#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2e9x s ASP 2 N 0.00 6.33 0.39 6.12 -0.00 -1.26 -4.99 116.67 123.26 2e9x s ASP 2 Ca 0.00 0.47 0.08 0.00 -0.00 0.00 0.00 52.55 53.10 2e9x s ASP 2 Cb 0.00 -2.04 0.79 0.00 -0.00 0.00 0.00 42.92 41.67 2e9x s ASP 2 CO 0.00 -0.24 1.97 0.00 -0.00 0.00 0.00 175.17 176.90 2e9x h ALA 3 N 1.09 1.57 -0.91 5.23 0.00 -1.98 -1.18 119.26 123.07 2e9x h ALA 3 Ca -0.49 -0.13 0.02 0.00 0.00 0.00 0.00 54.91 54.30 2e9x h ALA 3 Cb 1.21 -0.12 -0.05 0.00 0.00 0.00 0.00 17.79 18.83 2e9x h ALA 3 CO 0.63 0.33 0.60 0.00 0.00 0.00 0.00 179.25 180.81 2e9x h ALA 4 N 1.66 1.17 -0.26 0.00 0.00 -1.98 0.57 119.26 120.41 2e9x h ALA 4 Ca 0.10 -0.06 -0.10 0.00 0.00 0.00 0.00 54.91 54.85 2e9x h ALA 4 Cb 0.19 -0.36 -0.01 0.00 0.00 0.00 0.00 17.79 17.61 2e9x h ALA 4 CO -0.00 0.53 -0.27 0.93 0.00 0.00 0.00 179.25 180.44 2e9x h GLU 5 N 1.21 0.50 -0.50 0.00 5.08 -1.63 0.43 114.58 119.68 2e9x h GLU 5 Ca 0.34 -0.20 -0.10 0.00 -1.00 0.00 0.00 59.36 58.40 2e9x h GLU 5 Cb -0.11 -0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.10 2e9x h GLU 5 CO -0.08 0.73 -0.08 0.28 -1.00 0.00 0.00 179.01 178.85 2e9x h VAL 6 N 0.44 1.27 -0.18 3.13 2.07 -0.68 -2.19 116.25 120.11 2e9x h VAL 6 Ca 0.06 -1.21 -0.05 0.00 0.82 0.00 0.00 66.70 66.32 2e9x h VAL 6 Cb 0.70 1.03 -0.01 0.00 -1.52 0.00 0.00 31.29 31.50 2e9x h VAL 6 CO 0.05 0.42 -0.10 -0.08 0.02 0.00 0.00 177.57 177.88 2e9x h GLU 7 N 0.79 0.28 -0.83 1.57 4.81 -0.41 -0.85 114.58 119.95 2e9x h GLU 7 Ca 0.13 -0.06 -0.00 0.00 -0.13 0.00 0.00 59.36 59.30 2e9x h GLU 7 Cb 0.63 -0.04 -0.04 0.00 0.63 0.00 0.00 28.75 29.93 2e9x h GLU 7 CO 0.04 0.40 0.51 0.35 -0.73 0.00 0.00 179.01 179.58 2e9x h PHE 8 N 0.27 1.08 -0.37 0.92 3.57 -0.31 0.53 116.94 122.63 2e9x h PHE 8 Ca 0.06 0.00 -0.12 0.00 3.53 0.00 0.00 57.97 61.44 2e9x h PHE 8 Cb 0.36 -0.36 -0.01 0.00 2.79 0.00 0.00 35.95 38.73 2e9x h PHE 8 CO 0.01 0.72 -0.23 -0.07 -2.23 0.00 0.00 178.31 176.51 2e9x h LEU 9 N 1.14 0.85 -1.55 0.59 3.38 -0.94 -2.84 115.31 115.94 2e9x h LEU 9 Ca 0.30 -0.42 0.06 0.00 0.09 0.00 0.00 57.88 57.91 2e9x h LEU 9 Cb -0.06 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 40.42 2e9x h LEU 9 CO -0.06 1.09 0.39 0.00 0.09 0.00 0.00 178.44 179.95 2e9x h ALA 10 N 0.79 1.84 0.00 1.53 0.00 -0.50 -1.59 119.26 121.33 2e9x h ALA 10 Ca 0.08 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.97 2e9x h ALA 10 Cb 0.79 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.44 2e9x h ALA 10 CO 0.06 0.07 0.00 0.39 0.00 0.00 0.00 179.25 179.77 2e9x n GLU 11 N -4.48 0.03 0.13 0.00 1.02 0.12 -1.33 120.64 116.12 2e9x n GLU 11 Ca 0.08 0.35 0.06 0.00 -0.02 0.00 0.00 57.16 57.63 2e9x n GLU 11 Cb 0.24 -1.50 0.03 0.00 -0.02 0.00 0.00 31.44 30.19 2e9x n GLU 11 CO 0.00 0.00 0.00 0.87 1.18 0.00 0.00 177.13 179.18 2e9x h LYS 12 N 0.00 0.00 -6.65 3.49 1.57 -1.39 -2.12 116.57 111.47 2e9x h LYS 12 Ca 0.00 0.00 -0.58 0.00 -1.87 0.00 0.00 60.65 58.20 2e9x h LYS 12 Cb 0.07 0.00 0.11 0.00 0.08 0.00 0.00 32.23 32.49 2e9x h LYS 12 CO 0.00 0.23 0.35 0.39 -0.57 0.00 0.00 179.45 179.85 2e9x n GLU 13 N -3.00 1.79 -2.93 3.15 -0.58 -0.44 -4.45 120.64 114.17 2e9x n GLU 13 Ca -0.01 0.63 -0.36 0.00 -0.42 0.00 0.00 57.16 57.00 2e9x n GLU 13 Cb 0.67 -2.15 -0.06 0.00 -0.57 0.00 0.00 31.44 29.33 2e9x n GLU 13 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 2e9x s LEU 14 N -0.54 4.30 0.13 -4.62 1.43 -1.26 -0.41 118.68 117.71 2e9x s LEU 14 Ca 0.57 1.63 -0.01 0.00 -1.03 0.00 0.00 54.13 55.30 2e9x s LEU 14 Cb -0.61 -3.88 -0.04 0.00 0.03 0.00 0.00 46.19 41.70 2e9x s LEU 14 CO 0.61 -0.05 0.06 0.68 0.23 0.00 0.00 176.35 177.87 2e9x s VAL 15 N -1.63 0.10 -0.13 -1.59 -7.23 -0.65 -4.87 120.40 104.40 2e9x s VAL 15 Ca 0.48 -1.91 -0.04 0.00 -1.81 0.00 0.00 61.98 58.70 2e9x s VAL 15 Cb -0.17 -2.05 -0.03 0.00 0.56 0.00 0.00 36.38 34.69 2e9x s VAL 15 CO 0.22 -0.46 0.01 -0.89 -0.31 0.00 0.00 175.10 173.67 2e9x s THR 16 N -4.05 4.36 0.23 5.32 2.01 -1.26 -1.40 115.64 120.85 2e9x s THR 16 Ca 0.24 -0.21 0.08 0.00 0.31 0.00 0.00 61.69 62.12 2e9x s THR 16 Cb 0.07 -2.90 -0.05 0.00 0.01 0.00 0.00 72.50 69.64 2e9x s THR 16 CO 0.02 0.53 -0.13 0.27 -0.69 0.00 0.00 174.62 174.63 2e9x s ILE 17 N -0.19 1.81 -0.36 1.82 -4.36 -0.67 -1.60 121.20 117.64 2e9x s ILE 17 Ca 0.05 -2.21 0.04 0.00 -0.26 0.00 0.00 60.65 58.27 2e9x s ILE 17 Cb -0.12 -2.18 0.10 0.00 1.25 0.00 0.00 42.46 41.51 2e9x s ILE 17 CO 0.02 -0.49 0.08 -0.63 0.24 0.00 0.00 174.94 174.15 2e9x s ILE 18 N -2.93 2.21 0.81 8.37 1.01 0.24 -2.08 121.20 128.83 2e9x s ILE 18 Ca 0.25 -2.40 -0.11 0.00 0.00 0.00 0.00 60.65 58.39 2e9x s ILE 18 Cb -0.00 -2.63 0.08 0.00 0.01 0.00 0.00 42.46 39.92 2e9x s ILE 18 CO 0.09 -0.63 1.09 -2.16 0.00 0.00 0.00 174.94 173.33 2e9x s PRO 19 N 0.81 1.98 -0.16 2.79 0.04 -1.26 -0.55 135.00 138.65 2e9x s PRO 19 Ca 0.12 0.78 0.15 0.00 0.04 0.00 0.00 61.00 62.08 2e9x s PRO 19 Cb -0.20 -1.89 0.41 0.00 0.04 0.00 0.00 34.50 32.86 2e9x s PRO 19 CO -0.08 -1.73 1.20 0.27 0.04 0.00 0.00 177.00 176.70 2e9x n ASN 20 N -3.53 1.55 -4.00 6.66 0.23 -0.83 -1.59 115.26 113.75 2e9x n ASN 20 Ca 0.07 -3.43 -0.10 0.00 -0.53 0.00 0.00 54.58 50.60 2e9x n ASN 20 Cb 0.55 -0.47 -0.07 0.00 -2.08 0.00 0.00 39.78 37.71 2e9x n ASN 20 CO 0.00 0.00 0.00 0.72 -0.93 0.00 0.00 177.26 177.05 2e9x s PHE 21 N -2.46 0.50 0.08 -2.53 -0.12 -1.26 -4.89 117.98 107.31 2e9x s PHE 21 Ca 0.36 -0.84 0.06 0.00 -0.05 0.00 0.00 56.93 56.46 2e9x s PHE 21 Cb 0.37 -0.08 -0.04 0.00 -0.63 0.00 0.00 43.02 42.64 2e9x s PHE 21 CO -0.09 -0.77 -0.06 -1.12 -0.05 0.00 0.00 175.22 173.13 2e9x s SER 22 N -3.01 4.64 -0.29 1.98 0.01 -1.26 -3.19 113.70 112.59 2e9x s SER 22 Ca 0.21 -0.28 -0.24 0.00 1.31 0.00 0.00 55.95 56.96 2e9x s SER 22 Cb 0.03 -1.00 0.14 0.00 0.21 0.00 0.00 66.02 65.40 2e9x s SER 22 CO 0.04 0.19 1.09 -0.22 0.41 0.00 0.00 173.24 174.75 2e9x s LEU 23 N -2.12 -0.40 0.82 2.44 2.96 -0.70 -4.94 118.68 116.74 2e9x s LEU 23 Ca 0.22 0.74 -0.11 0.00 -0.22 0.00 