#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 5.91 0.32 6.12 1.01 -1.26 -4.98 116.67 123.79 2e9x s ASP 2 Ca 0.00 0.27 0.01 0.00 0.71 0.00 0.00 52.55 53.54 2e9x s ASP 2 Cb 0.00 -1.58 0.54 0.00 1.01 0.00 0.00 42.92 42.89 2e9x s ASP 2 CO 0.00 -0.62 1.91 0.00 0.21 0.00 0.00 175.17 176.67 2e9x h ALA 3 N 0.49 1.38 -0.77 5.23 0.00 -1.99 -1.94 119.26 121.67 2e9x h ALA 3 Ca -0.47 -0.14 0.06 0.00 0.00 0.00 0.00 54.91 54.36 2e9x h ALA 3 Cb 1.25 -0.22 -0.06 0.00 0.00 0.00 0.00 17.79 18.76 2e9x h ALA 3 CO 0.57 0.47 0.46 0.00 0.00 0.00 0.00 179.25 180.75 2e9x h ALA 4 N 1.48 1.04 -0.13 0.00 0.00 -1.99 0.26 119.26 119.92 2e9x h ALA 4 Ca 0.18 0.00 -0.09 0.00 0.00 0.00 0.00 54.91 55.01 2e9x h ALA 4 Cb 0.15 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 2e9x h ALA 4 CO -0.02 0.17 -0.31 0.93 0.00 0.00 0.00 179.25 180.03 2e9x h GLU 5 N 0.84 0.26 -0.30 0.00 5.08 -1.76 -0.16 114.58 118.54 2e9x h GLU 5 Ca 0.34 -0.10 -0.14 0.00 -1.00 0.00 0.00 59.36 58.46 2e9x h GLU 5 Cb 0.17 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.40 2e9x h GLU 5 CO -0.17 0.55 -0.39 0.28 -1.00 0.00 0.00 179.01 178.27 2e9x h VAL 6 N 0.23 1.29 -0.41 3.13 2.07 -0.83 -2.43 116.25 119.29 2e9x h VAL 6 Ca 0.03 -1.57 -0.07 0.00 0.82 0.00 0.00 66.70 65.91 2e9x h VAL 6 Cb 0.66 1.48 -0.02 0.00 -1.52 0.00 0.00 31.29 31.89 2e9x h VAL 6 CO 0.05 0.51 -0.04 -0.08 0.02 0.00 0.00 177.57 178.02 2e9x h GLU 7 N 0.58 0.69 -0.74 1.57 4.81 -0.40 -1.52 114.58 119.58 2e9x h GLU 7 Ca 0.05 -0.19 0.11 0.00 -0.13 0.00 0.00 59.36 59.20 2e9x h GLU 7 Cb 0.93 -0.08 -0.08 0.00 0.63 0.00 0.00 28.75 30.15 2e9x h GLU 7 CO 0.08 0.74 0.35 0.35 -0.73 0.00 0.00 179.01 179.80 2e9x h PHE 8 N 0.64 0.62 -0.19 0.92 3.57 -0.56 0.20 116.94 122.13 2e9x h PHE 8 Ca 0.12 0.03 -0.17 0.00 3.53 0.00 0.00 57.97 61.48 2e9x h PHE 8 Cb 0.47 -0.17 -0.00 0.00 2.79 0.00 0.00 35.95 39.04 2e9x h PHE 8 CO 0.02 0.18 -0.58 -0.07 -2.23 0.00 0.00 178.31 175.63 2e9x h LEU 9 N 0.57 0.70 -1.29 0.59 3.38 -1.18 -3.00 115.31 115.07 2e9x h LEU 9 Ca 0.38 -0.39 -0.03 0.00 0.09 0.00 0.00 57.88 57.93 2e9x h LEU 9 Cb 0.46 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.99 2e9x h LEU 9 CO -0.31 1.13 0.17 0.00 0.09 0.00 0.00 178.44 179.52 2e9x h ALA 10 N 0.88 1.44 0.00 1.53 0.00 -0.13 -2.19 119.26 120.80 2e9x h ALA 10 Ca 0.00 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.78 2e9x h ALA 10 Cb 1.15 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.75 2e9x h ALA 10 CO 0.11 0.42 0.00 0.39 0.00 0.00 0.00 179.25 180.18 2e9x n GLU 11 N -4.35 0.16 0.04 0.00 1.02 0.55 -1.28 120.64 116.78 2e9x n GLU 11 Ca 0.03 0.08 0.11 0.00 -0.02 0.00 0.00 57.16 57.36 2e9x n GLU 11 Cb 0.16 -1.50 0.06 0.00 -0.02 0.00 0.00 31.44 30.14 2e9x n GLU 11 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 2e9x n LYS 12 N -1.09 0.33 -1.88 3.49 5.02 -0.82 -1.99 118.16 121.20 2e9x n LYS 12 Ca 0.04 0.03 -0.39 0.00 -2.02 0.00 0.00 58.31 55.97 2e9x n LYS 12 Cb 0.03 -1.64 0.02 0.00 -0.02 0.00 0.00 35.03 33.42 2e9x n LYS 12 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 2e9x s GLU 13 N -3.21 3.50 0.15 1.97 0.41 -0.41 -4.59 118.70 116.52 2e9x s GLU 13 Ca 0.04 2.22 -0.28 0.00 -0.41 0.00 0.00 54.97 56.54 2e9x s GLU 13 Cb 0.14 -2.47 -0.07 0.00 -1.78 0.00 0.00 34.13 29.95 2e9x s GLU 13 CO 0.78 -0.90 0.87 -0.51 -0.49 0.00 0.00 175.26 175.01 2e9x s LEU 14 N -3.06 4.55 0.13 1.80 1.43 -1.26 -0.73 118.68 121.54 2e9x s LEU 14 Ca 0.65 1.73 0.04 0.00 -1.03 0.00 0.00 54.13 55.53 2e9x s LEU 14 Cb -0.40 -3.46 -0.04 0.00 0.03 0.00 0.00 46.19 42.33 2e9x s LEU 14 CO 0.49 0.07 -0.10 0.54 0.23 0.00 0.00 176.35 177.58 2e9x s VAL 15 N -0.59 1.10 -0.17 -1.59 0.11 -0.31 -4.89 120.40 114.05 2e9x s VAL 15 Ca 0.41 -1.90 -0.07 0.00 -2.93 0.00 0.00 61.98 57.49 2e9x s VAL 15 Cb -0.23 -1.67 -0.04 0.00 -1.53 0.00 0.00 36.38 32.90 2e9x s VAL 15 CO 0.28 -0.67 0.06 -0.89 -3.33 0.00 0.00 175.10 170.56 2e9x s THR 16 N -2.97 4.81 0.27 5.04 2.01 -1.26 -1.17 115.64 122.37 2e9x s THR 16 Ca 0.13 -0.03 0.07 0.00 0.31 0.00 0.00 61.69 62.16 2e9x s THR 16 Cb 0.00 -3.15 -0.06 0.00 0.01 0.00 0.00 72.50 69.31 2e9x s THR 16 CO 0.00 0.49 -0.07 0.27 -0.69 0.00 0.00 174.62 174.62 2e9x s ILE 17 N 0.14 1.68 -0.46 1.82 -4.36 -0.59 -1.59 121.20 117.83 2e9x s ILE 17 Ca 0.05 -2.14 0.01 0.00 -0.26 0.00 0.00 60.65 58.31 2e9x s ILE 17 Cb -0.12 -2.41 0.12 0.00 1.25 0.00 0.00 42.46 41.30 2e9x s ILE 17 CO 0.01 -0.33 0.22 -0.63 0.24 0.00 0.00 174.94 174.44 2e9x s ILE 18 N -2.99 2.89 0.63 8.37 -1.09 -0.06 -2.30 121.20 126.65 2e9x s ILE 18 Ca 0.29 -2.64 -0.15 0.00 -2.23 0.00 0.00 60.65 55.92 2e9x s ILE 18 Cb 0.03 -3.00 -0.02 0.00 -1.58 0.00 0.00 42.46 37.89 2e9x s ILE 18 CO 0.11 -0.73 1.08 -2.16 -1.23 0.00 0.00 174.94 172.01 2e9x s PRO 19 N 0.47 3.06 -0.19 2.79 0.04 -1.26 -1.96 135.00 137.95 2e9x s PRO 19 Ca 0.13 1.24 0.13 0.00 0.04 0.00 0.00 61.00 62.55 2e9x s PRO 19 Cb -0.22 -1.99 0.39 0.00 0.04 0.00 0.00 34.50 32.72 2e9x s PRO 19 CO -0.04 -1.02 1.23 0.27 0.04 0.00 0.00 177.00 177.47 2e9x n ASN 20 N -2.32 2.06 -4.18 6.66 0.23 -0.72 -1.06 115.26 115.93 2e9x n ASN 20 Ca 0.09 -3.61 -0.12 0.00 -0.53 0.00 0.00 54.58 50.41 2e9x n ASN 20 Cb 0.53 -0.51 -0.10 0.00 -2.08 0.00 0.00 39.78 37.62 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 -3.11 1.09 -0.09 -2.53 -0.12 -1.26 -4.85 117.98 107.10 2e9x s PHE 21 Ca 0.37 -1.32 0.00 0.00 -0.05 0.00 0.00 56.93 55.93 2e9x s PHE 21 Cb 0.34 -0.49 -0.03 0.00 -0.63 0.00 0.00 43.02 42.22 2e9x s PHE 21 CO -0.03 -0.67 -0.09 -1.12 -0.05 0.00 0.00 175.22 173.26 2e9x s SER 22 N -3.15 4.43 -0.22 1.98 0.01 -1.26 -2.89 113.70 112.60 2e9x s SER 22 Ca 0.37 -0.13 -0.21 0.00 1.31 0.00 0.00 55.95 57.30 2e9x s SER 22 Cb 0.06 -1.29 0.06 0.00 0.21 0.00 0.00 66.02 65.06 2e9x s SER 22 CO 0.12 0.29 0.59 -0.22 0.41 0.00 0.00 173.24 174.43 2e9x s LEU 23 N -0.38 -0.25 0.56 2.44 2.96 -0.42 -4.98 118.68 118.60 