#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3kyd s ARG 5 N 0.00 3.36 0.00 1.43 3.52 -1.26 -4.41 118.95 121.59 3kyd s ARG 5 Ca 0.00 -0.49 0.00 0.00 -0.13 0.00 0.00 55.73 55.11 3kyd s ARG 5 Cb 0.00 -2.99 0.00 0.00 -1.56 0.00 0.00 34.95 30.40 3kyd s ARG 5 CO 0.00 0.59 0.00 0.41 -0.81 0.00 0.00 175.30 175.49 3kyd n GLY 6 N 0.22 0.69 3.20 8.12 0.00 -1.26 -5.14 105.19 111.03 3kyd n GLY 6 Ca -0.06 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.86 3kyd n GLY 6 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 3kyd s LEU 7 N 0.00 1.22 0.47 0.99 0.05 -1.26 -5.15 118.68 115.01 3kyd s LEU 7 Ca 0.00 -0.33 -0.19 0.00 0.05 0.00 0.00 54.13 53.65 3kyd s LEU 7 Cb 0.00 1.08 -0.14 0.00 -2.05 0.00 0.00 46.19 45.08 3kyd s LEU 7 CO 0.00 -0.59 0.06 -2.65 -0.55 0.00 0.00 176.35 172.62 3kyd n PRO 8 N 0.60 0.10 -0.22 1.48 -0.02 -1.26 -4.33 135.00 131.35 3kyd n PRO 8 Ca -0.18 0.04 0.01 0.00 -2.02 0.00 0.00 63.50 61.34 3kyd n PRO 8 Cb 0.59 -1.11 0.09 0.00 -0.02 0.00 0.00 33.50 33.05 3kyd n PRO 8 CO 0.00 0.00 0.00 -0.09 1.98 0.00 0.00 175.50 177.39 3kyd h ARG 9 N 0.17 0.03 -0.82 -0.52 2.43 -2.01 -1.28 114.38 112.38 3kyd h ARG 9 Ca -0.40 -0.00 0.01 0.00 -0.81 0.00 0.00 59.98 58.78 3kyd h ARG 9 Cb 1.44 -0.01 -0.04 0.00 -0.42 0.00 0.00 29.97 30.94 3kyd h ARG 9 CO 0.45 0.02 0.54 1.49 -1.51 0.00 0.00 179.97 180.96 3kyd h GLU 10 N 0.03 1.07 -0.22 0.20 4.81 -1.99 -1.45 114.58 117.04 3kyd h GLU 10 Ca 0.33 -0.06 -0.10 0.00 -0.13 0.00 0.00 59.36 59.40 3kyd h GLU 10 Cb 0.53 -0.24 -0.00 0.00 0.63 0.00 0.00 28.75 29.66 3kyd h GLU 10 CO -0.64 0.71 -0.25 1.25 -0.73 0.00 0.00 179.01 179.35 3kyd h LEU 11 N 1.11 0.60 -0.64 1.64 6.46 -1.60 -1.52 115.31 121.36 3kyd h LEU 11 Ca 0.30 -0.49 -0.04 0.00 -0.12 0.00 0.00 57.88 57.54 3kyd h LEU 11 Cb -0.12 -0.17 -0.03 0.00 -0.73 0.00 0.00 40.66 39.62 3kyd h LEU 11 CO -0.07 0.97 0.26 0.00 -0.62 0.00 0.00 178.44 178.98 3kyd h ALA 12 N 0.65 0.83 -0.03 1.25 0.00 -1.13 0.91 119.26 121.75 3kyd h ALA 12 Ca 0.03 -0.17 -0.12 0.00 0.00 0.00 0.00 54.91 54.65 3kyd h ALA 12 Cb 0.81 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.33 3kyd h ALA 12 CO 0.06 0.45 -0.52 0.93 0.00 0.00 0.00 179.25 180.16 3kyd h GLU 13 N 0.90 0.07 -0.29 0.00 5.08 -1.28 0.12 114.58 119.18 3kyd h GLU 13 Ca 0.21 -0.04 -0.03 0.00 -1.00 0.00 0.00 59.36 58.50 3kyd h GLU 13 Cb 0.20 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.44 3kyd h GLU 13 CO -0.02 0.58 0.07 0.00 -1.00 0.00 0.00 179.01 178.64 3kyd h ALA 14 N 1.41 0.38 -0.25 3.43 0.00 -0.79 -2.29 119.26 121.16 3kyd h ALA 14 Ca -0.00 -0.17 -0.19 0.00 0.00 0.00 0.00 54.91 54.54 3kyd h ALA 14 Cb 0.95 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.63 3kyd h ALA 14 CO 0.07 0.05 -0.59 0.28 0.00 0.00 0.00 179.25 179.06 3kyd h VAL 15 N 0.30 1.28 -0.03 0.00 2.07 -0.55 -1.08 116.25 118.23 3kyd h VAL 15 Ca 0.09 -1.79 -0.13 0.00 0.82 0.00 0.00 66.70 65.69 3kyd h VAL 15 Cb 0.30 1.72 -0.01 0.00 -1.52 0.00 0.00 31.29 31.77 3kyd h VAL 15 CO 0.00 0.58 -0.56 0.00 0.02 0.00 0.00 177.57 177.61 3kyd h ALA 16 N 0.71 1.00 0.00 1.67 0.00 -0.81 -3.31 119.26 118.52 3kyd h ALA 16 Ca 0.00 -0.51 -0.13 0.00 0.00 0.00 0.00 54.91 54.27 3kyd h ALA 16 Cb 1.20 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.88 3kyd h ALA 16 CO 0.13 0.70 -1.79 0.41 0.00 0.00 0.00 179.25 178.69 3kyd n GLY 17 N 0.12 -1.12 3.67 0.00 0.00 -0.86 -4.43 105.19 102.56 3kyd n GLY 17 Ca -0.02 -0.33 -0.29 0.00 0.00 0.00 0.00 46.02 45.38 3kyd n GLY 17 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3kyd s GLY 18 N -4.79 1.56 -0.05 -0.02 0.00 -0.41 -4.99 107.32 98.62 3kyd s GLY 18 Ca -0.06 -0.45 0.02 0.00 0.00 0.00 0.00 44.72 44.23 3kyd s GLY 18 CO 0.85 0.20 -0.09 -1.60 0.00 0.00 0.00 173.10 172.45 3kyd s ARG 19 N -5.02 1.27 0.12 2.90 3.52 -1.26 -4.23 118.95 116.25 3kyd s ARG 19 Ca 0.66 -0.31 0.08 0.00 -0.13 0.00 0.00 55.73 56.03 3kyd s ARG 19 Cb -0.18 -1.12 -0.04 0.00 -1.56 0.00 0.00 34.95 32.06 3kyd s ARG 19 CO 0.57 0.03 -0.19 0.14 -0.81 0.00 0.00 175.30 175.04 3kyd s VAL 20 N 0.59 1.67 -0.11 7.11 -7.23 -0.84 -0.79 120.40 120.80 3kyd s VAL 20 Ca -0.11 -1.67 0.02 0.00 -1.81 0.00 0.00 61.98 58.42 3kyd s VAL 20 Cb -0.13 -1.62 -0.01 0.00 0.56 0.00 0.00 36.38 35.18 3kyd s VAL 20 CO 0.02 -0.19 -0.18 -0.22 -0.31 0.00 0.00 175.10 174.22 3kyd s LEU 21 N -2.20 2.43 -0.20 1.32 2.96 -0.74 -1.09 118.68 121.16 3kyd s LEU 21 Ca 0.09 -0.43 -0.02 0.00 -0.22 0.00 0.00 54.13 53.55 3kyd s LEU 21 Cb -0.08 -1.52 -0.00 0.00 0.50 0.00 0.00 46.19 45.09 3kyd s LEU 21 CO 0.05 0.17 -0.09 -0.69 -1.32 0.00 0.00 176.35 174.47 3kyd s VAL 22 N 0.32 3.04 -0.34 1.68 1.01 0.07 0.40 120.40 126.57 3kyd s VAL 22 Ca -0.14 -0.61 -0.10 0.00 0.00 0.00 0.00 61.98 61.13 3kyd s VAL 22 Cb -0.17 -2.35 0.02 0.00 0.00 0.00 0.00 36.38 33.87 3kyd s VAL 22 CO 0.07 0.46 0.16 -0.69 0.00 0.00 0.00 175.10 175.11 3kyd s VAL 23 N 1.30 4.44 0.00 2.92 1.01 -0.34 -2.00 120.40 127.73 3kyd s VAL 23 Ca 0.04 -0.72 0.00 0.00 0.00 0.00 0.00 61.98 61.29 3kyd s VAL 23 Cb -0.14 -3.39 0.00 0.00 0.00 0.00 0.00 36.38 32.85 3kyd s VAL 23 CO -0.04 -0.09 0.00 0.61 0.00 0.00 0.00 175.10 175.57 3kyd n GLY 24 N 4.96 2.18 2.28 4.51 0.00 0.54 -0.60 105.19 119.07 3kyd n GLY 24 Ca -0.13 -1.41 -0.14 0.00 0.00 0.00 0.00 46.02 44.34 3kyd n GLY 24 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3kyd n ALA 25 N 2.31 4.06 -1.38 4.61 0.00 -1.26 -4.27 120.51 124.58 3kyd n ALA 25 Ca 0.00 -3.38 0.00 0.00 0.00 0.00 0.00 53.44 50.06 3kyd n ALA 25 Cb 0.00 -0.53 0.00 0.00 0.00 0.00 0.00 19.45 18.92 3kyd n ALA 25 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3kyd n GLY 26 N -0.66 1.24 0.40 0.00 0.00 -1.26 -4.37 105.19 100.54 3kyd n GLY 26 Ca 0.29 -1.42 -0.18 0.00 0.00 0.00 0.00 46.02 44.72 3kyd n GLY 26 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 3kyd h GLY 27 N 0.00 -1.03 0.96 -0.02 0.00 -1.94 -0.45 103.07 100.60 3kyd h GLY 27 Ca 0.00 0.38 -0.00 0.00 0.00 0.00 0.00 47.33 47.71 3kyd h GLY 27 CO 0.00 -0.37 0.12 -2.22 0.00 0.00 0.00 176.54 174.07 3kyd h ILE 28 N -1.02 1.10 0.08 2.60 2.04 -1.91 -2.73 117.51 117.67 3kyd h ILE 28 Ca -0.10 -0.25 0.02 0.00 1.00 0.00 0.00 64.86 65.53 3kyd h ILE 28 Cb 0.76 0.89 -0.04 0.00 -0.74 0.00 0.00 36.82 37.70 3kyd h ILE 28 CO 0.17 0.09 -0.25 1.23 0.00 0.00 0.00 178.15 179.39 3kyd h GLY 29 N 0.24 -0.43 0.82 5.37 0.00 -1.73 0.21 103.07 107.55 3kyd h GLY 29 Ca 0.07 0.29 0.05 0.00 0.00 0.00 0.00 47.33 47.74 3kyd h GLY 29 CO -0.01 -0.21 0.61 0.00 0.00 0.00 0.00 176.54 176.93 3kyd h GLU 31 N 1.16 0.47 -0.22 0.00 4.39 -1.18 -3.13 114.58 116.07 3kyd h GLU 31 Ca 0.39 -0.19 0.04 0.00 0.34 0.00 0.00 59.36 59.95 3kyd h GLU 31 Cb 0.07 -0.02 -0.04 0.00 -0.10 0.00 0.00 28.75 28.66 3kyd h GLU 31 CO -0.14 0.71 -0.02 1.25 -1.16 0.00 0.00 179.01 179.64 3kyd h LEU 32 N 0.20 -0.14 -0.36 1.33 6.46 0.18 -1.87 115.31 121.11 3kyd h LEU 32 Ca 0.06 0.06 0.08 0.00 -0.12 0.00 0.00 57.88 57.95 3kyd h LEU 32 Cb 0.54 0.11 -0.08 0.00 -0.73 0.00 0.00 40.66 40.50 3kyd h LEU 32 CO 0.03 -0.04 -0.17 0.25 -0.62 0.00 0.00 178.44 177.88 3kyd h LEU 33 N 0.04 -0.59 -0.34 2.25 5.85 -0.85 0.82 115.31 122.49 3kyd h LEU 33 Ca 0.10 0.14 0.05 0.00 0.84 0.00 0.00 57.88 59.01 3kyd h LEU 33 Cb 0.14 0.32 -0.04 0.00 0.37 0.00 0.00 40.66 41.45 3kyd h LEU 33 CO -0.20 -0.21 0.08 0.50 -0.34 0.00 0.00 178.44 178.28 3kyd h LYS 34 N -0.11 0.20 -0.89 1.25 3.64 -1.46 -1.93 116.57 117.28 3kyd h LYS 34 Ca 0.18 -0.01 0.01 0.00 -1.27 0.00 0.00 60.65 59.56 3kyd h LYS 34 Cb 0.39 -0.05 -0.04 0.00 -0.41 0.00 0.00 32.23 32.12 3kyd h LYS 34 CO -0.43 0.13 0.59 -0.91 -2.27 0.00 0.00 179.45 176.56 3kyd h ASN 35 N 0.21 1.01 -0.14 4.20 2.35 -0.34 -1.22 115.58 121.64 3kyd h ASN 35 Ca 0.16 -0.02 -0.02 0.00 -0.55 0.00 0.00 56.30 55.87 3kyd h ASN 35 Cb 0.17 -0.25 -0.01 0.00 0.05 0.00 0.00 38.32 38.28 3kyd h ASN 35 CO -0.20 0.73 0.02 -0.07 -1.65 0.00 0.00 177.43 176.26 3kyd h LEU 36 N 1.19 0.22 -0.98 1.61 3.38 -0.52 -2.32 115.31 117.89 3kyd h LEU 36 Ca 0.33 -0.26 -0.09 0.00 0.09 0.00 0.00 57.88 57.95 3kyd h LEU 36 Cb -0.12 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 40.55 3kyd h LEU 36 CO -0.07 0.42 -0.26 -0.37 0.09 0.00 0.00 178.44 178.24 3kyd h VAL 37 N 0.01 1.26 0.00 1.22 -1.51 -1.07 -1.06 116.25 115.10 3kyd h VAL 37 Ca 0.04 -1.26 0.00 0.00 -1.23 0.00 0.00 66.70 64.25 3kyd h VAL 37 Cb 0.30 1.39 0.00 0.00 -2.13 0.00 0.00 31.29 30.84 3kyd h VAL 37 CO 0.00 0.40 0.00 -0.07 -1.23 0.00 0.00 177.57 176.67 3kyd h LEU 38 N 0.37 0.00 0.00 4.19 3.38 -1.23 -3.06 115.31 118.96 3kyd h LEU 38 Ca 0.05 0.00 -0.16 0.00 0.09 0.00 0.00 57.88 57.87 3kyd h LEU 38 Cb 0.66 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.39 3kyd h LEU 38 CO 0.05 0.00 -1.23 0.74 0.09 0.00 0.00 178.44 178.09 3kyd h THR 39 N 0.00 0.61 0.00 0.22 2.02 -0.82 -3.49 112.91 111.45 3kyd h THR 39 Ca 0.00 -2.09 0.00 0.00 0.77 0.00 0.00 66.41 65.09 3kyd h THR 39 Cb 0.72 2.14 0.00 0.00 -1.74 0.00 0.00 68.15 69.26 3kyd h THR 39 CO 0.00 0.35 0.00 0.61 0.37 0.00 0.00 175.52 176.85 3kyd n GLY 40 N 1.36 1.33 3.65 2.16 0.00 -0.74 -4.79 105.19 108.17 3kyd n GLY 40 Ca -0.07 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.52 3kyd n GLY 40 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3kyd s PHE 41 N -1.86 2.50 -0.78 1.61 0.40 -0.48 -3.76 117.98 115.60 3kyd s PHE 41 Ca 0.00 0.73 0.09 0.00 -0.60 0.00 0.00 56.93 57.16 3kyd s PHE 41 Cb 0.00 -3.77 -0.02 0.00 0.51 0.00 0.00 43.02 39.75 3kyd s PHE 41 CO 0.00 -2.35 0.57 -1.13 0.70 0.00 0.00 175.22 173.01 3kyd n SER 42 N 7.32 1.05 -3.78 1.36 3.41 -1.26 -4.20 113.62 117.52 3kyd n SER 42 Ca 0.16 -1.03 -0.30 0.00 -0.26 0.00 0.00 58.87 57.44 3kyd n SER 42 Cb 0.45 0.55 -0.14 0.00 -0.26 0.00 0.00 64.21 64.80 3kyd n SER 42 CO 0.00 0.00 0.00 -1.00 -0.16 0.00 0.00 175.04 173.88 3kyd s HIS 43 N -1.37 2.19 -0.10 7.33 3.76 -1.26 -0.23 115.29 125.62 3kyd s HIS 43 Ca 0.07 -2.29 0.03 0.00 -0.15 0.00 0.00 55.06 52.71 3kyd s HIS 43 Cb 0.07 -2.02 0.01 0.00 1.11 0.00 0.00 32.58 31.75 3kyd s HIS 43 CO 0.25 -0.84 -0.17 0.42 -0.85 0.00 0.00 174.74 173.55 3kyd s ILE 44 N 0.87 1.60 -0.15 0.60 1.01 -0.80 -1.98 121.20 122.34 3kyd s ILE 44 Ca 0.14 -0.73 -0.07 0.00 0.00 0.00 0.00 60.65 59.98 3kyd s ILE 44 Cb -0.21 -1.43 -0.04 0.00 0.01 0.00 0.00 42.46 40.79 3kyd s ILE 44 CO -0.10 0.46 0.11 -1.81 0.00 0.00 0.00 174.94 173.59 3kyd s ASP 45 N 0.70 6.05 -0.08 3.58 1.11 -0.25 -0.81 116.67 126.97 3kyd s ASP 45 Ca -0.13 0.28 -0.00 0.00 0.18 0.00 0.00 52.55 52.89 3kyd s ASP 45 Cb -0.16 -1.99 0.02 0.00 1.07 0.00 0.00 42.92 41.87 3kyd s ASP 45 CO 0.03 0.29 -0.04 -0.22 1.18 0.00 0.00 175.17 176.41 3kyd s LEU 46 N -0.32 0.98 -0.04 1.23 2.96 0.37 -0.75 118.68 123.11 3kyd s LEU 46 Ca 0.10 -0.17 0.06 0.00 -0.22 0.00 0.00 54.13 53.90 3kyd s LEU 46 Cb -0.12 -0.59 -0.01 0.00 0.50 0.00 0.00 46.19 45.97 3kyd s LEU 46 CO 0.01 -0.13 -0.23 -0.51 -1.32 0.00 0.00 176.35 174.18 3kyd s ILE 47 N 1.61 1.83 -0.27 6.68 2.07 -0.85 -0.63 121.20 131.64 3kyd s ILE 47 Ca 0.01 -0.96 -0.19 0.00 -1.41 0.00 0.00 60.65 58.10 3kyd s ILE 47 Cb -0.13 -1.54 0.08 0.00 0.13 0.00 0.00 42.46 41.00 3kyd s ILE 47 CO -0.05 0.51 0.69 -0.62 -1.91 0.00 0.00 174.94 173.57 3kyd s ASP 48 N -0.28 -0.86 0.40 4.50 2.15 -0.78 -0.34 116.67 121.47 3kyd s ASP 48 Ca 0.02 1.47 0.22 0.00 0.43 0.00 0.00 52.55 54.69 3kyd s ASP 48 Cb -0.11 1.39 0.28 0.00 -0.30 0.00 0.00 42.92 44.18 3kyd s ASP 48 CO 0.01 -0.24 1.52 0.17 -0.17 0.00 0.00 175.17 176.47 3kyd h LEU 49 N 6.26 0.00-10.26 -1.34 8.10 -1.62 -2.66 115.31 113.78 3kyd h LEU 49 Ca -0.30 0.00 -0.48 0.00 0.11 0.00 0.00 57.88 57.21 3kyd h LEU 49 Cb 1.20 0.00 0.02 0.00 -0.44 0.00 0.00 40.66 41.44 3kyd h LEU 49 CO 0.13 0.03 -0.10 -0.62 -4.11 0.00 0.00 178.44 173.77 3kyd s ASP 50 N -6.11 6.25 0.44 0.17 3.68 -1.26 -4.67 116.67 115.17 3kyd s ASP 50 Ca 0.06 0.58 0.08 0.00 2.13 0.00 0.00 52.55 55.39 3kyd s ASP 50 Cb 0.06 -2.06 0.00 0.00 -1.45 0.00 0.00 42.92 39.47 3kyd s ASP 50 CO 0.69 -0.40 0.49 0.42 0.13 0.00 0.00 175.17 176.50 3kyd s THR 51 N -2.46 2.68 -0.06 1.71 -4.23 -1.26 -2.35 115.64 109.67 3kyd s THR 51 Ca 0.43 -1.19 -0.17 0.00 -1.18 0.00 0.00 61.69 59.57 3kyd s THR 51 Cb -0.10 -2.87 -0.05 0.00 1.34 0.00 0.00 72.50 70.82 3kyd s THR 51 CO 0.39 0.00 0.47 -0.63 -0.54 0.00 0.00 174.62 174.31 3kyd s ILE 52 N -2.46 5.08 -0.18 2.99 1.01 0.37 -4.58 121.20 123.42 3kyd s ILE 52 Ca 0.51 0.97 -0.05 0.00 0.00 0.00 0.00 60.65 62.08 3kyd s ILE 52 Cb -0.06 -3.80 0.07 0.00 0.01 0.00 0.00 42.46 38.68 3kyd s ILE 52 CO 0.30 0.43 0.13 -0.62 0.00 0.00 0.00 174.94 175.19 3kyd s ASP 53 N -0.10 2.01 0.05 3.58 -1.08 -1.26 -0.06 116.67 119.82 3kyd s ASP 53 Ca 0.26 -0.48 0.03 0.00 -0.52 0.00 0.00 52.55 51.84 3kyd s ASP 53 Cb -0.16 -0.04 -0.02 0.00 -1.46 0.00 0.00 42.92 41.24 3kyd s ASP 53 CO 0.12 -0.34 -0.10 0.68 0.52 0.00 0.00 175.17 176.05 3kyd s VAL 54 N 2.20 0.75 0.10 1.11 -7.23 -1.26 -4.69 120.40 111.38 3kyd s VAL 54 Ca 0.04 -1.11 -0.10 0.00 -1.81 0.00 0.00 61.98 58.99 3kyd s VAL 54 Cb -0.16 -0.77 0.00 0.00 0.56 0.00 0.00 36.38 36.02 3kyd s VAL 54 CO -0.10 -0.29 0.23 -0.94 -0.31 0.00 0.00 175.10 173.69 3kyd s SER 55 N -1.55 0.05 0.00 4.85 1.04 -1.26 -4.82 113.70 112.02 3kyd s SER 55 Ca -0.06 -0.60 0.02 0.00 0.48 0.00 0.00 55.95 55.79 3kyd s SER 55 Cb -0.10 0.37 0.14 0.00 0.10 0.00 0.00 66.02 66.54 3kyd s SER 55 CO 0.01 -0.76 0.46 0.59 0.98 0.00 0.00 173.24 174.52 3kyd n ASN 56 N -0.10 0.00 0.05 7.02 4.13 -1.26 -1.11 115.26 123.99 3kyd n ASN 56 Ca -0.15 -0.45 -0.11 0.00 1.68 0.00 0.00 54.58 55.55 3kyd n ASN 56 Cb 0.63 0.00 0.01 0.00 -1.54 0.00 0.00 39.78 38.88 3kyd n ASN 56 CO 0.00 0.00 0.00 0.25 0.28 0.00 0.00 177.26 177.79 3kyd h LEU 57 N 0.00 0.53 -7.18 3.41 5.85 -1.98 -3.43 115.31 112.51 3kyd h LEU 57 Ca 0.00 -0.36 -0.14 0.00 0.84 0.00 0.00 57.88 58.23 3kyd h LEU 57 Cb 0.00 -0.16 -0.29 0.00 0.37 0.00 0.00 40.66 40.59 3kyd h LEU 57 CO 0.00 1.11 -0.40 0.21 -0.34 0.00 0.00 178.44 179.02 3kyd s ASN 58 N -7.00 -0.17 -0.15 1.25 3.84 -0.27 -5.17 114.94 107.28 3kyd s ASN 58 Ca -0.06 0.84 -0.05 0.00 0.21 0.00 0.00 52.86 53.81 3kyd s ASN 58 Cb 0.10 1.00 -0.03 0.00 -0.55 0.00 0.00 41.25 41.77 3kyd s ASN 58 CO 0.85 -0.22 0.01 -0.60 -2.79 0.00 0.00 177.10 174.35 3kyd s ARG 59 N 2.21 3.62 0.23 0.43 6.06 -1.26 -4.01 118.95 126.23 3kyd s ARG 59 Ca -0.03 -0.42 0.01 0.00 -2.50 0.00 0.00 55.73 52.80 3kyd s ARG 59 Cb -0.11 -3.00 -0.04 0.00 0.06 0.00 0.00 34.95 31.86 3kyd s ARG 59 CO -0.11 0.38 0.39 -0.65 -2.50 0.00 0.00 175.30 172.81 3kyd s GLN 60 N 0.02 3.48 0.02 5.12 -1.52 -1.26 -5.06 119.66 120.47 3kyd s GLN 60 Ca 0.03 -0.48 -0.24 0.00 -1.95 0.00 0.00 55.36 52.72 3kyd s GLN 60 Cb -0.13 -2.84 -0.13 0.00 -0.22 0.00 0.00 33.01 29.69 3kyd s GLN 60 CO 0.02 0.38 1.15 0.35 -0.25 0.00 0.00 175.29 176.94 3kyd h PHE 61 N 1.62 -0.81 0.00 0.91 3.57 -1.97 -3.34 116.94 116.92 3kyd h PHE 61 Ca -0.49 -0.02 0.00 0.00 3.53 0.00 0.00 57.97 60.99 3kyd h PHE 61 Cb 1.21 0.27 0.00 0.00 2.79 0.00 0.00 35.95 40.21 3kyd h PHE 61 CO 0.52 -0.50 -1.01 1.28 -2.23 0.00 0.00 178.31 176.36 3kyd n LEU 62 N -4.81 0.68 -4.61 0.59 4.77 -1.26 -4.91 117.00 107.44 3kyd n LEU 62 Ca -0.11 -0.18 -0.37 0.00 -0.03 0.00 0.00 56.01 55.32 3kyd n LEU 62 Cb 0.34 -0.08 -0.10 0.00 -2.33 0.00 0.00 43.42 41.25 3kyd n LEU 62 CO 0.26 0.13 -0.18 -0.36 -1.33 0.00 0.00 177.39 175.91 3kyd s PHE 63 N -3.12 3.26 0.46 -1.77 2.99 -1.26 -4.89 117.98 113.65 3kyd s PHE 63 Ca 0.05 0.14 0.03 0.00 0.00 0.00 0.00 56.93 57.15 3kyd s PHE 63 Cb 0.15 -2.32 -0.02 0.00 0.00 0.00 0.00 43.02 40.84 3kyd s PHE 63 CO 0.82 -0.06 0.05 -0.65 -0.00 0.00 0.00 175.22 175.38 3kyd s GLN 64 N 1.40 2.06 0.45 0.44 1.11 -1.26 -4.02 119.66 119.85 3kyd s GLN 64 Ca 0.07 -2.28 0.12 0.00 0.01 0.00 0.00 55.36 53.27 3kyd s GLN 64 Cb -0.15 -1.16 1.03 0.00 -1.01 0.00 0.00 33.01 31.72 3kyd s GLN 64 CO 0.07 -0.38 2.06 0.87 0.01 0.00 0.00 175.29 177.93 3kyd h LYS 65 N 1.57 0.34 0.00 2.91 1.79 -1.98 -1.87 116.57 119.33 3kyd h LYS 65 Ca -0.41 -0.02 0.00 0.00 -2.18 0.00 0.00 60.65 58.04 3kyd h LYS 65 Cb 1.29 -0.08 0.00 0.00 -1.58 0.00 0.00 32.23 31.87 3kyd h LYS 65 CO 0.68 0.22 0.00 1.57 -1.08 0.00 0.00 179.45 180.84 3kyd h LYS 66 N 0.35 0.00 -0.00 3.15 2.10 -1.98 -2.98 116.57 117.21 3kyd h LYS 66 Ca 0.14 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.79 3kyd h LYS 66 Cb 0.14 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.47 3kyd h LYS 66 CO -0.03 0.00 -0.55 0.72 -2.00 0.00 0.00 179.45 177.59 3kyd n HIS 67 N -2.80 0.00 -1.69 0.07 8.25 -0.70 -4.97 115.22 113.37 3kyd n HIS 67 Ca 0.01 0.00 -0.53 0.00 -0.26 0.00 0.00 57.72 56.94 3kyd n HIS 67 Cb 0.26 -0.17 -0.06 0.00 1.12 0.00 0.00 29.99 31.14 3kyd n HIS 67 CO 0.00 0.00 0.00 0.28 0.64 0.00 0.00 176.34 177.26 3kyd n VAL 68 N -1.28 0.40 0.00 1.59 0.31 -1.13 -1.15 118.33 117.08 3kyd n VAL 68 Ca 0.07 -0.07 0.00 0.00 -0.01 0.00 0.00 64.34 64.32 3kyd n VAL 68 Cb 0.34 -1.49 0.00 0.00 -0.91 0.00 0.00 33.84 31.78 3kyd n VAL 68 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3kyd n GLY 69 N 4.21 0.11 3.96 2.92 0.00 0.92 -4.97 105.19 112.34 3kyd n GLY 69 Ca 0.24 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 46.04 3kyd n GLY 69 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3kyd s ARG 70 N -0.99 3.26 0.28 1.61 0.52 -0.30 -4.67 118.95 118.67 3kyd s ARG 70 Ca 0.00 -0.59 -0.30 0.00 -0.52 0.00 0.00 55.73 54.32 3kyd s ARG 70 Cb 0.00 -2.70 -0.12 0.00 0.52 0.00 0.00 34.95 32.65 3kyd s ARG 70 CO 0.00 0.04 1.46 0.45 0.02 0.00 0.00 175.30 177.27 3kyd n SER 71 N -1.79 3.21 -0.05 0.23 2.88 -1.26 -0.48 113.62 116.36 3kyd n SER 71 Ca -0.02 1.16 -0.12 0.00 -1.33 0.00 0.00 58.87 58.56 3kyd n SER 71 Cb 0.57 -1.51 -0.06 0.00 -0.75 0.00 0.00 64.21 62.46 3kyd n SER 71 CO 0.00 0.00 0.00 0.11 -1.23 0.00 0.00 175.04 173.92 3kyd h LYS 72 N 4.07 0.26 -0.58 -1.46 1.57 -1.77 -2.74 116.57 115.93 3kyd h LYS 72 Ca -0.46 -0.09 -0.05 0.00 -1.87 0.00 0.00 60.65 58.18 3kyd h LYS 72 Cb 1.26 -0.02 -0.02 0.00 0.08 0.00 0.00 32.23 33.52 3kyd h LYS 72 CO 0.74 0.50 0.15 0.00 -0.57 0.00 0.00 179.45 180.28 3kyd h ALA 73 N 0.75 0.76 -0.11 3.86 0.00 -1.83 -1.41 119.26 121.28 3kyd h ALA 73 Ca 0.04 -0.22 -0.01 0.00 0.00 0.00 0.00 54.91 54.73 3kyd h ALA 73 Cb 0.39 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 17.95 3kyd h ALA 73 CO 0.01 0.46 0.04 0.37 0.00 0.00 0.00 179.25 180.13 3kyd h GLN 74 N 0.83 0.16 -0.63 0.00 5.75 -1.91 -0.45 115.11 118.85 3kyd h GLN 74 Ca 0.18 -0.03 -0.08 0.00 -0.15 0.00 0.00 58.65 58.57 3kyd h GLN 74 Cb 0.33 -0.03 -0.02 0.00 1.07 0.00 0.00 27.48 28.83 3kyd h GLN 74 CO -0.00 0.25 0.08 0.28 -2.65 0.00 0.00 178.83 176.79 3kyd h VAL 75 N 0.02 1.26 -0.50 2.39 2.07 -1.45 0.27 116.25 120.32 3kyd h VAL 75 Ca 0.04 -1.06 0.01 0.00 0.82 0.00 0.00 66.70 66.51 3kyd h VAL 75 Cb 0.15 0.71 -0.03 0.00 -1.52 0.00 0.00 31.29 30.60 3kyd h VAL 75 CO -0.00 0.39 0.32 0.00 0.02 0.00 0.00 177.57 178.29 3kyd h ALA 76 N 1.02 0.64 -0.26 1.67 0.00 -1.15 0.23 119.26 121.42 3kyd h ALA 76 Ca 0.19 -0.02 0.02 0.00 0.00 0.00 0.00 54.91 55.10 3kyd h ALA 76 Cb 0.47 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 18.06 3kyd h ALA 76 CO 0.02 0.04 0.10 -0.22 0.00 0.00 0.00 179.25 179.18 3kyd h LYS 77 N 0.64 0.21 -0.64 0.00 3.64 -0.74 -1.62 116.57 118.05 3kyd h LYS 77 Ca 0.19 -0.01 -0.07 0.00 -1.27 0.00 0.00 60.65 59.49 3kyd h LYS 77 Cb -0.03 -0.05 -0.03 0.00 -0.41 0.00 0.00 32.23 31.72 3kyd h LYS 77 CO -0.06 0.14 0.12 0.93 -2.27 0.00 0.00 179.45 178.31 3kyd h GLU 78 N 0.22 1.05 -0.69 1.90 5.08 -0.54 -1.15 114.58 120.45 3kyd h GLU 78 Ca 0.11 -0.27 -0.05 0.00 -1.00 0.00 0.00 59.36 58.15 3kyd h GLU 78 Cb 0.07 -0.13 -0.03 0.00 0.50 0.00 0.00 28.75 29.16 3kyd h GLU 78 CO -0.11 0.96 0.25 0.77 -1.00 0.00 0.00 179.01 179.88 3kyd h SER 79 N 0.97 0.98 0.21 1.42 0.02 -0.40 -3.12 113.55 113.63 3kyd h SER 79 Ca 0.20 -0.19 -0.23 0.00 -0.84 0.00 0.00 61.79 60.73 3kyd h SER 79 Cb 0.41 -0.26 0.01 0.00 0.14 0.00 0.00 62.40 62.70 3kyd h SER 79 CO 0.01 0.91 -0.93 0.58 -1.14 0.00 0.00 176.83 176.26 3kyd h VAL 80 N 1.00 1.36 -0.38 2.27 2.07 -1.16 -3.03 116.25 118.37 3kyd h VAL 80 Ca 0.23 -2.32 0.11 0.00 0.82 0.00 0.00 66.70 65.54 3kyd h VAL 80 Cb 0.26 2.33 -0.02 0.00 -1.52 0.00 0.00 31.29 32.34 3kyd h VAL 80 CO -0.01 0.70 0.48 -0.07 0.02 0.00 0.00 177.57 178.69 3kyd h LEU 81 N 0.30 0.00 -0.62 2.57 4.07 -1.15 0.21 115.31 120.70 3kyd h LEU 81 Ca -0.08 0.00 -0.04 0.00 0.08 0.00 0.00 57.88 57.83 3kyd h LEU 81 Cb 1.56 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 43.29 3kyd h LEU 81 CO 0.17 0.00 -0.20 1.56 -1.08 0.00 0.00 178.44 178.88 3kyd h GLN 82 N 0.00 0.00 0.00 1.13 4.20 -1.50 -2.83 115.11 116.12 3kyd h GLN 82 Ca 0.18 0.00 -0.00 0.00 0.06 0.00 0.00 58.65 58.89 3kyd h GLN 82 Cb 1.14 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.92 3kyd h GLN 82 CO -0.00 0.20 -0.23 0.74 -0.67 0.00 0.00 178.83 178.88 3kyd h PHE 83 N 0.00 0.00 -3.69 2.96 0.05 -0.72 -3.44 116.94 112.10 3kyd h PHE 83 Ca -0.00 0.00 -0.69 0.00 3.82 0.00 0.00 57.97 61.10 3kyd h PHE 83 Cb 0.93 0.00 -0.30 0.00 2.00 0.00 0.00 35.95 38.58 3kyd h PHE 83 CO 0.00 0.03 -0.63 0.71 -0.18 0.00 0.00 178.31 178.24 3kyd s TYR 84 N -1.86 3.27 -0.60 -0.55 1.51 -0.90 -4.98 117.35 113.25 3kyd s TYR 84 Ca -0.07 -1.62 0.23 0.00 -1.01 0.00 0.00 57.07 54.61 3kyd s TYR 84 Cb 0.01 -2.28 0.92 0.00 -0.11 0.00 0.00 41.96 40.50 3kyd s TYR 84 CO 0.11 -0.77 1.70 -2.30 -1.11 0.00 0.00 175.55 173.18 3kyd n PRO 85 N 4.74 0.18 0.00 -1.71 -0.02 -1.07 -3.71 135.00 133.41 3kyd n PRO 85 Ca -0.12 0.36 0.11 0.00 -2.02 0.00 0.00 63.50 61.82 3kyd n PRO 85 Cb 0.44 -1.80 0.03 0.00 -0.02 0.00 0.00 33.50 32.15 3kyd n PRO 85 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 3kyd n LYS 86 N -2.13 0.18 -2.08 -0.52 5.02 -1.26 -4.95 118.16 112.42 3kyd n LYS 86 Ca 0.03 -0.13 -0.41 0.00 -2.02 0.00 0.00 58.31 55.77 3kyd n LYS 86 Cb 0.26 -1.50 -0.02 0.00 -0.02 0.00 0.00 35.03 33.75 3kyd n LYS 86 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3kyd s ALA 87 N -2.92 3.56 -0.85 7.82 0.00 -1.24 -4.97 121.76 123.16 3kyd s ALA 87 Ca 0.11 1.27 -0.16 0.00 0.00 0.00 0.00 51.96 53.18 3kyd s ALA 87 Cb 0.17 -3.52 0.18 0.00 0.00 0.00 0.00 23.12 19.95 3kyd s ALA 87 CO 0.77 -0.68 0.89 -0.80 0.00 0.00 0.00 175.76 175.94 3kyd s ASN 88 N 0.04 6.69 -0.22 0.00 0.01 0.68 -5.02 114.94 117.12 3kyd s ASN 88 Ca 0.55 -2.40 -0.06 0.00 -0.71 0.00 0.00 52.86 50.24 3kyd s ASN 88 Cb -0.40 -2.28 -0.03 0.00 0.41 0.00 0.00 41.25 38.95 3kyd s ASN 88 CO 0.46 -0.77 0.03 -0.63 -1.51 0.00 0.00 177.10 174.68 3kyd s ILE 89 N 1.18 4.13 -0.26 0.60 1.01 -1.26 -1.90 121.20 124.70 3kyd s ILE 89 Ca 0.23 -0.25 -0.09 0.00 0.00 0.00 0.00 60.65 60.53 3kyd s ILE 89 Cb -0.09 -2.89 -0.04 0.00 0.01 0.00 0.00 42.46 39.45 3kyd s ILE 89 CO -0.08 0.40 0.14 -0.69 0.00 0.00 0.00 174.94 174.71 3kyd s VAL 90 N 1.16 4.96 -0.16 2.92 1.01 0.01 -5.00 120.40 125.31 3kyd s VAL 90 Ca 0.03 0.05 -0.06 0.00 0.00 0.00 0.00 61.98 62.01 3kyd s VAL 90 Cb -0.14 -3.33 -0.04 0.00 0.00 0.00 0.00 36.38 32.86 3kyd s VAL 90 CO 0.02 0.31 0.03 0.00 0.00 0.00 0.00 175.10 175.46 3kyd s ALA 91 N 1.50 3.32 -0.19 5.51 0.00 -1.26 -0.48 121.76 130.16 3kyd s ALA 91 Ca 0.06 -0.76 -0.01 0.00 0.00 0.00 0.00 51.96 51.25 3kyd s ALA 91 Cb -0.15 -1.77 0.00 0.00 0.00 0.00 0.00 23.12 21.21 3kyd s ALA 91 CO 0.07 0.28 -0.13 0.71 0.00 0.00 0.00 175.76 176.69 3kyd s TYR 92 N 0.08 2.85 -1.03 0.00 1.51 0.20 -4.94 117.35 116.02 3kyd s TYR 92 Ca 0.04 -1.22 -0.16 0.00 -1.01 0.00 0.00 57.07 54.71 3kyd s TYR 92 Cb -0.13 -1.98 0.17 0.00 -0.11 0.00 0.00 41.96 39.91 3kyd s TYR 92 CO 0.01 -0.62 1.19 -1.58 -1.11 0.00 0.00 175.55 173.44 3kyd s HIS 93 N 1.23 3.41 0.22 2.71 2.46 -1.26 -1.86 115.29 122.20 3kyd s HIS 93 Ca 0.03 -1.81 -0.22 0.00 0.47 0.00 0.00 55.06 53.53 3kyd s HIS 93 Cb -0.14 -4.21 0.05 0.00 -0.13 0.00 0.00 32.58 28.15 3kyd s HIS 93 CO -0.06 -1.36 0.88 0.34 -2.47 0.00 0.00 174.74 172.07 3kyd s ASP 94 N 3.03 -0.15 0.04 9.88 -1.08 -1.00 -4.67 116.67 122.71 3kyd s ASP 94 Ca 0.34 -0.59 -0.17 0.00 -0.52 0.00 0.00 52.55 51.62 3kyd s ASP 94 Cb -0.05 0.60 -0.06 0.00 -1.46 0.00 0.00 42.92 41.95 3kyd s ASP 94 CO -0.06 -1.13 0.48 -0.55 0.52 0.00 0.00 175.17 174.43 3kyd s SER 95 N -3.01 6.93 0.30 -0.34 0.15 -1.26 -1.75 113.70 114.71 3kyd s SER 95 Ca 0.14 1.10 0.24 0.00 0.70 0.00 0.00 55.95 58.13 3kyd s SER 95 Cb -0.03 -2.30 1.07 0.00 -1.71 0.00 0.00 66.02 63.05 3kyd s SER 95 CO 0.05 0.30 1.73 -0.29 1.20 0.00 0.00 173.24 176.23 3kyd h ILE 96 N 3.60 0.00 -0.01 6.45 6.09 -1.98 -2.16 117.51 129.51 3kyd h ILE 96 Ca -0.51 -0.20 0.00 0.00 -1.37 0.00 0.00 64.86 62.78 3kyd h ILE 96 Cb 1.22 0.90 0.00 0.00 0.47 0.00 0.00 36.82 39.41 3kyd h ILE 96 CO 0.62 0.00 -0.02 0.23 -3.07 0.00 0.00 178.15 175.91 3kyd n MET 97 N -2.32 1.31 -1.72 2.19 2.81 -1.26 -4.75 117.12 113.38 3kyd n MET 97 Ca 0.01 -0.54 -0.42 0.00 -1.81 0.00 0.00 57.70 54.94 3kyd n MET 97 Cb 0.19 -1.49 -0.03 0.00 -0.71 0.00 0.00 33.22 31.18 3kyd n MET 97 CO 0.00 0.00 0.00 1.21 1.51 0.00 0.00 175.97 178.69 3kyd s ASN 98 N -2.07 6.38 0.56 7.83 3.84 -0.81 -4.88 114.94 125.79 3kyd s ASN 98 Ca 0.40 2.86 0.30 0.00 0.21 0.00 0.00 52.86 56.63 3kyd s ASN 98 Cb 0.21 -2.59 1.63 0.00 -0.55 0.00 0.00 41.25 39.95 3kyd s ASN 98 CO 0.37 -0.99 1.90 -0.65 -2.79 0.00 0.00 177.10 174.95 3kyd h PRO 99 N 7.12 0.00 -0.35 0.43 0.11 -1.91 -2.09 132.00 135.32 3kyd h PRO 99 Ca -0.44 0.00 0.03 0.00 0.11 0.00 0.00 66.00 65.70 3kyd h PRO 99 Cb 1.20 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.30 3kyd h PRO 99 CO 0.96 0.00 0.23 -0.44 -0.21 0.00 0.00 178.00 178.54 3kyd h ASP 100 N 0.00 0.31 -1.18 -2.05 3.45 -1.94 -3.25 116.42 111.76 3kyd h ASP 100 Ca 0.00 -0.00 -0.74 0.00 0.43 0.00 0.00 57.03 56.71 3kyd h ASP 100 Cb 0.39 -0.07 -0.13 0.00 -0.56 0.00 0.00 39.33 38.96 3kyd h ASP 100 CO 0.00 0.21 2.33 -1.22 -1.57 0.00 0.00 179.24 179.00 3kyd n TYR 101 N -4.49 2.72 -1.66 4.55 4.02 -0.79 -4.81 117.16 116.70 3kyd n TYR 101 Ca 0.03 -2.82 -0.06 0.00 -0.01 0.00 0.00 57.90 55.04 3kyd n TYR 101 Cb 0.15 -1.91 0.04 0.00 -0.02 0.00 0.00 39.34 37.60 3kyd n TYR 101 CO 0.00 0.00 0.00 0.27 -1.01 0.00 0.00 176.86 176.12 3kyd n ASN 102 N 2.65 0.14 -0.11 7.72 6.94 -1.23 -4.78 115.26 126.59 3kyd n ASN 102 Ca 0.54 -1.17 0.08 0.00 -0.02 0.00 0.00 54.58 54.01 3kyd n ASN 102 Cb 0.29 -0.20 0.42 0.00 -2.36 0.00 0.00 39.78 37.93 3kyd n ASN 102 CO 0.00 0.00 0.00 0.58 -1.03 0.00 0.00 177.26 176.81 3kyd h VAL 103 N -0.88 0.99 -0.59 3.53 2.07 -1.92 -0.89 116.25 118.56 3kyd h VAL 103 Ca -0.09 -0.20 -0.07 0.00 0.82 0.00 0.00 66.70 67.16 3kyd h VAL 103 Cb 0.28 0.35 -0.02 0.00 -1.52 0.00 0.00 31.29 30.38 3kyd h VAL 103 CO 0.08 0.11 0.11 -0.08 0.02 0.00 0.00 177.57 177.81 3kyd h GLU 104 N 0.59 0.96 -0.68 1.57 4.81 -1.96 -1.53 114.58 118.34 3kyd h GLU 104 Ca 0.27 -0.25 -0.05 0.00 -0.13 0.00 0.00 59.36 59.20 3kyd h GLU 104 Cb 0.30 -0.12 -0.03 0.00 0.63 0.00 0.00 28.75 29.54 3kyd h GLU 104 CO -0.08 0.90 0.23 0.35 -0.73 0.00 0.00 179.01 179.68 3kyd h PHE 105 N 0.87 1.08 0.00 0.92 3.57 -1.51 -3.07 116.94 118.80 3kyd h PHE 105 Ca 0.18 -0.10 -0.08 0.00 3.53 0.00 0.00 57.97 61.50 3kyd h PHE 105 Cb 0.40 -0.32 -0.01 0.00 2.79 0.00 0.00 35.95 38.81 3kyd h PHE 105 CO 0.03 0.86 -0.37 0.74 -2.23 0.00 0.00 178.31 177.34 3kyd h PHE 106 N 0.99 0.00 0.00 0.41 -1.00 -1.08 -2.89 116.94 113.37 3kyd h PHE 106 Ca 0.22 0.00 0.00 0.00 2.81 0.00 0.00 57.97 61.00 3kyd h PHE 106 Cb 0.28 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.84 3kyd h PHE 106 CO 0.02 0.37 0.00 0.54 -1.61 0.00 0.00 178.31 177.63 3kyd n ARG 107 N -3.45 0.05 0.27 1.51 1.74 -0.60 -2.91 116.66 113.27 3kyd n ARG 107 Ca 0.00 0.19 0.15 0.00 -0.77 0.00 0.00 57.85 57.41 3kyd n ARG 107 Cb 0.53 -1.58 0.72 0.00 -1.02 0.00 0.00 32.46 31.11 3kyd n ARG 107 CO 0.00 0.00 0.00 1.96 -1.52 0.00 0.00 177.63 178.07 3kyd h GLN 108 N 0.00 0.00 -5.97 5.56 4.20 -1.54 -3.45 115.11 113.91 3kyd h GLN 108 Ca 0.00 0.00 -0.66 0.00 0.06 0.00 0.00 58.65 58.05 3kyd h GLN 108 Cb 0.40 0.00 -0.11 0.00 0.30 0.00 0.00 27.48 28.07 3kyd h GLN 108 CO 0.00 0.10 -0.58 -0.06 -0.67 0.00 0.00 178.83 177.62 3kyd s PHE 109 N -3.92 3.27 -2.38 2.96 0.40 -1.15 -4.64 117.98 112.51 3kyd s PHE 109 Ca -0.01 0.23 0.27 0.00 -0.60 0.00 0.00 56.93 56.81 3kyd s PHE 109 Cb 0.11 -1.76 0.81 0.00 0.51 0.00 0.00 43.02 42.69 3kyd s PHE 109 CO 0.56 0.54 1.61 0.44 0.70 0.00 0.00 175.22 179.07 3kyd n ILE 110 N 1.50 0.00 -3.64 0.64 -6.64 0.03 -4.90 119.36 106.35 3kyd n ILE 110 Ca -0.15 -0.26 -0.05 0.00 -1.77 0.00 0.00 62.75 60.52 3kyd n ILE 110 Cb 0.53 0.66 -0.07 0.00 -1.44 0.00 0.00 39.64 39.32 3kyd n ILE 110 CO 0.00 0.00 0.00 -0.22 -1.77 0.00 0.00 176.55 174.56 3kyd s LEU 111 N -2.13 -0.48 -0.09 7.28 2.96 -1.25 -4.57 118.68 120.39 3kyd s LEU 111 Ca 0.33 0.81 0.04 0.00 -0.22 0.00 0.00 54.13 55.09 3kyd s LEU 111 Cb 0.20 1.77 -0.00 0.00 0.50 0.00 0.00 46.19 48.66 3kyd s LEU 111 CO 0.38 -0.13 -0.24 -0.69 -1.32 0.00 0.00 176.35 174.35 3kyd s VAL 112 N 0.95 2.10 -0.17 1.68 1.01 -0.19 -1.80 120.40 123.98 3kyd s VAL 112 Ca -0.05 -1.02 0.00 0.00 0.00 0.00 0.00 61.98 60.92 3kyd s VAL 112 Cb -0.04 -1.79 0.01 0.00 0.00 0.00 0.00 36.38 34.56 3kyd s VAL 112 CO -0.12 0.56 -0.17 -0.04 0.00 0.00 0.00 175.10 175.33 3kyd s MET 113 N 0.20 3.12 0.12 2.72 -1.94 0.16 -0.46 119.30 123.22 3kyd s MET 113 Ca -0.14 -0.78 -0.25 0.00 -1.71 0.00 0.00 55.69 52.81 3kyd s MET 113 Cb -0.17 -2.63 -0.07 0.00 2.01 0.00 0.00 34.83 33.97 3kyd s MET 113 CO 0.07 -0.11 0.75 -0.80 -0.01 0.00 0.00 175.02 174.93 3kyd s ASN 114 N 1.09 7.31 -0.39 3.03 -0.87 0.04 -1.20 114.94 123.95 3kyd s ASN 114 Ca -0.00 1.55 0.11 0.00 -1.57 0.00 0.00 52.86 52.95 3kyd s ASN 114 Cb -0.14 -2.48 0.36 0.00 -0.02 0.00 0.00 41.25 38.97 3kyd s ASN 114 CO -0.06 0.16 0.92 0.00 -2.57 0.00 0.00 177.10 175.55 3kyd n ALA 115 N 1.96 1.39 -2.46 0.60 0.00 0.23 -4.12 120.51 118.11 3kyd n ALA 115 Ca -0.05 -2.66 -0.22 0.00 0.00 0.00 0.00 53.44 50.50 3kyd n ALA 115 Cb 0.49 -1.00 -0.05 0.00 0.00 0.00 0.00 19.45 18.89 3kyd n ALA 115 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3kyd s LEU 116 N -2.55 3.34 0.00 0.00 1.43 -1.26 -4.30 118.68 115.35 3kyd s LEU 116 Ca 0.32 -0.74 0.06 0.00 -1.03 0.00 0.00 54.13 52.74 3kyd s LEU 116 Cb 0.35 -1.86 -0.02 0.00 0.03 0.00 0.00 46.19 44.69 3kyd s LEU 116 CO -0.05 -0.39 0.39 -0.90 0.23 0.00 0.00 176.35 175.63 3kyd n ASP 117 N -1.27 0.70 -4.35 2.29 3.85 -1.26 -4.96 116.55 111.54 3kyd n ASP 117 Ca -0.02 -0.85 -0.18 0.00 -0.71 0.00 0.00 54.79 53.04 3kyd n ASP 117 Cb 0.61 0.65 -0.10 0.00 -1.35 0.00 0.00 41.12 40.93 3kyd n ASP 117 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.20 176.73 3kyd s ASN 118 N -1.17 2.14 -0.11 -1.12 2.20 -1.26 -5.09 114.94 110.53 3kyd s ASN 118 Ca 0.04 -1.18 -0.21 0.00 -0.94 0.00 0.00 52.86 50.57 3kyd s ASN 118 Cb 0.05 -0.05 -0.27 0.00 -2.00 0.00 0.00 41.25 38.97 3kyd s ASN 118 CO 0.17 -0.43 0.65 -0.09 -2.94 0.00 0.00 177.10 174.47 3kyd h ARG 119 N 2.45 0.18 -0.84 3.55 1.12 -1.99 -3.17 114.38 115.68 3kyd h ARG 119 Ca -0.39 -0.31 0.07 0.00 -1.11 0.00 0.00 59.98 58.24 3kyd h ARG 119 Cb 1.22 0.12 -0.05 0.00 -0.01 0.00 0.00 29.97 31.24 3kyd h ARG 119 CO 0.65 1.15 0.55 0.00 -3.11 0.00 0.00 179.97 179.21 3kyd h ALA 120 N -0.06 1.61 -0.05 2.80 0.00 -1.98 0.52 119.26 122.10 3kyd h ALA 120 Ca -0.20 -0.02 -0.18 0.00 0.00 0.00 0.00 54.91 54.50 3kyd h ALA 120 Cb 1.52 -0.23 0.01 0.00 0.00 0.00 0.00 17.79 19.10 3kyd h ALA 120 CO 0.04 0.26 -0.69 0.00 0.00 0.00 0.00 179.25 178.86 3kyd h ALA 121 N 1.55 0.15 -0.76 0.00 0.00 -1.99 -2.81 119.26 115.40 3kyd h ALA 121 Ca 0.37 -0.58 0.03 0.00 0.00 0.00 0.00 54.91 54.73 3kyd h ALA 121 Cb 0.26 0.02 -0.05 0.00 0.00 0.00 0.00 17.79 18.03 3kyd h ALA 121 CO -0.14 0.47 0.48 0.00 0.00 0.00 0.00 179.25 180.06 3kyd h ARG 122 N 0.14 0.90 -0.79 0.00 3.08 -1.39 -1.43 114.38 114.90 3kyd h ARG 122 Ca -0.07 -0.05 0.04 0.00 0.07 0.00 0.00 59.98 59.97 3kyd h ARG 122 Cb 1.36 -0.20 -0.05 0.00 0.08 0.00 0.00 29.97 31.15 3kyd h ARG 122 CO 0.14 0.60 0.50 -0.91 -1.07 0.00 0.00 179.97 179.22 3kyd h ASN 123 N 0.93 0.80 -0.16 7.04 2.35 -0.94 -0.82 115.58 124.78 3kyd h ASN 123 Ca 0.31 0.00 -0.02 0.00 -0.55 0.00 0.00 56.30 56.04 3kyd h ASN 123 Cb 0.03 -0.17 -0.01 0.00 0.05 0.00 0.00 38.32 38.22 3kyd h ASN 123 CO -0.12 0.54 0.00 -0.74 -1.65 0.00 0.00 177.43 175.47 3kyd h HIS 124 N 0.95 0.30 -0.91 1.19 2.76 -1.13 -2.44 115.15 115.87 3kyd h HIS 124 Ca 0.33 -0.05 -0.01 0.00 -2.20 0.00 0.00 60.37 58.43 3kyd h HIS 124 Cb 0.07 -0.08 -0.04 0.00 1.55 0.00 0.00 27.41 28.91 3kyd h HIS 124 CO -0.04 0.49 0.51 0.28 -1.30 0.00 0.00 177.93 177.88 3kyd h VAL 125 N 0.03 1.26 -0.25 5.26 2.07 -1.14 0.02 116.25 123.49 3kyd h VAL 125 Ca 0.05 -0.62 0.05 0.00 0.82 0.00 0.00 66.70 67.00 3kyd h VAL 125 Cb 0.37 0.01 -0.05 0.00 -1.52 0.00 0.00 31.29 30.10 3kyd h VAL 125 CO 0.01 0.29 -0.08 -1.13 0.02 0.00 0.00 177.57 176.68 3kyd h ASN 126 N 1.27 -0.27 -0.38 0.57 -1.24 -0.99 0.11 115.58 114.65 3kyd h ASN 126 Ca 0.32 0.08 -0.10 0.00 0.71 0.00 0.00 56.30 57.32 3kyd h ASN 126 Cb 0.00 0.17 -0.01 0.00 0.73 0.00 0.00 38.32 39.21 3kyd h ASN 126 CO -0.05 -0.10 -0.14 0.03 -1.29 0.00 0.00 177.43 175.87 3kyd h ARG 127 N -0.02 0.76 -0.68 6.67 3.08 -1.09 -2.20 114.38 120.91 3kyd h ARG 127 Ca 0.12 -0.32 0.01 0.00 0.07 0.00 0.00 59.98 59.87 3kyd h ARG 127 Cb 0.21 -0.03 -0.04 0.00 0.08 0.00 0.00 29.97 30.19 3kyd h ARG 127 CO -0.27 0.93 0.44 0.52 -1.07 0.00 0.00 179.97 180.52 3kyd h MET 128 N 0.56 0.87 -0.16 0.04 2.86 -0.70 -1.48 114.93 116.93 3kyd h MET 128 Ca 0.09 -0.05 -0.10 0.00 -2.06 0.00 0.00 59.70 57.58 3kyd h MET 128 Cb 0.68 -0.20 -0.01 0.00 0.06 0.00 0.00 31.60 32.13 3kyd h MET 128 CO 0.05 0.57 -0.33 0.00 1.06 0.00 0.00 176.91 178.26 3kyd h LEU 130 N 0.28 0.61 -0.72 0.00 3.38 -1.19 -1.01 115.31 116.65 3kyd h LEU 130 Ca 0.04 -0.48 -0.02 0.00 0.09 0.00 0.00 57.88 57.50 3kyd h LEU 130 Cb 0.72 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 41.26 3kyd h LEU 130 CO 0.05 0.97 0.38 0.00 0.09 0.00 0.00 178.44 179.93 3kyd h ALA 131 N 0.66 0.93 0.00 1.53 0.00 -1.09 -2.30 119.26 118.99 3kyd h ALA 131 Ca 0.03 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.82 3kyd h ALA 131 Cb 0.80 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 18.30 3kyd h ALA 131 CO 0.06 0.47 0.00 0.00 0.00 0.00 0.00 179.25 179.78 3kyd h ALA 132 N 1.19 1.00 -5.59 0.00 0.00 -1.01 -3.48 119.26 111.36 3kyd h ALA 132 Ca 0.25 0.00 -0.29 0.00 0.00 0.00 0.00 54.91 54.88 3kyd h ALA 132 Cb 0.07 0.00 0.18 0.00 0.00 0.00 0.00 17.79 18.04 3kyd h ALA 132 CO -0.04 0.00 -0.87 -3.47 0.00 0.00 0.00 179.25 174.88 3kyd n ASP 133 N -2.87 -6.10 -3.87 0.00 2.03 -0.50 -4.77 116.55 100.48 3kyd n ASP 133 Ca 0.03 -0.75 -0.20 0.00 0.52 0.00 0.00 54.79 54.38 3kyd n ASP 133 Cb 0.41 -4.91 -0.16 0.00 -0.72 0.00 0.00 41.12 35.73 3kyd n ASP 133 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 3kyd s VAL 134 N -3.41 0.47 0.16 5.18 1.01 -0.54 -5.01 120.40 118.26 3kyd s VAL 134 Ca 0.43 -0.06 -0.34 0.00 0.00 0.00 0.00 61.98 62.01 3kyd s VAL 134 Cb -0.07 -0.52 -0.14 0.00 0.00 0.00 0.00 36.38 35.65 3kyd s VAL 134 CO 0.76 0.22 1.52 -2.65 0.00 0.00 0.00 175.10 174.95 3kyd n PRO 135 N 4.21 2.00 -4.78 2.72 -0.02 -1.26 -4.68 135.00 133.18 3kyd n PRO 135 Ca -0.23 0.72 -0.33 0.00 -2.02 0.00 0.00 63.50 61.64 3kyd n PRO 135 Cb 0.51 -2.45 -0.16 0.00 -0.02 0.00 0.00 33.50 31.38 3kyd n PRO 135 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 3kyd s LEU 136 N 0.73 2.32 -0.33 2.45 2.96 -0.41 -1.02 118.68 125.37 3kyd s LEU 136 Ca 0.78 -0.51 -0.12 0.00 -0.22 0.00 0.00 54.13 54.06 3kyd s LEU 136 Cb -0.71 -1.50 -0.02 0.00 0.50 0.00 0.00 46.19 44.46 3kyd s LEU 136 CO 0.41 0.12 0.22 -0.63 -1.32 0.00 0.00 176.35 175.14 3kyd s ILE 137 N 0.62 5.12 -0.18 6.68 1.01 0.39 -0.13 121.20 134.71 3kyd s ILE 137 Ca -0.10 -0.24 -0.09 0.00 0.00 0.00 0.00 60.65 60.22 3kyd s ILE 137 Cb -0.16 -3.61 -0.05 0.00 0.01 0.00 0.00 42.46 38.65 3kyd s ILE 137 CO 0.03 0.03 0.11 -0.70 0.00 0.00 0.00 174.94 174.40 3kyd s GLU 138 N 1.70 4.00 0.02 2.79 2.56 -0.16 -0.78 118.70 128.84 3kyd s GLU 138 Ca 0.06 -0.24 -0.03 0.00 0.00 0.00 0.00 54.97 54.75 3kyd s GLU 138 Cb -0.17 -3.32 -0.01 0.00 2.00 0.00 0.00 34.13 32.63 3kyd s GLU 138 CO 0.10 0.37 0.04 -1.54 -0.56 0.00 0.00 175.26 173.67 3kyd s SER 139 N 0.13 0.20 0.10 -1.70 1.04 -1.26 -0.88 113.70 111.33 3kyd s SER 139 Ca 0.08 -0.50 -0.13 0.00 0.48 0.00 0.00 55.95 55.88 3kyd s SER 139 Cb -0.11 0.17 0.02 0.00 0.10 0.00 0.00 66.02 66.20 3kyd s SER 139 CO -0.01 -0.41 0.32 -0.83 0.98 0.00 0.00 173.24 173.30 3kyd s GLY 140 N -1.79 -0.14 -0.00 7.32 0.00 -0.97 -4.66 107.32 107.07 3kyd s GLY 140 Ca -0.10 -0.21 -0.08 0.00 0.00 0.00 0.00 44.72 44.33 3kyd s GLY 140 CO -0.02 -0.44 0.15 -0.51 0.00 0.00 0.00 173.10 172.28 3kyd s THR 141 N -3.61 0.07 -0.25 0.90 -4.23 -1.26 -1.92 115.64 105.34 3kyd s THR 141 Ca 0.02 -0.62 -0.03 0.00 -1.18 0.00 0.00 61.69 59.89 3kyd s THR 141 Cb 0.02 -0.43 0.14 0.00 1.34 0.00 0.00 72.50 73.57 3kyd s THR 141 CO -0.10 -0.34 0.43 0.00 -0.54 0.00 0.00 174.62 174.07 3kyd s ALA 142 N -1.25 -1.35 0.00 3.99 0.00 0.16 -4.88 121.76 118.43 3kyd s ALA 142 Ca -0.13 1.22 0.00 0.00 0.00 0.00 0.00 51.96 53.05 3kyd s ALA 142 Cb -0.07 -1.72 0.00 0.00 0.00 0.00 0.00 23.12 21.33 3kyd s ALA 142 CO 0.02 -1.19 0.00 0.41 0.00 0.00 0.00 175.76 175.00 3kyd n GLY 143 N 5.38 3.80 0.13 0.00 0.00 -1.26 -1.11 105.19 112.14 3kyd n GLY 143 Ca -0.04 0.02 0.13 0.00 0.00 0.00 0.00 46.02 46.12 3kyd n GLY 143 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 3kyd h TYR 144 N 0.00 0.00 -2.80 1.61 -1.99 -1.92 -3.40 116.97 108.46 3kyd h TYR 144 Ca 0.00 0.00 -0.50 0.00 2.00 0.00 0.00 58.73 60.23 3kyd h TYR 144 Cb 0.00 0.00 -0.00 0.00 2.00 0.00 0.00 36.73 38.73 3kyd h TYR 144 CO 0.00 0.00 -0.26 -0.51 -0.00 0.00 0.00 178.16 177.39 3kyd s LEU 145 N -4.72 4.13 0.00 3.88 1.43 -0.27 -4.61 118.68 118.52 3kyd s LEU 145 Ca 0.08 0.43 0.00 0.00 -1.03 0.00 0.00 54.13 53.60 3kyd s LEU 145 Cb 0.11 -3.24 0.00 0.00 0.03 0.00 0.00 46.19 43.08 3kyd s LEU 145 CO 0.52 -0.17 0.00 0.61 0.23 0.00 0.00 176.35 177.54 3kyd n GLY 146 N -1.25 1.40 3.26 -3.19 0.00 -1.24 -0.66 105.19 103.51 3kyd n GLY 146 Ca -0.05 -0.82 -0.09 0.00 0.00 0.00 0.00 46.02 45.06 3kyd n GLY 146 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 3kyd s GLN 147 N -2.00 1.00 -0.00 1.61 0.00 -0.81 0.71 119.66 120.17 3kyd s GLN 147 Ca 0.00 -1.11 0.02 0.00 -0.00 0.00 0.00 55.36 54.27 3kyd s GLN 147 Cb 0.00 0.35 -0.01 0.00 0.00 0.00 0.00 33.01 33.35 3kyd s GLN 147 CO 0.00 -0.34 -0.06 0.08 0.00 0.00 0.00 175.29 174.97 3kyd s VAL 148 N -3.93 0.51 0.21 3.63 1.01 -0.00 -2.30 120.40 119.52 3kyd s VAL 148 Ca 0.12 -0.30 -0.09 0.00 0.00 0.00 0.00 61.98 61.71 3kyd s VAL 148 Cb 0.04 -0.43 -0.01 0.00 0.00 0.00 0.00 36.38 35.98 3kyd s VAL 148 CO -0.05 0.12 0.34 0.28 0.00 0.00 0.00 175.10 175.79 3kyd s THR 149 N -0.19 0.02 -0.08 3.92 -1.32 -0.06 -0.12 115.64 117.81 3kyd s THR 149 Ca 0.02 -1.55 0.03 0.00 -1.21 0.00 0.00 61.69 58.97 3kyd s THR 149 Cb -0.03 -2.18 0.01 0.00 -1.51 0.00 0.00 72.50 68.79 3kyd s THR 149 CO -0.00 -0.08 -0.15 -0.89 -2.21 0.00 0.00 174.62 171.29 3kyd s THR 150 N -4.04 1.39 -0.25 5.08 2.01 -1.26 -0.99 115.64 117.59 3kyd s THR 150 Ca 0.25 -0.62 -0.03 0.00 0.31 0.00 0.00 61.69 61.59 3kyd s THR 150 Cb 0.02 -1.25 0.01 0.00 0.01 0.00 0.00 72.50 71.29 3kyd s THR 150 CO 0.07 0.41 -0.03 -0.63 -0.69 0.00 0.00 174.62 173.76 3kyd s ILE 151 N 0.62 3.26 -0.08 1.82 1.01 0.81 -4.81 121.20 123.83 3kyd s ILE 151 Ca -0.15 -0.76 0.02 0.00 0.00 0.00 0.00 60.65 59.75 3kyd s ILE 151 Cb -0.16 -2.60 0.02 0.00 0.01 0.00 0.00 42.46 39.73 3kyd s ILE 151 CO 0.05 0.26 -0.12 -0.75 0.00 0.00 0.00 174.94 174.38 3kyd s LYS 152 N 1.42 1.76 0.13 2.79 2.20 -1.26 -1.29 119.74 125.49 3kyd s LYS 152 Ca 0.03 -0.41 -0.35 0.00 -0.36 0.00 0.00 55.97 54.88 3kyd s LYS 152 Cb -0.16 -1.53 -0.15 0.00 -1.51 0.00 0.00 37.83 34.48 3kyd s LYS 152 CO -0.03 -0.05 1.43 1.17 -0.36 0.00 0.00 175.35 177.52 3kyd n LYS 153 N 4.10 1.63 -0.87 4.03 4.81 -1.26 -1.57 118.16 129.03 3kyd n LYS 153 Ca -0.20 0.59 0.00 0.00 -0.87 0.00 0.00 58.31 57.83 3kyd n LYS 153 Cb 0.51 -2.28 0.00 0.00 0.02 0.00 0.00 35.03 33.29 3kyd n LYS 153 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3kyd n GLY 154 N 2.84 0.53 1.10 3.14 0.00 -1.26 -4.73 105.19 106.81 3kyd n GLY 154 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.19 3kyd n GLY 154 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3kyd n VAL 155 N -2.19 0.16 -4.34 1.61 0.31 -0.73 -4.96 118.33 108.20 3kyd n VAL 155 Ca 0.00 0.05 -0.28 0.00 -0.01 0.00 0.00 64.34 64.10 3kyd n VAL 155 Cb 0.06 -1.42 -0.06 0.00 -0.91 0.00 0.00 33.84 31.50 3kyd n VAL 155 CO 0.00 0.00 0.00 0.42 -1.32 0.00 0.00 176.83 175.93 3kyd s THR 156 N -2.00 1.72 0.39 2.52 -4.23 -0.61 -4.34 115.64 109.09 3kyd s THR 156 Ca 0.00 -1.78 -0.25 0.00 -1.18 0.00 0.00 61.69 58.48 3kyd s THR 156 Cb 0.00 -2.50 -0.09 0.00 1.34 0.00 0.00 72.50 71.26 3kyd s THR 156 CO 0.00 0.00 1.08 -1.83 -0.54 0.00 0.00 174.62 173.33 3kyd s GLU 157 N -3.97 4.17 0.78 3.99 -1.05 -0.29 -3.85 118.70 118.47 3kyd s GLU 157 Ca 0.27 1.62 -0.12 0.00 -0.15 0.00 0.00 54.97 56.59 3kyd s GLU 157 Cb 0.02 -2.63 0.06 0.00 -0.44 0.00 0.00 34.13 31.14 3kyd s GLU 157 CO 0.15 -0.16 1.13 0.00 0.95 0.00 0.00 175.26 177.34 3kyd n TYR 159 N -3.24 0.27 -0.46 0.00 9.36 -1.26 -2.28 117.16 119.54 3kyd n TYR 159 Ca 0.07 0.14 0.04 0.00 3.32 0.00 0.00 57.90 61.47 3kyd n TYR 159 Cb 0.59 -0.57 0.05 0.00 -0.63 0.00 0.00 39.34 38.78 3kyd n TYR 159 CO 0.00 0.00 0.00 0.39 0.22 0.00 0.00 176.86 177.47 3kyd n GLU 160 N -1.74 2.22 0.20 2.98 1.02 -1.26 -4.70 120.64 119.36 3kyd n GLU 160 Ca -0.01 -1.87 0.04 0.00 -0.02 0.00 0.00 57.16 55.30 3kyd n GLU 160 Cb 0.20 -1.17 0.42 0.00 -0.02 0.00 0.00 31.44 30.87 3kyd n GLU 160 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3kyd s HIS 162 N -4.23 2.07 0.21 0.00 3.76 -1.26 -4.66 115.29 111.17 3kyd s HIS 162 Ca -0.03 -0.39 -0.32 0.00 -0.15 0.00 0.00 55.06 54.17 3kyd s HIS 162 Cb 0.14 -1.22 -0.12 0.00 1.11 0.00 0.00 32.58 32.49 3kyd s HIS 162 CO 0.70 0.14 1.73 -2.30 -0.85 0.00 0.00 174.74 174.16 3kyd n PRO 163 N 1.69 2.79 -2.90 8.40 -0.02 -1.26 -4.98 135.00 138.72 3kyd n PRO 163 Ca -0.17 1.01 -0.40 0.00 -2.02 0.00 0.00 63.50 61.91 3kyd n PRO 163 Cb 0.53 -2.86 -0.05 0.00 -0.02 0.00 0.00 33.50 31.10 3kyd n PRO 163 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 3kyd s LYS 164 N 1.17 4.59 0.10 -0.52 -0.14 -1.26 -5.00 119.74 118.68 3kyd s LYS 164 Ca 0.75 1.21 -0.31 0.00 -1.36 0.00 0.00 55.97 56.26 3kyd s LYS 164 Cb -0.50 -3.34 -0.10 0.00 -1.68 0.00 0.00 37.83 32.21 3kyd s LYS 164 CO 0.32 0.35 1.88 -1.25 -0.76 0.00 0.00 175.35 175.89 3kyd s PRO 165 N -0.36 4.13 0.13 -1.68 0.04 -1.26 -4.91 135.00 131.10 3kyd s PRO 165 Ca 0.40 2.62 -0.31 0.00 0.04 0.00 0.00 61.00 63.75 3kyd s PRO 165 Cb -0.22 -3.77 -0.10 0.00 0.04 0.00 0.00 34.50 30.45 3kyd s PRO 165 CO 0.26 -0.88 1.76 0.95 0.04 0.00 0.00 177.00 179.12 3kyd s THR 166 N 3.28 2.57 -0.32 1.26 -4.23 -1.26 -4.85 115.64 112.08 3kyd s THR 166 Ca 0.84 0.17 -0.28 0.00 -1.18 0.00 0.00 61.69 61.23 3kyd s THR 166 Cb -0.45 -3.11 -0.03 0.00 1.34 0.00 0.00 72.50 70.25 3kyd s THR 166 CO 0.38 0.00 1.94 -1.58 -0.54 0.00 0.00 174.62 174.82 3kyd s GLN 167 N 2.35 3.19 -0.20 3.99 0.74 -1.26 -4.84 119.66 123.64 3kyd s GLN 167 Ca 0.78 1.54 0.05 0.00 0.05 0.00 0.00 55.36 57.78 3kyd s GLN 167 Cb -0.45 -4.27 -0.21 0.00 1.10 0.00 0.00 33.01 29.18 3kyd s GLN 167 CO 0.34 -2.02 0.03 2.89 -0.55 0.00 0.00 175.29 175.98 3kyd n ARG 168 N 8.58 0.68 -4.55 1.67 1.85 -1.26 -4.94 116.66 118.69 3kyd n ARG 168 Ca 0.25 0.15 -0.34 0.00 -1.00 0.00 0.00 57.85 56.91 3kyd n ARG 168 Cb 0.47 -1.58 -0.11 0.00 -1.05 0.00 0.00 32.46 30.19 3kyd n ARG 168 CO 0.00 0.00 0.00 0.95 -0.01 0.00 0.00 177.63 178.57 3kyd s THR 169 N -2.53 3.78 -0.25 8.89 -4.23 -1.26 -4.85 115.64 115.19 3kyd s THR 169 Ca -0.24 -0.52 -0.03 0.00 -1.18 0.00 0.00 