0.00 54.13 54.76 2e9x s LEU 23 Cb -0.11 1.74 0.09 0.00 0.50 0.00 0.00 46.19 48.40 2e9x s LEU 23 CO 0.14 -0.13 1.09 -1.81 -1.32 0.00 0.00 176.35 174.33 2e9x s ASP 24 N 0.36 4.17 0.36 3.68 -0.00 -1.26 -0.19 116.67 123.79 2e9x s ASP 24 Ca 0.02 1.46 -0.26 0.00 -0.00 0.00 0.00 52.55 53.77 2e9x s ASP 24 Cb -0.05 -2.18 -0.12 0.00 -0.00 0.00 0.00 42.92 40.57 2e9x s ASP 24 CO -0.09 -2.19 1.10 0.29 -0.00 0.00 0.00 175.17 174.28 2e9x n LYS 25 N -3.59 1.59 -4.31 8.23 5.02 -1.26 -4.67 118.16 119.16 2e9x n LYS 25 Ca 0.07 0.56 -0.34 0.00 -2.02 0.00 0.00 58.31 56.58 2e9x n LYS 25 Cb 0.55 -2.08 -0.12 0.00 -0.02 0.00 0.00 35.03 33.35 2e9x n LYS 25 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 2e9x s ILE 26 N -1.17 3.84 -0.85 -0.18 1.01 -0.14 -4.96 121.20 118.75 2e9x s ILE 26 Ca 0.60 -0.37 -0.16 0.00 0.00 0.00 0.00 60.65 60.71 2e9x s ILE 26 Cb -0.59 -2.70 0.17 0.00 0.01 0.00 0.00 42.46 39.35 2e9x s ILE 26 CO 0.59 0.47 0.91 -0.31 0.00 0.00 0.00 174.94 176.61 2e9x s TYR 27 N 0.58 3.42 0.21 3.97 1.51 -1.26 -2.06 117.35 123.73 2e9x s TYR 27 Ca -0.03 -1.65 -0.15 0.00 -1.01 0.00 0.00 57.07 54.24 2e9x s TYR 27 Cb -0.14 -4.03 -0.08 0.00 -0.11 0.00 0.00 41.96 37.60 2e9x s TYR 27 CO 0.02 -1.23 0.62 -0.51 -1.11 0.00 0.00 175.55 173.35 2e9x s LEU 28 N 1.45 4.25 0.56 -1.29 1.43 -0.59 -4.95 118.68 119.55 2e9x s LEU 28 Ca 0.23 1.15 0.31 0.00 -1.03 0.00 0.00 54.13 54.80 2e9x s LEU 28 Cb -0.09 -3.57 1.45 0.00 0.03 0.00 0.00 46.19 44.01 2e9x s LEU 28 CO -0.08 -0.01 1.84 0.40 0.23 0.00 0.00 176.35 178.74 2e9x h ILE 29 N 2.47 0.42 -0.51 -0.59 2.04 -2.03 0.30 117.51 119.60 2e9x h ILE 29 Ca -0.48 0.00 -0.04 0.00 1.00 0.00 0.00 64.86 65.34 2e9x h ILE 29 Cb 1.18 0.52 -0.03 0.00 -0.74 0.00 0.00 36.82 37.76 2e9x h ILE 29 CO 0.66 0.00 0.05 0.61 0.00 0.00 0.00 178.15 179.48 2e9x n GLY 30 N -1.64 2.86 0.00 5.37 0.00 -1.26 -5.02 105.19 105.50 2e9x n GLY 30 Ca 0.16 -0.77 0.00 0.00 0.00 0.00 0.00 46.02 45.40 2e9x n GLY 30 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2e9x n GLY 31 N 0.38 2.33 3.88 -0.02 0.00 0.11 -5.08 105.19 106.79 2e9x n GLY 31 Ca 0.26 -2.11 -0.33 0.00 0.00 0.00 0.00 46.02 43.84 2e9x n GLY 31 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2e9x s ASP 32 N 0.00 6.56 0.01 1.61 -0.00 -1.26 -1.54 116.67 122.04 2e9x s ASP 32 Ca 0.00 0.70 0.00 0.00 -0.00 0.00 0.00 52.55 53.25 2e9x s ASP 32 Cb 0.00 -2.14 -0.01 0.00 -0.00 0.00 0.00 42.92 40.78 2e9x s ASP 32 CO 0.00 0.07 -0.02 -0.76 -0.00 0.00 0.00 175.17 174.46 2e9x s LEU 33 N -2.43 2.07 0.00 1.23 1.43 -0.87 -4.97 118.68 115.13 2e9x s LEU 33 Ca 0.39 -0.16 0.00 0.00 -1.03 0.00 0.00 54.13 53.33 2e9x s LEU 33 Cb -0.13 -0.03 0.00 0.00 0.03 0.00 0.00 46.19 46.06 2e9x s LEU 33 CO 0.22 -0.07 0.00 0.61 0.23 0.00 0.00 176.35 177.34 2e9x n GLY 34 N 2.64 -1.79 3.56 -3.19 0.00 -1.26 -0.97 105.19 104.18 2e9x n GLY 34 Ca -0.15 -1.81 -0.29 0.00 0.00 0.00 0.00 46.02 43.77 2e9x n GLY 34 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 2e9x s PRO 35 N 0.00 -0.36 -0.16 1.61 0.02 -1.26 -4.79 135.00 130.06 2e9x s PRO 35 Ca 0.00 0.77 -0.04 0.00 0.02 0.00 0.00 61.00 61.74 2e9x s PRO 35 Cb 0.00 -1.62 -0.03 0.00 0.02 0.00 0.00 34.50 32.86 2e9x s PRO 35 CO 0.00 -3.33 -0.01 -0.06 -0.33 0.00 0.00 177.00 173.27 2e9x s PHE 36 N -2.64 3.10 -0.05 6.54 0.40 0.74 -4.94 117.98 121.12 2e9x s PHE 36 Ca 0.67 -0.15 0.01 0.00 -0.60 0.00 0.00 56.93 56.86 2e9x s PHE 36 Cb -0.23 -1.97 0.02 0.00 0.51 0.00 0.00 43.02 41.35 2e9x s PHE 36 CO 0.62 0.06 -0.05 -0.80 0.70 0.00 0.00 175.22 175.75 2e9x s ASN 37 N 0.24 1.19 0.12 1.36 0.01 -1.25 -1.72 114.94 114.88 2e9x s ASN 37 Ca -0.01 -0.15 -0.34 0.00 -0.71 0.00 0.00 52.86 51.65 2e9x s ASN 37 Cb -0.13 -0.51 -0.17 0.00 0.41 0.00 0.00 41.25 40.84 2e9x s ASN 37 CO 0.02 -0.06 1.05 -2.65 -1.51 0.00 0.00 177.10 173.95 2e9x n PRO 38 N 4.19 0.65 -0.74 -0.60 -0.02 -1.19 -0.71 135.00 136.58 2e9x n PRO 38 Ca -0.22 0.23 0.00 0.00 -2.02 0.00 0.00 63.50 61.49 2e9x n PRO 38 Cb 0.51 -1.66 0.00 0.00 -0.02 0.00 0.00 33.50 32.33 2e9x n PRO 38 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2e9x n GLY 39 N 1.92 0.44 3.72 -1.23 0.00 -0.62 -4.98 105.19 104.43 2e9x n GLY 39 Ca 0.17 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.84 2e9x n GLY 39 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2e9x s LEU 40 N 0.00 3.96 0.19 0.99 2.96 0.11 -4.98 118.68 121.91 2e9x s LEU 40 Ca 0.00 0.21 -0.30 0.00 -0.22 0.00 0.00 54.13 53.81 2e9x s LEU 40 Cb 0.00 -1.98 -0.09 0.00 0.50 0.00 0.00 46.19 44.62 2e9x s LEU 40 CO 0.00 0.27 1.39 -2.84 -1.32 0.00 0.00 176.35 173.86 2e9x s PRO 41 N -0.23 4.32 -0.09 0.98 0.02 -1.26 -4.24 135.00 134.50 2e9x s PRO 41 Ca 0.09 2.16 -0.06 0.00 0.02 0.00 0.00 61.00 63.21 2e9x s PRO 41 Cb -0.12 -3.18 0.04 0.00 0.02 0.00 0.00 34.50 31.26 2e9x s PRO 41 CO 0.01 -0.38 0.22 0.54 -0.33 0.00 0.00 177.00 177.06 2e9x s VAL 42 N 0.44 -0.03 0.03 3.83 0.11 -0.88 -4.99 120.40 118.91 2e9x s VAL 42 Ca 0.61 0.11 -0.25 0.00 -2.93 0.00 0.00 61.98 59.52 2e9x s VAL 42 Cb -0.39 -0.33 -0.05 0.00 -1.53 0.00 0.00 36.38 34.08 2e9x s VAL 42 CO 0.37 0.04 0.76 -1.61 -3.33 0.00 0.00 175.10 171.33 2e9x s GLU 43 N 0.88 4.48 0.10 1.54 2.02 -1.26 -1.67 118.70 124.79 2e9x s GLU 43 Ca -0.06 1.04 -0.06 0.00 0.02 0.00 0.00 54.97 55.91 2e9x s GLU 43 Cb -0.08 -3.37 -0.02 0.00 0.10 0.00 0.00 34.13 30.76 2e9x s GLU 43 CO -0.05 0.26 0.13 0.14 0.02 0.00 0.00 175.26 175.76 2e9x s VAL 44 N 0.03 0.14 0.40 2.63 -7.23 -0.50 -4.73 120.40 111.15 2e9x s VAL 44 Ca 0.38 -1.49 -0.27 0.00 -1.81 0.00 0.00 61.98 58.80 2e9x s VAL 44 Cb -0.20 -1.59 -0.10 0.00 0.56 0.00 0.00 36.38 35.05 2e9x s VAL 44 CO 0.22 -0.64 1.42 -2.84 -0.31 0.00 0.00 175.10 172.95 2e9x s PRO 45 N -3.93 3.98 0.30 4.82 0.02 -1.26 -1.64 135.00 137.30 2e9x s PRO 45 Ca 0.11 2.41 0.06 0.00 0.02 0.00 0.00 61.00 63.60 2e9x s PRO 45 Cb 0.06 -2.85 0.76 0.00 0.02 0.00 0.00 34.50 32.49 2e9x s PRO 45 CO -0.07 -0.58 1.76 1.25 -0.33 0.00 0.00 177.00 179.04 2e9x h LEU 46 N 2.78 