.04 0.00 0.03 0.00 0.00 46.19 46.19 1tm1 s LEU 42 CO 0.20 -0.04 -0.09 -0.75 0.23 0.00 0.00 176.35 175.90 1tm1 s LYS 43 N -1.25 1.89 -0.22 1.70 2.20 -1.26 -4.73 119.74 118.08 1tm1 s LYS 43 Ca -0.02 -0.82 -0.11 0.00 -0.36 0.00 0.00 55.97 54.65 1tm1 s LYS 43 Cb -0.08 -2.39 -0.05 0.00 -1.51 0.00 0.00 37.83 33.80 1tm1 s LYS 43 CO 0.01 -0.45 0.20 0.08 -0.36 0.00 0.00 175.35 174.83 1tm1 s VAL 44 N 1.43 5.35 -0.23 4.02 1.01 -1.26 -4.28 120.40 126.43 1tm1 s VAL 44 Ca -0.02 0.29 0.21 0.00 0.00 0.00 0.00 61.98 62.46 1tm1 s VAL 44 Cb -0.16 -3.54 0.02 0.00 0.00 0.00 0.00 36.38 32.69 1tm1 s VAL 44 CO -0.08 0.36 1.09 0.00 0.00 0.00 0.00 175.10 176.47 1tm1 h ALA 45 N 7.21 0.60 0.00 5.51 0.00 -0.72 -3.48 119.26 128.38 1tm1 h ALA 45 Ca -0.39 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.32 1tm1 h ALA 45 Cb 1.16 0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.01 1tm1 h ALA 45 CO 0.70 0.22 0.00 0.41 0.00 0.00 0.00 179.25 180.58 1tm1 n GLY 46 N 1.22 -1.39 0.00 0.00 0.00 -1.22 -5.02 105.19 98.78 1tm1 n GLY 46 Ca -0.01 -1.01 0.00 0.00 0.00 0.00 0.00 46.02 45.00 1tm1 n GLY 46 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1tm1 n GLY 47 N -0.06 -0.94 3.53 -0.02 0.00 -1.26 -1.14 105.19 105.30 1tm1 n GLY 47 Ca 0.00 -1.53 -0.15 0.00 0.00 0.00 0.00 46.02 44.34 1tm1 n GLY 47 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1tm1 s ALA 48 N -1.31 -1.81 -0.11 4.61 0.00 -0.48 -4.95 121.76 117.71 1tm1 s ALA 48 Ca 0.00 1.32 -0.02 0.00 0.00 0.00 0.00 51.96 53.26 1tm1 s ALA 48 Cb 0.00 -0.12 -0.03 0.00 0.00 0.00 0.00 23.12 22.97 1tm1 s ALA 48 CO 0.00 -0.40 -0.03 0.45 0.00 0.00 0.00 175.76 175.78 1tm1 s SER 49 N -1.37 4.92 0.00 0.00 0.15 -1.26 -1.25 113.70 114.89 1tm1 s SER 49 Ca -0.06 -0.01 0.18 0.00 0.70 0.00 0.00 55.95 56.76 1tm1 s SER 49 Cb -0.00 -1.53 0.31 0.00 -1.71 0.00 0.00 66.02 63.10 1tm1 s SER 49 CO 0.04 0.29 1.24 0.23 1.20 0.00 0.00 173.24 176.24 1tm1 n MET 50 N 2.75 2.13 -3.03 5.44 2.81 0.72 -4.93 117.12 123.02 1tm1 n MET 50 Ca -0.18 -1.97 -0.43 0.00 -1.81 0.00 0.00 57.70 53.31 1tm1 n MET 50 Cb 0.53 -1.39 -0.06 0.00 -0.71 0.00 0.00 33.22 31.59 1tm1 n MET 50 CO 0.00 0.00 0.00 0.08 1.51 0.00 0.00 175.97 177.56 1tm1 s VAL 51 N -1.26 4.76 0.25 2.03 1.01 -1.24 -4.77 120.40 121.18 1tm1 s VAL 51 Ca 0.29 0.44 -0.03 0.00 0.00 0.00 0.00 61.98 62.68 1tm1 s VAL 51 Cb 0.17 -4.22 0.22 0.00 0.00 0.00 0.00 36.38 32.55 1tm1 s VAL 51 CO 0.24 -0.56 1.77 -0.65 0.00 0.00 0.00 175.10 175.90 1tm1 h PRO 52 N 8.77 0.59 -0.01 2.72 0.11 -1.97 -1.79 132.00 140.42 1tm1 h PRO 52 Ca -0.25 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.82 1tm1 h PRO 52 Cb 1.09 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 32.07 1tm1 h PRO 52 CO 0.91 0.39 -0.07 -1.13 -0.21 0.00 0.00 178.00 177.89 1tm1 n SER 53 N -4.88 1.51 -3.62 -2.05 3.41 -1.26 -4.56 113.62 102.18 1tm1 n SER 53 Ca 0.15 -1.39 -0.29 0.00 -0.26 0.00 0.00 58.87 57.08 1tm1 n SER 53 Cb 0.38 0.04 -0.12 0.00 -0.26 0.00 0.00 64.21 64.25 1tm1 n SER 53 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 1tm1 s GLU 54 N -2.13 1.16 0.00 4.33 2.02 -0.67 -4.99 118.70 118.42 1tm1 s GLU 54 Ca 0.34 -1.99 0.28 0.00 0.02 0.00 0.00 54.97 53.62 1tm1 s GLU 54 Cb 0.20 -2.05 1.12 0.00 0.10 0.00 0.00 34.13 33.51 1tm1 s GLU 54 CO 0.38 -1.22 1.80 0.25 0.02 0.00 0.00 175.26 176.50 1tm1 n THR 55 N 3.40 0.00 -3.46 3.63 -2.24 -1.25 -4.41 114.28 109.95 1tm1 n THR 55 Ca 0.14 -0.05 -0.43 0.00 -2.27 0.00 0.00 64.05 61.44 1tm1 n THR 55 Cb 0.37 -0.10 -0.09 0.00 -2.10 0.00 0.00 70.33 68.41 1tm1 n THR 55 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 1tm1 s ASN 56 N -2.62 6.06 0.19 3.42 3.84 -1.26 -4.43 114.94 120.14 1tm1 s ASN 56 Ca 0.24 -1.08 0.21 0.00 0.21 0.00 0.00 52.86 52.45 1tm1 s ASN 56 Cb 0.20 -2.15 0.89 0.00 -0.55 0.00 0.00 41.25 39.64 1tm1 s ASN 56 CO 0.51 -0.51 1.65 -0.81 -2.79 0.00 0.00 177.10 175.15 1tm1 n PRO 57 N 5.15 0.15 -0.25 0.43 -0.04 -1.26 -2.78 135.00 136.39 1tm1 n PRO 57 Ca -0.12 0.37 0.09 0.00 -0.04 0.00 0.00 63.50 63.81 1tm1 n PRO 57 Cb 0.46 -1.77 0.26 0.00 -0.04 0.00 0.00 33.50 32.40 1tm1 n PRO 57 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 1tm1 n PHE 58 N -2.04 0.66 -4.11 0.54 3.72 -1.26 -1.57 117.46 113.40 1tm1 n PHE 58 Ca 0.03 -0.33 -0.34 0.00 -0.05 0.00 0.00 57.45 56.76 1tm1 n PHE 58 Cb 0.22 0.00 -0.15 0.00 -0.94 0.00 0.00 39.48 38.61 1tm1 n PHE 58 CO 0.00 0.00 0.00 -1.14 -0.05 0.00 0.00 176.76 175.57 1tm1 s GLN 59 N -1.34 3.13 -0.40 -1.08 2.00 -1.12 -3.03 119.66 117.81 1tm1 s GLN 59 Ca 0.37 -0.76 -0.03 0.00 -2.00 0.00 0.00 55.36 52.94 1tm1 s GLN 59 Cb 0.20 -2.70 0.10 0.00 0.80 0.00 0.00 33.01 31.41 1tm1 s GLN 59 CO 0.26 -0.18 0.19 0.34 -0.50 0.00 0.00 175.29 175.40 1tm1 s ASP 60 N 1.29 5.22 0.00 6.67 2.15 -1.26 -4.59 116.67 126.16 1tm1 s ASP 60 Ca 0.04 -1.97 0.24 0.00 0.43 0.00 0.00 52.55 51.29 1tm1 s ASP 60 Cb -0.14 -1.82 1.05 0.00 -0.30 0.00 0.00 42.92 41.71 1tm1 s ASP 60 CO -0.09 -0.52 1.72 0.59 -0.17 0.00 0.00 175.17 176.71 1tm1 n ASN 61 N 4.59 1.13 -0.11 -0.34 3.02 -1.26 -4.01 115.26 118.29 1tm1 n ASN 61 Ca -0.03 -1.51 -0.22 0.00 -0.03 0.00 0.00 54.58 52.80 1tm1 n ASN 61 Cb 0.42 -0.04 -0.08 0.00 -0.61 0.00 0.00 39.78 39.46 1tm1 n ASN 61 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 1tm1 n ASN 62 N -0.07 1.63 0.00 6.41 2.85 -1.26 -4.75 115.26 120.06 1tm1 n ASN 62 Ca 0.18 0.21 0.00 0.00 -0.11 0.00 0.00 54.58 54.86 1tm1 n ASN 62 Cb 0.27 -0.58 0.00 0.00 1.24 0.00 0.00 39.78 40.70 1tm1 n ASN 62 CO 0.00 0.00 0.00 -1.54 -2.11 0.00 0.00 177.26 173.61 1tm1 n SER 63 N -3.84 0.00 0.00 1.20 3.41 -1.26 -4.99 113.62 108.14 1tm1 n SER 63 Ca -0.41 0.00 -0.12 0.00 -0.26 0.00 0.00 58.87 58.08 1tm1 n SER 63 Cb 0.81 0.00 -0.07 0.00 -0.26 0.00 0.00 64.21 64.69 1tm1 n SER 63 CO 0.00 0.00 0.00 -0.74 -0.16 0.00 0.00 175.04 174.14 1tm1 h HIS 64 N 0.00 0.07 -0.57 7.33 6.17 -1.93 -2.02 115.15 124.20 1tm1 h HIS 64 Ca 0.00 -0.01 -0.02 0.00 0.71 0.00 0.00 60.37 61.06 1tm1 h HIS 64 Cb 0.00 -0.02 -0.03 0.00 2.52 0.00 0.00 27.41 29.88 1tm1 h HIS 64 CO 0.00 0.22 0.28 0.78 0.71 0.00 0.00 177.93 179.92 1tm1 h GLY 65 N -0.11 0.85 1.06 5.26 0.00 -1.87 -0.78 103.07 107.49 1tm1 h GLY 65 Ca 0.01 -0.39 -0.09 0.00 0.00 0.00 0.00 47.33 46.86 1tm1 h GLY 65 CO -0.00 0.37 -0.00 -0.84 0.00 0.00 0.00 176.54 176.07 1tm1 h THR 66 N 0.80 1.27 -0.04 4.70 2.02 -1.53 0.25 112.91 120.37 1tm1 h THR 66 Ca 0.20 -1.14 -0.01 0.00 0.77 0.00 0.00 66.41 66.24 1tm1 h THR 66 Cb 0.07 0.85 -0.00 0.00 -1.74 0.00 0.00 68.15 67.33 1tm1 h THR 66 CO -0.03 0.41 0.00 -0.74 0.37 0.00 0.00 175.52 175.53 1tm1 h HIS 67 N 0.91 0.07 -0.52 3.16 6.17 -0.81 -1.66 115.15 122.47 1tm1 h HIS 67 Ca 0.16 -0.01 0.06 0.00 0.71 0.00 0.00 60.37 61.29 1tm1 h HIS 67 Cb 0.55 -0.02 -0.05 0.00 2.52 0.00 0.00 27.41 30.41 1tm1 h HIS 67 CO 0.04 0.33 0.23 0.28 0.71 0.00 0.00 177.93 179.52 1tm1 h VAL 68 N -0.21 0.90 -0.99 5.26 2.07 -1.13 -2.34 116.25 119.80 1tm1 h VAL 68 Ca 0.01 -0.15 0.02 0.00 0.82 0.00 0.00 66.70 67.40 1tm1 h VAL 68 Cb 0.30 0.41 -0.05 0.00 -1.52 0.00 0.00 31.29 30.43 1tm1 h VAL 68 CO 0.00 0.08 0.66 0.00 0.02 0.00 0.00 177.57 178.33 1tm1 h ALA 69 N 1.31 1.27 -0.11 1.67 0.00 -0.78 -2.31 119.26 120.31 1tm1 h ALA 69 Ca 0.24 -0.06 -0.06 0.00 0.00 0.00 0.00 54.91 55.03 1tm1 h ALA 69 Cb 0.20 -0.39 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 1tm1 h ALA 69 CO -0.20 0.62 -0.20 0.78 0.00 0.00 0.00 179.25 180.25 1tm1 h GLY 70 N 1.32 0.19 1.28 0.00 0.00 -0.80 0.96 103.07 106.03 1tm1 h GLY 70 Ca 0.37 -0.13 -0.16 0.00 0.00 0.00 0.00 47.33 47.41 1tm1 h GLY 70 CO -0.09 0.12 -0.44 -0.84 0.00 0.00 0.00 176.54 175.29 1tm1 h THR 71 N 0.17 1.29 -0.01 4.70 2.02 -0.96 -0.81 112.91 119.30 1tm1 h THR 71 Ca 0.03 -1.62 -0.00 0.00 0.77 0.00 0.00 66.41 65.59 1tm1 h THR 71 Cb 0.46 1.52 -0.00 0.00 -1.74 0.00 0.00 68.15 68.39 1tm1 h THR 71 CO 0.03 0.53 0.00 0.58 0.37 0.00 0.00 175.52 177.03 1tm1 h VAL 72 N 0.62 1.12 0.00 3.16 2.07 -0.94 -0.38 116.25 121.90 1tm1 h VAL 72 Ca 0.04 -0.35 -0.10 0.00 0.82 0.00 0.00 66.70 67.11 1tm1 h VAL 72 Cb 1.00 1.34 -0.17 0.00 -1.52 0.00 0.00 31.29 31.95 1tm1 h VAL 72 CO 0.10 