61.69 59.72 3kyd s THR 169 Cb 0.08 -2.58 0.02 0.00 1.34 0.00 0.00 72.50 71.36 3kyd s THR 169 CO 0.70 0.55 -0.03 -0.36 -0.54 0.00 0.00 174.62 174.95 3kyd s PHE 170 N -0.87 3.06 -0.03 3.99 0.40 0.02 -4.97 117.98 119.58 3kyd s PHE 170 Ca 0.14 -1.32 -0.30 0.00 -0.60 0.00 0.00 56.93 54.85 3kyd s PHE 170 Cb -0.11 -2.11 -0.06 0.00 0.51 0.00 0.00 43.02 41.25 3kyd s PHE 170 CO 0.03 -0.66 1.55 -1.25 0.70 0.00 0.00 175.22 175.59 3kyd s PRO 171 N 1.39 4.21 -0.16 0.24 0.04 -1.26 -0.18 135.00 139.28 3kyd s PRO 171 Ca 0.02 2.10 -0.29 0.00 0.04 0.00 0.00 61.00 62.87 3kyd s PRO 171 Cb -0.16 -3.81 -0.01 0.00 0.04 0.00 0.00 34.50 30.56 3kyd s PRO 171 CO -0.03 -0.75 1.11 0.20 0.04 0.00 0.00 177.00 177.57 3kyd s GLY 172 N 2.72 1.89 0.29 0.56 0.00 0.20 -4.90 107.32 108.07 3kyd s GLY 172 Ca 0.69 0.35 0.03 0.00 0.00 0.00 0.00 44.72 45.79 3kyd s GLY 172 CO 0.28 2.20 0.22 0.00 0.00 0.00 0.00 173.10 175.80 3kyd s THR 174 N -1.41 3.18 0.00 0.00 -4.23 -1.26 -4.70 115.64 107.22 3kyd s THR 174 Ca 0.16 0.17 0.00 0.00 -1.18 0.00 0.00 61.69 60.84 3kyd s THR 174 Cb -0.01 -3.29 0.00 0.00 1.34 0.00 0.00 72.50 70.54 3kyd s THR 174 CO 0.10 -0.21 0.00 -0.38 -0.54 0.00 0.00 174.62 173.59 3kyd n ILE 175 N 7.66 0.00 -3.36 2.99 5.41 -1.26 -4.91 119.36 125.89 3kyd n ILE 175 Ca 0.28 0.00 -0.38 0.00 1.00 0.00 0.00 62.75 63.65 3kyd n ILE 175 Cb 0.48 0.00 -0.06 0.00 -0.71 0.00 0.00 39.64 39.35 3kyd n ILE 175 CO 0.00 0.00 0.00 -0.60 0.00 0.00 0.00 176.55 175.95 3kyd s ARG 176 N 0.00 4.16 -0.15 0.38 6.06 -1.26 -4.63 118.95 123.50 3kyd s ARG 176 Ca 0.00 0.54 0.02 0.00 -2.50 0.00 0.00 55.73 53.79 3kyd s ARG 176 Cb 0.00 -3.31 -0.10 0.00 0.06 0.00 0.00 34.95 31.60 3kyd s ARG 176 CO 0.00 0.48 -0.13 0.09 -2.50 0.00 0.00 175.30 173.24 3kyd n ASN 177 N 2.47 2.75 -4.27 -2.12 5.03 -1.26 -4.88 115.26 112.98 3kyd n ASN 177 Ca -0.10 -0.08 -0.40 0.00 0.87 0.00 0.00 54.58 54.87 3kyd n ASN 177 Cb 0.52 -0.19 -0.10 0.00 -1.02 0.00 0.00 39.78 38.99 3kyd n ASN 177 CO 0.00 0.00 0.00 -0.89 -1.83 0.00 0.00 177.26 174.54 3kyd s THR 178 N -2.31 4.21 0.24 3.41 2.01 -1.26 -5.04 115.64 116.90 3kyd s THR 178 Ca -0.20 -1.39 -0.30 0.00 0.31 0.00 0.00 61.69 60.10 3kyd s THR 178 Cb 0.05 -3.57 -0.10 0.00 0.01 0.00 0.00 72.50 68.89 3kyd s THR 178 CO 0.36 -0.50 1.46 -2.84 -0.69 0.00 0.00 174.62 172.42 3kyd s PRO 179 N 1.42 4.26 0.02 4.92 0.02 -1.26 -4.94 135.00 139.44 3kyd s PRO 179 Ca 0.03 2.31 -0.04 0.00 0.02 0.00 0.00 61.00 63.32 3kyd s PRO 179 Cb -0.23 -3.12 -0.02 0.00 0.02 0.00 0.00 34.50 31.16 3kyd s PRO 179 CO 0.02 -0.45 -0.09 0.45 -0.33 0.00 0.00 177.00 176.61 3kyd n SER 180 N 2.56 1.18 -4.89 2.53 2.88 -1.26 -5.04 113.62 111.57 3kyd n SER 180 Ca 0.08 0.17 -0.29 0.00 -1.33 0.00 0.00 58.87 57.50 3kyd n SER 180 Cb 0.40 -0.40 -0.03 0.00 -0.75 0.00 0.00 64.21 63.43 3kyd n SER 180 CO 0.00 0.00 0.00 -1.61 -1.23 0.00 0.00 175.04 172.20 3kyd s GLU 181 N -2.20 3.68 0.60 -1.46 2.02 -1.26 -4.99 118.70 115.08 3kyd s GLU 181 Ca -0.07 0.17 0.36 0.00 0.02 0.00 0.00 54.97 55.44 3kyd s GLU 181 Cb 0.01 -2.55 1.89 0.00 0.10 0.00 0.00 34.13 33.58 3kyd s GLU 181 CO 0.11 0.12 2.21 -1.00 0.02 0.00 0.00 175.26 176.71 3kyd h PRO 182 N 1.50 0.00 0.00 0.39 0.13 -1.96 -2.39 132.00 129.67 3kyd h PRO 182 Ca -0.47 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 64.60 3kyd h PRO 182 Cb 1.19 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.31 3kyd h PRO 182 CO 0.65 0.03 -0.26 0.97 -0.23 0.00 0.00 178.00 179.17 3kyd h ILE 183 N 0.00 0.90 0.00 -3.56 6.09 -2.00 -2.87 117.51 116.07 3kyd h ILE 183 Ca -0.00 -0.99 -0.04 0.00 -1.37 0.00 0.00 64.86 62.46 3kyd h ILE 183 Cb 0.17 1.58 -0.01 0.00 0.47 0.00 0.00 36.82 39.04 3kyd h ILE 183 CO 0.00 0.25 -0.21 0.45 -3.07 0.00 0.00 178.15 175.58 3kyd h HIS 184 N 0.00 0.00 0.11 2.19 3.86 -1.83 -0.61 115.15 118.86 3kyd h HIS 184 Ca -0.00 0.00 -0.27 0.00 -1.16 0.00 0.00 60.37 58.93 3kyd h HIS 184 Cb 0.56 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 29.03 3kyd h HIS 184 CO 0.00 0.21 -1.28 0.00 0.86 0.00 0.00 177.93 177.72 3kyd h ILE 186 N 0.06 1.28 -0.47 0.00 2.04 -1.41 -0.07 117.51 118.94 3kyd h ILE 186 Ca -0.14 -1.47 -0.05 0.00 1.00 0.00 0.00 64.86 64.19 3kyd h ILE 186 Cb 1.96 1.33 -0.02 0.00 -0.74 0.00 0.00 36.82 39.35 3kyd h ILE 186 CO 0.18 0.49 0.09 0.58 0.00 0.00 0.00 178.15 179.49 3kyd h VAL 187 N 0.68 1.24 -0.61 1.67 2.07 -1.21 -1.29 116.25 118.81 3kyd h VAL 187 Ca 0.07 -0.89 -0.02 0.00 0.82 0.00 0.00 66.70 66.69 3kyd h VAL 187 Cb 0.86 0.92 -0.03 0.00 -1.52 0.00 0.00 31.29 31.53 3kyd h VAL 187 CO 0.08 0.31 0.32 -0.25 0.02 0.00 0.00 177.57 178.05 3kyd h TRP 188 N 0.64 0.85 -0.35 1.57 7.01 -1.28 0.78 115.95 125.17 3kyd h TRP 188 Ca 0.14 -0.03 -0.15 0.00 2.11 0.00 0.00 58.89 60.96 3kyd h TRP 188 Cb 0.37 -0.27 -0.01 0.00 -2.10 0.00 0.00 29.16 27.15 3kyd h TRP 188 CO 0.03 0.63 -0.40 0.00 -2.79 0.00 0.00 178.44 175.91 3kyd h ALA 189 N 1.15 0.64 -0.38 2.65 0.00 -0.95 0.13 119.26 122.49 3kyd h ALA 189 Ca 0.21 -0.45 -0.09 0.00 0.00 0.00 0.00 54.91 54.57 3kyd h ALA 189 Cb 0.07 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 3kyd h ALA 189 CO -0.03 0.67 -0.15 -0.22 0.00 0.00 0.00 179.25 179.52 3kyd h LYS 190 N 0.69 0.69 -0.14 0.00 3.11 -1.12 -0.42 116.57 119.40 3kyd h LYS 190 Ca 0.06 -0.24 -0.15 0.00 -2.81 0.00 0.00 60.65 57.50 3kyd h LYS 190 Cb 0.97 -0.05 -0.01 0.00 -1.00 0.00 0.00 32.23 32.14 3kyd h LYS 190 CO 0.09 0.81 -0.56 -0.92 -2.81 0.00 0.00 179.45 176.06 3kyd h TYR 191 N 0.63 0.55 -0.09 1.91 3.20 -0.62 -2.98 116.97 119.56 3kyd h TYR 191 Ca 0.10 -0.20 -0.18 0.00 3.14 0.00 0.00 58.73 61.60 3kyd h TYR 191 Cb 0.61 -0.10 -0.00 0.00 1.54 0.00 0.00 36.73 38.77 3kyd h TYR 191 CO 0.03 0.89 -0.70 1.25 -1.64 0.00 0.00 178.16 177.99 3kyd h LEU 192 N 0.33 0.50 -0.71 2.82 5.85 -0.53 -2.94 115.31 120.63 3kyd h LEU 192 Ca 0.00 -0.32 -0.06 0.00 0.84 0.00 0.00 57.88 58.35 3kyd h LEU 192 Cb 1.08 -0.15 -0.03 0.00 0.37 0.00 0.00 40.66 41.94 3kyd h LEU 192 CO 0.10 1.05 0.22 0.15 -0.34 0.00 0.00 178.44 179.62 3kyd h PHE 193 N 0.30 1.15 -0.06 1.25 3.57 -1.02 -2.38 116.94 119.76 3kyd h PHE 193 Ca -0.03 -0.12 0.00 0.00 3.53 0.00 0.00 57.97 61.36 3kyd h PHE 193 Cb 1.27 -0.33 0.00 0.00 2.79 0.00 0.00 35.95 39.68 3kyd h PHE 193 CO 0.04 0.92 0.00 0.09 -2.23 0.00 0.00 178.31 177.13 3kyd n ASN 194 N -4.28 1.29 -0.28 0.41 4.13 -1.13 -1.21 115.26 114.18 3kyd n ASN 194 Ca 0.05 -1.50 0.09 0.00 1.68 0.00 0.00 54.58 54.91 3kyd n ASN 194 Cb 0.23 -0.03 -0.04 0.00 -1.54 0.00 0.00 39.78 38.40 3kyd n ASN 194 CO 0.00 0.00 0.00 1.67 0.28 0.00 0.00 177.26 179.21 3kyd n GLN 195 N 0.02 1.32 -0.04 3.52 7.27 -0.97 -4.55 117.38 123.94 3kyd n GLN 195 Ca 0.18 -0.59 -0.08 0.00 0.07 0.00 0.00 57.00 56.59 3kyd n GLN 195 Cb 0.30 -1.36 -0.04 0.00 2.41 0.00 0.00 30.24 31.55 3kyd n GLN 195 CO 0.00 0.00 0.00 1.28 0.07 0.00 0.00 177.06 178.41 3kyd n LEU 196 N -0.54 1.84 -0.78 1.69 4.77 -0.93 -5.02 117.00 118.02 3kyd n LEU 196 Ca 0.06 0.03 0.03 0.00 -0.03 0.00 0.00 56.01 56.10 3kyd n LEU 196 Cb 0.36 -0.28 0.20 0.00 -2.33 0.00 0.00 43.42 41.37 3kyd n LEU 196 CO 0.28 0.42 0.57 0.49 -1.33 0.00 0.00 177.39 177.82 3kyd n PHE 197 N -3.06 0.55 0.00 -1.77 0.99 -0.35 -5.09 117.46 108.73 3kyd n PHE 197 Ca -0.16 -1.39 0.00 0.00 -0.00 0.00 0.00 57.45 55.90 3kyd n PHE 197 Cb 0.64 -0.34 0.00 0.00 -1.00 0.00 0.00 39.48 38.78 3kyd n PHE 197 CO 0.00 0.00 0.00 2.41 -0.00 0.00 0.00 176.76 179.17 3kyd n THR 240 N -1.10 0.00 0.10 4.37 -1.04 -1.26 -4.65 114.28 110.70 3kyd n THR 240 Ca 0.25 0.00 -0.23 0.00 -2.04 0.00 0.00 64.05 62.02 3kyd n THR 240 Cb 0.85 0.00 -0.15 0.00 -1.82 0.00 0.00 70.33 69.20 3kyd n THR 240 CO 0.00 0.00 0.00 0.07 -0.64 0.00 0.00 175.07 174.50 3kyd h LYS 241 N 0.03 0.44 -2.39 -2.82 -0.00 -2.05 -3.39 116.57 106.39 3kyd h LYS 241 Ca 0.00 -0.75 -0.67 0.00 -0.00 0.00 0.00 60.65 59.24 3kyd h LYS 241 Cb 0.00 0.28 -0.37 0.00 -0.00 0.00 0.00 32.23 32.14 3kyd h LYS 241 CO 0.00 1.36 -0.11 0.39 -0.00 0.00 0.00 179.45 181.08 3kyd n GLU 242 N -3.78 3.42 0.15 0.07 1.02 -1.26 -4.82 120.64 115.45 3kyd n GLU 242 Ca -0.19 -4.68 0.07 0.00 -0.02 0.00 0.00 57.16 52.33 3kyd n GLU 242 Cb 1.03 -2.34 0.06 0.00 -0.02 0.00 0.00 31.44 30.18 3kyd n GLU 242 CO 0.00 0.00 0.00 2.35 1.18 0.00 0.00 177.13 180.66 3kyd h TRP 243 N 4.26 0.00 -0.14 -0.32 2.91 -2.00 -3.26 115.95 117.40 3kyd h TRP 243 Ca 0.22 0.00 -0.14 0.00 1.13 0.00 0.00 58.89 60.10 3kyd h TRP 243 Cb 0.59 0.00 -0.01 0.00 -0.51 0.00 0.00 29.16 29.23 3kyd h TRP 243 CO 0.87 0.28 -0.51 0.00 -1.03 0.00 0.00 178.44 178.06 3kyd h ALA 244 N 1.72 0.87 -0.00 2.65 0.00 -1.95 -2.12 119.26 120.42 3kyd h ALA 244 Ca -0.02 -0.49 0.00 0.00 0.00 0.00 0.00 54.91 54.41 3kyd h ALA 244 Cb 1.23 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.93 3kyd h ALA 244 CO 0.03 0.67 0.00 1.17 0.00 0.00 0.00 179.25 181.12 3kyd n LYS 245 N -3.96 1.00 -0.01 0.00 4.81 -1.23 -1.06 118.16 117.72 3kyd n LYS 245 Ca -0.02 -0.00 -0.01 0.00 -0.87 0.00 0.00 58.31 57.40 3kyd n LYS 245 Cb 0.56 -1.30 -0.01 0.00 0.02 0.00 0.00 35.03 34.30 3kyd n LYS 245 CO 0.00 0.00 0.00 -1.13 1.17 0.00 0.00 177.40 177.44 3kyd n SER 246 N -0.80 4.16 -0.08 3.14 3.41 -1.11 -4.68 113.62 117.66 3kyd n SER 246 Ca 0.15 -0.01 0.13 0.00 -0.26 0.00 0.00 58.87 58.88 3kyd n SER 246 Cb 0.07 0.21 0.36 0.00 -0.26 0.00 0.00 64.21 64.59 3kyd n SER 246 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 3kyd n THR 247 N -2.35 0.00 -2.19 6.66 -2.24 -0.82 -4.96 114.28 108.39 3kyd n THR 247 Ca -0.03 -0.04 0.00 0.00 -2.27 0.00 0.00 64.05 61.71 3kyd n THR 247 Cb 0.55 0.18 0.00 0.00 -2.10 0.00 0.00 70.33 68.95 3kyd n THR 247 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3kyd n GLY 248 N 1.43 0.71 3.90 3.38 0.00 -1.04 -4.11 105.19 109.46 3kyd n GLY 248 Ca 0.08 -0.57 -0.27 0.00 0.00 0.00 0.00 46.02 45.27 3kyd n GLY 248 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 3kyd n TYR 249 N -1.73 -1.96 -2.54 1.61 4.01 -0.22 -4.93 117.16 111.40 3kyd n TYR 249 Ca 0.00 0.84 -0.43 0.00 -0.16 0.00 0.00 57.90 58.15 3kyd n TYR 249 Cb 0.48 -3.93 -0.02 0.00 -0.31 0.00 0.00 39.34 35.57 3kyd n TYR 249 CO 0.00 0.00 0.00 0.34 -0.46 0.00 0.00 176.86 176.74 3kyd s ASP 250 N -3.88 6.78 0.08 7.72 3.68 -1.26 -4.90 116.67 124.89 3kyd s ASP 250 Ca 0.32 1.05 0.18 0.00 2.13 0.00 0.00 52.55 56.23 3kyd s ASP 250 Cb -0.16 -2.54 0.77 0.00 -1.45 0.00 0.00 42.92 39.54 3kyd s ASP 250 CO 0.85 -1.01 1.58 -0.81 0.13 0.00 0.00 175.17 175.91 3kyd n PRO 251 N 7.18 0.06 -0.03 4.34 -0.04 -1.26 -2.17 135.00 143.08 3kyd n PRO 251 Ca 0.13 0.28 -0.18 0.00 -0.04 0.00 0.00 63.50 63.70 3kyd n PRO 251 Cb 0.47 -1.62 -0.14 0.00 -0.04 0.00 0.00 33.50 32.18 3kyd n PRO 251 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 3kyd n VAL 252 N -1.73 1.69 0.01 0.52 0.31 -1.26 -3.45 118.33 114.41 3kyd n VAL 252 Ca 0.03 -0.68 -0.10 0.00 -0.01 0.00 0.00 64.34 63.58 3kyd n VAL 252 Cb 0.21 -1.49 0.05 0.00 -0.91 0.00 0.00 33.84 31.70 3kyd n VAL 252 CO 0.00 0.00 0.00 0.11 -1.32 0.00 0.00 176.83 175.62 3kyd h LYS 253 N 0.04 0.53 -0.08 5.55 1.79 -1.94 -2.89 116.57 119.58 3kyd h LYS 253 Ca -0.43 -0.36 -0.15 0.00 -2.18 0.00 0.00 60.65 57.53 3kyd h LYS 253 Cb 2.02 0.05 -0.01 0.00 -1.58 0.00 0.00 32.23 32.71 3kyd h LYS 253 CO 0.06 0.97 -0.62 -0.07 -1.08 0.00 0.00 179.45 178.71 3kyd h LEU 254 N 0.40 0.34 -0.59 2.94 3.38 -1.63 -3.14 115.31 117.02 3kyd h LEU 254 Ca -0.00 -0.20 0.02 0.00 0.09 0.00 0.00 57.88 57.79 3kyd h LEU 254 Cb 1.14 -0.10 -0.03 0.00 0.09 0.00 0.00 40.66 41.76 3kyd h LEU 254 CO 0.11 0.88 0.37 0.15 0.09 0.00 0.00 178.44 180.04 3kyd h PHE 255 N 0.22 0.70 -0.15 1.13 3.57 -1.57 -3.09 116.94 117.75 3kyd h PHE 255 Ca -0.01 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.51 3kyd h PHE 255 Cb 1.14 -0.23 0.00 0.00 2.79 0.00 0.00 35.95 39.65 3kyd h PHE 255 CO 0.03 0.42 0.00 0.25 -2.23 0.00 0.00 178.31 176.77 3kyd n THR 256 N -4.72 0.63 0.02 4.41 -2.24 -1.10 -2.88 114.28 108.41 3kyd n THR 256 Ca 0.05 -0.34 -0.01 0.00 -2.27 0.00 0.00 64.05 61.48 3kyd n THR 256 Cb 0.06 -0.36 -0.00 0.00 -2.10 0.00 0.00 70.33 67.92 3kyd n THR 256 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 3kyd n LYS 257 N 0.14 0.03 0.00 -0.78 4.76 -1.17 -3.90 118.16 117.25 3kyd n LYS 257 Ca 0.07 0.01 0.12 0.00 -2.87 0.00 0.00 58.31 55.64 3kyd n LYS 257 Cb 0.44 -0.55 0.25 0.00 -1.84 0.00 0.00 35.03 33.33 3kyd n LYS 257 CO 0.00 0.00 0.00 1.28 -1.37 0.00 0.00 177.40 177.31 3kyd n LEU 258 N -3.37 0.51 -0.14 -0.35 4.77 -1.23 -0.47 117.00 116.71 3kyd n LEU 258 Ca -0.02 -0.01 0.02 0.00 -0.03 0.00 0.00 56.01 55.98 3kyd n LEU 258 Cb 0.21 -0.25 0.01 0.00 -2.33 0.00 0.00 43.42 41.06 3kyd n LEU 258 CO 0.01 0.13 0.23 0.49 -1.33 0.00 0.00 177.39 176.91 3kyd n PHE 259 N -1.48 0.00 0.00 -1.77 3.01 -1.14 -4.46 117.46 111.63 3kyd n PHE 259 Ca 0.06 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.52 3kyd n PHE 259 Cb 0.34 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.81 3kyd n PHE 259 CO 0.00 0.00 0.00 1.17 1.01 0.00 0.00 176.76 178.94 3kyd n LYS 260 N -0.13 0.00 -0.03 -1.08 4.81 -1.25 -2.79 118.16 117.69 3kyd n LYS 260 Ca 0.02 0.00 -0.12 0.00 -0.87 0.00 0.00 58.31 57.34 3kyd n LYS 260 Cb 0.11 -0.00 -0.07 0.00 0.02 0.00 0.00 35.03 35.09 3kyd n LYS 260 CO 0.00 0.00 0.00 -0.44 1.17 0.00 0.00 177.40 178.13 3kyd h ASP 261 N 0.00 0.20 -0.91 3.14 3.32 -1.55 -2.39 116.42 118.23 3kyd h ASP 261 Ca 0.00 -0.32 0.07 0.00 0.02 0.00 0.00 57.03 56.80 3kyd h ASP 261 Cb 0.00 -0.05 -0.06 0.00 0.22 0.00 0.00 39.33 39.44 3kyd h ASP 261 CO 0.00 0.47 0.59 -0.78 -1.72 0.00 0.00 179.24 177.80 3kyd h ASP 262 N -0.09 0.90 0.73 6.45 3.58 -1.02 0.23 116.42 127.20 3kyd h ASP 262 Ca 0.03 0.01 -0.26 0.00 0.42 0.00 0.00 57.03 57.23 3kyd h ASP 262 Cb 0.37 -0.18 -0.03 0.00 1.72 0.00 0.00 39.33 41.21 3kyd h ASP 262 CO 0.01 0.57 -1.33 0.40 -2.88 0.00 0.00 179.24 176.01 3kyd h ILE 263 N 1.02 1.32 0.00 2.25 2.04 -1.78 -2.82 117.51 119.55 3kyd h ILE 263 Ca 0.39 -3.07 -0.07 0.00 1.00 0.00 0.00 64.86 63.12 3kyd h ILE 263 Cb 0.22 2.69 -0.01 0.00 -0.74 0.00 0.00 36.82 38.98 3kyd h ILE 263 CO -0.15 0.79 -0.32 0.03 0.00 0.00 0.00 178.15 178.50 3kyd h ARG 264 N 0.01 0.00 0.00 2.37 3.08 -0.93 -2.44 114.38 116.48 3kyd h ARG 264 Ca -0.15 0.00 -0.12 0.00 0.07 0.00 0.00 59.98 59.79 3kyd h ARG 264 Cb 1.90 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 31.93 3kyd h ARG 264 CO 0.12 0.32 -0.57 -0.92 -1.07 0.00 0.00 179.97 177.85 3kyd h TYR 265 N 0.00 0.00 0.00 3.04 3.20 -0.54 -3.04 116.97 119.63 3kyd h TYR 265 Ca -0.00 0.00 -0.01 0.00 3.14 0.00 0.00 58.73 61.86 3kyd h TYR 265 Cb 0.72 0.00 -0.00 0.00 1.54 0.00 0.00 36.73 38.99 3kyd h TYR 265 CO 0.00 0.57 -0.03 1.25 -1.64 0.00 