2e9x s LEU 23 Ca 0.05 1.17 -0.17 0.00 -0.22 0.00 0.00 54.13 54.96 2e9x s LEU 23 Cb -0.12 2.03 -0.05 0.00 0.50 0.00 0.00 46.19 48.54 2e9x s LEU 23 CO 0.02 -0.22 1.05 -1.81 -1.32 0.00 0.00 176.35 174.07 2e9x s ASP 24 N 0.26 6.01 -0.30 3.68 1.01 -1.26 -0.34 116.67 125.73 2e9x s ASP 24 Ca -0.00 1.83 -0.40 0.00 0.71 0.00 0.00 52.55 54.69 2e9x s ASP 24 Cb -0.04 -2.54 -0.15 0.00 1.01 0.00 0.00 42.92 41.20 2e9x s ASP 24 CO 0.01 -1.01 1.82 1.17 0.21 0.00 0.00 175.17 177.37 2e9x n LYS 25 N -1.69 1.11 -3.44 8.23 4.81 -1.26 -4.70 118.16 121.22 2e9x n LYS 25 Ca 0.09 0.39 -0.38 0.00 -0.87 0.00 0.00 58.31 57.54 2e9x n LYS 25 Cb 0.53 -2.13 -0.06 0.00 0.02 0.00 0.00 35.03 33.39 2e9x n LYS 25 CO 0.00 0.00 0.00 0.96 1.17 0.00 0.00 177.40 179.53 2e9x s ILE 26 N 4.12 5.03 -0.62 3.15 -4.36 -0.56 -4.93 121.20 123.03 2e9x s ILE 26 Ca 1.01 0.90 -0.13 0.00 -0.26 0.00 0.00 60.65 62.17 2e9x s ILE 26 Cb -1.06 -3.75 0.16 0.00 1.25 0.00 0.00 42.46 39.05 2e9x s ILE 26 CO 0.64 0.52 0.55 -0.31 0.24 0.00 0.00 174.94 176.58 2e9x s TYR 27 N -0.72 3.46 0.08 1.37 1.51 -1.26 -1.46 117.35 120.33 2e9x s TYR 27 Ca 0.25 -1.74 0.01 0.00 -1.01 0.00 0.00 57.07 54.57 2e9x s TYR 27 Cb -0.17 -3.70 -0.04 0.00 -0.11 0.00 0.00 41.96 37.94 2e9x s TYR 27 CO 0.13 -0.99 0.19 -0.51 -1.11 0.00 0.00 175.55 173.26 2e9x s LEU 28 N 0.96 4.21 0.02 -1.29 1.43 -1.17 -5.01 118.68 117.82 2e9x s LEU 28 Ca 0.09 0.17 -0.30 0.00 -1.03 0.00 0.00 54.13 53.07 2e9x s LEU 28 Cb -0.22 -2.82 -0.08 0.00 0.03 0.00 0.00 46.19 43.10 2e9x s LEU 28 CO -0.02 0.15 1.83 -0.63 0.23 0.00 0.00 176.35 177.90 2e9x s ILE 29 N -1.53 3.17 0.00 -0.59 1.01 -1.26 -1.97 121.20 120.03 2e9x s ILE 29 Ca 0.33 0.29 0.00 0.00 0.00 0.00 0.00 60.65 61.28 2e9x s ILE 29 Cb -0.12 -3.19 0.00 0.00 0.01 0.00 0.00 42.46 39.16 2e9x s ILE 29 CO 0.27 -0.02 0.00 0.61 0.00 0.00 0.00 174.94 175.79 2e9x n GLY 30 N 4.34 1.03 0.00 6.18 0.00 -1.26 -5.03 105.19 110.44 2e9x n GLY 30 Ca 0.19 -0.10 0.00 0.00 0.00 0.00 0.00 46.02 46.10 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 -1.99 4.13 3.79 -0.02 0.00 -0.83 -5.09 105.19 105.18 2e9x n GLY 31 Ca 0.00 -1.20 -0.39 0.00 0.00 0.00 0.00 46.02 44.43 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 7.27 0.19 1.61 1.01 -1.26 -3.07 116.67 122.42 2e9x s ASP 32 Ca 0.00 1.50 0.11 0.00 0.71 0.00 0.00 52.55 54.88 2e9x s ASP 32 Cb 0.00 -2.45 -0.04 0.00 1.01 0.00 0.00 42.92 41.44 2e9x s ASP 32 CO 0.00 0.23 -0.23 -0.76 0.21 0.00 0.00 175.17 174.62 2e9x s LEU 33 N -1.11 2.46 0.00 1.23 1.43 -0.53 -4.98 118.68 117.17 2e9x s LEU 33 Ca 0.33 -0.85 0.00 0.00 -1.03 0.00 0.00 54.13 52.58 2e9x s LEU 33 Cb -0.22 -1.19 0.00 0.00 0.03 0.00 0.00 46.19 44.81 2e9x s LEU 33 CO 0.24 0.12 0.00 0.61 0.23 0.00 0.00 176.35 177.55 2e9x n GLY 34 N 0.26 -0.81 3.54 -3.19 0.00 -1.26 -1.49 105.19 102.24 2e9x n GLY 34 Ca -0.12 -1.17 -0.33 0.00 0.00 0.00 0.00 46.02 44.39 2e9x n GLY 34 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2e9x n PRO 35 N 0.00 -0.14 -4.07 1.61 -0.02 -1.26 -4.82 135.00 126.29 2e9x n PRO 35 Ca 0.00 0.02 -0.34 0.00 -2.02 0.00 0.00 63.50 61.15 2e9x n PRO 35 Cb 0.00 -2.10 -0.10 0.00 -0.02 0.00 0.00 33.50 31.28 2e9x n PRO 35 CO 0.00 0.00 0.00 -0.06 1.98 0.00 0.00 175.50 177.42 2e9x s PHE 36 N -2.32 3.21 -0.01 6.00 0.40 0.53 -4.92 117.98 120.86 2e9x s PHE 36 Ca 0.64 -0.00 0.02 0.00 -0.60 0.00 0.00 56.93 56.98 2e9x s PHE 36 Cb -0.25 -2.06 0.00 0.00 0.51 0.00 0.00 43.02 41.22 2e9x s PHE 36 CO 0.60 0.11 -0.05 -0.80 0.70 0.00 0.00 175.22 175.78 2e9x s ASN 37 N 0.39 0.71 0.22 1.36 0.01 -1.25 -1.30 114.94 115.07 2e9x s ASN 37 Ca 0.02 -0.10 -0.31 0.00 -0.71 0.00 0.00 52.86 51.75 2e9x s ASN 37 Cb -0.13 -0.15 -0.15 0.00 0.41 0.00 0.00 41.25 41.23 2e9x s ASN 37 CO 0.01 0.04 1.14 -2.65 -1.51 0.00 0.00 177.10 174.13 2e9x n PRO 38 N 3.22 1.34 -0.65 -0.60 -0.02 -1.14 -1.72 135.00 135.42 2e9x n PRO 38 Ca -0.16 0.47 0.00 0.00 -2.02 0.00 0.00 63.50 61.79 2e9x n PRO 38 Cb 0.56 -1.95 0.00 0.00 -0.02 0.00 0.00 33.50 32.09 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 1.79 0.30 3.66 -1.23 0.00 -0.22 -4.97 105.19 104.51 2e9x n GLY 39 Ca 0.13 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.80 2e9x n GLY 39 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2e9x s LEU 40 N 0.00 3.63 0.23 0.99 1.43 -0.70 -4.97 118.68 119.29 2e9x s LEU 40 Ca 0.00 0.11 -0.30 0.00 -1.03 0.00 0.00 54.13 52.91 2e9x s LEU 40 Cb 0.00 -1.86 -0.10 0.00 0.03 0.00 0.00 46.19 44.26 2e9x s LEU 40 CO 0.00 0.30 1.44 -2.84 0.23 0.00 0.00 176.35 175.48 2e9x s PRO 41 N -0.43 4.28 -0.13 1.29 0.02 -1.26 -4.14 135.00 134.63 2e9x s PRO 41 Ca 0.08 2.27 -0.10 0.00 0.02 0.00 0.00 61.00 63.27 2e9x s PRO 41 Cb -0.12 -3.13 0.04 0.00 0.02 0.00 0.00 34.50 31.31 2e9x s PRO 41 CO 0.02 -0.42 0.33 0.54 -0.33 0.00 0.00 177.00 177.14 2e9x s VAL 42 N 0.18 -0.01 -0.07 3.83 0.11 -0.97 -4.98 120.40 118.49 2e9x s VAL 42 Ca 0.60 0.03 -0.23 0.00 -2.93 0.00 0.00 61.98 59.46 2e9x s VAL 42 Cb -0.41 -0.48 -0.04 0.00 -1.53 0.00 0.00 36.38 33.92 2e9x s VAL 42 CO 0.41 0.01 0.67 -1.61 -3.33 0.00 0.00 175.10 171.26 2e9x s GLU 43 N 0.47 4.43 0.09 1.54 2.02 -1.26 -1.54 118.70 124.45 2e9x s GLU 43 Ca -0.02 0.83 -0.02 0.00 0.02 0.00 0.00 54.97 55.78 2e9x s GLU 43 Cb -0.04 -3.44 -0.03 0.00 0.10 0.00 0.00 34.13 30.72 2e9x s GLU 43 CO -0.02 0.09 0.05 0.14 0.02 0.00 0.00 175.26 175.54 2e9x s VAL 44 N 0.72 0.16 0.41 2.63 -7.23 -0.31 -4.67 120.40 112.11 2e9x s VAL 44 Ca 0.36 -1.74 -0.26 0.00 -1.81 0.00 0.00 61.98 58.53 2e9x s VAL 44 Cb -0.18 -1.71 -0.09 0.00 0.56 0.00 0.00 36.38 34.96 2e9x s VAL 44 CO 0.17 -0.72 1.37 -2.84 -0.31 0.00 0.00 175.10 172.78 2e9x s PRO 45 N -3.96 3.94 0.42 4.82 0.02 -1.26 -1.16 135.00 137.81 2e9x s PRO 45 Ca 0.14 2.31 0.18 0.00 0.02 0.00 0.00 61.00 63.65 2e9x s PRO 45 Cb 0.07 -2.79 1.10 0.00 0.02 0.00 0.00 34.50 32.91 2e9x s PRO 45 CO -0.05 -0.57 1.82 1.25 -0.33 0.00 0.00 