0.09 -0.53 0.00 0.02 0.00 0.00 177.57 177.25 1tm1 n ALA 73 N -2.17 2.68 -1.70 1.67 0.00 0.28 -0.08 120.51 121.20 1tm1 n ALA 73 Ca -0.07 -1.18 -0.41 0.00 0.00 0.00 0.00 53.44 51.77 1tm1 n ALA 73 Cb 0.10 -0.44 0.01 0.00 0.00 0.00 0.00 19.45 19.12 1tm1 n ALA 73 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1tm1 n ALA 74 N 0.17 1.24 -1.76 0.00 0.00 -0.32 -4.61 120.51 115.22 1tm1 n ALA 74 Ca -0.07 0.26 -0.34 0.00 0.00 0.00 0.00 53.44 53.29 1tm1 n ALA 74 Cb 0.82 -2.26 -0.01 0.00 0.00 0.00 0.00 19.45 18.00 1tm1 n ALA 74 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1tm1 s LEU 75 N -1.62 3.76 -0.53 0.00 1.43 0.09 -0.65 118.68 121.15 1tm1 s LEU 75 Ca 0.61 2.02 -0.24 0.00 -1.03 0.00 0.00 54.13 55.49 1tm1 s LEU 75 Cb -0.51 -4.57 0.04 0.00 0.03 0.00 0.00 46.19 41.18 1tm1 s LEU 75 CO 0.58 -1.03 0.94 0.21 0.23 0.00 0.00 176.35 177.28 1tm1 s ASN 76 N -1.99 6.37 0.00 2.29 2.47 -1.26 -4.59 114.94 118.24 1tm1 s ASN 76 Ca 0.69 -0.25 0.00 0.00 0.42 0.00 0.00 52.86 53.73 1tm1 s ASN 76 Cb -0.20 -2.44 0.00 0.00 -1.45 0.00 0.00 41.25 37.16 1tm1 s ASN 76 CO 0.25 -1.20 0.00 -0.46 -3.72 0.00 0.00 177.10 171.98 1tm1 n ASN 77 N 7.42 0.00 -1.69 -4.21 0.23 -1.26 -5.04 115.26 110.71 1tm1 n ASN 77 Ca 0.03 0.00 0.04 0.00 -0.53 0.00 0.00 54.58 54.12 1tm1 n ASN 77 Cb 0.48 0.00 0.35 0.00 -2.08 0.00 0.00 39.78 38.52 1tm1 n ASN 77 CO 0.00 0.00 0.00 -1.54 -0.93 0.00 0.00 177.26 174.79 1tm1 n SER 78 N 0.00 5.06 -4.24 0.53 3.41 -1.26 -4.47 113.62 112.65 1tm1 n SER 78 Ca 0.00 -3.05 -0.14 0.00 -0.26 0.00 0.00 58.87 55.42 1tm1 n SER 78 Cb 0.00 -0.67 -0.10 0.00 -0.26 0.00 0.00 64.21 63.18 1tm1 n SER 78 CO 0.00 0.00 0.00 0.27 -0.16 0.00 0.00 175.04 175.15 1tm1 s ILE 79 N -2.86 1.10 0.00 -1.33 -4.36 -1.26 -2.04 121.20 110.45 1tm1 s ILE 79 Ca 0.52 -2.05 0.00 0.00 -0.26 0.00 0.00 60.65 58.86 1tm1 s ILE 79 Cb 0.41 -1.86 0.00 0.00 1.25 0.00 0.00 42.46 42.26 1tm1 s ILE 79 CO 0.13 -0.74 0.00 0.61 0.24 0.00 0.00 174.94 175.19 1tm1 n GLY 80 N -0.19 3.20 2.37 6.27 0.00 -1.26 -4.47 105.19 111.11 1tm1 n GLY 80 Ca -0.10 -0.21 -0.18 0.00 0.00 0.00 0.00 46.02 45.53 1tm1 n GLY 80 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1tm1 n VAL 81 N 0.00 0.00 -4.65 1.61 0.24 -1.26 -1.00 118.33 113.28 1tm1 n VAL 81 Ca 0.00 -1.44 -0.25 0.00 -2.04 0.00 0.00 64.34 60.61 1tm1 n VAL 81 Cb 0.00 -0.00 -0.16 0.00 -1.47 0.00 0.00 33.84 32.20 1tm1 n VAL 81 CO 0.00 0.00 0.00 -0.22 -2.14 0.00 0.00 176.83 174.47 1tm1 s LEU 82 N 0.00 1.72 0.71 1.34 2.96 -1.06 -4.48 118.68 119.86 1tm1 s LEU 82 Ca 0.12 -0.31 -0.11 0.00 -0.22 0.00 0.00 54.13 53.60 1tm1 s LEU 82 Cb -0.01 -0.86 0.02 0.00 0.50 0.00 0.00 46.19 45.84 1tm1 s LEU 82 CO 0.08 0.06 1.08 -0.83 -1.32 0.00 0.00 176.35 175.41 1tm1 s GLY 83 N 0.53 1.64 0.20 7.98 0.00 0.18 -4.60 107.32 113.24 1tm1 s GLY 83 Ca -0.13 -0.18 -0.11 0.00 0.00 0.00 0.00 44.72 44.30 1tm1 s GLY 83 CO 0.04 0.17 1.85 -2.08 0.00 0.00 0.00 173.10 173.08 1tm1 h VAL 84 N -0.73 1.19 -2.53 1.40 2.07 -0.89 -3.35 116.25 113.42 1tm1 h VAL 84 Ca -0.45 -0.39 -0.60 0.00 0.82 0.00 0.00 66.70 66.08 1tm1 h VAL 84 Cb 1.24 0.21 -0.41 0.00 -1.52 0.00 0.00 31.29 30.81 1tm1 h VAL 84 CO 0.61 0.19 -0.74 0.00 0.02 0.00 0.00 177.57 177.65 1tm1 n ALA 85 N -2.30 3.35 0.41 1.67 0.00 0.89 -4.88 120.51 119.64 1tm1 n ALA 85 Ca 0.06 -4.15 0.10 0.00 0.00 0.00 0.00 53.44 49.45 1tm1 n ALA 85 Cb 0.04 -0.91 0.43 0.00 0.00 0.00 0.00 19.45 19.01 1tm1 n ALA 85 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1tm1 n PRO 86 N 1.73 0.13 -0.24 0.00 -0.04 -0.98 -1.37 135.00 134.23 1tm1 n PRO 86 Ca 0.25 0.38 0.12 0.00 -0.04 0.00 0.00 63.50 64.21 1tm1 n PRO 86 Cb 0.42 -1.76 0.24 0.00 -0.04 0.00 0.00 33.50 32.37 1tm1 n PRO 86 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 1tm1 n SER 87 N -2.00 3.58 -4.74 3.54 7.64 0.09 -4.46 113.62 117.27 1tm1 n SER 87 Ca 0.02 -1.99 -0.35 0.00 1.01 0.00 0.00 58.87 57.57 1tm1 n SER 87 Cb 0.20 -0.32 0.06 0.00 -1.01 0.00 0.00 64.21 63.14 1tm1 n SER 87 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1tm1 s ALA 88 N -1.31 2.37 -0.44 -0.43 0.00 -0.47 -4.05 121.76 117.44 1tm1 s ALA 88 Ca 0.41 0.94 -0.25 0.00 0.00 0.00 0.00 51.96 53.06 1tm1 s ALA 88 Cb 0.23 -3.46 0.02 0.00 0.00 0.00 0.00 23.12 19.92 1tm1 s ALA 88 CO 0.31 -1.47 0.91 -1.12 0.00 0.00 0.00 175.76 174.39 1tm1 s SER 89 N -1.82 6.53 -0.21 0.00 0.01 0.29 -4.96 113.70 113.55 1tm1 s SER 89 Ca 0.76 0.21 -0.12 0.00 1.31 0.00 0.00 55.95 58.12 1tm1 s SER 89 Cb -0.30 -2.45 -0.05 0.00 0.21 0.00 0.00 66.02 63.44 1tm1 s SER 89 CO 0.39 -0.98 0.21 -0.22 0.41 0.00 0.00 173.24 173.04 1tm1 s LEU 90 N 3.63 4.18 -0.15 2.44 2.96 -1.26 -0.70 118.68 129.78 1tm1 s LEU 90 Ca 0.36 0.28 0.01 0.00 -0.22 0.00 0.00 54.13 54.57 1tm1 s LEU 90 Cb -0.11 -2.21 -0.00 0.00 0.50 0.00 0.00 46.19 44.37 1tm1 s LEU 90 CO 0.24 0.09 -0.17 -0.31 -1.32 0.00 0.00 176.35 174.88 1tm1 s TYR 91 N 0.73 2.74 -0.46 5.38 1.51 -0.02 0.07 117.35 127.31 1tm1 s TYR 91 Ca 0.11 -1.08 -0.24 0.00 -1.01 0.00 0.00 57.07 54.86 1tm1 s TYR 91 Cb -0.13 -1.86 0.03 0.00 -0.11 0.00 0.00 41.96 39.89 1tm1 s TYR 91 CO 0.03 -0.48 0.83 0.00 -1.11 0.00 0.00 175.55 174.81 1tm1 s ALA 92 N 0.75 3.27 -0.54 3.71 0.00 -0.29 -1.09 121.76 127.57 1tm1 s ALA 92 Ca -0.07 -0.97 -0.04 0.00 0.00 0.00 0.00 51.96 50.88 1tm1 s ALA 92 Cb -0.16 -3.53 0.14 0.00 0.00 0.00 0.00 23.12 19.58 1tm1 s ALA 92 CO 0.01 -1.99 0.36 0.08 0.00 0.00 0.00 175.76 174.22 1tm1 s VAL 93 N 3.44 3.71 -0.32 0.00 1.01 -0.69 -1.38 120.40 126.18 1tm1 s VAL 93 Ca 0.32 -2.47 -0.26 0.00 0.00 0.00 0.00 61.98 59.57 1tm1 s VAL 93 Cb -0.12 -3.46 0.01 0.00 0.00 0.00 0.00 36.38 32.82 1tm1 s VAL 93 CO 0.23 -0.81 0.93 -0.75 0.00 0.00 0.00 175.10 174.71 1tm1 s LYS 94 N 0.56 4.00 0.00 2.72 2.20 -0.38 -1.55 119.74 127.29 1tm1 s LYS 94 Ca 0.12 0.81 0.00 0.00 -0.36 0.00 0.00 55.97 56.54 1tm1 s LYS 94 Cb -0.21 -3.74 0.00 0.00 -1.51 0.00 0.00 37.83 32.37 1tm1 s LYS 94 CO -0.04 -0.80 0.22 1.33 -0.36 0.00 0.00 175.35 175.71 1tm1 n VAL 95 N 5.71 0.00 -5.30 4.02 0.24 0.47 -0.20 118.33 123.28 1tm1 n VAL 95 Ca 0.08 -0.29 -0.31 0.00 -2.04 0.00 0.00 64.34 61.77 1tm1 n VAL 95 Cb 0.48 1.31 -0.16 0.00 -1.47 0.00 0.00 33.84 34.00 1tm1 n VAL 95 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 1tm1 s LEU 96 N -0.28 2.05 0.00 1.34 1.43 -0.90 -4.28 118.68 118.04 1tm1 s LEU 96 Ca 0.00 -0.48 -0.12 0.00 -1.03 0.00 0.00 54.13 52.51 1tm1 s LEU 96 Cb 0.00 -1.35 0.18 0.00 0.03 0.00 0.00 46.19 45.05 1tm1 s LEU 96 CO 0.00 0.30 1.06 0.61 0.23 0.00 0.00 176.35 178.56 1tm1 n GLY 97 N 2.57 -1.08 0.41 -3.19 0.00 -0.55 -4.40 105.19 98.95 1tm1 n GLY 97 Ca -0.16 -1.76 0.24 0.00 0.00 0.00 0.00 46.02 44.34 1tm1 n GLY 97 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1tm1 h ALA 98 N -1.61 2.28 0.00 4.61 0.00 -1.89 0.11 119.26 122.75 1tm1 h ALA 98 Ca -0.35 0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.62 1tm1 h ALA 98 Cb 0.99 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.82 1tm1 h ALA 98 CO 0.26 -0.69 0.00 -0.40 0.00 0.00 0.00 179.25 178.42 1tm1 n ASP 99 N -4.61 0.00 0.00 0.00 5.68 -1.26 -4.25 116.55 112.10 1tm1 n ASP 99 Ca 0.26 -1.39 0.00 0.00 -0.50 0.00 0.00 54.79 53.16 1tm1 n ASP 99 Cb 0.91 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.89 1tm1 n ASP 99 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1tm1 n GLY 100 N 0.77 0.73 3.34 6.12 0.00 0.37 -5.04 105.19 111.49 1tm1 n GLY 100 Ca 0.14 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.92 1tm1 n GLY 100 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1tm1 s SER 101 N -2.42 2.84 0.01 1.61 0.15 -1.26 -4.86 113.70 109.78 1tm1 s SER 101 Ca 0.00 -0.82 -0.09 0.00 0.70 0.00 0.00 55.95 55.74 1tm1 s SER 101 Cb 0.00 -0.18 0.00 0.00 -1.71 0.00 0.00 66.02 64.14 1tm1 s SER 101 CO 0.00 0.03 0.18 -0.83 1.20 0.00 0.00 173.24 173.81 1tm1 s GLY 102 N -2.48 0.02 0.50 9.45 0.00 -1.26 -1.47 107.32 112.07 1tm1 s GLY 102 Ca 0.15 -0.11 -0.21 0.00 0.00 0.00 0.00 44.72 44.54 1tm1 s GLY 102 CO 0.07 -0.27 1.14 1.20 0.00 0.00 0.00 173.10 175.23 1tm1 s GLN 103 N -1.69 3.59 0.25 2.90 -1.52 -1.26 -4.94 119.66 116.98 1tm1 s GLN 103 Ca -0.12 1.67 -0.03 