0.00 178.16 178.31 3kyd h LEU 266 N 0.00 0.00 -0.02 2.82 5.85 -1.18 -3.20 115.31 119.58 3kyd h LEU 266 Ca -0.01 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.71 3kyd h LEU 266 Cb 1.07 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.10 3kyd h LEU 266 CO 0.07 0.03 -0.04 0.18 -0.34 0.00 0.00 178.44 178.34 3kyd n LEU 267 N -3.11 0.07 0.12 2.25 4.77 -1.04 -3.43 117.00 116.63 3kyd n LEU 267 Ca 0.03 0.36 0.01 0.00 -0.03 0.00 0.00 56.01 56.38 3kyd n LEU 267 Cb 0.47 -0.39 0.33 0.00 -2.33 0.00 0.00 43.42 41.50 3kyd n LEU 267 CO 0.32 0.02 0.80 0.74 -1.33 0.00 0.00 177.39 177.93 3kyd h THR 268 N 0.04 1.23 -3.57 -5.08 2.02 -1.65 -3.39 112.91 102.51 3kyd h THR 268 Ca 0.00 -1.06 -0.71 0.00 0.77 0.00 0.00 66.41 65.41 3kyd h THR 268 Cb 0.42 1.40 -0.22 0.00 -1.74 0.00 0.00 68.15 68.01 3kyd h THR 268 CO 0.00 0.32 -0.48 0.00 0.37 0.00 0.00 175.52 175.73 3kyd s MET 269 N -4.49 3.00 -0.37 6.66 0.00 -1.22 -4.97 119.30 117.91 3kyd s MET 269 Ca -0.05 -0.98 0.04 0.00 0.00 0.00 0.00 55.69 54.70 3kyd s MET 269 Cb 0.15 -3.82 0.55 0.00 0.00 0.00 0.00 34.83 31.71 3kyd s MET 269 CO 0.74 -0.67 1.75 -0.40 0.00 0.00 0.00 175.02 176.45 3kyd n ASP 270 N 5.07 3.65 -0.12 -1.18 5.68 -1.26 -4.43 116.55 123.96 3kyd n ASP 270 Ca -0.12 -3.31 -0.08 0.00 -0.50 0.00 0.00 54.79 50.78 3kyd n ASP 270 Cb 0.47 -0.78 0.07 0.00 -1.14 0.00 0.00 41.12 39.75 3kyd n ASP 270 CO 0.00 0.00 0.00 0.11 -1.33 0.00 0.00 177.20 175.98 3kyd h LYS 271 N 0.89 0.85 0.13 0.11 1.79 -1.93 -3.15 116.57 115.26 3kyd h LYS 271 Ca 0.51 -0.33 -0.34 0.00 -2.18 0.00 0.00 60.65 58.31 3kyd h LYS 271 Cb 2.52 -0.05 -0.01 0.00 -1.58 0.00 0.00 32.23 33.12 3kyd h LYS 271 CO 0.90 0.96 -1.78 -0.07 -1.08 0.00 0.00 179.45 178.38 3kyd h LEU 272 N 0.75 0.43 -6.61 2.94 4.07 -1.83 -3.42 115.31 111.64 3kyd h LEU 272 Ca 0.11 -0.75 -0.76 0.00 0.08 0.00 0.00 57.88 56.56 3kyd h LEU 272 Cb 0.70 -0.14 -0.16 0.00 1.08 0.00 0.00 40.66 42.14 3kyd h LEU 272 CO 0.05 1.65 1.87 0.79 -1.08 0.00 0.00 178.44 181.72 3kyd n TRP 273 N -3.46 3.10 0.00 1.13 7.02 -1.19 -3.27 117.44 120.78 3kyd n TRP 273 Ca -0.24 -2.84 0.00 0.00 -1.02 0.00 0.00 57.50 53.40 3kyd n TRP 273 Cb 1.06 -1.92 0.00 0.00 -2.42 0.00 0.00 31.31 28.02 3kyd n TRP 273 CO 0.00 0.00 0.00 2.89 -2.02 0.00 0.00 177.69 178.56 3kyd n ARG 274 N 3.86 0.08 0.00 -0.99 0.00 -1.24 -4.76 116.66 113.61 3kyd n ARG 274 Ca 0.38 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 58.23 3kyd n ARG 274 Cb 0.37 -0.57 0.00 0.00 -0.00 0.00 0.00 32.46 32.26 3kyd n ARG 274 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.63 177.99 3kyd n LYS 275 N -1.49 1.57 -3.63 2.89 0.00 -1.26 -5.07 118.16 111.18 3kyd n LYS 275 Ca 0.00 0.00 -0.28 0.00 -0.00 0.00 0.00 58.31 58.03 3kyd n LYS 275 Cb 0.07 -0.89 -0.03 0.00 -0.00 0.00 0.00 35.03 34.17 3kyd n LYS 275 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.40 178.43 3kyd s ARG 276 N -1.61 3.55 0.04 -1.58 0.52 -1.20 -5.04 118.95 113.63 3kyd s ARG 276 Ca 0.00 -0.24 -0.30 0.00 -0.52 0.00 0.00 55.73 54.66 3kyd s ARG 276 Cb 0.00 -2.81 -0.08 0.00 0.52 0.00 0.00 34.95 32.59 3kyd s ARG 276 CO 0.00 0.38 1.69 0.21 0.02 0.00 0.00 175.30 177.60 3kyd s LYS 277 N -3.26 4.19 0.53 3.54 2.20 -1.26 -4.55 119.74 121.12 3kyd s LYS 277 Ca 0.40 2.34 -0.20 0.00 -0.36 0.00 0.00 55.97 58.15 3kyd s LYS 277 Cb -0.11 -3.74 -0.06 0.00 -1.51 0.00 0.00 37.83 32.41 3kyd s LYS 277 CO 0.29 -0.78 1.12 -2.14 -0.36 0.00 0.00 175.35 173.47 3kyd s PRO 278 N 3.12 3.46 0.37 4.03 0.02 -1.26 -4.97 135.00 139.78 3kyd s PRO 278 Ca 0.76 1.58 -0.22 0.00 0.02 0.00 0.00 61.00 63.14 3kyd s PRO 278 Cb -0.39 -2.05 -0.10 0.00 0.02 0.00 0.00 34.50 31.98 3kyd s PRO 278 CO 0.33 -0.76 0.91 -1.25 -0.33 0.00 0.00 177.00 175.90 3kyd s PRO 279 N -3.23 4.31 -0.35 5.54 0.04 -1.26 -4.83 135.00 135.21 3kyd s PRO 279 Ca 0.71 1.11 -0.07 0.00 0.04 0.00 0.00 61.00 62.79 3kyd s PRO 279 Cb -0.23 -2.44 0.05 0.00 0.04 0.00 0.00 34.50 31.92 3kyd s PRO 279 CO 0.26 0.11 0.13 0.08 0.04 0.00 0.00 177.00 177.63 3kyd s VAL 280 N -1.95 3.84 0.75 -0.36 1.01 -0.16 -5.03 120.40 118.51 3kyd s VAL 280 Ca 0.56 -1.20 -0.15 0.00 0.00 0.00 0.00 61.98 61.20 3kyd s VAL 280 Cb -0.12 -3.22 0.05 0.00 0.00 0.00 0.00 36.38 33.09 3kyd s VAL 280 CO 0.17 -0.24 1.24 -2.84 0.00 0.00 0.00 175.10 173.43 3kyd s PRO 281 N 1.40 1.97 0.03 2.72 0.02 -1.26 -4.54 135.00 135.33 3kyd s PRO 281 Ca -0.01 1.87 0.06 0.00 0.02 0.00 0.00 61.00 62.95 3kyd s PRO 281 Cb -0.20 -1.80 -0.02 0.00 0.02 0.00 0.00 34.50 32.50 3kyd s PRO 281 CO 0.03 -1.99 -0.17 -0.51 -0.33 0.00 0.00 177.00 174.02 3kyd s LEU 282 N -5.21 2.14 0.01 -5.54 1.43 -1.12 -5.08 118.68 105.31 3kyd s LEU 282 Ca 0.77 -0.45 0.08 0.00 -1.03 0.00 0.00 54.13 53.50 3kyd s LEU 282 Cb -0.32 -0.81 -0.03 0.00 0.03 0.00 0.00 46.19 45.06 3kyd s LEU 282 CO 0.47 0.12 -0.23 -0.62 0.23 0.00 0.00 176.35 176.31 3kyd s ASP 283 N -0.99 3.35 0.26 2.29 -1.08 -1.26 -4.13 116.67 115.10 3kyd s ASP 283 Ca 0.05 -0.48 -0.05 0.00 -0.52 0.00 0.00 52.55 51.55 3kyd s ASP 283 Cb -0.08 -0.43 0.30 0.00 -1.46 0.00 0.00 42.92 41.26 3kyd s ASP 283 CO 0.01 0.29 1.94 -0.25 0.52 0.00 0.00 175.17 177.68 3kyd h TRP 284 N 5.01 1.22 0.00 -5.34 2.91 -1.93 -1.97 115.95 115.85 3kyd h TRP 284 Ca -0.46 0.03 -0.05 0.00 1.13 0.00 0.00 58.89 59.54 3kyd h TRP 284 Cb 1.14 -0.41 -0.01 0.00 -0.51 0.00 0.00 29.16 29.37 3kyd h TRP 284 CO 0.47 0.77 -0.25 0.00 -1.03 0.00 0.00 178.44 178.39 3kyd h ALA 285 N 1.40 1.17 -0.15 2.65 0.00 -2.00 -2.99 119.26 119.34 3kyd h ALA 285 Ca 0.36 -0.23 -0.16 0.00 0.00 0.00 0.00 54.91 54.88 3kyd h ALA 285 Cb -0.15 -0.04 0.01 0.00 0.00 0.00 0.00 17.79 17.60 3kyd h ALA 285 CO -0.08 0.31 -0.52 0.93 0.00 0.00 0.00 179.25 179.90 3kyd h GLU 286 N 0.00 0.61 -0.41 0.00 5.08 -1.78 -3.13 114.58 114.96 3kyd h GLU 286 Ca -0.00 -0.46 -0.10 0.00 -1.00 0.00 0.00 59.36 57.79 3kyd h GLU 286 Cb 0.62 0.08 -0.02 0.00 0.50 0.00 0.00 28.75 29.94 3kyd h GLU 286 CO 0.03 1.08 -0.16 0.28 -1.00 0.00 0.00 179.01 179.24 3kyd h VAL 287 N 0.27 1.26 -0.51 3.13 2.07 -1.37 -1.81 116.25 119.29 3kyd h VAL 287 Ca -0.02 -1.24 -0.05 0.00 0.82 0.00 0.00 66.70 66.20 3kyd h VAL 287 Cb 1.14 1.12 -0.02 0.00 -1.52 0.00 0.00 31.29 32.01 3kyd h VAL 287 CO 0.11 0.42 0.11 -0.61 0.02 0.00 0.00 177.57 177.62 3kyd h GLN 288 N 0.69 0.79 0.00 1.57 4.15 -1.62 -3.34 115.11 117.34 3kyd h GLN 288 Ca 0.11 -0.16 0.00 0.00 0.77 0.00 0.00 58.65 59.36 3kyd h GLN 288 Cb 0.65 -0.12 0.00 0.00 0.21 0.00 0.00 27.48 28.23 3kyd h GLN 288 CO 0.05 0.72 0.00 0.45 -1.93 0.00 0.00 178.83 178.12 3kyd n SER 289 N -4.27 0.00 -3.17 -0.69 2.88 -0.93 -5.13 113.62 102.31 3kyd n SER 289 Ca 0.03 0.68 0.05 0.00 -1.33 0.00 0.00 58.87 58.30 3kyd n SER 289 Cb 0.23 -0.42 -0.02 0.00 -0.75 0.00 0.00 64.21 63.25 3kyd n SER 289 CO 0.00 0.00 0.00 -1.58 -1.23 0.00 0.00 175.04 172.23 3kyd s GLN 290 N -1.78 0.12 0.37 -1.46 2.00 -0.73 -5.12 119.66 113.06 3kyd s GLN 290 Ca 0.00 0.22 0.00 0.00 -2.00 0.00 0.00 55.36 53.58 3kyd s GLN 290 Cb 0.00 0.13 0.00 0.00 0.80 0.00 0.00 33.01 33.94 3kyd s GLN 290 CO 0.00 -0.11 0.00 -0.40 -0.50 0.00 0.00 175.29 174.28 3kyd n ASP 309 N 5.36 -5.32 -1.37 6.67 5.68 -1.26 -4.65 116.55 121.66 3kyd n ASP 309 Ca -0.08 1.18 0.09 0.00 -0.50 0.00 0.00 54.79 55.48 3kyd n ASP 309 Cb 0.54 -2.83 0.31 0.00 -1.14 0.00 0.00 41.12 38.00 3kyd n ASP 309 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 3kyd n GLN 310 N -2.21 3.17 -2.51 0.11 6.02 -1.26 -3.58 117.38 117.11 3kyd n GLN 310 Ca -0.00 -2.44 -0.42 0.00 -0.01 0.00 0.00 57.00 54.13 3kyd n GLN 310 Cb 0.31 -1.74 -0.03 0.00 1.02 0.00 0.00 30.24 29.80 3kyd n GLN 310 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 177.06 175.40 3kyd s GLN 311 N -1.66 4.44 -0.24 -1.09 -1.52 -1.26 -4.78 119.66 113.55 3kyd s GLN 311 Ca 0.44 1.65 -0.23 0.00 -1.95 0.00 0.00 55.36 55.27 3kyd s GLN 311 Cb 0.27 -3.44 -0.01 0.00 -0.22 0.00 0.00 33.01 29.61 3kyd s GLN 311 CO 0.23 -0.26 0.74 0.08 -0.25 0.00 0.00 175.29 175.83 3kyd s VAL 312 N 1.39 4.90 0.52 1.09 1.01 -1.26 -4.53 120.40 123.53 3kyd s VAL 312 Ca 0.56 1.39 0.08 0.00 0.00 0.00 0.00 61.98 64.01 3kyd s VAL 312 Cb -0.26 -4.04 0.05 0.00 0.00 0.00 0.00 36.38 32.13 3kyd s VAL 312 CO 0.26 -0.02 0.62 -0.76 0.00 0.00 0.00 175.10 175.21 3kyd s LEU 313 N 2.63 3.13 0.76 3.92 1.43 -1.26 -5.07 118.68 124.22 3kyd s LEU 313 Ca 0.31 -0.86 -0.07 0.00 -1.03 0.00 0.00 54.13 52.48 3kyd s LEU 313 Cb -0.15 -1.74 0.11 0.00 0.03 0.00 0.00 46.19 44.43 3kyd s LEU 313 CO 0.08 -1.12 1.07 1.51 0.23 0.00 0.00 176.35 178.12 3kyd s ASP 314 N -4.47 4.34 0.31 2.29 -4.77 -1.26 -4.99 116.67 108.13 3kyd s ASP 314 Ca 0.53 0.20 0.03 0.00 -3.30 0.00 0.00 52.55 50.00 3kyd s ASP 314 Cb -0.05 -0.66 0.51 0.00 -1.09 0.00 0.00 42.92 41.63 3kyd s ASP 314 CO 0.33 -1.90 1.82 -0.37 0.70 0.00 0.00 175.17 175.75 3kyd h VAL 315 N -0.79 1.22 -0.59 2.11 -1.51 -1.97 -3.08 116.25 111.64 3kyd h VAL 315 Ca -0.42 -0.92 -0.02 0.00 -1.23 0.00 0.00 66.70 64.10 3kyd h VAL 315 Cb 1.29 1.00 -0.03 0.00 -2.13 0.00 0.00 31.29 31.42 3kyd h VAL 315 CO 0.50 0.31 0.27 0.50 -1.23 0.00 0.00 177.57 177.92 3kyd h LYS 316 N 0.54 0.85 -0.56 5.19 3.64 -1.94 -1.95 116.57 122.34 3kyd h LYS 316 Ca 0.11 -0.13 -0.10 0.00 -1.27 0.00 0.00 60.65 59.25 3kyd h LYS 316 Cb 0.42 -0.15 -0.02 0.00 -0.41 0.00 0.00 32.23 32.07 3kyd h LYS 316 CO 0.02 0.70 -0.05 0.66 -2.27 0.00 0.00 179.45 178.52 3kyd h SER 317 N 0.80 1.01 0.83 4.20 4.64 -1.93 -1.75 113.55 121.35 3kyd h SER 317 Ca 0.20 -0.33 -0.11 0.00 -0.47 0.00 0.00 61.79 61.09 3kyd h SER 317 Cb 0.14 -0.27 -0.02 0.00 -0.31 0.00 0.00 62.40 61.94 3kyd h SER 317 CO -0.02 1.10 -0.51 1.88 -0.87 0.00 0.00 176.83 178.41 3kyd h TYR 318 N 0.90 0.00 -0.16 4.77 -1.99 -1.49 0.13 116.97 119.13 3kyd h TYR 318 Ca 0.15 0.00 -0.15 0.00 2.00 0.00 0.00 58.73 60.73 3kyd h TYR 318 Cb 0.61 0.00 -0.01 0.00 2.00 0.00 0.00 36.73 39.33 3kyd h TYR 318 CO 0.04 0.51 -0.54 0.00 -0.00 0.00 0.00 178.16 178.17 3kyd h ALA 319 N 1.49 0.75 -0.08 3.88 0.00 -1.22 -0.96 119.26 123.12 3kyd h ALA 319 Ca -0.01 -0.51 -0.23 0.00 0.00 0.00 0.00 54.91 54.17 3kyd h ALA 319 Cb 1.06 -0.08 0.01 0.00 0.00 0.00 0.00 17.79 18.78 3kyd h ALA 319 CO 0.07 0.69 -0.85 -0.09 0.00 0.00 0.00 179.25 179.06 3kyd h ARG 320 N 0.37 0.72 0.00 0.00 9.65 -1.08 -2.82 114.38 121.23 3kyd h ARG 320 Ca 0.01 -0.67 -0.07 0.00 -1.10 0.00 0.00 59.98 58.15 3kyd h ARG 320 Cb 1.07 0.16 -0.01 0.00 -1.39 0.00 0.00 29.97 29.80 3kyd h ARG 320 CO 0.10 1.26 -0.33 1.25 2.80 0.00 0.00 179.97 185.05 3kyd h LEU 321 N 0.42 0.00 -0.60 3.80 5.85 -0.76 0.19 115.31 124.22 3kyd h LEU 321 Ca -0.08 0.00 -0.02 0.00 0.84 0.00 0.00 57.88 58.61 3kyd h LEU 321 Cb 1.49 0.00 -0.03 0.00 0.37 0.00 0.00 40.66 42.50 3kyd h LEU 321 CO 0.17 0.33 0.28 0.15 -0.34 0.00 0.00 178.44 179.03 3kyd h PHE 322 N 0.00 0.87 0.00 1.25 3.57 -1.14 0.24 116.94 121.73 3kyd h PHE 322 Ca -0.00 -0.04 -0.13 0.00 3.53 0.00 0.00 57.97 61.32 3kyd h PHE 322 Cb 0.60 -0.27 -0.02 0.00 2.79 0.00 0.00 35.95 39.05 3kyd h PHE 322 CO 0.00 0.67 -0.61 0.66 -2.23 0.00 0.00 178.31 176.79 3kyd h SER 323 N 0.82 0.00 -0.14 0.41 4.64 -1.14 -2.80 113.55 115.34 3kyd h SER 323 Ca 0.21 0.00 -0.07 0.00 -0.47 0.00 0.00 61.79 61.46 3kyd h SER 323 Cb 0.13 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.22 3kyd h SER 323 CO -0.03 0.61 -0.18 0.50 -0.87 0.00 0.00 176.83 176.87 3kyd h LYS 324 N 0.00 0.37 -0.41 4.77 3.64 -0.36 -2.17 116.57 122.40 3kyd h LYS 324 Ca -0.01 -0.21 0.01 0.00 -1.27 0.00 0.00 60.65 59.17 3kyd h LYS 324 Cb 1.29 0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 33.10 3kyd h LYS 324 CO 0.08 0.78 0.26 0.77 -2.27 0.00 0.00 179.45 179.07 3kyd h SER 325 N -0.02 0.44 -0.22 4.20 0.02 -0.56 -1.60 113.55 115.82 3kyd h SER 325 Ca 0.02 -0.00 -0.08 0.00 -0.84 0.00 0.00 61.79 60.88 3kyd h SER 325 Cb 0.73 -0.10 -0.02 0.00 0.14 0.00 0.00 62.40 63.16 3kyd h SER 325 CO 0.04 0.31 -0.13 0.40 -1.14 0.00 0.00 176.83 176.32 3kyd h ILE 326 N 0.53 1.25 0.00 3.27 2.04 -1.56 0.12 117.51 123.16 3kyd h ILE 326 Ca 0.16 -1.11 -0.07 0.00 1.00 0.00 0.00 64.86 64.84 3kyd h ILE 326 Cb -0.03 1.12 -0.01 0.00 -0.74 0.00 0.00 36.82 37.16 3kyd h ILE 326 CO -0.05 0.37 -0.33 -0.08 0.00 0.00 0.00 178.15 178.05 3kyd h GLU 327 N 0.56 0.00 0.07 2.37 4.81 -1.03 -3.03 114.58 118.33 3kyd h GLU 327 Ca 0.10 0.00 -0.29 0.00 -0.13 0.00 0.00 59.36 59.04 3kyd h GLU 327 Cb 0.55 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.91 3kyd h GLU 327 CO 0.03 0.33 -1.57 1.15 -0.73 0.00 0.00 179.01 178.23 3kyd h THR 328 N 0.00 0.83 0.00 0.32 2.02 -0.84 -3.39 112.91 111.85 3kyd h THR 328 Ca -0.00 -2.29 -0.03 0.00 0.77 0.00 0.00 66.41 64.85 3kyd h THR 328 Cb 0.62 2.44 -0.00 0.00 -1.74 0.00 0.00 68.15 69.46 3kyd h THR 328 CO 0.04 0.63 -0.15 -0.07 0.37 0.00 0.00 175.52 176.33 3kyd h LEU 329 N -0.44 0.00 -1.25 2.58 3.38 -0.84 -2.82 115.31 115.92 3kyd h LEU 329 Ca -0.37 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.60 3kyd h LEU 329 Cb 1.68 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.43 3kyd h LEU 329 CO -0.04 0.15 0.00 0.08 0.09 0.00 0.00 178.44 178.73 3kyd h ARG 330 N 0.00 0.00 -0.16 1.13 0.11 -1.73 -2.10 114.38 111.63 3kyd h ARG 330 Ca -0.00 0.00 -0.18 0.00 0.10 0.00 0.00 59.98 59.90 3kyd h ARG 330 Cb 0.62 0.00 -0.00 0.00 1.11 0.00 0.00 29.97 31.70 3kyd h ARG 330 CO 0.02 0.00 -0.64 0.28 0.10 0.00 0.00 179.97 179.73 3kyd h VAL 331 N 0.00 1.33 -0.77 0.08 2.07 -1.72 -2.47 116.25 114.76 3kyd h VAL 331 Ca 0.00 -1.92 -0.03 0.00 0.82 0.00 0.00 66.70 65.58 3kyd h VAL 331 Cb 0.56 1.89 -0.04 0.00 -1.52 0.00 0.00 31.29 32.18 3kyd h VAL 331 CO 0.00 0.59 0.37 0.45 0.02 0.00 0.00 177.57 179.01 3kyd h HIS 332 N 0.43 1.10 0.00 1.57 3.86 -1.51 -2.99 115.15 117.60 3kyd h HIS 332 Ca -0.01 -0.05 -0.08 0.00 -1.16 0.00 0.00 60.37 59.07 3kyd h HIS 332 Cb 1.21 -0.34 -0.01 0.00 1.06 0.00 0.00 27.41 29.33 3kyd h HIS 332 CO 0.05 0.79 -0.39 1.25 0.86 0.00 0.00 177.93 180.50 3kyd h LEU 333 N 1.09 0.00 -1.72 2.43 5.85 -1.23 -3.12 115.31 118.61 3kyd h LEU 333 Ca 0.27 0.00 0.06 0.00 0.84 0.00 0.00 57.88 59.05 3kyd h LEU 333 Cb 0.11 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.11 3kyd h LEU 333 CO -0.03 0.39 0.30 0.00 -0.34 0.00 0.00 178.44 178.76 3kyd h ALA 334 N 1.61 1.98 -2.24 1.25 0.00 -1.29 -3.42 119.26 117.15 3kyd h ALA 334 Ca -0.00 -0.01 -0.48 0.00 0.00 0.00 0.00 54.91 54.41 3kyd h ALA 334 Cb 0.75 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.45 3kyd h ALA 334 CO 0.05 -0.07 0.21 -1.21 0.00 0.00 0.00 179.25 178.23 3kyd s GLU 335 N -5.33 3.97 3.77 0.00 0.41 -1.18 -5.14 118.70 115.21 3kyd s GLU 335 Ca -0.07 0.75 0.00 0.00 -0.41 0.00 0.00 54.97 55.24 3kyd s GLU 335 Cb 0.19 -2.31 0.00 0.00 -1.78 0.00 