#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3m9m s ILE 2 N 0.00 0.14 0.32 2.02 1.01 -1.26 -4.41 121.20 119.03 3m9m s ILE 2 Ca 0.00 -1.97 -0.25 0.00 0.00 0.00 0.00 60.65 58.44 3m9m s ILE 2 Cb 0.00 -1.10 -0.10 0.00 0.01 0.00 0.00 42.46 41.27 3m9m s ILE 2 CO 0.00 -1.03 0.91 -0.69 0.00 0.00 0.00 174.94 174.14 3m9m s VAL 3 N 0.74 4.28 -0.21 2.92 1.01 0.52 -3.26 120.40 126.41 3m9m s VAL 3 Ca 0.23 1.71 0.01 0.00 0.00 0.00 0.00 61.98 63.93 3m9m s VAL 3 Cb -0.12 -3.94 0.04 0.00 0.00 0.00 0.00 36.38 32.36 3m9m s VAL 3 CO -0.07 0.10 -0.11 -0.22 0.00 0.00 0.00 175.10 174.80 3m9m s LEU 4 N -2.18 2.43 -0.15 3.92 0.20 0.29 -1.15 118.68 122.05 3m9m s LEU 4 Ca 0.51 -0.95 -0.05 0.00 0.69 0.00 0.00 54.13 54.32 3m9m s LEU 4 Cb -0.17 -1.29 -0.04 0.00 -0.43 0.00 0.00 46.19 44.27 3m9m s LEU 4 CO 0.22 -0.15 0.04 0.12 -0.29 0.00 0.00 176.35 176.29 3m9m s PHE 5 N 1.35 3.22 -0.02 5.38 5.36 0.62 0.27 117.98 134.16 3m9m s PHE 5 Ca -0.02 0.08 0.06 0.00 -0.96 0.00 0.00 56.93 56.09 3m9m s PHE 5 Cb -0.17 -1.97 -0.02 0.00 -0.34 0.00 0.00 43.02 40.52 3m9m s PHE 5 CO -0.08 0.25 -0.20 0.08 -1.46 0.00 0.00 175.22 173.81 3m9m s VAL 6 N -0.07 2.56 -0.32 3.12 1.01 -0.04 -1.41 120.40 125.25 3m9m s VAL 6 Ca 0.05 -0.99 0.01 0.00 0.00 0.00 0.00 61.98 61.05 3m9m s VAL 6 Cb -0.12 -1.97 0.14 0.00 0.00 0.00 0.00 36.38 34.43 3m9m s VAL 6 CO 0.01 0.53 0.31 -0.62 0.00 0.00 0.00 175.10 175.33 3m9m s ASP 7 N -0.83 1.74 0.16 3.32 -1.08 -0.88 -1.88 116.67 117.23 3m9m s ASP 7 Ca 0.11 -1.22 -0.34 0.00 -0.52 0.00 0.00 52.55 50.58 3m9m s ASP 7 Cb -0.10 0.39 -0.15 0.00 -1.46 0.00 0.00 42.92 41.59 3m9m s ASP 7 CO 0.01 -0.34 1.33 0.49 0.52 0.00 0.00 175.17 177.18 3m9m n PHE 8 N 4.81 1.69 -2.55 -5.34 3.72 -0.98 -2.47 117.46 116.34 3m9m n PHE 8 Ca 0.04 0.55 -0.35 0.00 -0.05 0.00 0.00 57.45 57.63 3m9m n PHE 8 Cb 0.45 -2.37 -0.04 0.00 -0.94 0.00 0.00 39.48 36.58 3m9m n PHE 8 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 176.76 176.20 3m9m s ASP 9 N 0.35 6.59 0.00 4.37 1.01 -1.09 -3.93 116.67 123.98 3m9m s ASP 9 Ca 0.76 1.99 0.00 0.00 0.71 0.00 0.00 52.55 56.02 3m9m s ASP 9 Cb -0.81 -2.57 0.00 0.00 1.01 0.00 0.00 42.92 40.54 3m9m s ASP 9 CO 0.48 -0.61 0.00 0.00 0.21 0.00 0.00 175.17 175.25 3m9m n TYR 10 N -0.43 0.00 0.00 4.23 0.18 -1.26 -4.59 117.16 115.29 3m9m n TYR 10 Ca 0.07 0.00 0.00 0.00 1.88 0.00 0.00 57.90 59.85 3m9m n TYR 10 Cb 0.51 0.00 0.00 0.00 -0.38 0.00 0.00 39.34 39.47 3m9m n TYR 10 CO 0.00 0.00 0.00 0.34 -2.08 0.00 0.00 176.86 175.12 3m9m n PHE 11 N -0.66 0.00 -0.31 -3.48 7.35 -1.25 -1.02 117.46 118.09 3m9m n PHE 11 Ca 0.00 0.00 0.15 0.00 -0.76 0.00 0.00 57.45 56.84 3m9m n PHE 11 Cb 0.00 -0.03 0.33 0.00 0.35 0.00 0.00 39.48 40.13 3m9m n PHE 11 CO 0.00 0.00 0.00 1.88 -0.76 0.00 0.00 176.76 177.88 3m9m h TYR 12 N 0.00 0.71 0.00 -5.13 -1.99 -1.95 0.47 116.97 109.08 3m9m h TYR 12 Ca 0.00 0.04 -0.05 0.00 2.00 0.00 0.00 58.73 60.72 3m9m h TYR 12 Cb 0.00 -0.17 -0.01 0.00 2.00 0.00 0.00 36.73 38.55 3m9m h TYR 12 CO -0.05 -0.05 -0.24 0.00 -0.00 0.00 0.00 178.16 177.81 3m9m h ALA 13 N 1.73 1.04 0.06 3.88 0.00 -1.64 -3.08 119.26 121.25 3m9m h ALA 13 Ca 0.58 -0.22 -0.00 0.00 0.00 0.00 0.00 54.91 55.27 3m9m h ALA 13 Cb 1.13 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.88 3m9m h ALA 13 CO -0.53 0.31 -0.03 0.37 0.00 0.00 0.00 179.25 179.36 3m9m h GLN 14 N 0.00 -0.08 0.00 0.00 4.15 0.16 -2.54 115.11 116.80 3m9m h GLN 14 Ca -0.00 0.01 0.00 0.00 0.77 0.00 0.00 58.65 59.42 3m9m h GLN 14 Cb 0.74 0.02 0.00 0.00 0.21 0.00 0.00 27.48 28.45 3m9m h GLN 14 CO 0.03 0.52 0.02 0.28 -1.93 0.00 0.00 178.83 177.75 3m9m n VAL 15 N -4.79 0.37 -0.09 2.39 0.31 -0.33 0.11 118.33 116.29 3m9m n VAL 15 Ca -0.08 0.12 -0.11 0.00 -0.01 0.00 0.00 64.34 64.26 3m9m n VAL 15 Cb 0.31 -1.12 -0.11 0.00 -0.91 0.00 0.00 33.84 32.01 3m9m n VAL 15 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 3m9m n GLU 16 N -1.01 0.96 -0.01 5.55 -0.58 -1.13 -4.13 120.64 120.28 3m9m n GLU 16 Ca 0.00 0.05 0.06 0.00 -0.42 0.00 0.00 57.16 56.85 3m9m n GLU 16 Cb 0.02 -1.41 0.31 0.00 -0.57 0.00 0.00 31.44 29.79 3m9m n GLU 16 CO 0.00 0.00 0.00 0.39 -0.48 0.00 0.00 177.13 177.04 3m9m n GLU 17 N -2.84 1.06 -0.00 3.49 1.02 0.30 -2.71 120.64 120.95 3m9m n GLU 17 Ca -0.31 -0.09 0.04 0.00 -0.02 0.00 0.00 57.16 56.78 3m9m n GLU 17 Cb 0.96 -1.18 -0.05 0.00 -0.02 0.00 0.00 31.44 31.15 3m9m n GLU 17 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 3m9m n VAL 18 N -0.58 0.00 0.04 2.62 0.31 -0.33 -3.69 118.33 116.70 3m9m n VAL 18 Ca 0.08 -0.27 0.03 0.00 -0.01 0.00 0.00 64.34 64.17 3m9m n VAL 18 Cb 0.06 0.80 0.05 0.00 -0.91 0.00 0.00 33.84 33.84 3m9m n VAL 18 CO 0.00 0.00 0.00 0.18 -1.32 0.00 0.00 176.83 175.69 3m9m n LEU 19 N -1.37 2.03 -2.73 7.52 4.32 -1.15 -4.67 117.00 120.96 3m9m n LEU 19 Ca 0.01 -1.58 -0.07 0.00 -0.02 0.00 0.00 56.01 54.35 3m9m n LEU 19 Cb 0.15 -0.07 0.05 0.00 -1.62 0.00 0.00 43.42 41.94 3m9m n LEU 19 CO 0.17 0.48 0.31 -3.20 -1.22 0.00 0.00 177.39 173.93 3m9m n ASN 20 N 0.12 -2.49 0.10 -1.43 2.85 -1.10 -5.03 115.26 108.29 3m9m n ASN 20 Ca 0.05 -2.84 0.18 0.00 -0.11 0.00 0.00 54.58 51.86 3m9m n ASN 20 Cb 0.25 1.52 0.58 0.00 1.24 0.00 0.00 39.78 43.37 3m9m n ASN 20 CO 0.00 0.00 0.00 -0.65 -2.11 0.00 0.00 177.26 174.50 3m9m h PRO 21 N 3.84 0.00 0.00 1.20 0.11 -1.82 -1.21 132.00 134.12 3m9m h PRO 21 Ca -0.16 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.95 3m9m h PRO 21 Cb 1.08 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.19 3m9m h PRO 21 CO 0.17 0.00 0.09 0.66 -0.21 0.00 0.00 178.00 178.70 3m9m h SER 22 N 0.00 0.00 0.62 -2.05 4.64 -1.94 -2.13 113.55 112.68 3m9m h SER 22 Ca 0.20 0.00 -0.18 0.00 -0.47 0.00 0.00 61.79 61.34 3m9m h SER 22 Cb 1.59 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.66 3m9m h SER 22 CO -0.00 0.00 -0.80 -0.07 -0.87 0.00 0.00 176.83 175.08 3m9m h LEU 23 N 0.00 0.17 -9.45 5.97 3.38 -1.53 -3.44 115.31 110.41 3m9m h LEU 23 Ca 0.00 -0.13 -0.60 0.00 0.09 0.00 0.00 57.88 57.24 3m9m h LEU 23 Cb 0.17 -0.05 0.05 0.00 0.09 0.00 0.00 40.66 40.92 3m9m h LEU 23 CO 0.00 0.90 0.77 2.29 0.09 0.00 0.00 178.44 182.49 3m9m n LYS 24 N -3.67 2.00 0.00 1.13 2.85 -0.80 -0.25 118.16 119.41 3m9m n LYS 24 Ca -0.02 0.72 0.00 0.00 -1.05 0.00 0.00 58.31 57.96 3m9m n LYS 24 Cb 0.76 -2.48 0.00 0.00 -0.65 0.00 0.00 35.03 32.66 3m9m n LYS 24 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 3m9m n GLY 25 N 3.37 2.70 3.88 2.58 0.00 -1.26 -5.04 105.19 111.42 3m9m n GLY 25 Ca 0.18 -0.22 -0.33 0.00 0.00 0.00 0.00 46.02 45.65 3m9m n GLY 25 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3m9m s LYS 26 N 0.00 3.70 0.03 1.61 1.02 0.65 -4.99 119.74 121.76 3m9m s LYS 26 Ca 0.00 0.06 -0.30 0.00 0.02 0.00 0.00 55.97 55.75 3m9m s LYS 26 Cb 0.00 -2.89 -0.05 0.00 -0.52 0.00 0.00 37.83 34.37 3m9m s LYS 26 CO 0.00 0.49 1.21 -1.25 -0.92 0.00 0.00 175.35 174.88 3m9m s PRO 27 N -2.34 4.41 0.11 -1.68 0.04 -1.26 -4.84 135.00 129.44 3m9m s PRO 27 Ca 0.38 1.76 0.07 0.00 0.04 0.00 0.00 61.00 63.25 3m9m s PRO 27 Cb -0.13 -3.41 -0.04 0.00 0.04 0.00 0.00 34.50 30.96 3m9m s PRO 27 CO 0.21 -0.32 -0.08 0.08 0.04 0.00 0.00 177.00 176.93 3m9m s VAL 28 N 1.40 3.46 -0.28 -0.36 1.01 -1.26 -2.07 120.40 122.29 3m9m s VAL 28 Ca 0.58 -1.27 -0.02 0.00 0.00 0.00 0.00 61.98 61.28 3m9m s VAL 28 Cb -0.28 -2.64 0.12 0.00 0.00 0.00 0.00 36.38 33.58 3m9m s VAL 28 CO 0.27 0.08 0.25 -0.69 0.00 0.00 0.00 175.10 175.01 3m9m s VAL 29 N -1.29 -0.31 -0.32 2.92 1.01 -0.16 -2.47 120.40 119.78 3m9m s VAL 29 Ca 0.23 -0.52 -0.29 0.00 0.00 0.00 0.00 61.98 61.40 3m9m s VAL 29 Cb -0.11 -0.95 0.01 0.00 0.00 0.00 0.00 36.38 35.33 3m9m s VAL 29 CO 0.15 -0.51 1.12 -0.69 0.00 0.00 0.00 175.10 175.17 3m9m s VAL 30 N 2.29 4.43 0.27 2.92 1.01 0.36 -1.98 120.40 129.70 3m9m s VAL 30 Ca 0.09 1.64 0.09 0.00 0.00 0.00 0.00 61.98 63.80 3m9m s VAL 30 Cb -0.15 -4.36 -0.04 0.00 0.00 0.00 0.00 36.38 31.83 3m9m s VAL 30 CO -0.32 -0.48 0.04 0.00 0.00 0.00 0.00 175.10 174.34 3m9m s VAL 32 N -2.29 3.97 -0.55 0.00 1.01 0.83 -1.92 120.40 121.45 3m9m s VAL 32 Ca 0.32 -1.30 -0.23 0.00 0.00 0.00 0.00 61.98 60.77 3m9m s VAL 32 Cb -0.07 -3.36 0.05 0.00 0.00 0.00 0.00 36.38 33.00 3m9m s VAL 32 CO 0.21 -0.36 0.90 -0.36 0.00 0.00 0.00 175.10 175.50 3m9m s PHE 33 N 1.40 2.82 0.08 5.22 0.08 -1.26 -1.33 117.98 124.99 3m9m s PHE 33 Ca 0.01 -0.12 -0.24 0.00 0.12 0.00 0.00 56.93 56.70 3m9m s PHE 33 Cb -0.21 -4.02 -0.16 0.00 -0.57 0.00 0.00 43.02 38.06 3m9m s PHE 33 CO 0.02 -1.33 1.70 0.66 -0.10 0.00 0.00 175.22 176.17 3m9m h SER 34 N 9.29 -0.11 0.00 1.36 4.64 -0.99 -3.48 113.55 124.26 3m9m h SER 34 Ca -0.26 -0.02 0.00 0.00 -0.47 0.00 0.00 61.79 61.04 3m9m h SER 34 Cb 1.08 0.03 0.00 0.00 -0.31 0.00 0.00 62.40 63.19 3m9m h SER 34 CO 1.08 -0.05 0.00 0.61 -0.87 0.00 0.00 176.83 177.59 3m9m n GLY 35 N -1.08 1.16 0.36 -0.77 0.00 -1.25 -4.64 105.19 98.96 3m9m n GLY 35 Ca -0.08 0.00 0.02 0.00 0.00 0.00 0.00 46.02 45.96 3m9m n GLY 35 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 3m9m n ARG 36 N -0.06 0.37 0.00 1.61 1.85 -1.26 -4.64 116.66 114.52 3m9m n ARG 36 Ca 0.00 -1.37 0.00 0.00 -1.00 0.00 0.00 57.85 55.48 3m9m n ARG 36 Cb 0.00 -0.76 0.00 0.00 -1.05 0.00 0.00 32.46 30.65 3m9m n ARG 36 CO 0.00 0.00 0.00 1.97 -0.01 0.00 0.00 177.63 179.59 3m9m n PHE 37 N -0.36 0.00 -1.58 2.89 1.16 -1.26 -5.03 117.46 113.28 3m9m n PHE 37 Ca 0.04 0.00 -0.61 0.00 -1.87 0.00 0.00 57.45 55.01 3m9m n PHE 37 Cb 0.67 0.00 -0.09 0.00 -1.61 0.00 0.00 39.48 38.45 3m9m n PHE 37 CO 0.00 0.00 0.00 -1.91 -1.87 0.00 0.00 176.76 172.98 3m9m n GLU 38 N -1.18 0.50 -3.55 3.97 4.07 -1.26 -1.90 120.64 121.30 3m9m n GLU 38 Ca 0.00 0.17 -0.20 0.00 -0.06 0.00 0.00 57.16 57.07 3m9m n GLU 38 Cb 0.00 -1.81 0.06 0.00 -0.06 0.00 0.00 31.44 29.62 3m9m n GLU 38 CO 0.00 0.00 0.00 -0.25 -0.06 0.00 0.00 177.13 176.82 3m9m n ASP 39 N 6.02 -2.30 -4.58 4.31 8.00 -1.26 -5.01 116.55 121.73 3m9m n ASP 39 Ca 0.37 -0.75 -0.34 0.00 0.71 0.00 0.00 54.79 54.78 3m9m n ASP 39 Cb 0.04 -4.53 -0.11 0.00 -0.02 0.00 0.00 41.12 36.50 3m9m n ASP 39 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 3m9m s SER 40 N -4.21 4.97 0.00 -2.24 1.04 -0.80 -4.03 113.70 108.44 3m9m s SER 40 Ca 0.08 -0.01 0.00 0.00 0.48 0.00 0.00 55.95 56.49 3m9m s SER 40 Cb -0.02 -1.61 0.00 0.00 0.10 0.00 0.00 66.02 64.49 3m9m s SER 40 CO 0.78 0.26 0.00 0.61 0.98 0.00 0.00 173.24 175.87 3m9m n GLY 41 N 2.92 0.11 3.67 7.32 0.00 -1.26 -0.26 105.19 117.69 3m9m n GLY 41 Ca -0.18 -1.07 -0.10 0.00 0.00 0.00 0.00 46.02 44.66 3m9m n GLY 41 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3m9m s ALA 42 N -1.00 -0.24 -0.26 4.61 0.00 -0.44 -3.55 121.76 120.88 3m9m s ALA 42 Ca 0.00 -0.95 -0.18 0.00 0.00 0.00 0.00 51.96 50.83 3m9m s ALA 42 Cb 0.00 0.93 -0.03 0.00 0.00 0.00 0.00 23.12 24.03 3m9m s ALA 42 CO 0.00 -0.91 0.54 0.08 0.00 0.00 0.00 175.76 175.47 3m9m s VAL 43 N -3.14 5.05 -0.01 0.00 1.01 -1.05 -0.12 120.40 122.14 3m9m s VAL 43 Ca 0.21 0.93 -0.04 0.00 0.00 0.00 0.00 61.98 63.08 3m9m s VAL 43 Cb -0.03 -3.85 -0.02 0.00 0.00 0.00 0.00 36.38 32.48 3m9m s VAL 43 CO 0.13 0.07 0.45 0.00 0.00 0.00 0.00 175.10 175.75 3m9m h ALA 44 N 8.00 -0.43 -2.57 5.51 0.00 -0.98 0.30 119.26 129.09 3m9m h ALA 44 Ca -0.28 -0.03 -0.15 0.00 0.00 0.00 0.00 54.91 54.44 3m9m h ALA 44 Cb 1.14 0.06 -0.14 0.00 0.00 0.00 0.00 17.79 18.85 3m9m h ALA 44 CO 0.73 -0.42 -0.47 -0.08 0.00 0.00 0.00 179.25 179.01 3m9m s THR 45 N -2.21 0.07 -0.17 0.00 -1.32 -1.07 -4.20 115.64 106.74 3m9m s THR 45 Ca -0.02 -1.66 -0.06 0.00 -1.21 0.00 0.00 61.69 58.73 3m9m s THR 45 Cb 0.00 -2.02 0.08 0.00 -1.51 0.00 0.00 72.50 69.04 3m9m s THR 45 CO 0.07 -0.30 0.36 0.00 -2.21 0.00 0.00 174.62 172.53 