0.00 -1.95 0.00 0.00 55.36 54.92 1tm1 s GLN 103 Cb -0.06 -2.21 0.51 0.00 -0.22 0.00 0.00 33.01 31.04 1tm1 s GLN 103 CO 0.01 -0.67 1.68 1.88 -0.25 0.00 0.00 175.29 177.94 1tm1 h TYR 104 N 1.64 0.32 -0.13 0.91 -1.99 -2.00 -0.51 116.97 115.20 1tm1 h TYR 104 Ca -0.50 0.04 -0.01 0.00 2.00 0.00 0.00 58.73 60.27 1tm1 h TYR 104 Cb 1.25 -0.02 -0.01 0.00 2.00 0.00 0.00 36.73 39.95 1tm1 h TYR 104 CO 0.53 -0.09 0.06 0.66 -0.00 0.00 0.00 178.16 179.31 1tm1 h SER 105 N 0.28 0.16 -0.39 3.88 4.64 -1.99 -0.56 113.55 119.57 1tm1 h SER 105 Ca 0.44 -0.01 -0.11 0.00 -0.47 0.00 0.00 61.79 61.65 1tm1 h SER 105 Cb 0.78 -0.04 -0.01 0.00 -0.31 0.00 0.00 62.40 62.82 1tm1 h SER 105 CO -0.53 0.14 -0.18 -0.50 -0.87 0.00 0.00 176.83 174.89 1tm1 h TRP 106 N 0.18 0.93 -0.36 4.77 6.55 -1.40 0.22 115.95 126.85 1tm1 h TRP 106 Ca 0.05 -0.23 -0.06 0.00 0.95 0.00 0.00 58.89 59.60 1tm1 h TRP 106 Cb 0.03 -0.22 -0.01 0.00 -0.86 0.00 0.00 29.16 28.10 1tm1 h TRP 106 CO 0.00 0.98 -0.00 0.82 -1.05 0.00 0.00 178.44 179.19 1tm1 h ILE 107 N 0.61 1.26 -0.52 1.49 5.03 -1.14 -0.98 117.51 123.27 1tm1 h ILE 107 Ca 0.09 -0.99 -0.01 0.00 -0.12 0.00 0.00 64.86 63.83 1tm1 h ILE 107 Cb 0.73 1.18 -0.02 0.00 -3.03 0.00 0.00 36.82 35.68 1tm1 h ILE 107 CO 0.06 0.33 0.28 0.40 -0.68 0.00 0.00 178.15 178.53 1tm1 h ILE 108 N 0.46 1.18 -0.77 -0.67 2.04 -1.02 0.15 117.51 118.87 1tm1 h ILE 108 Ca 0.10 -0.47 0.01 0.00 1.00 0.00 0.00 64.86 65.50 1tm1 h ILE 108 Cb 0.46 0.54 -0.04 0.00 -0.74 0.00 0.00 36.82 37.05 1tm1 h ILE 108 CO 0.02 0.20 0.51 0.78 0.00 0.00 0.00 178.15 179.65 1tm1 h ASN 109 N 0.70 0.89 -0.29 1.72 2.35 -0.67 0.50 115.58 120.77 1tm1 h ASN 109 Ca 0.18 -0.02 -0.04 0.00 -0.55 0.00 0.00 56.30 55.87 1tm1 h ASN 109 Cb 0.06 -0.22 -0.01 0.00 0.05 0.00 0.00 38.32 38.20 1tm1 h ASN 109 CO -0.03 0.64 0.02 1.23 -1.65 0.00 0.00 177.43 177.65 1tm1 h GLY 110 N 1.05 0.54 0.79 2.83 0.00 -0.36 0.09 103.07 108.00 1tm1 h GLY 110 Ca 0.28 -0.38 0.03 0.00 0.00 0.00 0.00 47.33 47.27 1tm1 h GLY 110 CO -0.06 0.35 0.24 -2.22 0.00 0.00 0.00 176.54 174.85 1tm1 h ILE 111 N 0.30 0.98 -0.83 2.60 2.04 -0.48 -0.60 117.51 121.52 1tm1 h ILE 111 Ca 0.08 -0.16 0.00 0.00 1.00 0.00 0.00 64.86 65.78 1tm1 h ILE 111 Cb 0.39 0.46 -0.04 0.00 -0.74 0.00 0.00 36.82 36.90 1tm1 h ILE 111 CO 0.01 0.09 0.53 -0.33 0.00 0.00 0.00 178.15 178.44 1tm1 h GLU 112 N 0.48 1.11 -0.42 2.37 4.39 -0.74 -1.10 114.58 120.67 1tm1 h GLU 112 Ca 0.20 -0.08 0.03 0.00 0.34 0.00 0.00 59.36 59.84 1tm1 h GLU 112 Cb 0.09 -0.24 -0.04 0.00 -0.10 0.00 0.00 28.75 28.46 1tm1 h GLU 112 CO -0.13 0.76 0.21 2.35 -1.16 0.00 0.00 179.01 181.04 1tm1 h TRP 113 N 1.14 0.39 -0.52 4.33 7.01 -0.62 -0.62 115.95 127.05 1tm1 h TRP 113 Ca 0.30 0.02 0.03 0.00 2.11 0.00 0.00 58.89 61.35 1tm1 h TRP 113 Cb -0.09 -0.11 -0.04 0.00 -2.10 0.00 0.00 29.16 26.83 1tm1 h TRP 113 CO -0.01 0.20 0.30 0.00 -2.79 0.00 0.00 178.44 176.15 1tm1 h ALA 114 N 1.22 0.67 -0.12 2.65 0.00 -0.49 -0.06 119.26 123.13 1tm1 h ALA 114 Ca 0.18 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.08 1tm1 h ALA 114 Cb 0.08 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 1tm1 h ALA 114 CO -0.12 0.00 0.07 0.82 0.00 0.00 0.00 179.25 180.02 1tm1 h ILE 115 N 0.60 1.06 0.00 0.00 2.04 -0.93 -1.65 117.51 118.63 1tm1 h ILE 115 Ca 0.21 -0.15 -0.03 0.00 1.00 0.00 0.00 64.86 65.90 1tm1 h ILE 115 Cb 0.04 0.94 -0.00 0.00 -0.74 0.00 0.00 36.82 37.06 1tm1 h ILE 115 CO -0.10 0.05 -0.13 0.00 0.00 0.00 0.00 178.15 177.97 1tm1 h ALA 116 N 1.01 1.25 -0.71 1.87 0.00 -0.66 -2.20 119.26 119.83 1tm1 h ALA 116 Ca 0.04 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.83 1tm1 h ALA 116 Cb 0.02 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.79 1tm1 h ALA 116 CO -0.01 0.17 0.00 0.09 0.00 0.00 0.00 179.25 179.50 1tm1 n ASN 117 N -3.61 4.24 -2.93 0.00 3.02 -0.08 -4.97 115.26 110.93 1tm1 n ASN 117 Ca -0.02 -2.16 -0.19 0.00 -0.03 0.00 0.00 54.58 52.19 1tm1 n ASN 117 Cb 0.26 -0.52 0.06 0.00 -0.61 0.00 0.00 39.78 38.97 1tm1 n ASN 117 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 1tm1 n ASN 118 N 1.47 -5.41 -4.77 6.41 3.02 -0.83 -4.96 115.26 110.18 1tm1 n ASN 118 Ca 0.25 -0.43 -0.41 0.00 -0.03 0.00 0.00 54.58 53.97 1tm1 n ASN 118 Cb 0.72 -4.07 -0.02 0.00 -0.61 0.00 0.00 39.78 35.80 1tm1 n ASN 118 CO 0.00 0.00 0.00 -0.04 -2.62 0.00 0.00 177.26 174.60 1tm1 s MET 119 N -6.02 4.31 0.06 3.52 -1.94 -0.66 -4.86 119.30 113.70 1tm1 s MET 119 Ca 0.46 2.28 0.10 0.00 -1.71 0.00 0.00 55.69 56.82 1tm1 s MET 119 Cb -0.20 -3.06 -0.20 0.00 2.01 0.00 0.00 34.83 33.38 1tm1 s MET 119 CO 0.57 -0.26 1.01 -0.44 -0.01 0.00 0.00 175.02 175.89 1tm1 h ASP 120 N 3.42 0.00 -3.71 3.03 3.32 -1.25 -3.43 116.42 117.81 1tm1 h ASP 120 Ca -0.49 0.00 -0.24 0.00 0.02 0.00 0.00 57.03 56.32 1tm1 h ASP 120 Cb 1.23 0.00 -0.29 0.00 0.22 0.00 0.00 39.33 40.49 1tm1 h ASP 120 CO 0.66 0.96 -0.71 -0.69 -1.72 0.00 0.00 179.24 177.74 1tm1 s VAL 121 N -2.68 -0.01 -0.10 -1.35 1.01 -0.68 -1.38 120.40 115.20 1tm1 s VAL 121 Ca -0.01 0.03 0.02 0.00 0.00 0.00 0.00 61.98 62.01 1tm1 s VAL 121 Cb 0.09 -0.03 -0.02 0.00 0.00 0.00 0.00 36.38 36.43 1tm1 s VAL 121 CO 0.82 0.01 -0.15 -0.63 0.00 0.00 0.00 175.10 175.15 1tm1 s ILE 122 N 0.14 2.88 -0.14 2.22 1.01 0.40 -0.80 121.20 126.90 1tm1 s ILE 122 Ca -0.01 -0.75 -0.02 0.00 0.00 0.00 0.00 60.65 59.88 1tm1 s ILE 122 Cb -0.02 -2.17 -0.02 0.00 0.01 0.00 0.00 42.46 40.27 1tm1 s ILE 122 CO -0.00 0.55 -0.09 0.21 0.00 0.00 0.00 174.94 175.60 1tm1 s ASN 123 N 0.03 4.30 -0.40 3.58 2.47 -0.20 -0.93 114.94 123.80 1tm1 s ASN 123 Ca -0.05 -0.26 0.03 0.00 0.42 0.00 0.00 52.86 52.99 1tm1 s ASN 123 Cb -0.15 -1.68 0.11 0.00 -1.45 0.00 0.00 41.25 38.09 1tm1 s ASN 123 CO 0.05 0.16 0.14 -0.04 -3.72 0.00 0.00 177.10 173.69 1tm1 s MET 124 N 0.40 1.43 -1.37 0.43 -1.94 0.29 -1.53 119.30 117.01 1tm1 s MET 124 Ca -0.08 -1.94 -0.07 0.00 -1.71 0.00 0.00 55.69 51.89 1tm1 s MET 124 Cb -0.15 -2.87 0.09 0.00 2.01 0.00 0.00 34.83 33.91 1tm1 s MET 124 CO 0.04 -1.03 2.43 0.43 -0.01 0.00 0.00 175.02 176.88 1tm1 n SER 125 N 3.95 7.79 -3.83 3.03 7.64 -1.26 -1.84 113.62 129.09 1tm1 n SER 125 Ca 0.04 -3.03 -0.09 0.00 1.01 0.00 0.00 58.87 56.80 1tm1 n SER 125 Cb 0.38 -1.41 -0.04 0.00 -1.01 0.00 0.00 64.21 62.13 1tm1 n SER 125 CO 0.00 0.00 0.00 -1.48 -3.01 0.00 0.00 175.04 170.55 1tm1 s LEU 126 N -1.44 0.02 0.00 -3.43 0.05 -1.26 -4.83 118.68 107.80 1tm1 s LEU 126 Ca 0.55 -0.62 0.00 0.00 0.05 0.00 0.00 54.13 54.11 1tm1 s LEU 126 Cb 0.17 2.23 0.00 0.00 -2.05 0.00 0.00 46.19 46.54 1tm1 s LEU 126 CO -0.08 -1.16 0.00 0.61 -0.55 0.00 0.00 176.35 175.17 1tm1 n GLY 127 N -0.39 -0.15 3.34 -3.48 0.00 -1.26 -4.49 105.19 98.77 1tm1 n GLY 127 Ca -0.06 -0.92 -0.10 0.00 0.00 0.00 0.00 46.02 44.94 1tm1 n GLY 127 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1tm1 s GLY 128 N 0.00 -0.18 0.46 -0.02 0.00 -0.20 -4.95 107.32 102.43 1tm1 s GLY 128 Ca 0.00 -0.16 0.30 0.00 0.00 0.00 0.00 44.72 44.86 1tm1 s GLY 128 CO 0.00 -0.36 1.86 -0.56 0.00 0.00 0.00 173.10 174.04 1tm1 h PRO 129 N 2.37 0.00 -6.74 2.90 0.13 -1.96 -0.18 132.00 128.53 1tm1 h PRO 129 Ca -0.33 0.00 -0.67 0.00 -0.87 0.00 0.00 66.00 64.13 1tm1 h PRO 129 Cb 1.25 0.00 -0.19 0.00 0.13 0.00 0.00 31.00 32.19 1tm1 h PRO 129 CO 0.46 0.00 -0.82 -1.12 -0.23 0.00 0.00 178.00 176.29 1tm1 s SER 130 N -5.47 3.70 0.52 1.44 0.01 -1.26 -4.75 113.70 107.89 1tm1 s SER 130 Ca 0.03 -0.65 0.00 0.00 1.31 0.00 0.00 55.95 56.64 1tm1 s SER 130 Cb 0.08 -0.43 0.06 0.00 0.21 0.00 0.00 66.02 65.94 1tm1 s SER 130 CO 0.54 0.17 0.41 0.61 0.41 0.00 0.00 173.24 175.38 1tm1 n GLY 131 N 0.70 0.76 3.17 3.44 0.00 -1.26 -4.73 105.19 107.27 1tm1 n GLY 131 Ca -0.15 -1.99 -0.11 0.00 0.00 0.00 0.00 46.02 43.77 1tm1 n GLY 131 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1tm1 s SER 132 N -2.68 0.01 0.26 1.61 1.04 -1.26 -5.02 113.70 107.66 1tm1 s SER 132 Ca 0.27 -0.31 -0.02 0.00 0.48 0.00 0.00 55.95 56.38 1tm1 s SER 132 Cb -0.02 0.28 0.43 0.00 0.10 0.00 0.00 66.02 66.82 1tm1 s SER 132 CO 0.18 -0.52 1.86 0.00 0.98 0.00 0.00 173.24 175.74 1tm1 h ALA 133 N 3.61 1.37 -0.27 5.32 0.00 -2.00 -0.33 119.26 