0.72 -1.30 -5.54 5.85 -0.33 0.08 115.31 117.57 2e9x h LEU 46 Ca -0.50 0.11 0.01 0.00 0.84 0.00 0.00 57.88 58.33 2e9x h LEU 46 Cb 1.25 -0.01 -0.04 0.00 0.37 0.00 0.00 40.66 42.23 2e9x h LEU 46 CO 0.63 0.22 0.48 4.11 -0.34 0.00 0.00 178.44 183.53 2e9x h TRP 47 N 0.69 0.90 -0.11 1.25 5.08 -1.69 -0.35 115.95 121.72 2e9x h TRP 47 Ca 0.59 0.02 -0.15 0.00 1.08 0.00 0.00 58.89 60.43 2e9x h TRP 47 Cb 0.97 -0.30 0.01 0.00 -3.00 0.00 0.00 29.16 26.83 2e9x h TRP 47 CO -0.02 0.56 -0.53 1.25 -1.28 0.00 0.00 178.44 178.43 2e9x h LEU 48 N 0.97 0.66 -0.46 0.11 5.85 -1.32 -2.73 115.31 118.39 2e9x h LEU 48 Ca 0.26 -0.63 0.07 0.00 0.84 0.00 0.00 57.88 58.42 2e9x h LEU 48 Cb -0.10 -0.19 -0.06 0.00 0.37 0.00 0.00 40.66 40.67 2e9x h LEU 48 CO -0.06 1.19 0.12 0.00 -0.34 0.00 0.00 178.44 179.35 2e9x h ALA 49 N 0.49 0.53 -0.56 1.25 0.00 -0.79 0.92 119.26 121.09 2e9x h ALA 49 Ca -0.03 0.08 0.01 0.00 0.00 0.00 0.00 54.91 54.96 2e9x h ALA 49 Cb 1.17 0.09 -0.03 0.00 0.00 0.00 0.00 17.79 19.02 2e9x h ALA 49 CO 0.11 -0.28 0.37 0.82 0.00 0.00 0.00 179.25 180.27 2e9x h ILE 50 N 0.27 1.14 0.03 0.00 1.08 -1.11 0.06 117.51 118.98 2e9x h ILE 50 Ca 0.22 -0.26 -0.00 0.00 -0.39 0.00 0.00 64.86 64.43 2e9x h ILE 50 Cb 0.26 0.32 0.00 0.00 -3.07 0.00 0.00 36.82 34.33 2e9x h ILE 50 CO -0.27 0.14 -0.01 -1.13 -0.69 0.00 0.00 178.15 176.19 2e9x h ASN 51 N 0.76 -0.03 -0.81 1.72 -1.24 -1.07 -2.04 115.58 112.87 2e9x h ASN 51 Ca 0.21 -0.26 0.02 0.00 0.71 0.00 0.00 56.30 56.98 2e9x h ASN 51 Cb -0.08 0.01 -0.04 0.00 0.73 0.00 0.00 38.32 38.93 2e9x h ASN 51 CO -0.05 0.24 0.53 -0.07 -1.29 0.00 0.00 177.43 176.79 2e9x h LEU 52 N -0.31 0.90 -0.40 0.34 3.38 -0.70 -1.78 115.31 116.75 2e9x h LEU 52 Ca -0.00 -0.02 -0.01 0.00 0.09 0.00 0.00 57.88 57.93 2e9x h LEU 52 Cb 0.29 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.80 2e9x h LEU 52 CO 0.01 0.64 0.19 0.50 0.09 0.00 0.00 178.44 179.86 2e9x h LYS 53 N 1.05 0.57 0.00 1.13 1.63 -0.86 0.16 116.57 120.24 2e9x h LYS 53 Ca 0.31 -0.08 -0.04 0.00 -0.85 0.00 0.00 60.65 59.98 2e9x h LYS 53 Cb -0.06 -0.10 -0.01 0.00 -0.60 0.00 0.00 32.23 31.46 2e9x h LYS 53 CO -0.08 0.50 -0.18 1.96 -3.45 0.00 0.00 179.45 178.20 2e9x h GLN 54 N 0.50 0.00 -0.22 1.90 4.20 -0.83 0.36 115.11 121.02 2e9x h GLN 54 Ca 0.14 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.85 2e9x h GLN 54 Cb 0.12 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.90 2e9x h GLN 54 CO -0.02 0.18 0.00 0.54 -0.67 0.00 0.00 178.83 178.87 2e9x n ARG 55 N -3.71 1.79 -3.78 1.46 1.74 -0.72 -4.93 116.66 108.51 2e9x n ARG 55 Ca -0.02 -1.20 -0.24 0.00 -0.77 0.00 0.00 57.85 55.63 2e9x n ARG 55 Cb 0.30 -1.38 0.02 0.00 -1.02 0.00 0.00 32.46 30.38 2e9x n ARG 55 CO 0.00 0.00 0.00 1.04 -1.52 0.00 0.00 177.63 177.15 2e9x n GLN 56 N 0.43 -4.74 -0.09 5.56 6.02 0.12 -4.89 117.38 119.79 2e9x n GLN 56 Ca 0.16 0.58 0.03 0.00 -0.01 0.00 0.00 57.00 57.76 2e9x n GLN 56 Cb 0.34 -5.13 0.08 0.00 1.02 0.00 0.00 30.24 26.55 2e9x n GLN 56 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.06 177.68 2e9x n LYS 57 N -4.37 2.84 -3.84 -1.09 5.02 -0.04 -4.97 118.16 111.73 2e9x n LYS 57 Ca -0.24 -1.84 -0.05 0.00 -2.02 0.00 0.00 58.31 54.16 2e9x n LYS 57 Cb 0.65 -1.17 0.01 0.00 -0.02 0.00 0.00 35.03 34.50 2e9x n LYS 57 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2e9x s ARG 59 N -2.50 1.86 -0.14 0.00 3.52 0.29 -4.73 118.95 117.24 2e9x s ARG 59 Ca 0.18 -0.72 -0.13 0.00 -0.13 0.00 0.00 55.73 54.93 2e9x s ARG 59 Cb -0.03 -1.69 -0.05 0.00 -1.56 0.00 0.00 34.95 31.62 2e9x s ARG 59 CO 0.07 0.37 0.27 -0.51 -0.81 0.00 0.00 175.30 174.68 2e9x s LEU 60 N -0.26 4.28 -0.10 -0.88 1.43 -1.26 -0.59 118.68 121.31 2e9x s LEU 60 Ca 0.02 0.52 -0.10 0.00 -1.03 0.00 0.00 54.13 53.54 2e9x s LEU 60 Cb -0.10 -2.33 -0.05 0.00 0.03 0.00 0.00 46.19 43.75 2e9x s LEU 60 CO 0.01 0.17 0.24 -0.76 0.23 0.00 0.00 176.35 176.24 2e9x s LEU 61 N 0.09 4.38 0.27 1.79 1.43 -0.63 -4.73 118.68 121.28 2e9x s LEU 61 Ca 0.16 0.60 -0.29 0.00 -1.03 0.00 0.00 54.13 53.57 2e9x s LEU 61 Cb -0.13 -2.26 -0.09 0.00 0.03 0.00 0.00 46.19 43.73 2e9x s LEU 61 CO 0.04 0.32 1.23 -2.84 0.23 0.00 0.00 176.35 175.34 2e9x s PRO 62 N -0.73 4.47 0.78 1.29 0.02 -1.26 -4.56 135.00 135.00 2e9x s PRO 62 Ca 0.17 2.01 -0.14 0.00 0.02 0.00 0.00 61.00 63.06 2e9x s PRO 62 Cb -0.13 -3.15 0.05 0.00 0.02 0.00 0.00 34.50 31.28 2e9x s PRO 62 CO 0.06 -0.06 1.09 -2.30 -0.33 0.00 0.00 177.00 175.45 2e9x n PRO 63 N 1.51 0.33 -0.04 5.54 -0.02 -1.26 -4.83 135.00 136.23 2e9x n PRO 63 Ca 0.01 0.18 0.18 0.00 -2.02 0.00 0.00 63.50 61.85 2e9x n PRO 63 Cb 0.43 -2.34 0.62 0.00 -0.02 0.00 0.00 33.50 32.20 2e9x n PRO 63 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 2e9x h GLU 64 N -0.62 0.14 0.00 -0.52 4.81 -2.00 -0.36 114.58 116.02 2e9x h GLU 64 Ca -0.47 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 58.75 2e9x h GLU 64 Cb 1.31 -0.03 0.00 0.00 0.63 0.00 0.00 28.75 30.66 2e9x h GLU 64 CO 0.46 0.09 -0.04 0.11 -0.73 0.00 0.00 179.01 178.91 2e9x h TRP 65 N 0.14 0.00 -0.62 0.92 5.08 -1.94 -3.40 115.95 116.14 2e9x h TRP 65 Ca 0.28 0.00 -0.72 0.00 1.08 0.00 0.00 58.89 59.53 2e9x h TRP 65 Cb 0.90 0.00 -0.08 0.00 -3.00 0.00 0.00 29.16 26.98 2e9x h TRP 65 CO -0.00 0.00 2.59 -0.12 -1.28 0.00 0.00 178.44 179.63 2e9x n MET 66 N -2.70 3.12 -3.81 0.12 1.56 -0.15 -4.41 117.12 110.85 2e9x n MET 66 Ca 0.05 -3.02 -0.13 0.00 -0.27 0.00 0.00 57.70 54.32 2e9x n MET 66 Cb 0.48 -3.24 -0.14 0.00 2.15 0.00 0.00 33.22 32.47 2e9x n MET 66 CO 0.00 0.00 0.00 0.34 -0.73 0.00 0.00 175.97 175.58 2e9x s ASP 67 N 2.92 -0.05 0.18 6.12 2.15 -1.26 -4.76 116.67 121.97 2e9x s ASP 67 Ca 0.47 0.15 -0.18 0.00 0.43 0.00 0.00 52.55 53.41 2e9x s ASP 67 Cb 0.10 0.10 0.14 0.00 -0.30 0.00 0.00 42.92 42.96 2e9x s ASP 67 CO -0.03 -0.08 1.62 0.58 -0.17 0.00 0.00 175.17 177.09 2e9x h VAL 68 N 5.56 0.33 0.06 1.11 2.07 -1.90 0.74 116.25 124.22 2e9x h VAL 68 Ca -0.34 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.21 