0.00 34.13 30.22 3kyd s GLU 335 CO 0.73 -0.02 0.00 1.17 -0.49 0.00 0.00 175.26 176.65 3kyd n LYS 336 N -0.95 0.00 0.00 1.61 3.00 -1.26 -5.05 118.16 115.52 3kyd n LYS 336 Ca 0.04 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.35 3kyd n LYS 336 Cb 0.54 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.57 3kyd n LYS 336 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.40 173.93 3kyd n ASP 345 N 7.79 0.00 0.00 3.14 -0.08 -1.26 -5.17 116.55 120.97 3kyd n ASP 345 Ca 0.00 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.28 3kyd n ASP 345 Cb 0.00 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.46 3kyd n ASP 345 CO 0.00 0.00 0.00 2.29 0.12 0.00 0.00 177.20 179.61 3kyd n LYS 346 N -0.75 0.00 -0.26 -0.67 2.85 -1.26 -5.01 118.16 113.07 3kyd n LYS 346 Ca 0.00 0.00 -0.07 0.00 -1.05 0.00 0.00 58.31 57.19 3kyd n LYS 346 Cb 0.00 0.00 0.05 0.00 -0.65 0.00 0.00 35.03 34.43 3kyd n LYS 346 CO 0.00 0.00 0.00 -0.44 -0.05 0.00 0.00 177.40 176.91 3kyd h ASP 347 N 0.00 1.07 -3.67 -5.58 3.32 -2.04 -3.38 116.42 106.15 3kyd h ASP 347 Ca 0.00 -0.22 -0.53 0.00 0.02 0.00 0.00 57.03 56.31 3kyd h ASP 347 Cb 0.00 -0.28 0.07 0.00 0.22 0.00 0.00 39.33 39.33 3kyd h ASP 347 CO 0.00 1.01 0.70 1.51 -1.72 0.00 0.00 179.24 180.74 3kyd s ASP 348 N -6.41 6.68 0.22 6.45 -4.77 -1.26 -4.92 116.67 112.66 3kyd s ASP 348 Ca -0.12 2.71 -0.08 0.00 -3.30 0.00 0.00 52.55 51.76 3kyd s ASP 348 Cb 0.15 -2.64 0.32 0.00 -1.09 0.00 0.00 42.92 39.66 3kyd s ASP 348 CO 0.84 -0.64 1.76 1.55 0.70 0.00 0.00 175.17 179.38 3kyd h PRO 349 N 4.05 0.48 -0.37 2.11 0.13 -1.99 -2.19 132.00 134.21 3kyd h PRO 349 Ca -0.48 -0.03 -0.00 0.00 -0.87 0.00 0.00 66.00 64.62 3kyd h PRO 349 Cb 1.22 -0.11 -0.02 0.00 0.13 0.00 0.00 31.00 32.23 3kyd h PRO 349 CO 0.70 0.32 0.21 0.66 -0.23 0.00 0.00 178.00 179.66 3kyd h SER 350 N 0.49 0.44 -0.33 1.44 4.64 -1.95 0.58 113.55 118.86 3kyd h SER 350 Ca 0.34 -0.02 -0.09 0.00 -0.47 0.00 0.00 61.79 61.55 3kyd h SER 350 Cb 0.40 -0.11 -0.01 0.00 -0.31 0.00 0.00 62.40 62.37 3kyd h SER 350 CO -0.30 0.34 -0.13 0.00 -0.87 0.00 0.00 176.83 175.87 3kyd h ALA 351 N 1.73 0.46 -0.00 5.18 0.00 -1.72 -3.00 119.26 121.91 3kyd h ALA 351 Ca 0.13 -0.32 -0.16 0.00 0.00 0.00 0.00 54.91 54.56 3kyd h ALA 351 Cb -0.01 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.65 3kyd h ALA 351 CO -0.02 0.35 -0.73 1.98 0.00 0.00 0.00 179.25 180.82 3kyd h MET 352 N 0.44 0.02 -0.21 0.00 -1.53 -1.08 -3.04 114.93 109.53 3kyd h MET 352 Ca 0.08 -0.02 -0.01 0.00 -3.44 0.00 0.00 59.70 56.31 3kyd h MET 352 Cb 0.65 0.00 -0.01 0.00 -0.55 0.00 0.00 31.60 31.70 3kyd h MET 352 CO 0.04 0.74 0.08 -0.44 0.14 0.00 0.00 176.91 177.47 3kyd h ASP 353 N 0.01 0.26 -0.10 1.39 5.19 0.15 -0.91 116.42 122.41 3kyd h ASP 353 Ca -0.01 -0.02 -0.03 0.00 -0.62 0.00 0.00 57.03 56.35 3kyd h ASP 353 Cb 1.29 -0.07 -0.00 0.00 0.18 0.00 0.00 39.33 40.74 3kyd h ASP 353 CO 0.10 0.25 -0.06 0.15 -3.12 0.00 0.00 179.24 176.56 3kyd h PHE 354 N 0.29 0.25 -0.52 4.55 3.57 -1.41 -2.64 116.94 121.02 3kyd h PHE 354 Ca 0.08 -0.06 0.00 0.00 3.53 0.00 0.00 57.97 61.51 3kyd h PHE 354 Cb 0.07 -0.06 -0.03 0.00 2.79 0.00 0.00 35.95 38.73 3kyd h PHE 354 CO 0.00 0.59 0.33 0.28 -2.23 0.00 0.00 178.31 177.28 3kyd h VAL 355 N -0.16 1.15 -0.81 1.41 2.07 -1.40 0.31 116.25 118.81 3kyd h VAL 355 Ca 0.02 -0.30 0.02 0.00 0.82 0.00 0.00 66.70 67.26 3kyd h VAL 355 Cb 0.53 0.41 -0.04 0.00 -1.52 0.00 0.00 31.29 30.66 3kyd h VAL 355 CO 0.02 0.14 0.53 0.74 0.02 0.00 0.00 177.57 179.02 3kyd h THR 356 N 0.70 1.17 0.28 2.57 2.02 -1.24 -2.78 112.91 115.63 3kyd h THR 356 Ca 0.19 -0.36 -0.01 0.00 0.77 0.00 0.00 66.41 66.99 3kyd h THR 356 Cb -0.05 0.02 0.00 0.00 -1.74 0.00 0.00 68.15 66.38 3kyd h THR 356 CO -0.04 0.19 -0.13 0.77 0.37 0.00 0.00 175.52 176.68 3kyd h SER 357 N 1.05 -0.32 -0.03 4.18 4.64 -1.04 -2.68 113.55 119.36 3kyd h SER 357 Ca 0.31 -0.03 0.01 0.00 -0.47 0.00 0.00 61.79 61.60 3kyd h SER 357 Cb -0.06 0.08 -0.00 0.00 -0.31 0.00 0.00 62.40 62.11 3kyd h SER 357 CO -0.09 0.15 0.02 0.00 -0.87 0.00 0.00 176.83 176.04 3kyd h ALA 358 N -1.02 1.73 0.07 5.18 0.00 -1.05 0.08 119.26 124.25 3kyd h ALA 358 Ca -0.04 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.87 3kyd h ALA 358 Cb 0.33 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.13 3kyd h ALA 358 CO 0.06 -0.04 -0.03 0.00 0.00 0.00 0.00 179.25 179.24 3kyd h ALA 359 N 1.98 -0.09 -0.30 0.00 0.00 -1.61 -3.06 119.26 116.18 3kyd h ALA 359 Ca 0.01 -0.15 0.09 0.00 0.00 0.00 0.00 54.91 54.86 3kyd h ALA 359 Cb 0.06 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 3kyd h ALA 359 CO -0.00 -0.09 0.23 -0.91 0.00 0.00 0.00 179.25 178.48 3kyd h ASN 360 N -1.00 0.00 0.00 0.00 2.35 -1.22 0.35 115.58 116.07 3kyd h ASN 360 Ca -0.01 0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 55.74 3kyd h ASN 360 Cb 0.32 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.69 3kyd h ASN 360 CO 0.01 0.00 -0.00 0.25 -1.65 0.00 0.00 177.43 176.04 3kyd h LEU 361 N 0.00 -0.01 -1.04 1.61 5.85 -1.10 -1.43 115.31 119.19 3kyd h LEU 361 Ca 0.14 -0.27 -0.09 0.00 0.84 0.00 0.00 57.88 58.50 3kyd h LEU 361 Cb 0.61 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.63 3kyd h LEU 361 CO -0.00 0.27 -0.29 -0.09 -0.34 0.00 0.00 178.44 177.99 3kyd h ARG 362 N -0.28 0.33 -0.52 1.25 2.43 -1.08 -2.67 114.38 113.84 3kyd h ARG 362 Ca -0.00 -0.13 0.00 0.00 -0.81 0.00 0.00 59.98 59.04 3kyd h ARG 362 Cb 0.27 -0.02 -0.03 0.00 -0.42 0.00 0.00 29.97 29.78 3kyd h ARG 362 CO 0.00 0.60 0.33 0.52 -1.51 0.00 0.00 179.97 179.90 3kyd h MET 363 N 0.29 0.70 -0.55 0.20 2.86 -0.25 -1.65 114.93 116.53 3kyd h MET 363 Ca 0.04 -0.05 -0.07 0.00 -2.06 0.00 0.00 59.70 57.56 3kyd h MET 363 Cb 0.66 -0.15 -0.02 0.00 0.06 0.00 0.00 31.60 32.15 3kyd h MET 363 CO 0.05 0.49 0.07 1.25 1.06 0.00 0.00 176.91 179.83 3kyd h HIS 364 N 0.70 0.93 -0.50 -0.22 -0.00 -1.10 0.16 115.15 115.13 3kyd h HIS 364 Ca 0.19 -0.12 -0.04 0.00 -0.00 0.00 0.00 60.37 60.40 3kyd h HIS 364 Cb -0.04 -0.26 -0.02 0.00 -0.00 0.00 0.00 27.41 27.09 3kyd h HIS 364 CO -0.03 0.81 0.14 0.82 -0.00 0.00 0.00 177.93 179.67 3kyd h ILE 365 N 0.83 1.23 -0.77 6.26 2.04 -1.21 -3.16 117.51 122.75 3kyd h ILE 365 Ca 0.17 -0.80 -0.51 0.00 1.00 0.00 0.00 64.86 64.72 3kyd h ILE 365 Cb 0.40 0.82 -0.22 0.00 -0.74 0.00 0.00 36.82 37.07 3kyd h ILE 365 CO 0.01 0.29 0.66 0.49 0.00 0.00 0.00 178.15 179.60 3kyd n PHE 366 N -4.48 2.47 -4.09 1.37 3.01 -0.64 -0.99 117.46 114.10 3kyd n PHE 366 Ca 0.01 -2.47 -0.30 0.00 1.01 0.00 0.00 57.45 55.70 3kyd n PHE 366 Cb 0.21 -1.20 -0.03 0.00 -0.01 0.00 0.00 39.48 38.45 3kyd n PHE 366 CO 0.00 0.00 0.00 0.43 1.01 0.00 0.00 176.76 178.20 3kyd n SER 367 N -0.39 -1.25 -4.21 4.37 7.64 -1.19 -4.96 113.62 113.63 3kyd n SER 367 Ca 0.48 -1.04 -0.29 0.00 1.01 0.00 0.00 58.87 59.03 3kyd n SER 367 Cb 0.69 -2.78 -0.16 0.00 -1.01 0.00 0.00 64.21 60.95 3kyd n SER 367 CO 0.00 0.00 0.00 -0.32 -3.01 0.00 0.00 175.04 171.71 3kyd s MET 368 N -6.79 2.10 0.13 1.43 0.00 0.56 -5.04 119.30 111.70 3kyd s MET 368 Ca 0.27 -0.76 -0.31 0.00 0.00 0.00 0.00 55.69 54.89 3kyd s MET 368 Cb -0.15 -1.83 -0.09 0.00 0.00 0.00 0.00 34.83 32.76 3kyd s MET 368 CO 0.92 0.34 1.58 1.21 0.00 0.00 0.00 175.02 179.07 3kyd s ASN 369 N -0.14 6.61 0.44 1.11 2.47 -1.26 -3.76 114.94 120.42 3kyd s ASN 369 Ca -0.02 2.55 -0.23 0.00 0.42 0.00 0.00 52.86 55.58 3kyd s ASN 369 Cb -0.12 -2.58 -0.08 0.00 -1.45 0.00 0.00 41.25 37.02 3kyd s ASN 369 CO 0.02 -0.83 1.14 -0.04 -3.72 0.00 0.00 177.10 173.67 3kyd s MET 370 N 1.63 3.86 0.18 0.43 -1.94 -1.26 -4.98 119.30 117.22 3kyd s MET 370 Ca 0.71 1.73 0.05 0.00 -1.71 0.00 0.00 55.69 56.47 3kyd s MET 370 Cb -0.42 -2.45 -0.04 0.00 2.01 0.00 0.00 34.83 33.93 3kyd s MET 370 CO 0.31 -0.46 0.15 0.15 -0.01 0.00 0.00 175.02 175.17 3kyd s LYS 371 N -2.63 2.93 0.77 2.03 -0.14 -1.26 -4.96 119.74 116.49 3kyd s LYS 371 Ca 0.62 -0.88 -0.11 0.00 -1.36 0.00 0.00 55.97 54.24 3kyd s LYS 371 Cb -0.27 -2.65 0.07 0.00 -1.68 0.00 0.00 37.83 33.29 3kyd s LYS 371 CO 0.34 0.47 1.13 -1.54 -0.76 0.00 0.00 175.35 174.99 3kyd s SER 372 N -3.21 4.67 0.16 2.83 1.04 -1.26 -4.84 113.70 113.08 3kyd s SER 372 Ca 0.31 0.73 -0.14 0.00 0.48 0.00 0.00 55.95 57.34 3kyd s SER 372 Cb -0.10 -1.29 0.05 0.00 0.10 0.00 0.00 66.02 64.78 3kyd s SER 372 CO 0.24 -1.78 1.77 -0.09 0.98 0.00 0.00 173.24 174.36 3kyd h ARG 373 N -0.91 0.72 -0.44 4.02 2.43 -1.80 -2.35 114.38 116.06 3kyd h ARG 373 Ca -0.46 -0.08 0.05 0.00 -0.81 0.00 0.00 59.98 58.68 3kyd h ARG 373 Cb 1.32 -0.14 -0.04 0.00 -0.42 0.00 0.00 29.97 30.68 3kyd h ARG 373 CO 0.64 0.56 0.19 0.35 -1.51 0.00 0.00 179.97 180.20 3kyd h PHE 374 N 0.69 0.34 -0.40 2.20 3.57 -1.93 0.99 116.94 122.39 3kyd h PHE 374 Ca 0.18 0.02 -0.06 0.00 3.53 0.00 0.00 57.97 61.64 3kyd h PHE 374 Cb 0.05 -0.09 -0.01 0.00 2.79 0.00 0.00 35.95 38.69 3kyd h PHE 374 CO -0.02 0.15 0.01 -0.44 -2.23 0.00 0.00 178.31 175.79 3kyd h ASP 375 N 0.38 0.69 -0.43 0.41 5.19 -1.88 -3.04 116.42 117.74 3kyd h ASP 375 Ca 0.20 -0.30 -0.13 0.00 -0.62 0.00 0.00 57.03 56.19 3kyd h ASP 375 Cb 0.16 -0.18 -0.01 0.00 0.18 0.00 0.00 39.33 39.47 3kyd h ASP 375 CO -0.18 0.82 -0.22 0.40 -3.12 0.00 0.00 179.24 176.94 3kyd h ILE 376 N 0.54 1.27 -0.25 0.35 2.04 -1.22 -2.48 117.51 117.76 3kyd h ILE 376 Ca 0.12 -1.37 0.06 0.00 1.00 0.00 0.00 64.86 64.66 3kyd h ILE 376 Cb 0.46 1.23 -0.06 0.00 -0.74 0.00 0.00 36.82 37.71 3kyd h ILE 376 CO 0.02 0.47 -0.15 0.50 0.00 0.00 0.00 178.15 178.98 3kyd h LYS 377 N 0.74 -0.13 -0.27 2.37 1.63 -0.78 0.25 116.57 120.38 3kyd h LYS 377 Ca 0.09 0.01 -0.17 0.00 -0.85 0.00 0.00 60.65 59.73 3kyd h LYS 377 Cb 0.79 0.03 -0.00 0.00 -0.60 0.00 0.00 32.23 32.45 3kyd h LYS 377 CO 0.07 -0.09 -0.51 0.66 -3.45 0.00 0.00 179.45 176.13 3kyd h SER 378 N -0.13 0.85 -0.30 4.20 4.64 -1.57 -2.49 113.55 118.73 3kyd h SER 378 Ca 0.14 -0.44 -0.01 0.00 -0.47 0.00 0.00 61.79 61.01 3kyd h SER 378 Cb 0.34 -0.24 -0.01 0.00 -0.31 0.00 0.00 62.40 62.17 3kyd h SER 378 CO -0.33 1.20 0.14 0.24 -0.87 0.00 0.00 176.83 177.22 3kyd h MET 379 N 0.60 0.44 -0.37 4.77 2.86 -1.13 -2.31 114.93 119.79 3kyd h MET 379 Ca 0.02 -0.06 -0.05 0.00 -2.06 0.00 0.00 59.70 57.54 3kyd h MET 379 Cb 1.09 -0.08 -0.02 0.00 0.06 0.00 0.00 31.60 32.65 3kyd h MET 379 CO 0.11 0.41 -0.00 0.00 1.06 0.00 0.00 176.91 178.49 3kyd h ALA 380 N 1.00 1.31 0.00 6.32 0.00 -0.49 -1.65 119.26 125.75 3kyd h ALA 380 Ca 0.10 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.80 3kyd h ALA 380 Cb 0.12 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 17.75 3kyd h ALA 380 CO -0.01 0.47 0.00 0.78 0.00 0.00 0.00 179.25 180.49 3kyd h GLY 381 N 0.88 0.00 -1.99 0.00 0.00 -1.31 -3.16 103.07 97.49 3kyd h GLY 381 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.45 3kyd h GLY 381 CO 0.01 0.00 0.00 0.70 0.00 0.00 0.00 176.54 177.25 3kyd n ASN 382 N -2.95 3.01 -4.60 0.19 5.03 -0.63 -4.89 115.26 110.43 3kyd n ASN 382 Ca 0.01 -1.95 -0.43 0.00 0.87 0.00 0.00 54.58 53.09 3kyd n ASN 382 Cb 0.33 -0.29 -0.02 0.00 -1.02 0.00 0.00 39.78 38.77 3kyd n ASN 382 CO 0.00 0.00 0.00 -0.63 -1.83 0.00 0.00 177.26 174.80 3kyd s ILE 383 N -1.42 3.90 -0.14 2.41 1.01 -1.18 -0.80 121.20 124.99 3kyd s ILE 383 Ca 0.38 0.90 -0.29 0.00 0.00 0.00 0.00 60.65 61.64 3kyd s ILE 383 Cb 0.21 -4.24 -0.02 0.00 0.01 0.00 0.00 42.46 38.42 3kyd s ILE 383 CO 0.29 -0.81 1.19 -0.63 0.00 0.00 0.00 174.94 174.97 3kyd s ILE 384 N 5.49 4.37 0.47 2.92 1.01 0.75 -4.90 121.20 131.32 3kyd s ILE 384 Ca 0.60 1.67 -0.24 0.00 0.00 0.00 0.00 60.65 62.68 3kyd s ILE 384 Cb -0.13 -4.08 -0.07 0.00 0.01 0.00 0.00 42.46 38.19 3kyd s ILE 384 CO 0.32 -0.09 1.34 -2.16 0.00 0.00 0.00 174.94 174.35 3kyd s PRO 385 N 2.95 3.59 0.34 2.79 0.04 -1.26 -0.62 135.00 142.82 3kyd s PRO 385 Ca 0.53 2.21 -0.27 0.00 0.04 0.00 0.00 61.00 63.51 3kyd s PRO 385 Cb -0.21 -2.52 -0.09 0.00 0.04 0.00 0.00 34.50 31.72 3kyd s PRO 385 CO 0.16 -0.82 1.10 0.00 0.04 0.00 0.00 177.00 177.48 3kyd s ALA 386 N -1.29 3.27 -0.30 8.56 0.00 -1.25 -4.12 121.76 126.63 3kyd s ALA 386 Ca 0.64 0.86 0.03 0.00 0.00 0.00 0.00 51.96 53.49 3kyd s ALA 386 Cb -0.39 -3.32 0.09 0.00 0.00 0.00 0.00 23.12 19.49 3kyd s ALA 386 CO 0.49 -0.25 0.01 0.42 0.00 0.00 0.00 175.76 176.42 3kyd s ILE 387 N -1.35 1.97 0.52 0.00 1.01 -1.26 -4.99 121.20 117.10 3kyd s ILE 387 Ca 0.51 -1.91 0.20 0.00 0.00 0.00 0.00 60.65 59.44 3kyd s ILE 387 Cb -0.29 -2.34 0.33 0.00 0.01 0.00 0.00 42.46 40.16 3kyd s ILE 387 CO 0.37 -0.41 2.07 0.00 0.00 0.00 0.00 174.94 176.97 3kyd h ALA 388 N 7.75 2.22 0.00 9.38 0.00 -1.96 -1.71 119.26 134.95 3kyd h ALA 388 Ca -0.10 -0.01 -0.06 0.00 0.00 0.00 0.00 54.91 54.73 3kyd h ALA 388 Cb 1.03 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.83 3kyd h ALA 388 CO 0.49 -0.30 -0.31 0.00 0.00 0.00 0.00 179.25 179.13 3kyd h THR 389 N 0.02 1.15 -0.29 0.00 1.03 -1.96 -2.61 112.91 110.25 3kyd h THR 389 Ca 0.12 -1.08 -0.16 0.00 -0.01 0.00 0.00 66.41 65.28 3kyd h THR 389 Cb 0.48 1.60 -0.00 0.00 -1.07 0.00 0.00 68.15 69.15 3kyd h THR 389 CO -0.00 0.30 -0.48 0.74 -0.01 0.00 0.00 175.52 176.07 3kyd h THR 390 N 0.00 1.29 -0.01 0.00 2.02 -1.60 -2.62 112.91 111.99 3kyd h THR 390 Ca -0.00 -1.67 -0.05 0.00 0.77 0.00 0.00 66.41 65.45 3kyd h THR 390 Cb 0.57 1.57 -0.01 0.00 -1.74 0.00 0.00 68.15 68.55 3kyd h THR 390 CO 0.04 0.54 -0.25 0.78 0.37 0.00 0.00 175.52 177.00 3kyd h ASN 391 N 0.61 0.02 -0.32 4.18 2.35 -1.52 -1.74 115.58 119.16 3kyd h ASN 391 Ca 0.03 -0.00 -0.09 0.00 -0.55 0.00 0.00 56.30 55.68 3kyd h ASN 391 Cb 1.05 -0.00 -0.01 0.00 0.05 0.00 0.00 38.32 39.41 3kyd h ASN 391 CO 0.10 0.27 -0.16 0.00 -1.65 0.00 0.00 177.43 175.99 3kyd h ALA 392 N 1.73 0.46 -0.32 -0.83 0.00 -1.33 -1.91 119.26 117.06 3kyd h ALA 392 Ca 0.00 -0.34 -0.00 0.00 0.00 0.00 0.00 54.91 54.56 3kyd h ALA 392 Cb 0.46 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.12 3kyd h ALA 392 CO 0.03 0.37 0.19 0.28 0.00 0.00 0.00 179.25 180.12 3kyd h VAL 393 N 0.45 1.12 -0.50 0.00 2.07 -1.08 -2.12 116.25 116.19 3kyd h VAL 393 Ca 0.07 -0.31 -0.08 0.00 0.82 0.00 0.00 66.70 67.20 3kyd h VAL 393 Cb 0.70 0.74 -0.02 0.00 -1.52 0.00 0.00 31.29 31.19 3kyd h VAL 393 CO 0.05 0.12 -0.00 0.40 0.02 0.00 0.00 177.57 178.16 3kyd h ILE 394 N 0.41 1.26 0.00 4.57 1.08 -1.35 -1.75 117.51 121.73 3kyd h ILE 394 Ca 0.12 -1.09 -0.05 0.00 -0.39 0.00 0.00 64.86 63.44 3kyd h ILE 394 Cb 0.04 0.97 -0.01 0.00 -3.07 0.00 0.00 36.82 34.75 3kyd h ILE 394 CO -0.02 0.38 -0.25 0.00 -0.69 0.00 0.00 178.15 177.57 3kyd h ALA 395 N 0.93 1.54 -0.05 1.87 0.00 -1.26 -0.66 119.26 121.63 3kyd h ALA 395 Ca 0.14 -0.23 -0.18 0.00 0.00 0.00 0.00 54.91 54.64 3kyd h ALA 