126.96 1tm1 h ALA 133 Ca -0.32 -0.00 -0.12 0.00 0.00 0.00 0.00 54.91 54.47 1tm1 h ALA 133 Cb 1.19 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.72 1tm1 h ALA 133 CO 0.46 0.32 -0.32 0.00 0.00 0.00 0.00 179.25 179.72 1tm1 h ALA 134 N 1.47 0.94 -0.16 0.00 0.00 -1.98 0.10 119.26 119.62 1tm1 h ALA 134 Ca 0.44 -0.40 -0.06 0.00 0.00 0.00 0.00 54.91 54.90 1tm1 h ALA 134 Cb 0.28 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 17.94 1tm1 h ALA 134 CO -0.21 0.61 -0.11 1.25 0.00 0.00 0.00 179.25 180.79 1tm1 h LEU 135 N 0.49 0.39 -0.74 0.00 5.85 -1.80 -1.64 115.31 117.85 1tm1 h LEU 135 Ca 0.06 -0.44 0.04 0.00 0.84 0.00 0.00 57.88 58.37 1tm1 h LEU 135 Cb 0.79 -0.11 -0.05 0.00 0.37 0.00 0.00 40.66 41.67 1tm1 h LEU 135 CO 0.06 0.75 0.46 0.50 -0.34 0.00 0.00 178.44 179.87 1tm1 h LYS 136 N 0.03 0.86 -0.42 1.25 3.64 -0.89 -1.74 116.57 119.30 1tm1 h LYS 136 Ca 0.03 -0.05 -0.04 0.00 -1.27 0.00 0.00 60.65 59.32 1tm1 h LYS 136 Cb 0.62 -0.19 -0.02 0.00 -0.41 0.00 0.00 32.23 32.22 1tm1 h LYS 136 CO 0.03 0.57 0.10 0.00 -2.27 0.00 0.00 179.45 177.89 1tm1 h ALA 137 N 1.33 1.40 -0.05 5.00 0.00 -0.64 -0.21 119.26 126.08 1tm1 h ALA 137 Ca 0.30 -0.16 -0.02 0.00 0.00 0.00 0.00 54.91 55.03 1tm1 h ALA 137 Cb 0.05 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 17.67 1tm1 h ALA 137 CO -0.13 0.44 -0.06 0.00 0.00 0.00 0.00 179.25 179.51 1tm1 h ALA 138 N 1.51 0.08 -0.70 0.00 0.00 -0.71 0.72 119.26 120.16 1tm1 h ALA 138 Ca 0.14 -0.28 -0.06 0.00 0.00 0.00 0.00 54.91 54.71 1tm1 h ALA 138 Cb 0.23 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 17.97 1tm1 h ALA 138 CO -0.00 -0.12 0.18 -0.39 0.00 0.00 0.00 179.25 178.92 1tm1 h VAL 139 N -0.33 1.26 -0.63 0.00 -1.51 -1.24 -1.22 116.25 112.59 1tm1 h VAL 139 Ca 0.01 -0.94 -0.05 0.00 -1.23 0.00 0.00 66.70 64.49 1tm1 h VAL 139 Cb 0.57 0.52 -0.03 0.00 -2.13 0.00 0.00 31.29 30.22 1tm1 h VAL 139 CO 0.01 0.36 0.19 0.44 -1.23 0.00 0.00 177.57 177.34 1tm1 h ASP 140 N 1.05 0.89 -0.46 4.19 3.32 -0.97 -1.69 116.42 122.76 1tm1 h ASP 140 Ca 0.22 -0.16 -0.07 0.00 0.02 0.00 0.00 57.03 57.05 1tm1 h ASP 140 Cb 0.35 -0.23 -0.02 0.00 0.22 0.00 0.00 39.33 39.65 1tm1 h ASP 140 CO -0.00 0.85 0.01 0.50 -1.72 0.00 0.00 179.24 178.88 1tm1 h LYS 141 N 0.93 0.80 -0.48 3.56 3.64 -0.53 0.07 116.57 124.56 1tm1 h LYS 141 Ca 0.21 -0.25 0.02 0.00 -1.27 0.00 0.00 60.65 59.36 1tm1 h LYS 141 Cb 0.28 -0.08 -0.03 0.00 -0.41 0.00 0.00 32.23 31.99 1tm1 h LYS 141 CO -0.01 0.85 0.30 0.00 -2.27 0.00 0.00 179.45 178.32 1tm1 h ALA 142 N 0.92 0.61 -0.54 5.00 0.00 -0.91 -0.26 119.26 124.09 1tm1 h ALA 142 Ca 0.13 -0.02 -0.10 0.00 0.00 0.00 0.00 54.91 54.93 1tm1 h ALA 142 Cb 0.48 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.10 1tm1 h ALA 142 CO 0.02 0.00 -0.04 0.28 0.00 0.00 0.00 179.25 179.52 1tm1 h VAL 143 N 0.60 1.27 -0.10 0.00 2.07 -1.16 -1.39 116.25 117.53 1tm1 h VAL 143 Ca 0.19 -1.17 -0.01 0.00 0.82 0.00 0.00 66.70 66.53 1tm1 h VAL 143 Cb -0.01 0.94 -0.01 0.00 -1.52 0.00 0.00 31.29 30.69 1tm1 h VAL 143 CO -0.07 0.41 -0.00 0.00 0.02 0.00 0.00 177.57 177.93 1tm1 h ALA 144 N 0.94 1.82 -0.00 1.67 0.00 -0.68 -1.08 119.26 121.92 1tm1 h ALA 144 Ca 0.15 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.99 1tm1 h ALA 144 Cb 0.59 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.33 1tm1 h ALA 144 CO 0.04 0.15 -0.02 0.43 0.00 0.00 0.00 179.25 179.85 1tm1 n SER 145 N -4.45 0.20 0.00 0.00 7.64 -0.13 -4.92 113.62 111.96 1tm1 n SER 145 Ca -0.01 -0.79 0.00 0.00 1.01 0.00 0.00 58.87 59.08 1tm1 n SER 145 Cb 0.14 -0.08 0.00 0.00 -1.01 0.00 0.00 64.21 63.26 1tm1 n SER 145 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1tm1 n GLY 146 N 1.12 0.77 3.75 0.23 0.00 -0.41 -5.07 105.19 105.59 1tm1 n GLY 146 Ca 0.20 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.82 1tm1 n GLY 146 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1tm1 s VAL 147 N -2.00 4.75 -0.16 1.61 1.01 -0.57 -4.12 120.40 120.91 1tm1 s VAL 147 Ca 0.00 1.53 -0.29 0.00 0.00 0.00 0.00 61.98 63.22 1tm1 s VAL 147 Cb 0.00 -4.07 -0.01 0.00 0.00 0.00 0.00 36.38 32.31 1tm1 s VAL 147 CO 0.00 0.39 1.11 -0.69 0.00 0.00 0.00 175.10 175.91 1tm1 s VAL 148 N -0.18 4.54 -0.21 2.92 1.01 -0.48 -4.18 120.40 123.83 1tm1 s VAL 148 Ca 0.36 1.85 -0.02 0.00 0.00 0.00 0.00 61.98 64.17 1tm1 s VAL 148 Cb -0.20 -4.19 -0.00 0.00 0.00 0.00 0.00 36.38 31.98 1tm1 s VAL 148 CO 0.22 -0.11 -0.09 -0.69 0.00 0.00 0.00 175.10 174.43 1tm1 s VAL 149 N 2.89 3.03 -0.04 2.92 1.01 -1.26 -0.46 120.40 128.49 1tm1 s VAL 149 Ca 0.49 -0.61 0.06 0.00 0.00 0.00 0.00 61.98 61.92 1tm1 s VAL 149 Cb -0.19 -2.35 -0.01 0.00 0.00 0.00 0.00 36.38 33.83 1tm1 s VAL 149 CO 0.13 0.46 -0.24 -0.69 0.00 0.00 0.00 175.10 174.75 1tm1 s VAL 150 N 1.37 1.96 0.04 2.92 1.01 -0.10 -1.46 120.40 126.14 1tm1 s VAL 150 Ca 0.05 -1.03 -0.02 0.00 0.00 0.00 0.00 61.98 60.98 1tm1 s VAL 150 Cb -0.14 -1.65 -0.03 0.00 0.00 0.00 0.00 36.38 34.57 1tm1 s VAL 150 CO -0.05 0.55 -0.00 0.00 0.00 0.00 0.00 175.10 175.59 1tm1 s ALA 151 N -0.29 0.23 0.37 5.51 0.00 0.11 -0.55 121.76 127.13 1tm1 s ALA 151 Ca 0.01 -0.81 -0.28 0.00 0.00 0.00 0.00 51.96 50.88 1tm1 s ALA 151 Cb -0.12 0.22 -0.11 0.00 0.00 0.00 0.00 23.12 23.11 1tm1 s ALA 151 CO 0.02 -0.27 1.45 0.00 0.00 0.00 0.00 175.76 176.95 1tm1 s ALA 152 N -2.63 3.54 0.26 0.00 0.00 -0.77 -1.08 121.76 121.09 1tm1 s ALA 152 Ca -0.05 1.51 0.17 0.00 0.00 0.00 0.00 51.96 53.59 1tm1 s ALA 152 Cb -0.01 -3.58 0.73 0.00 0.00 0.00 0.00 23.12 20.26 1tm1 s ALA 152 CO -0.05 -0.98 1.78 0.00 0.00 0.00 0.00 175.76 176.51 1tm1 h ALA 153 N 3.05 1.12 0.00 0.00 0.00 -1.17 -3.40 119.26 118.86 1tm1 h ALA 153 Ca -0.50 -0.35 0.00 0.00 0.00 0.00 0.00 54.91 54.06 1tm1 h ALA 153 Cb 1.24 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.97 1tm1 h ALA 153 CO 0.64 0.48 0.00 0.41 0.00 0.00 0.00 179.25 180.78 1tm1 n GLY 154 N -0.05 2.54 2.17 0.00 0.00 -1.26 -1.11 105.19 107.48 1tm1 n GLY 154 Ca -0.01 -2.05 -0.25 0.00 0.00 0.00 0.00 46.02 43.71 1tm1 n GLY 154 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1tm1 n ASN 155 N 0.00 4.83 -0.20 1.61 3.02 -1.26 -1.33 115.26 121.94 1tm1 n ASN 155 Ca 0.00 -3.73 0.13 0.00 -0.03 0.00 0.00 54.58 50.95 1tm1 n ASN 155 Cb 0.00 -0.38 0.35 0.00 -0.61 0.00 0.00 39.78 39.14 1tm1 n ASN 155 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1tm1 n GLU 156 N -0.64 0.67 0.00 3.52 -0.58 -0.96 -4.75 120.64 117.90 1tm1 n GLU 156 Ca 0.42 -0.40 0.00 0.00 -0.42 0.00 0.00 57.16 56.76 1tm1 n GLU 156 Cb 0.87 -1.49 0.00 0.00 -0.57 0.00 0.00 31.44 30.25 1tm1 n GLU 156 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1tm1 n GLY 157 N 1.37 1.36 3.92 0.62 0.00 0.03 -4.78 105.19 107.71 1tm1 n GLY 157 Ca 0.11 -0.60 -0.21 0.00 0.00 0.00 0.00 46.02 45.31 1tm1 n GLY 157 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1tm1 s THR 158 N 0.00 4.74 -0.45 2.61 -4.23 -1.26 -3.83 115.64 113.22 1tm1 s THR 158 Ca 0.00 -1.13 0.07 0.00 -1.18 0.00 0.00 61.69 59.45 1tm1 s THR 158 Cb 0.00 -3.62 0.25 0.00 1.34 0.00 0.00 72.50 70.46 1tm1 s THR 158 CO 0.00 -0.30 0.76 -0.24 -0.54 0.00 0.00 174.62 174.30 1tm1 n SER 159 N -1.38 -1.78 0.00 3.99 2.88 -1.26 -5.09 113.62 110.98 1tm1 n SER 159 Ca -0.07 -3.09 0.00 0.00 -1.33 0.00 0.00 58.87 54.38 1tm1 n SER 159 Cb 0.58 0.94 0.00 0.00 -0.75 0.00 0.00 64.21 64.98 1tm1 n SER 159 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1tm1 n GLY 160 N 1.54 4.06 0.90 0.46 0.00 -1.26 -1.80 105.19 109.09 1tm1 n GLY 160 Ca 0.13 0.06 0.12 0.00 0.00 0.00 0.00 46.02 46.33 1tm1 n GLY 160 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1tm1 n SER 161 N 7.25 2.71 -4.82 1.61 7.64 -1.26 -4.96 113.62 121.79 1tm1 n SER 161 Ca 0.00 -1.88 -0.34 0.00 1.01 0.00 0.00 58.87 57.66 1tm1 n SER 161 Cb 0.00 -0.14 -0.06 0.00 -1.01 0.00 0.00 64.21 63.00 1tm1 n SER 161 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 1tm1 s SER 162 N -1.66 7.01 0.33 6.43 0.01 -0.74 -5.04 113.70 120.03 1tm1 s SER 162 Ca 0.35 1.55 -0.28 0.00 1.31 0.00 0.00 55.95 58.87 1tm1 s SER 162 Cb 0.21 -2.48 -0.10 0.00 0.21 0.00 0.00 66.02 63.86 1tm1 s SER 162 CO 0.30 -0.16 1.24 -0.55 