#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1s9f s ILE 2 N 0.00 1.74 -0.09 1.12 1.01 -1.26 -4.28 121.20 119.44 1s9f s ILE 2 Ca 0.00 -0.83 -0.00 0.00 0.00 0.00 0.00 60.65 59.81 1s9f s ILE 2 Cb 0.00 -1.66 -0.03 0.00 0.01 0.00 0.00 42.46 40.78 1s9f s ILE 2 CO 0.00 0.40 -0.05 -0.69 0.00 0.00 0.00 174.94 174.59 1s9f s VAL 3 N 1.40 3.83 -0.19 2.92 1.01 -0.16 -1.53 120.40 127.67 1s9f s VAL 3 Ca 0.03 -0.42 0.01 0.00 0.00 0.00 0.00 61.98 61.60 1s9f s VAL 3 Cb -0.14 -2.59 0.03 0.00 0.00 0.00 0.00 36.38 33.68 1s9f s VAL 3 CO -0.11 0.58 -0.18 -0.22 0.00 0.00 0.00 175.10 175.17 1s9f s LEU 4 N -0.62 2.35 -0.14 3.92 0.20 0.09 -1.99 118.68 122.48 1s9f s LEU 4 Ca 0.09 -0.76 -0.06 0.00 0.69 0.00 0.00 54.13 54.09 1s9f s LEU 4 Cb -0.12 -1.49 -0.04 0.00 -0.43 0.00 0.00 46.19 44.11 1s9f s LEU 4 CO 0.02 -0.03 0.07 0.12 -0.29 0.00 0.00 176.35 176.24 1s9f s PHE 5 N 1.26 3.33 -0.07 5.38 5.36 0.23 -0.70 117.98 132.77 1s9f s PHE 5 Ca 0.03 0.23 0.05 0.00 -0.96 0.00 0.00 56.93 56.28 1s9f s PHE 5 Cb -0.14 -1.97 -0.01 0.00 -0.34 0.00 0.00 43.02 40.55 1s9f s PHE 5 CO -0.12 0.39 -0.23 0.08 -1.46 0.00 0.00 175.22 173.89 1s9f s VAL 6 N -0.30 2.25 -0.13 3.12 1.01 -0.29 -0.48 120.40 125.59 1s9f s VAL 6 Ca 0.09 -0.99 -0.03 0.00 0.00 0.00 0.00 61.98 61.04 1s9f s VAL 6 Cb -0.12 -1.84 0.05 0.00 0.00 0.00 0.00 36.38 34.47 1s9f s VAL 6 CO 0.02 0.57 0.06 -0.62 0.00 0.00 0.00 175.10 175.13 1s9f s ASP 7 N -0.15 2.00 0.22 3.32 3.68 0.26 -1.82 116.67 124.19 1s9f s ASP 7 Ca -0.04 -0.39 -0.30 0.00 2.13 0.00 0.00 52.55 53.95 1s9f s ASP 7 Cb -0.14 -0.28 -0.10 0.00 -1.45 0.00 0.00 42.92 40.95 1s9f s ASP 7 CO 0.04 -0.30 1.41 -0.36 0.13 0.00 0.00 175.17 176.09 1s9f s PHE 8 N 2.09 3.10 0.15 -5.34 0.08 -0.68 -0.39 117.98 116.98 1s9f s PHE 8 Ca 0.03 1.05 -0.30 0.00 0.12 0.00 0.00 56.93 57.82 1s9f s PHE 8 Cb -0.15 -3.76 -0.07 0.00 -0.57 0.00 0.00 43.02 38.47 1s9f s PHE 8 CO -0.07 -2.49 1.19 -0.51 -0.10 0.00 0.00 175.22 173.24 1s9f s ASP 9 N 0.45 7.10 -0.29 1.36 1.01 -1.03 -3.97 116.67 121.30 1s9f s ASP 9 Ca 0.60 2.15 -0.07 0.00 0.71 0.00 0.00 52.55 55.94 1s9f s ASP 9 Cb -0.40 -2.60 0.01 0.00 1.01 0.00 0.00 42.92 40.94 1s9f s ASP 9 CO 0.40 -0.39 0.13 0.00 0.21 0.00 0.00 175.17 175.53 1s9f n TYR 10 N 2.93 -0.31 -0.21 4.23 0.18 -1.26 -4.54 117.16 118.18 1s9f n TYR 10 Ca 0.06 0.03 -0.06 0.00 1.88 0.00 0.00 57.90 59.81 1s9f n TYR 10 Cb 0.45 -0.63 -0.05 0.00 -0.38 0.00 0.00 39.34 38.73 1s9f n TYR 10 CO 0.00 0.00 0.00 0.35 -2.08 0.00 0.00 176.86 175.13 1s9f h PHE 11 N 1.59 -0.99 -0.51 -3.48 3.57 -1.95 0.59 116.94 115.76 1s9f h PHE 11 Ca -0.16 0.07 0.08 0.00 3.53 0.00 0.00 57.97 61.48 1s9f h PHE 11 Cb 0.32 0.50 -0.06 0.00 2.79 0.00 0.00 35.95 39.50 1s9f h PHE 11 CO 0.09 -0.20 0.16 1.88 -2.23 0.00 0.00 178.31 178.01 1s9f h TYR 12 N -0.01 0.27 -0.62 0.41 0.05 -1.96 -0.08 116.97 115.03 1s9f h TYR 12 Ca 0.08 0.03 -0.10 0.00 0.05 0.00 0.00 58.73 58.79 1s9f h TYR 12 Cb 0.22 -0.04 -0.02 0.00 1.01 0.00 0.00 36.73 37.89 1s9f h TYR 12 CO -0.97 0.06 0.01 0.00 -1.05 0.00 0.00 178.16 176.21 1s9f h ALA 13 N 1.36 0.85 -0.45 3.88 0.00 -1.80 -2.50 119.26 120.60 1s9f h ALA 13 Ca 0.25 -0.31 -0.08 0.00 0.00 0.00 0.00 54.91 54.78 1s9f h ALA 13 Cb 0.30 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 1s9f h ALA 13 CO -0.28 0.67 -0.03 0.37 0.00 0.00 0.00 179.25 179.99 1s9f h GLN 14 N 0.99 0.76 -0.58 0.00 4.15 -0.18 -1.73 115.11 118.53 1s9f h GLN 14 Ca 0.18 -0.21 -0.05 0.00 0.77 0.00 0.00 58.65 59.34 1s9f h GLN 14 Cb 0.55 -0.08 -0.02 0.00 0.21 0.00 0.00 27.48 28.13 1s9f h GLN 14 CO 0.03 0.79 0.17 0.28 -1.93 0.00 0.00 178.83 178.16 1s9f h VAL 15 N 0.70 1.24 -0.25 2.39 2.07 -0.83 -0.72 116.25 120.86 1s9f h VAL 15 Ca 0.13 -0.85 -0.04 0.00 0.82 0.00 0.00 66.70 66.76 1s9f h VAL 15 Cb 0.47 0.69 -0.01 0.00 -1.52 0.00 0.00 31.29 30.92 1s9f h VAL 15 CO 0.02 0.32 -0.03 -0.33 0.02 0.00 0.00 177.57 177.57 1s9f h GLU 16 N 0.82 0.38 -0.30 1.57 4.39 -1.12 -1.02 114.58 119.30 1s9f h GLU 16 Ca 0.18 -0.07 -0.18 0.00 0.34 0.00 0.00 59.36 59.63 1s9f h GLU 16 Cb 0.31 -0.06 -0.00 0.00 -0.10 0.00 0.00 28.75 28.90 1s9f h GLU 16 CO -0.00 0.44 -0.50 0.93 -1.16 0.00 0.00 179.01 178.71 1s9f h GLU 17 N 0.37 0.85 -0.58 2.33 5.08 -0.65 0.44 114.58 122.41 1s9f h GLU 17 Ca 0.08 -0.51 -0.11 0.00 -1.00 0.00 0.00 59.36 57.82 1s9f h GLU 17 Cb 0.30 0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.58 1s9f h GLU 17 CO 0.01 1.15 -0.05 0.28 -1.00 0.00 0.00 179.01 179.40 1s9f h VAL 18 N 0.66 1.27 0.00 3.13 2.07 -0.67 -1.83 116.25 120.88 1s9f h VAL 18 Ca 0.03 -1.21 -0.10 0.00 0.82 0.00 0.00 66.70 66.23 1s9f h VAL 18 Cb 1.10 0.87 -0.01 0.00 -1.52 0.00 0.00 31.29 31.72 1s9f h VAL 18 CO 0.11 0.43 -0.49 -0.07 0.02 0.00 0.00 177.57 177.57 1s9f h LEU 19 N 0.95 0.00 -6.53 2.57 3.38 -1.12 -3.38 115.31 111.19 1s9f h LEU 19 Ca 0.16 0.00 -0.59 0.00 0.09 0.00 0.00 57.88 57.54 1s9f h LEU 19 Cb 0.62 0.00 -0.39 0.00 0.09 0.00 0.00 40.66 40.98 1s9f h LEU 19 CO 0.04 0.49 -0.89 0.21 0.09 0.00 0.00 178.44 178.38 1s9f s ASN 20 N -6.51 2.25 0.56 -0.43 2.47 0.14 -5.00 114.94 108.41 1s9f s ASN 20 Ca 0.01 -2.95 0.32 0.00 0.42 0.00 0.00 52.86 50.66 1s9f s ASN 20 Cb 0.10 -0.60 1.47 0.00 -1.45 0.00 0.00 41.25 40.77 1s9f s ASN 20 CO 0.72 -0.19 1.84 -0.65 -3.72 0.00 0.00 177.10 175.09 1s9f h PRO 21 N 5.96 0.00 0.00 0.43 0.11 -1.52 -1.01 132.00 135.96 1s9f h PRO 21 Ca 0.19 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.30 1s9f h PRO 21 Cb 0.91 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.02 1s9f h PRO 21 CO 0.40 0.00 0.00 -1.13 -0.21 0.00 0.00 178.00 177.06 1s9f n SER 22 N -4.04 0.26 0.17 -2.05 3.41 -1.26 -0.86 113.62 109.26 1s9f n SER 22 Ca 0.18 0.62 0.12 0.00 -0.26 0.00 0.00 58.87 59.53 1s9f n SER 22 Cb 0.99 -0.65 0.11 0.00 -0.26 0.00 0.00 64.21 64.40 1s9f n SER 22 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 1s9f h LEU 23 N 0.00 0.00 -9.64 1.04 3.38 -1.48 -3.46 115.31 105.14 1s9f h LEU 23 Ca 0.00 -0.00 -0.57 0.00 0.09 0.00 0.00 57.88 57.40 1s9f h LEU 23 Cb 0.03 0.00 0.09 0.00 0.09 0.00 0.00 40.66 40.86 1s9f h LEU 23 CO 0.00 0.00 0.66 2.29 0.09 0.00 0.00 178.44 181.48 1s9f n LYS 24 N -2.93 2.18 0.00 1.13 2.85 -0.04 -1.17 118.16 120.18 1s9f n LYS 24 Ca 0.03 0.77 0.00 0.00 -1.05 0.00 0.00 58.31 58.06 1s9f n LYS 24 Cb 0.54 -2.45 0.00 0.00 -0.65 0.00 0.00 35.03 32.47 1s9f n LYS 24 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 1s9f n GLY 25 N 2.03 1.82 3.87 2.58 0.00 -1.26 -5.04 105.19 109.19 1s9f n GLY 25 Ca 0.10 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.86 1s9f n GLY 25 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1s9f s LYS 26 N -0.47 3.15 -0.04 1.61 1.02 -0.32 -5.05 119.74 119.64 1s9f s LYS 26 Ca 0.00 -0.75 -0.30 0.00 0.02 0.00 0.00 55.97 54.94 1s9f s LYS 26 Cb 0.00 -2.79 -0.03 0.00 -0.52 0.00 0.00 37.83 34.49 1s9f s LYS 26 CO 0.00 0.50 1.17 -1.25 -0.92 0.00 0.00 175.35 174.84 1s9f s PRO 27 N -3.21 4.38 -0.13 -1.68 0.04 -1.26 -4.82 135.00 128.33 1s9f s PRO 27 Ca 0.33 1.64 0.01 0.00 0.04 0.00 0.00 61.00 63.02 1s9f s PRO 27 Cb -0.10 -3.52 -0.00 0.00 0.04 0.00 0.00 34.50 30.92 1s9f s PRO 27 CO 0.26 -0.38 -0.18 0.08 0.04 0.00 0.00 177.00 176.82 1s9f s VAL 28 N 1.94 2.55 -0.19 -0.36 1.01 -1.26 -1.33 120.40 122.75 1s9f s VAL 28 Ca 0.55 -0.83 0.01 0.00 0.00 0.00 0.00 61.98 61.71 1s9f s VAL 28 Cb -0.25 -2.04 0.04 0.00 0.00 0.00 0.00 36.38 34.14 1s9f s VAL 28 CO 0.23 0.53 -0.10 -0.69 0.00 0.00 0.00 175.10 175.07 1s9f s VAL 29 N 0.52 1.60 -0.18 2.92 1.01 0.75 -1.37 120.40 125.66 1s9f s VAL 29 Ca -0.11 -0.96 -0.19 0.00 0.00 0.00 0.00 61.98 60.71 1s9f s VAL 29 Cb -0.16 -1.67 -0.03 0.00 0.00 0.00 0.00 36.38 34.51 1s9f s VAL 29 CO 0.04 0.19 0.55 -0.69 0.00 0.00 0.00 175.10 175.19 1s9f s VAL 30 N 1.42 5.09 0.27 2.92 1.01 0.31 -0.88 120.40 130.53 1s9f s VAL 30 Ca -0.01 1.03 0.05 0.00 0.00 0.00 0.00 61.98 63.06 1s9f s VAL 30 Cb -0.16 -3.87 -0.06 0.00 0.00 0.00 0.00 36.38 32.29 1s9f s VAL 30 CO -0.08 0.19 -0.02 0.00 0.00 0.00 0.00 175.10 175.18 1s9f s VAL 32 N -3.23 3.13 -0.31 0.00 1.01 0.56 -0.42 120.40 121.15 1s9f s VAL 32 Ca 0.30 -1.97 -0.28 0.00 0.00 0.00 0.00 61.98 60.03 1s9f s VAL 32 Cb 0.05 -3.11 0.01 0.00 0.00 0.00 0.00 36.38 33.34 1s9f s VAL 32 CO 0.11 -0.58 1.02 -0.36 0.00 0.00 0.00 175.10 175.28 1s9f s PHE 33 N 1.13 3.18 -0.34 5.22 0.08 -1.26 -1.97 117.98 124.03 1s9f s PHE 33 Ca 0.06 1.15 0.20 0.00 0.12 0.00 0.00 56.93 58.47 1s9f s PHE 33 Cb -0.22 -3.56 0.23 0.00 -0.57 0.00 0.00 43.02 38.90 1s9f s PHE 33 CO -0.04 -0.70 1.52 0.66 -0.10 0.00 0.00 175.22 176.55 1s9f h SER 34 N 8.04 0.00 -0.20 1.36 4.64 -1.75 -3.48 113.55 122.16 1s9f h SER 34 Ca -0.21 0.00 -0.09 0.00 -0.47 0.00 0.00 61.79 61.02 1s9f h SER 34 Cb 1.07 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 63.12 1s9f h SER 34 CO 1.00 0.16 -0.08 0.61 -0.87 0.00 0.00 176.83 177.65 1s9f n GLY 35 N 1.15 0.70 0.12 -0.77 0.00 -1.26 -4.76 105.19 100.37 1s9f n GLY 35 Ca 0.03 -0.86 0.03 0.00 0.00 0.00 0.00 46.02 45.22 1s9f n GLY 35 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1s9f h ARG 36 N 0.02 0.00 -1.99 1.61 3.08 -1.87 -3.45 114.38 111.78 1s9f h ARG 36 Ca -0.09 0.00 0.24 0.00 0.07 0.00 0.00 59.98 60.21 1s9f h ARG 36 Cb 0.28 0.00 -0.09 0.00 0.08 0.00 0.00 29.97 30.23 1s9f h ARG 36 CO 0.13 0.33 0.65 -0.59 -1.07 0.00 0.00 179.97 179.42 1s9f s PHE 37 N -3.00 -0.07 -0.00 3.04 -0.12 -1.26 -4.98 117.98 111.59 1s9f s PHE 37 Ca 0.01 -0.16 -0.34 0.00 -0.05 0.00 0.00 56.93 56.39 1s9f s PHE 37 Cb 0.08 0.60 -0.13 0.00 -0.63 0.00 0.00 43.02 42.95 1s9f s PHE 37 CO 0.77 -0.59 1.77 -1.91 -0.05 0.00 0.00 175.22 175.21 1s9f n GLU 38 N -0.52 2.16 -1.70 1.99 2.13 -1.26 -1.03 120.64 122.42 1s9f n GLU 38 Ca -0.06 0.79 -0.16 0.00 0.66 0.00 0.00 57.16 58.38 1s9f n GLU 38 Cb 0.61 -2.60 -0.05 0.00 0.27 0.00 0.00 31.44 29.67 1s9f n GLU 38 CO 0.00 0.00 0.00 -0.25 -0.41 0.00 0.00 177.13 176.47 1s9f n ASP 39 N 5.49 -4.95 -4.79 4.31 8.00 -1.26 -4.97 116.55 118.38 1s9f n ASP 39 Ca 0.21 0.30 -0.34 0.00 0.71 0.00 0.00 54.79 55.67 1s9f n ASP 39 Cb 0.29 -3.94 -0.00 0.00 -0.02 0.00 0.00 41.12 37.45 1s9f n ASP 39 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 1s9f s SER 40 N -2.68 5.88 0.00 -2.24 1.04 -0.19 -3.77 113.70 111.74 1s9f s SER 40 Ca 0.00 1.93 0.00 0.00 0.48 0.00 0.00 55.95 58.36 1s9f s SER 40 Cb 0.00 -2.55 0.00 0.00 0.10 0.00 0.00 66.02 63.57 1s9f s SER 40 CO 0.00 -1.10 0.00 0.61 0.98 0.00 0.00 173.24 173.73 1s9f n GLY 41 N -0.51 0.59 3.23 7.32 0.00 -1.26 -1.94 105.19 112.62 1s9f n GLY 41 Ca 0.10 -2.17 -0.13 0.00 0.00 0.00 0.00 46.02 43.81 1s9f n GLY 41 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1s9f s ALA 42 N -1.50 1.29 0.06 4.61 0.00 -0.83 -1.52 121.76 123.88 1s9f s ALA 42 Ca 0.00 -1.58 -0.27 0.00 0.00 0.00 0.00 51.96 50.11 1s9f s ALA 42 Cb 0.00 0.58 -0.05 0.00 0.00 0.00 0.00 23.12 23.64 1s9f s ALA 42 CO 0.00 -0.34 0.85 0.08 0.00 0.00 0.00 175.76 176.36 1s9f s VAL 43 N -3.70 4.66 -0.14 0.00 1.01 -0.49 -0.32 120.40 121.42 1s9f s VAL 43 Ca 0.24 1.83 -0.05 0.00 0.00 0.00 0.00 61.98 64.00 1s9f s VAL 43 Cb 0.06 -4.21 -0.25 0.00 0.00 0.00 0.00 36.38 31.99 1s9f s VAL 43 CO 0.04 0.33 0.27 0.00 0.00 0.00 0.00 175.10 175.74 1s9f n ALA 44 N 2.91 0.99 -3.62 5.51 0.00 0.15 0.35 120.51 126.79 1s9f n ALA 44 Ca 0.00 -0.68 -0.02 0.00 0.00 0.00 0.00 53.44 52.75 1s9f n ALA 44 Cb 0.50 -0.59 -0.01 0.00 0.00 0.00 0.00 19.45 19.35 1s9f n ALA 44 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.50 177.42 1s9f s THR 45 N -2.55 0.00 0.10 0.00 -1.32 -1.08 -4.31 115.64 106.47 1s9f s THR 45 Ca -0.24 -0.20 -0.11 0.00 -1.21 0.00 0.00 61.69 59.93 1s9f s THR 45 Cb 0.07 -1.63 0.01 0.00 -1.51 0.00 0.00 72.50 69.44 1s9f s THR 45 CO 0.74 0.00 0.26 0.00 -2.21 0.00 0.00 174.62 