177.00 179.12 2e9x h LEU 46 N 2.69 0.41 -1.05 -5.54 5.85 -0.48 0.43 115.31 117.61 2e9x h LEU 46 Ca -0.50 0.05 -0.08 0.00 0.84 0.00 0.00 57.88 58.19 2e9x h LEU 46 Cb 1.25 -0.02 -0.01 0.00 0.37 0.00 0.00 40.66 42.25 2e9x h LEU 46 CO 0.63 0.13 -0.22 4.11 -0.34 0.00 0.00 178.44 182.75 2e9x h TRP 47 N 0.39 0.45 -0.08 1.25 5.08 -1.70 -1.51 115.95 119.84 2e9x h TRP 47 Ca 0.52 -0.08 -0.08 0.00 1.08 0.00 0.00 58.89 60.32 2e9x h TRP 47 Cb 1.33 -0.12 0.00 0.00 -3.00 0.00 0.00 29.16 27.37 2e9x h TRP 47 CO -0.00 0.61 -0.28 1.25 -1.28 0.00 0.00 178.44 178.73 2e9x h LEU 48 N 0.37 0.38 -0.85 0.11 5.85 -1.24 -2.45 115.31 117.47 2e9x h LEU 48 Ca 0.06 -0.63 0.13 0.00 0.84 0.00 0.00 57.88 58.28 2e9x h LEU 48 Cb 0.59 -0.11 -0.09 0.00 0.37 0.00 0.00 40.66 41.43 2e9x h LEU 48 CO 0.04 0.94 0.46 0.00 -0.34 0.00 0.00 178.44 179.54 2e9x h ALA 49 N 0.45 1.27 -0.35 1.25 0.00 -1.18 0.16 119.26 120.87 2e9x h ALA 49 Ca -0.01 0.07 -0.15 0.00 0.00 0.00 0.00 54.91 54.81 2e9x h ALA 49 Cb 0.92 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.64 2e9x h ALA 49 CO 0.06 -0.02 -0.38 0.82 0.00 0.00 0.00 179.25 179.73 2e9x h ILE 50 N 0.69 1.28 0.07 0.00 1.08 -1.27 -1.21 117.51 118.15 2e9x h ILE 50 Ca 0.45 -1.56 -0.00 0.00 -0.39 0.00 0.00 64.86 63.36 2e9x h ILE 50 Cb 0.57 1.42 0.00 0.00 -3.07 0.00 0.00 36.82 35.74 2e9x h ILE 50 CO -0.32 0.51 -0.03 -1.13 -0.69 0.00 0.00 178.15 176.48 2e9x h ASN 51 N 0.68 -0.08 -0.68 1.72 -1.24 -0.74 -2.14 115.58 113.10 2e9x h ASN 51 Ca 0.06 -0.37 0.06 0.00 0.71 0.00 0.00 56.30 56.76 2e9x h ASN 51 Cb 0.95 0.02 -0.06 0.00 0.73 0.00 0.00 38.32 39.96 2e9x h ASN 51 CO 0.09 0.34 0.37 -0.07 -1.29 0.00 0.00 177.43 176.87 2e9x h LEU 52 N -0.51 0.55 -0.52 0.34 3.38 -0.76 -0.77 115.31 117.00 2e9x h LEU 52 Ca -0.01 0.03 0.09 0.00 0.09 0.00 0.00 57.88 58.09 2e9x h LEU 52 Cb 0.44 -0.07 -0.08 0.00 0.09 0.00 0.00 40.66 41.05 2e9x h LEU 52 CO 0.02 0.35 0.08 0.50 0.09 0.00 0.00 178.44 179.47 2e9x h LYS 53 N 0.68 0.20 0.00 1.13 1.63 -1.15 0.16 116.57 119.22 2e9x h LYS 53 Ca 0.31 -0.01 -0.04 0.00 -0.85 0.00 0.00 60.65 60.06 2e9x h LYS 53 Cb 0.22 -0.05 -0.01 0.00 -0.60 0.00 0.00 32.23 31.79 2e9x h LYS 53 CO -0.20 0.14 -0.19 1.96 -3.45 0.00 0.00 179.45 177.71 2e9x h GLN 54 N 0.21 0.00 -0.08 1.90 4.20 -0.57 -0.23 115.11 120.55 2e9x h GLN 54 Ca 0.27 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.98 2e9x h GLN 54 Cb 0.38 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.16 2e9x h GLN 54 CO -0.37 0.19 0.00 0.54 -0.67 0.00 0.00 178.83 178.52 2e9x n ARG 55 N -3.78 1.35 -3.73 1.46 1.74 0.47 -4.90 116.66 109.26 2e9x n ARG 55 Ca -0.02 -0.53 -0.22 0.00 -0.77 0.00 0.00 57.85 56.31 2e9x n ARG 55 Cb 0.29 -1.35 0.03 0.00 -1.02 0.00 0.00 32.46 30.42 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 -0.26 -4.92 0.00 5.56 6.02 -0.10 -4.88 117.38 118.80 2e9x n GLN 56 Ca 0.15 0.61 0.00 0.00 -0.01 0.00 0.00 57.00 57.75 2e9x n GLN 56 Cb 0.19 -5.19 0.00 0.00 1.02 0.00 0.00 30.24 26.27 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 -4.33 1.89 -3.67 -1.09 5.02 -0.66 -4.97 118.16 110.34 2e9x n LYS 57 Ca -0.26 -1.18 -0.01 0.00 -2.02 0.00 0.00 58.31 54.83 2e9x n LYS 57 Cb 0.66 -0.95 -0.01 0.00 -0.02 0.00 0.00 35.03 34.71 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 -2.79 1.78 0.14 0.00 1.81 -0.83 -4.58 118.95 114.47 2e9x s ARG 59 Ca 0.13 -0.60 -0.20 0.00 -1.72 0.00 0.00 55.73 53.34 2e9x s ARG 59 Cb 0.02 -1.54 -0.07 0.00 -0.45 0.00 0.00 34.95 32.90 2e9x s ARG 59 CO -0.01 0.24 0.65 -0.51 -0.68 0.00 0.00 175.30 174.99 2e9x s LEU 60 N 0.05 4.47 -0.15 2.53 1.43 -1.26 -0.89 118.68 124.86 2e9x s LEU 60 Ca -0.04 1.36 -0.07 0.00 -1.03 0.00 0.00 54.13 54.35 2e9x s LEU 60 Cb -0.12 -3.20 -0.04 0.00 0.03 0.00 0.00 46.19 42.86 2e9x s LEU 60 CO 0.02 0.18 0.10 -0.76 0.23 0.00 0.00 176.35 176.12 2e9x s LEU 61 N -1.44 4.10 0.29 1.79 1.43 -0.62 -4.82 118.68 119.41 2e9x s LEU 61 Ca 0.35 0.27 -0.29 0.00 -1.03 0.00 0.00 54.13 53.43 2e9x s LEU 61 Cb -0.19 -2.02 -0.10 0.00 0.03 0.00 0.00 46.19 43.91 2e9x s LEU 61 CO 0.21 0.29 1.45 -2.84 0.23 0.00 0.00 176.35 175.69 2e9x s PRO 62 N -0.31 4.23 0.67 1.29 0.02 -1.26 -4.54 135.00 135.10 2e9x s PRO 62 Ca 0.10 2.38 -0.17 0.00 0.02 0.00 0.00 61.00 63.33 2e9x s PRO 62 Cb -0.12 -3.06 0.00 0.00 0.02 0.00 0.00 34.50 31.34 2e9x s PRO 62 CO 0.01 -0.44 1.26 -2.14 -0.33 0.00 0.00 177.00 175.37 2e9x s PRO 63 N -0.94 2.44 0.41 5.54 0.02 -1.26 -4.86 135.00 136.35 2e9x s PRO 63 Ca 0.57 1.96 0.12 0.00 0.02 0.00 0.00 61.00 63.67 2e9x s PRO 63 Cb -0.43 -1.85 0.96 0.00 0.02 0.00 0.00 34.50 33.20 2e9x s PRO 63 CO 0.49 -1.65 1.96 1.49 -0.33 0.00 0.00 177.00 178.96 2e9x h GLU 64 N 0.30 0.49 0.00 5.54 4.81 -2.02 -1.69 114.58 122.01 2e9x h GLU 64 Ca -0.50 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 58.70 2e9x h GLU 64 Cb 1.32 -0.11 0.00 0.00 0.63 0.00 0.00 28.75 30.59 2e9x h GLU 64 CO 0.52 0.32 0.00 0.11 -0.73 0.00 0.00 179.01 179.23 2e9x h TRP 65 N 0.50 0.00 0.00 0.92 5.08 -1.95 -3.36 115.95 117.14 2e9x h TRP 65 Ca 0.30 0.00 -0.66 0.00 1.08 0.00 0.00 58.89 59.61 2e9x h TRP 65 Cb 0.52 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.68 2e9x h TRP 65 CO -0.00 0.00 3.36 -0.12 -1.28 0.00 0.00 178.44 180.40 2e9x n MET 66 N -3.05 3.08 -4.49 0.12 1.56 -0.64 -4.50 117.12 109.20 2e9x n MET 66 Ca 0.02 -2.29 -0.21 0.00 -0.27 0.00 0.00 57.70 54.95 2e9x n MET 66 Cb 0.39 -2.99 -0.15 0.00 2.15 0.00 0.00 33.22 32.62 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 2.88 1.40 0.12 6.12 -1.08 -1.26 -4.83 116.67 120.02 2e9x s ASP 67 Ca 0.57 -0.22 -0.32 0.00 -0.52 0.00 0.00 52.55 52.06 2e9x s ASP 67 Cb 0.15 -0.32 -0.10 0.00 -1.46 0.00 0.00 42.92 41.20 2e9x s ASP 67 CO -0.06 0.10 1.56 0.58 0.52 0.00 0.00 175.17 177.87 2e9x h VAL 68 N 5.23 0.04 -0.33 1.11 2.07 -1.91 0.11 116.25 122.57 2e9x h VAL 68 Ca -0.33 0.00 0.06 0.00 0.82 0.00 0.00 66.70 67.25 2e9x h VAL 