3m9m s ALA 46 N -4.03 -0.91 1.05 11.08 0.00 -1.26 -0.49 121.76 127.21 3m9m s ALA 46 Ca 0.23 1.29 -0.22 0.00 0.00 0.00 0.00 51.96 53.26 3m9m s ALA 46 Cb 0.05 -1.13 -0.04 0.00 0.00 0.00 0.00 23.12 22.00 3m9m s ALA 46 CO 0.03 -0.62 -0.64 0.27 0.00 0.00 0.00 175.76 174.80 3m9m n ASN 47 N 5.17 -2.95 0.30 0.00 6.94 -1.03 -4.42 115.26 119.26 3m9m n ASN 47 Ca -0.11 -0.01 0.18 0.00 -0.02 0.00 0.00 54.58 54.63 3m9m n ASN 47 Cb 0.50 -0.79 0.92 0.00 -2.36 0.00 0.00 39.78 38.06 3m9m n ASN 47 CO 0.00 0.00 0.00 1.88 -1.03 0.00 0.00 177.26 178.11 3m9m h TYR 48 N -1.51 0.00 0.00 -2.53 -1.99 -1.96 -1.19 116.97 107.80 3m9m h TYR 48 Ca -0.46 0.00 -0.05 0.00 2.00 0.00 0.00 58.73 60.22 3m9m h TYR 48 Cb 1.36 0.00 -0.01 0.00 2.00 0.00 0.00 36.73 40.09 3m9m h TYR 48 CO 0.12 0.03 -0.23 0.93 -0.00 0.00 0.00 178.16 179.01 3m9m h GLU 49 N 0.00 0.00 0.04 4.88 3.07 -1.88 -2.86 114.58 117.83 3m9m h GLU 49 Ca -0.00 0.00 -0.29 0.00 -0.50 0.00 0.00 59.36 58.57 3m9m h GLU 49 Cb 0.25 0.00 -0.03 0.00 -0.84 0.00 0.00 28.75 28.12 3m9m h GLU 49 CO 0.00 0.23 -1.59 0.00 -1.40 0.00 0.00 179.01 176.26 3m9m h ALA 50 N 1.77 0.55 -0.34 3.43 0.00 -1.50 -3.36 119.26 119.81 3m9m h ALA 50 Ca -0.00 -1.29 -0.12 0.00 0.00 0.00 0.00 54.91 53.50 3m9m h ALA 50 Cb 0.76 0.37 -0.01 0.00 0.00 0.00 0.00 17.79 18.91 3m9m h ALA 50 CO 0.03 1.40 -0.26 0.00 0.00 0.00 0.00 179.25 180.42 3m9m h ARG 51 N 0.02 0.70 0.00 0.00 3.08 -1.37 -2.60 114.38 114.21 3m9m h ARG 51 Ca -0.25 -0.29 0.00 0.00 0.07 0.00 0.00 59.98 59.51 3m9m h ARG 51 Cb 1.98 -0.03 0.00 0.00 0.08 0.00 0.00 29.97 32.00 3m9m h ARG 51 CO 0.11 0.89 0.56 0.87 -1.07 0.00 0.00 179.97 181.33 3m9m h LYS 52 N 0.60 0.00 -0.36 0.04 1.57 -1.65 0.16 116.57 116.93 3m9m h LYS 52 Ca 0.08 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.86 3m9m h LYS 52 Cb 0.76 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.07 3m9m h LYS 52 CO 0.06 0.00 0.00 1.19 -0.57 0.00 0.00 179.45 180.13 3m9m n PHE 53 N -2.74 0.47 0.00 -1.35 3.72 -0.99 -4.98 117.46 111.60 3m9m n PHE 53 Ca -0.01 -0.41 0.00 0.00 -0.05 0.00 0.00 57.45 56.98 3m9m n PHE 53 Cb 0.59 -0.02 0.00 0.00 -0.94 0.00 0.00 39.48 39.11 3m9m n PHE 53 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3m9m n GLY 54 N 0.78 2.39 3.67 1.37 0.00 0.56 -4.93 105.19 109.01 3m9m n GLY 54 Ca 0.13 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.73 3m9m n GLY 54 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3m9m s VAL 55 N -2.49 4.52 0.32 1.61 1.01 -1.19 -4.99 120.40 119.19 3m9m s VAL 55 Ca 0.00 1.83 -0.07 0.00 0.00 0.00 0.00 61.98 63.74 3m9m s VAL 55 Cb 0.00 -4.18 0.01 0.00 0.00 0.00 0.00 36.38 32.21 3m9m s VAL 55 CO 0.00 -0.12 0.51 -1.59 0.00 0.00 0.00 175.10 173.90 3m9m s LYS 56 N 2.98 1.86 0.05 2.72 -2.85 -1.26 -3.48 119.74 119.75 3m9m s LYS 56 Ca 0.49 -1.59 -0.33 0.00 -1.00 0.00 0.00 55.97 53.54 3m9m s LYS 56 Cb -0.19 0.47 -0.12 0.00 -2.06 0.00 0.00 37.83 35.93 3m9m s LYS 56 CO 0.12 -0.78 1.77 0.00 0.10 0.00 0.00 175.35 176.56 3m9m n ALA 57 N -0.51 1.36 0.00 0.59 0.00 -1.26 -3.35 120.51 117.34 3m9m n ALA 57 Ca -0.01 0.34 0.00 0.00 0.00 0.00 0.00 53.44 53.77 3m9m n ALA 57 Cb 0.61 -2.48 0.00 0.00 0.00 0.00 0.00 19.45 17.59 3m9m n ALA 57 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3m9m n GLY 58 N 4.03 2.52 3.57 0.00 0.00 0.10 -4.97 105.19 110.44 3m9m n GLY 58 Ca 0.20 -0.81 -0.48 0.00 0.00 0.00 0.00 46.02 44.92 3m9m n GLY 58 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 3m9m n ILE 59 N 0.00 1.10 -1.53 -0.61 -6.64 -1.21 -4.10 119.36 106.37 3m9m n ILE 59 Ca 0.00 -0.27 -0.41 0.00 -1.77 0.00 0.00 62.75 60.30 3m9m n ILE 59 Cb 0.00 -0.80 0.02 0.00 -1.44 0.00 0.00 39.64 37.42 3m9m n ILE 59 CO 0.00 0.00 0.00 -2.65 -1.77 0.00 0.00 176.55 172.13 3m9m n PRO 60 N 1.55 0.87 0.22 6.28 -0.02 -1.26 -2.53 135.00 140.10 3m9m n PRO 60 Ca 0.14 0.32 0.18 0.00 -2.02 0.00 0.00 63.50 62.12 3m9m n PRO 60 Cb 0.25 -1.78 0.83 0.00 -0.02 0.00 0.00 33.50 32.79 3m9m n PRO 60 CO 0.00 0.00 0.00 0.82 1.98 0.00 0.00 175.50 178.30 3m9m h ILE 61 N 0.97 0.28 0.00 4.25 2.04 -1.80 0.40 117.51 123.64 3m9m h ILE 61 Ca -0.43 0.00 -0.09 0.00 1.00 0.00 0.00 64.86 65.33 3m9m h ILE 61 Cb 1.37 0.75 -0.01 0.00 -0.74 0.00 0.00 36.82 38.19 3m9m h ILE 61 CO 0.53 0.00 -0.45 0.58 0.00 0.00 0.00 178.15 178.81 3m9m h VAL 62 N 0.00 0.82 0.12 1.67 2.07 -1.88 -2.51 116.25 116.54 3m9m h VAL 62 Ca 0.09 -2.01 -0.31 0.00 0.82 0.00 0.00 66.70 65.28 3m9m h VAL 62 Cb 0.68 2.30 -0.01 0.00 -1.52 0.00 0.00 31.29 32.74 3m9m h VAL 62 CO -0.00 0.44 -1.59 -0.33 0.02 0.00 0.00 177.57 176.11 3m9m h GLU 63 N 0.00 0.25 -0.22 1.57 4.39 -1.28 -3.16 114.58 116.13 3m9m h GLU 63 Ca -0.00 -0.42 0.05 0.00 0.34 0.00 0.00 59.36 59.32 3m9m h GLU 63 Cb 1.26 0.16 -0.05 0.00 -0.10 0.00 0.00 28.75 30.02 3m9m h GLU 63 CO 0.06 1.10 -0.11 0.00 -1.16 0.00 0.00 179.01 178.90 3m9m h ALA 64 N 0.46 0.07 0.00 3.43 0.00 -1.33 -1.17 119.26 120.71 3m9m h ALA 64 Ca -0.27 0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.73 3m9m h ALA 64 Cb 2.02 0.27 0.00 0.00 0.00 0.00 0.00 17.79 20.08 3m9m h ALA 64 CO 0.15 -0.53 0.00 0.87 0.00 0.00 0.00 179.25 179.74 3m9m h LYS 65 N -0.09 0.00 0.05 0.00 1.57 -1.54 0.21 116.57 116.76 3m9m h LYS 65 Ca 0.12 0.00 -0.23 0.00 -1.87 0.00 0.00 60.65 58.66 3m9m h LYS 65 Cb 0.27 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.56 3m9m h LYS 65 CO -0.28 0.00 -1.10 0.87 -0.57 0.00 0.00 179.45 178.38 3m9m h LYS 66 N 0.00 0.10 0.00 3.15 1.57 -1.22 -2.22 116.57 117.94 3m9m h LYS 66 Ca 0.00 -0.16 -0.11 0.00 -1.87 0.00 0.00 60.65 58.51 3m9m h LYS 66 Cb 0.39 0.06 -0.02 0.00 0.08 0.00 0.00 32.23 32.74 3m9m h LYS 66 CO 0.00 1.07 -0.64 0.82 -0.57 0.00 0.00 179.45 180.13 3m9m h ILE 67 N 0.03 1.13 -2.20 1.86 2.04 -0.61 -3.41 117.51 116.35 3m9m h ILE 67 Ca -0.06 -2.08 -0.56 0.00 1.00 0.00 0.00 64.86 63.16 3m9m h ILE 67 Cb 1.85 2.37 -0.41 0.00 -0.74 0.00 0.00 36.82 39.88 3m9m h ILE 67 CO 0.16 0.38 -0.80 0.18 0.00 0.00 0.00 178.15 178.06 3m9m n LEU 68 N -4.54 3.33 0.03 1.44 4.77 0.68 -4.95 117.00 117.76 3m9m n LEU 68 Ca -0.20 -5.46 0.21 0.00 -0.03 0.00 0.00 56.01 50.53 3m9m n LEU 68 Cb 0.53 -0.18 0.60 0.00 -2.33 0.00 0.00 43.42 42.04 3m9m n LEU 68 CO 0.23 2.31 1.19 1.55 -1.33 0.00 0.00 177.39 181.34 3m9m h PRO 69 N 3.09 0.00 -0.55 3.23 0.13 -1.55 -1.67 132.00 134.67 3m9m h PRO 69 Ca 0.12 0.00 -0.17 0.00 -0.87 0.00 0.00 66.00 65.08 3m9m h PRO 69 Cb 0.65 0.00 -0.10 0.00 0.13 0.00 0.00 31.00 31.68 3m9m h PRO 69 CO 0.72 0.00 0.15 0.09 -0.23 0.00 0.00 178.00 178.73 3m9m n ASN 70 N -3.38 4.02 -4.93 1.44 3.02 -1.26 -5.00 115.26 109.17 3m9m n ASN 70 Ca 0.11 -3.32 -0.26 0.00 -0.03 0.00 0.00 54.58 51.09 3m9m n ASN 70 Cb 0.93 -0.68 0.01 0.00 -0.61 0.00 0.00 39.78 39.44 3m9m n ASN 70 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3m9m s ALA 71 N -3.03 3.49 -0.70 5.41 0.00 -0.63 -5.00 121.76 121.30 3m9m s ALA 71 Ca 0.50 -0.76 -0.27 0.00 0.00 0.00 0.00 51.96 51.42 3m9m s ALA 71 Cb 0.41 -2.43 0.03 0.00 0.00 0.00 0.00 23.12 21.13 3m9m s ALA 71 CO 0.09 -0.50 1.27 0.08 0.00 0.00 0.00 175.76 176.70 3m9m s VAL 72 N -2.75 3.78 -0.31 0.00 1.01 -0.88 -4.97 120.40 116.29 3m9m s VAL 72 Ca 0.49 0.52 -0.16 0.00 0.00 0.00 0.00 61.98 62.84 3m9m s VAL 72 Cb -0.10 -4.86 -0.02 0.00 0.00 0.00 0.00 36.38 31.39 3m9m s VAL 72 CO 0.42 -1.73 0.40 -0.31 0.00 0.00 0.00 175.10 173.88 3m9m s TYR 73 N 5.60 3.22 0.15 5.22 2.02 -1.26 -0.99 117.35 131.31 3m9m s TYR 73 Ca 0.37 0.23 0.11 0.00 -0.37 0.00 0.00 57.07 57.41 3m9m s TYR 73 Cb -0.08 -2.67 -0.04 0.00 -0.40 0.00 0.00 41.96 38.77 3m9m s TYR 73 CO 0.17 -0.35 -0.26 -0.51 -1.57 0.00 0.00 175.55 173.03 3m9m s LEU 74 N 2.12 2.35 0.56 -1.29 1.43 -0.84 -4.99 118.68 118.03 3m9m s LEU 74 Ca 0.15 -0.78 -0.15 0.00 -1.03 0.00 0.00 54.13 52.31 3m9m s LEU 74 Cb -0.16 -1.18 -0.05 0.00 0.03 0.00 0.00 46.19 44.82 3m9m s LEU 74 CO 0.11 0.15 1.02 -2.16 0.23 0.00 0.00 176.35 175.70 3m9m s PRO 75 N -2.24 3.65 -0.01 1.29 0.04 -1.26 -0.56 135.00 135.90 3m9m s PRO 75 Ca 0.16 1.00 -0.30 0.00 0.04 0.00 0.00 61.00 61.89 3m9m s PRO 75 Cb -0.09 -2.09 -0.05 0.00 0.04 0.00 0.00 34.50 32.31 3m9m s PRO 75 CO 0.07 -0.53 1.35 1.41 0.04 0.00 0.00 177.00 179.35 3m9m s MET 76 N -4.30 4.30 -0.87 4.56 1.75 -0.81 -4.75 119.30 119.19 3m9m s MET 76 Ca 0.60 1.90 -0.01 0.00 -1.25 0.00 0.00 55.69 56.92 3m9m s MET 76 Cb -0.12 -3.56 0.21 0.00 2.84 0.00 0.00 34.83 34.20 3m9m s MET 76 CO 0.38 -0.54 0.75 1.03 -0.65 0.00 0.00 175.02 175.99 3m9m s ARG 77 N 2.33 3.20 0.11 4.11 0.52 -1.26 -4.91 118.95 123.04 3m9m s ARG 77 Ca 0.62 -3.28 -0.14 0.00 -0.52 0.00 0.00 55.73 52.42 3m9m s ARG 77 Cb -0.30 -3.91 -0.09 0.00 0.52 0.00 0.00 34.95 31.17 3m9m s ARG 77 CO 0.25 -1.26 1.40 -0.22 0.02 0.00 0.00 175.30 175.49 3m9m h LYS 78 N 5.97 0.77 0.00 3.54 1.63 -1.99 -2.71 116.57 123.77 3m9m h LYS 78 Ca 0.15 -0.45 -0.00 0.00 -0.85 0.00 0.00 60.65 59.50 3m9m h LYS 78 Cb 0.81 0.04 -0.00 0.00 -0.60 0.00 0.00 32.23 32.47 3m9m h LYS 78 CO 0.84 1.07 -0.02 0.93 -3.45 0.00 0.00 179.45 178.83 3m9m h GLU 79 N 0.52 0.00 0.13 1.90 3.07 -1.99 -0.96 114.58 117.25 3m9m h GLU 79 Ca 0.03 0.00 -0.28 0.00 -0.50 0.00 0.00 59.36 58.61 3m9m h GLU 79 Cb 0.99 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.90 3m9m h GLU 79 CO 0.09 0.02 -1.33 0.28 -1.40 0.00 0.00 179.01 176.67 3m9m h VAL 80 N 0.00 1.40 0.00 3.13 2.07 -1.96 -3.14 116.25 117.75 3m9m h VAL 80 Ca -0.00 -2.98 -0.14 0.00 0.82 0.00 0.00 66.70 64.39 3m9m h VAL 80 Cb 0.04 2.90 -0.02 0.00 -1.52 0.00 0.00 31.29 32.68 3m9m h VAL 80 CO 0.00 0.87 -0.69 1.88 0.02 0.00 0.00 177.57 179.65 3m9m h TYR 81 N 0.07 0.00 -0.74 1.57 0.05 -1.14 -2.92 116.97 113.86 3m9m h TYR 81 Ca -0.17 0.00 -0.05 0.00 0.05 0.00 0.00 58.73 58.57 3m9m h TYR 81 Cb 1.99 0.00 -0.03 0.00 1.01 0.00 0.00 36.73 39.70 3m9m h TYR 81 CO 0.07 0.69 0.28 0.37 -1.05 0.00 0.00 178.16 178.52 3m9m h GLN 82 N 0.00 1.12 0.09 4.88 5.75 -1.23 -0.60 115.11 125.12 3m9m h GLN 82 Ca -0.01 -0.20 -0.00 0.00 -0.15 0.00 0.00 58.65 58.28 3m9m h GLN 82 Cb 1.27 -0.18 0.00 0.00 1.07 0.00 0.00 27.48 29.65 3m9m h GLN 82 CO 0.09 0.91 -0.04 1.96 -2.65 0.00 0.00 178.83 179.10 3m9m h GLN 83 N 1.09 -0.12 -0.87 1.69 4.20 -1.49 -2.48 115.11 117.12 3m9m h GLN 83 Ca 0.25 0.01 0.20 0.00 0.06 0.00 0.00 58.65 59.17 3m9m h GLN 83 Cb 0.23 0.03 -0.12 0.00 0.30 0.00 0.00 27.48 27.91 3m9m h GLN 83 CO -0.02 0.41 0.38 0.28 -0.67 0.00 0.00 178.83 179.21 3m9m h VAL 84 N -0.77 0.52 0.06 -0.54 2.07 -1.49 0.61 116.25 116.70 3m9m h VAL 84 Ca -0.01 -0.15 0.01 0.00 0.82 0.00 0.00 66.70 67.37 3m9m h VAL 84 Cb 0.58 0.06 -0.01 0.00 -1.52 0.00 0.00 31.29 30.40 3m9m h VAL 84 CO 0.02 0.08 -0.08 -1.28 0.02 0.00 0.00 177.57 176.33 3m9m h SER 85 N 0.42 -0.22 -0.47 0.57 0.87 -1.07 -2.01 113.55 111.65 3m9m h SER 85 Ca 0.53 0.02 0.01 0.00 -1.23 0.00 0.00 61.79 61.12 3m9m h SER 85 Cb 0.96 0.08 -0.02 0.00 -0.44 0.00 0.00 62.40 62.98 3m9m h SER 85 CO -0.50 -0.12 0.30 0.28 -0.53 0.00 0.00 176.83 176.26 3m9m h SER 86 N -0.17 0.52 -0.55 6.23 0.02 -0.62 0.20 113.55 119.18 3m9m h SER 86 Ca 0.01 -0.01 0.08 0.00 -0.84 0.00 0.00 61.79 61.03 3m9m h SER 86 Cb 0.18 -0.12 -0.07 0.00 0.14 0.00 0.00 62.40 62.52 3m9m h SER 86 CO -0.04 0.37 0.18 0.03 -1.14 0.00 0.00 176.83 176.24 3m9m h ARG 87 N 0.62 0.35 -0.35 3.45 3.08 -0.77 0.11 114.38 120.86 3m9m h ARG 87 Ca 0.17 -0.02 -0.02 0.00 0.07 0.00 0.00 59.98 60.18 3m9m h ARG 87 Cb -0.06 -0.08 -0.02 0.00 0.08 0.00 0.00 29.97 29.90 3m9m h ARG 87 CO -0.05 0.23 0.13 0.82 -1.07 0.00 0.00 179.97 180.03 3m9m h ILE 88 N 0.36 1.19 -0.27 2.04 2.04 -0.60 -2.63 117.51 119.65 3m9m h ILE 88 Ca 0.27 -0.61 0.07 0.00 1.00 0.00 0.00 64.86 65.59 3m9m h ILE 88 Cb 0.33 0.93 -0.08 0.00 -0.74 0.00 0.00 36.82 37.26 3m9m h ILE 88 CO -0.29 0.21 -0.28 0.24 0.00 0.00 0.00 178.15 178.03 3m9m h MET 89 N 0.42 -0.27 -1.02 2.37 2.86 0.68 0.24 114.93 120.22 3m9m h MET 89 Ca 0.12 0.02 0.25 0.00 -2.06 0.00 0.00 59.70 58.03 3m9m h MET 89 Cb 0.20 0.06 -0.10 0.00 0.06 0.00 0.00 31.60 31.82 3m9m h MET 89 CO -0.01 -0.18 0.64 -0.91 1.06 0.00 0.00 176.91 177.52 3m9m h ASN 90 N -0.28 0.54 -0.82 1.22 2.35 -0.62 0.47 115.58 118.43 3m9m h ASN 90 Ca 0.14 0.10 -0.01 0.00 -0.55 0.00 0.00 56.30 55.98 3m9m h ASN 90 Cb 0.50 0.01 -0.04 0.00 0.05 0.00 0.00 38.32 38.84 3m9m h ASN 90 CO -0.43 0.11 0.47 -0.07 -1.65 0.00 0.00 177.43 175.86 3m9m h LEU 91 N 0.48 1.02 -0.65 1.61 3.38 -0.17 -2.57 115.31 118.40 3m9m h LEU 91 Ca 0.60 -0.08 -0.06 0.00 0.09 0.00 0.00 57.88 58.43 3m9m h LEU 91 Cb 1.36 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 41.85 3m9m h LEU 91 CO -0.35 0.81 -0.29 -0.07 0.09 0.00 0.00 178.44 178.63 3m9m h LEU 92 N 1.15 0.00 -1.03 1.67 3.38 0.49 -3.20 115.31 117.77 3m9m h LEU 92 Ca 0.29 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.26 3m9m h LEU 92 Cb 0.