2e9x h VAL 68 Cb 1.17 0.33 -0.04 0.00 -1.52 0.00 0.00 31.29 31.23 2e9x h VAL 68 CO 0.46 0.00 -0.24 -0.33 0.02 0.00 0.00 177.57 177.48 2e9x h GLU 69 N -0.12 -0.39 -0.59 1.57 4.39 -1.97 -0.66 114.58 116.82 2e9x h GLU 69 Ca 0.23 0.03 -0.04 0.00 0.34 0.00 0.00 59.36 59.92 2e9x h GLU 69 Cb 0.48 0.09 -0.03 0.00 -0.10 0.00 0.00 28.75 29.19 2e9x h GLU 69 CO -0.57 -0.26 0.21 0.87 -1.16 0.00 0.00 179.01 178.10 2e9x h LYS 70 N -0.40 0.89 -0.37 2.33 1.57 -1.77 -2.88 116.57 115.93 2e9x h LYS 70 Ca 0.05 -0.18 -0.08 0.00 -1.87 0.00 0.00 60.65 58.57 2e9x h LYS 70 Cb 0.46 -0.14 -0.02 0.00 0.08 0.00 0.00 32.23 32.61 2e9x h LYS 70 CO -0.18 0.78 -0.11 -0.07 -0.57 0.00 0.00 179.45 179.30 2e9x h LEU 71 N 0.82 0.64 -0.79 2.94 3.38 -0.70 -1.75 115.31 119.85 2e9x h LEU 71 Ca 0.19 -0.18 -0.01 0.00 0.09 0.00 0.00 57.88 57.97 2e9x h LEU 71 Cb 0.24 -0.17 -0.04 0.00 0.09 0.00 0.00 40.66 40.78 2e9x h LEU 71 CO -0.01 0.78 0.44 -0.33 0.09 0.00 0.00 178.44 179.41 2e9x h GLU 72 N 0.60 1.09 -0.33 1.13 5.08 -0.97 0.15 114.58 121.33 2e9x h GLU 72 Ca 0.11 -0.12 -0.09 0.00 -1.00 0.00 0.00 59.36 58.25 2e9x h GLU 72 Cb 0.54 -0.22 -0.01 0.00 0.50 0.00 0.00 28.75 29.57 2e9x h GLU 72 CO 0.03 0.81 -0.13 0.87 -1.00 0.00 0.00 179.01 179.58 2e9x h LYS 73 N 1.09 0.67 -0.74 2.33 1.57 -1.27 -0.16 116.57 120.06 2e9x h LYS 73 Ca 0.28 -0.28 -0.04 0.00 -1.87 0.00 0.00 60.65 58.74 2e9x h LYS 73 Cb 0.02 -0.03 -0.03 0.00 0.08 0.00 0.00 32.23 32.28 2e9x h LYS 73 CO -0.05 0.87 0.33 0.52 -0.57 0.00 0.00 179.45 180.55 2e9x h MET 74 N 0.45 1.09 -0.21 3.15 2.86 -1.05 0.22 114.93 121.44 2e9x h MET 74 Ca 0.08 -0.18 -0.01 0.00 -2.06 0.00 0.00 59.70 57.53 2e9x h MET 74 Cb 0.66 -0.19 -0.01 0.00 0.06 0.00 0.00 31.60 32.12 2e9x h MET 74 CO 0.04 0.87 0.09 -0.09 1.06 0.00 0.00 176.91 178.89 2e9x h ARG 75 N 1.06 0.30 -0.51 1.72 1.12 -0.53 0.13 114.38 117.66 2e9x h ARG 75 Ca 0.25 -0.05 -0.02 0.00 -1.11 0.00 0.00 59.98 59.05 2e9x h ARG 75 Cb 0.17 -0.05 -0.02 0.00 -0.01 0.00 0.00 29.97 30.05 2e9x h ARG 75 CO -0.03 0.34 0.23 -0.44 -3.11 0.00 0.00 179.97 176.96 2e9x h ASP 76 N 0.19 0.69 -0.90 -3.80 3.32 -0.77 -2.14 116.42 113.01 2e9x h ASP 76 Ca 0.07 -0.15 0.01 0.00 0.02 0.00 0.00 57.03 56.98 2e9x h ASP 76 Cb 0.14 -0.18 -0.05 0.00 0.22 0.00 0.00 39.33 39.47 2e9x h ASP 76 CO -0.01 0.65 0.60 -0.74 -1.72 0.00 0.00 179.24 178.02 2e9x h HIS 77 N 0.69 1.13 -0.30 4.55 2.76 -0.25 -1.86 115.15 121.86 2e9x h HIS 77 Ca 0.17 0.03 -0.06 0.00 -2.20 0.00 0.00 60.37 58.32 2e9x h HIS 77 Cb 0.16 -0.38 -0.02 0.00 1.55 0.00 0.00 27.41 28.72 2e9x h HIS 77 CO 0.00 0.70 -0.05 1.49 -1.30 0.00 0.00 177.93 178.77 2e9x h GLU 78 N 1.21 0.48 -0.19 5.26 4.57 -0.41 -2.83 114.58 122.67 2e9x h GLU 78 Ca 0.33 -0.11 -0.16 0.00 -1.18 0.00 0.00 59.36 58.24 2e9x h GLU 78 Cb -0.12 -0.07 -0.01 0.00 -0.16 0.00 0.00 28.75 28.40 2e9x h GLU 78 CO -0.08 0.55 -0.54 0.00 -1.18 0.00 0.00 179.01 177.77 2e9x h ARG 79 N 0.46 0.57 0.00 1.92 3.08 -0.70 -3.21 114.38 116.49 2e9x h ARG 79 Ca 0.10 -0.35 -0.08 0.00 0.07 0.00 0.00 59.98 59.72 2e9x h ARG 79 Cb 0.38 0.04 -0.01 0.00 0.08 0.00 0.00 29.97 30.46 2e9x h ARG 79 CO 0.02 0.96 -0.37 0.87 -1.07 0.00 0.00 179.97 180.37 2e9x h LYS 80 N 0.44 0.00 -6.40 0.04 1.57 -1.18 -3.45 116.57 107.59 2e9x h LYS 80 Ca 0.01 0.00 -0.55 0.00 -1.87 0.00 0.00 60.65 58.25 2e9x h LYS 80 Cb 1.08 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 33.35 2e9x h LYS 80 CO 0.10 0.37 0.01 -1.21 -0.57 0.00 0.00 179.45 178.15 2e9x s GLU 81 N -3.60 4.15 0.23 3.15 8.01 -1.09 -4.97 118.70 124.58 2e9x s GLU 81 Ca 0.00 0.71 0.25 0.00 0.01 0.00 0.00 54.97 55.94 2e9x s GLU 81 Cb 0.11 -3.00 0.59 0.00 -4.31 0.00 0.00 34.13 27.52 2e9x s GLU 81 CO 0.69 0.49 1.61 0.93 0.01 0.00 0.00 175.26 178.98 2e9x h GLU 82 N 3.76 0.00 -5.92 1.61 5.08 -1.87 -3.46 114.58 113.77 2e9x h GLU 82 Ca -0.48 0.00 -0.56 0.00 -1.00 0.00 0.00 59.36 57.32 2e9x h GLU 82 Cb 1.20 0.00 -0.07 0.00 0.50 0.00 0.00 28.75 30.38 2e9x h GLU 82 CO 0.65 0.00 -0.45 0.95 -1.00 0.00 0.00 179.01 179.16 2e9x s THR 83 N -3.15 2.26 0.23 1.13 -4.23 -1.26 -5.06 115.64 105.57 2e9x s THR 83 Ca 0.08 -1.62 -0.30 0.00 -1.18 0.00 0.00 61.69 58.68 2e9x s THR 83 Cb 0.11 -2.88 -0.09 0.00 1.34 0.00 0.00 72.50 70.99 2e9x s THR 83 CO 0.65 0.00 1.02 -0.36 -0.54 0.00 0.00 174.62 175.39 2e9x s PHE 84 N -2.61 3.77 0.29 3.99 0.40 -1.26 -5.02 117.98 117.54 2e9x s PHE 84 Ca 0.40 1.78 0.05 0.00 -0.60 0.00 0.00 56.93 58.57 2e9x s PHE 84 Cb 0.02 -3.14 -0.02 0.00 0.51 0.00 0.00 43.02 40.39 2e9x s PHE 84 CO 0.23 -0.08 0.43 0.95 0.70 0.00 0.00 175.22 177.45 2e9x s THR 85 N -0.94 4.72 0.13 0.64 -4.23 -1.26 -4.83 115.64 109.87 2e9x s THR 85 Ca 0.44 -0.94 -0.31 0.00 -1.18 0.00 0.00 61.69 59.69 2e9x s THR 85 Cb -0.28 -3.66 -0.09 0.00 1.34 0.00 0.00 72.50 69.81 2e9x s THR 85 CO 0.35 -0.27 1.51 -2.84 -0.54 0.00 0.00 174.62 172.83 2e9x s PRO 86 N -4.10 4.25 0.34 3.99 0.02 -1.26 -4.85 135.00 133.39 2e9x s PRO 86 Ca 0.39 2.24 -0.09 0.00 0.02 0.00 0.00 61.00 63.56 2e9x s PRO 86 Cb -0.09 -3.25 -0.06 0.00 0.02 0.00 0.00 34.50 31.11 2e9x s PRO 86 CO 0.31 -0.56 0.68 -1.64 -0.33 0.00 0.00 177.00 175.46 2e9x s MET 87 N 1.33 3.77 0.30 5.54 -1.94 -1.26 -4.97 119.30 122.08 2e9x s MET 87 Ca 0.68 0.35 0.23 0.00 -1.71 0.00 0.00 55.69 55.24 2e9x s MET 87 Cb -0.40 -2.49 1.10 0.00 2.01 0.00 0.00 34.83 35.04 2e9x s MET 87 CO 0.31 0.10 1.70 -2.30 -0.01 0.00 0.00 175.02 174.81 2e9x n PRO 88 N -0.94 0.17 -3.63 2.03 -0.02 -1.26 -4.72 135.00 126.63 2e9x n PRO 88 Ca 0.01 0.53 -0.15 0.00 -2.02 0.00 0.00 63.50 61.88 2e9x n PRO 88 Cb 0.54 -1.93 -0.08 0.00 -0.02 0.00 0.00 33.50 32.01 2e9x n PRO 88 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 2e9x s SER 89 N -4.18 -0.56 0.17 2.55 0.15 -1.26 -4.99 113.70 105.57 2e9x s SER 89 Ca 0.01 0.84 0.19 0.00 0.70 0.00 0.00 55.95 57.69 2e9x s SER 89 Cb 0.08 0.82 0.82 0.00 -1.71 0.00 0.00 66.02 66.03 2e9x s SER 89 CO 0.30 -0.39 1.58 -2.65 1.20 0.00 0.00 173.24 173.28 2e9x n PRO 90 N 1.85 0.12 -2.65 5.44 -0.02 -1.26 -2.81 135.00 135.67 2e9x n PRO 90 Ca -0.17 0.39 -0.14 0.00 -2.02 0.00 0.00 63.50 61.56 2e9x n PRO 90 Cb 0.56 -1.74 0.02 0.00 -0.02 0.00 0.00 33.50 32.32 2e9x n PRO 90 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 2e9x n TYR 91 N -1.96 1.71 -0.01 6.00 4.02 -1.26 -4.10 117.16 121.56 2e9x n TYR 91 Ca 0.02 -2.95 -0.00 0.00 -0.01 0.00 0.00 57.90 54.96 2e9x n TYR 91 Cb 0.18 -0.31 0.29 0.00 -0.02 0.00 0.00 39.34 39.48 2e9x n TYR 91 CO 0.00 0.00 0.00 0.10 -1.01 0.00 0.00 176.86 175.95 2e9x h TYR 92 N 2.90 0.56 -0.02 -0.72 -0.00 -1.92 -1.45 116.97 116.32 2e9x h TYR 92 Ca 0.01 -0.06 -0.01 0.00 0.00 0.00 0.00 58.73 58.68 2e9x h TYR 92 Cb 1.09 -0.16 -0.00 0.00 0.00 0.00 0.00 36.73 37.66 2e9x h TYR 92 CO 0.58 0.55 -0.01 0.52 -0.00 0.00 0.00 178.16 179.80 2e9x h MET 93 N 0.51 0.04 -0.39 0.10 2.86 -1.91 -2.29 114.93 113.85 2e9x h MET 93 Ca 0.11 -0.02 -0.02 0.00 -2.06 0.00 0.00 59.70 57.71 2e9x h MET 93 Cb 0.34 -0.00 -0.02 0.00 0.06 0.00 0.00 31.60 31.98 2e9x h MET 93 CO 0.01 0.41 0.16 0.93 1.06 0.00 0.00 176.91 179.49 2e9x h GLU 94 N -0.33 0.58 -0.70 1.72 3.07 -1.94 0.26 114.58 117.24 2e9x h GLU 94 Ca 0.01 -0.10 -0.04 0.00 -0.50 0.00 0.00 59.36 58.72 2e9x h GLU 94 Cb 0.40 -0.10 -0.03 0.00 -0.84 0.00 0.00 28.75 28.18 2e9x h GLU 94 CO 0.00 0.54 0.26 -0.07 -1.40 0.00 0.00 179.01 178.35 2e9x h LEU 95 N 0.49 0.98 -0.18 1.33 4.07 -1.33 0.35 115.31 121.02 2e9x h LEU 95 Ca 0.13 -0.18 -0.02 0.00 0.08 0.00 0.00 57.88 57.89 2e9x h LEU 95 Cb 0.17 -0.25 -0.01 0.00 1.08 0.00 0.00 40.66 41.65 2e9x h LEU 95 CO -0.01 0.89 0.02 0.74 -1.08 0.00 0.00 178.44 179.00 2e9x h THR 96 N 1.00 1.23 -0.15 0.22 2.02 -1.24 -0.30 112.91 115.68 2e9x h THR 96 Ca 0.23 -0.75 0.02 0.00 0.77 0.00 0.00 66.41 66.68 2e9x h THR 96 Cb 0.23 1.38 -0.02 0.00 -1.74 0.00 0.00 68.15 68.00 2e9x h THR 96 CO -0.02 0.23 0.03 0.50 0.37 0.00 0.00 175.52 176.63 2e9x h LYS 97 N 0.08 0.10 -0.11 6.66 3.11 -0.72 -0.95 116.57 124.74 2e9x h LYS 97 Ca 0.05 -0.01 -0.09 0.00 -2.81 0.00 0.00 60.65 57.80 2e9x h LYS 97 Cb 0.32 -0.02 0.00 0.00 -1.00 0.00 0.00 32.23 31.53 2e9x h LYS 97 CO 0.00 0.06 -0.27 -0.07 -2.81 0.00 0.00 179.45 176.37 2e9x h LEU 98 N 0.10 0.43 -0.47 5.20 3.38 -0.91 -2.38 115.31 120.65 2e9x h LEU 98 Ca 0.07 -0.58 -0.02 0.00 0.09 0.00 0.00 57.88 57.44 2e9x h LEU 98 Cb 0.06 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 40.66 2e9x h LEU 98 CO -0.09 0.93 0.22 -0.07 0.09 0.00 0.00 178.44 179.52 2e9x h LEU 99 N -0.05 0.62 -1.13 1.67 4.07 -1.05 -1.82 115.31 117.62 2e9x h LEU 99 Ca -0.00 -0.13 -0.09 0.00 0.08 0.00 0.00 57.88 57.73 2e9x h LEU 99 Cb 0.87 -0.16 -0.01 0.00 1.08 0.00 0.00 40.66 42.44 2e9x h LEU 99 CO 0.06 0.58 -0.43 -0.07 -1.08 0.00 0.00 178.44 177.50 2e9x h LEU 100 N 0.62 0.00 -0.23 1.67 3.38 -1.24 0.24 115.31 119.74 2e9x h LEU 100 Ca 0.16 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 58.04 2e9x h LEU 100 Cb 0.13 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.87 2e9x h LEU 100 CO -0.02 0.43 -0.43 0.78 0.09 0.00 0.00 178.44 179.29 2e9x h ASN 101 N 0.00 0.00 0.00 -0.43 4.21 -1.16 -3.26 115.58 114.94 2e9x h ASN 101 Ca -0.00 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.51 2e9x h ASN 101 Cb 0.78 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.98 2e9x h ASN 101 CO 0.06 0.43 0.00 1.41 -1.29 0.00 0.00 177.43 178.03 2e9x n HIS 102 N -3.27 0.00 -2.62 1.19 8.25 -0.71 -4.83 115.22 113.24 2e9x n HIS 102 Ca 0.02 0.00 -0.01 0.00 -0.26 0.00 0.00 57.72 57.47 2e9x n HIS 102 Cb 0.66 0.00 0.06 0.00 1.12 0.00 0.00 29.99 31.83 2e9x n HIS 102 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2e9x n ALA 103 N -0.54 2.83 0.28 -1.41 0.00 0.83 -4.83 120.51 117.68 2e9x n ALA 103 Ca 0.00 -1.79 0.14 0.00 0.00 0.00 0.00 53.44 51.79 2e9x n ALA 103 Cb 0.01 -0.76 0.81 0.00 0.00 0.00 0.00 19.45 19.51 2e9x n ALA 103 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 2e9x h SER 104 N 1.45 0.00 0.46 0.00 4.64 -1.59 0.14 113.55 118.66 2e9x h SER 104 Ca -0.32 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.00 2e9x h SER 104 Cb 1.39 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.48 2e9x h SER 104 CO -0.03 0.07 0.00 -0.90 -0.87 0.00 0.00 176.83 175.10 2e9x n ASP 105 N -3.75 0.00 -0.00 4.97 5.75 -1.26 -2.41 116.55 119.84 2e9x n ASP 105 Ca -0.02 -0.02 0.06 0.00 -0.01 0.00 0.00 54.79 54.79 2e9x n ASP 105 Cb 0.16 -0.30 -0.09 0.00 -1.03 0.00 0.00 41.12 39.87 2e9x n ASP 105 CO 0.00 0.00 0.00 0.59 -0.11 0.00 0.00 177.20 177.68 2e9x n ASN 106 N -1.30 1.89 -4.56 -1.12 5.03 0.41 -4.93 115.26 110.69 2e9x n ASN 106 Ca 0.11 -0.16 -0.38 0.00 0.87 0.00 0.00 54.58 55.02 2e9x n ASN 106 Cb 0.19 1.44 -0.11 0.00 -1.02 0.00 0.00 39.78 40.28 2e9x n ASN 106 CO 0.00 0.00 0.00 -0.63 -1.83 0.00 0.00 177.26 174.80 2e9x s ILE 107 N -2.69 5.12 0.42 2.41 -1.09 -0.72 -4.66 121.20 119.99 2e9x s ILE 107 Ca -0.03 0.07 -0.26 0.00 -2.23 0.00 0.00 60.65 58.21 2e9x s ILE 107 Cb 0.08 -3.45 -0.08 0.00 -1.58 0.00 0.00 42.46 37.43 2e9x s ILE 107 CO 0.50 0.24 1.34 -2.84 -1.23 0.00 0.00 174.94 172.95 2e9x s PRO 108 N 1.73 3.86 -1.32 2.79 0.02 -1.26 -3.40 135.00 137.41 2e9x s PRO 108 Ca 0.07 2.23 -0.22 0.00 0.02 0.00 0.00 61.00 63.10 2e9x s PRO 108 Cb -0.16 -2.71 0.03 0.00 0.02 0.00 0.00 34.50 31.68 2e9x s PRO 108 CO 0.10 -0.61 0.47 1.63 -0.33 0.00 0.00 177.00 178.26 2e9x n LYS 109 N -0.01 -0.66 -0.09 5.54 5.02 -1.26 -4.83 118.16 121.87 2e9x n LYS 109 Ca 0.04 0.11 -0.06 0.00 -2.02 0.00 0.00 58.31 56.38 2e9x n LYS 109 Cb 0.43 -3.02 0.00 0.00 -0.02 0.00 0.00 35.03 32.42 2e9x n LYS 109 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2e9x h ALA 110 N 1.31 0.29 -0.83 7.82 0.00 -1.83 -2.43 119.26 123.59 2e9x h ALA 110 Ca -0.69 0.08 0.08 0.00 0.00 0.00 0.00 54.91 54.38 2e9x h ALA 110 Cb 1.40 0.13 -0.06 0.00 0.00 0.00 0.00 17.79 19.27 2e9x h ALA 110 CO 0.58 -0.39 0.54 -0.44 0.00 0.00 0.00 179.25 179.54 2e9x h ASP 111 N 0.11 0.77 0.18 0.00 3.32 -1.92 0.65 116.42 119.53 2e9x h ASP 111 Ca 0.15 