68 Cb 1.17 0.04 -0.05 0.00 -1.52 0.00 0.00 31.29 30.93 2e9x h VAL 68 CO 0.49 0.00 -0.01 -0.33 0.02 0.00 0.00 177.57 177.74 2e9x h GLU 69 N -0.54 0.08 -0.69 1.57 4.39 -1.98 -0.59 114.58 116.83 2e9x h GLU 69 Ca 0.05 -0.00 -0.00 0.00 0.34 0.00 0.00 59.36 59.74 2e9x h GLU 69 Cb 0.66 -0.02 -0.03 0.00 -0.10 0.00 0.00 28.75 29.26 2e9x h GLU 69 CO -0.44 0.05 0.41 0.87 -1.16 0.00 0.00 179.01 178.75 2e9x h LYS 70 N 0.08 0.93 -0.33 2.33 1.57 -1.81 -2.61 116.57 116.74 2e9x h LYS 70 Ca 0.16 -0.09 -0.07 0.00 -1.87 0.00 0.00 60.65 58.78 2e9x h LYS 70 Cb 0.22 -0.20 -0.02 0.00 0.08 0.00 0.00 32.23 32.32 2e9x h LYS 70 CO -0.28 0.66 -0.11 -0.07 -0.57 0.00 0.00 179.45 179.08 2e9x h LEU 71 N 0.93 0.54 -0.63 2.94 3.38 -0.25 -1.92 115.31 120.31 2e9x h LEU 71 Ca 0.25 -0.14 -0.04 0.00 0.09 0.00 0.00 57.88 58.03 2e9x h LEU 71 Cb -0.03 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 40.55 2e9x h LEU 71 CO -0.05 0.69 0.22 -0.33 0.09 0.00 0.00 178.44 179.07 2e9x h GLU 72 N 0.51 0.96 -0.46 1.13 5.08 -0.78 -1.20 114.58 119.82 2e9x h GLU 72 Ca 0.09 -0.19 -0.10 0.00 -1.00 0.00 0.00 59.36 58.16 2e9x h GLU 72 Cb 0.51 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.59 2e9x h GLU 72 CO 0.03 0.83 -0.12 0.87 -1.00 0.00 0.00 179.01 179.62 2e9x h LYS 73 N 0.89 0.90 -0.30 2.33 1.57 -1.19 -1.23 116.57 119.54 2e9x h LYS 73 Ca 0.21 -0.35 -0.00 0.00 -1.87 0.00 0.00 60.65 58.64 2e9x h LYS 73 Cb 0.25 -0.05 -0.01 0.00 0.08 0.00 0.00 32.23 32.50 2e9x h LYS 73 CO -0.01 0.99 0.17 0.52 -0.57 0.00 0.00 179.45 180.55 2e9x h MET 74 N 0.74 0.42 -0.69 3.15 2.86 -1.17 0.21 114.93 120.45 2e9x h MET 74 Ca 0.12 -0.04 0.01 0.00 -2.06 0.00 0.00 59.70 57.72 2e9x h MET 74 Cb 0.67 -0.08 -0.04 0.00 0.06 0.00 0.00 31.60 32.21 2e9x h MET 74 CO 0.05 0.34 0.45 -0.09 1.06 0.00 0.00 176.91 178.72 2e9x h ARG 75 N 0.38 0.89 -0.53 1.72 1.12 -1.13 0.32 114.38 117.15 2e9x h ARG 75 Ca 0.11 -0.05 -0.04 0.00 -1.11 0.00 0.00 59.98 58.88 2e9x h ARG 75 Cb 0.04 -0.20 -0.02 0.00 -0.01 0.00 0.00 29.97 29.78 2e9x h ARG 75 CO -0.02 0.59 0.17 -0.44 -3.11 0.00 0.00 179.97 177.16 2e9x h ASP 76 N 0.91 0.77 -0.79 -3.80 3.32 -0.75 -2.65 116.42 113.44 2e9x h ASP 76 Ca 0.26 -0.20 -0.00 0.00 0.02 0.00 0.00 57.03 57.10 2e9x h ASP 76 Cb -0.09 -0.20 -0.04 0.00 0.22 0.00 0.00 39.33 39.22 2e9x h ASP 76 CO -0.06 0.77 0.47 -0.74 -1.72 0.00 0.00 179.24 177.96 2e9x h HIS 77 N 0.73 1.04 -0.78 4.55 2.76 -0.05 -2.68 115.15 120.71 2e9x h HIS 77 Ca 0.17 -0.00 0.05 0.00 -2.20 0.00 0.00 60.37 58.39 2e9x h HIS 77 Cb 0.27 -0.34 -0.06 0.00 1.55 0.00 0.00 27.41 28.84 2e9x h HIS 77 CO 0.02 0.69 0.48 1.49 -1.30 0.00 0.00 177.93 179.31 2e9x h GLU 78 N 1.08 0.87 -0.76 5.26 4.57 -0.63 -2.63 114.58 122.33 2e9x h GLU 78 Ca 0.28 -0.05 -0.01 0.00 -1.18 0.00 0.00 59.36 58.40 2e9x h GLU 78 Cb -0.04 -0.20 -0.04 0.00 -0.16 0.00 0.00 28.75 28.32 2e9x h GLU 78 CO -0.05 0.57 0.45 0.00 -1.18 0.00 0.00 179.01 178.80 2e9x h ARG 79 N 0.89 1.04 0.00 1.92 3.08 -1.15 -2.75 114.38 117.41 2e9x h ARG 79 Ca 0.33 -0.10 0.00 0.00 0.07 0.00 0.00 59.98 60.28 2e9x h ARG 79 Cb 0.13 -0.21 0.00 0.00 0.08 0.00 0.00 29.97 29.96 2e9x h ARG 79 CO -0.16 0.74 0.00 0.87 -1.07 0.00 0.00 179.97 180.36 2e9x h LYS 80 N 1.04 0.00 -5.74 0.04 1.57 -1.34 -3.44 116.57 108.70 2e9x h LYS 80 Ca 0.27 0.00 -0.65 0.00 -1.87 0.00 0.00 60.65 58.40 2e9x h LYS 80 Cb -0.02 0.00 -0.06 0.00 0.08 0.00 0.00 32.23 32.23 2e9x h LYS 80 CO -0.05 0.00 -0.43 -1.21 -0.57 0.00 0.00 179.45 177.19 2e9x s GLU 81 N -3.35 3.52 0.13 3.15 0.41 -1.04 -5.00 118.70 116.53 2e9x s GLU 81 Ca 0.04 -0.07 -0.02 0.00 -0.41 0.00 0.00 54.97 54.51 2e9x s GLU 81 Cb 0.09 -3.17 -0.09 0.00 -1.78 0.00 0.00 34.13 29.18 2e9x s GLU 81 CO 0.41 0.74 1.31 0.93 -0.49 0.00 0.00 175.26 178.16 2e9x h GLU 82 N 4.69 0.32 0.00 1.61 5.08 -1.86 -3.46 114.58 120.97 2e9x h GLU 82 Ca -0.53 -0.37 -0.37 0.00 -1.00 0.00 0.00 59.36 57.09 2e9x h GLU 82 Cb 1.22 0.11 0.02 0.00 0.50 0.00 0.00 28.75 30.60 2e9x h GLU 82 CO 0.61 1.07 -0.05 0.25 -1.00 0.00 0.00 179.01 179.89 2e9x n THR 83 N -3.69 0.00 -2.92 1.13 -2.24 -1.26 -5.04 114.28 100.26 2e9x n THR 83 Ca -0.06 -1.46 -0.40 0.00 -2.27 0.00 0.00 64.05 59.86 2e9x n THR 83 Cb 0.85 -0.64 -0.05 0.00 -2.10 0.00 0.00 70.33 68.38 2e9x n THR 83 CO 0.00 0.00 0.00 -0.36 -0.57 0.00 0.00 175.07 174.14 2e9x s PHE 84 N -1.72 3.85 0.29 4.78 0.40 -1.26 -5.03 117.98 119.28 2e9x s PHE 84 Ca 0.46 1.64 -0.01 0.00 -0.60 0.00 0.00 56.93 58.42 2e9x s PHE 84 Cb -0.04 -2.85 -0.04 0.00 0.51 0.00 0.00 43.02 40.60 2e9x s PHE 84 CO 0.29 0.38 0.51 0.95 0.70 0.00 0.00 175.22 178.06 2e9x s THR 85 N -0.63 5.10 0.17 0.64 -4.23 -1.26 -4.49 115.64 110.94 2e9x s THR 85 Ca 0.39 -0.28 -0.32 0.00 -1.18 0.00 0.00 61.69 60.30 2e9x s THR 85 Cb -0.23 -3.79 -0.12 0.00 1.34 0.00 0.00 72.50 69.70 2e9x s THR 85 CO 0.26 -0.40 1.76 -2.65 -0.54 0.00 0.00 174.62 173.06 2e9x n PRO 86 N -1.26 2.73 -2.42 3.99 -0.02 -1.26 -4.84 135.00 131.92 2e9x n PRO 86 Ca -0.04 0.99 -0.27 0.00 -2.02 0.00 0.00 63.50 62.16 2e9x n PRO 86 Cb 0.55 -2.85 0.02 0.00 -0.02 0.00 0.00 33.50 31.20 2e9x n PRO 86 CO 0.00 0.00 0.00 -1.64 1.98 0.00 0.00 175.50 175.84 2e9x s MET 87 N 1.79 3.15 0.50 -0.52 -1.94 -1.26 -4.97 119.30 116.05 2e9x s MET 87 Ca 0.78 0.11 0.22 0.00 -1.71 0.00 0.00 55.69 55.09 2e9x s MET 87 Cb -0.51 -2.29 1.30 0.00 2.01 0.00 0.00 34.83 35.35 2e9x s MET 87 CO 0.35 -0.55 2.06 -1.35 -0.01 0.00 0.00 175.02 175.52 2e9x h PRO 88 N -0.08 0.00 -3.05 2.03 0.11 -1.98 -3.44 132.00 125.59 2e9x h PRO 88 Ca -0.46 0.00 -0.11 0.00 0.11 0.00 0.00 66.00 65.54 2e9x h PRO 88 Cb 1.24 0.00 -0.20 0.00 0.11 0.00 0.00 31.00 32.15 2e9x h PRO 88 CO 0.61 0.13 -0.27 0.45 -0.21 0.00 0.00 178.00 178.72 2e9x s SER 89 N -6.53 -0.19 0.13 -2.05 0.15 -1.26 -5.01 113.70 98.94 2e9x s SER 89 Ca -0.04 0.06 0.18 0.00 0.70 0.00 0.00 55.95 56.85 2e9x s SER 89 Cb 0.15 0.32 0.77 0.00 -1.71 0.00 0.00 66.02 65.55 