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.75 3m9m h LEU 92 CO -0.05 0.29 0.00 0.54 0.09 0.00 0.00 178.44 179.31 3m9m n ARG 93 N -3.31 0.14 0.14 1.13 1.74 -0.68 -2.26 116.66 113.56 3m9m n ARG 93 Ca 0.01 0.54 -0.24 0.00 -0.77 0.00 0.00 57.85 57.39 3m9m n ARG 93 Cb 0.54 -1.88 -0.16 0.00 -1.02 0.00 0.00 32.46 29.94 3m9m n ARG 93 CO 0.00 0.00 0.00 0.93 -1.52 0.00 0.00 177.63 177.04 3m9m h GLU 94 N 0.00 0.53 0.00 5.56 5.08 -1.67 -3.28 114.58 120.79 3m9m h GLU 94 Ca 0.00 -0.89 0.00 0.00 -1.00 0.00 0.00 59.36 57.47 3m9m h GLU 94 Cb 0.13 0.33 0.00 0.00 0.50 0.00 0.00 28.75 29.71 3m9m h GLU 94 CO 0.00 1.43 0.00 0.66 -1.00 0.00 0.00 179.01 180.10 3m9m n TYR 95 N -3.71 0.00 0.00 4.33 4.01 -0.96 -4.77 117.16 116.06 3m9m n TYR 95 Ca -0.16 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.58 3m9m n TYR 95 Cb 1.10 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 40.13 3m9m n TYR 95 CO 0.00 0.00 0.00 0.45 -0.46 0.00 0.00 176.86 176.85 3m9m n SER 96 N -0.88 0.00 0.11 7.72 2.88 -1.24 -4.91 113.62 117.30 3m9m n SER 96 Ca 0.10 0.00 0.01 0.00 -1.33 0.00 0.00 58.87 57.65 3m9m n SER 96 Cb 0.05 0.00 -0.02 0.00 -0.75 0.00 0.00 64.21 63.49 3m9m n SER 96 CO 0.00 0.00 0.00 -0.33 -1.23 0.00 0.00 175.04 173.48 3m9m h GLU 97 N 0.00 0.00 -4.88 -1.46 3.07 -1.86 -3.42 114.58 106.03 3m9m h GLU 97 Ca 0.00 0.00 -0.69 0.00 -0.50 0.00 0.00 59.36 58.17 3m9m h GLU 97 Cb 0.00 0.00 -0.19 0.00 -0.84 0.00 0.00 28.75 27.72 3m9m h GLU 97 CO 0.00 0.50 0.48 0.15 -1.40 0.00 0.00 179.01 178.74 3m9m s LYS 98 N -2.93 3.33 -0.01 2.33 1.02 -1.26 -5.00 119.74 117.22 3m9m s LYS 98 Ca 0.02 -1.51 0.03 0.00 0.02 0.00 0.00 55.97 54.52 3m9m s LYS 98 Cb 0.08 -4.53 -0.01 0.00 -0.52 0.00 0.00 37.83 32.86 3m9m s LYS 98 CO 0.77 -1.66 -0.10 -1.50 -0.92 0.00 0.00 175.35 171.94 3m9m s ILE 99 N 2.70 0.78 -0.18 2.17 2.07 -1.26 -2.24 121.20 125.24 3m9m s ILE 99 Ca 0.23 -0.41 0.01 0.00 -1.41 0.00 0.00 60.65 59.07 3m9m s ILE 99 Cb -0.14 -0.66 0.02 0.00 0.13 0.00 0.00 42.46 41.81 3m9m s ILE 99 CO -0.01 0.23 -0.19 -0.70 -1.91 0.00 0.00 174.94 172.36 3m9m s GLU 100 N -0.13 3.01 -0.74 3.50 2.12 -0.33 -4.07 118.70 122.05 3m9m s GLU 100 Ca 0.02 -0.82 -0.19 0.00 0.36 0.00 0.00 54.97 54.34 3m9m s GLU 100 Cb -0.05 -2.58 0.12 0.00 0.26 0.00 0.00 34.13 31.88 3m9m s GLU 100 CO -0.00 -0.20 0.88 0.42 -0.54 0.00 0.00 175.26 175.82 3m9m s ILE 101 N 1.28 4.83 0.01 -3.70 1.01 -1.26 -0.72 121.20 122.64 3m9m s ILE 101 Ca 0.04 -1.29 -0.25 0.00 0.00 0.00 0.00 60.65 59.16 3m9m s ILE 101 Cb -0.13 -4.61 -0.18 0.00 0.01 0.00 0.00 42.46 37.56 3m9m s ILE 101 CO -0.12 -1.28 1.31 0.00 0.00 0.00 0.00 174.94 174.85 3m9m h ALA 102 N 8.94 -0.21 -3.17 9.38 0.00 -1.59 -3.45 119.26 129.14 3m9m h ALA 102 Ca -0.10 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.63 3m9m h ALA 102 Cb 1.06 0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.93 3m9m h ALA 102 CO 1.07 -0.45 0.00 -1.13 0.00 0.00 0.00 179.25 178.74 3m9m n SER 103 N -5.03 0.38 0.00 0.00 3.41 -1.13 -4.97 113.62 106.28 3m9m n SER 103 Ca -0.09 -0.93 0.10 0.00 -0.26 0.00 0.00 58.87 57.69 3m9m n SER 103 Cb 0.23 0.00 0.48 0.00 -0.26 0.00 0.00 64.21 64.66 3m9m n SER 103 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3m9m n ILE 104 N 0.00 0.44 -2.50 -1.33 3.06 -1.26 -3.54 119.36 114.22 3m9m n ILE 104 Ca 0.00 0.11 -0.02 0.00 -2.50 0.00 0.00 62.75 60.34 3m9m n ILE 104 Cb 0.00 -0.79 0.04 0.00 0.54 0.00 0.00 39.64 39.43 3m9m n ILE 104 CO 0.00 0.00 0.00 -0.90 -2.50 0.00 0.00 176.55 173.15 3m9m n ASP 105 N -1.31 -0.20 -3.71 9.51 5.75 -1.26 -4.76 116.55 120.57 3m9m n ASP 105 Ca 0.09 -2.08 -0.12 0.00 -0.01 0.00 0.00 54.79 52.67 3m9m n ASP 105 Cb 0.16 0.14 -0.13 0.00 -1.03 0.00 0.00 41.12 40.26 3m9m n ASP 105 CO 0.00 0.00 0.00 -1.61 -0.11 0.00 0.00 177.20 175.48 3m9m s GLU 106 N -0.84 0.21 -0.01 0.11 2.02 -1.23 -2.31 118.70 116.66 3m9m s GLU 106 Ca 0.15 0.61 -0.00 0.00 0.02 0.00 0.00 54.97 55.75 3m9m s GLU 106 Cb 0.29 -0.09 0.01 0.00 0.10 0.00 0.00 34.13 34.44 3m9m s GLU 106 CO -0.08 -0.19 0.01 0.00 0.02 0.00 0.00 175.26 175.02 3m9m s ALA 107 N 1.55 -0.01 -0.16 5.21 0.00 -0.79 -1.35 121.76 126.22 3m9m s ALA 107 Ca -0.07 0.07 -0.04 0.00 0.00 0.00 0.00 51.96 51.92 3m9m s ALA 107 Cb -0.11 -0.05 -0.03 0.00 0.00 0.00 0.00 23.12 22.93 3m9m s ALA 107 CO -0.09 -0.02 -0.01 0.71 0.00 0.00 0.00 175.76 176.35 3m9m s TYR 108 N 0.17 3.08 -0.09 0.00 2.02 0.10 -0.86 117.35 121.78 3m9m s TYR 108 Ca -0.01 -0.18 0.04 0.00 -0.37 0.00 0.00 57.07 56.54 3m9m s TYR 108 Cb -0.02 -1.98 -0.01 0.00 -0.40 0.00 0.00 41.96 39.56 3m9m s TYR 108 CO -0.00 0.04 -0.22 -0.51 -1.57 0.00 0.00 175.55 173.28 3m9m s LEU 109 N 0.29 2.22 -0.50 -1.29 1.02 0.14 -1.19 118.68 119.38 3m9m s LEU 109 Ca -0.02 -0.49 -0.16 0.00 0.02 0.00 0.00 54.13 53.48 3m9m s LEU 109 Cb -0.14 -1.44 0.09 0.00 0.02 0.00 0.00 46.19 44.72 3m9m s LEU 109 CO 0.02 0.19 0.45 -0.62 0.02 0.00 0.00 176.35 176.41 3m9m s ASP 110 N 0.17 6.17 -0.68 2.29 -1.08 -0.95 -0.55 116.67 122.03 3m9m s ASP 110 Ca -0.12 -1.46 0.00 0.00 -0.52 0.00 0.00 52.55 50.45 3m9m s ASP 110 Cb -0.16 -2.20 0.39 0.00 -1.46 0.00 0.00 42.92 39.49 3m9m s ASP 110 CO 0.07 -0.74 1.78 2.30 0.52 0.00 0.00 175.17 179.10 3m9m n ILE 111 N 5.25 3.28 0.57 4.11 -5.35 -1.20 -4.64 119.36 121.38 3m9m n ILE 111 Ca -0.13 -4.12 0.06 0.00 -0.27 0.00 0.00 62.75 58.29 3m9m n ILE 111 Cb 0.42 -1.22 0.18 0.00 -1.74 0.00 0.00 39.64 37.29 3m9m n ILE 111 CO 0.00 0.00 0.00 -1.20 -1.76 0.00 0.00 176.55 173.59 3m9m n SER 112 N -0.63 2.44 -0.39 7.28 7.64 -1.26 -2.68 113.62 126.03 3m9m n SER 112 Ca 0.52 -2.13 0.00 0.00 1.01 0.00 0.00 58.87 58.28 3m9m n SER 112 Cb 0.47 -0.35 0.00 0.00 -1.01 0.00 0.00 64.21 63.32 3m9m n SER 112 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 3m9m n ASP 113 N 0.56 0.00 0.00 6.43 9.92 -1.26 -4.81 116.55 127.38 3m9m n ASP 113 Ca 0.13 -1.69 0.00 0.00 -0.53 0.00 0.00 54.79 52.70 3m9m n ASP 113 Cb 0.44 -0.14 0.00 0.00 -0.64 0.00 0.00 41.12 40.78 3m9m n ASP 113 CO 0.00 0.00 0.00 0.29 0.13 0.00 0.00 177.20 177.62 3m9m n LYS 114 N 0.00 3.70 -3.91 -1.24 4.76 -1.10 -5.11 118.16 115.26 3m9m n LYS 114 Ca 0.00 0.00 -0.11 0.00 -2.87 0.00 0.00 58.31 55.33 3m9m n LYS 114 Cb 0.64 -0.34 -0.00 0.00 -1.84 0.00 0.00 35.03 33.48 3m9m n LYS 114 CO 0.00 0.00 0.00 0.14 -1.37 0.00 0.00 177.40 176.17 3m9m s VAL 115 N -0.63 0.00 -0.01 -0.18 -7.23 -1.09 -5.04 120.40 106.22 3m9m s VAL 115 Ca 0.00 -1.22 0.01 0.00 -1.81 0.00 0.00 61.98 58.95 3m9m s VAL 115 Cb 0.00 -2.75 -0.01 0.00 0.56 0.00 0.00 36.38 34.18 3m9m s VAL 115 CO 0.00 0.00 -0.00 0.54 -0.31 0.00 0.00 175.10 175.33 3m9m n ARG 116 N -0.54 2.73 -4.25 4.82 1.74 -1.26 -4.81 116.66 115.10 3m9m n ARG 116 Ca -0.05 0.00 -0.16 0.00 -0.77 0.00 0.00 57.85 56.87 3m9m n ARG 116 Cb 0.60 -1.02 -0.09 0.00 -1.02 0.00 0.00 32.46 30.93 3m9m n ARG 116 CO 0.00 0.00 0.00 0.16 -1.52 0.00 0.00 177.63 176.27 3m9m s ASP 117 N -3.41 1.01 0.47 0.55 -4.77 -1.26 -5.04 116.67 104.22 3m9m s ASP 117 Ca -0.01 -1.59 0.31 0.00 -3.30 0.00 0.00 52.55 47.96 3m9m s ASP 117 Cb 0.00 0.47 1.34 0.00 -1.09 0.00 0.00 42.92 43.65 3m9m s ASP 117 CO 0.03 -0.96 1.93 1.88 0.70 0.00 0.00 175.17 178.75 3m9m h TYR 118 N 2.35 0.00 -0.07 2.11 0.05 -1.99 -0.44 116.97 118.99 3m9m h TYR 118 Ca -0.30 0.00 -0.20 0.00 0.05 0.00 0.00 58.73 58.28 3m9m h TYR 118 Cb 1.24 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.98 3m9m h TYR 118 CO 1.10 0.00 -0.80 -0.09 -1.05 0.00 0.00 178.16 177.31 3m9m h ARG 119 N 0.00 0.49 0.04 4.88 2.43 -1.98 0.31 114.38 120.54 3m9m h ARG 119 Ca 0.00 -0.43 -0.25 0.00 -0.81 0.00 0.00 59.98 58.48 3m9m h ARG 119 Cb 0.41 0.10 0.01 0.00 -0.42 0.00 0.00 29.97 30.07 3m9m h ARG 119 CO 0.00 1.07 -1.06 0.93 -1.51 0.00 0.00 179.97 179.40 3m9m h GLU 120 N 0.32 0.48 0.20 0.20 5.08 -1.83 -2.69 114.58 116.34 3m9m h GLU 120 Ca -0.05 -0.57 -0.01 0.00 -1.00 0.00 0.00 59.36 57.73 3m9m h GLU 120 Cb 1.41 0.18 0.00 0.00 0.50 0.00 0.00 28.75 30.84 3m9m h GLU 120 CO 0.14 1.21 -0.10 0.00 -1.00 0.00 0.00 179.01 179.27 3m9m h ALA 121 N 0.58 -0.27 -0.86 3.43 0.00 -1.02 -0.87 119.26 120.24 3m9m h ALA 121 Ca -0.12 -0.07 0.11 0.00 0.00 0.00 0.00 54.91 54.84 3m9m h ALA 121 Cb 1.72 0.11 -0.06 0.00 0.00 0.00 0.00 17.79 19.55 3m9m h ALA 121 CO 0.19 -0.64 0.56 -0.92 0.00 0.00 0.00 179.25 178.44 3m9m h TYR 122 N -0.30 0.85 -0.14 0.00 3.20 -0.96 -0.12 116.97 119.51 3m9m h TYR 122 Ca -0.03 0.02 -0.18 0.00 3.14 0.00 0.00 58.73 61.69 3m9m h TYR 122 Cb 0.23 -0.27 -0.00 0.00 1.54 0.00 0.00 36.73 38.22 3m9m h TYR 122 CO -0.06 0.36 -0.65 -0.91 -1.64 0.00 0.00 178.16 175.27 3m9m h ASN 123 N 0.76 0.59 0.09 -2.11 2.35 -1.11 -2.59 115.58 113.57 3m9m h ASN 123 Ca 0.41 -0.36 -0.07 0.00 -0.55 0.00 0.00 56.30 55.74 3m9m h ASN 123 Cb 0.54 -0.17 -0.01 0.00 0.05 0.00 0.00 38.32 38.73 3m9m h ASN 123 CO -0.18 1.09 -0.22 0.25 -1.65 0.00 0.00 177.43 176.72 3m9m h LEU 124 N 0.37 0.23 0.85 1.61 5.85 0.19 -1.03 115.31 123.39 3m9m h LEU 124 Ca -0.01 -0.06 -0.04 0.00 0.84 0.00 0.00 57.88 58.60 3m9m h LEU 124 Cb 1.22 -0.06 0.01 0.00 0.37 0.00 0.00 40.66 42.19 3m9m h LEU 124 CO 0.12 0.46 -0.41 1.23 -0.34 0.00 0.00 178.44 179.50 3m9m h GLY 125 N 0.91 -1.20 0.07 3.75 0.00 -0.77 -0.37 103.07 105.47 3m9m h GLY 125 Ca 0.04 0.44 0.15 0.00 0.00 0.00 0.00 47.33 47.96 3m9m h GLY 125 CO 0.04 -0.43 0.28 1.41 0.00 0.00 0.00 176.54 177.83 3m9m h LEU 126 N -1.21 0.22 -0.40 3.11 3.38 -1.32 0.35 115.31 119.44 3m9m h LEU 126 Ca -0.12 0.12 0.07 0.00 0.09 0.00 0.00 57.88 58.04 3m9m h LEU 126 Cb 0.88 0.11 -0.06 0.00 0.09 0.00 0.00 40.66 41.68 3m9m h LEU 126 CO 0.19 0.06 0.02 -0.08 0.09 0.00 0.00 178.44 178.72 3m9m h GLU 127 N 0.40 0.12 0.76 1.13 4.81 -1.02 -0.53 114.58 120.26 3m9m h GLU 127 Ca 0.42 -0.01 -0.03 0.00 -0.13 0.00 0.00 59.36 59.61 3m9m h GLU 127 Cb 0.68 -0.03 0.00 0.00 0.63 0.00 0.00 28.75 30.03 3m9m h GLU 127 CO -0.44 0.08 -0.41 0.82 -0.73 0.00 0.00 179.01 178.33 3m9m h ILE 128 N 0.13 0.16 -0.64 2.32 2.04 0.13 -0.29 117.51 121.36 3m9m h ILE 128 Ca 0.20 0.00 0.10 0.00 1.00 0.00 0.00 64.86 66.16 3m9m h ILE 128 Cb 0.27 0.16 -0.12 0.00 -0.74 0.00 0.00 36.82 36.40 3m9m h ILE 128 CO -0.31 0.00 -0.38 0.11 0.00 0.00 0.00 178.15 177.57 3m9m h LYS 129 N -1.08 -0.16 0.28 2.37 1.57 -0.20 -0.91 116.57 118.43 3m9m h LYS 129 Ca -0.10 0.01 -0.00 0.00 -1.87 0.00 0.00 60.65 58.69 3m9m h LYS 129 Cb 0.85 0.04 -0.03 0.00 0.08 0.00 0.00 32.23 33.17 3m9m h LYS 129 CO 0.14 -0.11 -0.43 -0.91 -0.57 0.00 0.00 179.45 177.57 3m9m h ASN 130 N -0.17 -1.25 -0.93 0.86 2.35 -0.93 0.38 115.58 115.89 3m9m h ASN 130 Ca 0.23 0.11 0.14 0.00 -0.55 0.00 0.00 56.30 56.23 3m9m h ASN 130 Cb 0.56 0.43 -0.14 0.00 0.05 0.00 0.00 38.32 