0.01 -0.16 0.00 0.02 0.00 0.00 57.03 57.05 2e9x h ASP 111 Cb 0.19 -0.15 -0.01 0.00 0.22 0.00 0.00 39.33 39.59 2e9x h ASP 111 CO -0.24 0.47 -0.59 -0.33 -1.72 0.00 0.00 179.24 176.83 2e9x h GLU 112 N 0.86 0.42 -0.38 3.56 5.08 -1.83 -2.25 114.58 120.03 2e9x h GLU 112 Ca 0.37 -0.28 -0.13 0.00 -1.00 0.00 0.00 59.36 58.32 2e9x h GLU 112 Cb 0.32 0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.60 2e9x h GLU 112 CO -0.14 0.89 -0.26 0.82 -1.00 0.00 0.00 179.01 179.31 2e9x h ILE 113 N 0.31 1.28 -0.84 3.13 2.04 -0.81 -0.87 117.51 121.75 2e9x h ILE 113 Ca -0.00 -1.42 0.04 0.00 1.00 0.00 0.00 64.86 64.48 2e9x h ILE 113 Cb 1.12 1.36 -0.05 0.00 -0.74 0.00 0.00 36.82 38.52 2e9x h ILE 113 CO 0.10 0.47 0.53 -0.09 0.00 0.00 0.00 178.15 179.17 2e9x h ARG 114 N 0.64 0.98 -0.17 2.37 2.43 -0.81 -0.66 114.38 119.17 2e9x h ARG 114 Ca 0.07 -0.06 -0.05 0.00 -0.81 0.00 0.00 59.98 59.13 2e9x h ARG 114 Cb 0.83 -0.22 -0.00 0.00 -0.42 0.00 0.00 29.97 30.16 2e9x h ARG 114 CO 0.07 0.65 -0.11 1.15 -1.51 0.00 0.00 179.97 180.23 2e9x h THR 115 N 1.01 1.32 -0.76 0.20 2.02 -1.20 -1.96 112.91 113.55 2e9x h THR 115 Ca 0.35 -1.19 -0.02 0.00 0.77 0.00 0.00 66.41 66.31 2e9x h THR 115 Cb 0.07 1.74 -0.04 0.00 -1.74 0.00 0.00 68.15 68.18 2e9x h THR 115 CO -0.14 0.35 0.39 -0.07 0.37 0.00 0.00 175.52 176.43 2e9x h LEU 116 N 0.04 0.97 -0.56 2.58 3.38 -0.81 0.04 115.31 120.94 2e9x h LEU 116 Ca 0.03 -0.11 -0.15 0.00 0.09 0.00 0.00 57.88 57.74 2e9x h LEU 116 Cb 0.60 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 41.10 2e9x h LEU 116 CO 0.03 0.81 -0.45 0.58 0.09 0.00 0.00 178.44 179.49 2e9x h VAL 117 N 1.05 1.30 -0.77 1.22 2.07 -1.15 -2.16 116.25 117.81 2e9x h VAL 117 Ca 0.26 -1.64 -0.04 0.00 0.82 0.00 0.00 66.70 66.10 2e9x h VAL 117 Cb 0.07 1.59 -0.03 0.00 -1.52 0.00 0.00 31.29 31.40 2e9x h VAL 117 CO -0.04 0.52 0.33 0.50 0.02 0.00 0.00 177.57 178.90 2e9x h LYS 118 N 0.52 1.13 -0.75 1.57 3.64 -0.95 -1.84 116.57 119.88 2e9x h LYS 118 Ca 0.03 -0.19 0.00 0.00 -1.27 0.00 0.00 60.65 59.22 2e9x h LYS 118 Cb 0.99 -0.19 -0.04 0.00 -0.41 0.00 0.00 32.23 32.58 2e9x h LYS 118 CO 0.09 0.90 0.47 -0.44 -2.27 0.00 0.00 179.45 178.21 2e9x h ASP 119 N 1.10 0.88 -0.50 4.20 3.32 -0.71 -1.08 116.42 123.63 2e9x h ASP 119 Ca 0.26 -0.05 -0.07 0.00 0.02 0.00 0.00 57.03 57.19 2e9x h ASP 119 Cb 0.18 -0.22 -0.02 0.00 0.22 0.00 0.00 39.33 39.48 2e9x h ASP 119 CO -0.03 0.67 0.06 0.24 -1.72 0.00 0.00 179.24 178.46 2e9x h MET 120 N 1.02 0.90 0.09 3.56 2.86 -1.02 -0.71 114.93 121.63 2e9x h MET 120 Ca 0.27 -0.23 -0.00 0.00 -2.06 0.00 0.00 59.70 57.68 2e9x h MET 120 Cb -0.07 -0.11 0.00 0.00 0.06 0.00 0.00 31.60 31.48 2e9x h MET 120 CO -0.05 0.86 -0.04 2.35 1.06 0.00 0.00 176.91 181.08 2e9x h TRP 121 N 0.85 -0.11 -0.92 -0.22 2.91 -0.91 -1.13 115.95 116.42 2e9x h TRP 121 Ca 0.17 -0.00 0.03 0.00 1.13 0.00 0.00 58.89 60.21 2e9x h TRP 121 Cb 0.42 0.04 -0.05 0.00 -0.51 0.00 0.00 29.16 29.05 2e9x h TRP 121 CO 0.03 0.11 0.60 -0.44 -1.03 0.00 0.00 178.44 177.70 2e9x h ASP 122 N -0.32 1.01 -0.24 2.65 3.32 -1.01 0.67 116.42 122.51 2e9x h ASP 122 Ca -0.01 -0.01 -0.02 0.00 0.02 0.00 0.00 57.03 57.00 2e9x h ASP 122 Cb 0.27 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 39.57 2e9x h ASP 122 CO 0.02 0.71 0.06 0.74 -1.72 0.00 0.00 179.24 179.05 2e9x h THR 123 N 1.18 1.20 -0.15 0.35 2.02 -1.05 -2.68 112.91 113.78 2e9x h THR 123 Ca 0.36 -0.66 -0.12 0.00 0.77 0.00 0.00 66.41 66.75 2e9x h THR 123 Cb -0.04 1.19 -0.01 0.00 -1.74 0.00 0.00 68.15 67.55 2e9x h THR 123 CO -0.11 0.21 -0.44 0.03 0.37 0.00 0.00 175.52 175.58 2e9x h ARG 124 N 0.21 0.37 -0.06 6.66 3.08 -0.63 -2.02 114.38 121.99 2e9x h ARG 124 Ca 0.08 -0.19 -0.17 0.00 0.07 0.00 0.00 59.98 59.76 2e9x h ARG 124 Cb 0.26 0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.31 2e9x h ARG 124 CO -0.00 0.75 -0.70 0.97 -1.07 0.00 0.00 179.97 179.92 2e9x h ILE 125 N 0.30 1.40 -0.37 2.04 2.10 -0.87 0.50 117.51 122.61 2e9x h ILE 125 Ca 0.02 -2.15 -0.12 0.00 1.08 0.00 0.00 64.86 63.69 2e9x h ILE 125 Cb 0.91 2.12 -0.01 0.00 -1.09 0.00 0.00 36.82 38.74 2e9x h ILE 125 CO 0.08 0.64 -0.27 0.00 -1.08 0.00 0.00 178.15 177.52 2e9x h ALA 126 N 1.05 0.82 -0.13 0.18 0.00 -1.41 -2.03 119.26 117.74 2e9x h ALA 126 Ca -0.02 -0.39 -0.08 0.00 0.00 0.00 0.00 54.91 54.42 2e9x h ALA 126 Cb 1.25 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.89 2e9x h ALA 126 CO 0.11 0.64 -0.26 -0.22 0.00 0.00 0.00 179.25 179.53 2e9x h LYS 127 N 0.67 0.24 -0.27 0.00 3.64 -1.12 -2.34 116.57 117.39 2e9x h LYS 127 Ca 0.08 -0.08 -0.10 0.00 -1.27 0.00 0.00 60.65 59.29 2e9x h LYS 127 Cb 0.79 -0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 32.58 2e9x h LYS 127 CO 0.07 0.49 -0.25 1.25 -2.27 0.00 0.00 179.45 178.73 2e9x h LEU 128 N 0.22 0.52 -0.33 5.20 6.46 -0.22 -1.03 115.31 126.12 2e9x h LEU 128 Ca 0.03 -0.18 -0.09 0.00 -0.12 0.00 0.00 57.88 57.53 2e9x h LEU 128 Cb 0.57 -0.14 -0.01 0.00 -0.73 0.00 0.00 40.66 40.35 2e9x h LEU 128 CO 0.04 0.76 -0.15 0.03 -0.62 0.00 0.00 178.44 178.51 2e9x h ARG 129 N 0.45 0.68 -0.61 1.25 3.08 -0.86 -1.30 114.38 117.07 2e9x h ARG 129 Ca 0.07 -0.29 -0.06 0.00 0.07 0.00 0.00 59.98 59.76 2e9x h ARG 129 Cb 0.68 -0.02 -0.02 0.00 0.08 0.00 0.00 29.97 30.68 2e9x h ARG 129 CO 0.05 0.89 0.13 0.28 -1.07 0.00 0.00 179.97 180.24 2e9x h VAL 130 N 0.45 1.26 -0.61 2.04 2.07 -1.32 -0.93 116.25 119.20 2e9x h VAL 130 Ca 0.08 -0.95 -0.04 0.00 0.82 0.00 0.00 66.70 66.60 2e9x h VAL 130 Cb 0.67 0.70 -0.03 0.00 -1.52 0.00 0.00 31.29 31.11 2e9x h VAL 130 CO 0.05 0.35 0.21 -1.28 0.02 0.00 0.00 177.57 176.92 2e9x h SER 131 N 0.90 0.85 0.11 0.57 0.87 -1.09 -0.75 113.55 115.00 2e9x h SER 131 Ca 0.19 -0.13 -0.18 0.00 -1.23 0.00 0.00 61.79 60.44 2e9x h SER 131 Cb 0.38 -0.22 -0.00 0.00 -0.44 0.00 0.00 62.40 62.12 2e9x h SER 131 CO 0.01 0.78 -0.66 0.00 -0.53 0.00 0.00 176.83 176.43 2e9x h ALA 132 N 1.33 0.61 -0.76 6.23 0.00 -0.92 -1.41 119.26 124.34 2e9x h ALA 132 Ca 0.20 -0.56 -0.03 0.00 