0.41 0.00 0.00 173.24 174.48 1tm1 s SER 163 N -1.96 6.82 -0.05 2.44 0.15 -1.26 -4.46 113.70 115.39 1tm1 s SER 163 Ca 0.53 2.55 0.07 0.00 0.70 0.00 0.00 55.95 59.79 1tm1 s SER 163 Cb -0.13 -2.64 0.10 0.00 -1.71 0.00 0.00 66.02 61.64 1tm1 s SER 163 CO 0.18 -0.48 1.00 0.35 1.20 0.00 0.00 173.24 175.49 1tm1 n THR 164 N 0.75 1.12 -2.07 6.45 -2.24 0.88 -4.98 114.28 114.19 1tm1 n THR 164 Ca 0.01 -1.25 -0.42 0.00 -2.27 0.00 0.00 64.05 60.11 1tm1 n THR 164 Cb 0.43 0.30 -0.03 0.00 -2.10 0.00 0.00 70.33 68.93 1tm1 n THR 164 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 1tm1 s VAL 165 N -1.47 3.02 0.61 2.28 1.01 -1.16 -4.61 120.40 120.09 1tm1 s VAL 165 Ca 0.11 0.73 -0.01 0.00 0.00 0.00 0.00 61.98 62.81 1tm1 s VAL 165 Cb 0.10 -3.47 0.12 0.00 0.00 0.00 0.00 36.38 33.13 1tm1 s VAL 165 CO 0.01 0.05 0.83 0.61 0.00 0.00 0.00 175.10 176.60 1tm1 n GLY 166 N 3.61 0.55 3.86 4.51 0.00 -0.27 -4.69 105.19 112.76 1tm1 n GLY 166 Ca 0.13 -2.00 -0.34 0.00 0.00 0.00 0.00 46.02 43.81 1tm1 n GLY 166 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1tm1 s TYR 167 N -2.52 3.46 -1.98 1.61 2.02 -0.08 -0.25 117.35 119.61 1tm1 s TYR 167 Ca 0.54 0.32 0.30 0.00 -0.37 0.00 0.00 57.07 57.86 1tm1 s TYR 167 Cb -0.03 -1.81 1.40 0.00 -0.40 0.00 0.00 41.96 41.12 1tm1 s TYR 167 CO 0.36 0.62 1.95 -0.35 -1.57 0.00 0.00 175.55 176.56 1tm1 n PRO 168 N 1.15 1.03 -0.19 -1.71 -0.04 -1.26 -1.04 135.00 132.94 1tm1 n PRO 168 Ca -0.13 -0.34 0.19 0.00 -0.04 0.00 0.00 63.50 63.18 1tm1 n PRO 168 Cb 0.53 -1.49 0.54 0.00 -0.04 0.00 0.00 33.50 33.03 1tm1 n PRO 168 CO 0.00 0.00 0.00 0.78 -0.04 0.00 0.00 175.50 176.24 1tm1 h GLY 169 N 4.95 0.68 2.00 0.55 0.00 -1.70 -1.69 103.07 107.86 1tm1 h GLY 169 Ca 0.00 -0.16 0.00 0.00 0.00 0.00 0.00 47.33 47.17 1tm1 h GLY 169 CO 0.00 0.02 0.00 1.70 0.00 0.00 0.00 176.54 178.26 1tm1 h LYS 170 N 0.35 0.00 -6.73 4.80 3.64 -0.90 -3.37 116.57 114.36 1tm1 h LYS 170 Ca 0.41 0.00 -0.52 0.00 -1.27 0.00 0.00 60.65 59.27 1tm1 h LYS 170 Cb 1.09 0.00 0.04 0.00 -0.41 0.00 0.00 32.23 32.95 1tm1 h LYS 170 CO -0.13 0.00 0.67 0.71 -2.27 0.00 0.00 179.45 178.43 1tm1 s TYR 171 N -3.47 3.18 0.48 1.91 2.02 -0.64 -4.92 117.35 115.91 1tm1 s TYR 171 Ca 0.03 1.22 0.22 0.00 -0.37 0.00 0.00 57.07 58.17 1tm1 s TYR 171 Cb 0.09 -3.66 1.24 0.00 -0.40 0.00 0.00 41.96 39.23 1tm1 s TYR 171 CO 0.51 -2.03 1.93 -1.35 -1.57 0.00 0.00 175.55 173.04 1tm1 h PRO 172 N 4.92 0.20 0.00 -1.71 0.11 -1.89 -1.70 132.00 131.94 1tm1 h PRO 172 Ca -0.46 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.64 1tm1 h PRO 172 Cb 1.22 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.28 1tm1 h PRO 172 CO 0.75 0.13 0.00 -1.13 -0.21 0.00 0.00 178.00 177.55 1tm1 n SER 173 N -4.42 0.38 -4.63 -2.05 3.41 -1.26 -4.75 113.62 100.31 1tm1 n SER 173 Ca 0.14 0.57 -0.34 0.00 -0.26 0.00 0.00 58.87 58.98 1tm1 n SER 173 Cb 0.65 -0.66 -0.10 0.00 -0.26 0.00 0.00 64.21 63.83 1tm1 n SER 173 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1tm1 s VAL 174 N -3.13 4.06 -0.39 -3.33 1.01 -0.64 -4.72 120.40 113.26 1tm1 s VAL 174 Ca 0.08 -0.34 -0.26 0.00 0.00 0.00 0.00 61.98 61.46 1tm1 s VAL 174 Cb 0.11 -2.70 0.02 0.00 0.00 0.00 0.00 36.38 33.81 1tm1 s VAL 174 CO 0.40 0.59 0.92 -0.63 0.00 0.00 0.00 175.10 176.39 1tm1 s ILE 175 N -0.72 4.56 -0.18 2.22 1.01 -0.53 -4.79 121.20 122.78 1tm1 s ILE 175 Ca 0.11 1.10 -0.18 0.00 0.00 0.00 0.00 60.65 61.68 1tm1 s ILE 175 Cb -0.11 -4.35 -0.04 0.00 0.01 0.00 0.00 42.46 37.97 1tm1 s ILE 175 CO 0.02 -0.60 0.50 0.00 0.00 0.00 0.00 174.94 174.86 1tm1 s ALA 176 N 3.53 3.53 -0.18 9.38 0.00 -1.26 -0.71 121.76 136.04 1tm1 s ALA 176 Ca 0.38 -0.36 -0.01 0.00 0.00 0.00 0.00 51.96 51.97 1tm1 s ALA 176 Cb -0.12 -2.75 -0.00 0.00 0.00 0.00 0.00 23.12 20.25 1tm1 s ALA 176 CO 0.20 -0.31 -0.11 0.08 0.00 0.00 0.00 175.76 175.62 1tm1 s VAL 177 N 1.33 2.91 0.68 0.00 1.01 -0.24 -1.29 120.40 124.79 1tm1 s VAL 177 Ca 0.24 -0.67 -0.01 0.00 0.00 0.00 0.00 61.98 61.54 1tm1 s VAL 177 Cb -0.15 -2.27 0.10 0.00 0.00 0.00 0.00 36.38 34.06 1tm1 s VAL 177 CO 0.10 0.49 0.94 -0.83 0.00 0.00 0.00 175.10 175.79 1tm1 s GLY 178 N 1.07 1.77 -0.10 4.51 0.00 -0.21 -0.67 107.32 113.69 1tm1 s GLY 178 Ca -0.00 -1.58 0.02 0.00 0.00 0.00 0.00 44.72 43.16 1tm1 s GLY 178 CO -0.03 -1.09 -0.17 0.00 0.00 0.00 0.00 173.10 171.81 1tm1 s ALA 179 N -3.06 2.49 0.36 3.20 0.00 -1.26 -1.36 121.76 122.14 1tm1 s ALA 179 Ca 0.64 -0.94 0.09 0.00 0.00 0.00 0.00 51.96 51.75 1tm1 s ALA 179 Cb -0.07 -1.04 -0.07 0.00 0.00 0.00 0.00 23.12 21.95 1tm1 s ALA 179 CO 0.43 0.33 -0.06 0.14 0.00 0.00 0.00 175.76 176.59 1tm1 s VAL 180 N 0.11 2.17 0.00 0.00 -7.23 -0.56 -1.23 120.40 113.66 1tm1 s VAL 180 Ca -0.08 -2.14 0.00 0.00 -1.81 0.00 0.00 61.98 57.95 1tm1 s VAL 180 Cb -0.15 -2.75 0.00 0.00 0.56 0.00 0.00 36.38 34.03 1tm1 s VAL 180 CO 0.05 -0.14 0.00 -0.90 -0.31 0.00 0.00 175.10 173.80 1tm1 n ASP 181 N -0.85 0.00 0.03 4.85 5.68 -0.15 -1.00 116.55 125.10 1tm1 n ASP 181 Ca -0.05 -0.78 0.09 0.00 -0.50 0.00 0.00 54.79 53.55 1tm1 n ASP 181 Cb 0.65 0.00 0.40 0.00 -1.14 0.00 0.00 41.12 41.03 1tm1 n ASP 181 CO 0.00 0.00 0.00 -1.54 -1.33 0.00 0.00 177.20 174.33 1tm1 n SER 182 N -2.35 0.15 -1.29 -1.12 3.41 -1.26 -1.10 113.62 110.07 1tm1 n SER 182 Ca 0.00 0.53 0.12 0.00 -0.26 0.00 0.00 58.87 59.26 1tm1 n SER 182 Cb 0.00 -0.57 0.30 0.00 -0.26 0.00 0.00 64.21 63.68 1tm1 n SER 182 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1tm1 n SER 183 N -1.66 3.76 -1.03 4.04 3.41 -1.26 -4.95 113.62 115.93 1tm1 n SER 183 Ca 0.04 -2.00 -0.13 0.00 -0.26 0.00 0.00 58.87 56.52 1tm1 n SER 183 Cb 0.23 -0.43 -0.06 0.00 -0.26 0.00 0.00 64.21 63.69 1tm1 n SER 183 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1tm1 n ASN 184 N 1.58 -4.76 -4.76 4.04 3.02 -0.25 -5.01 115.26 109.11 1tm1 n ASN 184 Ca 0.23 0.33 -0.39 0.00 -0.03 0.00 0.00 54.58 54.72 1tm1 n ASN 184 Cb 0.60 -3.44 -0.05 0.00 -0.61 0.00 0.00 39.78 36.28 1tm1 n ASN 184 CO 0.00 0.00 0.00 -1.10 -2.62 0.00 0.00 177.26 173.54 1tm1 s GLN 185 N -3.09 4.45 0.29 3.52 -1.52 -1.26 -4.78 119.66 117.27 1tm1 s GLN 185 Ca 0.00 1.00 -0.30 0.00 -1.95 0.00 0.00 55.36 54.11 1tm1 s GLN 185 Cb 0.00 -3.33 -0.12 0.00 -0.22 0.00 0.00 33.01 29.34 1tm1 s GLN 185 CO 0.00 0.39 1.54 -2.13 -0.25 0.00 0.00 175.29 174.85 1tm1 n ARG 186 N 2.42 2.53 -2.08 2.91 0.63 -1.26 -0.98 116.66 120.83 1tm1 n ARG 186 Ca -0.05 0.90 -0.41 0.00 -0.92 0.00 0.00 57.85 57.38 1tm1 n ARG 186 Cb 0.50 -2.65 -0.02 0.00 0.45 0.00 0.00 32.46 30.74 1tm1 n ARG 186 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1tm1 s ALA 187 N -0.09 3.52 0.50 5.13 0.00 -0.37 -4.83 121.76 125.63 1tm1 s ALA 187 Ca 0.64 1.29 0.20 0.00 0.00 0.00 0.00 51.96 54.09 1tm1 s ALA 187 Cb -0.53 -3.50 1.27 0.00 0.00 0.00 0.00 23.12 20.35 1tm1 s ALA 187 CO 0.50 -0.68 2.04 0.66 0.00 0.00 0.00 175.76 178.27 1tm1 h SER 188 N 3.64 0.09 1.33 0.00 4.64 -1.92 -0.88 113.55 120.46 1tm1 h SER 188 Ca -0.49 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.84 1tm1 h SER 188 Cb 1.23 -0.02 0.00 0.00 -0.31 0.00 0.00 62.40 63.30 1tm1 h SER 188 CO 0.67 0.06 0.00 2.22 -0.87 0.00 0.00 176.83 178.91 1tm1 n PHE 189 N -4.45 0.66 -1.84 4.77 1.16 -1.26 -4.39 117.46 112.11 1tm1 n PHE 189 Ca 0.06 0.19 -0.42 0.00 -1.87 0.00 0.00 57.45 55.41 1tm1 n PHE 189 Cb 0.39 -0.82 -0.03 0.00 -1.61 0.00 0.00 39.48 37.41 1tm1 n PHE 189 CO 0.00 0.00 0.00 0.45 -1.87 0.00 0.00 176.76 175.34 1tm1 s SER 190 N -4.09 6.53 0.73 5.98 0.15 -0.34 -0.79 113.70 121.88 1tm1 s SER 190 Ca 0.12 2.59 -0.16 0.00 0.70 0.00 0.00 55.95 59.20 1tm1 s SER 190 Cb 0.14 -2.56 0.01 0.00 -1.71 0.00 0.00 66.02 61.90 1tm1 s SER 190 CO 0.58 -0.93 0.95 -1.20 1.20 0.00 0.00 173.24 173.83 1tm1 n SER 191 N 5.66 0.40 -4.28 5.45 7.64 -0.44 -3.81 113.62 124.24 1tm1 n SER 191 Ca 0.17 0.65 -0.15 0.00 1.01 0.00 0.00 58.87 60.55 1tm1 n SER 191 Cb 0.40 -1.40 -0.10 0.00 -1.01 0.00 0.00 64.21 62.09 1tm1 n SER 191 CO 0.00 0.00 0.00 0.68 -3.01 0.00 0.00 175.04 172.71 1tm1 s VAL 192 N -1.85 0.97 0.00 0.44 -7.23 -1.25 -4.89 120.40 106.59 1tm1 s VAL 192 Ca 0.73 -2.02 0.00 0.00 -1.81 0.00 0.00 61.98 58.87 1tm1 s VAL 192 Cb -0.34 -2.11 0.00 0.00 0.56 0.00 0.00 36.38 34.49 1tm1 s VAL 192 CO 0.51 -0.51 0.00 0.61 -0.31 0.00 0.00 175.10 175.40 1tm1 n GLY 193 N -0.29 3.68 0.24 2.32 0.00 -0.36 -0.08 105.19 110.70 1tm1 n GLY 193 Ca -0.07 -1.62 0.16 0.00 0.00 0.00 0.00 46.02 44.49 1tm1 n GLY 193 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1tm1 h PRO 194 N 0.00 0.00 0.00 1.61 0.13 -1.87 -1.85 132.00 130.01 1tm1 h PRO 194 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 1tm1 h PRO 194 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 1tm1 h PRO 194 CO 0.00 0.00 0.00 0.39 -0.23 0.00 0.00 178.00 178.16 1tm1 n GLU 195 N -2.79 0.08 -2.04 0.86 4.71 -1.26 -4.79 120.64 115.41 1tm1 n GLU 195 Ca 0.00 0.11 -0.42 0.00 -0.01 0.00 0.00 57.16 56.84 1tm1 n GLU 195 Cb 0.23 -1.61 -0.03 0.00 -1.01 0.00 0.00 31.44 29.02 1tm1 n GLU 195 CO 0.00 0.00 0.00 -1.17 0.09 0.00 0.00 177.13 176.05 1tm1 s LEU 196 N -3.51 4.34 -0.19 -4.62 2.96 -0.70 -4.46 118.68 112.50 1tm1 s LEU 196 Ca 0.12 2.32 -0.17 0.00 -0.22 0.00 0.00 54.13 56.18 1tm1 s LEU 196 Cb 0.15 -3.56 -0.07 0.00 0.50 0.00 0.00 46.19 43.22 1tm1 s LEU 196 CO 0.51 -0.83 -0.35 -0.67 -1.32 0.00 0.00 176.35 173.69 1tm1 n ASP 197 N 5.72 1.92 -4.21 3.68 2.03 -0.41 -4.26 116.55 121.03 1tm1 n ASP 197 Ca 0.15 0.33 -0.13 0.00 0.52 0.00 0.00 54.79 55.66 1tm1 n ASP 197 Cb 0.42 -0.74 -0.10 0.00 -0.72 0.00 0.00 41.12 39.97 1tm1 n ASP 197 CO 0.00 0.00 0.00 0.68 -1.92 0.00 0.00 177.20 175.96 1tm1 s VAL 198 N -2.83 0.10 0.23 5.18 -7.23 -1.11 -0.46 120.40 114.28 1tm1 s VAL 198 Ca -0.30 -2.00 0.11 0.00 -1.81 0.00 0.00 61.98 57.98 1tm1 s VAL 198 Cb 0.06 -2.52 -0.05 0.00 0.56 0.00 0.00 36.38 34.43 1tm1 s VAL 198 CO 0.43 0.00 -0.18 -0.04 -0.31 0.00 0.00 175.10 175.00 1tm1 s MET 199 N -4.13 1.75 0.22 4.82 -1.94 0.52 -1.04 119.30 119.49 1tm1 s MET 199 Ca 0.39 -1.56 -0.13 0.00 -1.71 0.00 0.00 55.69 52.67 1tm1 s MET 199 Cb 0.07 -1.90 0.00 0.00 2.01 0.00 0.00 34.83 35.01 1tm1 s MET 199 CO 0.13 0.38 0.45 0.00 -0.01 0.00 0.00 175.02 175.96 1tm1 s ALA 200 N -2.06 -0.33 0.20 3.03 0.00 -0.46 -2.08 121.76 120.06 1tm1 s ALA 200 Ca 0.26 -0.75 -0.32 0.00 0.00 0.00 0.00 51.96 51.15 1tm1 s ALA 200 Cb -0.07 0.98 -0.12 0.00 0.00 0.00 0.00 23.12 23.92 1tm1 s ALA 200 CO 0.14 -0.80 1.73 -2.14 0.00 0.00 0.00 175.76 174.69 1tm1 s PRO 201 N -3.98 4.12 0.00 0.00 0.02 -1.26 -1.50 135.00 132.41 1tm1 s PRO 201 Ca 0.19 2.61 0.00 0.00 0.02 0.00 0.00 61.00 63.82 1tm1 s PRO 201 Cb 0.00 -3.12 0.00 0.00 0.02 0.00 0.00 34.50 31.40 1tm1 s PRO 201 CO 0.05 -0.76 0.85 0.41 -0.33 0.00 0.00 177.00 177.21 1tm1 n GLY 202 N 4.00 0.10 3.19 0.52 0.00 -0.17 -3.24 105.19 109.59 1tm1 n GLY 202 Ca 0.16 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.86 1tm1 n GLY 202 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1tm1 s VAL 203 N 0.00 2.02 -1.22 1.61 1.01 -1.23 -1.00 120.40 121.59 1tm1 s VAL 203 Ca 0.00 -0.98 -0.11 0.00 0.00 0.00 0.00 61.98 60.89 1tm1 s VAL 203 Cb 0.00 -1.76 -0.01 0.00 0.00 0.00 0.00 36.38 34.61 1tm1 s VAL 203 CO 0.00 0.55 0.72 -1.20 0.00 0.00 0.00 175.10 175.16 1tm1 n SER 204 N 3.73 -3.58 -4.53 3.32 7.64 -1.13 -4.83 113.62 114.23 1tm1 n SER 204 Ca -0.19 -0.94 -0.42 0.00 1.01 0.00 0.00 58.87 58.32 1tm1 n SER 204 Cb 0.52 -3.64 -0.08 0.00 -1.01 0.00 0.00 64.21 60.00 1tm1 n SER 204 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 1tm1 s ILE 205 N -3.59 5.02 0.08 0.44 -1.09 0.30 -4.79 121.20 117.56 1tm1 s ILE 205 Ca 0.28 0.10 -0.30 0.00 -2.23 0.00 0.00 60.65 58.50 1tm1 s ILE 205 Cb -0.09 -4.01 -0.06 0.00 -1.58 0.00 0.00 42.46 36.73 1tm1 s ILE 205 CO 0.84 -0.32 1.15 -1.10 -1.23 0.00 0.00 174.94 174.29 1tm1 s GLN 206 N 2.36 4.48 0.23 2.79 -1.52 -1.26 -1.30 119.66 125.45 1tm1 s GLN 206 Ca 0.17 1.71 -0.08 0.00 -1.95 0.00 0.00 55.36 55.22 1tm1 s GLN 206 Cb -0.16 -3.35 0.03 0.00 -0.22 0.00 0.00 33.01 29.31 1tm1 s GLN 206 CO 0.14 -0.17 0.44 0.45 -0.25 0.00 0.00 175.29 175.91 1tm1 n SER 207 N 3.62 -1.28 -4.77 5.90 2.88 -0.61 -4.85 113.62 114.50 1tm1 n SER 207 Ca 0.07 -1.99 -0.38 0.00 -1.33 0.00 0.00 58.87 55.25 1tm1 n SER 207 Cb 0.47 2.17 -0.04 0.00 -0.75 0.00 0.00 64.21 66.05 1tm1 n SER 207 CO 0.00 0.00 0.00 0.42 -1.23 0.00 0.00 175.04 174.23 1tm1 s THR 208 N -2.50 3.61 0.11 2.46 -4.23 -1.26 -1.35 115.64 112.49 1tm1 s THR 208 Ca 0.11 1.37 0.04 0.00 -1.18 0.00 0.00 61.69 62.03 1tm1 s THR 208 Cb -0.03 -3.77 -0.04 0.00 1.34 0.00 0.00 72.50 70.01 1tm1 s THR 208 CO 0.08 0.13 -0.11 -0.76 -0.54 0.00 0.00 174.62 173.43 1tm1 s LEU 209 N -2.23 2.44 0.67 4.79 1.43 0.29 -2.33 118.68 123.73 1tm1 s LEU 209 Ca 0.53 -0.86 -0.17 0.00 -1.03 0.00 0.00 54.13 52.60 1tm1 s LEU 209 Cb -0.26 -0.35 -0.00 0.00 0.03 0.00 0.00 46.19 45.61 1tm1 s LEU 209 CO 0.33 -0.26 1.24 -2.65 0.23 0.00 0.00 176.35 175.23 1tm1 n PRO 210 N 0.36 0.94 -2.92 1.29 -0.02 -1.26 -1.84 135.00 131.56 1tm1 n PRO 210 Ca -0.14 0.38 -0.09 0.00 -2.02 0.00 0.00 63.50 61.62 1tm1 n PRO 210 Cb 0.58 -2.47 0.03 0.00 -0.02 0.00 0.00 33.50 31.62 1tm1 n PRO 210 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1tm1 n GLY 211 N 0.92 0.36 3.61 -1.23 0.00 -1.26 -3.86 105.19 103.72 1tm1 n GLY 211 Ca 0.15 -0.31 -0.20 0.00 0.00 0.00 0.00 46.02 45.67 1tm1 n GLY 211 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1tm1 n ASN 212 N -0.33 -1.46 -4.65 1.61 5.15 -1.23 -5.00 115.26 109.36 1tm1 n ASN 212 Ca -0.00 -0.75 -0.30 0.00 -0.60 0.00 0.00 54.58 52.93 1tm1 n ASN 212 Cb 0.53 -4.43 -0.09 0.00 -0.53 0.00 0.00 39.78 35.25 1tm1 n ASN 212 CO 0.00 0.00 0.00 -0.54 1.40 0.00 0.00 177.26 178.12 1tm1 s LYS 213 N -5.76 2.07 0.04 1.20 -0.14 -0.77 -5.01 119.74 111.37 1tm1 s LYS 213 Ca 0.00 -2.27 -0.00 0.00 -1.36 0.00 0.00 55.97 52.34 1tm1 s LYS 213 Cb -0.00 -1.45 -0.03 0.00 -1.68 0.00 0.00 37.83 34.67 1tm1 s LYS 213 CO 0.78 -0.26 -0.03 0.71 -0.76 0.00 0.00 175.35 175.79 1tm1 s TYR 214 N -2.87 0.40 -0.05 3.18 2.02 -1.26 -0.55 117.35 118.21 1tm1 s TYR 214 Ca 0.18 -0.78 -0.31 0.00 -0.37 0.00 0.00 57.07 55.79 1tm1 s TYR 214 Cb 0.05 -0.29 0.11 0.00 -0.40 0.00 0.00 41.96 41.43 1tm1 s TYR 214 CO 0.09 -0.27 1.02 0.20 -1.57 0.00 0.00 175.55 175.02 1tm1 s GLY 215 N -2.16 -0.39 -0.29 0.71 0.00 -0.45 -4.85 107.32 99.89 1tm1 s GLY 215 Ca -0.05 1.12 -0.18 0.00 0.00 0.00 0.00 44.72 45.61 1tm1 s GLY 215 CO -0.05 0.36 0.51 0.00 0.00 0.00 0.00 173.10 173.92 1tm1 s ALA 216 N -2.87 3.55 0.30 3.20 0.00 -1.26 -1.57 121.76 123.12 1tm1 s ALA 216 Ca 0.07 -0.73 0.10 0.00 0.00 0.00 0.00 51.96 51.40 1tm1 s ALA 216 Cb -0.01 -2.93 -0.05 0.00 0.00 0.00 0.00 23.12 20.14 1tm1 s ALA 216 CO -0.06 -0.89 -0.01 0.71 0.00 0.00 0.00 175.76 175.50 1tm1 s TYR 217 N 2.34 2.59 0.06 0.00 1.51 -0.42 -4.75 117.35 118.69 1tm1 s TYR 217 Ca 0.20 -0.32 0.07 0.00 -1.01 0.00 0.00 57.07 56.01 1tm1 s TYR 217 Cb -0.15 -1.30 -0.03 0.00 -0.11 0.00 0.00 41.96 40.36 1tm1 s TYR 217 CO 0.11 0.56 -0.19 -0.80 -1.11 0.00 0.00 175.55 174.11 1tm1 s ASN 218 N -3.68 2.31 0.00 2.29 0.01 -1.26 -0.53 114.94 114.07 1tm1 s ASN 218 Ca 0.33 -0.57 0.00 0.00 -0.71 0.00 0.00 52.86 51.91 1tm1 s ASN 218 Cb -0.04 -0.16 0.00 0.00 0.41 0.00 0.00 41.25 41.46 1tm1 s ASN 218 CO 0.19 0.09 0.00 0.61 -1.51 0.00 0.00 177.10 176.49 1tm1 n GLY 219 N 1.60 3.87 0.30 0.66 0.00 -0.17 -4.78 105.19 106.67 1tm1 n GLY 219 Ca -0.18 -1.21 0.19 0.00 0.00 0.00 0.00 46.02 44.82 1tm1 n GLY 219 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 1tm1 h THR 220 N 1.17 0.10 -0.67 2.61 1.35 -1.84 -1.68 112.91 113.95 1tm1 h THR 220 Ca 0.00 -0.30 0.14 0.00 -0.55 0.00 0.00 66.41 65.71 1tm1 h THR 220 Cb 0.00 1.26 -0.04 0.00 -1.73 0.00 0.00 68.15 67.64 1tm1 h THR 220 CO 0.00 0.02 0.45 0.28 -0.25 0.00 0.00 175.52 176.02 1tm1 h SER 221 N 0.00 0.28 0.91 5.36 0.02 -1.87 -1.71 113.55 116.53 1tm1 h SER 221 Ca -0.00 0.01 -0.22 0.00 -0.84 0.00 0.00 61.79 60.74 1tm1 h SER 221 Cb 0.26 -0.04 -0.03 0.00 0.14 0.00 0.00 62.40 62.73 1tm1 h SER 221 CO 0.00 0.15 -1.14 0.24 -1.14 0.00 0.00 176.83 174.94 1tm1 h MET 222 N 0.30 0.00 -0.06 3.45 2.07 -1.61 -3.35 114.93 115.73 1tm1 h MET 222 Ca 0.32 0.00 -0.10 0.00 -2.07 0.00 0.00 59.70 57.85 1tm1 h MET 222 Cb 0.84 0.00 0.01 0.00 -1.87 0.00 0.00 31.60 30.58 