39.22 3m9m h ASN 130 CO -0.72 -0.52 -0.39 1.17 -1.65 0.00 0.00 177.43 175.32 3m9m n LYS 131 N -4.99 -0.24 -0.15 0.81 3.00 -0.13 0.74 118.16 117.19 3m9m n LYS 131 Ca -0.09 1.43 -0.03 0.00 -0.00 0.00 0.00 58.31 59.62 3m9m n LYS 131 Cb 0.37 -2.12 0.06 0.00 0.00 0.00 0.00 35.03 33.34 3m9m n LYS 131 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.40 178.22 3m9m h ILE 132 N 0.00 0.79 -0.23 3.15 2.04 -0.58 0.64 117.51 123.32 3m9m h ILE 132 Ca 0.30 -0.10 -0.04 0.00 1.00 0.00 0.00 64.86 66.02 3m9m h ILE 132 Cb 0.53 0.48 -0.01 0.00 -0.74 0.00 0.00 36.82 37.08 3m9m h ILE 132 CO -0.92 0.05 -0.05 0.25 0.00 0.00 0.00 178.15 177.48 3m9m h LEU 133 N 0.29 0.32 0.44 1.44 5.85 0.25 0.14 115.31 124.04 3m9m h LEU 133 Ca 0.23 -0.06 -0.02 0.00 0.84 0.00 0.00 57.88 58.87 3m9m h LEU 133 Cb 0.27 -0.08 0.00 0.00 0.37 0.00 0.00 40.66 41.22 3m9m h LEU 133 CO -0.27 0.42 -0.21 -0.33 -0.34 0.00 0.00 178.44 177.71 3m9m h GLU 134 N 0.33 -0.57 -0.55 1.25 5.08 0.16 -1.82 114.58 118.45 3m9m h GLU 134 Ca 0.07 0.04 -0.09 0.00 -1.00 0.00 0.00 59.36 58.38 3m9m h GLU 134 Cb 0.31 0.13 -0.02 0.00 0.50 0.00 0.00 28.75 29.67 3m9m h GLU 134 CO 0.01 -0.32 -0.02 0.87 -1.00 0.00 0.00 179.01 178.55 3m9m h LYS 135 N -1.10 0.99 0.00 2.33 1.79 -0.87 -3.37 116.57 116.34 3m9m h LYS 135 Ca -0.06 -0.33 0.00 0.00 -2.18 0.00 0.00 60.65 58.08 3m9m h LYS 135 Cb 0.52 -0.08 0.00 0.00 -1.58 0.00 0.00 32.23 31.09 3m9m h LYS 135 CO 0.10 1.00 0.00 0.39 -1.08 0.00 0.00 179.45 179.86 3m9m n GLU 136 N -4.23 1.53 -4.28 3.15 -0.58 0.02 -5.02 120.64 111.24 3m9m n GLU 136 Ca 0.02 -1.02 -0.37 0.00 -0.42 0.00 0.00 57.16 55.37 3m9m n GLU 136 Cb 0.35 -0.83 -0.04 0.00 -0.57 0.00 0.00 31.44 30.35 3m9m n GLU 136 CO 0.00 0.00 0.00 0.36 -0.48 0.00 0.00 177.13 177.01 3m9m n LYS 137 N -0.27 -2.65 -4.04 3.49 0.00 -0.69 -4.94 118.16 109.06 3m9m n LYS 137 Ca 0.00 0.32 -0.34 0.00 -0.00 0.00 0.00 58.31 58.30 3m9m n LYS 137 Cb 0.29 -4.98 -0.15 0.00 -0.00 0.00 0.00 35.03 30.19 3m9m n LYS 137 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.40 177.82 3m9m s ILE 138 N -3.32 2.55 0.35 0.58 -1.09 -1.25 -4.98 121.20 114.05 3m9m s ILE 138 Ca 0.73 -0.81 -0.20 0.00 -2.23 0.00 0.00 60.65 58.14 3m9m s ILE 138 Cb -0.40 -2.13 -0.10 0.00 -1.58 0.00 0.00 42.46 38.25 3m9m s ILE 138 CO 0.95 0.47 0.86 0.42 -1.23 0.00 0.00 174.94 176.41 3m9m s THR 139 N 1.35 4.47 0.08 2.92 -4.23 -1.26 -3.98 115.64 114.99 3m9m s THR 139 Ca 0.05 1.36 -0.08 0.00 -1.18 0.00 0.00 61.69 61.84 3m9m s THR 139 Cb -0.14 -3.70 -0.01 0.00 1.34 0.00 0.00 72.50 69.99 3m9m s THR 139 CO -0.09 -0.14 0.16 0.68 -0.54 0.00 0.00 174.62 174.69 3m9m s VAL 140 N -1.95 0.15 0.06 2.29 -7.23 -1.26 -2.68 120.40 109.79 3m9m s VAL 140 Ca 0.55 -1.26 0.02 0.00 -1.81 0.00 0.00 61.98 59.48 3m9m s VAL 140 Cb -0.12 -1.36 -0.04 0.00 0.56 0.00 0.00 36.38 35.42 3m9m s VAL 140 CO 0.17 -0.70 0.12 -0.89 -0.31 0.00 0.00 175.10 173.49 3m9m s THR 141 N -3.86 4.81 -0.01 5.32 2.01 -1.03 -3.88 115.64 119.00 3m9m s THR 141 Ca 0.05 -0.61 0.07 0.00 0.31 0.00 0.00 61.69 61.51 3m9m s THR 141 Cb 0.05 -3.31 -0.02 0.00 0.01 0.00 0.00 72.50 69.23 3m9m s THR 141 CO -0.11 0.16 -0.21 -0.69 -0.69 0.00 0.00 174.62 173.08 3m9m s VAL 142 N -1.40 1.70 -0.07 3.82 1.01 -0.50 -2.06 120.40 122.91 3m9m s VAL 142 Ca 0.30 -0.95 -0.01 0.00 0.00 0.00 0.00 61.98 61.32 3m9m s VAL 142 Cb -0.12 -1.42 0.03 0.00 0.00 0.00 0.00 36.38 34.87 3m9m s VAL 142 CO 0.23 0.45 -0.01 -0.83 0.00 0.00 0.00 175.10 174.94 3m9m s GLY 143 N -0.58 0.47 -0.03 4.51 0.00 -0.50 -0.87 107.32 110.32 3m9m s GLY 143 Ca 0.08 -0.11 0.06 0.00 0.00 0.00 0.00 44.72 44.75 3m9m s GLY 143 CO -0.01 0.96 -0.21 -0.42 0.00 0.00 0.00 173.10 173.42 3m9m s ILE 144 N 1.69 2.46 0.00 0.90 1.01 0.78 -0.28 121.20 127.77 3m9m s ILE 144 Ca 0.01 -0.96 0.00 0.00 0.00 0.00 0.00 60.65 59.70 3m9m s ILE 144 Cb -0.13 -1.90 0.00 0.00 0.01 0.00 0.00 42.46 40.44 3m9m s ILE 144 CO -0.04 0.58 0.00 -0.24 0.00 0.00 0.00 174.94 175.24 3m9m n SER 145 N 2.37 0.00 0.00 3.58 2.88 -0.30 -2.19 113.62 119.97 3m9m n SER 145 Ca -0.16 -0.82 0.14 0.00 -1.33 0.00 0.00 58.87 56.70 3m9m n SER 145 Cb 0.51 0.00 0.79 0.00 -0.75 0.00 0.00 64.21 64.76 3m9m n SER 145 CO 0.00 0.00 0.00 2.29 -1.23 0.00 0.00 175.04 176.10 3m9m n LYS 146 N 0.00 0.67 -3.79 -1.46 2.85 -1.26 0.20 118.16 115.37 3m9m n LYS 146 Ca 0.00 0.01 -0.04 0.00 -1.05 0.00 0.00 58.31 57.23 3m9m n LYS 146 Cb 0.00 -1.50 -0.01 0.00 -0.65 0.00 0.00 35.03 32.87 3m9m n LYS 146 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 177.40 177.89 3m9m s ASN 147 N -2.26 -0.14 0.14 -5.58 2.20 -1.26 -4.49 114.94 103.55 3m9m s ASN 147 Ca 0.36 -0.51 -0.16 0.00 -0.94 0.00 0.00 52.86 51.61 3m9m s ASN 147 Cb 0.19 0.52 0.00 0.00 -2.00 0.00 0.00 41.25 39.97 3m9m s ASN 147 CO 0.38 -0.99 1.73 0.11 -2.94 0.00 0.00 177.10 175.39 3m9m h LYS 148 N 2.00 0.58 -0.55 3.55 1.57 -1.90 -1.95 116.57 119.86 3m9m h LYS 148 Ca -0.25 -0.08 0.07 0.00 -1.87 0.00 0.00 60.65 58.52 3m9m h LYS 148 Cb 1.23 -0.11 -0.06 0.00 0.08 0.00 0.00 32.23 33.37 3m9m h LYS 148 CO 0.28 0.50 0.24 0.28 -0.57 0.00 0.00 179.45 180.17 3m9m h VAL 149 N 0.52 0.87 0.00 0.50 2.07 -1.95 -0.15 116.25 118.11 3m9m h VAL 149 Ca 0.14 -0.15 0.00 0.00 0.82 0.00 0.00 66.70 67.51 3m9m h VAL 149 Cb 0.10 0.38 0.00 0.00 -1.52 0.00 0.00 31.29 30.24 3m9m h VAL 149 CO -0.02 0.08 -0.33 -0.26 0.02 0.00 0.00 177.57 177.06 3m9m h PHE 150 N 0.45 0.00 -0.04 1.57 0.04 -1.96 -2.18 116.94 114.82 3m9m h PHE 150 Ca 0.26 0.00 -0.16 0.00 2.80 0.00 0.00 57.97 60.87 3m9m h PHE 150 Cb 0.25 0.00 0.01 0.00 2.20 0.00 0.00 35.95 38.41 3m9m h PHE 150 CO -0.13 0.00 -0.62 0.00 -0.60 0.00 0.00 178.31 176.96 3m9m h ALA 151 N 2.38 0.13 0.57 2.45 0.00 -0.81 -1.76 119.26 122.22 3m9m h ALA 151 Ca 0.00 -0.56 -0.03 0.00 0.00 0.00 0.00 54.91 54.32 3m9m h ALA 151 Cb 0.81 0.02 0.01 0.00 0.00 0.00 0.00 17.79 18.62 3m9m h ALA 151 CO 0.00 0.40 -0.27 -0.22 0.00 0.00 0.00 179.25 179.16 3m9m h LYS 152 N 0.04 -0.74 -0.99 0.00 3.64 -1.03 -2.10 116.57 115.39 3m9m h LYS 152 Ca -0.07 0.05 0.22 0.00 -1.27 0.00 0.00 60.65 59.59 3m9m h LYS 152 Cb 1.30 0.17 -0.12 0.00 -0.41 0.00 0.00 32.23 33.17 3m9m h LYS 152 CO 0.12 -0.49 0.57 0.82 -2.27 0.00 0.00 179.45 178.20 3m9m h ILE 153 N -0.76 0.59 -0.07 2.00 2.04 -1.43 0.68 117.51 120.56 3m9m h ILE 153 Ca -0.08 -0.21 0.04 0.00 1.00 0.00 0.00 64.86 65.61 3m9m h ILE 153 Cb 0.59 -0.09 -0.05 0.00 -0.74 0.00 0.00 36.82 36.53 3m9m h ILE 153 CO 0.13 0.11 -0.25 0.00 0.00 0.00 0.00 178.15 178.14 3m9m h ALA 154 N 1.70 -0.28 -0.99 1.87 0.00 -0.65 -1.86 119.26 119.04 3m9m h ALA 154 Ca 0.61 0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.54 3m9m h ALA 154 Cb 1.08 0.46 -0.05 0.00 0.00 0.00 0.00 17.79 19.28 3m9m h ALA 154 CO -0.45 -0.73 0.63 0.00 0.00 0.00 0.00 179.25 178.70 3m9m h ALA 155 N 0.54 1.25 -0.99 0.00 0.00 -0.49 -1.36 119.26 118.21 3m9m h ALA 155 Ca 0.08 -0.08 0.16 0.00 0.00 0.00 0.00 54.91 55.06 3m9m h ALA 155 Cb 0.47 -0.40 -0.09 0.00 0.00 0.00 0.00 17.79 17.76 3m9m h ALA 155 CO -0.27 0.67 0.62 -0.44 0.00 0.00 0.00 179.25 179.83 3m9m h ASP 156 N 1.35 0.82 0.77 0.00 3.32 -0.34 0.16 116.42 122.50 3m9m h ASP 156 Ca 0.36 0.07 -0.18 0.00 0.02 0.00 0.00 57.03 57.30 3m9m h ASP 156 Cb -0.12 -0.09 -0.02 0.00 0.22 0.00 0.00 39.33 39.32 3m9m h ASP 156 CO -0.07 0.37 -0.83 0.24 -1.72 0.00 0.00 179.24 177.22 3m9m h MET 157 N 0.84 0.04 0.00 3.56 2.86 -0.56 -3.35 114.93 118.32 3m9m h MET 157 Ca 0.53 -0.04 -0.08 0.00 -2.06 0.00 0.00 59.70 58.04 3m9m h MET 157 Cb 0.72 0.01 -0.02 0.00 0.06 0.00 0.00 31.60 32.38 3m9m h MET 157 CO -0.31 0.85 -1.54 0.00 1.06 0.00 0.00 176.91 176.97 3m9m n ALA 158 N -2.40 2.33 -1.67 6.32 0.00 -0.45 -4.95 120.51 119.69 3m9m n ALA 158 Ca -0.01 -0.51 -0.39 0.00 0.00 0.00 0.00 53.44 52.53 3m9m n ALA 158 Cb 0.79 -0.87 0.04 0.00 0.00 0.00 0.00 19.45 19.41 3m9m n ALA 158 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.50 177.86 3m9m n LYS 159 N -2.63 1.29 -2.74 0.00 2.85 0.44 -4.16 118.16 113.21 3m9m n LYS 159 Ca -0.07 0.48 -0.21 0.00 -1.05 0.00 0.00 58.31 57.46 3m9m n LYS 159 Cb 0.70 -2.33 0.07 0.00 -0.65 0.00 0.00 35.03 32.82 3m9m n LYS 159 CO 0.00 0.00 0.00 -1.25 -0.05 0.00 0.00 177.40 176.10 3m9m s PRO 160 N -2.72 2.14 -1.02 -1.58 0.04 -1.26 -4.98 135.00 125.62 3m9m s PRO 160 Ca 0.73 -1.16 -0.22 0.00 0.04 0.00 0.00 61.00 60.38 3m9m s PRO 160 Cb -0.44 -2.48 0.03 0.00 0.04 0.00 0.00 34.50 31.65 3m9m s PRO 160 CO 0.49 -1.02 0.42 -1.71 0.04 0.00 0.00 177.00 175.22 3m9m n ASN 161 N -2.49 -2.36 -0.43 6.66 5.15 -1.26 -4.93 115.26 115.61 3m9m n ASN 161 Ca 0.13 -1.04 0.00 0.00 -0.60 0.00 0.00 54.58 53.07 3m9m n ASN 161 Cb 0.60 -1.25 0.00 0.00 -0.53 0.00 0.00 39.78 38.60 3m9m n ASN 161 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 3m9m n GLY 162 N -1.96 4.87 3.61 8.20 0.00 -1.25 -4.97 105.19 113.69 3m9m n GLY 162 Ca -0.13 -1.56 -0.14 0.00 0.00 0.00 0.00 46.02 44.19 3m9m n GLY 162 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 3m9m s ILE 163 N -1.26 0.00 0.22 -0.61 2.07 -1.25 -1.40 121.20 118.96 3m9m s ILE 163 Ca 0.00 0.00 -0.22 0.00 -1.41 0.00 0.00 60.65 59.02 3m9m s ILE 163 Cb 0.00 -1.00 0.04 0.00 0.13 0.00 0.00 42.46 41.63 3m9m s ILE 163 CO 0.00 0.00 0.69 -0.75 -1.91 0.00 0.00 174.94 172.97 3m9m s LYS 164 N 0.11 1.53 -0.03 3.50 2.47 -0.05 -4.93 119.74 122.33 3m9m s LYS 164 Ca -0.01 -0.75 -0.02 0.00 -1.56 0.00 0.00 55.97 53.63 3m9m s LYS 164 Cb -0.04 0.58 0.02 0.00 -1.46 0.00 0.00 37.83 36.93 3m9m s LYS 164 CO 0.01 -0.69 0.07 0.08 0.16 0.00 0.00 175.35 174.98 3m9m s VAL 165 N -3.79 -0.02 -0.78 4.02 1.01 -1.26 -0.15 120.40 119.43 3m9m s VAL 165 Ca 0.07 0.06 0.03 0.00 0.00 0.00 0.00 61.98 62.14 3m9m s VAL 165 Cb -0.04 -0.12 0.22 0.00 0.00 0.00 0.00 36.38 36.44 3m9m s VAL 165 CO -0.01 0.03 0.72 -0.38 0.00 0.00 0.00 175.10 175.45 3m9m n ILE 166 N 3.42 2.52 -0.68 2.22 5.41 -0.93 -4.98 119.36 126.34 3m9m n ILE 166 Ca -0.17 -5.11 -0.32 0.00 1.00 0.00 0.00 62.75 58.14 3m9m n ILE 166 Cb 0.57 -2.22 0.17 0.00 -0.71 0.00 0.00 39.64 37.45 3m9m n ILE 166 CO 0.00 0.00 0.00 -0.90 0.00 0.00 0.00 176.55 175.65 3m9m n ASP 167 N 1.73 -2.30 -0.40 4.38 5.68 -1.26 -4.35 116.55 120.03 3m9m n ASP 167 Ca 0.23 -0.07 0.33 0.00 -0.50 0.00 0.00 54.79 54.78 3m9m n ASP 167 Cb 0.37 -1.00 0.65 0.00 -1.14 0.00 0.00 41.12 40.00 3m9m n ASP 167 CO 0.00 0.00 0.00 0.44 -1.33 0.00 0.00 177.20 176.31 3m9m h ASP 168 N -2.05 0.23 -0.17 -1.12 5.19 -1.99 0.08 116.42 116.59 3m9m h ASP 168 Ca -0.53 0.07 -0.18 0.00 -0.62 0.00 0.00 57.03 55.77 3m9m h ASP 168 Cb 1.35 0.04 0.01 0.00 0.18 0.00 0.00 39.33 40.91 3m9m h ASP 168 CO 0.38 -0.03 -0.59 -0.08 -3.12 0.00 0.00 179.24 175.81 3m9m h GLU 169 N 0.16 0.70 -0.50 3.56 4.81 -2.02 -3.27 114.58 118.02 3m9m h GLU 169 Ca 0.69 -0.52 -0.04 0.00 -0.13 0.00 0.00 59.36 59.36 3m9m h GLU 169 Cb 2.26 0.09 -0.02 0.00 0.63 0.00 0.00 28.75 31.71 3m9m h GLU 169 CO -0.23 1.14 0.17 1.49 -0.73 0.00 0.00 179.01 180.84 3m9m h GLU 170 N 0.39 0.76 -0.96 1.92 4.81 -1.27 -2.82 114.58 117.41 3m9m h GLU 170 Ca -0.03 -0.16 0.26 0.00 -0.13 0.00 0.00 59.36 59.31 3m9m h GLU 170 Cb 1.21 -0.11 -0.13 0.00 0.63 0.00 0.00 28.75 30.34 3m9m h GLU 170 CO 0.12 0.71 0.49 0.28 -0.73 0.00 0.00 179.01 179.88 3m9m h VAL 171 N 0.67 0.41 -0.05 0.32 2.07 -1.49 0.47 116.25 118.66 3m9m h VAL 171 Ca 0.16 -0.14 -0.19 0.00 0.82 0.00 0.00 66.70 67.35 3m9m h VAL 171 Cb 0.25 -0.03 -0.00 0.00 -1.52 0.00 0.00 31.29 29.99 3m9m h VAL 171 CO -0.01 0.07 -0.78 0.11 0.02 0.00 0.00 177.57 176.98 3m9m h LYS 172 N 0.41 0.38 -0.35 1.57 1.57 -1.59 0.34 116.57 118.89 3m9m h LYS 172 Ca 0.64 -0.34 -0.00 0.00 -1.87 0.00 0.00 60.65 59.08 3m9m h LYS 172 Cb 1.32 0.08 -0.02 0.00 0.08 0.00 0.00 32.23 33.69 3m9m h LYS 172 CO -0.55 0.99 0.21 