0.00 0.00 0.00 54.91 54.52 2e9x h ALA 132 Cb 0.23 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 17.92 2e9x h ALA 132 CO -0.01 0.72 0.35 0.22 0.00 0.00 0.00 179.25 180.53 2e9x h ASP 133 N 0.37 1.01 -0.35 0.00 3.58 -0.71 0.50 116.42 120.81 2e9x h ASP 133 Ca -0.02 -0.15 -0.04 0.00 0.42 0.00 0.00 57.03 57.25 2e9x h ASP 133 Cb 1.22 -0.26 -0.01 0.00 1.72 0.00 0.00 39.33 42.00 2e9x h ASP 133 CO 0.12 0.87 0.07 -1.28 -2.88 0.00 0.00 179.24 176.14 2e9x h SER 134 N 1.08 0.56 -0.26 2.28 0.87 -0.99 0.19 113.55 117.26 2e9x h SER 134 Ca 0.26 -0.25 0.04 0.00 -1.23 0.00 0.00 61.79 60.61 2e9x h SER 134 Cb 0.15 -0.15 -0.04 0.00 -0.44 0.00 0.00 62.40 61.92 2e9x h SER 134 CO -0.03 0.66 -0.00 0.15 -0.53 0.00 0.00 176.83 177.08 2e9x h PHE 135 N 0.42 -0.02 -0.27 2.24 3.57 -0.76 -1.52 116.94 120.61 2e9x h PHE 135 Ca 0.11 0.02 -0.07 0.00 3.53 0.00 0.00 57.97 61.56 2e9x h PHE 135 Cb 0.34 0.05 -0.01 0.00 2.79 0.00 0.00 35.95 39.12 2e9x h PHE 135 CO 0.02 -0.04 -0.11 0.28 -2.23 0.00 0.00 178.31 176.23 2e9x h VAL 136 N 0.08 1.29 -0.51 1.41 2.07 -0.76 -1.47 116.25 118.36 2e9x h VAL 136 Ca 0.12 -1.17 0.08 0.00 0.82 0.00 0.00 66.70 66.55 2e9x h VAL 136 Cb 0.16 1.50 -0.07 0.00 -1.52 0.00 0.00 31.29 31.36 2e9x h VAL 136 CO -0.21 0.37 0.12 0.03 0.02 0.00 0.00 177.57 177.90 2e9x h ARG 137 N 0.28 0.25 -0.06 1.57 2.47 -0.35 -1.07 114.38 117.48 2e9x h ARG 137 Ca 0.06 -0.02 0.00 0.00 -1.26 0.00 0.00 59.98 58.77 2e9x h ARG 137 Cb 0.61 -0.06 0.00 0.00 -1.65 0.00 0.00 29.97 28.87 2e9x h ARG 137 CO 0.03 0.17 0.00 1.04 0.56 0.00 0.00 179.97 181.77 2e9x n GLN 138 N -5.09 1.52 -3.65 0.04 6.02 -0.60 -4.94 117.38 110.68 2e9x n GLN 138 Ca 0.06 -0.77 -0.23 0.00 -0.01 0.00 0.00 57.00 56.05 2e9x n GLN 138 Cb 0.25 -1.44 0.04 0.00 1.02 0.00 0.00 30.24 30.10 2e9x n GLN 138 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 177.06 177.09 2e9x n GLN 139 N -0.05 -3.61 -1.71 -1.09 6.02 -0.41 -4.97 117.38 111.57 2e9x n GLN 139 Ca 0.18 0.60 -0.31 0.00 -0.01 0.00 0.00 57.00 57.46 2e9x n GLN 139 Cb 0.28 -4.97 0.03 0.00 1.02 0.00 0.00 30.24 26.60 2e9x n GLN 139 CO 0.00 0.00 0.00 -1.21 -1.01 0.00 0.00 177.06 174.84 2e9x s GLU 140 N -5.81 3.16 0.00 -1.09 2.02 -0.60 -4.98 118.70 111.40 2e9x s GLU 140 Ca 0.17 0.93 0.00 0.00 0.02 0.00 0.00 54.97 56.09 2e9x s GLU 140 Cb -0.05 -2.02 0.00 0.00 0.10 0.00 0.00 34.13 32.16 2e9x s GLU 140 CO 0.82 -0.92 0.63 0.00 0.02 0.00 0.00 175.26 175.81 2e9x n ALA 141 N -2.89 2.12 -3.55 5.21 0.00 -1.26 -4.93 120.51 115.21 2e9x n ALA 141 Ca 0.07 -0.63 -0.13 0.00 0.00 0.00 0.00 53.44 52.75 2e9x n ALA 141 Cb 0.54 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.93 2e9x n ALA 141 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 2e9x s HIS 142 N -0.33 -0.47 -0.08 0.00 5.65 -1.26 -5.18 115.29 113.63 2e9x s HIS 142 Ca 0.00 0.76 -0.23 0.00 0.25 0.00 0.00 55.06 55.83 2e9x s HIS 142 Cb 0.00 0.45 0.05 0.00 -1.18 0.00 0.00 32.58 31.90 2e9x s HIS 142 CO 0.00 -0.46 0.54 0.00 -0.65 0.00 0.00 174.74 174.18 2e9x s ALA 143 N -1.35 -1.39 -0.12 1.58 0.00 -1.26 -5.15 121.76 114.08 2e9x s ALA 143 Ca -0.04 1.10 -0.05 0.00 0.00 0.00 0.00 51.96 52.97 2e9x s ALA 143 Cb -0.00 -0.22 -0.04 0.00 0.00 0.00 0.00 23.12 22.86 2e9x s ALA 143 CO 0.03 -0.31 0.07 0.21 0.00 0.00 0.00 175.76 175.76 2e9x s LYS 144 N -0.84 3.38 -0.39 0.00 2.20 -1.26 -5.03 119.74 117.81 2e9x s LYS 144 Ca -0.09 -0.29 0.11 0.00 -0.36 0.00 0.00 55.97 55.34 2e9x s LYS 144 Cb -0.03 -3.04 0.34 0.00 -1.51 0.00 0.00 37.83 33.59 2e9x s LYS 144 CO 0.06 0.64 0.76 1.47 -0.36 0.00 0.00 175.35 177.92 2e9x n LEU 145 N 2.39 0.31 0.24 5.43 -0.00 -1.26 -4.98 117.00 119.13 2e9x n LEU 145 Ca -0.19 -4.79 0.08 0.00 -0.00 0.00 0.00 56.01 51.11 2e9x n LEU 145 Cb 0.54 0.74 0.62 0.00 -0.00 0.00 0.00 43.42 45.32 2e9x n LEU 145 CO 0.31 2.24 1.07 0.44 -0.00 0.00 0.00 177.39 181.45 2e9x h ASP 146 N 3.10 0.04 0.04 1.45 3.32 -1.99 -3.07 116.42 119.32 2e9x h ASP 146 Ca 0.07 -0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.12 2e9x h ASP 146 Cb 0.98 -0.01 0.00 0.00 0.22 0.00 0.00 39.33 40.52 2e9x h ASP 146 CO 0.45 0.04 -0.06 0.59 -1.72 0.00 0.00 179.24 178.54 2e9x n ASN 147 N -4.52 1.37 -4.82 6.45 3.02 -1.26 -4.89 115.26 110.60 2e9x n ASN 147 Ca -0.02 -1.35 -0.35 0.00 -0.03 0.00 0.00 54.58 52.83 2e9x n ASN 147 Cb 0.10 0.03 -0.06 0.00 -0.61 0.00 0.00 39.78 39.23 2e9x n ASN 147 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 2e9x s LEU 148 N -2.11 4.23 0.34 3.41 1.43 -1.16 -4.51 118.68 120.30 2e9x s LEU 148 Ca 0.35 1.42 0.03 0.00 -1.03 0.00 0.00 54.13 54.90 2e9x s LEU 148 Cb 0.21 -3.83 -0.02 0.00 0.03 0.00 0.00 46.19 42.57 2e9x s LEU 148 CO 0.38 -0.08 0.51 0.42 0.23 0.00 0.00 176.35 177.82 2e9x s THR 149 N -1.72 4.64 0.25 5.49 -4.23 -1.26 -4.94 115.64 113.87 2e9x s THR 149 Ca 0.48 -0.72 -0.04 0.00 -1.18 0.00 0.00 61.69 60.24 2e9x s THR 149 Cb -0.14 -3.67 0.23 0.00 1.34 0.00 0.00 72.50 70.26 2e9x s THR 149 CO 0.20 -0.36 1.85 0.25 -0.54 0.00 0.00 174.62 176.02 2e9x h LEU 150 N 0.80 0.87 -1.12 4.79 5.85 -1.98 -0.79 115.31 123.73 2e9x h LEU 150 Ca -0.49 0.02 -0.02 0.00 0.84 0.00 0.00 57.88 58.24 2e9x h LEU 150 Cb 1.24 -0.16 -0.03 0.00 0.37 0.00 0.00 40.66 42.08 2e9x h LEU 150 CO 0.58 0.54 0.34 -0.03 -0.34 0.00 0.00 178.44 179.54 2e9x h MET 151 N 1.00 0.96 -0.12 1.25 4.05 -1.95 0.14 114.93 120.26 2e9x h MET 151 Ca 0.40 -0.12 -0.23 0.00 -0.28 0.00 0.00 59.70 59.47 2e9x h MET 151 Cb 0.22 -0.18 0.01 0.00 -0.80 0.00 0.00 31.60 30.85 2e9x h MET 151 CO -0.19 0.73 -0.82 0.93 0.23 0.00 0.00 176.91 177.79 2e9x h GLU 152 N 0.96 0.76 -0.52 0.39 5.08 -1.79 -2.18 114.58 117.29 2e9x h GLU 152 Ca 0.24 -0.66 -0.07 0.00 -1.00 0.00 0.00 59.36 57.86 2e9x h GLU 152 Cb 0.08 0.15 -0.02 0.00 0.50 0.00 0.00 28.75 29.46 2e9x h GLU 152 CO -0.03 1.26 0.03 0.82 -1.00 0.00 0.00 179.01 180.09 2e9x h ILE 153 N 0.48 1.26 -0.14 3.13 2.04 -0.88 -3.23 117.51 120.17 2e9x h ILE 153 Ca -0.07 -1.03 -0.18 0.00 1.00 0.00 0.00 64.86 64.57 2e9x h ILE 153 Cb 1.45 