1tm1 h MET 222 CO -0.08 0.85 -0.37 0.00 1.07 0.00 0.00 176.91 178.39 1tm1 h ALA 223 N 1.03 0.12 -0.55 6.32 0.00 -1.29 -3.35 119.26 121.54 1tm1 h ALA 223 Ca -0.07 -0.47 0.11 0.00 0.00 0.00 0.00 54.91 54.48 1tm1 h ALA 223 Cb 1.80 0.00 -0.11 0.00 0.00 0.00 0.00 17.79 19.49 1tm1 h ALA 223 CO 0.11 0.22 -0.15 1.03 0.00 0.00 0.00 179.25 180.46 1tm1 h SER 224 N -0.16 -0.56 0.75 0.00 0.87 -1.46 -1.64 113.55 111.35 1tm1 h SER 224 Ca -0.03 0.17 0.00 0.00 -1.23 0.00 0.00 61.79 60.70 1tm1 h SER 224 Cb 1.03 0.36 0.00 0.00 -0.44 0.00 0.00 62.40 63.35 1tm1 h SER 224 CO 0.07 -0.20 0.00 1.55 -0.53 0.00 0.00 176.83 177.73 1tm1 h PRO 225 N -0.02 0.00 -0.70 2.24 0.13 -1.72 -0.11 132.00 131.82 1tm1 h PRO 225 Ca 0.26 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 65.34 1tm1 h PRO 225 Cb 0.42 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 31.52 1tm1 h PRO 225 CO -0.57 0.00 0.24 0.45 -0.23 0.00 0.00 178.00 177.88 1tm1 h HIS 226 N 0.00 1.11 -0.05 1.56 3.86 -1.43 0.94 115.15 121.13 1tm1 h HIS 226 Ca 0.00 -0.10 -0.25 0.00 -1.16 0.00 0.00 60.37 58.85 1tm1 h HIS 226 Cb 0.38 -0.32 0.02 0.00 1.06 0.00 0.00 27.41 28.54 1tm1 h HIS 226 CO 0.00 0.88 -0.95 0.28 0.86 0.00 0.00 177.93 179.00 1tm1 h VAL 227 N 1.02 1.28 -0.31 2.45 2.07 -1.13 -0.06 116.25 121.57 1tm1 h VAL 227 Ca 0.23 -2.16 -0.02 0.00 0.82 0.00 0.00 66.70 65.57 1tm1 h VAL 227 Cb 0.28 2.24 -0.01 0.00 -1.52 0.00 0.00 31.29 32.27 1tm1 h VAL 227 CO -0.01 0.67 0.12 0.00 0.02 0.00 0.00 177.57 178.37 1tm1 h ALA 228 N 0.47 0.41 -0.80 1.67 0.00 -1.02 -0.18 119.26 119.80 1tm1 h ALA 228 Ca -0.10 -0.13 0.03 0.00 0.00 0.00 0.00 54.91 54.71 1tm1 h ALA 228 Cb 1.59 -0.12 -0.04 0.00 0.00 0.00 0.00 17.79 19.22 1tm1 h ALA 228 CO 0.19 0.01 0.53 0.78 0.00 0.00 0.00 179.25 180.75 1tm1 h GLY 229 N 0.36 1.12 1.38 0.00 0.00 -0.82 -2.05 103.07 103.06 1tm1 h GLY 229 Ca 0.10 -0.40 -0.10 0.00 0.00 0.00 0.00 47.33 46.94 1tm1 h GLY 229 CO -0.01 0.36 -0.16 0.00 0.00 0.00 0.00 176.54 176.73 1tm1 h ALA 230 N 1.53 0.99 -0.79 3.60 0.00 -0.45 -0.56 119.26 123.57 1tm1 h ALA 230 Ca 0.31 -0.33 -0.02 0.00 0.00 0.00 0.00 54.91 54.87 1tm1 h ALA 230 Cb -0.01 -0.16 -0.04 0.00 0.00 0.00 0.00 17.79 17.59 1tm1 h ALA 230 CO -0.08 0.60 0.43 0.00 0.00 0.00 0.00 179.25 180.20 1tm1 h ALA 231 N 1.18 1.01 -0.57 0.00 0.00 -0.69 -0.69 119.26 119.50 1tm1 h ALA 231 Ca 0.10 -0.12 -0.05 0.00 0.00 0.00 0.00 54.91 54.84 1tm1 h ALA 231 Cb 0.63 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 18.08 1tm1 h ALA 231 CO 0.04 0.53 0.16 0.00 0.00 0.00 0.00 179.25 179.98 1tm1 h ALA 232 N 1.23 0.76 -0.28 0.00 0.00 -0.71 -1.20 119.26 119.05 1tm1 h ALA 232 Ca 0.28 -0.21 0.04 0.00 0.00 0.00 0.00 54.91 55.02 1tm1 h ALA 232 Cb 0.04 -0.22 -0.04 0.00 0.00 0.00 0.00 17.79 17.57 1tm1 h ALA 232 CO -0.04 0.44 0.02 -0.07 0.00 0.00 0.00 179.25 179.60 1tm1 h LEU 233 N 0.82 -0.06 -0.39 0.00 3.38 -0.73 -0.38 115.31 117.96 1tm1 h LEU 233 Ca 0.18 0.05 0.04 0.00 0.09 0.00 0.00 57.88 58.25 1tm1 h LEU 233 Cb 0.32 0.09 -0.04 0.00 0.09 0.00 0.00 40.66 41.12 1tm1 h LEU 233 CO -0.00 0.01 0.15 0.40 0.09 0.00 0.00 178.44 179.08 1tm1 h ILE 234 N 0.12 0.90 -0.11 1.22 2.04 -1.01 -1.87 117.51 118.80 1tm1 h ILE 234 Ca 0.13 -0.11 -0.08 0.00 1.00 0.00 0.00 64.86 65.80 1tm1 h ILE 234 Cb 0.16 0.56 -0.01 0.00 -0.74 0.00 0.00 36.82 36.78 1tm1 h ILE 234 CO -0.20 0.06 -0.31 -0.07 0.00 0.00 0.00 178.15 177.62 1tm1 h LEU 235 N 0.32 0.21 -1.12 1.44 3.38 -1.07 0.27 115.31 118.73 1tm1 h LEU 235 Ca 0.18 -0.07 -0.09 0.00 0.09 0.00 0.00 57.88 57.99 1tm1 h LEU 235 Cb 0.14 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 40.83 1tm1 h LEU 235 CO -0.17 0.52 -0.41 0.77 0.09 0.00 0.00 178.44 179.24 1tm1 h SER 236 N 0.18 0.00 0.73 -0.43 4.64 -0.44 -1.35 113.55 116.87 1tm1 h SER 236 Ca 0.02 0.00 -0.25 0.00 -0.47 0.00 0.00 61.79 61.09 1tm1 h SER 236 Cb 0.65 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.71 1tm1 h SER 236 CO 0.05 0.41 -1.35 0.50 -0.87 0.00 0.00 176.83 175.57 1tm1 h LYS 237 N 0.00 0.03 -2.23 4.77 3.64 -0.75 -3.41 116.57 118.63 1tm1 h LYS 237 Ca -0.00 -0.05 -0.59 0.00 -1.27 0.00 0.00 60.65 58.74 1tm1 h LYS 237 Cb 0.79 0.02 -0.40 0.00 -0.41 0.00 0.00 32.23 32.22 1tm1 h LYS 237 CO 0.05 0.80 -0.82 0.72 -2.27 0.00 0.00 179.45 177.93 1tm1 n HIS 238 N -3.23 1.67 0.29 1.91 8.25 0.88 -4.98 115.22 120.01 1tm1 n HIS 238 Ca -0.09 -3.87 0.12 0.00 -0.26 0.00 0.00 57.72 53.63 1tm1 n HIS 238 Cb 1.00 -0.41 0.58 0.00 1.12 0.00 0.00 29.99 32.28 1tm1 n HIS 238 CO 0.00 0.00 0.00 -1.35 0.64 0.00 0.00 176.34 175.63 1tm1 h PRO 239 N 4.37 0.00 -0.38 -0.41 0.11 -1.49 -1.57 132.00 132.64 1tm1 h PRO 239 Ca 0.15 0.00 -0.10 0.00 0.11 0.00 0.00 66.00 66.17 1tm1 h PRO 239 Cb 0.78 0.00 -0.06 0.00 0.11 0.00 0.00 31.00 31.83 1tm1 h PRO 239 CO 0.64 0.00 0.04 0.27 -0.21 0.00 0.00 178.00 178.74 1tm1 n ASN 240 N -2.34 3.65 -4.74 -2.05 6.94 -1.26 -4.92 115.26 110.53 1tm1 n ASN 240 Ca 0.00 -3.27 -0.40 0.00 -0.02 0.00 0.00 54.58 50.89 1tm1 n ASN 240 Cb 0.14 -0.61 -0.05 0.00 -2.36 0.00 0.00 39.78 36.90 1tm1 n ASN 240 CO 0.00 0.00 0.00 0.26 -1.03 0.00 0.00 177.26 176.49 1tm1 s TRP 241 N -2.98 3.92 0.76 -2.53 0.52 -0.59 -5.05 118.94 112.99 1tm1 s TRP 241 Ca 0.45 1.86 -0.12 0.00 0.02 0.00 0.00 56.10 58.31 1tm1 s TRP 241 Cb 0.38 -2.99 0.05 0.00 -1.15 0.00 0.00 33.47 29.76 1tm1 s TRP 241 CO 0.07 0.38 1.12 0.95 0.02 0.00 0.00 176.95 179.49 1tm1 s THR 242 N -0.77 2.96 0.28 2.01 -4.23 -1.26 -4.84 115.64 109.79 1tm1 s THR 242 Ca 0.43 0.31 0.01 0.00 -1.18 0.00 0.00 61.69 61.26 1tm1 s THR 242 Cb -0.25 -3.24 0.28 0.00 1.34 0.00 0.00 72.50 70.63 1tm1 s THR 242 CO 0.31 -0.41 1.84 -0.55 -0.54 0.00 0.00 174.62 175.27 1tm1 h ASN 243 N -0.89 0.94 -0.64 3.99 -1.07 -1.91 0.65 115.58 116.65 1tm1 h ASN 243 Ca -0.46 0.04 0.09 0.00 0.07 0.00 0.00 56.30 56.05 1tm1 h ASN 243 Cb 1.28 -0.15 -0.07 0.00 -2.07 0.00 0.00 38.32 37.31 1tm1 h ASN 243 CO 0.63 0.51 0.27 0.74 0.07 0.00 0.00 177.43 179.65 1tm1 h THR 244 N 1.02 0.79 -0.27 6.14 2.02 -1.93 0.31 112.91 120.99 1tm1 h THR 244 Ca 0.49 -0.16 -0.19 0.00 0.77 0.00 0.00 66.41 67.32 1tm1 h THR 244 Cb 0.46 0.28 0.00 0.00 -1.74 0.00 0.00 68.15 67.15 1tm1 h THR 244 CO -0.26 0.09 -0.58 -0.61 0.37 0.00 0.00 175.52 174.53 1tm1 h GLN 245 N 0.47 0.86 -0.46 6.66 5.75 -1.62 -0.63 115.11 126.14 1tm1 h GLN 245 Ca 0.32 -0.56 -0.03 0.00 -0.15 0.00 0.00 58.65 58.23 1tm1 h GLN 245 Cb 0.38 0.07 -0.02 0.00 1.07 0.00 0.00 27.48 28.98 1tm1 h GLN 245 CO -0.29 1.19 0.17 0.28 -2.65 0.00 0.00 178.83 177.52 1tm1 h VAL 246 N 0.65 1.21 -0.00 2.39 2.07 -0.40 0.11 116.25 122.28 1tm1 h VAL 246 Ca 0.01 -0.69 -0.00 0.00 0.82 0.00 0.00 66.70 66.84 1tm1 h VAL 246 Cb 1.19 0.80 -0.00 0.00 -1.52 0.00 0.00 31.29 31.76 1tm1 h VAL 246 CO 0.13 0.25 0.00 -0.09 0.02 0.00 0.00 177.57 177.88 1tm1 h ARG 247 N 0.60 0.00 -0.80 1.57 2.43 -0.89 -1.73 114.38 115.56 1tm1 h ARG 247 Ca 0.15 -0.00 0.01 0.00 -0.81 0.00 0.00 59.98 59.33 1tm1 h ARG 247 Cb 0.23 -0.00 -0.04 0.00 -0.42 0.00 0.00 29.97 29.74 1tm1 h ARG 247 CO -0.01 0.07 0.52 0.66 -1.51 0.00 0.00 179.97 179.70 1tm1 h SER 248 N -0.06 0.92 -0.53 -3.80 4.64 -0.99 -1.21 113.55 112.52 1tm1 h SER 248 Ca 0.00 -0.03 -0.03 0.00 -0.47 0.00 0.00 61.79 61.27 1tm1 h SER 248 Cb 0.06 -0.23 -0.03 0.00 -0.31 0.00 0.00 62.40 61.90 1tm1 h SER 248 CO -0.00 0.67 0.24 0.77 -0.87 0.00 0.00 176.83 177.64 1tm1 h SER 249 N 1.08 0.74 -0.09 4.97 4.64 -0.20 0.13 113.55 124.83 1tm1 h SER 249 Ca 0.29 -0.09 -0.22 0.00 -0.47 0.00 0.00 61.79 61.30 1tm1 h SER 249 Cb -0.12 -0.19 0.01 0.00 -0.31 0.00 0.00 62.40 61.79 1tm1 h SER 249 CO -0.06 0.66 -0.81 -0.07 -0.87 0.00 0.00 176.83 175.68 1tm1 h LEU 250 N 0.81 0.87 -0.74 5.97 3.38 -0.82 -3.10 115.31 121.68 1tm1 h LEU 250 Ca 0.20 -0.67 -0.11 0.00 0.09 0.00 0.00 57.88 57.38 1tm1 h LEU 250 Cb 0.14 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.62 1tm1 h LEU 250 CO -0.02 1.41 -0.26 -0.33 0.09 0.00 0.00 178.44 179.33 1tm1 h GLU 251 N 0.40 0.68 -0.00 1.13 5.08 -0.91 -3.18 114.58 117.77 1tm1 h GLU 251 Ca -0.08 -0.28 0.00 0.00 -1.00 0.00 0.00 59.36 58.00 1tm1 h GLU 251 Cb 1.46 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 