395 Cb 0.52 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 3kyd h ALA 395 CO 0.03 0.31 -0.74 0.78 0.00 0.00 0.00 179.25 179.63 3kyd h GLY 396 N 0.80 0.36 1.40 0.00 0.00 -1.08 -3.17 103.07 101.38 3kyd h GLY 396 Ca -0.00 -0.52 -0.17 0.00 0.00 0.00 0.00 47.33 46.64 3kyd h GLY 396 CO 0.03 0.46 -0.57 1.41 0.00 0.00 0.00 176.54 177.88 3kyd h LEU 397 N 0.21 0.70 0.05 3.11 3.38 -0.41 -2.83 115.31 119.52 3kyd h LEU 397 Ca -0.03 -0.38 0.03 0.00 0.09 0.00 0.00 57.88 57.58 3kyd h LEU 397 Cb 1.32 -0.20 -0.04 0.00 0.09 0.00 0.00 40.66 41.83 3kyd h LEU 397 CO 0.12 1.12 -0.25 0.40 0.09 0.00 0.00 178.44 179.92 3kyd h ILE 398 N 0.48 0.43 -0.81 1.22 2.04 -1.20 -0.91 117.51 118.76 3kyd h ILE 398 Ca 0.01 0.00 0.04 0.00 1.00 0.00 0.00 64.86 65.90 3kyd h ILE 398 Cb 1.13 0.43 -0.05 0.00 -0.74 0.00 0.00 36.82 37.59 3kyd h ILE 398 CO 0.11 0.00 0.52 0.58 0.00 0.00 0.00 178.15 179.36 3kyd h VAL 399 N -0.42 1.11 -0.45 1.67 2.07 -1.56 0.17 116.25 118.85 3kyd h VAL 399 Ca 0.05 -0.34 -0.04 0.00 0.82 0.00 0.00 66.70 67.18 3kyd h VAL 399 Cb 0.48 0.03 -0.02 0.00 -1.52 0.00 0.00 31.29 30.25 3kyd h VAL 399 CO -0.19 0.18 0.10 -0.07 0.02 0.00 0.00 177.57 177.61 3kyd h LEU 400 N 1.00 0.62 -0.36 2.57 3.38 -1.19 0.87 115.31 122.20 3kyd h LEU 400 Ca 0.33 -0.10 -0.14 0.00 0.09 0.00 0.00 57.88 58.06 3kyd h LEU 400 Cb 0.03 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.61 3kyd h LEU 400 CO -0.12 0.63 -0.31 -0.33 0.09 0.00 0.00 178.44 178.40 3kyd h GLU 401 N 0.65 0.84 -0.52 1.13 4.39 -0.49 -3.17 114.58 117.42 3kyd h GLU 401 Ca 0.15 -0.42 0.09 0.00 0.34 0.00 0.00 59.36 59.51 3kyd h GLU 401 Cb 0.26 0.01 -0.07 0.00 -0.10 0.00 0.00 28.75 28.84 3kyd h GLU 401 CO -0.00 1.06 0.09 0.78 -1.16 0.00 0.00 179.01 179.78 3kyd h GLY 402 N 0.63 0.62 1.33 -3.84 0.00 0.30 -2.56 103.07 99.55 3kyd h GLY 402 Ca 0.06 -0.01 0.01 0.00 0.00 0.00 0.00 47.33 47.39 3kyd h GLY 402 CO 0.08 -0.09 0.44 1.41 0.00 0.00 0.00 176.54 178.39 3kyd h LEU 403 N 0.22 0.76 -0.31 3.11 3.38 -0.85 -1.68 115.31 119.93 3kyd h LEU 403 Ca 0.26 -0.02 -0.14 0.00 0.09 0.00 0.00 57.88 58.07 3kyd h LEU 403 Cb 0.36 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 40.92 3kyd h LEU 403 CO -0.35 0.55 -0.35 0.11 0.09 0.00 0.00 178.44 178.49 3kyd h LYS 404 N 0.89 0.79 0.12 1.13 1.57 -1.44 -1.15 116.57 118.47 3kyd h LYS 404 Ca 0.25 -0.43 -0.01 0.00 -1.87 0.00 0.00 60.65 58.59 3kyd h LYS 404 Cb -0.08 0.02 0.00 0.00 0.08 0.00 0.00 32.23 32.25 3kyd h LYS 404 CO -0.06 1.06 -0.06 0.82 -0.57 0.00 0.00 179.45 180.65 3kyd h ILE 405 N 0.56 0.93 0.00 1.86 2.04 -1.18 0.29 117.51 122.00 3kyd h ILE 405 Ca 0.05 -0.16 0.00 0.00 1.00 0.00 0.00 64.86 65.75 3kyd h ILE 405 Cb 0.93 1.03 0.00 0.00 -0.74 0.00 0.00 36.82 38.04 3kyd h ILE 405 CO 0.08 0.04 0.00 0.18 0.00 0.00 0.00 178.15 178.45 3kyd n LEU 406 N -5.12 0.40 0.01 1.44 4.77 -0.66 -0.39 117.00 117.44 3kyd n LEU 406 Ca -0.08 0.60 0.13 0.00 -0.03 0.00 0.00 56.01 56.62 3kyd n LEU 406 Cb 0.12 -0.55 0.39 0.00 -2.33 0.00 0.00 43.42 41.05 3kyd n LEU 406 CO 0.34 -0.44 0.65 -0.24 -1.33 0.00 0.00 177.39 176.37 3kyd n SER 407 N -1.94 0.35 0.00 -1.43 2.88 -0.44 -4.90 113.62 108.14 3kyd n SER 407 Ca 0.03 0.10 0.00 0.00 -1.33 0.00 0.00 58.87 57.66 3kyd n SER 407 Cb 0.20 -0.08 0.00 0.00 -0.75 0.00 0.00 64.21 63.58 3kyd n SER 407 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3kyd n GLY 408 N 1.48 0.43 2.59 0.46 0.00 0.48 -4.97 105.19 105.66 3kyd n GLY 408 Ca 0.06 -0.86 -0.32 0.00 0.00 0.00 0.00 46.02 44.90 3kyd n GLY 408 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3kyd n LYS 409 N -2.94 3.14 0.13 1.61 5.02 0.95 -4.77 118.16 121.29 3kyd n LYS 409 Ca 0.00 -4.01 0.05 0.00 -2.02 0.00 0.00 58.31 52.32 3kyd n LYS 409 Cb 0.00 -2.26 0.48 0.00 -0.02 0.00 0.00 35.03 33.22 3kyd n LYS 409 CO 0.00 0.00 0.00 0.82 -0.52 0.00 0.00 177.40 177.70 3kyd h ILE 410 N 2.20 1.10 0.00 -0.18 1.08 -1.84 -0.47 117.51 119.40 3kyd h ILE 410 Ca 0.43 -0.36 0.00 0.00 -0.39 0.00 0.00 64.86 64.54 3kyd h ILE 410 Cb 0.63 0.93 0.00 0.00 -3.07 0.00 0.00 36.82 35.31 3kyd h ILE 410 CO 1.12 0.12 0.05 -2.24 -0.69 0.00 0.00 178.15 176.52 3kyd h ASP 411 N 0.26 0.00 0.09 1.72 2.03 -1.94 -0.05 116.42 118.53 3kyd h ASP 411 Ca 0.06 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.36 3kyd h ASP 411 Cb 0.12 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.62 3kyd h ASP 411 CO -0.00 0.00 -0.66 0.00 -1.03 0.00 0.00 179.24 177.55 3kyd n GLN 412 N -2.31 0.52 -1.43 4.15 6.02 -0.19 -4.97 117.38 119.16 3kyd n GLN 412 Ca -0.01 -0.40 -0.32 0.00 -0.01 0.00 0.00 57.00 56.25 3kyd n GLN 412 Cb 0.09 -1.49 0.08 0.00 1.02 0.00 0.00 30.24 29.94 3kyd n GLN 412 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3kyd s ARG 414 N -4.35 0.65 -0.36 0.00 6.06 -1.26 -4.52 118.95 115.18 3kyd s ARG 414 Ca 0.67 -0.49 -0.24 0.00 -2.50 0.00 0.00 55.73 53.16 3kyd s ARG 414 Cb -0.21 0.28 0.01 0.00 0.06 0.00 0.00 34.95 35.08 3kyd s ARG 414 CO 0.48 -0.18 0.83 0.99 -2.50 0.00 0.00 175.30 174.92 3kyd s THR 415 N -2.09 4.69 -0.27 4.11 2.01 0.78 -4.53 115.64 120.34 3kyd s THR 415 Ca -0.09 1.02 -0.08 0.00 0.31 0.00 0.00 61.69 62.85 3kyd s THR 415 Cb -0.03 -4.24 -0.02 0.00 0.01 0.00 0.00 72.50 68.21 3kyd s THR 415 CO -0.01 -0.45 0.10 -0.63 -0.69 0.00 0.00 174.62 172.94 3kyd s ILE 416 N 3.21 4.38 -0.09 1.82 1.01 0.83 -0.16 121.20 132.19 3kyd s ILE 416 Ca 0.34 -0.29 -0.09 0.00 0.00 0.00 0.00 60.65 60.61 3kyd s ILE 416 Cb -0.13 -3.12 -0.04 0.00 0.01 0.00 0.00 42.46 39.17 3kyd s ILE 416 CO 0.17 0.23 0.20 -0.36 0.00 0.00 0.00 174.94 175.19 3kyd s PHE 417 N 1.61 3.62 -0.15 3.97 0.40 0.64 -0.82 117.98 127.24 3kyd s PHE 417 Ca 0.05 0.63 -0.06 0.00 -0.60 0.00 0.00 56.93 56.95 3kyd s PHE 417 Cb -0.16 -2.03 -0.04 0.00 0.51 0.00 0.00 43.02 41.30 3kyd s PHE 417 CO 0.04 0.70 0.06 -1.17 0.70 0.00 0.00 175.22 175.56 3kyd s LEU 418 N -0.99 3.87 0.34 -0.37 2.96 0.22 -0.34 118.68 124.38 3kyd s LEU 418 Ca 0.17 0.16 0.07 0.00 -0.22 0.00 0.00 54.13 54.31 3kyd s LEU 418 Cb -0.13 -1.96 -0.03 0.00 0.50 0.00 0.00 46.19 44.58 3kyd s LEU 418 CO 0.06 0.25 0.29 0.20 -1.32 0.00 0.00 176.35 175.84 3kyd s ASN 419 N -0.10 5.25 -0.10 3.68 0.02 -0.14 -3.66 114.94 119.89 3kyd s ASN 419 Ca 0.07 -0.52 -0.18 0.00 -1.02 0.00 0.00 52.86 51.21 3kyd s ASN 419 Cb -0.12 -0.93 -0.28 0.00 0.02 0.00 0.00 41.25 39.94 3kyd s ASN 419 CO 0.01 -0.37 0.62 0.50 0.02 0.00 0.00 177.10 177.88 3kyd h LYS 420 N 1.24 0.24 -6.40 -0.60 3.64 -1.87 -3.46 116.57 109.36 3kyd h LYS 420 Ca -0.44 -0.41 -0.61 0.00 -1.27 0.00 0.00 60.65 57.92 3kyd h LYS 420 Cb 1.25 0.15 -0.19 0.00 -0.41 0.00 0.00 32.23 33.03 3kyd h LYS 420 CO 0.58 1.20 -0.82 -0.65 -2.27 0.00 0.00 179.45 177.49 3kyd s GLN 421 N -2.45 1.39 0.32 1.90 -0.21 -1.26 -5.11 119.66 114.23 3kyd s GLN 421 Ca -0.19 -1.43 -0.29 0.00 0.02 0.00 0.00 55.36 53.47 3kyd s GLN 421 Cb 0.03 -1.65 -0.11 0.00 1.00 0.00 0.00 33.01 32.29 3kyd s GLN 421 CO 0.77 0.36 1.47 -2.14 -2.12 0.00 0.00 175.29 173.63 3kyd s PRO 422 N -2.54 4.19 1.10 2.91 0.02 -1.26 -4.72 135.00 134.70 3kyd s PRO 422 Ca 0.17 2.45 -0.18 0.00 0.02 0.00 0.00 61.00 63.46 3kyd s PRO 422 Cb -0.08 -3.03 0.25 0.00 0.02 0.00 0.00 34.50 31.66 3kyd s PRO 422 CO 0.08 -0.47 1.22 0.54 -0.33 0.00 0.00 177.00 178.03 3kyd s ASN 423 N 0.07 1.88 0.53 2.53 2.20 -0.74 -4.76 114.94 116.65 3kyd s ASN 423 Ca 0.56 0.42 0.22 0.00 -0.94 0.00 0.00 52.86 53.12 3kyd s ASN 423 Cb -0.45 -0.54 1.36 0.00 -2.00 0.00 0.00 41.25 39.62 3kyd s ASN 423 CO 0.53 -3.51 2.06 1.55 -2.94 0.00 0.00 177.10 174.79 3kyd h PRO 424 N -2.17 0.00 -0.49 3.55 0.13 -1.95 0.38 132.00 131.45 3kyd h PRO 424 Ca -0.44 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.69 3kyd h PRO 424 Cb 1.26 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.39 3kyd h PRO 424 CO 0.34 0.00 0.00 0.54 -0.23 0.00 0.00 178.00 178.65 3kyd n ARG 425 N -4.42 1.51 -2.36 0.86 1.74 -1.26 -4.89 116.66 107.84 3kyd n ARG 425 Ca 0.04 -0.54 -0.16 0.00 -0.77 0.00 0.00 57.85 56.42 3kyd n ARG 425 Cb 0.39 -1.35 -0.00 0.00 -1.02 0.00 0.00 32.46 30.48 3kyd n ARG 425 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 3kyd n LYS 426 N 0.00 -1.55 -3.87 5.56 5.02 0.13 -5.00 118.16 118.46 3kyd n LYS 426 Ca 0.05 0.78 -0.36 0.00 -2.02 0.00 0.00 58.31 56.76 3kyd n LYS 426 Cb 0.26 -5.18 -0.13 0.00 -0.02 0.00 0.00 35.03 29.96 3kyd n LYS 426 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 3kyd s LYS 427 N -4.87 3.53 -0.14 1.97 1.02 -1.25 -4.76 119.74 115.25 3kyd s LYS 427 Ca 0.02 -0.55 0.09 0.00 0.02 0.00 0.00 55.97 55.56 3kyd s LYS 427 Cb -0.01 -3.15 -0.23 0.00 -0.52 0.00 0.00 37.83 33.91 3kyd s LYS 427 CO 0.03 -0.16 0.29 -0.11 -0.92 0.00 0.00 175.35 174.48 3kyd n LEU 428 N 4.77 1.28 -4.40 3.17 7.94 -1.26 -1.80 117.00 126.70 3kyd n LEU 428 Ca -0.17 0.17 -0.35 0.00 -1.11 0.00 0.00 56.01 54.55 3kyd n LEU 428 Cb 0.51 -0.15 -0.13 0.00 0.53 0.00 0.00 43.42 44.18 3kyd n LEU 428 CO 0.30 0.60 -0.34 -0.76 -1.11 0.00 0.00 177.39 176.07 3kyd s LEU 429 N -6.16 3.16 -0.37 -1.96 1.43 -1.26 -0.97 118.68 112.55 3kyd s LEU 429 Ca -0.14 -0.27 -0.04 0.00 -1.03 0.00 0.00 54.13 52.65 3kyd s LEU 429 Cb 0.07 -1.81 0.08 0.00 0.03 0.00 0.00 46.19 44.56 3kyd s LEU 429 CO 0.78 0.02 0.14 -0.69 0.23 0.00 0.00 176.35 176.82 3kyd s VAL 430 N 1.28 3.38 0.16 -1.59 1.01 0.54 -4.94 120.40 120.24 3kyd s VAL 430 Ca 0.04 -1.64 -0.25 0.00 0.00 0.00 0.00 61.98 60.12 3kyd s VAL 430 Cb -0.15 -3.12 -0.08 0.00 0.00 0.00 0.00 36.38 33.04 3kyd s VAL 430 CO 0.01 -0.42 0.78 -2.16 0.00 0.00 0.00 175.10 173.31 3kyd s PRO 431 N 1.25 4.57 0.02 2.72 0.04 -1.26 -0.26 135.00 142.08 3kyd s PRO 431 Ca 0.02 1.16 0.02 0.00 0.04 0.00 0.00 61.00 62.25 3kyd s PRO 431 Cb -0.21 -3.27 -0.02 0.00 0.04 0.00 0.00 34.50 31.04 3kyd s PRO 431 CO -0.02 0.55 -0.08 0.00 0.04 0.00 0.00 177.00 177.50 3kyd n ALA 433 N 2.14 1.20 -2.28 0.00 0.00 -1.26 -0.16 120.51 120.16 3kyd n ALA 433 Ca -0.18 0.24 -0.41 0.00 0.00 0.00 0.00 53.44 53.08 3kyd n ALA 433 Cb 0.56 -2.26 -0.04 0.00 0.00 0.00 0.00 19.45 17.72 3kyd n ALA 433 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3kyd s LEU 434 N -1.77 4.44 0.21 0.00 1.43 -1.26 -4.65 118.68 117.08 3kyd s LEU 434 Ca 0.63 1.97 -0.25 0.00 -1.03 0.00 0.00 54.13 55.44 3kyd s LEU 434 Cb -0.50 -3.59 -0.08 0.00 0.03 0.00 0.00 46.19 42.05 3kyd s LEU 434 CO 0.57 -0.27 0.81 -1.81 0.23 0.00 0.00 176.35 175.88 3kyd s ASP 435 N 0.36 7.36 0.86 2.29 1.01 -1.26 -4.98 116.67 122.31 3kyd s ASP 435 Ca 0.52 1.67 -0.11 0.00 0.71 0.00 0.00 52.55 55.34 3kyd s ASP 435 Cb -0.27 -2.51 0.11 0.00 1.01 0.00 0.00 42.92 41.26 3kyd s ASP 435 CO 0.32 0.14 1.10 -2.16 0.21 0.00 0.00 175.17 174.78 3kyd s PRO 436 N -1.41 1.51 0.33 8.23 0.04 -1.26 -1.14 135.00 141.29 3kyd s PRO 436 Ca 0.39 1.17 -0.27 0.00 0.04 0.00 0.00 61.00 62.33 3kyd s PRO 436 Cb -0.22 -1.81 -0.13 0.00 0.04 0.00 0.00 34.50 32.38 3kyd s PRO 436 CO 0.26 -2.17 1.10 -2.30 0.04 0.00 0.00 177.00 173.93 3kyd n PRO 437 N -3.88 1.61 -2.69 0.56 -0.02 -1.25 -4.15 135.00 125.18 3kyd n PRO 437 Ca 0.09 0.57 -0.43 0.00 -2.02 0.00 0.00 63.50 61.71 3kyd n PRO 437 Cb 0.53 -2.03 -0.03 0.00 -0.02 0.00 0.00 33.50 31.95 3kyd n PRO 437 CO 0.00 0.00 0.00 1.21 1.98 0.00 0.00 175.50 178.69 3kyd s ASN 438 N -0.50 6.77 0.59 2.55 2.47 -1.26 -4.92 114.94 120.64 3kyd s ASN 438 Ca 0.58 0.74 0.29 0.00 0.42 0.00 0.00 52.86 54.89 3kyd s ASN 438 Cb -0.64 -2.52 1.49 0.00 -1.45 0.00 0.00 41.25 38.14 3kyd s ASN 438 CO 0.60 -0.96 1.91 -0.65 -3.72 0.00 0.00 177.10 174.28 3kyd h PRO 439 N 8.49 0.00 -0.01 0.43 0.11 -1.97 -0.61 132.00 138.44 3kyd h PRO 439 Ca -0.22 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.89 3kyd h PRO 439 Cb 1.07 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.18 3kyd h PRO 439 CO 1.04 0.00 -0.34 0.09 -0.21 0.00 0.00 178.00 178.57 3kyd n ASN 440 N -3.68 1.49 -4.66 -2.05 3.02 -1.26 -4.83 115.26 103.29 3kyd n ASN 440 Ca 0.08 -1.19 -0.46 0.00 -0.03 0.00 0.00 54.58 52.98 3kyd n ASN 440 Cb 0.64 0.28 -0.03 0.00 -0.61 0.00 0.00 39.78 40.05 3kyd n ASN 440 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3kyd n TYR 442 N 2.39 0.11 0.02 0.00 0.18 -1.26 -3.60 117.16 115.00 3kyd n TYR 442 Ca 0.14 -0.05 -0.01 0.00 1.88 0.00 0.00 57.90 59.86 3kyd n TYR 442 Cb 0.30 0.00 -0.00 0.00 -0.38 0.00 0.00 39.34 39.25 3kyd n TYR 442 CO 0.00 0.00 0.00 0.28 -2.08 0.00 0.00 176.86 175.06 3kyd n VAL 443 N -0.30 0.72 1.09 -3.48 0.31 -1.26 -4.74 118.33 110.67 3kyd n VAL 443 Ca 0.10 0.24 0.13 0.00 -0.01 0.00 0.00 64.34 64.80 3kyd n VAL 443 Cb 0.13 -1.43 0.42 0.00 -0.91 0.00 0.00 33.84 32.05 3kyd n VAL 443 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3kyd s ALA 445 N -2.86 2.95 0.00 0.00 0.00 -1.24 -5.00 121.76 115.62 3kyd s ALA 445 Ca 0.16 0.13 -0.30 0.00 0.00 0.00 0.00 51.96 51.95 3kyd s ALA 445 Cb 0.18 -3.14 -0.04 0.00 0.00 0.00 0.00 23.12 20.12 3kyd s ALA 445 CO 0.60 -0.63 1.18 0.45 0.00 0.00 0.00 175.76 177.36 3kyd s SER 446 N -3.43 7.10 -0.96 0.00 0.15 -1.26 -3.99 113.70 111.31 3kyd s SER 446 Ca 0.59 1.88 -0.05 0.00 0.70 0.00 0.00 55.95 59.07 3kyd s SER 446 Cb -0.12 -2.57 -0.04 0.00 -1.71 0.00 0.00 66.02 61.58 3kyd s SER 446 CO 0.42 -0.50 0.83 0.29 1.20 0.00 0.00 173.24 175.49 3kyd n LYS 447 N 4.52 -1.86 -2.60 5.44 4.76 -1.26 -4.98 118.16 122.18 3kyd n LYS 447 Ca 0.10 1.03 -0.35 0.00 -2.87 0.00 0.00 58.31 56.22 3kyd n LYS 447 Cb 0.47 -5.61 -0.04 0.00 -1.84 0.00 0.00 35.03 28.01 3kyd n LYS 447 CO 0.00 0.00 0.00 -1.25 -1.37 0.00 0.00 177.40 174.78 3kyd s PRO 448 N -4.09 4.04 -0.11 1.97 0.04 -1.26 -5.01 135.00 130.59 3kyd s PRO 448 Ca 0.31 1.38 -0.09 0.00 0.04 0.00 0.00 61.00 62.63 3kyd s PRO 448 Cb -0.05 -2.31 0.03 0.00 0.04 0.00 0.00 34.50 32.21 3kyd s PRO 448 CO 0.76 -0.22 0.28 -2.00 0.04 0.00 0.00 177.00 175.85 3kyd s GLU 449 N -2.89 0.31 0.25 4.56 2.12 -1.26 -2.75 118.70 119.03 3kyd s GLU 449 Ca 0.62 0.42 0.01 0.00 0.36 0.00 0.00 54.97 56.39 3kyd s GLU 449 Cb -0.17 0.11 -0.01 0.00 0.26 0.00 0.00 34.13 34.32 3kyd s GLU 449 CO 0.22 -0.06 0.05 1.33 -0.54 0.00 0.00 175.26 176.26 3kyd n VAL 450 N 3.16 0.00 -3.72 3.70 0.24 -0.08 -4.97 118.33 116.67 3kyd n VAL 450 Ca -0.15 -1.33 -0.13 0.00 -2.04 0.00 0.00 64.34 60.70 3kyd n VAL 450 Cb 0.57 0.40 -0.13 0.00 -1.47 0.00 0.00 33.84 33.21 3kyd n VAL 450 CO 0.00 0.00 0.00 -0.89 -2.14 0.00 0.00 176.83 173.80 3kyd s THR 451 N -2.26 -0.09 -0.10 3.34 2.01 -1.26 -1.99 115.64 115.29 3kyd s THR 451 Ca 0.07 0.17 0.03 0.00 0.31 0.00 0.00 61.69 62.27 3kyd s THR 451 Cb 0.00 -0.39 0.01 0.00 0.01 0.00 0.00 72.50 72.13 3kyd s THR 451 CO 0.05 0.07 -0.18 -0.69 -0.69 0.00 0.00 174.62 173.18 3kyd s VAL 452 N 1.42 1.67 -0.20 3.82 1.01 0.88 -1.90 120.40 127.10 3kyd s VAL 452 