173.41 1s9f s ALA 46 N -2.59 -0.46 0.96 11.08 0.00 -1.26 -0.53 121.76 128.96 1s9f s ALA 46 Ca 0.12 -0.41 -0.16 0.00 0.00 0.00 0.00 51.96 51.51 1s9f s ALA 46 Cb 0.02 0.54 0.19 0.00 0.00 0.00 0.00 23.12 23.86 1s9f s ALA 46 CO -0.04 -0.54 1.28 0.54 0.00 0.00 0.00 175.76 177.00 1s9f s ASN 47 N -2.79 3.15 0.47 0.00 2.20 -0.47 -4.74 114.94 112.75 1s9f s ASN 47 Ca 0.04 0.40 0.14 0.00 -0.94 0.00 0.00 52.86 52.50 1s9f s ASN 47 Cb 0.04 -0.55 1.07 0.00 -2.00 0.00 0.00 41.25 39.81 1s9f s ASN 47 CO -0.11 -2.72 2.05 1.88 -2.94 0.00 0.00 177.10 175.26 1s9f h TYR 48 N -1.63 0.07 -0.45 1.54 -1.99 -1.95 -0.71 116.97 111.84 1s9f h TYR 48 Ca -0.45 -0.00 -0.01 0.00 2.00 0.00 0.00 58.73 60.27 1s9f h TYR 48 Cb 1.26 -0.02 -0.02 0.00 2.00 0.00 0.00 36.73 39.94 1s9f h TYR 48 CO -0.97 0.14 0.24 0.93 -0.00 0.00 0.00 178.16 178.51 1s9f h GLU 49 N 0.07 0.62 0.15 4.88 3.07 -1.93 -1.95 114.58 119.48 1s9f h GLU 49 Ca 0.01 -0.06 -0.35 0.00 -0.50 0.00 0.00 59.36 58.47 1s9f h GLU 49 Cb 0.18 -0.13 -0.01 0.00 -0.84 0.00 0.00 28.75 27.96 1s9f h GLU 49 CO 0.01 0.47 -1.81 0.00 -1.40 0.00 0.00 179.01 176.28 1s9f h ALA 50 N 1.64 0.31 -0.31 3.43 0.00 -1.73 -3.38 119.26 119.22 1s9f h ALA 50 Ca 0.16 -1.25 -0.03 0.00 0.00 0.00 0.00 54.91 53.80 1s9f h ALA 50 Cb 0.03 0.52 -0.02 0.00 0.00 0.00 0.00 17.79 18.33 1s9f h ALA 50 CO -0.03 1.18 0.07 0.00 0.00 0.00 0.00 179.25 180.48 1s9f h ARG 51 N 0.08 0.44 0.00 0.00 3.08 -0.94 -2.18 114.38 114.86 1s9f h ARG 51 Ca -0.36 -0.06 0.00 0.00 0.07 0.00 0.00 59.98 59.63 1s9f h ARG 51 Cb 2.06 -0.08 0.00 0.00 0.08 0.00 0.00 29.97 32.03 1s9f h ARG 51 CO 0.14 0.41 0.00 1.57 -1.07 0.00 0.00 179.97 181.02 1s9f h LYS 52 N 0.44 0.00 -0.47 0.04 2.10 -1.53 0.08 116.57 117.23 1s9f h LYS 52 Ca 0.10 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.75 1s9f h LYS 52 Cb 0.17 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.50 1s9f h LYS 52 CO -0.00 0.00 0.00 1.19 -2.00 0.00 0.00 179.45 178.64 1s9f n PHE 53 N -2.36 0.62 -0.22 0.07 3.72 -0.84 -4.97 117.46 113.49 1s9f n PHE 53 Ca -0.01 -0.48 0.00 0.00 -0.05 0.00 0.00 57.45 56.90 1s9f n PHE 53 Cb 0.06 -0.02 0.00 0.00 -0.94 0.00 0.00 39.48 38.59 1s9f n PHE 53 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1s9f n GLY 54 N 0.91 0.68 3.54 1.37 0.00 0.01 -5.01 105.19 106.70 1s9f n GLY 54 Ca 0.16 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.75 1s9f n GLY 54 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1s9f s VAL 55 N -2.33 4.42 0.24 1.61 1.01 -1.11 -4.98 120.40 119.26 1s9f s VAL 55 Ca 0.00 0.49 -0.06 0.00 0.00 0.00 0.00 61.98 62.41 1s9f s VAL 55 Cb 0.00 -4.50 -0.02 0.00 0.00 0.00 0.00 36.38 31.86 1s9f s VAL 55 CO 0.00 -1.00 0.31 -1.59 0.00 0.00 0.00 175.10 172.83 1s9f s LYS 56 N 3.88 1.42 0.10 2.72 -2.85 -1.26 -3.35 119.74 120.41 1s9f s LYS 56 Ca 0.33 -1.49 -0.36 0.00 -1.00 0.00 0.00 55.97 53.46 1s9f s LYS 56 Cb -0.11 0.37 -0.16 0.00 -2.06 0.00 0.00 37.83 35.87 1s9f s LYS 56 CO 0.22 -0.54 1.37 0.00 0.10 0.00 0.00 175.35 176.51 1s9f n ALA 57 N -0.35 -0.58 0.00 0.59 0.00 -1.26 -2.73 120.51 116.18 1s9f n ALA 57 Ca 0.01 0.50 0.00 0.00 0.00 0.00 0.00 53.44 53.95 1s9f n ALA 57 Cb 0.64 -2.12 0.00 0.00 0.00 0.00 0.00 19.45 17.97 1s9f n ALA 57 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1s9f n GLY 58 N 2.64 2.66 3.78 0.00 0.00 0.16 -4.97 105.19 109.46 1s9f n GLY 58 Ca 0.18 -0.30 -0.35 0.00 0.00 0.00 0.00 46.02 45.55 1s9f n GLY 58 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1s9f s ILE 59 N -1.99 3.34 0.49 -0.61 -4.36 -1.10 -4.62 121.20 112.34 1s9f s ILE 59 Ca 0.00 0.86 -0.24 0.00 -0.26 0.00 0.00 60.65 61.01 1s9f s ILE 59 Cb 0.00 -3.36 -0.07 0.00 1.25 0.00 0.00 42.46 40.28 1s9f s ILE 59 CO 0.00 -0.16 1.37 -2.84 0.24 0.00 0.00 174.94 173.55 1s9f s PRO 60 N -3.19 3.48 0.26 0.37 0.02 -1.26 -1.40 135.00 133.28 1s9f s PRO 60 Ca 0.70 2.28 -0.05 0.00 0.02 0.00 0.00 61.00 63.96 1s9f s PRO 60 Cb -0.22 -2.48 0.31 0.00 0.02 0.00 0.00 34.50 32.13 1s9f s PRO 60 CO 0.26 -0.94 1.93 0.82 -0.33 0.00 0.00 177.00 178.74 1s9f h ILE 61 N 1.93 1.23 -0.15 2.83 2.04 -1.48 -1.40 117.51 122.50 1s9f h ILE 61 Ca -0.51 -0.45 -0.03 0.00 1.00 0.00 0.00 64.86 64.88 1s9f h ILE 61 Cb 1.28 -0.19 -0.01 0.00 -0.74 0.00 0.00 36.82 37.16 1s9f h ILE 61 CO 0.59 0.24 -0.05 -0.37 0.00 0.00 0.00 178.15 178.56 1s9f h VAL 62 N 1.30 1.13 -0.10 1.67 -1.51 -1.83 -1.28 116.25 115.64 1s9f h VAL 62 Ca 0.37 -0.54 -0.22 0.00 -1.23 0.00 0.00 66.70 65.08 1s9f h VAL 62 Cb -0.11 1.08 0.01 0.00 -2.13 0.00 0.00 31.29 30.14 1s9f h VAL 62 CO -0.09 0.17 -0.82 -0.08 -1.23 0.00 0.00 177.57 175.52 1s9f h GLU 63 N 0.21 0.65 -0.43 5.19 4.81 -1.67 -2.86 114.58 120.49 1s9f h GLU 63 Ca 0.05 -0.57 -0.01 0.00 -0.13 0.00 0.00 59.36 58.70 1s9f h GLU 63 Cb 0.24 0.13 -0.02 0.00 0.63 0.00 0.00 28.75 29.73 1s9f h GLU 63 CO 0.01 1.18 0.23 0.00 -0.73 0.00 0.00 179.01 179.71 1s9f h ALA 64 N 0.64 0.55 0.00 2.92 0.00 -0.64 -2.20 119.26 120.53 1s9f h ALA 64 Ca -0.06 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.75 1s9f h ALA 64 Cb 1.44 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 19.06 1s9f h ALA 64 CO 0.16 0.07 -0.07 0.87 0.00 0.00 0.00 179.25 180.28 1s9f h LYS 65 N 0.55 0.00 -0.09 0.00 1.57 -1.25 0.66 116.57 118.02 1s9f h LYS 65 Ca 0.15 0.00 -0.17 0.00 -1.87 0.00 0.00 60.65 58.76 1s9f h LYS 65 Cb 0.05 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.36 1s9f h LYS 65 CO -0.02 0.07 -0.67 0.87 -0.57 0.00 0.00 179.45 179.12 1s9f h LYS 66 N 0.00 0.36 -0.02 3.15 1.57 -1.17 -1.58 116.57 118.88 1s9f h LYS 66 Ca -0.00 -0.27 -0.06 0.00 -1.87 0.00 0.00 60.65 58.45 1s9f h LYS 66 Cb 0.12 0.05 0.00 0.00 0.08 0.00 0.00 32.23 32.48 1s9f h LYS 66 CO 0.01 0.90 -0.21 0.82 -0.57 0.00 0.00 179.45 180.40 1s9f h ILE 67 N 0.25 1.51 -2.54 1.86 2.04 -0.79 -3.40 117.51 116.44 1s9f h ILE 67 Ca -0.02 -1.81 -0.60 0.00 1.00 0.00 0.00 64.86 63.44 1s9f h ILE 67 Cb 1.22 2.62 -0.40 0.00 -0.74 0.00 0.00 36.82 39.52 1s9f h ILE 67 CO 0.11 0.49 -0.81 0.18 0.00 0.00 0.00 178.15 178.13 1s9f n LEU 68 N -4.55 1.32 0.24 1.44 4.77 0.11 -4.97 117.00 115.37 1s9f n LEU 68 Ca -0.09 -4.83 0.15 0.00 -0.03 0.00 0.00 56.01 51.20 1s9f n LEU 68 Cb 0.46 -0.04 0.82 0.00 -2.33 0.00 0.00 43.42 42.34 1s9f n LEU 68 CO 0.38 1.88 1.13 1.55 -1.33 0.00 0.00 177.39 181.00 1s9f h PRO 69 N 5.15 0.00 -0.47 3.23 0.13 -1.51 -2.37 132.00 136.17 1s9f h PRO 69 Ca 0.19 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.32 1s9f h PRO 69 Cb 0.82 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.95 1s9f h PRO 69 CO 0.56 0.00 0.00 0.09 -0.23 0.00 0.00 178.00 178.42 1s9f n ASN 70 N -3.99 2.92 -4.74 1.44 5.03 -1.26 -4.96 115.26 109.69 1s9f n ASN 70 Ca -0.01 -1.95 -0.29 0.00 0.87 0.00 0.00 54.58 53.20 1s9f n ASN 70 Cb 0.20 -0.31 0.14 0.00 -1.02 0.00 0.00 39.78 38.79 1s9f n ASN 70 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1s9f s ALA 71 N -1.38 1.53 -0.27 5.41 0.00 -0.89 -4.92 121.76 121.23 1s9f s ALA 71 Ca 0.37 -0.39 -0.13 0.00 0.00 0.00 0.00 51.96 51.82 1s9f s ALA 71 Cb 0.20 -3.09 -0.04 0.00 0.00 0.00 0.00 23.12 20.19 1s9f s ALA 71 CO 0.27 -2.41 0.29 0.08 0.00 0.00 0.00 175.76 173.99 1s9f s VAL 72 N -3.12 5.24 -0.32 0.00 1.01 -0.44 -5.00 120.40 117.76 1s9f s VAL 72 Ca 0.64 0.39 -0.09 0.00 0.00 0.00 0.00 61.98 62.91 1s9f s VAL 72 Cb -0.16 -3.62 0.01 0.00 0.00 0.00 0.00 36.38 32.61 1s9f s VAL 72 CO 0.55 0.21 0.14 -0.31 0.00 0.00 0.00 175.10 175.70 1s9f s TYR 73 N 1.86 3.19 0.06 5.22 2.02 -1.26 -0.18 117.35 128.26 1s9f s TYR 73 Ca 0.11 -0.81 0.07 0.00 -0.37 0.00 0.00 57.07 56.08 1s9f s TYR 73 Cb -0.16 -2.34 -0.03 0.00 -0.40 0.00 0.00 41.96 39.02 1s9f s TYR 73 CO 0.10 -0.54 -0.16 -0.51 -1.57 0.00 0.00 175.55 172.87 1s9f s LEU 74 N 1.56 2.73 0.32 -1.29 1.43 -0.06 -5.00 118.68 118.38 1s9f s LEU 74 Ca 0.03 -0.42 -0.27 0.00 -1.03 0.00 0.00 54.13 52.44 1s9f s LEU 74 Cb -0.18 -1.59 -0.09 0.00 0.03 0.00 0.00 46.19 44.36 1s9f s LEU 74 CO 0.05 0.23 1.02 -2.16 0.23 0.00 0.00 176.35 175.73 1s9f s PRO 75 N -1.68 4.51 0.26 1.29 0.04 -1.26 -0.48 135.00 137.69 1s9f s PRO 75 Ca 0.16 1.55 -0.31 0.00 0.04 0.00 0.00 61.00 62.44 1s9f s PRO 75 Cb -0.11 -2.91 -0.13 0.00 0.04 0.00 0.00 34.50 31.40 1s9f s PRO 75 CO 0.07 0.17 1.52 -0.12 0.04 0.00 0.00 177.00 178.69 1s9f n MET 76 N 0.69 2.39 -3.20 4.56 0.00 0.44 -4.76 117.12 117.24 1s9f n MET 76 Ca 0.01 0.85 -0.24 0.00 -0.00 0.00 0.00 57.70 58.33 1s9f n MET 76 Cb 0.48 -2.59 -0.06 0.00 0.00 0.00 0.00 33.22 31.05 1s9f n MET 76 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 175.97 176.51 1s9f n ARG 77 N 2.30 1.79 -0.31 2.12 1.74 -1.26 -4.97 116.66 118.06 1s9f n ARG 77 Ca 0.11 -3.99 0.15 0.00 -0.77 0.00 0.00 57.85 53.35 1s9f n ARG 77 Cb 0.34 -1.82 0.34 0.00 -1.02 0.00 0.00 32.46 30.30 1s9f n ARG 77 CO 0.00 0.00 0.00 -0.22 -1.52 0.00 0.00 177.63 175.89 1s9f h LYS 78 N 3.61 0.38 -0.63 5.56 1.63 -2.00 -1.34 116.57 123.78 1s9f h LYS 78 Ca 0.12 -0.02 0.05 0.00 -0.85 0.00 0.00 60.65 59.95 1s9f h LYS 78 Cb 0.76 -0.09 -0.05 0.00 -0.60 0.00 0.00 32.23 32.26 1s9f h LYS 78 CO 0.65 0.25 0.36 0.93 -3.45 0.00 0.00 179.45 178.18 1s9f h GLU 79 N 0.39 0.66 -0.07 1.90 3.07 -1.99 -0.70 114.58 117.83 1s9f h GLU 79 Ca 0.60 -0.04 -0.00 0.00 -0.50 0.00 0.00 59.36 59.41 1s9f h GLU 79 Cb 1.18 -0.15 -0.00 0.00 -0.84 0.00 0.00 28.75 28.94 1s9f h GLU 79 CO -0.55 0.43 0.03 0.28 -1.40 0.00 0.00 179.01 177.80 1s9f h VAL 80 N 0.68 1.13 -0.40 3.13 2.07 -1.68 -2.50 116.25 118.67 1s9f h VAL 80 Ca 0.27 -0.37 -0.01 0.00 0.82 0.00 0.00 66.70 67.41 1s9f h VAL 80 Cb 0.13 1.25 -0.02 0.00 -1.52 0.00 0.00 31.29 31.12 1s9f h VAL 80 CO -0.15 0.11 0.19 1.88 0.02 0.00 0.00 177.57 179.62 1s9f h TYR 81 N -0.03 0.54 -0.50 1.57 0.05 -1.24 -2.02 116.97 115.33 1s9f h TYR 81 Ca 0.02 -0.01 -0.12 0.00 0.05 0.00 0.00 58.73 58.68 1s9f h TYR 81 Cb 0.14 -0.17 -0.01 0.00 1.01 0.00 0.00 36.73 37.70 1s9f h TYR 81 CO -0.03 0.40 -0.15 0.37 -1.05 0.00 0.00 178.16 177.70 1s9f h GLN 82 N 0.55 0.99 -0.45 4.88 5.75 -0.94 -0.01 115.11 125.88 1s9f h GLN 82 Ca 0.14 -0.39 -0.12 0.00 -0.15 0.00 0.00 58.65 58.13 1s9f h GLN 82 Cb 0.06 -0.05 -0.01 0.00 1.07 0.00 0.00 27.48 28.55 1s9f h GLN 82 CO -0.02 1.07 -0.19 1.96 -2.65 0.00 0.00 178.83 179.00 1s9f h GLN 83 N 0.85 0.92 -0.32 1.69 4.20 -1.00 -0.33 115.11 121.12 1s9f h GLN 83 Ca 0.12 -0.39 -0.03 0.00 0.06 0.00 0.00 58.65 58.42 1s9f h GLN 83 Cb 0.72 -0.03 -0.01 0.00 0.30 0.00 0.00 27.48 28.46 1s9f h GLN 83 CO 0.06 1.04 0.09 0.28 -0.67 0.00 0.00 178.83 179.63 1s9f h VAL 84 N 0.75 1.21 -0.45 -0.54 2.07 -1.31 -2.43 116.25 115.55 1s9f h VAL 84 Ca 0.10 -0.68 0.05 0.00 0.82 0.00 0.00 66.70 67.00 1s9f h VAL 84 Cb 0.75 1.06 -0.05 0.00 -1.52 0.00 0.00 31.29 31.53 1s9f h VAL 84 CO 0.06 0.23 0.18 -1.28 0.02 0.00 0.00 177.57 176.78 1s9f h SER 85 N 0.35 0.21 -0.24 0.57 0.87 -0.78 -1.71 113.55 112.82 1s9f h SER 85 Ca 0.10 0.05 -0.03 0.00 -1.23 0.00 0.00 61.79 60.68 1s9f h SER 85 Cb 0.26 0.02 -0.02 0.00 -0.44 0.00 0.00 62.40 62.22 1s9f h SER 85 CO -0.00 0.16 0.08 0.77 -0.53 0.00 0.00 176.83 177.30 1s9f h SER 86 N 0.36 0.42 -0.41 6.23 4.64 -0.91 -0.01 113.55 123.88 1s9f h SER 86 Ca 0.21 -0.05 -0.11 0.00 -0.47 0.00 0.00 61.79 61.37 1s9f h SER 86 Cb 0.19 -0.11 -0.01 0.00 -0.31 0.00 0.00 62.40 62.16 1s9f h SER 86 CO -0.20 0.43 -0.16 0.03 -0.87 0.00 0.00 176.83 176.06 1s9f h ARG 87 N 0.45 0.83 -0.46 4.77 3.08 -0.89 -1.85 114.38 120.32 1s9f h ARG 87 Ca 0.11 -0.34 -0.13 0.00 0.07 0.00 0.00 59.98 59.68 1s9f h ARG 87 Cb 0.18 -0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.18 1s9f h ARG 87 CO -0.00 0.98 -0.23 0.82 -1.07 0.00 0.00 179.97 180.46 1s9f h ILE 88 N 0.64 1.27 -0.70 2.04 2.04 -0.80 -2.45 117.51 119.55 1s9f h ILE 88 Ca 0.10 -1.39 -0.02 0.00 1.00 0.00 0.00 64.86 64.54 1s9f h ILE 88 Cb 