30.68 1tm1 h GLU 251 CO 0.16 0.87 -0.13 0.09 -1.00 0.00 0.00 179.01 179.00 1tm1 n ASN 252 N -4.10 0.45 -0.02 1.42 5.03 0.00 -3.77 115.26 114.28 1tm1 n ASN 252 Ca -0.00 -0.47 0.01 0.00 0.87 0.00 0.00 54.58 54.98 1tm1 n ASN 252 Cb 0.44 -0.08 0.01 0.00 -1.02 0.00 0.00 39.78 39.13 1tm1 n ASN 252 CO 0.00 0.00 0.00 0.35 -1.83 0.00 0.00 177.26 175.78 1tm1 n THR 253 N -1.03 0.75 -1.06 3.41 -2.24 -1.17 -2.94 114.28 110.00 1tm1 n THR 253 Ca 0.13 -0.78 -0.34 0.00 -2.27 0.00 0.00 64.05 60.80 1tm1 n THR 253 Cb 0.29 0.59 0.12 0.00 -2.10 0.00 0.00 70.33 69.24 1tm1 n THR 253 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1tm1 n THR 254 N -0.40 1.66 -2.84 4.28 -2.24 -1.21 -4.25 114.28 109.27 1tm1 n THR 254 Ca 0.01 -0.21 -0.42 0.00 -2.27 0.00 0.00 64.05 61.16 1tm1 n THR 254 Cb 0.35 -1.08 -0.04 0.00 -2.10 0.00 0.00 70.33 67.46 1tm1 n THR 254 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 1tm1 s THR 255 N -2.17 4.64 0.34 4.28 2.01 0.20 -3.03 115.64 121.92 1tm1 s THR 255 Ca 0.71 1.17 -0.28 0.00 0.31 0.00 0.00 61.69 63.60 1tm1 s THR 255 Cb -0.29 -4.29 -0.09 0.00 0.01 0.00 0.00 72.50 67.84 1tm1 s THR 255 CO 0.54 -0.47 1.22 -0.54 -0.69 0.00 0.00 174.62 174.67 1tm1 s LYS 256 N 3.34 4.31 0.00 4.92 -0.14 -1.26 -1.18 119.74 129.73 1tm1 s LYS 256 Ca 0.36 2.00 0.00 0.00 -1.36 0.00 0.00 55.97 56.98 1tm1 s LYS 256 Cb -0.12 -2.96 0.00 0.00 -1.68 0.00 0.00 37.83 33.07 1tm1 s LYS 256 CO 0.17 -0.15 0.00 1.28 -0.76 0.00 0.00 175.35 175.89 1tm1 n LEU 257 N 0.63 0.00 0.00 3.17 4.77 -1.26 -4.90 117.00 119.41 1tm1 n LEU 257 Ca 0.01 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.99 1tm1 n LEU 257 Cb 0.44 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.53 1tm1 n LEU 257 CO 0.55 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 177.22 1tm1 n GLY 258 N 5.00 0.42 3.64 -0.72 0.00 -1.26 -5.00 105.19 107.26 1tm1 n GLY 258 Ca 0.00 -1.63 -0.45 0.00 0.00 0.00 0.00 46.02 43.94 1tm1 n GLY 258 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1tm1 n ASP 259 N 0.00 2.10 0.30 1.61 2.03 -1.26 -4.69 116.55 116.64 1tm1 n ASP 259 Ca 0.00 1.17 0.19 0.00 0.52 0.00 0.00 54.79 56.67 1tm1 n ASP 259 Cb 0.00 -1.37 0.94 0.00 -0.72 0.00 0.00 41.12 39.97 1tm1 n ASP 259 CO 0.00 0.00 0.00 0.77 -1.92 0.00 0.00 177.20 176.05 1tm1 h SER 260 N 2.96 0.00 -0.35 1.67 4.64 -1.92 0.13 113.55 120.69 1tm1 h SER 260 Ca -0.43 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 60.88 1tm1 h SER 260 Cb 1.31 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.38 1tm1 h SER 260 CO 0.67 0.03 0.20 0.15 -0.87 0.00 0.00 176.83 177.00 1tm1 h PHE 261 N 0.00 0.50 0.00 4.77 3.57 -1.87 0.05 116.94 123.97 1tm1 h PHE 261 Ca -0.00 -0.00 -0.21 0.00 3.53 0.00 0.00 57.97 61.28 1tm1 h PHE 261 Cb 0.23 -0.16 -0.04 0.00 2.79 0.00 0.00 35.95 38.77 1tm1 h PHE 261 CO 0.00 0.36 -2.11 0.66 -2.23 0.00 0.00 178.31 174.99 1tm1 n TYR 262 N -4.43 0.00 -0.15 0.41 4.01 -0.28 -1.23 117.16 115.49 1tm1 n TYR 262 Ca 0.03 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.77 1tm1 n TYR 262 Cb 0.10 -0.73 0.00 0.00 -0.31 0.00 0.00 39.34 38.40 1tm1 n TYR 262 CO 0.00 0.00 0.00 0.66 -0.46 0.00 0.00 176.86 177.06 1tm1 n TYR 263 N -2.49 0.00 -2.34 -0.72 4.01 -0.12 -4.93 117.16 110.57 1tm1 n TYR 263 Ca -0.20 -0.07 0.00 0.00 -0.16 0.00 0.00 57.90 57.47 1tm1 n TYR 263 Cb 0.88 -0.01 0.00 0.00 -0.31 0.00 0.00 39.34 39.90 1tm1 n TYR 263 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1tm1 n GLY 264 N -0.07 2.12 0.00 2.72 0.00 0.00 -1.36 105.19 108.60 1tm1 n GLY 264 Ca 0.00 -0.31 0.12 0.00 0.00 0.00 0.00 46.02 45.82 1tm1 n GLY 264 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1tm1 n LYS 265 N 14.00 0.30 0.00 1.61 5.02 0.39 -4.10 118.16 135.39 1tm1 n LYS 265 Ca 0.00 0.06 0.00 0.00 -2.02 0.00 0.00 58.31 56.35 1tm1 n LYS 265 Cb 0.00 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 33.51 1tm1 n LYS 265 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1tm1 n GLY 266 N 0.78 -0.51 3.71 0.72 0.00 -0.46 -3.98 105.19 105.44 1tm1 n GLY 266 Ca 0.11 -2.19 -0.42 0.00 0.00 0.00 0.00 46.02 43.52 1tm1 n GLY 266 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1tm1 s LEU 267 N 0.00 4.36 0.65 0.99 2.96 -0.33 -0.36 118.68 126.96 1tm1 s LEU 267 Ca 0.00 1.60 -0.17 0.00 -0.22 0.00 0.00 54.13 55.34 1tm1 s LEU 267 Cb 0.00 -3.51 -0.01 0.00 0.50 0.00 0.00 46.19 43.18 1tm1 s LEU 267 CO 0.00 -0.24 1.23 0.27 -1.32 0.00 0.00 176.35 176.28 1tm1 s ILE 268 N 0.98 2.41 -0.31 6.68 -4.36 -0.88 -0.63 121.20 125.09 1tm1 s ILE 268 Ca 0.50 0.24 -0.02 0.00 -0.26 0.00 0.00 60.65 61.10 1tm1 s ILE 268 Cb -0.21 -2.99 0.11 0.00 1.25 0.00 0.00 42.46 40.63 1tm1 s ILE 268 CO 0.27 -0.07 0.14 0.21 0.24 0.00 0.00 174.94 175.73 1tm1 s ASN 269 N -1.71 3.51 0.35 4.36 3.84 -1.26 -4.56 114.94 119.46 1tm1 s ASN 269 Ca 0.77 -1.57 0.18 0.00 0.21 0.00 0.00 52.86 52.45 1tm1 s ASN 269 Cb -0.31 -0.47 0.52 0.00 -0.55 0.00 0.00 41.25 40.44 1tm1 s ASN 269 CO 0.39 -0.40 1.65 1.62 -2.79 0.00 0.00 177.10 177.57 1tm1 h VAL 270 N 6.10 0.90 0.13 -5.21 3.04 -1.27 -1.14 116.25 118.80 1tm1 h VAL 270 Ca -0.13 -1.73 0.01 0.00 -1.01 0.00 0.00 66.70 63.84 1tm1 h VAL 270 Cb 1.00 2.07 -0.03 0.00 -2.01 0.00 0.00 31.29 32.32 1tm1 h VAL 270 CO 0.41 0.41 -0.23 -0.61 -1.01 0.00 0.00 177.57 176.54 1tm1 h GLN 271 N 0.00 -0.42 -0.54 4.17 4.15 -1.73 -1.15 115.11 119.60 1tm1 h GLN 271 Ca -0.00 0.03 -0.09 0.00 0.77 0.00 0.00 58.65 59.36 1tm1 h GLN 271 Cb 1.03 0.10 -0.02 0.00 0.21 0.00 0.00 27.48 28.80 1tm1 h GLN 271 CO 0.05 -0.28 -0.01 0.00 -1.93 0.00 0.00 178.83 176.67 1tm1 h ALA 272 N 0.33 0.97 -0.33 3.38 0.00 -1.86 -2.92 119.26 118.83 1tm1 h ALA 272 Ca 0.02 -0.29 -0.01 0.00 0.00 0.00 0.00 54.91 54.63 1tm1 h ALA 272 Cb 0.45 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.02 1tm1 h ALA 272 CO -0.12 0.62 0.17 0.00 0.00 0.00 0.00 179.25 179.92 1tm1 h ALA 273 N 1.14 1.67 -0.30 0.00 0.00 -0.97 -2.63 119.26 118.17 1tm1 h ALA 273 Ca 0.16 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.00 1tm1 h ALA 273 Cb 0.51 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.16 1tm1 h ALA 273 CO 0.03 0.28 0.00 0.00 0.00 0.00 0.00 179.25 179.55 1tm1 n ALA 274 N -2.48 2.47 -1.92 0.00 0.00 -0.46 -4.81 120.51 113.31 1tm1 n ALA 274 Ca 0.02 -0.67 -0.29 0.00 0.00 0.00 0.00 53.44 52.49 1tm1 n ALA 274 Cb 0.11 -1.01 0.05 0.00 0.00 0.00 0.00 19.45 18.59 1tm1 n ALA 274 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 1tm1 s GLN 275 N -1.61 2.82 0.10 0.00 -1.52 -0.99 -5.00 119.66 113.46 1tm1 s GLN 275 Ca 0.32 0.35 -0.21 0.00 -1.95 0.00 0.00 55.36 53.87 1tm1 s GLN 275 Cb 0.17 -2.06 -0.10 0.00 -0.22 0.00 0.00 33.01 30.80 1tm1 s GLN 275 CO 0.24 -1.00 1.69 0.45 -0.25 0.00 0.00 175.29 176.42 1tm1 h HIS 276 N -0.59 0.21 -3.31 0.91 3.86 -1.88 -3.44 115.15 110.91 1tm1 h HIS 276 Ca -0.45 -0.01 -0.64 0.00 -1.16 0.00 0.00 60.37 58.11 1tm1 h HIS 276 Cb 1.26 -0.07 -0.19 0.00 1.06 0.00 0.00 27.41 29.47 1tm1 h HIS 276 CO 0.49 0.21 -0.63 -1.01 0.86 0.00 0.00 177.93 177.85 1tm1 s HIS 277 N -5.84 3.10 -0.10 2.45 3.76 -1.26 -5.11 115.29 112.28 1tm1 s HIS 277 Ca -0.13 -0.12 0.00 0.00 -0.15 0.00 0.00 55.06 54.66 1tm1 s HIS 277 Cb 0.07 -1.95 -0.02 0.00 1.11 0.00 0.00 32.58 31.78 1tm1 s HIS 277 CO 0.69 0.10 -0.11 -1.01 -0.85 0.00 0.00 174.74 173.56 1tm1 s HIS 278 N 0.14 2.84 0.17 1.40 0.09 -1.26 -4.98 115.29 113.69 1tm1 s HIS 278 Ca 0.01 -0.36 -0.16 0.00 -0.00 0.00 0.00 55.06 54.56 1tm1 s HIS 278 Cb -0.13 -1.79 0.02 0.00 -0.00 0.00 0.00 32.58 30.68 1tm1 s HIS 278 CO 0.02 0.01 0.45 -3.38 -0.00 0.00 0.00 174.74 171.84 1tm1 s HIS 279 N -0.11 -0.04 0.39 1.40 -3.43 -1.24 -4.96 115.29 107.30 1tm1 s HIS 279 Ca -0.01 -0.30 -0.25 0.00 -0.80 0.00 0.00 55.06 53.71 1tm1 s HIS 279 Cb -0.14 0.28 -0.09 0.00 -1.43 0.00 0.00 32.58 31.20 1tm1 s HIS 279 CO 0.03 -0.83 1.07 -1.01 -2.00 0.00 0.00 174.74 172.00 1tm1 s HIS 280 N -3.87 3.28 -1.51 0.38 3.76 -1.15 -4.35 115.29 111.83 1tm1 s HIS 280 Ca 0.09 1.64 0.12 0.00 -0.15 0.00 0.00 55.06 56.76 1tm1 s HIS 280 Cb 0.00 -3.17 0.10 0.00 1.11 0.00 0.00 32.58 30.62 1tm1 s HIS 280 CO -0.04 -0.69 0.88 0.72 -0.85 0.00 0.00 174.74 174.76