2e9x s SER 89 CO 0.63 -0.47 1.56 -2.65 1.20 0.00 0.00 173.24 173.51 2e9x n PRO 90 N 1.19 0.09 -2.73 5.44 -0.02 -1.26 -2.93 135.00 134.78 2e9x n PRO 90 Ca -0.21 0.36 -0.14 0.00 -2.02 0.00 0.00 63.50 61.49 2e9x n PRO 90 Cb 0.56 -1.69 0.01 0.00 -0.02 0.00 0.00 33.50 32.37 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 -1.87 1.51 0.05 6.00 4.02 -1.26 -4.19 117.16 121.43 2e9x n TYR 91 Ca 0.02 -3.07 -0.01 0.00 -0.01 0.00 0.00 57.90 54.84 2e9x n TYR 91 Cb 0.18 -0.34 0.27 0.00 -0.02 0.00 0.00 39.34 39.43 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 2.93 0.42 -0.41 -0.72 -0.00 -1.93 -0.68 116.97 116.58 2e9x h TYR 92 Ca 0.01 -0.07 -0.14 0.00 0.00 0.00 0.00 58.73 58.53 2e9x h TYR 92 Cb 1.07 -0.11 -0.01 0.00 0.00 0.00 0.00 36.73 37.68 2e9x h TYR 92 CO 0.56 0.57 -0.29 0.52 -0.00 0.00 0.00 178.16 179.53 2e9x h MET 93 N 0.35 0.92 -0.13 0.10 2.86 -1.91 -2.17 114.93 114.95 2e9x h MET 93 Ca 0.06 -0.44 -0.08 0.00 -2.06 0.00 0.00 59.70 57.18 2e9x h MET 93 Cb 0.56 -0.01 -0.00 0.00 0.06 0.00 0.00 31.60 32.21 2e9x h MET 93 CO 0.04 1.10 -0.22 0.93 1.06 0.00 0.00 176.91 179.82 2e9x h GLU 94 N 0.75 0.38 -0.64 1.72 3.07 -1.90 -0.94 114.58 117.02 2e9x h GLU 94 Ca 0.08 -0.23 -0.05 0.00 -0.50 0.00 0.00 59.36 58.65 2e9x h GLU 94 Cb 0.87 0.02 -0.03 0.00 -0.84 0.00 0.00 28.75 28.77 2e9x h GLU 94 CO 0.08 0.82 0.18 -0.07 -1.40 0.00 0.00 179.01 178.62 2e9x h LEU 95 N -0.02 0.91 -0.14 1.33 4.07 -1.18 0.35 115.31 120.63 2e9x h LEU 95 Ca 0.01 -0.16 -0.03 0.00 0.08 0.00 0.00 57.88 57.78 2e9x h LEU 95 Cb 0.79 -0.24 -0.00 0.00 1.08 0.00 0.00 40.66 42.29 2e9x h LEU 95 CO 0.05 0.87 -0.02 0.74 -1.08 0.00 0.00 178.44 179.00 2e9x h THR 96 N 0.94 1.28 0.37 0.22 2.02 -1.38 -1.01 112.91 115.34 2e9x h THR 96 Ca 0.21 -0.93 -0.01 0.00 0.77 0.00 0.00 66.41 66.45 2e9x h THR 96 Cb 0.29 1.60 -0.01 0.00 -1.74 0.00 0.00 68.15 68.30 2e9x h THR 96 CO -0.01 0.27 -0.24 0.50 0.37 0.00 0.00 175.52 176.41 2e9x h LYS 97 N -0.02 -0.57 -0.65 6.66 3.11 -0.90 -1.50 116.57 122.69 2e9x h LYS 97 Ca 0.04 0.04 -0.05 0.00 -2.81 0.00 0.00 60.65 57.86 2e9x h LYS 97 Cb 0.43 0.13 -0.03 0.00 -1.00 0.00 0.00 32.23 31.76 2e9x h LYS 97 CO 0.01 -0.38 0.20 -0.07 -2.81 0.00 0.00 179.45 176.40 2e9x h LEU 98 N -0.60 0.96 -0.84 5.20 3.38 -0.98 -1.38 115.31 121.06 2e9x h LEU 98 Ca -0.04 -0.21 -0.11 0.00 0.09 0.00 0.00 57.88 57.61 2e9x h LEU 98 Cb 0.50 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.98 2e9x h LEU 98 CO 0.03 0.91 -0.32 -0.07 0.09 0.00 0.00 178.44 179.09 2e9x h LEU 99 N 0.95 0.51 0.00 1.67 4.07 -1.14 -1.74 115.31 119.63 2e9x h LEU 99 Ca 0.21 -0.19 -0.16 0.00 0.08 0.00 0.00 57.88 57.82 2e9x h LEU 99 Cb 0.30 -0.14 -0.02 0.00 1.08 0.00 0.00 40.66 41.88 2e9x h LEU 99 CO -0.01 0.80 -0.80 -0.07 -1.08 0.00 0.00 178.44 177.29 2e9x h LEU 100 N 0.43 0.00 0.00 1.67 3.38 -1.19 0.88 115.31 120.48 2e9x h LEU 100 Ca 0.05 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.00 2e9x h LEU 100 Cb 0.76 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.51 2e9x h LEU 100 CO 0.06 0.73 -0.33 0.78 0.09 0.00 0.00 178.44 179.77 2e9x h ASN 101 N 0.00 0.00 0.00 -0.43 4.21 -1.13 -3.22 115.58 115.02 2e9x h ASN 101 Ca -0.02 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.49 2e9x h ASN 101 Cb 1.58 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 38.78 2e9x h ASN 101 CO 0.09 0.11 0.00 1.41 -1.29 0.00 0.00 177.43 177.75 2e9x n HIS 102 N -3.03 0.00 -2.41 1.19 8.25 -0.67 -4.86 115.22 113.69 2e9x n HIS 102 Ca 0.02 0.00 -0.02 0.00 -0.26 0.00 0.00 57.72 57.46 2e9x n HIS 102 Cb 0.58 0.00 0.02 0.00 1.12 0.00 0.00 29.99 31.71 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 -0.66 3.02 0.20 -1.41 0.00 0.25 -4.91 120.51 117.00 2e9x n ALA 103 Ca 0.00 -1.52 0.10 0.00 0.00 0.00 0.00 53.44 52.02 2e9x n ALA 103 Cb 0.00 -0.63 0.64 0.00 0.00 0.00 0.00 19.45 19.46 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 0.90 0.02 0.11 0.00 4.64 -1.42 0.39 113.55 118.20 2e9x h SER 104 Ca -0.39 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.93 2e9x h SER 104 Cb 1.49 -0.01 0.00 0.00 -0.31 0.00 0.00 62.40 63.58 2e9x h SER 104 CO -0.09 0.02 0.00 -0.90 -0.87 0.00 0.00 176.83 174.99 2e9x n ASP 105 N -4.51 0.00 -0.00 4.97 5.75 -1.26 -1.55 116.55 119.95 2e9x n ASP 105 Ca -0.00 -0.35 0.04 0.00 -0.01 0.00 0.00 54.79 54.46 2e9x n ASP 105 Cb 0.18 -0.10 -0.04 0.00 -1.03 0.00 0.00 41.12 40.13 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 -1.10 0.37 -4.54 -1.12 5.03 0.13 -4.95 115.26 109.07 2e9x n ASN 106 Ca 0.12 -0.68 -0.37 0.00 0.87 0.00 0.00 54.58 54.51 2e9x n ASN 106 Cb 0.09 0.99 -0.11 0.00 -1.02 0.00 0.00 39.78 39.72 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 -1.70 4.97 0.29 2.41 -1.09 -0.59 -4.48 121.20 121.02 2e9x s ILE 107 Ca 0.03 0.05 -0.29 0.00 -2.23 0.00 0.00 60.65 58.21 2e9x s ILE 107 Cb 0.06 -3.35 -0.11 0.00 -1.58 0.00 0.00 42.46 37.48 2e9x s ILE 107 CO 0.31 0.29 1.47 -2.84 -1.23 0.00 0.00 174.94 172.93 2e9x s PRO 108 N 1.67 4.21 -1.46 2.79 0.02 -1.26 -2.95 135.00 138.02 2e9x s PRO 108 Ca 0.07 2.41 -0.01 0.00 0.02 0.00 0.00 61.00 63.49 2e9x s PRO 108 Cb -0.16 -3.06 0.01 0.00 0.02 0.00 0.00 34.50 31.32 2e9x s PRO 108 CO 0.08 -0.47 0.35 1.63 -0.33 0.00 0.00 177.00 178.26 2e9x n LYS 109 N 1.75 -2.76 -0.28 5.54 5.02 -1.26 -4.80 118.16 121.37 2e9x n LYS 109 Ca 0.05 0.33 0.10 0.00 -2.02 0.00 0.00 58.31 56.77 2e9x n LYS 109 Cb 0.39 -4.35 0.25 0.00 -0.02 0.00 0.00 35.03 31.30 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 0.83 1.23 -0.82 7.82 0.00 -1.81 -1.46 119.26 125.05 2e9x h ALA 110 Ca -0.63 0.16 -0.00 0.00 0.00 0.00 0.00 54.91 54.43 2e9x h ALA 110 Cb 1.38 0.17 -0.04 0.00 0.00 0.00 0.00 17.79 19.30 2e9x h ALA 110 CO 0.65 -0.32 0.50 -0.44 0.00 0.00 0.00 179.25 179.64 2e9x h ASP 111 N 0.37 0.98 -0.18 0.00 3.32 -1.91 0.32 116.42 119.32 2e9x h ASP 111 Ca 0.50 -0.06 -0.11 0.00 0.02 0.00 0.00 57.03 