0.00 -0.57 0.00 0.00 179.45 179.53 3m9m h ARG 173 N 0.25 0.47 -0.12 3.15 3.08 -0.01 -3.08 114.38 118.13 3m9m h ARG 173 Ca -0.04 -0.04 -0.04 0.00 0.07 0.00 0.00 59.98 59.93 3m9m h ARG 173 Cb 1.38 -0.10 -0.00 0.00 0.08 0.00 0.00 29.97 31.32 3m9m h ARG 173 CO 0.13 0.35 -0.07 -0.07 -1.07 0.00 0.00 179.97 179.25 3m9m h LEU 174 N 0.46 0.26 -1.61 3.04 3.38 -0.40 0.38 115.31 120.81 3m9m h LEU 174 Ca 0.13 -0.43 0.10 0.00 0.09 0.00 0.00 57.88 57.77 3m9m h LEU 174 Cb -0.00 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 40.66 3m9m h LEU 174 CO -0.02 0.63 0.60 0.40 0.09 0.00 0.00 178.44 180.14 3m9m h ILE 175 N -0.11 0.15 0.02 1.22 2.04 -0.92 0.54 117.51 120.45 3m9m h ILE 175 Ca 0.02 0.00 -0.39 0.00 1.00 0.00 0.00 64.86 65.49 3m9m h ILE 175 Cb 0.54 0.47 -0.06 0.00 -0.74 0.00 0.00 36.82 37.03 3m9m h ILE 175 CO 0.02 0.00 -2.38 0.54 0.00 0.00 0.00 178.15 176.33 3m9m n ARG 176 N -3.24 0.66 -0.00 2.37 1.74 -1.04 -0.53 116.66 116.62 3m9m n ARG 176 Ca 0.06 0.19 0.08 0.00 -0.77 0.00 0.00 57.85 57.41 3m9m n ARG 176 Cb 0.74 -1.55 -0.09 0.00 -1.02 0.00 0.00 32.46 30.54 3m9m n ARG 176 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 3m9m n GLU 177 N -3.45 1.60 -2.54 5.56 1.02 0.09 -4.83 120.64 118.09 3m9m n GLU 177 Ca -0.45 -0.02 -0.43 0.00 -0.02 0.00 0.00 57.16 56.25 3m9m n GLU 177 Cb 0.98 -1.27 -0.02 0.00 -0.02 0.00 0.00 31.44 31.11 3m9m n GLU 177 CO 0.00 0.00 0.00 -1.17 1.18 0.00 0.00 177.13 177.14 3m9m s LEU 178 N -2.91 4.20 -0.12 -4.62 2.96 0.18 -4.95 118.68 113.43 3m9m s LEU 178 Ca 0.05 1.62 -0.32 0.00 -0.22 0.00 0.00 54.13 55.26 3m9m s LEU 178 Cb 0.12 -3.55 -0.10 0.00 0.50 0.00 0.00 46.19 43.16 3m9m s LEU 178 CO 0.66 -0.62 2.01 -0.67 -1.32 0.00 0.00 176.35 176.40 3m9m n ASP 179 N 5.79 3.42 0.06 3.68 -0.08 -1.26 -4.15 116.55 124.02 3m9m n ASP 179 Ca 0.11 0.74 0.20 0.00 -1.51 0.00 0.00 54.79 54.33 3m9m n ASP 179 Cb 0.46 -1.43 0.74 0.00 2.34 0.00 0.00 41.12 43.23 3m9m n ASP 179 CO 0.00 0.00 0.00 -0.29 0.12 0.00 0.00 177.20 177.03 3m9m h ILE 180 N 6.04 0.51 0.00 5.18 2.10 -1.72 0.41 117.51 130.03 3m9m h ILE 180 Ca -0.45 0.00 0.00 0.00 1.08 0.00 0.00 64.86 65.49 3m9m h ILE 180 Cb 1.26 0.70 0.00 0.00 -1.09 0.00 0.00 36.82 37.69 3m9m h ILE 180 CO 0.96 0.00 0.00 0.00 -1.08 0.00 0.00 178.15 178.03 3m9m n ALA 181 N -2.46 1.34 0.27 0.18 0.00 -1.26 -1.23 120.51 117.35 3m9m n ALA 181 Ca 0.08 0.15 0.08 0.00 0.00 0.00 0.00 53.44 53.75 3m9m n ALA 181 Cb 0.59 -1.36 0.24 0.00 0.00 0.00 0.00 19.45 18.91 3m9m n ALA 181 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 3m9m n ASP 182 N -2.29 2.94 -4.71 0.00 8.00 0.15 -4.79 116.55 115.85 3m9m n ASP 182 Ca 0.00 -2.05 -0.39 0.00 0.71 0.00 0.00 54.79 53.06 3m9m n ASP 182 Cb 0.13 -0.37 -0.05 0.00 -0.02 0.00 0.00 41.12 40.81 3m9m n ASP 182 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 3m9m s VAL 183 N -1.36 5.08 -0.27 2.53 1.01 -0.37 -4.98 120.40 122.05 3m9m s VAL 183 Ca 0.36 1.27 -0.39 0.00 0.00 0.00 0.00 61.98 63.21 3m9m s VAL 183 Cb 0.19 -3.96 -0.15 0.00 0.00 0.00 0.00 36.38 32.46 3m9m s VAL 183 CO 0.23 0.25 1.80 -2.65 0.00 0.00 0.00 175.10 174.73 3m9m n PRO 184 N 3.92 1.24 0.00 2.72 -0.02 -1.26 -1.37 135.00 140.23 3m9m n PRO 184 Ca -0.03 0.45 0.00 0.00 -2.02 0.00 0.00 63.50 61.90 3m9m n PRO 184 Cb 0.51 -2.18 0.00 0.00 -0.02 0.00 0.00 33.50 31.81 3m9m n PRO 184 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3m9m n GLY 185 N 4.44 0.83 3.06 -1.23 0.00 -1.26 -5.07 105.19 105.96 3m9m n GLY 185 Ca 0.28 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.98 3m9m n GLY 185 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3m9m s ILE 186 N -2.00 2.09 0.00 -0.61 -1.09 -0.47 -5.05 121.20 114.07 3m9m s ILE 186 Ca 0.00 -1.55 0.00 0.00 -2.23 0.00 0.00 60.65 56.87 3m9m s ILE 186 Cb 0.00 -2.20 0.00 0.00 -1.58 0.00 0.00 42.46 38.68 3m9m s ILE 186 CO 0.00 -0.01 0.00 0.61 -1.23 0.00 0.00 174.94 174.31 3m9m n GLY 187 N 4.47 2.54 0.17 6.18 0.00 -1.26 -4.73 105.19 112.55 3m9m n GLY 187 Ca -0.14 -2.04 -0.11 0.00 0.00 0.00 0.00 46.02 43.73 3m9m n GLY 187 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 3m9m h ASN 188 N 0.00 0.48 0.46 1.61 -0.26 -1.97 0.27 115.58 116.17 3m9m h ASN 188 Ca 0.00 -0.29 -0.02 0.00 -0.56 0.00 0.00 56.30 55.44 3m9m h ASN 188 Cb 0.00 -0.13 -0.00 0.00 -1.06 0.00 0.00 38.32 37.13 3m9m h ASN 188 CO 0.00 0.65 -0.28 0.40 -1.06 0.00 0.00 177.43 177.14 3m9m h ILE 189 N 0.29 0.43 -0.02 2.81 2.04 -2.00 -0.27 117.51 120.80 3m9m h ILE 189 Ca 0.08 0.00 -0.12 0.00 1.00 0.00 0.00 64.86 65.82 3m9m h ILE 189 Cb 0.39 0.43 -0.02 0.00 -0.74 0.00 0.00 36.82 36.88 3m9m h ILE 189 CO 0.01 0.00 -0.55 0.74 0.00 0.00 0.00 178.15 178.35 3m9m h THR 190 N -0.70 1.39 -0.10 -0.27 2.02 -1.95 -2.57 112.91 110.73 3m9m h THR 190 Ca -0.05 -1.88 -0.00 0.00 0.77 0.00 0.00 66.41 65.25 3m9m h THR 190 Cb 0.57 2.00 -0.00 0.00 -1.74 0.00 0.00 68.15 68.97 3m9m h THR 190 CO 0.06 0.54 0.06 0.00 0.37 0.00 0.00 175.52 176.55 3m9m h ALA 191 N 1.41 0.13 0.15 6.16 0.00 -0.20 -1.56 119.26 125.35 3m9m h ALA 191 Ca -0.00 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.88 3m9m h ALA 191 Cb 0.98 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.72 3m9m h ALA 191 CO 0.07 -0.36 -0.12 1.49 0.00 0.00 0.00 179.25 180.33 3m9m h GLU 192 N 0.11 -0.28 -0.98 0.00 4.57 -0.94 0.17 114.58 117.23 3m9m h GLU 192 Ca 0.04 0.02 0.19 0.00 -1.18 0.00 0.00 59.36 58.42 3m9m h GLU 192 Cb 0.02 0.06 -0.09 0.00 -0.16 0.00 0.00 28.75 28.58 3m9m h GLU 192 CO -0.01 -0.18 0.61 0.87 -1.18 0.00 0.00 179.01 179.12 3m9m h LYS 193 N -0.29 0.67 0.00 1.92 1.57 -1.30 0.23 116.57 119.38 3m9m h LYS 193 Ca -0.00 -0.04 -0.16 0.00 -1.87 0.00 0.00 60.65 58.58 3m9m h LYS 193 Cb 0.26 -0.15 -0.02 0.00 0.08 0.00 0.00 32.23 32.40 3m9m h LYS 193 CO -0.02 0.44 -0.77 -0.07 -0.57 0.00 0.00 179.45 178.47 3m9m h LEU 194 N 0.69 0.00 -0.83 2.94 3.38 -0.64 -3.06 115.31 117.80 3m9m h LEU 194 Ca 0.54 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 58.40 3m9m h LEU 194 Cb 0.94 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.68 3m9m h LEU 194 CO -0.32 0.77 -0.38 0.50 0.09 0.00 0.00 178.44 179.10 3m9m h LYS 195 N 0.00 0.41 0.00 1.13 3.64 0.97 -0.30 116.57 122.43 3m9m h LYS 195 Ca -0.01 -0.19 0.00 0.00 -1.27 0.00 0.00 60.65 59.18 3m9m h LYS 195 Cb 1.41 -0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.23 3m9m h LYS 195 CO 0.10 0.73 0.00 0.87 -2.27 0.00 0.00 179.45 178.88 3m9m h LYS 196 N 0.35 0.00 -0.15 1.90 1.57 -1.09 -2.23 116.57 116.91 3m9m h LYS 196 Ca 0.04 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.82 3m9m h LYS 196 Cb 0.83 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.14 3m9m h LYS 196 CO 0.07 0.00 0.00 1.28 -0.57 0.00 0.00 179.45 180.23 3m9m n LEU 197 N -2.99 2.85 0.00 2.94 4.77 -0.93 -4.93 117.00 118.72 3m9m n LEU 197 Ca 0.00 -1.07 0.00 0.00 -0.03 0.00 0.00 56.01 54.92 3m9m n LEU 197 Cb 0.28 -0.09 0.00 0.00 -2.33 0.00 0.00 43.42 41.28 3m9m n LEU 197 CO 0.26 0.53 0.00 0.61 -1.33 0.00 0.00 177.39 177.46 3m9m n GLY 198 N 1.36 0.75 3.53 -0.72 0.00 -0.84 -4.99 105.19 104.28 3m9m n GLY 198 Ca 0.17 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.76 3m9m n GLY 198 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3m9m s ILE 199 N -2.88 4.34 -0.17 -0.61 1.01 -0.17 -4.79 121.20 117.93 3m9m s ILE 199 Ca 0.00 0.34 0.02 0.00 0.00 0.00 0.00 60.65 61.01 3m9m s ILE 199 Cb 0.00 -4.57 -0.00 0.00 0.01 0.00 0.00 42.46 37.90 3m9m s ILE 199 CO 0.00 -1.16 0.29 0.59 0.00 0.00 0.00 174.94 174.66 3m9m n ASN 200 N 7.60 0.55 -4.01 3.58 3.02 -1.26 -3.89 115.26 120.85 3m9m n ASN 200 Ca 0.02 -0.77 -0.08 0.00 -0.03 0.00 0.00 54.58 53.72 3m9m n ASN 200 Cb 0.48 0.58 -0.09 0.00 -0.61 0.00 0.00 39.78 40.14 3m9m n ASN 200 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 3m9m s LYS 201 N -0.76 0.83 0.11 3.52 -0.14 -1.26 -2.00 119.74 120.03 3m9m s LYS 201 Ca 0.01 -1.17 -0.27 0.00 -1.36 0.00 0.00 55.97 53.18 3m9m s LYS 201 Cb 0.02 0.28 -0.10 0.00 -1.68 0.00 0.00 37.83 36.35 3m9m s LYS 201 CO 0.06 -0.24 1.65 -0.07 -0.76 0.00 0.00 175.35 175.99 3m9m h LEU 202 N 2.87 -0.63 -1.22 3.17 3.38 -1.69 -2.16 115.31 119.04 3m9m h LEU 202 Ca -0.34 0.07 0.00 0.00 0.09 0.00 0.00 57.88 57.70 3m9m h LEU 202 Cb 1.18 0.23 0.00 0.00 0.09 0.00 0.00 40.66 42.16 3m9m h LEU 202 CO 0.59 -0.32 0.49 1.62 0.09 0.00 0.00 178.44 180.91 3m9m h VAL 203 N -0.45 0.00 0.00 1.22 3.04 -1.12 -0.27 116.25 118.67 3m9m h VAL 203 Ca 0.02 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.71 3m9m h VAL 203 Cb 0.45 0.41 0.00 0.00 -2.01 0.00 0.00 31.29 30.14 3m9m h VAL 203 CO -0.10 0.00 0.00 0.47 -1.01 0.00 0.00 177.57 176.93 3m9m n ASP 204 N -2.56 0.00 0.05 3.17 8.00 -0.81 -3.27 116.55 121.12 3m9m n ASP 204 Ca -0.01 0.42 0.12 0.00 0.71 0.00 0.00 54.79 56.03 3m9m n ASP 204 Cb 0.52 -0.47 0.23 0.00 -0.02 0.00 0.00 41.12 41.38 3m9m n ASP 204 CO 0.00 0.00 0.00 0.35 -0.39 0.00 0.00 177.20 177.16 3m9m n THR 205 N -1.47 0.27 0.43 -3.53 -2.24 -0.11 -3.69 114.28 103.94 3m9m n THR 205 Ca 0.05 -0.20 0.12 0.00 -2.27 0.00 0.00 64.05 61.76 3m9m n THR 205 Cb 0.22 -0.09 0.24 0.00 -2.10 0.00 0.00 70.33 68.59 3m9m n THR 205 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 3m9m h LEU 206 N 0.00 0.00 0.02 3.22 3.38 -1.77 -3.36 115.31 116.81 3m9m h LEU 206 Ca 0.00 -0.05 -0.30 0.00 0.09 0.00 0.00 57.88 57.62 3m9m h LEU 206 Cb 0.68 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.39 3m9m h LEU 206 CO 0.00 0.02 -1.65 -1.54 0.09 0.00 0.00 178.44 175.36 3m9m n SER 207 N -2.53 1.93 -4.70 -0.43 3.41 -1.25 -4.92 113.62 105.13 3m9m n SER 207 Ca 0.04 0.35 -0.40 0.00 -0.26 0.00 0.00 58.87 58.59 3m9m n SER 207 Cb 0.48 -0.90 0.02 0.00 -0.26 0.00 0.00 64.21 63.54 3m9m n SER 207 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3m9m n ILE 208 N -4.19 2.80 -1.86 -1.33 3.06 -1.24 -4.89 119.36 111.71 3m9m n ILE 208 Ca -0.36 -0.50 -0.40 0.00 -2.50 0.00 0.00 62.75 58.99 3m9m n ILE 208 Cb 0.79 -1.54 0.01 0.00 0.54 0.00 0.00 39.64 39.44 3m9m n ILE 208 CO 0.00 0.00 0.00 -0.70 -2.50 0.00 0.00 176.55 173.35 3m9m s GLU 209 N -2.33 3.86 0.03 9.51 2.12 -1.26 -4.94 118.70 125.68 3m9m s GLU 209 Ca 0.63 2.39 -0.25 0.00 0.36 0.00 0.00 54.97 58.11 3m9m s GLU 209 Cb -0.49 -2.76 -0.14 0.00 0.26 0.00 0.00 34.13 31.01 3m9m s GLU 209 CO 0.56 -0.67 1.22 0.35 -0.54 0.00 0.00 175.26 176.18 3m9m h PHE 210 N 2.58 -0.82 0.00 5.30 -0.00 -1.90 -3.14 116.94 118.96 3m9m h PHE 210 Ca -0.51 -0.02 0.00 0.00 -0.00 0.00 0.00 57.97 57.45 3m9m h PHE 210 Cb 1.25 0.27 0.00 0.00 -0.00 0.00 0.00 35.95 37.48 3m9m h PHE 210 CO 0.52 -0.51 0.44 -0.44 -0.00 0.00 0.00 178.31 178.32 3m9m h ASP 211 N -1.00 0.00 -0.51 0.41 3.32 -1.98 1.55 116.42 118.21 3m9m h ASP 211 Ca -0.09 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.96 3m9m h ASP 211 Cb 0.68 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.23 3m9m h ASP 211 CO 0.15 0.00 0.00 1.17 -1.72 0.00 0.00 179.24 178.84 3m9m n LYS 212 N -2.16 2.55 -0.04 3.56 4.81 -1.19 -2.10 118.16 123.60 3m9m n LYS 212 Ca -0.01 -1.98 -0.08 0.00 -0.87 0.00 0.00 58.31 55.37 3m9m n LYS 212 Cb 0.46 -1.54 -0.03 0.00 0.02 0.00 0.00 35.03 33.94 3m9m n LYS 212 CO 0.00 0.00 0.00 -0.11 1.17 0.00 0.00 177.40 178.46 3m9m n LEU 213 N 0.92 0.64 -0.07 3.14 7.94 0.52 -4.16 117.00 125.94 3m9m n LEU 213 Ca 0.18 0.11 0.24 0.00 -1.11 0.00 0.00 56.01 55.43 3m9m n LEU 213 Cb 0.55 -0.26 0.71 0.00 0.53 0.00 0.00 43.42 44.95 3m9m n LEU 213 CO 0.14 0.09 1.22 0.50 -1.11 0.00 0.00 177.39 178.24 3m9m h LYS 214 N -0.29 0.00 -0.16 1.96 3.64 -1.45 0.77 116.57 121.04 3m9m h LYS 214 Ca -0.19 0.00 -0.22 0.00 -1.27 0.00 0.00 60.65 58.97 3m9m h LYS 214 Cb 1.09 0.00 0.01 0.00 -0.41 0.00 0.00 32.23 32.93 3m9m h LYS 214 CO -0.11 0.00 -0.78 0.78 -2.27 0.00 0.00 179.45 177.07 3m9m h GLY 215 N 0.00 0.89 0.42 5.01 0.00 -1.63 -3.20 103.07 104.56 3m9m h GLY 215 Ca 0.32 -1.25 -0.29 0.00 0.00 0.00 0.00 47.33 46.11 3m9m h GLY 215 CO -0.00 1.11 -1.56 1.98 0.00 0.00 0.00 176.54 178.07 3m9m h MET 216 N 0.55 0.18 0.00 4.80 1.85 -1.03 -3.42 114.93 117.86 3m9m h MET 216 Ca -0.05 -0.31 0.00 0.00 -0.61 0.00 0.00 59.70 58.73 3m9m h MET 216 Cb 1.41 0.12 0.00 0.00 0.43 0.00 0.00 31.60 33.55 3m9m h MET 216 CO 0.16 1.15 -1.02 0.44 -0.40 0.00 0.00 176.91 177.24 3m9m n ILE 217 N -3.92 0.00 0.00 1.77 -5.35 -0.77 -5.05 119.36 106.04 3m9m n ILE 217 Ca -0.29 -0.22 0.00 0.00 -0.27 0.00 0.00 62.75 61.96 3m9m n ILE 217 Cb 0.89 0.71 0.00 0.00 -1.74 0.00 0.00 39.64 39.50 3m9m n ILE 217 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3m9m n GLY 218 N 1.45 3.33 0.22 3.28 0.00 -1.21 -4.69 105.19 107.57 3m9m n GLY 218 Ca 0.01 -1.60 -0.05 0.00 0.00 0.00 0.00 46.02 44.38 3m9m n GLY 218 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 3m9m h GLU 219 N 0.00 -0.07 0.62 1.61 4.81 -1.87 -1.96 114.58 117.73 3m9m h GLU 219 Ca 0.00 0.00 -0.03 0.00 -0.13 0.00 0.00 59.36 59.20 3m9m h GLU 219 Cb 0.00 0.02 0.01 0.00 0.63 0.00 0.00 28.75 29.40 3m9m h GLU 219 CO 0.00 -0.05 -0.30 0.00 -0.73 0.00 0.00 179.01 177.93 3m9m h ALA 220 N 1.25 -0.84 -0.00 2.92 0.00 -1.94 -2.35 119.26 118.30 3m9m h ALA 220 Ca 0.20 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.90 3m9m h ALA 220 Cb 0.38 0.32 -0.00 0.00 0.00 0.00 0.00 17.79 18.49 3m9m h ALA 220 CO -0.45 -0.90 0.02 -0.22 0.00 0.00 0.00 179.25 177.70 3m9m h LYS 221 N -0.98 0.00 0.11 0.00 3.64 -1.82 0.35 116.57 117.87 3m9m h LYS 221 Ca -0.09 0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.29 3m9m h LYS 221 Cb 0.68 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.50 3m9m h LYS 221 CO 0.14 0.00 -0.05 0.00 -2.27 0.00 0.00 179.45 177.27 3m9m h ALA 222 N 1.96 -0.15 -0.96 5.00 0.00 -1.15 -2.39 119.26 121.57 3m9m h ALA 222 Ca 0.00 -0.26 0.11 0.00 0.00 0.00 0.00 54.91 54.77 3m9m h ALA 222 Cb 0.05 0.06 -0.08 0.00 0.00 0.00 0.00 17.79 17.81 3m9m h ALA 222 CO -0.00 -0.24 0.59 0.87 0.00 0.00 0.00 179.25 180.47 3m9m h LYS 223 N -0.83 0.92 0.55 0.00 1.79 -0.72 -2.03 116.57 116.25 3m9m h LYS 223 Ca -0.01 -0.06 -0.02 0.00 -2.18 0.00 0.00 60.65 58.38 3m9m h LYS 223 Cb 0.57 -0.21 -0.01 0.00 -1.58 0.00 0.00 32.23 31.00 3m9m h LYS 223 CO 0.02 0.61 -0.42 -0.92 -1.08 0.00 0.00 179.45 177.67 3m9m h TYR 224 N 0.95 -1.13 -0.68 -1.35 3.20 -0.98 -2.14 116.97 114.83 3m9m h TYR 224 Ca 0.47 -0.00 0.07 0.00 3.14 0.00 0.00 58.73 62.41 3m9m h TYR 224 Cb 0.45 0.42 -0.06 0.00 1.54 0.00 0.00 36.73 39.08 3m9m h TYR 224 CO -0.02 -0.59 0.35 -0.07 -1.64 0.00 0.00 178.16 176.20 3m9m h LEU 225 N -0.93 0.49 0.05 2.82 3.38 -1.07 -2.76 115.31 117.29 3m9m h LEU 225 Ca -0.07 0.04 -0.00 0.00 0.09 0.00 0.00 57.88 57.94 3m9m h LEU 225 Cb 0.77 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.47 3m9m h LEU 225 CO 0.02 0.31 -0.02 0.40 0.09 0.00 0.00 178.44 179.23 3m9m h ILE 226 N 0.63 1.01 -0.81 1.22 2.04 -1.33 -0.36 117.51 119.91 3m9m h ILE 226 Ca 0.32 -0.17 0.14 0.00 1.00 0.00 0.00 64.86 66.14 3m9m h ILE 226 Cb 0.26 1.12 -0.06 0.00 -0.74 0.00 0.00 36.82 37.41 3m9m h ILE 226 CO -0.22 0.04 0.53 0.77 0.00 0.00 0.00 178.15 179.27 3m9m h SER 227 N -0.14 0.53 -0.35 1.72 4.64 -1.25 0.23 113.55 118.93 3m9m h SER 227 Ca -0.01 0.03 -0.14 0.00 -0.47 0.00 0.00 61.79 61.20 3m9m h SER 227 Cb 0.12 -0.08 -0.01 0.00 -0.31 0.00 0.00 62.40 62.12 3m9m h SER 227 CO 0.01 0.28 -0.31 -0.07 -0.87 0.00 0.00 176.83 175.87 3m9m h LEU 228 N 0.57 0.89 -1.67 5.97 3.38 -1.17 0.36 115.31 123.63 3m9m h LEU 228 Ca 0.40 -0.46 -0.03 0.00 0.09 0.00 0.00 57.88 57.88 3m9m h LEU 228 Cb 0.73 -0.25 -0.00 0.00 0.09 0.00 0.00 40.66 41.23 3m9m h LEU 228 CO -0.15 1.16 -0.16 0.00 0.09 0.00 0.00 178.44 179.38 3m9m h ALA 229 N 0.75 1.20 -0.24 1.53 0.00 0.11 -2.18 119.26 120.43 3m9m h ALA 229 Ca 0.06 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.83 3m9m h ALA 229 Cb 0.89 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.66 3m9m h ALA 229 CO 0.08 0.20 0.00 0.54 0.00 0.00 0.00 179.25 180.07 3m9m n ARG 230 N -3.56 2.07 -3.27 0.00 1.74 -0.00 -4.80 116.66 108.84 3m9m n ARG 230 Ca -0.01 -1.60 -0.24 0.00 -0.77 0.00 0.00 57.85 55.23 3m9m n ARG 230 Cb 0.30 -1.45 0.03 0.00 -1.02 0.00 0.00 32.46 30.32 3m9m n ARG 230 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 3m9m n ASP 231 N 0.84 -5.49 -0.72 0.55 -0.08 -0.82 -4.87 116.55 105.94 3m9m n ASP 231 Ca 0.17 -0.39 0.05 0.00 -1.51 0.00 0.00 54.79 53.11 3m9m n ASP 231 Cb 0.45 -4.43 0.19 0.00 2.34 0.00 0.00 41.12 39.67 3m9m n ASP 231 CO 0.00 0.00 0.00 -0.62 0.12 0.00 0.00 177.20 176.70 3m9m n GLU 232 N -4.16 1.57 -3.47 -0.67 1.02 0.12 -5.01 120.64 110.03 3m9m n GLU 232 Ca -0.06 -3.26 -0.38 0.00 -0.02 0.00 0.00 57.16 53.44 3m9m n GLU 232 Cb 0.59 -1.54 -0.09 0.00 -0.02 0.00 0.00 31.44 30.37 3m9m n GLU 232 CO 0.00 0.00 0.00 -0.47 1.18 0.00 0.00 177.13 177.84 3m9m s TYR 233 N -3.04 3.26 -0.26 -0.32 5.04 -1.06 -4.79 117.35 116.18 3m9m s TYR 233 Ca 0.38 0.33 -0.02 0.00 -2.44 0.00 0.00 57.07 55.33 3m9m s TYR 233 Cb 0.37 -2.49 0.12 0.00 0.35 0.00 0.00 41.96 40.32 3m9m s TYR 233 CO -0.07 -0.16 0.28 -0.80 -1.34 0.00 0.00 175.55 173.46 3m9m s ASN 234 N 1.57 1.48 -0.21 4.32 0.02 -1.26 -4.85 114.94 116.01 3m9m s ASN 234 Ca 0.12 -0.53 -0.02 0.00 -1.02 0.00 0.00 52.86 51.41 3m9m s ASN 234 Cb -0.16 0.53 0.00 0.00 0.02 0.00 0.00 41.25 41.65 3m9m s ASN 234 CO 0.10 -0.37 -0.09 -1.61 0.02 0.00 0.00 177.10 175.15 3m9m s GLU 235 N 2.37 3.24 0.70 -0.60 0.41 -1.26 -5.10 118.70 118.45 3m9m s GLU 235 Ca 0.09 -0.70 -0.15 0.00 -0.41 0.00 0.00 54.97 53.80 3m9m s GLU 235 Cb -0.15 -2.87 0.02 0.00 -1.78 0.00 0.00 34.13 29.36 3m9m s GLU 235 CO -0.26 -0.21 1.16 -1.25 -0.49 0.00 0.00 175.26 174.21 3m9m s PRO 236 N 1.41 2.43 -0.75 0.39 0.04 -1.26 -4.65 135.00 132.62 3m9m s PRO 236 Ca 0.05 1.57 -0.25 0.00 0.04 0.00 0.00 61.00 62.42 3m9m s PRO 236 Cb -0.14 -1.89 0.05 0.00 0.04 0.00 0.00 34.50 32.56 3m9m s PRO 236 CO -0.06 -1.57 1.20 0.42 0.04 0.00 0.00 177.00 177.02 3m9m s ILE 237 N -2.18 3.95 0.02 0.56 1.09 -1.26 -5.00 121.20 118.38 3m9m s ILE 237 Ca 0.70 -0.01 0.04 0.00 -1.10 0.00 0.00 60.65 60.28 3m9m s ILE 237 Cb -0.25 -4.86 -0.03 0.00 -1.06 0.00 0.00 42.46 36.26 3m9m s ILE 237 CO 0.44 -1.74 -0.07 0.00 -0.10 0.00 0.00 174.94 173.47 3m9m s ARG 238 N 5.06 2.52 0.26 2.79 1.70 -1.26 -4.64 118.95 125.38 3m9m s ARG 238 Ca 0.32 -0.75 -0.31 0.00 -0.47 0.00 0.00 55.73 54.52 3m9m s ARG 238 Cb -0.10 -2.49 -0.12 0.00 -0.57 0.00 0.00 34.95 31.67 3m9m s ARG 238 CO 0.10 0.59 1.57 2.41 -1.08 0.00 0.00 175.30 178.90 3m9m n THR 239 N 1.45 0.76 -3.82 4.99 -1.04 -1.26 -4.47 114.28 110.89 3m9m n THR 239 Ca -0.15 -0.19 -0.36 0.00 -2.04 0.00 0.00 64.05 61.31 3m9m n THR 239 Cb 0.52 -1.83 -0.13 0.00 -1.82 0.00 0.00 70.33 67.08 3m9m n THR 239 CO 0.00 0.00 0.00 -0.60 -0.64 0.00 0.00 175.07 173.83 3m9m s ARG 240 N -0.10 3.54 -0.34 -2.82 3.52 -1.26 -5.04 118.95 116.45 3m9m s ARG 240 Ca 0.68 -0.54 -0.15 0.00 -0.13 0.00 0.00 55.73 55.59 3m9m s ARG 240 Cb -0.55 -3.20 -0.02 0.00 -1.56 0.00 0.00 34.95 29.63 3m9m s ARG 240 CO 0.45 -0.19 0.34 0.08 -0.81 0.00 0.00 175.30 175.17 3m9m s VAL 241 N 1.56 5.19 0.07 7.11 1.01 -1.26 -4.89 120.40 129.19 3m9m s VAL 241 Ca 0.06 0.04 -0.37 0.00 0.00 0.00 0.00 61.98 61.71 3m9m s VAL 241 Cb -0.15 -3.79 -0.18 0.00 0.00 0.00 0.00 36.38 32.26 3m9m s VAL 241 CO 0.01 -0.06 1.13 -1.14 0.00 0.00 0.00 175.10 175.04 3m9m n ARG 242 N 5.33 0.55 -0.01 2.72 0.63 -1.26 -4.89 116.66 119.73 3m9m n ARG 242 Ca -0.10 0.20 0.09 0.00 -0.92 0.00 0.00 57.85 57.12 3m9m n ARG 242 Cb 0.50 -1.70 -0.14 0.00 0.45 0.00 0.00 32.46 31.56 3m9m n ARG 242 CO 0.00 0.00 0.00 1.63 -2.51 0.00 0.00 177.63 176.75 3m9m n LYS 243 N 1.82 0.64 -4.09 -0.14 5.02 -1.26 -4.95 118.16 115.20 3m9m n LYS 243 Ca 0.19 -0.14 -0.11 0.00 -2.02 0.00 0.00 58.31 56.22 3m9m n LYS 243 Cb 0.16 -1.44 -0.07 0.00 -0.02 0.00 0.00 35.03 33.66 3m9m n LYS 243 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 3m9m s SER 244 N -3.93 0.19 -0.29 4.39 1.04 -1.26 -3.84 113.70 110.01 3m9m s SER 244 Ca -0.04 -1.20 -0.16 0.00 0.48 0.00 0.00 55.95 55.03 3m9m s SER 244 Cb 0.13 0.52 0.14 0.00 0.10 0.00 0.00 66.02 66.91 3m9m s SER 244 CO 0.79 -1.05 0.95 -0.63 0.98 0.00 0.00 173.24 174.28 3m9m s ILE 245 N -3.91 -0.06 0.29 -1.02 1.01 -0.76 -4.99 121.20 111.75 3m9m s ILE 245 Ca 0.30 0.00 -0.08 0.00 0.00 0.00 0.00 60.65 60.87 3m9m s ILE 245 Cb 0.02 -1.00 0.03 0.00 0.01 0.00 0.00 42.46 41.53 3m9m s ILE 245 CO 0.12 0.00 0.53 0.61 0.00 0.00 0.00 174.94 176.20 3m9m n GLY 246 N 3.90 1.54 3.38 6.18 0.00 -1.26 -0.78 105.19 118.14 3m9m n GLY 246 Ca -0.18 -1.29 -0.09 0.00 0.00 0.00 0.00 46.02 44.47 3m9m n GLY 246 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3m9m s ARG 247 N -2.21 0.46 -0.06 1.61 6.06 -0.97 -4.92 118.95 118.92 3m9m s ARG 247 Ca 0.14 0.99 0.04 0.00 -2.50 0.00 0.00 55.73 54.40 3m9m s ARG 247 Cb -0.03 0.16 -0.02 0.00 0.06 0.00 0.00 34.95 35.12 3m9m s ARG 247 CO 0.11 -0.18 -0.17 0.42 -2.50 0.00 0.00 175.30 172.98 3m9m s ILE 248 N 1.83 2.78 0.30 4.11 1.01 -1.26 -1.98 121.20 128.00 3m9m s ILE 248 Ca -0.08 -0.81 0.09 0.00 0.00 0.00 0.00 60.65 59.86 3m9m s ILE 248 Cb -0.09 -2.08 -0.05 0.00 0.01 0.00 0.00 42.46 40.25 3m9m s ILE 248 CO -0.15 0.57 -0.01 0.68 0.00 0.00 0.00 174.94 176.04 3m9m s VAL 249 N -0.43 2.96 -0.19 2.92 -7.23 0.12 -4.93 120.40 113.62 3m9m s VAL 249 Ca 0.05 -1.98 -0.03 0.00 -1.81 0.00 0.00 61.98 58.22 3m9m s VAL 249 Cb -0.12 -2.77 -0.01 0.00 0.56 0.00 0.00 36.38 34.04 3m9m s VAL 249 CO 0.02 -0.29 -0.08 -0.89 -0.31 0.00 0.00 175.10 173.55 3m9m s THR 250 N -2.44 3.20 0.37 5.32 2.01 -1.26 -0.60 115.64 122.25 3m9m s THR 250 Ca 0.33 -0.57 -0.26 0.00 0.31 0.00 0.00 61.69 61.51 3m9m s THR 250 Cb -0.03 -2.42 -0.09 0.00 0.01 0.00 0.00 72.50 69.97 3m9m s THR 250 CO 0.19 0.46 1.12 -0.04 -0.69 0.00 0.00 174.62 175.67 3m9m s MET 251 N 1.17 4.21 0.33 4.92 -1.94 0.94 -4.91 119.30 124.02 3m9m s MET 251 Ca 0.02 1.74 0.20 0.00 -1.71 0.00 0.00 55.69 55.94 3m9m s MET 251 Cb -0.14 -2.75 1.09 0.00 2.01 0.00 0.00 34.83 35.04 3m9m s MET 251 CO -0.02 -0.16 1.59 1.17 -0.01 0.00 0.00 175.02 177.59 3m9m n LYS 252 N 0.27 0.13 -3.64 2.03 3.00 -1.26 -4.64 118.16 114.05 3m9m n LYS 252 Ca 0.03 0.63 -0.04 0.00 -0.00 0.00 0.00 58.31 58.93 3m9m n LYS 252 Cb 0.47 -2.01 -0.07 0.00 0.00 0.00 0.00 35.03 33.42 3m9m n LYS 252 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.40 176.42 3m9m s ARG 253 N -3.51 0.17 0.93 1.64 1.70 -1.26 -4.96 118.95 113.65 3m9m s ARG 253 Ca -0.02 0.18 -0.13 0.00 -0.47 0.00 0.00 55.73 55.28 3m9m s ARG 253 Cb 0.06 0.08 0.01 0.00 -0.57 0.00 0.00 34.95 34.53 3m9m s ARG 253 CO 0.18 -0.02 0.33 0.09 -1.08 0.00 0.00 175.30 174.80 3m9m n ASN 254 N 1.63 -2.28 0.00 -2.89 4.13 -1.26 -4.90 115.26 109.70 3m9m n ASN 254 Ca -0.10 0.35 0.00 0.00 1.68 0.00 0.00 54.58 56.51 3m9m n ASN 254 Cb 0.57 -1.18 0.00 0.00 -1.54 0.00 0.00 39.78 37.63 3m9m n ASN 254 CO 0.00 0.00 0.00 -1.54 0.28 0.00 0.00 177.26 176.00 3m9m n SER 255 N -0.85 0.00 0.00 6.41 3.41 -0.29 -4.90 113.62 117.40 3m9m n SER 255 Ca 0.06 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.67 3m9m n SER 255 Cb 0.53 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.48 3m9m n SER 255 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 3m9m n ARG 256 N -0.21 0.06 -2.33 4.33 1.74 -1.26 -1.15 116.66 117.83 3m9m n ARG 256 Ca 0.00 -0.52 -0.40 0.00 -0.77 0.00 0.00 57.85 56.17 3m9m n ARG 256 Cb 0.00 -0.80 -0.03 0.00 -1.02 0.00 0.00 32.46 30.61 3m9m n ARG 256 CO 0.00 0.00 0.00 1.21 -1.52 0.00 0.00 177.63 