0.71 1.16 -0.03 0.00 -0.74 0.00 0.00 36.82 37.91 1s9f h ILE 88 CO 0.05 0.48 0.35 0.24 0.00 0.00 0.00 178.15 179.27 1s9f h MET 89 N 0.82 0.99 -0.58 2.37 2.86 -0.92 -1.38 114.93 119.10 1s9f h MET 89 Ca 0.10 -0.13 -0.04 0.00 -2.06 0.00 0.00 59.70 57.57 1s9f h MET 89 Cb 0.80 -0.19 -0.03 0.00 0.06 0.00 0.00 31.60 32.25 1s9f h MET 89 CO 0.07 0.76 0.19 -0.91 1.06 0.00 0.00 176.91 178.07 1s9f h ASN 90 N 0.99 0.80 -0.51 1.22 2.35 -1.07 -1.11 115.58 118.24 1s9f h ASN 90 Ca 0.25 -0.13 -0.04 0.00 -0.55 0.00 0.00 56.30 55.83 1s9f h ASN 90 Cb 0.08 -0.21 -0.02 0.00 0.05 0.00 0.00 38.32 38.22 1s9f h ASN 90 CO -0.03 0.76 0.17 -0.07 -1.65 0.00 0.00 177.43 176.61 1s9f h LEU 91 N 0.85 0.74 -1.15 1.61 3.38 -0.81 -2.62 115.31 117.30 1s9f h LEU 91 Ca 0.19 -0.20 -0.04 0.00 0.09 0.00 0.00 57.88 57.93 1s9f h LEU 91 Cb 0.24 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.77 1s9f h LEU 91 CO -0.01 0.73 0.13 -0.07 0.09 0.00 0.00 178.44 179.32 1s9f h LEU 92 N 0.70 0.67 -2.04 1.67 3.38 -0.89 -2.11 115.31 116.69 1s9f h LEU 92 Ca 0.17 -0.11 0.07 0.00 0.09 0.00 0.00 57.88 58.11 1s9f h LEU 92 Cb 0.25 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.82 1s9f h LEU 92 CO -0.01 0.66 0.36 -0.09 0.09 0.00 0.00 178.44 179.45 1s9f h ARG 93 N 0.71 0.00 0.00 1.13 9.65 -0.82 0.99 114.38 126.04 1s9f h ARG 93 Ca 0.16 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 59.04 1s9f h ARG 93 Cb 0.24 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 28.82 1s9f h ARG 93 CO -0.00 0.00 0.00 0.39 2.80 0.00 0.00 179.97 183.16 1s9f n GLU 94 N -3.49 0.11 -0.00 0.20 1.02 -0.79 -3.36 120.64 114.32 1s9f n GLU 94 Ca 0.04 0.14 0.10 0.00 -0.02 0.00 0.00 57.16 57.41 1s9f n GLU 94 Cb 0.49 -1.64 -0.13 0.00 -0.02 0.00 0.00 31.44 30.14 1s9f n GLU 94 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 1s9f n TYR 95 N -1.84 0.00 -3.65 -0.32 4.01 0.34 -4.97 117.16 110.73 1s9f n TYR 95 Ca 0.06 0.00 -0.04 0.00 -0.16 0.00 0.00 57.90 57.76 1s9f n TYR 95 Cb 0.35 -0.08 -0.07 0.00 -0.31 0.00 0.00 39.34 39.23 1s9f n TYR 95 CO 0.00 0.00 0.00 0.45 -0.46 0.00 0.00 176.86 176.85 1s9f s SER 96 N -3.23 -0.19 0.20 7.72 0.15 -1.21 -4.96 113.70 112.18 1s9f s SER 96 Ca 0.05 0.34 0.12 0.00 0.70 0.00 0.00 55.95 57.17 1s9f s SER 96 Cb 0.16 0.52 -0.06 0.00 -1.71 0.00 0.00 66.02 64.92 1s9f s SER 96 CO 0.87 -0.06 1.34 1.05 1.20 0.00 0.00 173.24 177.64 1s9f h GLU 97 N 3.93 0.00 -5.70 5.44 9.09 -1.91 -3.39 114.58 122.03 1s9f h GLU 97 Ca -0.27 0.00 -0.66 0.00 0.05 0.00 0.00 59.36 58.48 1s9f h GLU 97 Cb 1.19 0.00 -0.11 0.00 -1.65 0.00 0.00 28.75 28.17 1s9f h GLU 97 CO 0.17 0.69 1.68 0.15 0.05 0.00 0.00 179.01 181.76 1s9f s LYS 98 N -2.85 3.82 -0.03 1.06 1.02 -1.26 -4.94 119.74 116.55 1s9f s LYS 98 Ca 0.02 -1.74 0.04 0.00 0.02 0.00 0.00 55.97 54.31 1s9f s LYS 98 Cb 0.09 -5.34 -0.00 0.00 -0.52 0.00 0.00 37.83 32.05 1s9f s LYS 98 CO 0.78 -2.12 -0.14 -1.50 -0.92 0.00 0.00 175.35 171.45 1s9f s ILE 99 N 3.96 1.14 -0.28 2.17 2.07 -1.26 -1.16 121.20 127.84 1s9f s ILE 99 Ca 0.47 -0.56 0.01 0.00 -1.41 0.00 0.00 60.65 59.16 1s9f s ILE 99 Cb 0.01 -0.99 0.06 0.00 0.13 0.00 0.00 42.46 41.66 1s9f s ILE 99 CO -0.01 0.34 -0.06 -0.70 -1.91 0.00 0.00 174.94 172.60 1s9f s GLU 100 N 0.09 2.29 -0.65 3.50 2.12 0.20 -4.25 118.70 121.99 1s9f s GLU 100 Ca -0.03 -1.34 -0.25 0.00 0.36 0.00 0.00 54.97 53.71 1s9f s GLU 100 Cb -0.10 -3.03 0.05 0.00 0.26 0.00 0.00 34.13 31.31 1s9f s GLU 100 CO 0.01 -0.61 1.08 0.42 -0.54 0.00 0.00 175.26 175.62 1s9f s ILE 101 N 1.15 4.13 0.04 -3.70 1.01 -1.26 -0.06 121.20 122.51 1s9f s ILE 101 Ca -0.07 0.16 -0.19 0.00 0.00 0.00 0.00 60.65 60.55 1s9f s ILE 101 Cb -0.20 -4.72 -0.16 0.00 0.01 0.00 0.00 42.46 37.38 1s9f s ILE 101 CO -0.04 -1.48 1.27 0.00 0.00 0.00 0.00 174.94 174.69 1s9f h ALA 102 N 9.64 0.21 -2.57 9.38 0.00 -1.48 -3.44 119.26 131.00 1s9f h ALA 102 Ca -0.27 -0.43 0.00 0.00 0.00 0.00 0.00 54.91 54.21 1s9f h ALA 102 Cb 1.06 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.83 1s9f h ALA 102 CO 1.19 0.26 0.00 -1.13 0.00 0.00 0.00 179.25 179.57 1s9f n SER 103 N -4.37 0.00 0.28 0.00 3.41 -1.06 -4.97 113.62 106.91 1s9f n SER 103 Ca -0.07 -0.77 0.19 0.00 -0.26 0.00 0.00 58.87 57.95 1s9f n SER 103 Cb 0.50 0.00 0.87 0.00 -0.26 0.00 0.00 64.21 65.31 1s9f n SER 103 CO 0.00 0.00 0.00 -0.29 -0.16 0.00 0.00 175.04 174.59 1s9f h ILE 104 N 0.77 0.00 0.00 -1.33 2.10 -2.01 -3.23 117.51 113.82 1s9f h ILE 104 Ca 0.00 -0.26 -0.07 0.00 1.08 0.00 0.00 64.86 65.61 1s9f h ILE 104 Cb 0.00 1.20 -0.15 0.00 -1.09 0.00 0.00 36.82 36.78 1s9f h ILE 104 CO 0.00 0.00 -0.66 -0.90 -1.08 0.00 0.00 178.15 175.51 1s9f n ASP 105 N -2.95 0.74 -3.80 2.19 5.68 -1.26 -4.79 116.55 112.36 1s9f n ASP 105 Ca -0.01 -2.25 -0.13 0.00 -0.50 0.00 0.00 54.79 51.90 1s9f n ASP 105 Cb 0.19 -0.29 -0.14 0.00 -1.14 0.00 0.00 41.12 39.74 1s9f n ASP 105 CO 0.00 0.00 0.00 -1.61 -1.33 0.00 0.00 177.20 174.26 1s9f s GLU 106 N -0.53 0.06 -0.06 0.11 2.02 -1.22 -1.69 118.70 117.39 1s9f s GLU 106 Ca 0.19 0.20 -0.07 0.00 0.02 0.00 0.00 54.97 55.30 1s9f s GLU 106 Cb 0.20 -0.08 0.02 0.00 0.10 0.00 0.00 34.13 34.37 1s9f s GLU 106 CO -0.07 -0.09 0.19 0.00 0.02 0.00 0.00 175.26 175.31 1s9f s ALA 107 N 0.58 -0.47 -0.14 5.21 0.00 -0.76 -1.10 121.76 125.10 1s9f s ALA 107 Ca -0.05 0.42 -0.03 0.00 0.00 0.00 0.00 51.96 52.31 1s9f s ALA 107 Cb -0.06 -0.23 -0.03 0.00 0.00 0.00 0.00 23.12 22.80 1s9f s ALA 107 CO -0.02 -0.12 -0.05 0.71 0.00 0.00 0.00 175.76 176.28 1s9f s TYR 108 N -0.24 3.01 -0.13 0.00 2.02 0.92 -1.14 117.35 121.79 1s9f s TYR 108 Ca -0.03 -0.24 0.02 0.00 -0.37 0.00 0.00 57.07 56.44 1s9f s TYR 108 Cb -0.03 -1.90 0.01 0.00 -0.40 0.00 0.00 41.96 39.65 1s9f s TYR 108 CO 0.01 0.04 -0.17 -0.51 -1.57 0.00 0.00 175.55 173.35 1s9f s LEU 109 N 0.10 1.86 -0.61 -1.29 1.02 0.12 0.59 118.68 120.47 1s9f s LEU 109 Ca -0.01 -0.51 -0.24 0.00 0.02 0.00 0.00 54.13 53.39 1s9f s LEU 109 Cb -0.14 -1.24 0.05 0.00 0.02 0.00 0.00 46.19 44.88 1s9f s LEU 109 CO 0.03 0.02 1.00 -0.62 0.02 0.00 0.00 176.35 176.80 1s9f s ASP 110 N 1.04 6.27 -0.27 2.29 3.68 -0.31 -0.73 116.67 128.64 1s9f s ASP 110 Ca -0.04 -0.55 0.12 0.00 2.13 0.00 0.00 52.55 54.21 1s9f s ASP 110 Cb -0.15 -2.45 0.65 0.00 -1.45 0.00 0.00 42.92 39.53 1s9f s ASP 110 CO -0.04 -1.38 1.64 2.30 0.13 0.00 0.00 175.17 177.82 1s9f n ILE 111 N 6.15 2.68 0.23 4.11 -5.35 -0.58 -4.60 119.36 121.99 1s9f n ILE 111 Ca 0.00 -1.87 0.12 0.00 -0.27 0.00 0.00 62.75 60.73 1s9f n ILE 111 Cb 0.47 -0.32 0.72 0.00 -1.74 0.00 0.00 39.64 38.77 1s9f n ILE 111 CO 0.00 0.00 0.00 0.77 -1.76 0.00 0.00 176.55 175.56 1s9f h SER 112 N 2.24 0.00 0.87 7.28 4.64 -1.82 -1.67 113.55 125.10 1s9f h SER 112 Ca 0.16 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.48 1s9f h SER 112 Cb 1.95 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 64.04 1s9f h SER 112 CO 0.52 0.00 -0.92 0.47 -0.87 0.00 0.00 176.83 176.03 1s9f n ASP 113 N -4.31 0.77 0.05 4.97 10.43 -1.26 -4.06 116.55 123.14 1s9f n ASP 113 Ca -0.01 0.20 0.12 0.00 2.57 0.00 0.00 54.79 57.67 1s9f n ASP 113 Cb 0.18 0.44 0.12 0.00 1.84 0.00 0.00 41.12 43.70 1s9f n ASP 113 CO 0.00 0.00 0.00 0.29 -1.07 0.00 0.00 177.20 176.42 1s9f n LYS 114 N -2.43 0.29 -4.03 -1.24 4.76 -0.67 -4.94 118.16 109.91 1s9f n LYS 114 Ca 0.01 0.05 -0.09 0.00 -2.87 0.00 0.00 58.31 55.42 1s9f n LYS 114 Cb 0.51 -1.65 -0.11 0.00 -1.84 0.00 0.00 35.03 31.94 1s9f n LYS 114 CO 0.00 0.00 0.00 0.14 -1.37 0.00 0.00 177.40 176.17 1s9f s VAL 115 N -3.18 0.23 -0.17 -0.18 -7.23 -0.97 -5.00 120.40 103.90 1s9f s VAL 115 Ca 0.05 -1.26 -0.10 0.00 -1.81 0.00 0.00 61.98 58.86 1s9f s VAL 115 Cb 0.14 -0.76 -0.22 0.00 0.56 0.00 0.00 36.38 36.09 1s9f s VAL 115 CO 0.75 -0.66 0.21 0.54 -0.31 0.00 0.00 175.10 175.63 1s9f n ARG 116 N 1.04 0.68 -3.39 4.82 1.74 -1.26 -4.78 116.66 115.51 1s9f n ARG 116 Ca -0.20 0.34 -0.13 0.00 -0.77 0.00 0.00 57.85 57.09 1s9f n ARG 116 Cb 0.57 -1.69 -0.05 0.00 -1.02 0.00 0.00 32.46 30.28 1s9f n ARG 116 CO 0.00 0.00 0.00 -0.40 -1.52 0.00 0.00 177.63 175.71 1s9f n ASP 117 N -3.77 0.09 0.27 0.55 3.85 -1.26 -5.05 116.55 111.23 1s9f n ASP 117 Ca -0.35 -2.33 0.17 0.00 -0.71 0.00 0.00 54.79 51.57 1s9f n ASP 117 Cb 0.93 0.89 0.63 0.00 -1.35 0.00 0.00 41.12 42.22 1s9f n ASP 117 CO 0.00 0.00 0.00 1.88 -1.01 0.00 0.00 177.20 178.07 1s9f h TYR 118 N 1.57 0.00 -0.19 2.11 0.05 -1.98 -2.20 116.97 116.33 1s9f h TYR 118 Ca -0.16 0.00 -0.05 0.00 0.05 0.00 0.00 58.73 58.57 1s9f h TYR 118 Cb 0.73 0.00 -0.00 0.00 1.01 0.00 0.00 36.73 38.47 1s9f h TYR 118 CO 0.00 0.01 -0.09 -0.09 -1.05 0.00 0.00 178.16 176.93 1s9f h ARG 119 N 0.00 0.39 -0.36 4.88 2.43 -1.99 -0.62 114.38 119.12 1s9f h ARG 119 Ca -0.00 -0.17 -0.06 0.00 -0.81 0.00 0.00 59.98 58.94 1s9f h ARG 119 Cb 0.56 -0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 30.09 1s9f h ARG 119 CO 0.00 0.69 0.01 0.93 -1.51 0.00 0.00 179.97 180.09 1s9f h GLU 120 N 0.08 0.63 -0.75 0.20 5.08 -1.94 -0.96 114.58 116.92 1s9f h GLU 120 Ca 0.04 -0.20 0.08 0.00 -1.00 0.00 0.00 59.36 58.28 1s9f h GLU 120 Cb 0.57 -0.06 -0.07 0.00 0.50 0.00 0.00 28.75 29.70 1s9f h GLU 120 CO 0.03 0.74 0.42 0.00 -1.00 0.00 0.00 179.01 179.19 1s9f h ALA 121 N 0.87 1.04 0.24 3.43 0.00 -1.36 0.31 119.26 123.79 1s9f h ALA 121 Ca 0.10 0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.03 1s9f h ALA 121 Cb 0.45 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.12 1s9f h ALA 121 CO 0.02 0.06 -0.13 -0.92 0.00 0.00 0.00 179.25 178.28 1s9f h TYR 122 N 0.73 -0.34 -0.25 0.00 3.20 -0.79 0.33 116.97 119.84 1s9f h TYR 122 Ca 0.35 -0.01 0.02 0.00 3.14 0.00 0.00 58.73 62.23 1s9f h TYR 122 Cb 0.29 0.12 -0.01 0.00 1.54 0.00 0.00 36.73 38.67 1s9f h TYR 122 CO -0.08 -0.21 0.17 -0.91 -1.64 0.00 0.00 178.16 175.49 1s9f h ASN 123 N -0.35 0.23 0.44 -2.11 2.35 -0.22 0.24 115.58 116.16 1s9f h ASN 123 Ca -0.03 -0.00 -0.12 0.00 -0.55 0.00 0.00 56.30 55.60 1s9f h ASN 123 Cb 0.28 -0.06 -0.01 0.00 0.05 0.00 0.00 38.32 38.58 1s9f h ASN 123 CO 0.04 0.17 -0.52 0.25 -1.65 0.00 0.00 177.43 175.72 1s9f h LEU 124 N 0.28 0.10 -0.47 1.61 5.85 0.27 -1.31 115.31 121.64 1s9f h LEU 124 Ca 0.10 -0.05 -0.06 0.00 0.84 0.00 0.00 57.88 58.71 1s9f h LEU 124 Cb 0.05 -0.03 -0.02 0.00 0.37 0.00 0.00 40.66 41.04 1s9f h LEU 124 CO -0.02 0.61 0.07 1.23 -0.34 0.00 0.00 178.44 179.99 1s9f h GLY 125 N 1.49 0.84 1.49 3.75 0.00 0.16 -0.74 103.07 110.05 1s9f h GLY 125 Ca -0.00 -0.56 -0.09 0.00 0.00 0.00 0.00 47.33 46.68 1s9f h GLY 125 CO 0.07 0.52 -0.15 1.41 0.00 0.00 0.00 176.54 178.40 1s9f h LEU 126 N 0.65 0.60 0.01 3.11 4.07 -1.06 -1.58 115.31 121.11 1s9f h LEU 126 Ca 0.14 -0.17 -0.00 0.00 0.08 0.00 0.00 57.88 57.93 1s9f h LEU 126 Cb 0.39 -0.16 0.00 0.00 1.08 0.00 0.00 40.66 41.97 1s9f h LEU 126 CO 0.01 0.76 -0.00 -0.08 -1.08 0.00 0.00 178.44 178.05 1s9f h GLU 127 N 0.55 -0.01 -0.66 1.13 4.57 -0.75 -0.35 114.58 119.06 1s9f h GLU 127 Ca 0.09 0.00 -0.02 0.00 -1.18 0.00 0.00 59.36 58.25 1s9f h GLU 127 Cb 0.57 0.00 -0.03 0.00 -0.16 0.00 0.00 28.75 29.13 1s9f h GLU 127 CO 0.04 0.01 0.33 0.82 -1.18 0.00 0.00 179.01 179.03 1s9f h ILE 128 N -0.03 1.22 -0.62 2.32 2.04 -0.97 -0.83 117.51 120.64 1s9f h ILE 128 Ca -0.00 -0.59 -0.02 0.00 1.00 0.00 0.00 64.86 65.25 1s9f h ILE 128 Cb 0.02 0.40 -0.03 0.00 -0.74 0.00 0.00 36.82 36.48 1s9f h ILE 128 CO 0.00 0.25 0.32 0.11 0.00 0.00 0.00 178.15 178.83 1s9f h LYS 129 N 0.91 0.88 -0.39 2.37 1.57 -1.03 -1.06 116.57 119.81 1s9f h LYS 129 Ca 0.23 -0.12 -0.07 0.00 -1.87 0.00 0.00 60.65 58.82 1s9f h LYS 129 Cb 0.09 -0.17 -0.01 0.00 0.08 0.00 0.00 32.23 32.22 1s9f h LYS 129 CO -0.03 0.68 -0.04 -0.91 -0.57 0.00 0.00 179.45 178.58 1s9f h ASN 130 N 0.84 0.72 -0.30 0.86 2.35 -0.79 -1.35 115.58 117.92 1s9f h ASN 130 Ca 0.22 -0.33 0.01 0.00 -0.55 