57.37 2e9x h ASP 111 Cb 0.89 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 40.18 2e9x h ASP 111 CO -0.51 0.75 -0.25 -0.33 -1.72 0.00 0.00 179.24 177.18 2e9x h GLU 112 N 1.12 0.64 -0.34 3.56 5.08 -1.65 -2.08 114.58 120.91 2e9x h GLU 112 Ca 0.29 -0.26 -0.05 0.00 -1.00 0.00 0.00 59.36 58.35 2e9x h GLU 112 Cb -0.05 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.16 2e9x h GLU 112 CO -0.06 0.84 0.03 0.82 -1.00 0.00 0.00 179.01 179.64 2e9x h ILE 113 N 0.56 1.25 -0.79 3.13 1.08 -0.84 -1.49 117.51 120.40 2e9x h ILE 113 Ca 0.08 -0.89 0.05 0.00 -0.39 0.00 0.00 64.86 63.71 2e9x h ILE 113 Cb 0.73 1.16 -0.05 0.00 -3.07 0.00 0.00 36.82 35.58 2e9x h ILE 113 CO 0.06 0.30 0.49 -0.09 -0.69 0.00 0.00 178.15 178.21 2e9x h ARG 114 N 0.41 0.90 -0.29 2.37 2.43 -0.73 -0.86 114.38 118.59 2e9x h ARG 114 Ca 0.10 -0.05 -0.08 0.00 -0.81 0.00 0.00 59.98 59.14 2e9x h ARG 114 Cb 0.39 -0.20 -0.01 0.00 -0.42 0.00 0.00 29.97 29.73 2e9x h ARG 114 CO 0.01 0.59 -0.12 1.15 -1.51 0.00 0.00 179.97 180.10 2e9x h THR 115 N 0.92 1.29 -0.50 0.20 2.02 -1.21 -2.12 112.91 113.52 2e9x h THR 115 Ca 0.33 -1.19 -0.07 0.00 0.77 0.00 0.00 66.41 66.25 2e9x h THR 115 Cb 0.10 1.45 -0.02 0.00 -1.74 0.00 0.00 68.15 67.95 2e9x h THR 115 CO -0.15 0.38 0.04 -0.07 0.37 0.00 0.00 175.52 176.09 2e9x h LEU 116 N 0.35 0.83 -0.68 2.58 4.07 -1.01 -1.46 115.31 119.99 2e9x h LEU 116 Ca 0.07 -0.29 -0.07 0.00 0.08 0.00 0.00 57.88 57.68 2e9x h LEU 116 Cb 0.63 -0.22 -0.03 0.00 1.08 0.00 0.00 40.66 42.12 2e9x h LEU 116 CO 0.04 0.91 0.17 0.58 -1.08 0.00 0.00 178.44 179.05 2e9x h VAL 117 N 0.72 1.26 -0.58 1.22 2.07 -1.18 -0.39 116.25 119.38 2e9x h VAL 117 Ca 0.15 -0.95 -0.04 0.00 0.82 0.00 0.00 66.70 66.68 2e9x h VAL 117 Cb 0.46 0.58 -0.03 0.00 -1.52 0.00 0.00 31.29 30.79 2e9x h VAL 117 CO 0.02 0.36 0.22 0.50 0.02 0.00 0.00 177.57 178.69 2e9x h LYS 118 N 1.01 0.87 -0.09 1.57 3.64 -1.25 -1.01 116.57 121.31 2e9x h LYS 118 Ca 0.21 -0.16 -0.08 0.00 -1.27 0.00 0.00 60.65 59.35 2e9x h LYS 118 Cb 0.37 -0.14 -0.01 0.00 -0.41 0.00 0.00 32.23 32.04 2e9x h LYS 118 CO 0.00 0.75 -0.31 0.22 -2.27 0.00 0.00 179.45 177.85 2e9x h ASP 119 N 0.80 0.17 -0.43 4.20 3.58 -0.92 0.19 116.42 123.99 2e9x h ASP 119 Ca 0.19 -0.05 -0.06 0.00 0.42 0.00 0.00 57.03 57.53 2e9x h ASP 119 Cb 0.22 -0.05 -0.02 0.00 1.72 0.00 0.00 39.33 41.21 2e9x h ASP 119 CO -0.01 0.48 0.05 -0.03 -2.88 0.00 0.00 179.24 176.85 2e9x h MET 120 N 0.15 0.73 -0.30 0.28 4.05 -0.53 0.69 114.93 119.99 2e9x h MET 120 Ca 0.02 -0.20 -0.04 0.00 -0.28 0.00 0.00 59.70 59.20 2e9x h MET 120 Cb 0.63 -0.08 -0.01 0.00 -0.80 0.00 0.00 31.60 31.34 2e9x h MET 120 CO 0.05 0.77 0.04 2.35 0.23 0.00 0.00 176.91 180.35 2e9x h TRP 121 N 0.58 0.53 -0.75 1.39 2.91 -0.57 -1.84 115.95 118.20 2e9x h TRP 121 Ca 0.13 -0.08 -0.04 0.00 1.13 0.00 0.00 58.89 60.03 2e9x h TRP 121 Cb 0.40 -0.14 -0.03 0.00 -0.51 0.00 0.00 29.16 28.88 2e9x h TRP 121 CO 0.03 0.59 0.30 -0.44 -1.03 0.00 0.00 178.44 177.90 2e9x h ASP 122 N 0.31 1.01 -0.42 2.65 3.32 -0.49 -0.69 116.42 122.11 2e9x h ASP 122 Ca 0.09 -0.15 -0.05 0.00 0.02 0.00 0.00 57.03 56.94 2e9x h ASP 122 Cb 0.35 -0.26 -0.02 0.00 0.22 0.00 0.00 39.33 39.62 2e9x h ASP 122 CO 0.01 0.89 0.07 0.74 -1.72 0.00 0.00 179.24 179.23 2e9x h THR 123 N 1.08 1.24 -0.17 0.35 2.02 -0.77 -2.70 112.91 113.96 2e9x h THR 123 Ca 0.25 -0.87 -0.18 0.00 0.77 0.00 0.00 66.41 66.38 2e9x h THR 123 Cb 0.19 1.00 -0.00 0.00 -1.74 0.00 0.00 68.15 67.60 2e9x h THR 123 CO -0.02 0.30 -0.64 0.03 0.37 0.00 0.00 175.52 175.56 2e9x h ARG 124 N 0.55 0.62 0.00 6.66 3.08 -0.97 -2.27 114.38 122.05 2e9x h ARG 124 Ca 0.13 -0.44 -0.10 0.00 0.07 0.00 0.00 59.98 59.63 2e9x h ARG 124 Cb 0.37 0.07 -0.01 0.00 0.08 0.00 0.00 29.97 30.47 2e9x h ARG 124 CO 0.01 1.06 -0.49 0.97 -1.07 0.00 0.00 179.97 180.44 2e9x h ILE 125 N 0.45 1.15 -0.24 2.04 2.10 -1.16 0.12 117.51 121.97 2e9x h ILE 125 Ca -0.01 -1.83 -0.09 0.00 1.08 0.00 0.00 64.86 64.01 2e9x h ILE 125 Cb 1.22 2.04 -0.00 0.00 -1.09 0.00 0.00 36.82 38.99 2e9x h ILE 125 CO 0.12 0.49 -0.20 0.00 -1.08 0.00 0.00 178.15 177.48 2e9x h ALA 126 N 1.51 0.35 -0.53 0.18 0.00 -1.44 -1.17 119.26 118.15 2e9x h ALA 126 Ca -0.00 -0.35 -0.01 0.00 0.00 0.00 0.00 54.91 54.54 2e9x h ALA 126 Cb 1.00 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.69 2e9x h ALA 126 CO 0.06 0.28 0.29 -0.22 0.00 0.00 0.00 179.25 179.67 2e9x h LYS 127 N 0.26 0.72 -0.51 0.00 3.64 -1.02 -1.69 116.57 117.98 2e9x h LYS 127 Ca 0.04 -0.07 -0.05 0.00 -1.27 0.00 0.00 60.65 59.30 2e9x h LYS 127 Cb 0.74 -0.15 -0.02 0.00 -0.41 0.00 0.00 32.23 32.39 2e9x h LYS 127 CO 0.05 0.53 0.11 1.25 -2.27 0.00 0.00 179.45 179.12 2e9x h LEU 128 N 0.73 0.78 -0.60 5.20 6.46 -0.33 0.02 115.31 127.57 2e9x h LEU 128 Ca 0.19 -0.24 -0.05 0.00 -0.12 0.00 0.00 57.88 57.65 2e9x h LEU 128 Cb 0.01 -0.21 -0.02 0.00 -0.73 0.00 0.00 40.66 39.71 2e9x h LEU 128 CO -0.03 0.82 0.16 0.03 -0.62 0.00 0.00 178.44 178.80 2e9x h ARG 129 N 0.71 0.95 0.07 1.25 3.08 -0.71 0.72 114.38 120.44 2e9x h ARG 129 Ca 0.16 -0.22 -0.00 0.00 0.07 0.00 0.00 59.98 59.98 2e9x h ARG 129 Cb 0.36 -0.13 0.00 0.00 0.08 0.00 0.00 29.97 30.28 2e9x h ARG 129 CO 0.00 0.86 -0.03 0.28 -1.07 0.00 0.00 179.97 180.01 2e9x h VAL 130 N 0.86 0.98 -0.96 2.04 2.07 -1.10 -0.48 116.25 119.66 2e9x h VAL 130 Ca 0.19 -0.16 0.00 0.00 0.82 0.00 0.00 66.70 67.55 2e9x h VAL 130 Cb 0.33 1.09 -0.05 0.00 -1.52 0.00 0.00 31.29 31.14 2e9x h VAL 130 CO -0.00 0.04 0.60 -1.28 0.02 0.00 0.00 177.57 176.95 2e9x h SER 131 N -0.17 1.13 -0.49 0.57 0.87 -0.83 -1.94 113.55 112.69 2e9x h SER 131 Ca -0.01 -0.05 -0.10 0.00 -1.23 0.00 0.00 61.79 60.39 2e9x h SER 131 Cb 0.14 -0.28 -0.02 0.00 -0.44 0.00 0.00 62.40 61.80 2e9x h SER 131 CO 0.02 0.84 -0.09 0.00 -0.53 0.00 0.00 176.83 177.08 2e9x h ALA 132 N 1.33 0.86 -0.46 6.23 0.00 -0.66 -1.17 119.26 125.40 2e9x h ALA 132 Ca 0.35 -0.33 -0.02 0.00 