177.32 3m9m s ASN 257 N -0.16 5.79 0.40 0.55 3.84 -1.26 -4.92 114.94 119.17 3m9m s ASN 257 Ca 0.00 -0.16 0.25 0.00 0.21 0.00 0.00 52.86 53.15 3m9m s ASN 257 Cb 0.00 -2.55 1.36 0.00 -0.55 0.00 0.00 41.25 39.52 3m9m s ASN 257 CO 0.00 -2.07 1.60 0.25 -2.79 0.00 0.00 177.10 174.09 3m9m h LEU 258 N 14.50 0.30 -0.01 3.21 5.85 -1.99 0.70 115.31 137.87 3m9m h LEU 258 Ca -0.25 0.20 0.00 0.00 0.84 0.00 0.00 57.88 58.67 3m9m h LEU 258 Cb 1.09 0.19 0.00 0.00 0.37 0.00 0.00 40.66 42.32 3m9m h LEU 258 CO 1.26 -0.30 0.00 -0.33 -0.34 0.00 0.00 178.44 178.73 3m9m h GLU 259 N 0.07 0.00 0.00 1.25 4.39 -2.00 -0.00 114.58 118.28 3m9m h GLU 259 Ca 0.83 0.00 -0.08 0.00 0.34 0.00 0.00 59.36 60.45 3m9m h GLU 259 Cb 2.38 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 31.01 3m9m h GLU 259 CO -0.60 0.00 -0.95 1.49 -1.16 0.00 0.00 179.01 177.80 3m9m h GLU 260 N 0.00 0.00 0.05 2.33 4.81 -0.04 -3.36 114.58 118.36 3m9m h GLU 260 Ca 0.00 0.00 -0.20 0.00 -0.13 0.00 0.00 59.36 59.03 3m9m h GLU 260 Cb 0.90 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.27 3m9m h GLU 260 CO 0.00 0.20 -1.08 0.82 -0.73 0.00 0.00 179.01 178.22 3m9m h ILE 261 N 0.00 1.14 -0.87 2.32 1.08 -1.06 -3.41 117.51 116.72 3m9m h ILE 261 Ca -0.06 -2.31 0.19 0.00 -0.39 0.00 0.00 64.86 62.29 3m9m h ILE 261 Cb 1.28 2.67 -0.16 0.00 -3.07 0.00 0.00 36.82 37.54 3m9m h ILE 261 CO 0.03 0.55 -0.15 0.29 -0.69 0.00 0.00 178.15 178.17 3m9m n LYS 262 N -4.24 -0.08 -0.32 2.37 5.02 -0.03 -1.71 118.16 119.17 3m9m n LYS 262 Ca -0.25 1.34 0.02 0.00 -2.02 0.00 0.00 58.31 57.40 3m9m n LYS 262 Cb 0.74 -2.03 0.15 0.00 -0.02 0.00 0.00 35.03 33.87 3m9m n LYS 262 CO 0.00 0.00 0.00 -1.35 -0.52 0.00 0.00 177.40 175.53 3m9m h PRO 263 N 0.00 0.96 -0.21 1.97 0.11 -1.79 0.08 132.00 133.12 3m9m h PRO 263 Ca 0.45 -0.06 -0.12 0.00 0.11 0.00 0.00 66.00 66.38 3m9m h PRO 263 Cb 0.76 -0.22 -0.00 0.00 0.11 0.00 0.00 31.00 31.65 3m9m h PRO 263 CO -0.87 0.63 -0.33 1.88 -0.21 0.00 0.00 178.00 179.10 3m9m h TYR 264 N 0.99 0.74 -0.15 0.65 0.05 -1.60 -1.48 116.97 116.16 3m9m h TYR 264 Ca 0.39 -0.25 0.00 0.00 0.05 0.00 0.00 58.73 58.92 3m9m h TYR 264 Cb 0.21 -0.14 -0.01 0.00 1.01 0.00 0.00 36.73 37.80 3m9m h TYR 264 CO -0.03 0.99 0.10 1.25 -1.05 0.00 0.00 178.16 179.41 3m9m h LEU 265 N 0.28 0.18 -1.64 3.88 5.85 -1.26 0.16 115.31 122.76 3m9m h LEU 265 Ca 0.02 -0.02 -0.04 0.00 0.84 0.00 0.00 57.88 58.68 3m9m h LEU 265 Cb 0.91 -0.04 -0.01 0.00 0.37 0.00 0.00 40.66 41.89 3m9m h LEU 265 CO 0.08 0.15 -0.19 -0.26 -0.34 0.00 0.00 178.44 177.88 3m9m h PHE 266 N 0.19 0.00 -0.12 1.25 0.04 -1.00 -0.57 116.94 116.73 3m9m h PHE 266 Ca 0.05 0.00 -0.14 0.00 2.80 0.00 0.00 57.97 60.69 3m9m h PHE 266 Cb -0.00 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.14 3m9m h PHE 266 CO -0.06 0.19 -0.53 -0.09 -0.60 0.00 0.00 178.31 177.22 3m9m h ARG 267 N 0.00 0.35 -0.04 1.51 2.43 -0.15 -2.39 114.38 116.09 3m9m h ARG 267 Ca -0.00 -0.21 -0.25 0.00 -0.81 0.00 0.00 59.98 58.71 3m9m h ARG 267 Cb 0.34 0.02 0.02 0.00 -0.42 0.00 0.00 29.97 29.92 3m9m h ARG 267 CO 0.02 0.79 -0.94 0.00 -1.51 0.00 0.00 179.97 178.33 3m9m h ALA 268 N 1.17 0.17 0.06 2.80 0.00 0.32 -2.97 119.26 120.80 3m9m h ALA 268 Ca 0.01 -0.66 0.02 0.00 0.00 0.00 0.00 54.91 54.28 3m9m h ALA 268 Cb 1.02 0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.81 3m9m h ALA 268 CO 0.09 0.66 -0.22 0.82 0.00 0.00 0.00 179.25 180.59 3m9m h ILE 269 N 0.40 0.50 -0.39 0.00 2.04 -1.06 0.19 117.51 119.19 3m9m h ILE 269 Ca -0.11 0.00 0.06 0.00 1.00 0.00 0.00 64.86 65.81 3m9m h ILE 269 Cb 1.59 0.50 -0.09 0.00 -0.74 0.00 0.00 36.82 38.08 3m9m h ILE 269 CO 0.19 0.00 -0.50 -0.33 0.00 0.00 0.00 178.15 177.51 3m9m h GLU 270 N -0.38 -0.37 -0.66 2.37 4.39 -1.48 0.11 114.58 118.58 3m9m h GLU 270 Ca 0.04 0.02 0.05 0.00 0.34 0.00 0.00 59.36 59.82 3m9m h GLU 270 Cb 0.43 0.08 -0.04 0.00 -0.10 0.00 0.00 28.75 29.12 3m9m h GLU 270 CO -0.16 -0.24 0.43 0.93 -1.16 0.00 0.00 179.01 178.81 3m9m h GLU 271 N -0.38 0.69 -0.67 2.33 5.08 -1.30 -1.58 114.58 118.75 3m9m h GLU 271 Ca 0.10 -0.04 -0.04 0.00 -1.00 0.00 0.00 59.36 58.38 3m9m h GLU 271 Cb 0.60 -0.16 -0.03 0.00 0.50 0.00 0.00 28.75 29.66 3m9m h GLU 271 CO -0.58 0.46 0.26 0.77 -1.00 0.00 0.00 179.01 178.92 3m9m h SER 272 N 0.71 0.90 1.23 1.42 0.02 0.18 -2.56 113.55 115.45 3m9m h SER 272 Ca 0.27 -0.12 -0.08 0.00 -0.84 0.00 0.00 61.79 61.02 3m9m h SER 272 Cb 0.19 -0.23 -0.01 0.00 0.14 0.00 0.00 62.40 62.49 3m9m h SER 272 CO -0.08 0.80 -0.38 1.88 -1.14 0.00 0.00 176.83 177.91 3m9m h TYR 273 N 0.96 0.00 -0.43 3.45 0.05 -0.10 -2.34 116.97 118.57 3m9m h TYR 273 Ca 0.23 0.00 -0.07 0.00 0.05 0.00 0.00 58.73 58.93 3m9m h TYR 273 Cb 0.19 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 37.91 3m9m h TYR 273 CO 0.01 0.38 -0.02 -0.92 -1.05 0.00 0.00 178.16 176.57 3m9m h TYR 274 N 0.00 0.84 0.77 4.88 3.20 -1.04 -3.16 116.97 122.46 3m9m h TYR 274 Ca -0.00 -0.15 -0.04 0.00 3.14 0.00 0.00 58.73 61.68 3m9m h TYR 274 Cb 1.10 -0.22 0.01 0.00 1.54 0.00 0.00 36.73 39.16 3m9m h TYR 274 CO 0.00 0.84 -0.37 0.87 -1.64 0.00 0.00 178.16 177.85 3m9m h LYS 275 N 0.60 -1.00 -0.67 1.82 1.57 -1.29 -3.23 116.57 114.37 3m9m h LYS 275 Ca 0.12 0.07 0.12 0.00 -1.87 0.00 0.00 60.65 59.09 3m9m h LYS 275 Cb 0.51 0.23 -0.12 0.00 0.08 0.00 0.00 32.23 32.93 3m9m h LYS 275 CO 0.03 -0.66 -0.20 1.28 -0.57 0.00 0.00 179.45 179.32 3m9m n LEU 276 N -5.47 -0.32 -3.19 2.94 4.77 -0.90 -4.85 117.00 109.98 3m9m n LEU 276 Ca -0.13 1.15 -0.01 0.00 -0.03 0.00 0.00 56.01 57.00 3m9m n LEU 276 Cb 0.41 -0.32 0.00 0.00 -2.33 0.00 0.00 43.42 41.19 3m9m n LEU 276 CO 0.32 -1.08 -0.50 -0.67 -1.33 0.00 0.00 177.39 174.14 3m9m n ASP 277 N -5.05 -6.56 0.00 -1.43 2.03 -1.20 -2.68 116.55 101.66 3m9m n ASP 277 Ca 0.09 0.41 0.00 0.00 0.52 0.00 0.00 54.79 55.81 3m9m n ASP 277 Cb 0.31 -1.63 0.00 0.00 -0.72 0.00 0.00 41.12 39.08 3m9m n ASP 277 CO 0.00 0.00 0.00 0.29 -1.92 0.00 0.00 177.20 175.57 3m9m n LYS 278 N 1.25 0.00 -2.89 -0.67 4.76 -1.26 -4.99 118.16 114.36 3m9m n LYS 278 Ca -0.00 0.00 -0.40 0.00 -2.87 0.00 0.00 58.31 55.03 3m9m n LYS 278 Cb 0.50 -1.02 -0.04 0.00 -1.84 0.00 0.00 35.03 32.62 3m9m n LYS 278 CO 0.00 0.00 0.00 1.03 -1.37 0.00 0.00 177.40 177.06 3m9m s ARG 279 N -0.06 4.54 -0.23 1.97 0.52 -1.09 -5.04 118.95 119.56 3m9m s ARG 279 Ca 0.00 1.19 -0.06 0.00 -0.52 0.00 0.00 55.73 56.34 3m9m s ARG 279 Cb 0.00 -3.40 -0.02 0.00 0.52 0.00 0.00 34.95 32.05 3m9m s ARG 279 CO 0.00 0.18 0.01 0.42 0.02 0.00 0.00 175.30 175.93 3m9m s ILE 280 N 0.26 3.88 -0.06 1.52 -1.09 -1.26 -4.90 121.20 119.55 3m9m s ILE 280 Ca 0.43 -0.32 -0.10 0.00 -2.23 0.00 0.00 60.65 58.42 3m9m s ILE 280 Cb -0.21 -2.79 -0.05 0.00 -1.58 0.00 0.00 42.46 37.84 3m9m s ILE 280 CO 0.25 0.39 0.26 -2.16 -1.23 0.00 0.00 174.94 172.44 3m9m s PRO 281 N 1.44 3.65 0.00 2.79 0.04 -1.26 -1.14 135.00 140.52 3m9m s PRO 281 Ca 0.05 0.10 0.20 0.00 0.04 0.00 0.00 61.00 61.39 3m9m s PRO 281 Cb -0.15 -3.20 0.20 0.00 0.04 0.00 0.00 34.50 31.40 3m9m s PRO 281 CO 0.01 0.74 1.17 1.63 0.04 0.00 0.00 177.00 180.59 3m9m n LYS 282 N 1.86 1.91 -3.88 4.56 5.02 -0.56 -0.36 118.16 126.71 3m9m n LYS 282 Ca -0.17 -1.79 -0.16 0.00 -2.02 0.00 0.00 58.31 54.17 3m9m n LYS 282 Cb 0.54 -1.40 -0.16 0.00 -0.02 0.00 0.00 35.03 33.99 3m9m n LYS 282 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3m9m s ALA 283 N -1.63 0.22 0.02 7.82 0.00 -1.05 0.18 121.76 127.32 3m9m s ALA 283 Ca 0.25 0.19 0.08 0.00 0.00 0.00 0.00 51.96 52.48 3m9m s ALA 283 Cb 0.17 -0.26 -0.02 0.00 0.00 0.00 0.00 23.12 23.01 3m9m s ALA 283 CO 0.26 -0.07 -0.23 -1.50 0.00 0.00 0.00 175.76 174.21 3m9m s ILE 284 N 0.92 1.87 -0.06 0.00 2.07 -0.90 -0.11 121.20 124.98 3m9m s ILE 284 Ca -0.09 -1.19 0.01 0.00 -1.41 0.00 0.00 60.65 57.97 3m9m s ILE 284 Cb -0.12 -1.59 0.02 0.00 0.13 0.00 0.00 42.46 40.90 3m9m s ILE 284 CO -0.02 0.36 -0.06 -1.00 -1.91 0.00 0.00 174.94 172.31 3m9m s HIS 285 N -0.72 0.94 -0.18 3.50 3.76 0.36 -2.16 115.29 120.80 3m9m s HIS 285 Ca 0.09 -0.31 -0.15 0.00 -0.15 0.00 0.00 55.06 54.55 3m9m s HIS 285 Cb -0.09 -0.81 -0.04 0.00 1.11 0.00 0.00 32.58 32.74 3m9m s HIS 285 CO 0.01 -0.26 0.33 0.08 -0.85 0.00 0.00 174.74 174.06 3m9m s VAL 286 N 1.08 5.27 -0.09 -0.90 1.01 -0.03 -0.82 120.40 125.91 3m9m s VAL 286 Ca -0.08 0.60 0.04 0.00 0.00 0.00 0.00 61.98 62.54 3m9m s VAL 286 Cb -0.14 -3.67 0.00 0.00 0.00 0.00 0.00 36.38 32.57 3m9m s VAL 286 CO -0.01 0.33 -0.23 -0.69 0.00 0.00 0.00 175.10 174.50 3m9m s VAL 287 N 0.83 1.98 0.01 2.92 1.01 -0.63 -1.89 120.40 124.64 3m9m s VAL 287 Ca 0.17 -0.98 0.02 0.00 0.00 0.00 0.00 61.98 61.19 3m9m s VAL 287 Cb -0.14 -1.71 -0.01 0.00 0.00 0.00 0.00 36.38 34.52 3m9m s VAL 287 CO 0.06 0.54 -0.06 0.00 0.00 0.00 0.00 175.10 175.64 3m9m s ALA 288 N 0.32 0.46 -0.36 5.51 0.00 -0.63 0.23 121.76 127.31 3m9m s ALA 288 Ca -0.17 -0.43 -0.02 0.00 0.00 0.00 0.00 51.96 51.34 3m9m s ALA 288 Cb -0.17 -0.04 0.08 0.00 0.00 0.00 0.00 23.12 22.99 3m9m s ALA 288 CO 0.08 0.05 0.10 0.08 0.00 0.00 0.00 175.76 176.07 3m9m s VAL 289 N -0.62 3.05 0.82 0.00 1.01 -0.88 -1.90 120.40 121.88 3m9m s VAL 289 Ca -0.03 -1.81 -0.16 0.00 0.00 0.00 0.00 61.98 59.98 3m9m s VAL 289 Cb -0.05 -2.97 -0.05 0.00 0.00 0.00 0.00 36.38 33.31 3m9m s VAL 289 CO 0.00 -0.44 0.17 0.35 0.00 0.00 0.00 175.10 175.18 3m9m n THR 290 N 4.57 0.75 -0.40 3.92 -2.24 -1.11 -3.03 114.28 116.74 3m9m n THR 290 Ca -0.06 -0.37 0.34 0.00 -2.27 0.00 0.00 64.05 61.69 3m9m n THR 290 Cb 0.42 -0.49 0.66 0.00 -2.10 0.00 0.00 70.33 68.83 3m9m n THR 290 CO 0.00 0.00 0.00 1.05 -0.57 0.00 0.00 175.07 175.55 3m9m h GLU 291 N -0.80 0.13 -0.04 -0.78 4.11 -1.53 1.72 114.58 117.39 3m9m h GLU 291 Ca -0.44 -0.01 0.00 0.00 0.07 0.00 0.00 59.36 58.98 3m9m h GLU 291 Cb 1.33 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 30.55 3m9m h GLU 291 CO 0.36 0.09 0.00 -0.40 0.07 0.00 0.00 179.01 179.13 3m9m n ASP 292 N -4.41 0.70 0.00 3.06 5.75 -1.26 -4.93 116.55 115.45 3m9m n ASP 292 Ca 0.31 -1.38 0.00 0.00 -0.01 0.00 0.00 54.79 53.71 3m9m n ASP 292 Cb 1.28 -0.02 0.00 0.00 -1.03 0.00 0.00 41.12 41.35 3m9m n ASP 292 CO 0.00 0.00 0.00 0.18 -0.11 0.00 0.00 177.20 177.27 3m9m n LEU 293 N -0.39 0.23 -4.79 -2.12 4.77 0.58 -5.04 117.00 110.24 3m9m n LEU 293 Ca 0.18 0.00 -0.30 0.00 -0.03 0.00 0.00 56.01 55.86 3m9m n LEU 293 Cb 0.20 -0.90 0.09 0.00 -2.33 0.00 0.00 43.42 40.49 3m9m n LEU 293 CO 0.14 -0.22 0.70 -0.62 -1.33 0.00 0.00 177.39 176.07 3m9m s ASP 294 N -2.07 4.45 -0.32 -1.43 2.15 -1.26 -4.79 116.67 113.41 3m9m s ASP 294 Ca 0.00 1.40 -0.03 0.00 0.43 0.00 0.00 52.55 54.35 3m9m s ASP 294 Cb 0.00 -2.14 0.05 0.00 -0.30 0.00 0.00 42.92 40.53 3m9m s ASP 294 CO 0.00 -2.00 0.04 -0.63 -0.17 0.00 0.00 175.17 172.40 3m9m s ILE 295 N -3.10 3.19 -0.13 4.11 1.01 -1.26 -2.74 121.20 122.28 3m9m s ILE 295 Ca 0.61 -1.37 -0.06 0.00 0.00 0.00 0.00 60.65 59.82 3m9m s ILE 295 Cb -0.15 -2.85 -0.04 0.00 0.01 0.00 0.00 42.46 39.43 3m9m s ILE 295 CO 0.55 -0.16 0.10 -0.69 0.00 0.00 0.00 174.94 174.74 3m9m s VAL 296 N 1.28 5.20 -0.19 2.92 1.01 -0.80 -5.01 120.40 124.82 3m9m s VAL 296 Ca -0.03 0.10 -0.13 0.00 0.00 0.00 0.00 61.98 61.91 3m9m s VAL 296 Cb -0.20 -3.27 0.06 0.00 0.00 0.00 0.00 36.38 32.96 3m9m s VAL 296 CO -0.00 0.58 0.47 -0.94 0.00 0.00 0.00 175.10 175.21 3m9m s SER 297 N -0.68 -0.57 -0.03 3.32 1.04 -1.26 -1.60 113.70 113.92 3m9m s SER 297 Ca 0.13 1.00 0.08 0.00 0.48 0.00 0.00 55.95 57.63 3m9m s SER 297 Cb -0.12 0.93 -0.02 0.00 0.10 0.00 0.00 66.02 66.92 3m9m s SER 297 CO 0.03 -0.19 -0.26 -0.13 0.98 0.00 0.00 173.24 173.67 3m9m s ARG 298 N 1.00 2.21 0.27 4.02 1.81 -0.79 -4.95 118.95 122.52 3m9m s ARG 298 Ca -0.06 -0.92 0.02 0.00 -1.72 0.00 0.00 55.73 53.05 3m9m s ARG 298 