0.00 0.00 56.30 55.64 1s9f h ASN 130 Cb 0.08 -0.20 -0.02 0.00 0.05 0.00 0.00 38.32 38.23 1s9f h ASN 130 CO -0.03 0.89 0.17 0.50 -1.65 0.00 0.00 177.43 177.31 1s9f h LYS 131 N 0.54 0.34 -0.66 0.81 1.63 -0.93 0.47 116.57 118.78 1s9f h LYS 131 Ca 0.11 -0.02 -0.08 0.00 -0.85 0.00 0.00 60.65 59.81 1s9f h LYS 131 Cb 0.54 -0.08 -0.03 0.00 -0.60 0.00 0.00 32.23 32.07 1s9f h LYS 131 CO 0.03 0.23 0.11 0.82 -3.45 0.00 0.00 179.45 177.19 1s9f h ILE 132 N 0.36 1.26 -0.20 2.00 2.04 -1.14 -0.52 117.51 121.30 1s9f h ILE 132 Ca 0.12 -1.01 -0.12 0.00 1.00 0.00 0.00 64.86 64.84 1s9f h ILE 132 Cb 0.00 0.63 -0.01 0.00 -0.74 0.00 0.00 36.82 36.70 1s9f h ILE 132 CO -0.06 0.38 -0.38 0.25 0.00 0.00 0.00 178.15 178.35 1s9f h LEU 133 N 1.01 0.48 -0.14 1.44 5.85 -0.84 -0.29 115.31 122.82 1s9f h LEU 133 Ca 0.20 -0.20 -0.05 0.00 0.84 0.00 0.00 57.88 58.68 1s9f h LEU 133 Cb 0.42 -0.13 -0.00 0.00 0.37 0.00 0.00 40.66 41.32 1s9f h LEU 133 CO 0.01 0.81 -0.09 -0.08 -0.34 0.00 0.00 178.44 178.75 1s9f h GLU 134 N 0.38 0.30 0.24 1.25 4.81 0.37 -0.59 114.58 121.34 1s9f h GLU 134 Ca 0.04 -0.14 -0.32 0.00 -0.13 0.00 0.00 59.36 58.80 1s9f h GLU 134 Cb 0.84 -0.00 0.04 0.00 0.63 0.00 0.00 28.75 30.25 1s9f h GLU 134 CO 0.07 0.66 -1.41 0.87 -0.73 0.00 0.00 179.01 178.47 1s9f h LYS 135 N -0.06 0.53 0.00 1.92 1.79 -1.10 -3.40 116.57 116.26 1s9f h LYS 135 Ca 0.03 -0.89 0.00 0.00 -2.18 0.00 0.00 60.65 57.60 1s9f h LYS 135 Cb 0.58 0.33 0.00 0.00 -1.58 0.00 0.00 32.23 31.56 1s9f h LYS 135 CO 0.03 1.43 0.00 0.39 -1.08 0.00 0.00 179.45 180.21 1s9f n GLU 136 N -3.76 3.48 -3.66 3.15 -0.58 -0.14 -5.02 120.64 114.11 1s9f n GLU 136 Ca -0.16 -0.22 -0.24 0.00 -0.42 0.00 0.00 57.16 56.12 1s9f n GLU 136 Cb 1.07 -0.71 0.07 0.00 -0.57 0.00 0.00 31.44 31.30 1s9f n GLU 136 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 1s9f n LYS 137 N -0.56 -7.05 -5.03 3.49 4.01 -0.23 -4.98 118.16 107.81 1s9f n LYS 137 Ca 0.00 0.77 -0.31 0.00 -0.51 0.00 0.00 58.31 58.26 1s9f n LYS 137 Cb 0.00 -5.75 -0.17 0.00 -0.51 0.00 0.00 35.03 28.60 1s9f n LYS 137 CO 0.00 0.00 0.00 0.42 -1.11 0.00 0.00 177.40 176.71 1s9f s ILE 138 N -3.34 1.92 0.23 -0.18 1.01 -1.24 -4.93 121.20 114.67 1s9f s ILE 138 Ca 0.49 -0.93 -0.19 0.00 0.00 0.00 0.00 60.65 60.02 1s9f s ILE 138 Cb -0.22 -1.68 -0.08 0.00 0.01 0.00 0.00 42.46 40.49 1s9f s ILE 138 CO 0.76 0.53 0.72 0.42 0.00 0.00 0.00 174.94 177.36 1s9f s THR 139 N 0.48 4.60 0.15 2.92 -4.23 -1.26 -3.82 115.64 114.48 1s9f s THR 139 Ca -0.16 1.20 -0.00 0.00 -1.18 0.00 0.00 61.69 61.54 1s9f s THR 139 Cb -0.17 -3.81 -0.04 0.00 1.34 0.00 0.00 72.50 69.82 1s9f s THR 139 CO 0.06 0.14 0.04 0.68 -0.54 0.00 0.00 174.62 175.01 1s9f s VAL 140 N -1.60 0.27 -0.06 2.29 -7.23 -1.26 -2.45 120.40 110.36 1s9f s VAL 140 Ca 0.45 -1.93 0.04 0.00 -1.81 0.00 0.00 61.98 58.72 1s9f s VAL 140 Cb -0.15 -2.09 -0.02 0.00 0.56 0.00 0.00 36.38 34.68 1s9f s VAL 140 CO 0.20 -0.45 -0.17 -0.89 -0.31 0.00 0.00 175.10 173.48 1s9f s THR 141 N -3.94 2.76 -0.02 5.32 2.01 0.47 -3.72 115.64 118.53 1s9f s THR 141 Ca 0.25 -0.82 0.06 0.00 0.31 0.00 0.00 61.69 61.49 1s9f s THR 141 Cb 0.07 -2.07 -0.01 0.00 0.01 0.00 0.00 72.50 70.50 1s9f s THR 141 CO 0.03 0.58 -0.21 0.54 -0.69 0.00 0.00 174.62 174.86 1s9f s VAL 142 N -0.47 1.71 -0.04 3.82 0.11 -0.90 -0.57 120.40 124.05 1s9f s VAL 142 Ca 0.06 -0.91 0.05 0.00 -2.93 0.00 0.00 61.98 58.25 1s9f s VAL 142 Cb -0.12 -1.42 -0.01 0.00 -1.53 0.00 0.00 36.38 33.30 1s9f s VAL 142 CO 0.01 0.48 -0.21 -0.83 -3.33 0.00 0.00 175.10 171.23 1s9f s GLY 143 N -0.41 1.07 -0.08 6.54 0.00 0.37 -1.51 107.32 113.30 1s9f s GLY 143 Ca 0.06 -0.85 0.02 0.00 0.00 0.00 0.00 44.72 43.95 1s9f s GLY 143 CO -0.00 -0.53 -0.13 -0.42 0.00 0.00 0.00 173.10 172.02 1s9f s ILE 144 N -0.13 1.23 0.00 0.90 1.01 -0.32 0.74 121.20 124.63 1s9f s ILE 144 Ca -0.01 -0.52 0.00 0.00 0.00 0.00 0.00 60.65 60.12 1s9f s ILE 144 Cb -0.12 -1.13 0.00 0.00 0.01 0.00 0.00 42.46 41.22 1s9f s ILE 144 CO 0.02 0.38 0.00 -0.24 0.00 0.00 0.00 174.94 175.10 1s9f n SER 145 N 3.95 0.00 -0.02 3.58 2.88 -0.84 -1.27 113.62 121.90 1s9f n SER 145 Ca -0.21 -0.87 0.13 0.00 -1.33 0.00 0.00 58.87 56.60 1s9f n SER 145 Cb 0.52 0.00 0.50 0.00 -0.75 0.00 0.00 64.21 64.47 1s9f n SER 145 CO 0.00 0.00 0.00 2.29 -1.23 0.00 0.00 175.04 176.10 1s9f n LYS 146 N 0.00 0.11 -3.92 -1.46 2.85 -1.26 -0.99 118.16 113.49 1s9f n LYS 146 Ca 0.00 -0.03 -0.08 0.00 -1.05 0.00 0.00 58.31 57.14 1s9f n LYS 146 Cb 0.00 -1.50 -0.03 0.00 -0.65 0.00 0.00 35.03 32.85 1s9f n LYS 146 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 177.40 177.89 1s9f s ASN 147 N -2.91 -0.11 0.16 -5.58 2.20 -1.26 -4.55 114.94 102.88 1s9f s ASN 147 Ca 0.16 -0.84 -0.16 0.00 -0.94 0.00 0.00 52.86 51.08 1s9f s ASN 147 Cb 0.19 0.68 0.06 0.00 -2.00 0.00 0.00 41.25 40.18 1s9f s ASN 147 CO 0.58 -1.30 1.75 0.11 -2.94 0.00 0.00 177.10 175.31 1s9f h LYS 148 N 2.11 0.28 0.09 3.55 1.57 -1.91 -2.16 116.57 120.09 1s9f h LYS 148 Ca -0.24 -0.02 0.01 0.00 -1.87 0.00 0.00 60.65 58.54 1s9f h LYS 148 Cb 1.25 -0.06 -0.02 0.00 0.08 0.00 0.00 32.23 33.47 1s9f h LYS 148 CO 0.31 0.19 -0.16 0.28 -0.57 0.00 0.00 179.45 179.49 1s9f h VAL 149 N 0.29 0.63 0.00 0.50 2.07 -1.97 -2.05 116.25 115.72 1s9f h VAL 149 Ca 0.17 0.00 -0.04 0.00 0.82 0.00 0.00 66.70 67.64 1s9f h VAL 149 Cb 0.14 0.63 -0.01 0.00 -1.52 0.00 0.00 31.29 30.53 1s9f h VAL 149 CO -0.16 0.00 -0.21 -0.26 0.02 0.00 0.00 177.57 176.96 1s9f h PHE 150 N -0.31 0.00 -0.53 1.57 0.04 -1.97 -0.92 116.94 114.82 1s9f h PHE 150 Ca 0.03 0.00 -0.11 0.00 2.80 0.00 0.00 57.97 60.69 1s9f h PHE 150 Cb 0.33 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 38.46 1s9f h PHE 150 CO -0.17 0.21 -0.08 0.00 -0.60 0.00 0.00 178.31 177.67 1s9f h ALA 151 N 1.79 0.72 -0.36 2.45 0.00 -1.06 -0.59 119.26 122.21 1s9f h ALA 151 Ca -0.00 -0.34 -0.14 0.00 0.00 0.00 0.00 54.91 54.43 1s9f h ALA 151 Cb 0.72 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.31 1s9f h ALA 151 CO 0.03 0.61 -0.31 -0.22 0.00 0.00 0.00 179.25 179.36 1s9f h LYS 152 N 0.86 0.85 -0.79 0.00 3.64 -0.86 -2.41 116.57 117.85 1s9f h LYS 152 Ca 0.14 -0.43 -0.01 0.00 -1.27 0.00 0.00 60.65 59.08 1s9f h LYS 152 Cb 0.64 0.01 -0.04 0.00 -0.41 0.00 0.00 32.23 32.43 1s9f h LYS 152 CO 0.04 1.07 0.47 0.82 -2.27 0.00 0.00 179.45 179.58 1s9f h ILE 153 N 0.64 1.22 -0.18 2.00 2.04 -0.99 -0.29 117.51 121.95 1s9f h ILE 153 Ca 0.06 -0.50 0.00 0.00 1.00 0.00 0.00 64.86 65.43 1s9f h ILE 153 Cb 0.89 0.11 -0.01 0.00 -0.74 0.00 0.00 36.82 37.07 1s9f h ILE 153 CO 0.08 0.24 0.11 0.00 0.00 0.00 0.00 178.15 178.58 1s9f h ALA 154 N 1.43 0.22 -0.68 1.87 0.00 -0.87 -0.60 119.26 120.63 1s9f h ALA 154 Ca 0.28 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.17 1s9f h ALA 154 Cb -0.04 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 17.66 1s9f h ALA 154 CO -0.05 -0.30 0.36 0.00 0.00 0.00 0.00 179.25 179.25 1s9f h ALA 155 N 1.07 1.36 -0.53 0.00 0.00 -0.92 -0.99 119.26 119.26 1s9f h ALA 155 Ca 0.07 -0.11 -0.05 0.00 0.00 0.00 0.00 54.91 54.82 1s9f h ALA 155 Cb -0.02 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.48 1s9f h ALA 155 CO -0.02 0.52 0.13 -0.44 0.00 0.00 0.00 179.25 179.43 1s9f h ASP 156 N 0.94 0.75 1.05 0.00 3.45 -0.39 0.79 116.42 123.03 1s9f h ASP 156 Ca 0.24 -0.13 -0.10 0.00 0.43 0.00 0.00 57.03 57.46 1s9f h ASP 156 Cb 0.04 -0.20 -0.01 0.00 -0.56 0.00 0.00 39.33 38.60 1s9f h ASP 156 CO -0.04 0.74 -0.49 0.24 -1.57 0.00 0.00 179.24 178.12 1s9f h MET 157 N 0.78 0.00 0.00 3.56 2.86 -0.19 -3.33 114.93 118.61 1s9f h MET 157 Ca 0.17 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.81 1s9f h MET 157 Cb 0.29 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.95 1s9f h MET 157 CO -0.00 0.49 -1.13 0.00 1.06 0.00 0.00 176.91 177.33 1s9f n ALA 158 N -2.29 3.89 -1.76 6.32 0.00 -0.47 -5.00 120.51 121.21 1s9f n ALA 158 Ca 0.00 -0.49 -0.36 0.00 0.00 0.00 0.00 53.44 52.59 1s9f n ALA 158 Cb 0.63 -0.65 0.02 0.00 0.00 0.00 0.00 19.45 19.45 1s9f n ALA 158 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 177.50 175.91 1s9f s LYS 159 N -2.86 3.23 0.49 0.00 -2.85 0.23 -3.70 119.74 114.27 1s9f s LYS 159 Ca 0.03 1.78 -0.02 0.00 -1.00 0.00 0.00 55.97 56.76 1s9f s LYS 159 Cb 0.13 -2.05 -0.00 0.00 -2.06 0.00 0.00 37.83 33.85 1s9f s LYS 159 CO 0.75 -0.99 0.74 -1.25 0.10 0.00 0.00 175.35 174.70 1s9f s PRO 160 N -3.19 3.06 -1.41 1.78 0.04 -1.26 -4.95 135.00 129.08 1s9f s PRO 160 Ca 0.73 -0.31 -0.08 0.00 0.04 0.00 0.00 61.00 61.38 1s9f s PRO 160 Cb -0.29 -2.47 0.01 0.00 0.04 0.00 0.00 34.50 31.79 1s9f s PRO 160 CO 0.32 -0.38 0.32 -1.71 0.04 0.00 0.00 177.00 175.60 1s9f n ASN 161 N -2.23 -0.91 -1.06 6.66 4.05 -1.26 -4.94 115.26 115.57 1s9f n ASN 161 Ca 0.02 -1.18 0.00 0.00 0.45 0.00 0.00 54.58 53.87 1s9f n ASN 161 Cb 0.57 -2.22 0.00 0.00 1.23 0.00 0.00 39.78 39.37 1s9f n ASN 161 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 1s9f n GLY 162 N -2.23 4.72 3.63 8.20 0.00 -1.24 -4.97 105.19 113.30 1s9f n GLY 162 Ca -0.26 -1.85 -0.11 0.00 0.00 0.00 0.00 46.02 43.79 1s9f n GLY 162 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1s9f s ILE 163 N -1.16 0.00 -0.14 -0.61 2.07 -1.26 -2.12 121.20 117.99 1s9f s ILE 163 Ca 0.00 0.00 -0.10 0.00 -1.41 0.00 0.00 60.65 59.14 1s9f s ILE 163 Cb 0.00 -1.00 0.05 0.00 0.13 0.00 0.00 42.46 41.64 1s9f s ILE 163 CO 0.00 0.00 0.36 -0.75 -1.91 0.00 0.00 174.94 172.64 1s9f s LYS 164 N 0.70 0.38 -0.11 3.50 2.36 -0.57 -4.96 119.74 121.05 1s9f s LYS 164 Ca -0.02 0.61 -0.01 0.00 -2.55 0.00 0.00 55.97 54.00 1s9f s LYS 164 Cb -0.05 0.08 -0.02 0.00 -1.05 0.00 0.00 37.83 36.78 1s9f s LYS 164 CO -0.06 -0.10 -0.08 0.08 1.55 0.00 0.00 175.35 176.74 1s9f s VAL 165 N 0.77 3.54 -0.41 4.02 1.01 -1.26 -1.17 120.40 126.90 1s9f s VAL 165 Ca -0.05 -0.51 0.03 0.00 0.00 0.00 0.00 61.98 61.45 1s9f s VAL 165 Cb -0.06 -2.48 0.11 0.00 0.00 0.00 0.00 36.38 33.95 1s9f s VAL 165 CO -0.05 0.55 0.14 -0.63 0.00 0.00 0.00 175.10 175.11 1s9f s ILE 166 N -0.16 2.52 1.18 2.22 1.01 -0.40 -4.98 121.20 122.59 1s9f s ILE 166 Ca 0.01 -2.65 -0.20 0.00 0.00 0.00 0.00 60.65 57.82 1s9f s ILE 166 Cb -0.13 -2.80 0.29 0.00 0.01 0.00 0.00 42.46 39.82 1s9f s ILE 166 CO 0.03 -0.68 1.17 1.51 0.00 0.00 0.00 174.94 176.97 1s9f s ASP 167 N 0.60 1.13 0.51 3.58 3.84 -1.26 -4.41 116.67 120.66 1s9f s ASP 167 Ca 0.13 0.44 0.18 0.00 -0.00 0.00 0.00 52.55 53.31 1s9f s ASP 167 Cb -0.21 -0.56 1.26 0.00 -1.38 0.00 0.00 42.92 42.02 1s9f s ASP 167 CO -0.05 -3.97 2.07 0.44 -0.00 0.00 0.00 175.17 173.65 1s9f h ASP 168 N -2.49 0.08 -0.12 2.11 5.19 -1.99 -1.91 116.42 117.30 1s9f h ASP 168 Ca -0.43 0.00 -0.15 0.00 -0.62 0.00 0.00 57.03 55.83 1s9f h ASP 168 Cb 1.27 -0.02 0.01 0.00 0.18 0.00 0.00 39.33 40.77 1s9f h ASP 168 CO 0.30 0.05 -0.51 -0.33 -3.12 0.00 0.00 179.24 175.64 1s9f h GLU 169 N 0.09 0.55 0.00 3.56 4.39 -2.00 -2.77 114.58 118.40 1s9f h GLU 169 Ca 0.13 -0.43 -0.06 0.00 0.34 0.00 0.00 59.36 59.34 1s9f h GLU 169 Cb 0.42 0.09 -0.01 0.00 -0.10 0.00 0.00 28.75 29.14 1s9f h GLU 169 CO -0.01 1.06 -0.31 1.49 -1.16 0.00 0.00 179.01 180.08 1s9f h GLU 170 N 0.16 0.00 -0.64 2.33 4.81 -1.83 -2.13 114.58 117.27 1s9f h GLU 170 Ca -0.03 0.00 -0.07 0.00 -0.13 0.00 0.00 59.36 59.13 1s9f h GLU 170 Cb 1.14 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 30.50 1s9f h GLU 170 CO 0.11 0.31 0.13 0.28 -0.73 0.00 0.00 179.01 179.10 1s9f h VAL 171 N 0.00 1.26 -0.48 0.32 2.07 -1.30 0.29 116.25 118.41 1s9f h VAL 171 Ca -0.00 -0.98 -0.10 0.00 0.82 0.00 0.00 66.70 66.44 1s9f h VAL 171 Cb 0.78 0.65 -0.02 0.00 -1.52 0.00 0.00 31.29 31.19 1s9f h VAL 171 CO 0.04 0.37 -0.09 0.11 0.02 0.00 0.00 177.57 178.02 1s9f h LYS 172 N 0.97 0.91 -0.48 1.57 1.57 -1.18 -1.45 116.57 118.48 1s9f h LYS 