0.00 0.00 0.00 54.91 54.91 2e9x h ALA 132 Cb -0.10 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.48 2e9x h ALA 132 CO -0.07 0.65 0.22 0.22 0.00 0.00 0.00 179.25 180.27 2e9x h ASP 133 N 0.86 0.60 0.22 0.00 3.58 -0.54 -0.60 116.42 120.54 2e9x h ASP 133 Ca 0.14 -0.13 -0.13 0.00 0.42 0.00 0.00 57.03 57.33 2e9x h ASP 133 Cb 0.62 -0.15 -0.01 0.00 1.72 0.00 0.00 39.33 41.51 2e9x h ASP 133 CO 0.04 0.56 -0.51 0.77 -2.88 0.00 0.00 179.24 177.22 2e9x h SER 134 N 0.60 0.35 -0.37 2.28 4.64 -1.25 -0.02 113.55 119.79 2e9x h SER 134 Ca 0.16 -0.18 0.00 0.00 -0.47 0.00 0.00 61.79 61.30 2e9x h SER 134 Cb 0.11 -0.10 -0.02 0.00 -0.31 0.00 0.00 62.40 62.08 2e9x h SER 134 CO -0.02 0.80 0.23 0.15 -0.87 0.00 0.00 176.83 177.13 2e9x h PHE 135 N 0.26 0.47 -0.21 4.77 3.57 -0.86 -1.69 116.94 123.25 2e9x h PHE 135 Ca 0.01 0.01 -0.06 0.00 3.53 0.00 0.00 57.97 61.46 2e9x h PHE 135 Cb 0.98 -0.16 -0.01 0.00 2.79 0.00 0.00 35.95 39.56 2e9x h PHE 135 CO 0.02 0.31 -0.10 0.28 -2.23 0.00 0.00 178.31 176.60 2e9x h VAL 136 N 0.49 1.30 -0.37 1.41 2.07 -0.90 -2.22 116.25 118.03 2e9x h VAL 136 Ca 0.13 -1.16 -0.02 0.00 0.82 0.00 0.00 66.70 66.47 2e9x h VAL 136 Cb -0.04 1.63 -0.02 0.00 -1.52 0.00 0.00 31.29 31.34 2e9x h VAL 136 CO -0.03 0.35 0.13 0.03 0.02 0.00 0.00 177.57 178.08 2e9x h ARG 137 N 0.13 0.53 -0.01 1.57 3.08 -0.88 -1.32 114.38 117.47 2e9x h ARG 137 Ca 0.05 -0.07 0.00 0.00 0.07 0.00 0.00 59.98 60.03 2e9x h ARG 137 Cb 0.59 -0.10 0.00 0.00 0.08 0.00 0.00 29.97 30.54 2e9x h ARG 137 CO 0.03 0.45 -0.00 1.04 -1.07 0.00 0.00 179.97 180.42 2e9x n GLN 138 N -4.38 1.46 -3.90 0.04 6.02 -0.65 -4.94 117.38 111.03 2e9x n GLN 138 Ca 0.02 -0.68 -0.27 0.00 -0.01 0.00 0.00 57.00 56.06 2e9x n GLN 138 Cb 0.15 -1.49 0.01 0.00 1.02 0.00 0.00 30.24 29.93 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 -0.18 -4.40 -1.64 -1.09 6.02 -0.50 -4.95 117.38 110.64 2e9x n GLN 139 Ca 0.20 0.52 -0.32 0.00 -0.01 0.00 0.00 57.00 57.40 2e9x n GLN 139 Cb 0.29 -5.06 0.05 0.00 1.02 0.00 0.00 30.24 26.53 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 -6.44 2.91 0.00 -1.09 2.02 -0.86 -4.98 118.70 110.26 2e9x s GLU 140 Ca 0.27 1.07 0.03 0.00 0.02 0.00 0.00 54.97 56.37 2e9x s GLU 140 Cb -0.14 -1.98 0.07 0.00 0.10 0.00 0.00 34.13 32.17 2e9x s GLU 140 CO 0.85 -1.13 0.88 0.00 0.02 0.00 0.00 175.26 175.89 2e9x n ALA 141 N -2.89 2.24 -3.59 5.21 0.00 -1.26 -4.93 120.51 115.29 2e9x n ALA 141 Ca 0.08 -0.83 -0.12 0.00 0.00 0.00 0.00 53.44 52.57 2e9x n ALA 141 Cb 0.53 -0.13 -0.06 0.00 0.00 0.00 0.00 19.45 19.79 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 -0.70 -0.50 0.01 0.00 5.65 -1.26 -5.18 115.29 113.32 2e9x s HIS 142 Ca 0.06 1.01 -0.13 0.00 0.25 0.00 0.00 55.06 56.24 2e9x s HIS 142 Cb 0.03 0.40 0.02 0.00 -1.18 0.00 0.00 32.58 31.85 2e9x s HIS 142 CO 0.05 -0.37 0.28 0.00 -0.65 0.00 0.00 174.74 174.05 2e9x s ALA 143 N -0.61 -0.66 -0.09 1.58 0.00 -1.26 -5.15 121.76 115.57 2e9x s ALA 143 Ca -0.02 0.11 -0.01 0.00 0.00 0.00 0.00 51.96 52.04 2e9x s ALA 143 Cb -0.02 0.18 -0.03 0.00 0.00 0.00 0.00 23.12 23.25 2e9x s ALA 143 CO 0.01 -0.31 -0.04 0.21 0.00 0.00 0.00 175.76 175.62 2e9x s LYS 144 N -1.86 3.01 -0.37 0.00 2.20 -1.26 -5.04 119.74 116.42 2e9x s LYS 144 Ca -0.10 -0.51 0.12 0.00 -0.36 0.00 0.00 55.97 55.12 2e9x s LYS 144 Cb -0.04 -2.71 0.36 0.00 -1.51 0.00 0.00 37.83 33.93 2e9x s LYS 144 CO 0.01 0.58 0.78 1.47 -0.36 0.00 0.00 175.35 177.82 2e9x n LEU 145 N 2.49 0.63 -0.33 5.43 -0.00 -1.26 -5.02 117.00 118.94 2e9x n LEU 145 Ca -0.18 -4.82 0.33 0.00 -0.00 0.00 0.00 56.01 51.34 2e9x n LEU 145 Cb 0.53 0.71 0.70 0.00 -0.00 0.00 0.00 43.42 45.36 2e9x n LEU 145 CO 0.29 2.22 1.30 0.44 -0.00 0.00 0.00 177.39 181.64 2e9x h ASP 146 N 2.99 0.10 -0.31 1.45 3.32 -1.96 -3.01 116.42 119.01 2e9x h ASP 146 Ca 0.07 0.02 0.00 0.00 0.02 0.00 0.00 57.03 57.14 2e9x h ASP 146 Cb 1.00 0.01 0.00 0.00 0.22 0.00 0.00 39.33 40.55 2e9x h ASP 146 CO 0.47 0.01 0.00 0.59 -1.72 0.00 0.00 179.24 178.59 2e9x n ASN 147 N -4.29 2.86 -4.76 6.45 3.02 -1.26 -4.98 115.26 112.30 2e9x n ASN 147 Ca 0.26 -2.03 -0.40 0.00 -0.03 0.00 0.00 54.58 52.38 2e9x n ASN 147 Cb 1.18 -0.22 -0.05 0.00 -0.61 0.00 0.00 39.78 40.08 2e9x n ASN 147 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 2e9x s LEU 148 N -1.05 4.59 0.52 3.41 2.96 -1.14 -4.54 118.68 123.42 2e9x s LEU 148 Ca 0.21 2.09 -0.03 0.00 -0.22 0.00 0.00 54.13 56.18 2e9x s LEU 148 Cb 0.11 -3.64 0.00 0.00 0.50 0.00 0.00 46.19 43.16 2e9x s LEU 148 CO 0.14 0.01 0.79 0.42 -1.32 0.00 0.00 176.35 176.38 2e9x s THR 149 N -1.20 3.87 0.24 3.68 -4.23 -1.26 -4.89 115.64 111.85 2e9x s THR 149 Ca 0.43 -0.23 -0.05 0.00 -1.18 0.00 0.00 61.69 60.66 2e9x s THR 149 Cb -0.28 -3.48 0.21 0.00 1.34 0.00 0.00 72.50 70.29 2e9x s THR 149 CO 0.36 -0.42 1.84 0.25 -0.54 0.00 0.00 174.62 176.11 2e9x h LEU 150 N 0.11 0.80 -0.96 4.79 5.85 -1.97 -0.06 115.31 123.87 2e9x h LEU 150 Ca -0.46 0.02 -0.03 0.00 0.84 0.00 0.00 57.88 58.26 2e9x h LEU 150 Cb 1.25 -0.14 -0.04 0.00 0.37 0.00 0.00 40.66 42.10 2e9x h LEU 150 CO 0.59 0.50 0.39 -0.03 -0.34 0.00 0.00 178.44 179.55 2e9x h MET 151 N 0.93 1.13 -0.18 1.25 4.05 -1.94 0.21 114.93 120.37 2e9x h MET 151 Ca 0.38 -0.15 -0.12 0.00 -0.28 0.00 0.00 59.70 59.53 2e9x h MET 151 Cb 0.22 -0.21 0.00 0.00 -0.80 0.00 0.00 31.60 30.81 2e9x h MET 151 CO -0.19 0.86 -0.35 0.93 0.23 0.00 0.00 176.91 178.39 2e9x h GLU 152 N 1.13 0.56 -0.02 0.39 5.08 -1.79 -2.23 114.58 117.70 2e9x h GLU 152 Ca 0.28 -0.36 -0.00 0.00 -1.00 0.00 0.00 59.36 58.28 2e9x h GLU 152 Cb 0.09 0.04 -0.00 0.00 0.50 0.00 0.00 28.75 29.39 2e9x h GLU 152 CO -0.04 0.97 0.01 0.82 -1.00 0.00 0.00 179.01 179.77 2e9x h ILE 153 N 0.21 1.14 -0.22 3.13 2.04 -0.82 -3.21 117.51 119.79 2e9x h ILE 153 Ca 0.01 -0.40 -0.06 0.00 1.00 0.00 0.00 64.86 65.40 2e9x h ILE 153 Cb 0.95 1.38 -0.01 0.00 -0.74 0.00 0.00 36.82 38.40 2e9x h ILE 153 