0.91 -0.00 0.00 -0.74 0.00 0.00 36.82 38.44 2e9x h ILE 153 CO 0.17 0.37 -0.67 -1.13 0.00 0.00 0.00 178.15 176.88 2e9x h ASN 154 N 0.76 0.64 -0.80 1.72 -1.24 -0.74 0.57 115.58 116.49 2e9x h ASN 154 Ca 0.15 -0.39 -0.01 0.00 0.71 0.00 0.00 56.30 56.76 2e9x h ASN 154 Cb 0.48 -0.19 -0.04 0.00 0.73 0.00 0.00 38.32 39.30 2e9x h ASN 154 CO 0.02 1.14 0.47 0.74 -1.29 0.00 0.00 177.43 178.50 2e9x h THR 155 N 0.39 1.23 0.00 -3.57 2.02 -1.41 -3.08 112.91 108.50 2e9x h THR 155 Ca -0.02 -0.54 0.00 0.00 0.77 0.00 0.00 66.41 66.62 2e9x h THR 155 Cb 1.25 0.11 0.00 0.00 -1.74 0.00 0.00 68.15 67.77 2e9x h THR 155 CO 0.13 0.25 -0.90 -1.20 0.37 0.00 0.00 175.52 174.16 2e9x n SER 156 N -4.36 0.91 -0.22 4.18 7.64 -1.22 -4.74 113.62 115.81 2e9x n SER 156 Ca 0.09 -0.63 0.02 0.00 1.01 0.00 0.00 58.87 59.36 2e9x n SER 156 Cb 0.08 1.16 0.13 0.00 -1.01 0.00 0.00 64.21 64.57 2e9x n SER 156 CO 0.00 0.00 0.00 1.23 -3.01 0.00 0.00 175.04 173.26 2e9x h GLY 157 N 3.14 0.89 1.12 0.23 0.00 0.26 -2.10 103.07 106.62 2e9x h GLY 157 Ca 0.00 -0.07 -0.08 0.00 0.00 0.00 0.00 47.33 47.18 2e9x h GLY 157 CO 0.00 -0.10 0.09 -0.84 0.00 0.00 0.00 176.54 175.68 2e9x h THR 158 N 0.32 1.26 -0.09 4.70 2.02 -1.81 -2.00 112.91 117.31 2e9x h THR 158 Ca 0.35 -1.04 -0.00 0.00 0.77 0.00 0.00 66.41 66.48 2e9x h THR 158 Cb 0.51 0.67 -0.00 0.00 -1.74 0.00 0.00 68.15 67.59 2e9x h THR 158 CO -0.40 0.39 0.05 0.15 0.37 0.00 0.00 175.52 176.08 2e9x h PHE 159 N 1.00 0.12 -0.30 3.16 3.57 -1.78 -1.15 116.94 121.55 2e9x h PHE 159 Ca 0.20 -0.00 -0.02 0.00 3.53 0.00 0.00 57.97 61.67 2e9x h PHE 159 Cb 0.45 -0.04 -0.01 0.00 2.79 0.00 0.00 35.95 39.14 2e9x h PHE 159 CO 0.03 0.13 0.11 -0.07 -2.23 0.00 0.00 178.31 176.28 2e9x h LEU 160 N 0.07 0.42 -0.63 0.59 3.38 -1.30 -0.85 115.31 116.99 2e9x h LEU 160 Ca 0.03 -0.18 -0.06 0.00 0.09 0.00 0.00 57.88 57.76 2e9x h LEU 160 Cb 0.05 -0.11 -0.03 0.00 0.09 0.00 0.00 40.66 40.66 2e9x h LEU 160 CO -0.01 0.48 0.14 0.71 0.09 0.00 0.00 178.44 179.86 2e9x h THR 161 N 0.33 1.26 -0.44 0.22 1.35 -1.31 0.18 112.91 114.49 2e9x h THR 161 Ca 0.10 -0.95 -0.02 0.00 -0.55 0.00 0.00 66.41 65.00 2e9x h THR 161 Cb 0.20 0.65 -0.02 0.00 -1.73 0.00 0.00 68.15 67.26 2e9x h THR 161 CO -0.01 0.36 0.21 1.56 -0.25 0.00 0.00 175.52 177.39 2e9x h GLN 162 N 0.94 0.64 -0.22 4.72 4.20 -1.08 0.32 115.11 124.63 2e9x h GLN 162 Ca 0.20 -0.10 0.00 0.00 0.06 0.00 0.00 58.65 58.81 2e9x h GLN 162 Cb 0.37 -0.11 -0.01 0.00 0.30 0.00 0.00 27.48 28.03 2e9x h GLN 162 CO 0.00 0.55 0.15 0.00 -0.67 0.00 0.00 178.83 178.87 2e9x h ALA 163 N 1.05 0.28 -0.57 3.87 0.00 -0.84 -1.13 119.26 121.93 2e9x h ALA 163 Ca 0.15 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 55.00 2e9x h ALA 163 Cb 0.13 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 17.80 2e9x h ALA 163 CO -0.02 -0.24 0.19 -0.07 0.00 0.00 0.00 179.25 179.11 2e9x h LEU 164 N 0.30 0.79 -0.75 0.00 3.38 -0.29 -0.36 115.31 118.38 2e9x h LEU 164 Ca 0.08 -0.12 -0.00 0.00 0.09 0.00 0.00 57.88 57.93 2e9x h LEU 164 Cb -0.04 -0.20 -0.04 0.00 0.09 0.00 0.00 40.66 40.47 2e9x h LEU 164 CO -0.02 0.74 0.46 0.78 0.09 0.00 0.00 178.44 180.49 2e9x h ASN 165 N 0.83 0.90 -0.48 -0.43 2.35 0.21 -0.67 115.58 118.29 2e9x h ASN 165 Ca 0.19 -0.06 -0.11 0.00 -0.55 0.00 0.00 56.30 55.77 2e9x h ASN 165 Cb 0.23 -0.23 -0.01 0.00 0.05 0.00 0.00 38.32 38.36 2e9x h ASN 165 CO -0.01 0.69 -0.14 0.45 -1.65 0.00 0.00 177.43 176.77 2e9x h HIS 166 N 1.03 1.06 -0.75 1.19 3.86 -0.55 -2.78 115.15 118.21 2e9x h HIS 166 Ca 0.27 -0.24 -0.03 0.00 -1.16 0.00 0.00 60.37 59.21 2e9x h HIS 166 Cb -0.04 -0.26 -0.03 0.00 1.06 0.00 0.00 27.41 28.14 2e9x h HIS 166 CO -0.01 1.03 0.36 0.52 0.86 0.00 0.00 177.93 180.69 2e9x h MET 167 N 0.79 1.08 -0.80 2.45 2.86 -0.74 -1.40 114.93 119.16 2e9x h MET 167 Ca 0.12 -0.16 0.02 0.00 -2.06 0.00 0.00 59.70 57.62 2e9x h MET 167 Cb 0.70 -0.19 -0.04 0.00 0.06 0.00 0.00 31.60 32.13 2e9x h MET 167 CO 0.05 0.84 0.52 -0.92 1.06 0.00 0.00 176.91 178.47 2e9x h TYR 168 N 1.05 0.98 -0.27 -0.22 3.20 -1.01 0.29 116.97 121.00 2e9x h TYR 168 Ca 0.26 0.02 -0.03 0.00 3.14 0.00 0.00 58.73 62.12 2e9x h TYR 168 Cb 0.12 -0.33 -0.01 0.00 1.54 0.00 0.00 36.73 38.05 2e9x h TYR 168 CO 0.01 0.60 0.06 0.87 -1.64 0.00 0.00 178.16 178.06 2e9x h LYS 169 N 1.05 0.43 -0.41 1.82 1.79 -1.19 -2.40 116.57 117.65 2e9x h LYS 169 Ca 0.30 -0.11 -0.04 0.00 -2.18 0.00 0.00 60.65 58.63 2e9x h LYS 169 Cb -0.07 -0.05 -0.02 0.00 -1.58 0.00 0.00 32.23 30.51 2e9x h LYS 169 CO -0.08 0.53 0.08 -0.07 -1.08 0.00 0.00 179.45 178.83 2e9x h LEU 170 N 0.26 0.57 -1.26 2.94 3.38 -0.66 -1.70 115.31 118.84 2e9x h LEU 170 Ca 0.08 -0.09 -0.04 0.00 0.09 0.00 0.00 57.88 57.92 2e9x h LEU 170 Cb 0.30 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 40.89 2e9x h LEU 170 CO 0.00 0.59 -0.20 -0.09 0.09 0.00 0.00 178.44 178.83 2e9x h ARG 171 N 0.60 0.00 -0.07 1.13 9.65 -0.23 -3.29 114.38 122.18 2e9x h ARG 171 Ca 0.14 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 59.02 2e9x h ARG 171 Cb 0.26 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 28.84 2e9x h ARG 171 CO -0.00 0.20 0.00 0.25 2.80 0.00 0.00 179.97 183.22 2e9x n THR 172 N -3.41 1.33 0.31 0.20 -2.24 -0.90 -4.77 114.28 104.79 2e9x n THR 172 Ca -0.00 -1.40 0.17 0.00 -2.27 0.00 0.00 64.05 60.55 2e9x n THR 172 Cb 0.39 0.25 0.75 0.00 -2.10 0.00 0.00 70.33 69.63 2e9x n THR 172 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 2e9x h ASN 173 N 0.43 0.00 0.01 3.42 7.08 -1.40 -3.19 115.58 121.93 2e9x h ASN 173 Ca 0.00 0.00 -0.40 0.00 -3.08 0.00 0.00 56.30 52.82 2e9x h ASN 173 Cb 0.74 0.00 -0.06 0.00 -2.08 0.00 0.00 38.32 36.91 2e9x h ASN 173 CO 0.02 0.00 -2.41 0.18 -2.08 0.00 0.00 177.43 173.14 2e9x n LEU 174 N -2.80 2.61 0.00 6.14 4.77 -1.26 -5.14 117.00 121.31 2e9x n LEU 174 Ca -0.00 0.05 0.04 0.00 -0.03 0.00 0.00 56.01 56.07 2e9x n LEU 174 Cb 0.21 -0.90 0.24 0.00 -2.33 0.00 0.00 43.42 40.63 2e9x n LEU 174 CO 0.22 0.80 0.46 0.00 -1.33 0.00 0.00 177.39 177.54