172 Ca 0.20 -0.34 -0.03 0.00 -1.87 0.00 0.00 60.65 58.61 1s9f h LYS 172 Cb 0.40 -0.06 -0.02 0.00 0.08 0.00 0.00 32.23 32.63 1s9f h LYS 172 CO 0.01 0.99 0.17 -0.09 -0.57 0.00 0.00 179.45 179.96 1s9f h ARG 173 N 0.76 0.72 -0.49 3.15 2.43 -0.95 -2.97 114.38 117.03 1s9f h ARG 173 Ca 0.13 -0.14 -0.08 0.00 -0.81 0.00 0.00 59.98 59.07 1s9f h ARG 173 Cb 0.64 -0.11 -0.02 0.00 -0.42 0.00 0.00 29.97 30.05 1s9f h ARG 173 CO 0.04 0.66 -0.03 -0.07 -1.51 0.00 0.00 179.97 179.06 1s9f h LEU 174 N 0.63 0.83 -1.93 3.80 3.38 -0.29 0.15 115.31 121.88 1s9f h LEU 174 Ca 0.16 -0.22 0.07 0.00 0.09 0.00 0.00 57.88 57.98 1s9f h LEU 174 Cb 0.22 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.74 1s9f h LEU 174 CO -0.01 0.91 0.21 0.40 0.09 0.00 0.00 178.44 180.05 1s9f h ILE 175 N 0.78 0.89 0.00 1.22 2.04 -1.11 0.38 117.51 121.72 1s9f h ILE 175 Ca 0.14 -0.03 -0.23 0.00 1.00 0.00 0.00 64.86 65.75 1s9f h ILE 175 Cb 0.52 0.80 -0.04 0.00 -0.74 0.00 0.00 36.82 37.36 1s9f h ILE 175 CO 0.03 0.02 -1.98 0.54 0.00 0.00 0.00 178.15 176.76 1s9f n ARG 176 N -4.47 0.66 0.00 2.37 1.74 -0.93 -1.72 116.66 114.31 1s9f n ARG 176 Ca 0.04 0.04 0.03 0.00 -0.77 0.00 0.00 57.85 57.19 1s9f n ARG 176 Cb 0.32 -1.62 -0.04 0.00 -1.02 0.00 0.00 32.46 30.10 1s9f n ARG 176 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 1s9f n GLU 177 N -2.71 4.77 -2.77 5.56 1.02 0.48 -4.88 120.64 122.12 1s9f n GLU 177 Ca -0.19 -0.01 -0.42 0.00 -0.02 0.00 0.00 57.16 56.53 1s9f n GLU 177 Cb 0.93 -0.82 -0.03 0.00 -0.02 0.00 0.00 31.44 31.51 1s9f n GLU 177 CO 0.00 0.00 0.00 -1.17 1.18 0.00 0.00 177.13 177.14 1s9f s LEU 178 N -2.30 4.29 0.01 -4.62 2.96 0.13 -4.98 118.68 114.16 1s9f s LEU 178 Ca 0.03 1.48 -0.33 0.00 -0.22 0.00 0.00 54.13 55.09 1s9f s LEU 178 Cb 0.05 -3.46 -0.11 0.00 0.50 0.00 0.00 46.19 43.17 1s9f s LEU 178 CO 0.27 -0.34 1.86 -0.67 -1.32 0.00 0.00 176.35 176.16 1s9f n ASP 179 N 4.51 3.68 0.18 3.68 -0.08 -1.26 -4.28 116.55 122.98 1s9f n ASP 179 Ca 0.06 0.97 0.11 0.00 -1.51 0.00 0.00 54.79 54.42 1s9f n ASP 179 Cb 0.50 -1.44 0.59 0.00 2.34 0.00 0.00 41.12 43.11 1s9f n ASP 179 CO 0.00 0.00 0.00 -0.29 0.12 0.00 0.00 177.20 177.03 1s9f h ILE 180 N 5.15 0.00 0.00 5.18 2.10 -1.64 0.94 117.51 129.25 1s9f h ILE 180 Ca -0.48 0.00 0.00 0.00 1.08 0.00 0.00 64.86 65.46 1s9f h ILE 180 Cb 1.25 0.48 0.00 0.00 -1.09 0.00 0.00 36.82 37.47 1s9f h ILE 180 CO 0.94 0.00 0.00 0.00 -1.08 0.00 0.00 178.15 178.01 1s9f h ALA 181 N 1.83 1.00 -0.09 0.18 0.00 -1.87 -2.78 119.26 117.53 1s9f h ALA 181 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1s9f h ALA 181 Cb 0.13 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.92 1s9f h ALA 181 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 179.25 179.00 1s9f n ASP 182 N -3.05 0.87 -4.70 0.00 10.43 0.33 -4.77 116.55 115.64 1s9f n ASP 182 Ca 0.03 -1.62 -0.41 0.00 2.57 0.00 0.00 54.79 55.37 1s9f n ASP 182 Cb 0.44 -0.06 -0.04 0.00 1.84 0.00 0.00 41.12 43.29 1s9f n ASP 182 CO 0.00 0.00 0.00 -0.69 -1.07 0.00 0.00 177.20 175.44 1s9f s VAL 183 N -1.88 4.98 0.15 2.53 1.01 -1.05 -4.98 120.40 121.16 1s9f s VAL 183 Ca 0.28 1.59 -0.34 0.00 0.00 0.00 0.00 61.98 63.51 1s9f s VAL 183 Cb 0.14 -4.11 -0.15 0.00 0.00 0.00 0.00 36.38 32.27 1s9f s VAL 183 CO 0.22 0.18 1.48 -2.65 0.00 0.00 0.00 175.10 174.32 1s9f n PRO 184 N 4.18 1.83 -0.01 2.72 -0.02 -1.26 -1.46 135.00 140.98 1s9f n PRO 184 Ca 0.01 0.66 0.00 0.00 -2.02 0.00 0.00 63.50 62.15 1s9f n PRO 184 Cb 0.51 -2.37 0.00 0.00 -0.02 0.00 0.00 33.50 31.62 1s9f n PRO 184 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1s9f n GLY 185 N 2.96 0.27 3.22 -1.23 0.00 -1.26 -5.03 105.19 104.12 1s9f n GLY 185 Ca 0.17 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.78 1s9f n GLY 185 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1s9f s ILE 186 N -2.08 4.18 0.00 -0.61 -1.09 -0.54 -5.02 121.20 116.03 1s9f s ILE 186 Ca 0.00 -1.74 0.00 0.00 -2.23 0.00 0.00 60.65 56.68 1s9f s ILE 186 Cb 0.00 -3.73 0.00 0.00 -1.58 0.00 0.00 42.46 37.15 1s9f s ILE 186 CO 0.00 -0.74 0.00 0.61 -1.23 0.00 0.00 174.94 173.58 1s9f n GLY 187 N 4.90 0.47 0.06 6.18 0.00 -1.26 -4.76 105.19 110.78 1s9f n GLY 187 Ca -0.08 -1.89 -0.11 0.00 0.00 0.00 0.00 46.02 43.95 1s9f n GLY 187 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 1s9f h ASN 188 N 0.00 -0.05 0.09 1.61 2.35 -1.97 0.11 115.58 117.71 1s9f h ASN 188 Ca 0.00 0.02 0.02 0.00 -0.55 0.00 0.00 56.30 55.79 1s9f h ASN 188 Cb 0.00 0.04 -0.03 0.00 0.05 0.00 0.00 38.32 38.38 1s9f h ASN 188 CO 0.00 -0.02 -0.22 0.40 -1.65 0.00 0.00 177.43 175.94 1s9f h ILE 189 N 0.00 0.50 -0.72 2.81 5.03 -2.00 0.38 117.51 123.52 1s9f h ILE 189 Ca 0.03 0.00 -0.07 0.00 -0.12 0.00 0.00 64.86 64.70 1s9f h ILE 189 Cb 0.05 0.50 -0.03 0.00 -3.03 0.00 0.00 36.82 34.31 1s9f h ILE 189 CO -0.07 0.00 0.18 0.74 -0.68 0.00 0.00 178.15 178.32 1s9f h THR 190 N -0.40 1.26 -0.33 -0.27 2.02 -1.91 -2.45 112.91 110.84 1s9f h THR 190 Ca 0.04 -0.98 0.02 0.00 0.77 0.00 0.00 66.41 66.26 1s9f h THR 190 Cb 0.43 0.52 -0.02 0.00 -1.74 0.00 0.00 68.15 67.34 1s9f h THR 190 CO -0.14 0.38 0.18 0.00 0.37 0.00 0.00 175.52 176.30 1s9f h ALA 191 N 1.09 0.40 -0.54 6.16 0.00 -0.35 -0.46 119.26 125.57 1s9f h ALA 191 Ca 0.23 0.00 0.01 0.00 0.00 0.00 0.00 54.91 55.15 1s9f h ALA 191 Cb 0.37 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.06 1s9f h ALA 191 CO 0.00 -0.19 0.35 0.93 0.00 0.00 0.00 179.25 180.34 1s9f h GLU 192 N 0.37 0.68 -0.70 0.00 4.39 -0.80 0.13 114.58 118.65 1s9f h GLU 192 Ca 0.13 -0.04 -0.03 0.00 0.34 0.00 0.00 59.36 59.76 1s9f h GLU 192 Cb 0.02 -0.15 -0.03 0.00 -0.10 0.00 0.00 28.75 28.48 1s9f h GLU 192 CO -0.07 0.45 0.32 0.87 -1.16 0.00 0.00 179.01 179.41 1s9f h LYS 193 N 0.70 1.01 -0.17 2.33 1.57 -1.06 -1.55 116.57 119.40 1s9f h LYS 193 Ca 0.20 -0.15 -0.05 0.00 -1.87 0.00 0.00 60.65 58.78 1s9f h LYS 193 Cb -0.05 -0.18 -0.00 0.00 0.08 0.00 0.00 32.23 32.07 1s9f h LYS 193 CO -0.06 0.80 -0.09 -0.07 -0.57 0.00 0.00 179.45 179.46 1s9f h LEU 194 N 1.00 0.37 -1.38 2.94 3.38 -0.54 -2.75 115.31 118.34 1s9f h LEU 194 Ca 0.24 -0.42 0.04 0.00 0.09 0.00 0.00 57.88 57.83 1s9f h LEU 194 Cb 0.14 -0.10 -0.04 0.00 0.09 0.00 0.00 40.66 40.74 1s9f h LEU 194 CO -0.03 0.71 0.45 0.50 0.09 0.00 0.00 178.44 180.16 1s9f h LYS 195 N 0.03 0.78 -0.20 1.13 3.64 -0.81 -0.58 116.57 120.57 1s9f h LYS 195 Ca 0.04 -0.05 -0.07 0.00 -1.27 0.00 0.00 60.65 59.30 1s9f h LYS 195 Cb 0.57 -0.18 -0.01 0.00 -0.41 0.00 0.00 32.23 32.20 1s9f h LYS 195 CO 0.03 0.52 -0.18 0.87 -2.27 0.00 0.00 179.45 178.42 1s9f h LYS 196 N 0.80 0.33 -0.00 1.90 1.57 -1.16 -2.28 116.57 117.74 1s9f h LYS 196 Ca 0.28 -0.10 0.00 0.00 -1.87 0.00 0.00 60.65 58.96 1s9f h LYS 196 Cb 0.09 -0.04 0.00 0.00 0.08 0.00 0.00 32.23 32.37 1s9f h LYS 196 CO -0.08 0.51 -0.12 1.28 -0.57 0.00 0.00 179.45 180.47 1s9f n LEU 197 N -4.20 0.18 0.00 2.94 4.77 -0.37 -4.90 117.00 115.43 1s9f n LEU 197 Ca -0.00 0.28 0.00 0.00 -0.03 0.00 0.00 56.01 56.26 1s9f n LEU 197 Cb 0.33 -0.36 0.00 0.00 -2.33 0.00 0.00 43.42 41.05 1s9f n LEU 197 CO 0.39 0.04 0.00 0.61 -1.33 0.00 0.00 177.39 177.11 1s9f n GLY 198 N 1.43 0.79 3.43 -0.72 0.00 -0.82 -5.02 105.19 104.27 1s9f n GLY 198 Ca 0.09 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.67 1s9f n GLY 198 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1s9f s ILE 199 N -2.01 4.66 -0.41 -0.61 1.01 -0.38 -4.82 121.20 118.64 1s9f s ILE 199 Ca 0.00 -0.59 0.10 0.00 0.00 0.00 0.00 60.65 60.15 1s9f s ILE 199 Cb 0.00 -4.50 -0.11 0.00 0.01 0.00 0.00 42.46 37.86 1s9f s ILE 199 CO 0.00 -1.13 0.40 0.59 0.00 0.00 0.00 174.94 174.79 1s9f n ASN 200 N 6.75 0.74 -4.15 3.58 4.13 -1.26 -3.77 115.26 121.28 1s9f n ASN 200 Ca -0.06 -0.64 -0.11 0.00 1.68 0.00 0.00 54.58 55.44 1s9f n ASN 200 Cb 0.44 1.06 -0.10 0.00 -1.54 0.00 0.00 39.78 39.64 1s9f n ASN 200 CO 0.00 0.00 0.00 -0.54 0.28 0.00 0.00 177.26 177.00 1s9f s LYS 201 N -2.04 0.78 0.25 3.52 -0.14 -1.26 -1.61 119.74 119.25 1s9f s LYS 201 Ca 0.03 -1.24 -0.04 0.00 -1.36 0.00 0.00 55.97 53.36 1s9f s LYS 201 Cb 0.07 -0.22 0.43 0.00 -1.68 0.00 0.00 37.83 36.43 1s9f s LYS 201 CO 0.41 -0.00 1.79 -0.07 -0.76 0.00 0.00 175.35 176.72 1s9f h LEU 202 N 3.23 0.59 -1.06 3.17 3.38 -1.70 -1.31 115.31 121.61 1s9f h LEU 202 Ca -0.35 0.06 0.11 0.00 0.09 0.00 0.00 57.88 57.79 1s9f h LEU 202 Cb 1.17 -0.04 -0.08 0.00 0.09 0.00 0.00 40.66 41.80 1s9f h LEU 202 CO 0.61 0.32 0.62 0.58 0.09 0.00 0.00 178.44 180.65 1s9f h VAL 203 N 0.71 0.94 -0.39 1.22 2.07 -1.67 -1.68 116.25 117.45 1s9f h VAL 203 Ca 0.41 -0.33 0.11 0.00 0.82 0.00 0.00 66.70 67.71 1s9f h VAL 203 Cb 0.45 -0.12 -0.02 0.00 -1.52 0.00 0.00 31.29 30.08 1s9f h VAL 203 CO -0.28 0.18 0.45 0.44 0.02 0.00 0.00 177.57 178.37 1s9f h ASP 204 N 0.97 0.00 0.60 0.57 3.32 -1.54 0.24 116.42 120.59 1s9f h ASP 204 Ca 0.47 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.52 1s9f h ASP 204 Cb 0.46 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.01 1s9f h ASP 204 CO -0.24 0.00 0.00 0.35 -1.72 0.00 0.00 179.24 177.63 1s9f n THR 205 N -3.65 0.91 1.24 0.35 -2.24 -0.63 -1.89 114.28 108.37 1s9f n THR 205 Ca 0.07 0.23 0.13 0.00 -2.27 0.00 0.00 64.05 62.21 1s9f n THR 205 Cb 0.62 -1.03 0.30 0.00 -2.10 0.00 0.00 70.33 68.12 1s9f n THR 205 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1s9f n LEU 206 N -1.74 1.99 -0.54 3.22 4.77 0.85 -4.00 117.00 121.55 1s9f n LEU 206 Ca 0.03 -0.66 0.08 0.00 -0.03 0.00 0.00 56.01 55.43 1s9f n LEU 206 Cb 0.20 -0.02 0.19 0.00 -2.33 0.00 0.00 43.42 41.46 1s9f n LEU 206 CO 0.16 0.34 0.64 -1.54 -1.33 0.00 0.00 177.39 175.66 1s9f n SER 207 N 0.42 3.15 -4.11 -1.43 3.41 -0.79 -4.99 113.62 109.28 1s9f n SER 207 Ca 0.15 -2.84 -0.14 0.00 -0.26 0.00 0.00 58.87 55.78 1s9f n SER 207 Cb 0.45 -0.43 -0.11 0.00 -0.26 0.00 0.00 64.21 63.86 1s9f n SER 207 CO 0.00 0.00 0.00 -0.51 -0.16 0.00 0.00 175.04 174.37 1s9f s ILE 208 N -2.48 0.72 0.26 -1.33 2.07 -1.25 -5.12 121.20 114.08 1s9f s ILE 208 Ca 0.33 -1.23 -0.30 0.00 -1.41 0.00 0.00 60.65 58.04 1s9f s ILE 208 Cb 0.27 -0.85 -0.10 0.00 0.13 0.00 0.00 42.46 41.91 1s9f s ILE 208 CO 0.07 -0.39 1.36 -1.61 -1.91 0.00 0.00 174.94 172.46 1s9f s GLU 209 N -1.86 4.33 0.25 3.50 0.41 -1.26 -4.91 118.70 119.17 1s9f s GLU 209 Ca -0.05 2.20 -0.04 0.00 -0.41 0.00 0.00 54.97 56.67 1s9f s GLU 209 Cb -0.08 -3.12 0.46 0.00 -1.78 0.00 0.00 34.13 29.60 1s9f s GLU 209 CO 0.01 -0.29 1.76 0.35 -0.49 0.00 0.00 175.26 176.59 1s9f h PHE 210 N 4.58 0.65 -0.70 1.61 3.57 -1.99 -1.54 116.94 123.13 1s9f h PHE 210 Ca -0.47 0.03 -0.01 0.00 3.53 0.00 0.00 57.97 61.06 1s9f h PHE 210 Cb 1.22 -0.17 -0.03 0.00 2.79 0.00 0.00 35.95 39.76 1s9f h PHE 210 CO 0.59 0.15 0.40 -0.44 -2.23 0.00 0.00 178.31 176.79 1s9f h ASP 211 N 0.56 0.84 -0.13 0.41 3.32 -1.98 0.53 116.42 119.97 1s9f h ASP 211 Ca 0.42 -0.06 -0.15 0.00 0.02 0.00 0.00 57.03 57.27 1s9f h ASP 211 Cb 0.57 -0.21 0.01 0.00 0.22 0.00 0.00 39.33 39.91 1s9f h ASP 211 CO -0.35 0.67 -0.49 0.50 -1.72 0.00 0.00 179.24 177.84 1s9f h LYS 212 N 0.96 0.56 -0.14 3.56 3.64 -1.69 -0.31 116.57 123.15 1s9f h LYS 212 Ca 0.25 -0.43 -0.01 0.00 -1.27 0.00 0.00 60.65 59.19 1s9f h LYS 212 Cb -0.01 0.08 -0.01 0.00 -0.41 0.00 0.00 32.23 31.89 1s9f h LYS 212 CO -0.04 1.05 0.05 1.25 -2.27 0.00 0.00 179.45 179.49 1s9f h LEU 213 N 0.19 0.21 -0.70 5.20 5.85 -1.06 -2.08 115.31 122.92 1s9f h LEU 213 Ca -0.02 -0.19 0.07 0.00 0.84 0.00 0.00 57.88 58.58 1s9f h LEU 213 Cb 1.12 -0.05 -0.06 0.00 0.37 0.00 0.00 40.66 42.04 1s9f h LEU 213 CO 0.10 0.34 0.38 0.50 -0.34 0.00 0.00 178.44 179.43 1s9f h LYS 214 N 0.06 0.67 0.00 1.25 3.64 0.04 -0.38 116.57 121.85 1s9f h LYS 214 Ca 0.05 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.39 1s9f h LYS 214 Cb 0.20 -0.15 0.00 