Cb -0.06 -2.07 -0.04 0.00 -0.45 0.00 0.00 34.95 32.33 3m9m s ARG 298 CO -0.09 0.52 0.15 0.20 -0.68 0.00 0.00 175.30 175.40 3m9m s GLY 299 N -0.51 1.85 -0.17 -3.53 0.00 -1.26 -0.85 107.32 102.85 3m9m s GLY 299 Ca 0.07 -1.79 -0.18 0.00 0.00 0.00 0.00 44.72 42.82 3m9m s GLY 299 CO 0.00 -1.53 0.49 -1.60 0.00 0.00 0.00 173.10 170.45 3m9m s ARG 300 N -3.92 0.60 -0.08 2.90 6.06 -0.92 -5.03 118.95 118.56 3m9m s ARG 300 Ca 0.37 0.60 0.02 0.00 -2.50 0.00 0.00 55.73 54.22 3m9m s ARG 300 Cb 0.06 0.29 -0.02 0.00 0.06 0.00 0.00 34.95 35.34 3m9m s ARG 300 CO 0.16 -0.09 -0.14 0.99 -2.50 0.00 0.00 175.30 173.72 3m9m s THR 301 N 0.07 3.04 0.33 4.11 2.01 -1.26 -2.13 115.64 121.82 3m9m s THR 301 Ca -0.02 -0.71 0.07 0.00 0.31 0.00 0.00 61.69 61.35 3m9m s THR 301 Cb -0.03 -2.22 -0.02 0.00 0.01 0.00 0.00 72.50 70.23 3m9m s THR 301 CO 0.01 0.57 0.36 -0.36 -0.69 0.00 0.00 174.62 174.51 3m9m s PHE 302 N -0.32 2.99 -0.81 4.92 0.40 0.46 -4.98 117.98 120.65 3m9m s PHE 302 Ca 0.03 -0.27 0.14 0.00 -0.60 0.00 0.00 56.93 56.24 3m9m s PHE 302 Cb -0.13 -1.87 0.68 0.00 0.51 0.00 0.00 43.02 42.22 3m9m s PHE 302 CO 0.03 0.12 1.56 -0.35 0.70 0.00 0.00 175.22 177.27 3m9m n PRO 303 N -1.47 3.88 -3.90 0.24 -0.04 -1.26 -4.79 135.00 127.67 3m9m n PRO 303 Ca -0.01 -2.64 -0.09 0.00 -0.04 0.00 0.00 63.50 60.72 3m9m n PRO 303 Cb 0.59 -1.99 -0.02 0.00 -0.04 0.00 0.00 33.50 32.05 3m9m n PRO 303 CO 0.00 0.00 0.00 -3.38 -0.04 0.00 0.00 175.50 172.08 3m9m s HIS 304 N -2.14 0.14 0.50 0.54 -3.43 -1.26 -5.15 115.29 104.48 3m9m s HIS 304 Ca 0.47 -0.62 -0.22 0.00 -0.80 0.00 0.00 55.06 53.89 3m9m s HIS 304 Cb 0.33 0.57 -0.06 0.00 -1.43 0.00 0.00 32.58 31.98 3m9m s HIS 304 CO 0.18 -1.28 1.23 0.20 -2.00 0.00 0.00 174.74 173.07 3m9m s GLY 305 N -3.02 2.80 -0.30 -1.38 0.00 -1.26 -4.40 107.32 99.77 3m9m s GLY 305 Ca 0.17 1.07 -0.17 0.00 0.00 0.00 0.00 44.72 45.78 3m9m s GLY 305 CO 0.10 1.53 0.45 -0.42 0.00 0.00 0.00 173.10 174.76 3m9m s ILE 306 N -1.48 5.10 0.10 0.90 1.01 0.51 -4.96 121.20 122.38 3m9m s ILE 306 Ca 0.68 0.51 -0.11 0.00 0.00 0.00 0.00 60.65 61.73 3m9m s ILE 306 Cb -0.32 -3.83 -0.06 0.00 0.01 0.00 0.00 42.46 38.26 3m9m s ILE 306 CO 0.38 -0.00 0.45 -0.94 0.00 0.00 0.00 174.94 174.83 3m9m s SER 307 N 1.67 6.69 0.24 3.58 1.04 -1.26 -4.66 113.70 121.00 3m9m s SER 307 Ca 0.17 0.88 -0.14 0.00 0.48 0.00 0.00 55.95 57.33 3m9m s SER 307 Cb -0.16 -2.21 0.31 0.00 0.10 0.00 0.00 66.02 64.06 3m9m s SER 307 CO 0.11 0.15 1.56 0.11 0.98 0.00 0.00 173.24 176.14 3m9m h LYS 308 N 3.64 -0.01 -0.77 4.02 1.57 -1.97 0.96 116.57 124.01 3m9m h LYS 308 Ca -0.49 0.00 0.17 0.00 -1.87 0.00 0.00 60.65 58.46 3m9m h LYS 308 Cb 1.19 0.00 -0.14 0.00 0.08 0.00 0.00 32.23 33.36 3m9m h LYS 308 CO 0.66 -0.01 -0.10 0.93 -0.57 0.00 0.00 179.45 180.37 3m9m h GLU 309 N -0.01 0.04 0.12 3.15 3.07 -1.98 1.64 114.58 120.61 3m9m h GLU 309 Ca 0.38 -0.00 -0.01 0.00 -0.50 0.00 0.00 59.36 59.23 3m9m h GLU 309 Cb 0.63 -0.01 0.00 0.00 -0.84 0.00 0.00 28.75 28.54 3m9m h GLU 309 CO -0.97 0.03 -0.06 1.15 -1.40 0.00 0.00 179.01 177.75 3m9m h THR 310 N 0.04 0.98 -0.99 1.13 2.02 0.41 -0.98 112.91 115.52 3m9m h THR 310 Ca 0.40 -0.38 0.20 0.00 0.77 0.00 0.00 66.41 67.39 3m9m h THR 310 Cb 0.67 1.22 -0.10 0.00 -1.74 0.00 0.00 68.15 68.20 3m9m h THR 310 CO -0.74 0.09 0.62 0.00 0.37 0.00 0.00 175.52 175.85 3m9m h ALA 311 N 0.51 1.85 0.41 6.16 0.00 0.24 0.40 119.26 128.83 3m9m h ALA 311 Ca -0.02 0.06 -0.02 0.00 0.00 0.00 0.00 54.91 54.93 3m9m h ALA 311 Cb 0.28 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.01 3m9m h ALA 311 CO 0.03 -0.21 -0.20 1.88 0.00 0.00 0.00 179.25 180.75 3m9m h TYR 312 N 0.65 -0.51 0.45 0.00 0.05 0.28 -2.07 116.97 115.81 3m9m h TYR 312 Ca 0.55 -0.01 -0.02 0.00 0.05 0.00 0.00 58.73 59.30 3m9m h TYR 312 Cb 1.02 0.17 0.00 0.00 1.01 0.00 0.00 36.73 38.93 3m9m h TYR 312 CO -0.00 -0.19 -0.21 0.77 -1.05 0.00 0.00 178.16 177.47 3m9m h SER 313 N -0.87 -0.51 -0.79 3.88 0.02 -0.19 -3.16 113.55 111.93 3m9m h SER 313 Ca -0.06 -0.03 -0.01 0.00 -0.84 0.00 0.00 61.79 60.85 3m9m h SER 313 Cb 0.55 0.13 -0.04 0.00 0.14 0.00 0.00 62.40 63.19 3m9m h SER 313 CO 0.09 -0.29 0.45 -0.08 -1.14 0.00 0.00 176.83 175.86 3m9m h GLU 314 N -0.69 1.09 0.00 3.45 4.57 -0.38 -2.67 114.58 119.96 3m9m h GLU 314 Ca -0.06 -0.11 -0.03 0.00 -1.18 0.00 0.00 59.36 57.98 3m9m h GLU 314 Cb 0.51 -0.22 -0.00 0.00 -0.16 0.00 0.00 28.75 28.87 3m9m h GLU 314 CO 0.10 0.79 -0.12 0.66 -1.18 0.00 0.00 179.01 179.25 3m9m h SER 315 N 1.10 0.00 -0.06 1.04 4.64 -1.38 -0.76 113.55 118.13 3m9m h SER 315 Ca 0.28 0.00 -0.21 0.00 -0.47 0.00 0.00 61.79 61.40 3m9m h SER 315 Cb -0.00 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.10 3m9m h SER 315 CO -0.05 0.12 -0.77 0.58 -0.87 0.00 0.00 176.83 175.84 3m9m h VAL 316 N 0.00 1.33 0.39 0.95 2.07 -1.45 -0.01 116.25 119.54 3m9m h VAL 316 Ca -0.00 -2.05 -0.01 0.00 0.82 0.00 0.00 66.70 65.46 3m9m h VAL 316 Cb 0.34 2.29 -0.02 0.00 -1.52 0.00 0.00 31.29 32.38 3m9m h VAL 316 CO 0.02 0.63 -0.39 0.11 0.02 0.00 0.00 177.57 177.96 3m9m h LYS 317 N 0.26 -0.77 0.07 1.57 1.57 -1.20 -0.21 116.57 117.86 3m9m h LYS 317 Ca -0.08 0.05 0.01 0.00 -1.87 0.00 0.00 60.65 58.76 3m9m h LYS 317 Cb 1.43 0.18 -0.03 0.00 0.08 0.00 0.00 32.23 33.88 3m9m h LYS 317 CO 0.15 -0.51 -0.37 -0.07 -0.57 0.00 0.00 179.45 178.08 3m9m h LEU 318 N -0.80 -1.11 -0.95 2.94 3.38 -1.19 -1.08 115.31 116.50 3m9m h LEU 318 Ca -0.03 0.12 0.24 0.00 0.09 0.00 0.00 57.88 58.29 3m9m h LEU 318 Cb 0.71 0.41 -0.18 0.00 0.09 0.00 0.00 40.66 41.70 3m9m h LEU 318 CO -0.06 -0.38 -0.04 0.25 0.09 0.00 0.00 178.44 178.30 3m9m h LEU 319 N -0.51 -0.56 -0.31 1.67 5.85 -0.84 0.55 115.31 121.16 3m9m h LEU 319 Ca -0.00 0.27 0.05 0.00 0.84 0.00 0.00 57.88 59.04 3m9m h LEU 319 Cb 0.52 0.49 -0.05 0.00 0.37 0.00 0.00 40.66 41.99 3m9m h LEU 319 CO -0.21 -0.32 0.01 1.56 -0.34 0.00 0.00 178.44 179.14 3m9m h GLN 320 N 0.02 0.10 -0.95 1.25 4.20 -0.02 -0.46 115.11 119.25 3m9m h GLN 320 Ca 0.54 -0.01 0.21 0.00 0.06 0.00 0.00 58.65 59.46 3m9m h GLN 320 Cb 1.03 -0.02 -0.08 0.00 0.30 0.00 0.00 27.48 28.72 3m9m h GLN 320 CO -0.90 0.06 0.62 -0.22 -0.67 0.00 0.00 178.83 177.72 3m9m h LYS 321 N 0.10 0.45 0.44 1.46 3.64 0.13 0.41 116.57 123.20 3m9m h LYS 321 Ca 0.15 -0.03 -0.02 0.00 -1.27 0.00 0.00 60.65 59.48 3m9m h LYS 321 Cb 0.19 -0.10 0.00 0.00 -0.41 0.00 0.00 32.23 31.92 3m9m h LYS 321 CO -0.24 0.30 -0.21 0.82 -2.27 0.00 0.00 179.45 177.85 3m9m h ILE 322 N 0.46 0.50 -0.95 2.00 2.04 -0.47 -0.74 117.51 120.35 3m9m h ILE 322 Ca 0.51 -0.43 0.10 0.00 1.00 0.00 0.00 64.86 66.04 3m9m h ILE 322 Cb 1.19 0.68 -0.07 0.00 -0.74 0.00 0.00 36.82 37.87 3m9m h ILE 322 CO -0.22 0.07 0.61 -0.07 0.00 0.00 0.00 178.15 178.53 3m9m h LEU 323 N -0.86 0.87 -0.72 1.44 4.07 -0.22 0.61 115.31 120.50 3m9m h LEU 323 Ca -0.06 0.03 -0.13 0.00 0.08 0.00 0.00 57.88 57.80 3m9m h LEU 323 Cb 0.56 -0.15 -0.01 0.00 1.08 0.00 0.00 40.66 42.14 3m9m h LEU 323 CO 0.10 0.50 -0.48 -0.33 -1.08 0.00 0.00 178.44 177.15 3m9m h GLU 324 N 0.96 0.39 -0.60 1.13 5.08 -0.18 -3.28 114.58 118.08 3m9m h GLU 324 Ca 0.45 -0.22 0.00 0.00 -1.00 0.00 0.00 59.36 58.59 3m9m h GLU 324 Cb 0.43 0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.69 3m9m h GLU 324 CO -0.21 0.79 0.00 0.39 -1.00 0.00 0.00 179.01 178.98 3m9m n GLU 325 N -3.98 2.74 -3.70 2.33 1.02 -0.29 -4.90 120.64 113.86 3m9m n GLU 325 Ca -0.02 -2.45 -0.11 0.00 -0.02 0.00 0.00 57.16 54.55 3m9m n GLU 325 Cb 0.54 -1.47 -0.12 0.00 -0.02 0.00 0.00 31.44 30.37 3m9m n GLU 325 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 3m9m s ASP 326 N -1.02 -0.27 0.00 1.62 -1.08 0.11 -5.02 116.67 111.01 3m9m s ASP 326 Ca 0.41 0.72 0.27 0.00 -0.52 0.00 0.00 52.55 53.42 3m9m s ASP 326 Cb 0.21 0.67 0.96 0.00 -1.46 0.00 0.00 42.92 43.30 3m9m s ASP 326 CO 0.28 -0.19 1.69 -1.84 0.52 0.00 0.00 175.17 175.63 3m9m n GLU 327 N 4.51 1.73 -1.84 4.34 0.28 -1.26 -4.54 120.64 123.86 3m9m n GLU 327 Ca -0.20 -1.06 -0.30 0.00 -0.16 0.00 0.00 57.16 55.43 3m9m n GLU 327 Cb 0.53 -1.47 0.05 0.00 1.43 0.00 0.00 31.44 31.97 3m9m n GLU 327 CO 0.00 0.00 0.00 1.03 -0.16 0.00 0.00 177.13 178.00 3m9m s ARG 328 N -1.98 2.87 0.46 3.44 0.52 -1.26 -5.06 118.95 117.94 3m9m s ARG 328 Ca 0.37 0.53 -0.15 0.00 -0.52 0.00 0.00 55.73 55.96 3m9m s ARG 328 Cb 0.21 -2.02 -0.08 0.00 0.52 0.00 0.00 34.95 33.58 3m9m s ARG 328 CO 0.33 -1.04 0.90 0.15 0.02 0.00 0.00 175.30 175.66 3m9m s LYS 329 N -5.30 3.94 -0.10 3.54 1.02 -1.26 -4.87 119.74 116.70 3m9m s LYS 329 Ca 0.58 0.81 -0.02 0.00 0.02 0.00 0.00 55.97 57.36 3m9m s LYS 329 Cb -0.11 -2.24 -0.03 0.00 -0.52 0.00 0.00 37.83 34.93 3m9m s LYS 329 CO 0.52 -0.14 0.00 0.42 -0.92 0.00 0.00 175.35 175.23 3m9m s ILE 330 N -2.45 4.33 0.00 2.17 -1.09 -0.30 -1.34 121.20 122.52 3m9m s ILE 330 Ca 0.57 -0.24 0.00 0.00 -2.23 0.00 0.00 60.65 58.75 3m9m s ILE 330 Cb -0.10 -2.83 0.00 0.00 -1.58 0.00 0.00 42.46 37.95 3m9m s ILE 330 CO 0.28 0.59 0.00 -2.11 -1.23 0.00 0.00 174.94 172.47 3m9m n ARG 331 N 2.31 1.23 -4.76 2.79 1.85 -1.17 -1.14 116.66 117.78 3m9m n ARG 331 Ca -0.18 0.00 -0.32 0.00 -1.00 0.00 0.00 57.85 56.34 3m9m n ARG 331 Cb 0.53 -0.96 -0.12 0.00 -1.05 0.00 0.00 32.46 30.86 3m9m n ARG 331 CO 0.00 0.00 0.00 1.03 -0.01 0.00 0.00 177.63 178.65 3m9m s ARG 332 N -1.93 2.43 -0.06 2.89 0.52 -1.18 -0.04 118.95 121.59 3m9m s ARG 332 Ca 0.00 -0.75 -0.04 0.00 -0.52 0.00 0.00 55.73 54.42 3m9m s ARG 332 Cb 0.00 -2.37 0.02 0.00 0.52 0.00 0.00 34.95 33.13 3m9m s ARG 332 CO 0.00 0.60 0.14 -1.50 0.02 0.00 0.00 175.30 174.56 3m9m s ILE 333 N -0.82 -0.02 0.00 1.52 1.10 0.23 -2.07 121.20 121.15 3m9m s ILE 333 Ca 0.13 0.07 0.00 0.00 -0.51 0.00 0.00 60.65 60.34 3m9m s ILE 333 Cb -0.11 -0.21 0.00 0.00 0.15 0.00 0.00 42.46 42.29 3m9m s ILE 333 CO 0.03 0.03 0.00 0.61 -2.11 0.00 0.00 174.94 173.50 3m9m n GLY 334 N 3.48 1.94 3.38 1.50 0.00 0.14 0.14 105.19 115.77 3m9m n GLY 334 Ca -0.18 -0.93 -0.13 0.00 0.00 0.00 0.00 46.02 44.77 3m9m n GLY 334 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3m9m s VAL 335 N -2.86 0.00 -0.27 1.61 0.11 -0.84 -1.60 120.40 116.55 3m9m s VAL 335 Ca 0.00 -1.76 -0.19 0.00 -2.93 0.00 0.00 61.98 57.10 3m9m s VAL 335 Cb 0.00 -2.48 0.07 0.00 -1.53 0.00 0.00 36.38 32.45 3m9m s VAL 335 CO 0.00 0.00 0.68 -0.60 -3.33 0.00 0.00 175.10 171.85 3m9m s ARG 336 N -3.70 0.74 -0.15 1.54 3.52 -0.00 -2.29 118.95 118.61 3m9m s ARG 336 Ca 0.33 1.11 -0.02 0.00 -0.13 0.00 0.00 55.73 57.02 3m9m s ARG 336 Cb 0.03 0.24 -0.02 0.00 -1.56 0.00 0.00 34.95 33.63 3m9m s ARG 336 CO 0.16 -0.13 -0.08 -0.06 -0.81 0.00 0.00 175.30 174.39 3m9m s PHE 337 N 1.12 2.93 0.09 5.12 0.08 0.04 -0.48 117.98 126.87 3m9m s PHE 337 Ca -0.06 -0.51 0.01 0.00 0.12 0.00 0.00 56.93 56.49 3m9m s PHE 337 Cb -0.05 -1.93 -0.00 0.00 -0.57 0.00 0.00 43.02 40.47 3m9m s PHE 337 CO -0.11 -0.16 0.02 0.43 -0.10 0.00 0.00 175.22 175.29 3m9m n SER 338 N 3.67 1.48 -3.94 1.36 7.64 0.84 -1.83 113.62 122.84 3m9m n SER 338 Ca -0.18 -1.46 -0.40 0.00 1.01 0.00 0.00 58.87 57.84 3m9m n SER 338 Cb 0.52 0.17 0.02 0.00 -1.01 0.00 0.00 64.21 63.91 3m9m n SER 338 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 3m9m n LYS 339 N -0.22 -0.75 -0.30 1.43 4.76 -1.25 -2.25 118.16 119.58 3m9m n LYS 339 Ca -0.02 0.22 -0.29 0.00 -2.87 0.00 0.00 58.31 55.35 3m9m n LYS 339 Cb 0.13 -3.22 0.28 0.00 -1.84 0.00 0.00 35.03 30.38 3m9m n LYS 339 CO 0.00 0.00 0.00 1.19 -1.37 0.00 0.00 177.40 177.22 3m9m n PHE 340 N -4.71 -3.75 1.48 2.13 3.72 -1.26 -1.49 117.46 113.58 3m9m n PHE 340 Ca -0.12 -0.80 0.14 0.00 -0.05 0.00 0.00 57.45 56.62 3m9m n PHE 340 Cb 0.58 -1.18 0.51 0.00 -0.94 0.00 0.00 39.48 38.45 3m9m n PHE 340 CO 0.00 0.00 0.00 -0.89 -0.05 0.00 0.00 176.76 175.82