CO 0.08 0.11 -0.13 -1.13 0.00 0.00 0.00 178.15 177.07 2e9x h ASN 154 N -0.14 0.34 -0.36 1.72 -1.24 -0.62 1.04 115.58 116.32 2e9x h ASN 154 Ca 0.00 -0.08 -0.07 0.00 0.71 0.00 0.00 56.30 56.87 2e9x h ASN 154 Cb 0.17 -0.09 -0.02 0.00 0.73 0.00 0.00 38.32 39.11 2e9x h ASN 154 CO -0.00 0.50 -0.00 0.74 -1.29 0.00 0.00 177.43 177.38 2e9x h THR 155 N 0.33 1.23 0.00 -3.57 2.02 -1.40 -3.06 112.91 108.47 2e9x h THR 155 Ca 0.06 -0.96 0.00 0.00 0.77 0.00 0.00 66.41 66.28 2e9x h THR 155 Cb 0.44 0.90 0.00 0.00 -1.74 0.00 0.00 68.15 67.75 2e9x h THR 155 CO 0.03 0.34 -0.78 -1.20 0.37 0.00 0.00 175.52 174.27 2e9x n SER 156 N -4.23 0.76 -0.05 4.18 7.64 -1.16 -4.75 113.62 116.01 2e9x n SER 156 Ca 0.02 -0.80 -0.11 0.00 1.01 0.00 0.00 58.87 58.99 2e9x n SER 156 Cb 0.29 1.05 -0.05 0.00 -1.01 0.00 0.00 64.21 64.49 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 3.52 -0.58 1.71 0.23 0.00 0.13 -1.07 103.07 107.00 2e9x h GLY 157 Ca 0.00 0.50 -0.05 0.00 0.00 0.00 0.00 47.33 47.78 2e9x h GLY 157 CO 0.00 -0.21 -0.08 -0.84 0.00 0.00 0.00 176.54 175.41 2e9x h THR 158 N -0.40 1.19 -0.10 4.70 2.02 -1.83 -1.74 112.91 116.75 2e9x h THR 158 Ca 0.11 -0.79 -0.01 0.00 0.77 0.00 0.00 66.41 66.48 2e9x h THR 158 Cb 0.59 1.10 -0.00 0.00 -1.74 0.00 0.00 68.15 68.10 2e9x h THR 158 CO -0.46 0.26 0.01 0.15 0.37 0.00 0.00 175.52 175.85 2e9x h PHE 159 N 0.35 0.18 -0.57 3.16 3.57 -1.76 -2.04 116.94 119.83 2e9x h PHE 159 Ca 0.07 -0.03 -0.05 0.00 3.53 0.00 0.00 57.97 61.49 2e9x h PHE 159 Cb 0.36 -0.05 -0.02 0.00 2.79 0.00 0.00 35.95 39.03 2e9x h PHE 159 CO 0.01 0.39 0.15 -0.07 -2.23 0.00 0.00 178.31 176.56 2e9x h LEU 160 N -0.08 0.86 -0.51 0.59 3.38 -0.96 -1.46 115.31 117.13 2e9x h LEU 160 Ca 0.03 -0.23 -0.16 0.00 0.09 0.00 0.00 57.88 57.61 2e9x h LEU 160 Cb 0.31 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.83 2e9x h LEU 160 CO 0.00 0.86 -0.55 0.71 0.09 0.00 0.00 178.44 179.55 2e9x h THR 161 N 0.82 1.32 -0.37 0.22 1.35 -1.35 -1.44 112.91 113.46 2e9x h THR 161 Ca 0.18 -1.80 -0.08 0.00 -0.55 0.00 0.00 66.41 64.16 2e9x h THR 161 Cb 0.33 1.78 -0.01 0.00 -1.73 0.00 0.00 68.15 68.51 2e9x h THR 161 CO -0.00 0.56 -0.08 1.56 -0.25 0.00 0.00 175.52 177.31 2e9x h GLN 162 N 0.43 0.71 -0.38 4.72 4.20 -1.25 -0.17 115.11 123.37 2e9x h GLN 162 Ca 0.01 -0.27 0.00 0.00 0.06 0.00 0.00 58.65 58.45 2e9x h GLN 162 Cb 1.10 -0.04 -0.02 0.00 0.30 0.00 0.00 27.48 28.82 2e9x h GLN 162 CO 0.10 0.86 0.24 0.00 -0.67 0.00 0.00 178.83 179.37 2e9x h ALA 163 N 0.83 0.48 -0.35 3.87 0.00 -1.18 -0.79 119.26 122.11 2e9x h ALA 163 Ca 0.10 -0.03 -0.08 0.00 0.00 0.00 0.00 54.91 54.89 2e9x h ALA 163 Cb 0.59 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.21 2e9x h ALA 163 CO 0.04 -0.06 -0.11 -0.07 0.00 0.00 0.00 179.25 179.05 2e9x h LEU 164 N 0.50 0.60 -0.64 0.00 3.38 -1.18 -1.50 115.31 116.47 2e9x h LEU 164 Ca 0.14 -0.16 -0.04 0.00 0.09 0.00 0.00 57.88 57.91 2e9x h LEU 164 Cb -0.04 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 40.52 2e9x h LEU 164 CO -0.03 0.74 0.26 0.78 0.09 0.00 0.00 178.44 180.29 2e9x h ASN 165 N 0.56 0.89 -0.56 -0.43 2.35 -0.48 0.94 115.58 118.85 2e9x h ASN 165 Ca 0.10 -0.17 -0.06 0.00 -0.55 0.00 0.00 56.30 55.63 2e9x h ASN 165 Cb 0.53 -0.23 -0.02 0.00 0.05 0.00 0.00 38.32 38.64 2e9x h ASN 165 CO 0.03 0.81 0.13 0.45 -1.65 0.00 0.00 177.43 177.21 2e9x h HIS 166 N 0.90 0.95 -0.55 1.19 3.86 -0.78 -2.58 115.15 118.13 2e9x h HIS 166 Ca 0.21 -0.11 -0.05 0.00 -1.16 0.00 0.00 60.37 59.27 2e9x h HIS 166 Cb 0.20 -0.27 -0.02 0.00 1.06 0.00 0.00 27.41 28.38 2e9x h HIS 166 CO 0.01 0.82 0.17 0.52 0.86 0.00 0.00 177.93 180.31 2e9x h MET 167 N 0.80 0.87 -0.99 2.45 2.86 -0.93 -1.31 114.93 118.68 2e9x h MET 167 Ca 0.18 -0.19 0.04 0.00 -2.06 0.00 0.00 59.70 57.67 2e9x h MET 167 Cb 0.35 -0.12 -0.06 0.00 0.06 0.00 0.00 31.60 31.82 2e9x h MET 167 CO 0.00 0.79 0.65 -0.92 1.06 0.00 0.00 176.91 178.49 2e9x h TYR 168 N 0.78 1.21 -0.32 -0.22 3.20 -0.64 0.26 116.97 121.23 2e9x h TYR 168 Ca 0.18 0.03 -0.14 0.00 3.14 0.00 0.00 58.73 61.94 2e9x h TYR 168 Cb 0.29 -0.40 -0.01 0.00 1.54 0.00 0.00 36.73 38.15 2e9x h TYR 168 CO 0.02 0.68 -0.38 0.87 -1.64 0.00 0.00 178.16 177.71 2e9x h LYS 169 N 1.23 0.76 -0.13 1.82 1.57 -1.14 -2.26 116.57 118.42 2e9x h LYS 169 Ca 0.40 -0.38 -0.11 0.00 -1.87 0.00 0.00 60.65 58.69 2e9x h LYS 169 Cb 0.05 0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.35 2e9x h LYS 169 CO -0.14 1.01 -0.39 -0.07 -0.57 0.00 0.00 179.45 179.29 2e9x h LEU 170 N 0.63 0.31 -0.10 2.94 3.38 -0.28 -1.40 115.31 120.78 2e9x h LEU 170 Ca 0.06 -0.12 0.00 0.00 0.09 0.00 0.00 57.88 57.90 2e9x h LEU 170 Cb 0.92 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 41.59 2e9x h LEU 170 CO 0.08 0.67 -0.03 -1.14 0.09 0.00 0.00 178.44 178.12 2e9x n ARG 171 N -4.04 0.71 -0.11 1.13 0.63 0.82 -3.81 116.66 111.99 2e9x n ARG 171 Ca -0.01 -0.10 0.01 0.00 -0.92 0.00 0.00 57.85 56.83 2e9x n ARG 171 Cb 0.47 -1.50 0.02 0.00 0.45 0.00 0.00 32.46 31.90 2e9x n ARG 171 CO 0.00 0.00 0.00 0.25 -2.51 0.00 0.00 177.63 175.37 2e9x n THR 172 N -1.06 0.47 0.97 5.15 -2.24 -0.87 -4.84 114.28 111.87 2e9x n THR 172 Ca 0.17 -0.52 0.11 0.00 -2.27 0.00 0.00 64.05 61.55 2e9x n THR 172 Cb 0.22 0.63 0.54 0.00 -2.10 0.00 0.00 70.33 69.61 2e9x n THR 172 CO 0.00 0.00 0.00 -0.46 -0.57 0.00 0.00 175.07 174.04 2e9x n ASN 173 N -0.29 0.00 -0.06 3.42 6.94 -0.56 -4.10 115.26 120.60 2e9x n ASN 173 Ca 0.02 0.15 -0.06 0.00 -0.02 0.00 0.00 54.58 54.67 2e9x n ASN 173 Cb 0.50 -0.36 -0.02 0.00 -2.36 0.00 0.00 39.78 37.54 2e9x n ASN 173 CO 0.00 0.00 0.00 0.18 -1.03 0.00 0.00 177.26 176.41 2e9x n LEU 174 N -1.36 1.50 0.00 -4.53 4.77 -1.26 -5.13 117.00 110.98 2e9x n LEU 174 Ca 0.09 0.39 0.02 0.00 -0.03 0.00 0.00 56.01 56.48 2e9x n LEU 174 Cb 0.21 -0.73 0.12 0.00 -2.33 0.00 0.00 43.42 40.69 2e9x n LEU 174 CO 0.19 -0.39 0.36 0.00 -1.33 0.00 0.00 177.39 176.22