0.00 -0.41 0.00 0.00 32.23 31.87 1s9f h LYS 214 CO -0.00 0.44 0.00 0.78 -2.27 0.00 0.00 179.45 178.40 1s9f h GLY 215 N 0.69 0.00 0.16 5.01 0.00 -0.80 0.23 103.07 108.35 1s9f h GLY 215 Ca 0.32 0.00 -0.29 0.00 0.00 0.00 0.00 47.33 47.36 1s9f h GLY 215 CO -0.21 0.00 -1.59 1.03 0.00 0.00 0.00 176.54 175.77 1s9f n MET 216 N -2.77 0.62 -0.03 4.80 2.81 -0.28 -4.65 117.12 117.62 1s9f n MET 216 Ca 0.01 0.46 0.02 0.00 -1.81 0.00 0.00 57.70 56.38 1s9f n MET 216 Cb 0.24 -1.71 0.03 0.00 -0.71 0.00 0.00 33.22 31.07 1s9f n MET 216 CO 0.00 0.00 0.00 0.44 1.51 0.00 0.00 175.97 177.92 1s9f n ILE 217 N -4.15 0.41 0.00 2.02 -5.35 -0.47 -5.04 119.36 106.79 1s9f n ILE 217 Ca -0.34 -0.71 0.00 0.00 -0.27 0.00 0.00 62.75 61.43 1s9f n ILE 217 Cb 0.80 0.85 0.00 0.00 -1.74 0.00 0.00 39.64 39.55 1s9f n ILE 217 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1s9f n GLY 218 N 0.08 1.11 0.16 3.28 0.00 0.80 -4.50 105.19 106.12 1s9f n GLY 218 Ca 0.03 -1.74 -0.14 0.00 0.00 0.00 0.00 46.02 44.18 1s9f n GLY 218 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1s9f h GLU 219 N 0.00 -0.30 -0.18 1.61 4.81 -1.92 -2.46 114.58 116.14 1s9f h GLU 219 Ca 0.00 0.02 0.05 0.00 -0.13 0.00 0.00 59.36 59.30 1s9f h GLU 219 Cb 0.00 0.07 -0.05 0.00 0.63 0.00 0.00 28.75 29.39 1s9f h GLU 219 CO 0.00 -0.10 -0.16 0.00 -0.73 0.00 0.00 179.01 178.02 1s9f h ALA 220 N 0.30 -0.04 0.00 2.92 0.00 -1.95 -1.63 119.26 118.86 1s9f h ALA 220 Ca -0.03 0.07 -0.08 0.00 0.00 0.00 0.00 54.91 54.87 1s9f h ALA 220 Cb 0.34 0.34 -0.01 0.00 0.00 0.00 0.00 17.79 18.45 1s9f h ALA 220 CO 0.05 -0.59 -0.37 0.87 0.00 0.00 0.00 179.25 179.21 1s9f h LYS 221 N -0.17 0.00 0.05 0.00 1.57 -1.79 -1.83 116.57 114.40 1s9f h LYS 221 Ca 0.11 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.89 1s9f h LYS 221 Cb 0.34 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.65 1s9f h LYS 221 CO -0.29 0.37 -0.03 0.00 -0.57 0.00 0.00 179.45 178.94 1s9f h ALA 222 N 1.63 -0.07 -0.54 3.86 0.00 -0.92 -1.77 119.26 121.44 1s9f h ALA 222 Ca -0.00 -0.18 -0.03 0.00 0.00 0.00 0.00 54.91 54.70 1s9f h ALA 222 Cb 0.67 0.03 -0.03 0.00 0.00 0.00 0.00 17.79 18.46 1s9f h ALA 222 CO 0.05 -0.36 0.21 0.87 0.00 0.00 0.00 179.25 180.02 1s9f h LYS 223 N -0.43 0.77 0.90 0.00 1.57 -1.28 -1.44 116.57 116.67 1s9f h LYS 223 Ca -0.01 -0.11 -0.04 0.00 -1.87 0.00 0.00 60.65 58.62 1s9f h LYS 223 Cb 0.38 -0.14 0.00 0.00 0.08 0.00 0.00 32.23 32.56 1s9f h LYS 223 CO 0.01 0.64 -0.48 -0.92 -0.57 0.00 0.00 179.45 178.13 1s9f h TYR 224 N 0.76 -1.25 -0.83 -1.35 3.20 -1.22 -0.10 116.97 116.19 1s9f h TYR 224 Ca 0.18 -0.02 -0.01 0.00 3.14 0.00 0.00 58.73 62.03 1s9f h TYR 224 Cb 0.15 0.43 -0.04 0.00 1.54 0.00 0.00 36.73 38.81 1s9f h TYR 224 CO 0.01 -0.74 0.50 -0.07 -1.64 0.00 0.00 178.16 176.21 1s9f h LEU 225 N -1.26 1.00 -0.28 2.82 3.38 -1.21 -2.29 115.31 117.48 1s9f h LEU 225 Ca -0.12 -0.06 -0.02 0.00 0.09 0.00 0.00 57.88 57.77 1s9f h LEU 225 Cb 0.99 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 41.47 1s9f h LEU 225 CO 0.17 0.77 0.10 0.40 0.09 0.00 0.00 178.44 179.98 1s9f h ILE 226 N 1.15 1.18 -0.68 1.22 2.04 -1.17 0.60 117.51 121.84 1s9f h ILE 226 Ca 0.30 -0.57 0.03 0.00 1.00 0.00 0.00 64.86 65.61 1s9f h ILE 226 Cb -0.04 1.04 -0.04 0.00 -0.74 0.00 0.00 36.82 37.04 1s9f h ILE 226 CO -0.06 0.19 0.45 0.77 0.00 0.00 0.00 178.15 179.51 1s9f h SER 227 N 0.30 0.73 -0.22 1.72 4.64 -0.72 -0.04 113.55 119.95 1s9f h SER 227 Ca 0.09 -0.01 -0.08 0.00 -0.47 0.00 0.00 61.79 61.32 1s9f h SER 227 Cb 0.20 -0.17 -0.00 0.00 -0.31 0.00 0.00 62.40 62.11 1s9f h SER 227 CO -0.01 0.51 -0.15 -0.07 -0.87 0.00 0.00 176.83 176.24 1s9f h LEU 228 N 0.85 0.52 -1.30 5.97 3.38 -0.95 0.34 115.31 124.13 1s9f h LEU 228 Ca 0.27 -0.44 -0.04 0.00 0.09 0.00 0.00 57.88 57.76 1s9f h LEU 228 Cb 0.01 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 40.60 1s9f h LEU 228 CO -0.07 0.85 0.08 0.00 0.09 0.00 0.00 178.44 179.39 1s9f h ALA 229 N 0.69 1.44 -0.00 1.53 0.00 -0.15 -0.55 119.26 122.22 1s9f h ALA 229 Ca 0.04 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.79 1s9f h ALA 229 Cb 0.68 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.31 1s9f h ALA 229 CO 0.04 0.41 -0.04 0.54 0.00 0.00 0.00 179.25 180.20 1s9f n ARG 230 N -4.33 0.82 -3.53 0.00 1.74 -0.10 -4.87 116.66 106.39 1s9f n ARG 230 Ca 0.02 -0.19 -0.25 0.00 -0.77 0.00 0.00 57.85 56.67 1s9f n ARG 230 Cb 0.20 -1.50 0.06 0.00 -1.02 0.00 0.00 32.46 30.20 1s9f n ARG 230 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 1s9f n ASP 231 N -0.93 -6.08 -0.29 0.55 2.03 -0.21 -4.88 116.55 106.74 1s9f n ASP 231 Ca 0.18 -0.52 0.03 0.00 0.52 0.00 0.00 54.79 54.99 1s9f n ASP 231 Cb 0.23 -4.82 0.06 0.00 -0.72 0.00 0.00 41.12 35.87 1s9f n ASP 231 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 1s9f n GLU 232 N -4.75 2.11 -2.53 -0.67 1.02 0.11 -5.00 120.64 110.93 1s9f n GLU 232 Ca -0.01 -1.53 -0.43 0.00 -0.02 0.00 0.00 57.16 55.18 1s9f n GLU 232 Cb 0.57 -1.13 -0.02 0.00 -0.02 0.00 0.00 31.44 30.84 1s9f n GLU 232 CO 0.00 0.00 0.00 -0.47 1.18 0.00 0.00 177.13 177.84 1s9f s TYR 233 N -0.86 3.23 -0.32 -0.32 5.04 -0.92 -4.91 117.35 118.29 1s9f s TYR 233 Ca 0.10 1.30 0.16 0.00 -2.44 0.00 0.00 57.07 56.19 1s9f s TYR 233 Cb 0.06 -3.36 0.45 0.00 0.35 0.00 0.00 41.96 39.45 1s9f s TYR 233 CO 0.08 -1.03 1.26 0.27 -1.34 0.00 0.00 175.55 174.78 1s9f n ASN 234 N 5.45 -0.05 -4.71 4.32 6.94 -1.26 -4.85 115.26 121.10 1s9f n ASN 234 Ca 0.11 -2.31 -0.42 0.00 -0.02 0.00 0.00 54.58 51.94 1s9f n ASN 234 Cb 0.47 0.15 -0.03 0.00 -2.36 0.00 0.00 39.78 38.01 1s9f n ASN 234 CO 0.00 0.00 0.00 -1.61 -1.03 0.00 0.00 177.26 174.62 1s9f s GLU 235 N -1.71 4.14 0.61 -3.83 0.41 -1.26 -4.96 118.70 112.11 1s9f s GLU 235 Ca 0.21 2.58 -0.17 0.00 -0.41 0.00 0.00 54.97 57.17 1s9f s GLU 235 Cb 0.40 -3.29 -0.02 0.00 -1.78 0.00 0.00 34.13 29.44 1s9f s GLU 235 CO -0.06 -0.78 1.15 -1.25 -0.49 0.00 0.00 175.26 173.84 1s9f s PRO 236 N 1.80 2.94 -0.17 0.39 0.04 -1.26 -4.71 135.00 134.03 1s9f s PRO 236 Ca 0.77 1.62 -0.29 0.00 0.04 0.00 0.00 61.00 63.14 1s9f s PRO 236 Cb -0.48 -1.95 -0.00 0.00 0.04 0.00 0.00 34.50 32.11 1s9f s PRO 236 CO 0.34 -1.18 1.11 0.42 0.04 0.00 0.00 177.00 177.73 1s9f s ILE 237 N -1.92 4.54 0.07 0.56 1.09 -1.26 -5.02 121.20 119.26 1s9f s ILE 237 Ca 0.72 1.85 0.06 0.00 -1.10 0.00 0.00 60.65 62.19 1s9f s ILE 237 Cb -0.25 -4.19 -0.03 0.00 -1.06 0.00 0.00 42.46 36.93 1s9f s ILE 237 CO 0.35 -0.12 -0.17 0.00 -0.10 0.00 0.00 174.94 174.89 1s9f s ARG 238 N 3.00 1.02 0.20 2.79 1.70 -1.26 -4.83 118.95 121.57 1s9f s ARG 238 Ca 0.49 -0.99 -0.32 0.00 -0.47 0.00 0.00 55.73 54.44 1s9f s ARG 238 Cb -0.18 -1.14 -0.12 0.00 -0.57 0.00 0.00 34.95 32.94 1s9f s ARG 238 CO 0.12 0.27 1.69 0.99 -1.08 0.00 0.00 175.30 177.29 1s9f s THR 239 N -1.09 2.15 -0.04 4.99 2.01 -1.26 -4.41 115.64 117.98 1s9f s THR 239 Ca 0.03 0.10 -0.21 0.00 0.31 0.00 0.00 61.69 61.92 1s9f s THR 239 Cb -0.09 -3.07 -0.05 0.00 0.01 0.00 0.00 72.50 69.30 1s9f s THR 239 CO 0.03 0.01 0.60 -0.60 -0.69 0.00 0.00 174.62 173.96 1s9f s ARG 240 N 1.18 4.35 -0.09 4.92 6.06 -1.26 -5.03 118.95 129.07 1s9f s ARG 240 Ca 0.74 0.71 0.02 0.00 -2.50 0.00 0.00 55.73 54.71 1s9f s ARG 240 Cb -0.49 -3.39 0.01 0.00 0.06 0.00 0.00 34.95 31.15 1s9f s ARG 240 CO 0.32 0.24 -0.17 0.08 -2.50 0.00 0.00 175.30 173.27 1s9f s VAL 241 N 0.24 1.55 0.12 7.11 1.01 -1.26 -4.97 120.40 124.21 1s9f s VAL 241 Ca 0.32 -0.70 -0.35 0.00 0.00 0.00 0.00 61.98 61.25 1s9f s VAL 241 Cb -0.17 -1.39 -0.15 0.00 0.00 0.00 0.00 36.38 34.67 1s9f s VAL 241 CO 0.16 0.45 1.51 0.54 0.00 0.00 0.00 175.10 177.76 1s9f n ARG 242 N 3.90 1.81 -0.01 2.72 3.00 -1.26 -4.88 116.66 121.94 1s9f n ARG 242 Ca -0.20 0.65 0.07 0.00 -0.01 0.00 0.00 57.85 58.36 1s9f n ARG 242 Cb 0.52 -2.38 -0.11 0.00 0.00 0.00 0.00 32.46 30.48 1s9f n ARG 242 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.63 179.26 1s9f n LYS 243 N 3.24 0.62 -3.58 5.56 5.02 -1.26 -4.99 118.16 122.76 1s9f n LYS 243 Ca 0.18 -0.12 -0.16 0.00 -2.02 0.00 0.00 58.31 56.19 1s9f n LYS 243 Cb 0.25 -1.33 -0.06 0.00 -0.02 0.00 0.00 35.03 33.87 1s9f n LYS 243 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 1s9f s SER 244 N -3.57 -0.49 -0.02 4.39 1.04 -1.26 -3.72 113.70 110.08 1s9f s SER 244 Ca -0.04 0.39 0.01 0.00 0.48 0.00 0.00 55.95 56.78 1s9f s SER 244 Cb 0.10 0.48 0.01 0.00 0.10 0.00 0.00 66.02 66.71 1s9f s SER 244 CO 0.61 -0.62 -0.01 -0.63 0.98 0.00 0.00 173.24 173.57 1s9f s ILE 245 N -1.70 0.17 0.29 -1.02 1.01 -0.38 -4.97 121.20 114.61 1s9f s ILE 245 Ca -0.09 0.00 -0.13 0.00 0.00 0.00 0.00 60.65 60.43 1s9f s ILE 245 Cb -0.01 -0.21 0.05 0.00 0.01 0.00 0.00 42.46 42.30 1s9f s ILE 245 CO 0.04 0.10 0.69 0.61 0.00 0.00 0.00 174.94 176.38 1s9f n GLY 246 N 3.61 1.07 3.42 6.18 0.00 -1.26 -0.52 105.19 117.69 1s9f n GLY 246 Ca -0.20 -1.19 -0.13 0.00 0.00 0.00 0.00 46.02 44.49 1s9f n GLY 246 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1s9f s ARG 247 N -2.07 0.60 0.01 1.61 6.06 -0.63 -4.87 118.95 119.66 1s9f s ARG 247 Ca 0.14 0.75 0.02 0.00 -2.50 0.00 0.00 55.73 54.14 1s9f s ARG 247 Cb -0.04 0.27 -0.01 0.00 0.06 0.00 0.00 34.95 35.24 1s9f s ARG 247 CO 0.09 -0.08 -0.08 -1.50 -2.50 0.00 0.00 175.30 171.23 1s9f s ILE 248 N 0.39 0.59 0.14 4.11 2.07 -1.26 -1.23 121.20 126.02 1s9f s ILE 248 Ca -0.01 -0.47 0.05 0.00 -1.41 0.00 0.00 60.65 58.81 1s9f s ILE 248 Cb -0.04 -0.53 -0.04 0.00 0.13 0.00 0.00 42.46 41.98 1s9f s ILE 248 CO -0.01 0.06 -0.11 0.68 -1.91 0.00 0.00 174.94 173.65 1s9f s VAL 249 N -0.40 1.21 -0.18 4.00 -7.23 -0.27 -4.96 120.40 112.57 1s9f s VAL 249 Ca 0.01 -2.00 -0.09 0.00 -1.81 0.00 0.00 61.98 58.09 1s9f s VAL 249 Cb -0.04 -1.78 -0.05 0.00 0.56 0.00 0.00 36.38 35.07 1s9f s VAL 249 CO -0.00 -0.68 0.13 -0.89 -0.31 0.00 0.00 175.10 173.35 1s9f s THR 250 N -3.09 5.43 0.32 5.32 2.01 -1.26 -0.94 115.64 123.43 1s9f s THR 250 Ca 0.15 0.19 -0.20 0.00 0.31 0.00 0.00 61.69 62.15 1s9f s THR 250 Cb 0.01 -3.45 -0.09 0.00 0.01 0.00 0.00 72.50 68.97 1s9f s THR 250 CO 0.01 0.48 0.83 -0.04 -0.69 0.00 0.00 174.62 175.21 1s9f s MET 251 N 0.03 4.25 0.39 4.92 -1.94 -0.69 -4.94 119.30 121.33 1s9f s MET 251 Ca 0.10 0.97 0.17 0.00 -1.71 0.00 0.00 55.69 55.22 1s9f s MET 251 Cb -0.11 -2.58 1.07 0.00 2.01 0.00 0.00 34.83 35.21 1s9f s MET 251 CO -0.01 0.21 1.79 0.87 -0.01 0.00 0.00 175.02 177.87 1s9f h LYS 252 N 2.71 0.42 -3.33 2.03 1.57 -1.86 -3.42 116.57 114.69 1s9f h LYS 252 Ca -0.48 -0.03 -0.11 0.00 -1.87 0.00 0.00 60.65 58.17 1s9f h LYS 252 Cb 1.18 -0.09 -0.18 0.00 0.08 0.00 0.00 32.23 33.22 1s9f h LYS 252 CO 0.64 0.28 -0.32 -0.98 -0.57 0.00 0.00 179.45 178.50 1s9f s ARG 253 N -5.50 0.71 0.63 3.15 1.70 -1.26 -4.52 118.95 113.85 1s9f s ARG 253 Ca -0.09 -0.45 -0.19 0.00 -0.47 0.00 0.00 55.73 54.53 1s9f s ARG 253 Cb 0.25 0.30 -0.02 0.00 -0.57 0.00 0.00 34.95 34.91 1s9f s ARG 253 CO 0.79 -0.21 1.30 -0.80 -1.08 0.00 0.00 175.30 175.31 1s9f s ASN 254 N -1.82 4.74 -0.05 -2.89 0.02 -1.26 -4.90 114.94 108.79 1s9f s ASN 254 Ca -0.08 2.64 -0.30 0.00 -1.02 0.00 0.00 52.86 54.10 1s9f s ASN 254 Cb -0.03 -2.62 0.11 0.00 0.02 0.00 0.00 41.25 38.73 1s9f s ASN 254 CO -0.01 -1.92 0.95 -0.55 0.02 0.00 0.00 177.10 175.59 1s9f s SER 255 N -1.32 -0.33 -0.05 -1.22 0.15 -0.49 -4.89 113.70 105.53 1s9f s SER 255 Ca 0.81 0.05 0.08 0.00 0.70 0.00 0.00 55.95 57.58 1s9f s SER 255 Cb -0.38 0.34 0.12 0.00 -1.71 0.00 0.00 66.02 64.39 1s9f s SER 255 CO 0.41 -0.53 1.03 -2.11 1.20 0.00 0.00 173.24 173.23 1s9f n ARG 256 N -0.11 0.72 -2.91 5.44 1.85 -1.26 -0.64 116.66 119.74 1s9f n ARG 256 Ca -0.08 -1.65 -0.43 0.00 -1.00 0.00 0.00 57.85 54.69 1s9f n ARG 256 Cb 0.61 -0.94 -0.05 0.00 -1.05 0.00 0.00 32.46 31.03 1s9f n ARG 256 CO 0.00 0.00 0.00 1.21 -0.01 0.00 0.00 177.63 178.83 1s9f s ASN 257 N -1.71 6.30 0.27 2.89 3.04 -1.26 -4.94 114.94 119.52 1s9f s ASN 257 Ca 0.13 -0.55 -0.01 0.00 0.04 0.00 0.00 52.86 52.47 1s9f s ASN 257 Cb 0.12 -2.40 0.60 0.00 -1.54 0.00 0.00 41.25 38.02 1s9f s ASN 257 CO 0.01 -1.17 1.66 0.25 -3.04 0.00 0.00 177.10 174.81 1s9f h LEU 258 N 10.71 -0.05 -1.39 3.21 7.12 -1.99 0.15 115.31 133.07 1s9f h LEU 258 Ca -0.27 0.18 -0.03 0.00 0.13 0.00 0.00 57.88 57.89 1s9f h LEU 258 Cb 1.08 0.26 -0.00 0.00 -0.53 0.00 0.00 40.66 41.46 1s9f h LEU 258 CO 1.07 -0.12 -0.15 -0.33 -0.13 0.00 0.00 178.44 178.78 1s9f h GLU 259 N 0.21 0.00 0.08 1.25 4.39 -2.01 -1.21 114.58 117.30 1s9f h GLU 259 Ca 0.49 0.00 -0.27 0.00 0.34 0.00 0.00 59.36 59.92 1s9f h GLU 259 Cb 0.93 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.57 1s9f h GLU 259 CO -0.62 0.15 -1.34 1.49 -1.16 0.00 0.00 179.01 177.53 1s9f h GLU 260 N 0.00 0.16 0.16 2.33 4.81 -1.17 -3.36 114.58 117.51 1s9f h GLU 260 Ca -0.00 -0.28 -0.29 0.00 -0.13 0.00 0.00 59.36 58.66 1s9f h GLU 260 Cb 0.60 0.10 0.01 0.00 0.63 0.00 0.00 28.75 30.10 1s9f h GLU 260 CO 0.02 1.04 -1.30 0.82 -0.73 0.00 0.00 179.01 178.86 1s9f h ILE 261 N 0.04 1.44 -0.82 2.32 2.04 -1.05 -3.38 117.51 118.10 1s9f h ILE 261 Ca -0.16 -2.95 0.20 0.00 1.00 0.00 0.00 64.86 62.95 1s9f h ILE 261 Cb 1.94 2.96 -0.14 0.00 -0.74 0.00 0.00 36.82 40.84 1s9f h ILE 261 CO 0.16 0.87 0.09 0.11 0.00 0.00 0.00 178.15 179.37 1s9f h LYS 262 N 0.10 0.13 -0.93 2.37 1.57 -1.37 -1.34 116.57 117.10 1s9f h LYS 262 Ca -0.17 -0.01 0.10 0.00 -1.87 0.00 0.00 60.65 58.71 1s9f h LYS 262 Cb 2.02 -0.03 -0.08 0.00 0.08 0.00 0.00 32.23 34.22 1s9f h LYS 262 CO 0.22 0.09 0.57 -1.35 -0.57 0.00 0.00 179.45 178.41 1s9f h PRO 263 N 0.14 0.90 -0.28 3.15 0.11 -1.78 0.28 132.00 134.53 1s9f h PRO 263 Ca 0.48 -0.05 -0.07 0.00 0.11 0.00 0.00 66.00 66.46 1s9f h PRO 263 Cb 0.90 -0.20 -0.01 0.00 0.11 0.00 0.00 31.00 31.80 1s9f h PRO 263 CO -0.68 0.59 -0.12 1.88 -0.21 0.00 0.00 178.00 179.46 1s9f h TYR 264 N 0.93 0.65 -0.51 0.65 0.05 -1.50 -1.90 116.97 115.33 1s9f h TYR 264 Ca 0.45 -0.16 -0.01 0.00 0.05 0.00 0.00 58.73 59.07 1s9f h TYR 264 Cb 0.41 -0.15 -0.02 0.00 1.01 0.00 0.00 36.73 37.97 1s9f h TYR 264 CO -0.03 0.80 0.29 1.25 -1.05 0.00 0.00 178.16 179.43 1s9f h LEU 265 N 0.31 0.62 -1.04 3.88 5.85 -0.87 -1.46 115.31 122.60 1s9f h LEU 265 Ca 0.06 -0.07 -0.07 0.00 0.84 0.00 0.00 57.88 58.64 1s9f h LEU 265 Cb 0.62 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 41.48 1s9f h LEU 265 CO 0.04 0.51 -0.06 -0.26 -0.34 0.00 0.00 178.44 178.33 1s9f h PHE 266 N 0.68 0.66 -0.79 1.25 0.04 -0.43 -0.95 116.94 117.39 1s9f h PHE 266 Ca 0.18 -0.09 -0.02 0.00 2.80 0.00 0.00 57.97 60.83 1s9f h PHE 266 Cb 0.02 -0.18 -0.04 0.00 2.20 0.00 0.00 35.95 37.95 1s9f h PHE 266 CO -0.02 0.67 0.40 -0.09 -0.60 0.00 0.00 178.31 178.67 1s9f h ARG 267 N 0.58 1.13 -0.47 1.51 2.43 -0.90 -1.16 114.38 117.50 1s9f h ARG 267 Ca 0.11 -0.15 -0.09 0.00 -0.81 0.00 0.00 59.98 59.04 1s9f h ARG 267 Cb 0.46 -0.21 -0.02 0.00 -0.42 0.00 0.00 29.97 29.78 1s9f h ARG 267 CO 0.02 0.86 -0.08 0.00 -1.51 0.00 0.00 179.97 179.27 1s9f h ALA 268 N 1.21 0.98 -0.40 2.80 0.00 -0.58 -2.06 119.26 121.21 1s9f h ALA 268 Ca 0.28 -0.31 -0.04 0.00 0.00 0.00 0.00 54.91 54.83 1s9f h ALA 268 Cb 0.09 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 1s9f h ALA 268 CO -0.04 0.61 0.08 0.82 0.00 0.00 0.00 179.25 180.72 1s9f h ILE 269 N 0.76 1.23 0.22 0.00 2.04 -0.64 -0.52 117.51 120.60 1s9f h ILE 269 Ca 0.13 -0.82 -0.01 0.00 1.00 0.00 0.00 64.86 65.16 1s9f h ILE 269 Cb 0.57 1.00 -0.00 0.00 -0.74 0.00 0.00 36.82 37.65 1s9f h ILE 269 CO 0.03 0.28 -0.13 -0.33 0.00 0.00 0.00 178.15 178.01 1s9f h GLU 270 N 0.51 -0.32 -1.00 2.37 4.39 -1.06 0.72 114.58 120.19 1s9f h GLU 270 Ca 0.12 0.02 0.03 0.00 0.34 0.00 0.00 59.36 59.87 1s9f h GLU 270 Cb 0.34 0.07 -0.05 0.00 -0.10 0.00 0.00 28.75 29.00 1s9f h GLU 270 CO 0.00 -0.21 0.66 0.93 -1.16 0.00 0.00 179.01 179.22 1s9f h GLU 271 N -0.33 1.26 -0.18 2.33 5.08 -1.34 -1.33 114.58 120.06 1s9f h GLU 271 Ca -0.02 -0.08 -0.01 0.00 -1.00 0.00 0.00 59.36 58.25 1s9f h GLU 271 Cb 0.27 -0.28 -0.01 0.00 0.50 0.00 0.00 28.75 29.23 1s9f h GLU 271 CO 0.03 0.83 0.09 0.77 -1.00 0.00 0.00 179.01 179.73 1s9f h SER 272 N 1.29 0.23 0.27 1.42 0.02 -0.67 -1.94 113.55 114.17 1s9f h SER 272 Ca 0.38 -0.11 -0.05 0.00 -0.84 0.00 0.00 61.79 61.17 1s9f h SER 272 Cb -0.06 -0.06 -0.01 0.00 0.14 0.00 0.00 62.40 62.42 1s9f h SER 272 CO -0.11 0.27 -0.25 1.88 -1.14 0.00 0.00 176.83 177.49 1s9f h TYR 273 N 0.16 0.00 -0.14 3.45 0.05 -0.49 -0.44 116.97 119.57 1s9f h TYR 273 Ca 0.06 0.00 -0.03 0.00 0.05 0.00 0.00 58.73 58.81 1s9f h TYR 273 Cb 0.10 0.00 -0.00 0.00 1.01 0.00 0.00 36.73 37.84 1s9f h TYR 273 CO -0.03 0.25 -0.02 -0.92 -1.05 0.00 0.00 178.16 176.39 1s9f h TYR 274 N 0.00 0.28 0.00 4.88 3.20 -0.97 -2.91 116.97 121.45 1s9f h TYR 274 Ca -0.00 -0.06 -0.00 0.00 3.14 0.00 0.00 58.73 61.81 1s9f h TYR 274 Cb 0.45 -0.07 -0.00 0.00 1.54 0.00 0.00 36.73 38.65 1s9f h TYR 274 CO 0.00 0.52 -0.01 0.87 -1.64 0.00 0.00 178.16 177.90 1s9f h LYS 275 N -0.04 0.00 -0.67 1.82 1.57 -0.87 -2.96 116.57 115.42 1s9f h LYS 275 Ca 0.04 0.00 -0.06 0.00 -1.87 0.00 0.00 60.65 58.76 1s9f h LYS 275 Cb 0.42 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.70 1s9f h LYS 275 CO 0.01 0.01 0.20 -0.07 -0.57 0.00 0.00 179.45 179.03 1s9f h LEU 276 N 0.00 0.97 -3.23 2.94 3.38 -0.88 -3.48 115.31 115.00 1s9f h LEU 276 Ca -0.00 -0.18 -0.18 0.00 0.09 0.00 0.00 57.88 57.61 1s9f h LEU 276 Cb 0.54 -0.25 0.01 0.00 0.09 0.00 0.00 40.66 41.05 1s9f h LEU 276 CO 0.00 0.91 -1.04 -0.67 0.09 0.00 0.00 178.44 177.73 1s9f n ASP 277 N -4.26 -5.60 0.00 -0.43 2.03 -1.12 -2.18 116.55 104.99 1s9f n ASP 277 Ca 0.05 0.11 0.00 0.00 0.52 0.00 0.00 54.79 55.48 1s9f n ASP 277 Cb 0.23 -1.47 0.00 0.00 -0.72 0.00 0.00 41.12 39.15 1s9f n ASP 277 CO 0.00 0.00 0.00 0.29 -1.92 0.00 0.00 177.20 175.57 1s9f n LYS 278 N 0.55 0.00 -2.33 -0.67 5.02 -1.26 -4.97 118.16 114.49 1s9f n LYS 278 Ca -0.04 0.00 -0.42 0.00 -2.02 0.00 0.00 58.31 55.83 1s9f n LYS 278 Cb 0.55 -0.74 -0.03 0.00 -0.02 0.00 0.00 35.03 34.79 1s9f n LYS 278 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 1s9f s ARG 279 N 0.00 4.43 -0.24 1.97 0.52 -0.93 -5.01 118.95 119.69 1s9f s ARG 279 Ca 0.00 1.91 -0.04 0.00 -0.52 0.00 0.00 55.73 57.07 1s9f s ARG 279 Cb 0.00 -3.26 -0.00 0.00 0.52 0.00 0.00 34.95 32.21 1s9f s ARG 279 CO 0.00 -0.22 -0.01 0.42 0.02 0.00 0.00 175.30 175.51 1s9f s ILE 280 N 0.46 3.49 0.28 1.52 1.01 -1.26 -4.89 121.20 121.82 1s9f s ILE 280 Ca 0.57 -0.59 -0.16 0.00 0.00 0.00 0.00 60.65 60.46 1s9f s ILE 280 Cb -0.33 -2.67 -0.09 0.00 0.01 0.00 0.00 42.46 39.38 1s9f s ILE 280 CO 0.34 0.31 0.72 -2.16 0.00 0.00 0.00 174.94 174.15 1s9f s PRO 281 N 1.47 4.08 0.00 2.79 0.04 -1.26 -0.85 135.00 141.26 1s9f s PRO 281 Ca 0.04 0.72 0.13 0.00 0.04 0.00 0.00 61.00 61.93 1s9f s PRO 281 Cb -0.15 -2.59 -0.13 0.00 0.04 0.00 0.00 34.50 31.67 1s9f s PRO 281 CO -0.02 0.24 0.57 1.63 0.04 0.00 0.00 177.00 179.47 1s9f n LYS 282 N 0.01 2.63 -4.82 4.56 5.02 -0.70 -0.54 118.16 124.32 1s9f n LYS 282 Ca 0.01 -0.08 -0.26 0.00 -2.02 0.00 0.00 58.31 55.97 1s9f n LYS 282 Cb 0.52 -1.12 -0.15 0.00 -0.02 0.00 0.00 35.03 34.26 1s9f n LYS 282 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1s9f s ALA 283 N -2.16 1.61 -0.01 7.82 0.00 -0.85 0.83 121.76 129.00 1s9f s ALA 283 Ca 0.06 -0.88 0.02 0.00 0.00 0.00 0.00 51.96 51.15 1s9f s ALA 283 Cb 0.10 -0.38 0.00 0.00 0.00 0.00 0.00 23.12 22.85 1s9f s ALA 283 CO 0.51 0.38 -0.06 -1.50 0.00 0.00 0.00 175.76 175.09 1s9f s ILE 284 N -0.56 0.55 -0.06 0.00 2.07 -0.46 -1.76 121.20 120.97 1s9f s ILE 284 Ca 0.07 -0.26 0.00 0.00 -1.41 0.00 0.00 60.65 59.06 1s9f s ILE 284 Cb -0.08 -0.49 0.02 0.00 0.13 0.00 0.00 42.46 42.05 1s9f s ILE 284 CO 0.00 0.17 -0.04 -1.00 -1.91 0.00 0.00 174.94 172.17 1s9f s HIS 285 N 0.10 0.86 -0.16 3.50 3.76 0.26 -0.33 115.29 123.28 1s9f s HIS 285 Ca -0.01 -0.28 -0.15 0.00 -0.15 0.00 0.00 55.06 54.47 1s9f s HIS 285 Cb -0.06 -0.81 -0.04 0.00 1.11 0.00 0.00 32.58 32.78 1s9f s HIS 285 CO -0.00 -0.29 0.34 0.08 -0.85 0.00 0.00 174.74 174.03 1s9f s VAL 286 N 1.37 5.27 -0.07 -0.90 1.01 0.61 -0.34 120.40 127.35 1s9f s VAL 286 Ca -0.04 0.65 0.05 0.00 0.00 0.00 0.00 61.98 62.64 1s9f s VAL 286 Cb -0.13 -3.68 -0.01 0.00 0.00 0.00 0.00 36.38 32.55 1s9f s VAL 286 CO -0.03 0.35 -0.21 -0.69 0.00 0.00 0.00 175.10 174.52 1s9f s VAL 287 N 0.67 2.39 -0.00 2.92 1.01 0.13 -1.69 120.40 125.82 1s9f s VAL 287 Ca 0.19 -0.94 0.04 0.00 0.00 0.00 0.00 61.98 61.26 1s9f s VAL 287 Cb -0.14 -1.90 -0.01 0.00 0.00 0.00 0.00 36.38 34.33 1s9f s VAL 287 CO 0.06 0.57 -0.13 0.00 0.00 0.00 0.00 175.10 175.59 1s9f s ALA 288 N -0.18 1.10 -0.22 5.51 0.00 0.13 -0.26 121.76 127.83 1s9f s ALA 288 Ca -0.02 -0.59 -0.05 0.00 0.00 0.00 0.00 51.96 51.30 1s9f s ALA 288 Cb -0.14 -0.27 -0.02 0.00 0.00 0.00 0.00 23.12 22.70 1s9f s ALA 288 CO 0.03 0.26 -0.01 0.08 0.00 0.00 0.00 175.76 176.13 1s9f s VAL 289 N -0.37 3.71 0.93 0.00 1.01 0.04 -0.46 120.40 125.27 1s9f s VAL 289 Ca 0.05 -0.38 -0.13 0.00 0.00 0.00 0.00 61.98 61.51 1s9f s VAL 289 Cb -0.05 -2.70 0.15 0.00 0.00 0.00 0.00 36.38 33.78 1s9f s VAL 289 CO -0.00 0.40 1.16 0.42 0.00 0.00 0.00 175.10 177.08 1s9f s THR 290 N 1.44 1.96 0.48 3.92 -4.23 0.26 -0.06 115.64 119.42 1s9f s THR 290 Ca 0.05 0.00 0.16 0.00 -1.18 0.00 0.00 61.69 60.72 1s9f s THR 290 Cb -0.15 -2.79 0.31 0.00 1.34 0.00 0.00 72.50 71.22 1s9f s THR 290 CO -0.01 0.00 2.06 1.05 -0.54 0.00 0.00 174.62 177.18 1s9f h GLU 291 N -1.56 0.19 -0.68 3.99 4.11 -1.32 0.10 114.58 119.42 1s9f h GLU 291 Ca -0.49 -0.01 0.00 0.00 0.07 0.00 0.00 59.36 58.93 1s9f h GLU 291 Cb 1.32 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 30.52 1s9f h GLU 291 CO 0.57 0.13 0.00 -0.40 0.07 0.00 0.00 179.01 179.38 1s9f n ASP 292 N -4.48 3.71 -1.09 3.06 3.85 -1.26 -4.91 116.55 115.45 1s9f n ASP 292 Ca 0.04 -2.47 -0.13 0.00 -0.71 0.00 0.00 54.79 51.52 1s9f n ASP 292 Cb 0.27 -0.56 -0.05 0.00 -1.35 0.00 0.00 41.12 39.44 1s9f n ASP 292 CO 0.00 0.00 0.00 0.18 -1.01 0.00 0.00 177.20 176.37 1s9f n LEU 293 N 0.51 -1.07 -4.88 -2.12 4.77 0.36 -5.02 117.00 109.54 1s9f n LEU 293 Ca 0.17 0.26 -0.30 0.00 -0.03 0.00 0.00 56.01 56.11 1s9f n LEU 293 Cb 0.76 -1.98 -0.04 0.00 -2.33 0.00 0.00 43.42 39.83 1s9f n LEU 293 CO 0.19 -0.58 0.35 -0.62 -1.33 0.00 0.00 177.39 175.39 1s9f s ASP 294 N -2.78 6.52 -0.17 -1.43 3.68 -1.26 -4.78 116.67 116.45 1s9f s ASP 294 Ca 0.00 0.99 -0.06 0.00 2.13 0.00 0.00 52.55 55.61 1s9f s ASP 294 Cb 0.00 -2.26 -0.04 0.00 -1.45 0.00 0.00 42.92 39.17 1s9f s ASP 294 CO 0.00 -0.29 0.04 -0.63 0.13 0.00 0.00 175.17 174.41 1s9f s ILE 295 N -2.21 4.55 0.02 4.11 1.01 -1.26 -0.57 121.20 126.85 1s9f s ILE 295 Ca 0.49 -0.12 0.03 0.00 0.00 0.00 0.00 60.65 61.05 1s9f s ILE 295 Cb -0.10 -3.04 -0.02 0.00 0.01 0.00 0.00 42.46 39.31 1s9f s ILE 295 CO 0.29 0.47 -0.10 -0.69 0.00 0.00 0.00 174.94 174.91 1s9f s VAL 296 N 0.33 0.79 0.07 2.92 1.01 0.39 -5.00 120.40 120.91 1s9f s VAL 296 Ca 0.01 -0.73 -0.11 0.00 0.00 0.00 0.00 61.98 61.15 1s9f s VAL 296 Cb -0.13 -0.72 0.01 0.00 0.00 0.00 0.00 36.38 35.54 1s9f s VAL 296 CO 0.01 -0.00 0.26 -0.94 0.00 0.00 0.00 175.10 174.43 1s9f s SER 297 N -0.82 -0.02 -0.08 3.32 1.04 -1.26 0.17 113.70 116.05 1s9f s SER 297 Ca -0.00 -0.41 -0.04 0.00 0.48 0.00 0.00 55.95 55.97 1s9f s SER 297 Cb -0.06 0.36 0.03 0.00 0.10 0.00 0.00 66.02 66.45 1s9f s SER 297 CO 0.00 -0.68 0.18 -0.13 0.98 0.00 0.00 173.24 173.59 1s9f s ARG 298 N -3.22 0.16 0.32 4.02 1.81 -0.68 -5.00 118.95 116.34 1s9f s ARG 298 Ca -0.00 0.37 0.00 0.00 -1.72 0.00 0.00 55.73 54.38 1s9f s ARG 298 Cb 0.02 -0.08 -0.01 0.00 -0.45 0.00 0.00 34.95 34.42 1s9f s ARG 298 CO -0.08 -0.12 0.37 0.20 -0.68 0.00 0.00 175.30 175.00 1s9f s GLY 299 N 0.86 1.68 -0.20 -3.53 0.00 -1.26 -0.29 107.32 104.59 1s9f s GLY 299 Ca -0.06 -1.67 -0.19 0.00 0.00 0.00 0.00 44.72 42.80 1s9f s GLY 299 CO -0.05 -1.17 0.55 -1.60 0.00 0.00 0.00 173.10 170.83 1s9f s ARG 300 N -3.38 0.64 -0.16 2.90 3.52 0.55 -4.98 118.95 118.05 1s9f s ARG 300 Ca 0.34 0.74 -0.05 0.00 -0.13 0.00 0.00 55.73 56.63 1s9f s ARG 300 Cb 0.01 0.31 -0.03 0.00 -1.56 0.00 0.00 34.95 33.69 1s9f s ARG 300 CO 0.21 -0.08 -0.00 0.99 -0.81 0.00 0.00 175.30 175.61 1s9f s THR 301 N 0.25 4.22 0.16 4.11 2.01 -1.26 -1.36 115.64 123.77 1s9f s THR 301 Ca -0.00 -0.24 0.04 0.00 0.31 0.00 0.00 61.69 61.79 1s9f s THR 301 Cb -0.04 -2.87 -0.04 0.00 0.01 0.00 0.00 72.50 69.56 1s9f s THR 301 CO 0.01 0.48 0.22 -0.36 -0.69 0.00 0.00 174.62 174.28 1s9f s PHE 302 N 0.36 3.34 -0.29 4.92 0.40 0.24 -4.99 117.98 121.96 1s9f s PHE 302 Ca -0.02 0.06 0.27 0.00 -0.60 0.00 0.00 56.93 56.64 1s9f s PHE 302 Cb -0.13 -1.60 1.08 0.00 0.51 0.00 0.00 43.02 42.88 1s9f s PHE 302 CO 0.02 0.52 1.81 -1.00 0.70 0.00 0.00 175.22 177.26 1s9f h PRO 303 N 2.23 0.00 -4.97 0.24 0.13 -2.00 -3.45 132.00 124.19 1s9f h PRO 303 Ca -0.48 0.00 -0.48 0.00 -0.87 0.00 0.00 66.00 64.17 1s9f h PRO 303 Cb 1.20 0.00 -0.14 0.00 0.13 0.00 0.00 31.00 32.19 1s9f h PRO 303 CO 0.66 0.00 -0.53 -1.01 -0.23 0.00 0.00 178.00 176.89 1s9f s HIS 304 N -3.42 1.71 0.71 1.56 3.76 -1.26 -5.12 115.29 113.24 1s9f s HIS 304 Ca 0.04 -1.36 -0.16 0.00 -0.15 0.00 0.00 55.06 53.43 1s9f s HIS 304 Cb 0.09 -0.98 0.02 0.00 1.11 0.00 0.00 32.58 32.82 1s9f s HIS 304 CO 0.47 -0.45 1.20 0.41 -0.85 0.00 0.00 174.74 175.52 1s9f n GLY 305 N -0.72 0.17 3.52 -2.22 0.00 -1.26 -4.56 105.19 100.11 1s9f n GLY 305 Ca -0.01 -0.29 -0.37 0.00 0.00 0.00 0.00 46.02 45.35 1s9f n GLY 305 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1s9f s ILE 306 N -1.70 4.81 0.58 -0.61 1.01 0.30 -4.96 121.20 120.62 1s9f s ILE 306 Ca 0.78 -0.00 -0.14 0.00 0.00 0.00 0.00 60.65 61.28 1s9f s ILE 306 Cb -0.35 -3.27 -0.05 0.00 0.01 0.00 0.00 42.46 38.81 1s9f s ILE 306 CO 0.46 0.30 1.02 -0.94 0.00 0.00 0.00 174.94 175.78 1s9f s SER 307 N 1.66 6.16 0.26 3.58 1.04 -1.26 -4.66 113.70 120.48 1s9f s SER 307 Ca 0.07 1.61 -0.02 0.00 0.48 0.00 0.00 55.95 58.09 1s9f s SER 307 Cb -0.15 -2.50 0.49 0.00 0.10 0.00 0.00 66.02 63.95 1s9f s SER 307 CO 0.07 -0.91 1.79 0.50 0.98 0.00 0.00 173.24 175.67 1s9f h LYS 308 N 0.31 0.71 -0.81 4.02 3.64 -1.99 0.91 116.57 123.36 1s9f h LYS 308 Ca -0.46 -0.04 -0.00 0.00 -1.27 0.00 0.00 60.65 58.88 1s9f h LYS 308 Cb 1.20 -0.16 -0.04 0.00 -0.41 0.00 0.00 32.23 32.82 1s9f h LYS 308 CO 0.60 0.47 0.49 0.93 -2.27 0.00 0.00 179.45 179.67 1s9f h GLU 309 N 0.73 1.10 -0.35 1.90 3.07 -2.00 -1.50 114.58 117.52 1s9f h GLU 309 Ca 0.45 -0.10 -0.12 0.00 -0.50 0.00 0.00 59.36 59.09 1s9f h GLU 309 Cb 0.54 -0.23 -0.01 0.00 -0.84 0.00 0.00 28.75 28.21 1s9f h GLU 309 CO -0.31 0.77 -0.26 1.15 -1.40 0.00 0.00 179.01 178.97 1s9f h THR 310 N 1.11 1.27 -0.50 1.13 2.02 -1.51 -2.71 112.91 113.73 1s9f h THR 310 Ca 0.29 -1.37 0.04 0.00 0.77 0.00 0.00 66.41 66.15 1s9f h THR 310 Cb -0.04 1.28 -0.04 0.00 -1.74 0.00 0.00 68.15 67.60 1s9f h THR 310 CO -0.05 0.45 0.25 0.00 0.37 0.00 0.00 175.52 176.54 1s9f h ALA 311 N 1.10 0.64 0.41 6.16 0.00 -0.19 0.37 119.26 127.76 1s9f h ALA 311 Ca 0.08 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 1s9f h ALA 311 Cb 0.76 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.47 1s9f h ALA 311 CO 0.06 -0.10 -0.30 1.88 0.00 0.00 0.00 179.25 180.79 1s9f h TYR 312 N 0.49 -0.81 -0.70 0.00 0.05 -1.12 -0.78 116.97 114.11 1s9f h TYR 312 Ca 0.22 -0.00 -0.05 0.00 0.05 0.00 0.00 58.73 58.95 1s9f h TYR 312 Cb 0.13 0.30 -0.03 0.00 1.01 0.00 0.00 36.73 38.14 1s9f h TYR 312 CO -0.10 -0.45 0.23 0.66 -1.05 0.00 0.00 178.16 177.44 1s9f h SER 313 N -0.71 1.02 -0.26 3.88 4.64 -1.22 -2.80 113.55 118.09 1s9f h SER 313 Ca -0.04 -0.20 -0.16 0.00 -0.47 0.00 0.00 61.79 60.92 1s9f h SER 313 Cb 0.61 -0.27 -0.01 0.00 -0.31 0.00 0.00 62.40 62.42 1s9f h SER 313 CO 0.01 0.95 -0.45 -0.08 -0.87 0.00 0.00 176.83 176.39 1s9f h GLU 314 N 1.03 0.83 -0.38 4.77 4.57 -0.91 -2.91 114.58 121.58 1s9f h GLU 314 Ca 0.23 -0.46 -0.00 0.00 -1.18 0.00 0.00 59.36 57.94 1s9f h GLU 314 Cb 0.29 0.03 -0.02 0.00 -0.16 0.00 0.00 28.75 28.89 1s9f h GLU 314 CO -0.01 1.10 0.22 0.66 -1.18 0.00 0.00 179.01 179.80 1s9f h SER 315 N 0.66 0.45 -0.37 1.04 4.64 -1.03 0.55 113.55 119.50 1s9f h SER 315 Ca 0.04 -0.02 -0.09 0.00 -0.47 0.00 0.00 61.79 61.25 1s9f h SER 315 Cb 1.02 -0.11 -0.01 0.00 -0.31 0.00 0.00 62.40 62.99 1s9f h SER 315 CO 0.10 0.35 -0.11 0.58 -0.87 0.00 0.00 176.83 176.89 1s9f h VAL 316 N 0.52 1.28 -0.68 0.95 2.07 -1.36 0.42 116.25 119.44 1s9f h VAL 316 Ca 0.14 -1.19 -0.07 0.00 0.82 0.00 0.00 66.70 66.39 1s9f h VAL 316 Cb -0.00 1.29 -0.03 0.00 -1.52 0.00 0.00 31.29 31.03 1s9f h VAL 316 CO -0.02 0.39 0.15 0.11 0.02 0.00 0.00 177.57 178.22 1s9f h LYS 317 N 0.52 1.09 -0.44 1.57 1.57 -1.12 0.25 116.57 120.00 1s9f h LYS 317 Ca 0.09 -0.27 -0.10 0.00 -1.87 0.00 0.00 60.65 58.51 1s9f h LYS 317 Cb 0.63 -0.14 -0.02 0.00 0.08 0.00 0.00 32.23 32.78 1s9f h LYS 317 CO 0.04 0.97 -0.13 -0.07 -0.57 0.00 0.00 179.45 179.70 1s9f h LEU 318 N 1.03 0.80 -0.38 2.94 3.38 -0.74 -1.36 115.31 120.99 1s9f h LEU 318 Ca 0.21 -0.25 -0.07 0.00 0.09 0.00 0.00 57.88 57.86 1s9f h LEU 318 Cb 0.38 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.90 1s9f h LEU 318 CO 0.00 0.94 -0.05 0.25 0.09 0.00 0.00 178.44 179.68 1s9f h LEU 319 N 0.73 0.70 -1.33 1.67 5.85 -0.48 -2.26 115.31 120.20 1s9f h LEU 319 Ca 0.12 -0.34 -0.01 0.00 0.84 0.00 0.00 57.88 58.49 1s9f h LEU 319 Cb 0.62 -0.19 -0.03 0.00 0.37 0.00 0.00 40.66 41.43 1s9f h LEU 319 CO 0.04 0.88 0.35 1.56 -0.34 0.00 0.00 178.44 180.93 1s9f h GLN 320 N 0.52 0.80 -0.60 1.25 4.20 -0.72 -1.00 115.11 119.56 1s9f h GLN 320 Ca 0.10 -0.07 -0.03 0.00 0.06 0.00 0.00 58.65 58.71 1s9f h GLN 320 Cb 0.55 -0.17 -0.03 0.00 0.30 0.00 0.00 27.48 28.13 1s9f h GLN 320 CO 0.03 0.57 0.25 -0.22 -0.67 0.00 0.00 178.83 178.79 1s9f h LYS 321 N 0.82 0.88 -0.49 1.46 3.64 -0.95 0.65 116.57 122.58 1s9f h LYS 321 Ca 0.21 -0.15 -0.02 0.00 -1.27 0.00 0.00 60.65 59.42 1s9f h LYS 321 Cb -0.02 -0.15 -0.02 0.00 -0.41 0.00 0.00 32.23 31.63 1s9f h LYS 321 CO -0.04 0.74 0.22 0.82 -2.27 0.00 0.00 179.45 178.92 1s9f h ILE 322 N 0.82 1.20 0.00 2.00 2.04 -0.77 -0.70 117.51 122.10 1s9f h ILE 322 Ca 0.20 -0.59 -0.06 0.00 1.00 0.00 0.00 64.86 65.41 1s9f h ILE 322 Cb 0.18 0.69 -0.01 0.00 -0.74 0.00 0.00 36.82 36.94 1s9f h ILE 322 CO -0.02 0.23 -0.26 -0.07 0.00 0.00 0.00 178.15 178.03 1s9f h LEU 323 N 0.65 0.00 0.00 1.44 3.38 -0.85 -1.37 115.31 118.55 1s9f h LEU 323 Ca 0.17 0.00 -0.21 0.00 0.09 0.00 0.00 57.88 57.93 1s9f h LEU 323 Cb 0.16 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.87 1s9f h LEU 323 CO -0.02 0.26 -1.11 -0.33 0.09 0.00 0.00 178.44 177.34 1s9f h GLU 324 N 0.00 0.00 -0.00 1.13 5.08 -0.42 -3.36 114.58 117.00 1s9f h GLU 324 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1s9f h GLU 324 Cb 0.65 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.90 1s9f h GLU 324 CO 0.03 0.74 -0.75 0.39 -1.00 0.00 0.00 179.01 178.42 1s9f n GLU 325 N -3.22 0.90 -3.93 2.33 1.02 -0.31 -4.89 120.64 112.54 1s9f n GLU 325 Ca -0.04 -0.30 -0.21 0.00 -0.02 0.00 0.00 57.16 56.59 1s9f n GLU 325 Cb 0.92 -1.41 -0.17 0.00 -0.02 0.00 0.00 31.44 30.77 1s9f n GLU 325 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 1s9f s ASP 326 N -2.64 1.16 0.00 1.62 3.68 -0.53 -5.04 116.67 114.92 1s9f s ASP 326 Ca 0.10 -0.09 0.28 0.00 2.13 0.00 0.00 52.55 54.98 1s9f s ASP 326 Cb 0.15 -0.40 1.17 0.00 -1.45 0.00 0.00 42.92 42.39 1s9f s ASP 326 CO 0.70 -0.13 1.82 -0.62 0.13 0.00 0.00 175.17 177.07 1s9f n GLU 327 N 4.59 0.86 -1.68 4.34 1.02 -1.26 -4.51 120.64 124.00 1s9f n GLU 327 Ca -0.17 -0.35 -0.31 0.00 -0.02 0.00 0.00 57.16 56.31 1s9f n GLU 327 Cb 0.50 -1.49 0.04 0.00 -0.02 0.00 0.00 31.44 30.47 1s9f n GLU 327 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 1s9f s ARG 328 N -2.38 3.12 0.51 3.49 0.52 -1.26 -5.04 118.95 117.91 1s9f s ARG 328 Ca 0.31 0.93 -0.13 0.00 -0.52 0.00 0.00 55.73 56.32 1s9f s ARG 328 Cb 0.20 -2.01 -0.06 0.00 0.52 0.00 0.00 34.95 33.59 1s9f s ARG 328 CO 0.46 -0.95 0.93 0.15 0.02 0.00 0.00 175.30 175.90 1s9f s LYS 329 N -4.98 3.80 -0.15 3.54 1.02 -1.26 -4.88 119.74 116.82 1s9f s LYS 329 Ca 0.58 0.73 -0.08 0.00 0.02 0.00 0.00 55.97 57.22 1s9f s LYS 329 Cb -0.13 -2.21 -0.04 0.00 -0.52 0.00 0.00 37.83 34.93 1s9f s LYS 329 CO 0.53 -0.28 0.12 0.42 -0.92 0.00 0.00 175.35 175.22 1s9f s ILE 330 N -2.70 5.32 -0.22 2.17 1.01 0.19 -0.89 121.20 126.08 1s9f s ILE 330 Ca 0.55 0.15 0.01 0.00 0.00 0.00 0.00 60.65 61.36 1s9f s ILE 330 Cb -0.10 -3.36 -0.14 0.00 0.01 0.00 0.00 42.46 38.87 1s9f s ILE 330 CO 0.38 0.54 -0.20 -1.14 0.00 0.00 0.00 174.94 174.51 1s9f n ARG 331 N 2.65 0.55 -4.35 2.79 0.63 0.92 -1.40 116.66 118.45 1s9f n ARG 331 Ca -0.18 0.13 -0.19 0.00 -0.92 0.00 0.00 57.85 56.69 1s9f n ARG 331 Cb 0.54 -1.44 -0.13 0.00 0.45 0.00 0.00 32.46 31.87 1s9f n ARG 331 CO 0.00 0.00 0.00 1.03 -2.51 0.00 0.00 177.63 176.15 1s9f s ARG 332 N -2.45 0.89 -0.01 -0.14 0.52 -0.75 -1.71 118.95 115.31 1s9f s ARG 332 Ca -0.30 -0.68 0.01 0.00 -0.52 0.00 0.00 55.73 54.24 1s9f s ARG 332 Cb 0.08 -0.88 -0.00 0.00 0.52 0.00 0.00 34.95 34.67 1s9f s ARG 332 CO 0.51 0.22 -0.04 -1.50 0.02 0.00 0.00 175.30 174.51 1s9f s ILE 333 N -0.76 0.29 0.32 1.52 1.10 -0.11 -0.78 121.20 122.78 1s9f s ILE 333 Ca 0.01 -0.15 -0.11 0.00 -0.51 0.00 0.00 60.65 59.90 1s9f s ILE 333 Cb -0.07 -0.26 0.04 0.00 0.15 0.00 0.00 42.46 42.32 1s9f s ILE 333 CO 0.01 0.09 0.61 0.61 -2.11 0.00 0.00 174.94 174.15 1s9f n GLY 334 N 3.07 1.33 3.08 1.50 0.00 0.64 -1.11 105.19 113.70 1s9f n GLY 334 Ca -0.14 -1.27 -0.09 0.00 0.00 0.00 0.00 46.02 44.53 1s9f n GLY 334 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1s9f s VAL 335 N -2.34 0.15 -0.05 1.61 0.11 -0.36 -0.69 120.40 118.82 1s9f s VAL 335 Ca 0.15 -1.21 -0.03 0.00 -2.93 0.00 0.00 61.98 57.96 1s9f s VAL 335 Cb -0.04 -0.90 0.03 0.00 -1.53 0.00 0.00 36.38 33.94 1s9f s VAL 335 CO 0.11 -0.67 0.12 -0.60 -3.33 0.00 0.00 175.10 170.73 1s9f s ARG 336 N -2.67 0.09 -0.04 1.54 3.52 0.54 -1.60 118.95 120.32 1s9f s ARG 336 Ca -0.05 0.28 0.03 0.00 -0.13 0.00 0.00 55.73 55.87 1s9f s ARG 336 Cb -0.01 -0.11 -0.03 0.00 -1.56 0.00 0.00 34.95 33.24 1s9f s ARG 336 CO -0.05 -0.12 -0.11 -0.06 -0.81 0.00 0.00 175.30 174.15 1s9f s PHE 337 N 0.82 2.80 0.07 5.12 0.08 0.32 -0.57 117.98 126.62 1s9f s PHE 337 Ca -0.06 -0.09 -0.01 0.00 0.12 0.00 0.00 56.93 56.89 1s9f s PHE 337 Cb -0.08 -1.64 0.00 0.00 -0.57 0.00 0.00 43.02 40.73 1s9f s PHE 337 CO -0.04 0.26 0.11 -1.13 -0.10 0.00 0.00 175.22 174.32 1s9f n SER 338 N 2.13 -0.30 -3.36 1.36 3.41 -0.72 -1.24 113.62 114.90 1s9f n SER 338 Ca -0.17 -1.37 -0.17 0.00 -0.26 0.00 0.00 58.87 56.89 1s9f n SER 338 Cb 0.52 0.54 0.05 0.00 -0.26 0.00 0.00 64.21 65.06 1s9f n SER 338 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1s9f n LYS 339 N -0.11 -1.73 -2.44 4.33 5.02 -1.24 -2.00 118.16 119.99 1s9f n LYS 339 Ca -0.00 0.87 -0.40 0.00 -2.02 0.00 0.00 58.31 56.76 1s9f n LYS 339 Cb 0.12 -5.15 -0.04 0.00 -0.02 0.00 0.00 35.03 29.94 1s9f n LYS 339 CO 0.00 0.00 0.00 -0.06 -0.52 0.00 0.00 177.40 176.82 1s9f s PHE 340 N -3.31 3.48 -2.00 2.13 0.08 -1.26 -1.73 117.98 115.37 1s9f s PHE 340 Ca 0.35 1.66 0.13 0.00 0.12 0.00 0.00 56.93 59.19 1s9f s PHE 340 Cb -0.08 -3.32 0.77 0.00 -0.57 0.00 0.00 43.02 39.82 1s9f s PHE 340 CO 0.79 -0.71 1.19 -0.89 -0.10 0.00 0.00 175.22 175.49