Ca -0.08 -0.78 -0.11 0.00 0.00 0.00 0.00 61.98 61.01 3kyd s VAL 452 Cb -0.11 -1.48 -0.05 0.00 0.00 0.00 0.00 36.38 34.74 3kyd s VAL 452 CO -0.09 0.47 0.18 -0.60 0.00 0.00 0.00 175.10 175.07 3kyd s ARG 453 N 0.64 4.18 0.17 2.72 3.52 0.22 -1.87 118.95 128.52 3kyd s ARG 453 Ca -0.13 -0.14 -0.17 0.00 -0.13 0.00 0.00 55.73 55.15 3kyd s ARG 453 Cb -0.16 -3.45 0.03 0.00 -1.56 0.00 0.00 34.95 29.81 3kyd s ARG 453 CO 0.04 0.22 0.48 -0.48 -0.81 0.00 0.00 175.30 174.75 3kyd s LEU 454 N 0.58 0.15 -0.41 -0.88 2.34 -0.91 -0.30 118.68 119.24 3kyd s LEU 454 Ca 0.10 -0.41 -0.22 0.00 0.06 0.00 0.00 54.13 53.67 3kyd s LEU 454 Cb -0.12 2.05 0.02 0.00 -0.56 0.00 0.00 46.19 47.58 3kyd s LEU 454 CO 0.01 -0.98 0.72 0.21 -1.06 0.00 0.00 176.35 175.25 3kyd s ASN 455 N -2.85 6.42 0.39 1.48 3.04 -1.23 -2.27 114.94 119.92 3kyd s ASN 455 Ca 0.07 -0.04 0.21 0.00 0.04 0.00 0.00 52.86 53.14 3kyd s ASN 455 Cb 0.00 -2.36 0.63 0.00 -1.54 0.00 0.00 41.25 37.98 3kyd s ASN 455 CO -0.06 -0.79 1.70 1.62 -3.04 0.00 0.00 177.10 176.53 3kyd h VAL 456 N 5.86 0.65 0.00 -5.21 3.04 -1.88 -2.04 116.25 116.66 3kyd h VAL 456 Ca -0.25 -1.46 0.00 0.00 -1.01 0.00 0.00 66.70 63.98 3kyd h VAL 456 Cb 1.09 1.98 0.00 0.00 -2.01 0.00 0.00 31.29 32.35 3kyd h VAL 456 CO 0.91 0.30 -0.36 1.41 -1.01 0.00 0.00 177.57 178.82 3kyd n HIS 457 N -3.35 0.63 -0.09 3.17 8.25 -1.26 -3.63 115.22 118.95 3kyd n HIS 457 Ca 0.01 0.18 -0.18 0.00 -0.26 0.00 0.00 57.72 57.47 3kyd n HIS 457 Cb 0.53 -0.73 -0.06 0.00 1.12 0.00 0.00 29.99 30.85 3kyd n HIS 457 CO 0.00 0.00 0.00 1.17 0.64 0.00 0.00 176.34 178.15 3kyd n LYS 458 N -2.09 0.39 -2.25 -0.41 3.00 -1.17 -4.99 118.16 110.63 3kyd n LYS 458 Ca 0.04 0.17 -0.42 0.00 -0.00 0.00 0.00 58.31 58.11 3kyd n LYS 458 Cb 0.42 -1.16 -0.03 0.00 0.00 0.00 0.00 35.03 34.26 3kyd n LYS 458 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.40 177.48 3kyd s VAL 459 N -2.39 3.44 0.51 3.15 1.01 -0.78 -5.00 120.40 120.35 3kyd s VAL 459 Ca -0.25 1.09 0.08 0.00 0.00 0.00 0.00 61.98 62.90 3kyd s VAL 459 Cb 0.09 -3.70 0.05 0.00 0.00 0.00 0.00 36.38 32.82 3kyd s VAL 459 CO 0.33 0.11 0.63 0.42 0.00 0.00 0.00 175.10 176.59 3kyd s THR 460 N 0.71 2.36 0.26 3.92 -4.23 -1.26 -3.43 115.64 113.96 3kyd s THR 460 Ca 0.60 -1.11 -0.03 0.00 -1.18 0.00 0.00 61.69 59.97 3kyd s THR 460 Cb -0.35 -2.47 0.14 0.00 1.34 0.00 0.00 72.50 71.16 3kyd s THR 460 CO 0.33 0.00 1.79 0.58 -0.54 0.00 0.00 174.62 176.78 3kyd h VAL 461 N 0.48 1.24 -0.75 2.29 2.07 -1.44 0.12 116.25 120.26 3kyd h VAL 461 Ca -0.35 -0.88 -0.04 0.00 0.82 0.00 0.00 66.70 66.25 3kyd h VAL 461 Cb 1.29 0.66 -0.03 0.00 -1.52 0.00 0.00 31.29 31.69 3kyd h VAL 461 CO 0.46 0.33 0.30 0.25 0.02 0.00 0.00 177.57 178.92 3kyd h LEU 462 N 0.86 1.04 -0.72 2.57 5.85 -1.60 0.46 115.31 123.76 3kyd h LEU 462 Ca 0.18 -0.16 -0.14 0.00 0.84 0.00 0.00 57.88 58.61 3kyd h LEU 462 Cb 0.33 -0.27 -0.01 0.00 0.37 0.00 0.00 40.66 41.08 3kyd h LEU 462 CO 0.00 0.92 -0.58 0.74 -0.34 0.00 0.00 178.44 179.19 3kyd h THR 463 N 1.10 1.38 -0.20 1.05 2.02 -1.70 -0.53 112.91 116.03 3kyd h THR 463 Ca 0.25 -1.93 -0.05 0.00 0.77 0.00 0.00 66.41 65.45 3kyd h THR 463 Cb 0.21 1.97 -0.01 0.00 -1.74 0.00 0.00 68.15 68.59 3kyd h THR 463 CO -0.02 0.57 -0.09 0.25 0.37 0.00 0.00 175.52 176.60 3kyd h LEU 464 N 0.15 0.42 0.37 2.58 5.85 -0.20 -2.66 115.31 121.81 3kyd h LEU 464 Ca -0.00 -0.40 -0.02 0.00 0.84 0.00 0.00 57.88 58.29 3kyd h LEU 464 Cb 1.06 -0.12 0.00 0.00 0.37 0.00 0.00 40.66 41.98 3kyd h LEU 464 CO 0.09 0.73 -0.18 -0.61 -0.34 0.00 0.00 178.44 178.13 3kyd h GLN 465 N 0.11 -0.48 0.00 1.25 4.15 -0.01 0.34 115.11 120.48 3kyd h GLN 465 Ca 0.05 0.03 -0.03 0.00 0.77 0.00 0.00 58.65 59.47 3kyd h GLN 465 Cb 0.57 0.11 -0.00 0.00 0.21 0.00 0.00 27.48 28.36 3kyd h GLN 465 CO 0.03 -0.17 -0.14 -0.44 -1.93 0.00 0.00 178.83 176.18 3kyd h ASP 466 N -0.97 0.00 0.00 -0.69 3.32 -1.24 0.32 116.42 117.15 3kyd h ASP 466 Ca -0.05 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.00 3kyd h ASP 466 Cb 0.53 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.08 3kyd h ASP 466 CO 0.08 0.14 -0.10 0.29 -1.72 0.00 0.00 179.24 177.93 3kyd n LYS 467 N -3.14 5.44 0.00 3.56 5.02 -1.01 -3.61 118.16 124.41 3kyd n LYS 467 Ca 0.03 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.32 3kyd n LYS 467 Cb 0.58 -0.49 0.00 0.00 -0.02 0.00 0.00 35.03 35.10 3kyd n LYS 467 CO 0.00 0.00 0.00 -0.89 -0.52 0.00 0.00 177.40 175.99 3kyd n ILE 468 N -0.92 0.00 0.01 -0.18 5.41 -0.95 -3.83 119.36 118.90 3kyd n ILE 468 Ca 0.00 0.00 -0.22 0.00 1.00 0.00 0.00 62.75 63.53 3kyd n ILE 468 Cb 0.00 -0.72 -0.14 0.00 -0.71 0.00 0.00 39.64 38.08 3kyd n ILE 468 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 176.55 177.13 3kyd h VAL 469 N 0.00 0.93 0.13 1.39 2.07 -0.36 -3.16 116.25 117.25 3kyd h VAL 469 Ca 0.00 -2.39 -0.35 0.00 0.82 0.00 0.00 66.70 64.79 3kyd h VAL 469 Cb 0.98 2.64 -0.01 0.00 -1.52 0.00 0.00 31.29 33.38 3kyd h VAL 469 CO 0.00 0.74 -1.84 0.11 0.02 0.00 0.00 177.57 176.59 3kyd h LYS 470 N -0.23 0.28 0.02 1.57 1.57 -1.14 -3.03 116.57 115.62 3kyd h LYS 470 Ca -0.34 -0.47 -0.00 0.00 -1.87 0.00 0.00 60.65 57.97 3kyd h LYS 470 Cb 1.83 0.18 0.00 0.00 0.08 0.00 0.00 32.23 34.31 3kyd h LYS 470 CO 0.06 1.23 -0.01 1.49 -0.57 0.00 0.00 179.45 181.65 3kyd h GLU 471 N -0.03 -0.03 0.29 3.15 4.81 -1.76 -2.90 114.58 118.11 3kyd h GLU 471 Ca -0.39 0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 58.83 3kyd h GLU 471 Cb 1.98 0.01 0.00 0.00 0.63 0.00 0.00 28.75 31.37 3kyd h GLU 471 CO 0.09 -0.02 -0.14 -0.22 -0.73 0.00 0.00 179.01 177.99 3kyd h LYS 472 N -0.66 -0.37 -0.08 1.92 1.63 -1.69 -3.19 116.57 114.13 3kyd h LYS 472 Ca -0.00 0.03 0.00 0.00 -0.85 0.00 0.00 60.65 59.82 3kyd h LYS 472 Cb 0.02 0.08 0.00 0.00 -0.60 0.00 0.00 32.23 31.74 3kyd h LYS 472 CO 0.00 -0.06 0.00 1.19 -3.45 0.00 0.00 179.45 177.14 3kyd n PHE 473 N -5.12 0.10 -3.93 1.91 0.99 -1.19 -4.94 117.46 105.28 3kyd n PHE 473 Ca -0.09 -0.05 -0.28 0.00 -0.00 0.00 0.00 57.45 57.02 3kyd n PHE 473 Cb 0.26 0.00 0.01 0.00 -1.00 0.00 0.00 39.48 38.75 3kyd n PHE 473 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 3kyd n ALA 474 N -0.31 -1.59 -2.49 4.37 0.00 -1.11 -4.93 120.51 114.45 3kyd n ALA 474 Ca 0.12 -0.01 -0.30 0.00 0.00 0.00 0.00 53.44 53.25 3kyd n ALA 474 Cb 0.15 -3.16 -0.04 0.00 0.00 0.00 0.00 19.45 16.40 3kyd n ALA 474 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 3kyd s MET 475 N -6.51 3.68 -0.12 0.00 -1.94 -1.14 -4.72 119.30 108.54 3kyd s MET 475 Ca 0.40 0.08 -0.11 0.00 -1.71 0.00 0.00 55.69 54.35 3kyd s MET 475 Cb -0.21 -2.65 -0.05 0.00 2.01 0.00 0.00 34.83 33.93 3kyd s MET 475 CO 0.85 0.24 -0.23 0.28 -0.01 0.00 0.00 175.02 176.16 3kyd n VAL 476 N -0.70 1.26 -3.44 -6.03 0.31 -1.26 -4.46 118.33 104.01 3kyd n VAL 476 Ca -0.01 0.05 -0.27 0.00 -0.01 0.00 0.00 64.34 64.11 3kyd n VAL 476 Cb 0.53 -1.96 -0.08 0.00 -0.91 0.00 0.00 33.84 31.42 3kyd n VAL 476 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3kyd n ALA 477 N -4.01 3.66 -2.04 3.52 0.00 -1.26 -5.07 120.51 115.31 3kyd n ALA 477 Ca -0.19 -4.45 -0.31 0.00 0.00 0.00 0.00 53.44 48.50 3kyd n ALA 477 Cb 0.49 -0.90 -0.02 0.00 0.00 0.00 0.00 19.45 19.02 3kyd n ALA 477 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 3kyd s PRO 478 N -2.04 3.77 -0.07 0.00 0.04 -1.26 -4.06 135.00 131.37 3kyd s PRO 478 Ca 0.37 0.62 0.00 0.00 0.04 0.00 0.00 61.00 62.03 3kyd s PRO 478 Cb 0.13 -2.26 0.02 0.00 0.04 0.00 0.00 34.50 32.43 3kyd s PRO 478 CO -0.05 -0.22 -0.05 -0.51 0.04 0.00 0.00 177.00 176.21 3kyd s ASP 479 N -3.43 1.57 -0.12 6.66 1.01 0.25 -2.64 116.67 119.98 3kyd s ASP 479 Ca 0.54 -0.18 0.03 0.00 0.71 0.00 0.00 52.55 53.65 3kyd s ASP 479 Cb -0.10 -0.60 0.01 0.00 1.01 0.00 0.00 42.92 43.24 3kyd s ASP 479 CO 0.37 -0.10 -0.22 -0.69 0.21 0.00 0.00 175.17 174.73 3kyd s VAL 480 N 1.43 1.99 0.09 -1.27 1.01 -0.11 -0.37 120.40 123.18 3kyd s VAL 480 Ca -0.02 -0.96 0.06 0.00 0.00 0.00 0.00 61.98 61.06 3kyd s VAL 480 Cb -0.13 -1.75 -0.03 0.00 0.00 0.00 0.00 36.38 34.46 3kyd s VAL 480 CO -0.03 0.54 -0.14 0.00 0.00 0.00 0.00 175.10 175.46 3kyd s GLN 481 N 0.65 0.90 0.09 2.72 -2.07 -1.07 -0.43 119.66 120.45 3kyd s GLN 481 Ca -0.12 -1.07 -0.26 0.00 -1.82 0.00 0.00 55.36 52.10 3kyd s GLN 481 Cb -0.16 -0.88 -0.06 0.00 -1.09 0.00 0.00 33.01 30.82 3kyd s GLN 481 CO 0.02 0.18 0.80 0.42 -1.32 0.00 0.00 175.29 175.39 3kyd s ILE 482 N -1.59 4.59 -0.40 3.63 1.01 -1.08 -1.01 121.20 126.36 3kyd s ILE 482 Ca 0.02 1.71 -0.29 0.00 0.00 0.00 0.00 60.65 62.10 3kyd s ILE 482 Cb -0.08 -4.15 0.01 0.00 0.01 0.00 0.00 42.46 38.25 3kyd s ILE 482 CO 0.03 0.40 1.35 -1.61 0.00 0.00 0.00 174.94 175.11 3kyd s GLU 483 N -0.36 3.67 0.00 2.79 0.41 0.31 -3.75 118.70 121.76 3kyd s GLU 483 Ca 0.39 0.94 0.00 0.00 -0.41 0.00 0.00 54.97 55.89 3kyd s GLU 483 Cb -0.22 -3.98 0.00 0.00 -1.78 0.00 0.00 34.13 28.16 3kyd s GLU 483 CO 0.25 -1.45 0.04 -0.40 -0.49 0.00 0.00 175.26 173.21 3kyd n ASP 484 N 8.43 0.00 -1.81 -0.19 5.75 -1.26 -4.57 116.55 122.90 3kyd n ASP 484 Ca 0.15 -0.68 -0.11 0.00 -0.01 0.00 0.00 54.79 54.14 3kyd n ASP 484 Cb 0.48 0.00 0.03 0.00 -1.03 0.00 0.00 41.12 40.60 3kyd n ASP 484 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3kyd n GLY 485 N 0.00 0.17 1.40 6.12 0.00 -1.26 -4.88 105.19 106.74 3kyd n GLY 485 Ca 0.00 -0.28 0.00 0.00 0.00 0.00 0.00 46.02 45.74 3kyd n GLY 485 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 3kyd n LYS 486 N -2.52 0.00 -2.03 1.61 4.81 -1.26 -5.10 118.16 113.66 3kyd n LYS 486 Ca -0.02 0.00 -0.04 0.00 -0.87 0.00 0.00 58.31 57.38 3kyd n LYS 486 Cb 0.54 -0.13 0.02 0.00 0.02 0.00 0.00 35.03 35.49 3kyd n LYS 486 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3kyd n GLY 487 N 1.03 0.34 3.68 3.14 0.00 -1.25 -5.00 105.19 107.12 3kyd n GLY 487 Ca 0.00 -0.09 -0.43 0.00 0.00 0.00 0.00 46.02 45.50 3kyd n GLY 487 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3kyd s THR 488 N -3.10 4.44 -0.55 2.61 2.01 -1.26 -4.84 115.64 114.95 3kyd s THR 488 Ca 0.10 1.75 -0.28 0.00 0.31 0.00 0.00 61.69 63.57 3kyd s THR 488 Cb -0.01 -4.12 0.02 0.00 0.01 0.00 0.00 72.50 68.39 3kyd s THR 488 CO 0.20 -0.06 1.29 -0.63 -0.69 0.00 0.00 174.62 174.73 3kyd s ILE 489 N 2.60 3.93 -0.13 1.82 1.01 -1.26 -2.63 121.20 126.55 3kyd s ILE 489 Ca 0.52 0.84 -0.21 0.00 0.00 0.00 0.00 60.65 61.80 3kyd s ILE 489 Cb -0.21 -4.56 -0.19 0.00 0.01 0.00 0.00 42.46 37.51 3kyd s ILE 489 CO 0.17 -1.20 0.58 -0.07 0.00 0.00 0.00 174.94 174.41 3kyd h LEU 490 N 12.34 -0.01 -8.46 2.97 3.38 -1.12 -3.46 115.31 120.95 3kyd h LEU 490 Ca -0.26 -0.71 -0.67 0.00 0.09 0.00 0.00 57.88 56.33 3kyd h LEU 490 Cb 1.07 0.00 -0.30 0.00 0.09 0.00 0.00 40.66 41.52 3kyd h LEU 490 CO 1.17 0.84 -0.83 -0.63 0.09 0.00 0.00 178.44 179.08 3kyd s ILE 491 N -2.11 2.48 -0.13 1.22 1.01 -1.01 -4.88 121.20 117.78 3kyd s ILE 491 Ca -0.14 -0.87 0.02 0.00 0.00 0.00 0.00 60.65 59.67 3kyd s ILE 491 Cb -0.02 -1.99 0.00 0.00 0.01 0.00 0.00 42.46 40.46 3kyd s ILE 491 CO 0.50 0.55 -0.21 -0.55 0.00 0.00 0.00 174.94 175.23 3kyd s SER 492 N 0.34 3.28 0.35 3.58 0.15 -1.26 -0.93 113.70 119.20 3kyd s SER 492 Ca -0.15 -0.54 0.11 0.00 0.70 0.00 0.00 55.95 56.07 3kyd s SER 492 Cb -0.17 -1.47 0.63 0.00 -1.71 0.00 0.00 66.02 63.30 3kyd s SER 492 CO 0.08 0.11 1.78 0.77 1.20 0.00 0.00 173.24 177.18 3kyd h SER 493 N 7.10 0.04 -2.79 5.45 4.64 -1.82 -3.42 113.55 122.75 3kyd h SER 493 Ca -0.28 -0.01 -0.56 0.00 -0.47 0.00 0.00 61.79 60.46 3kyd h SER 493 Cb 1.21 -0.01 -0.03 0.00 -0.31 0.00 0.00 62.40 63.26 3kyd h SER 493 CO 0.53 0.44 1.09 -0.70 -0.87 0.00 0.00 176.83 177.33 3kyd s GLU 494 N -4.11 3.88 0.22 4.77 2.56 -1.26 -4.95 118.70 119.81 3kyd s GLU 494 Ca -0.03 1.69 -0.30 0.00 0.00 0.00 0.00 54.97 56.33 3kyd s GLU 494 Cb 0.14 -4.00 -0.10 0.00 2.00 0.00 0.00 34.13 32.18 3kyd s GLU 494 CO 0.74 -1.18 1.45 -2.00 -0.56 0.00 0.00 175.26 173.70 3kyd s GLU 495 N 4.47 4.27 0.00 4.30 2.12 -1.26 -3.64 118.70 128.96 3kyd s GLU 495 Ca 0.69 2.27 0.00 0.00 0.36 0.00 0.00 54.97 58.29 3kyd s GLU 495 Cb -0.25 -3.14 0.00 0.00 0.26 0.00 0.00 34.13 31.00 3kyd s GLU 495 CO 0.28 -0.44 0.00 0.41 -0.54 0.00 0.00 175.26 174.97 3kyd n GLY 496 N 2.61 0.99 1.57 -1.50 0.00 -1.26 -5.01 105.19 102.60 3kyd n GLY 496 Ca 0.08 -0.34 0.00 0.00 0.00 0.00 0.00 46.02 45.76 3kyd n GLY 496 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3kyd n GLU 497 N -0.28 0.00 -0.82 1.61 1.02 -1.24 -4.91 120.64 116.03 3kyd n GLU 497 Ca 0.00 0.00 0.03 0.00 -0.02 0.00 0.00 57.16 57.17 3kyd n GLU 497 Cb 0.25 -0.22 0.18 0.00 -0.02 0.00 0.00 31.44 31.63 3kyd n GLU 497 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 3kyd n THR 498 N -2.94 2.06 0.01 2.62 -2.24 -1.26 -4.81 114.28 107.70 3kyd n THR 498 Ca 0.00 -3.16 -0.02 0.00 -2.27 0.00 0.00 64.05 58.60 3kyd n THR 498 Cb 0.15 -0.21 0.23 0.00 -2.10 0.00 0.00 70.33 68.40 3kyd n THR 498 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 3kyd h GLU 499 N 1.12 0.50 0.00 -0.78 4.39 -1.93 -2.71 114.58 115.17 3kyd h GLU 499 Ca 0.01 -0.16 0.00 0.00 0.34 0.00 0.00 59.36 59.55 3kyd h GLU 499 Cb 1.12 -0.04 0.00 0.00 -0.10 0.00 0.00 28.75 29.73 3kyd h GLU 499 CO 0.08 0.65 0.00 0.00 -1.16 0.00 0.00 179.01 178.58 3kyd n ALA 500 N -2.48 2.10 0.31 3.43 0.00 -1.26 -3.28 120.51 119.32 3kyd n ALA 500 Ca 0.00 -0.08 0.12 0.00 0.00 0.00 0.00 53.44 53.49 3kyd n ALA 500 Cb 0.35 -1.39 0.24 0.00 0.00 0.00 0.00 19.45 18.66 3kyd n ALA 500 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.50 176.59 3kyd h ASN 501 N 0.00 0.00 -0.37 0.00 2.35 -1.85 -3.39 115.58 112.32 3kyd h ASN 501 Ca 0.00 0.00 0.08 0.00 -0.55 0.00 0.00 56.30 55.83 3kyd h ASN 501 Cb 0.42 0.00 -0.08 0.00 0.05 0.00 0.00 38.32 38.71 3kyd h ASN 501 CO 0.00 0.00 -0.16 0.78 -1.65 0.00 0.00 177.43 176.40 3kyd h ASN 502 N 0.00 -0.55 1.47 5.81 2.35 -1.70 -2.21 115.58 120.75 3kyd h ASN 502 Ca 0.00 0.14 0.00 0.00 -0.55 0.00 0.00 56.30 55.89 3kyd h ASN 502 Cb 0.92 0.31 0.00 0.00 0.05 0.00 0.00 38.32 39.60 3kyd h ASN 502 CO 0.00 -0.20 0.00 1.12 -1.65 0.00 0.00 177.43 176.70 3kyd h HIS 503 N -0.09 0.00 -3.86 1.19 2.07 -1.85 -1.87 115.15 110.73 3kyd h HIS 503 Ca 0.19 0.00 -0.50 0.00 -2.85 0.00 0.00 60.37 57.21 3kyd h HIS 503 Cb 0.38 0.00 0.02 0.00 2.57 0.00 0.00 27.41 30.38 3kyd h HIS 503 CO -0.39 0.00 0.46 0.15 -3.07 0.00 0.00 177.93 175.07 3kyd s LYS 504 N -3.44 4.45 0.54 5.12 1.02 -0.83 -4.85 119.74 121.76 3kyd s LYS 504 Ca 0.04 1.71 -0.19 0.00 0.02 0.00 0.00 55.97 57.55 3kyd s LYS 504 Cb 0.07 -2.95 -0.06 0.00 -0.52 0.00 0.00 37.83 34.37 3kyd s LYS 504 CO 0.60 0.07 1.10 0.15 -0.92 0.00 0.00 175.35 176.35 3kyd s LYS 505 N -1.83 3.43 0.37 1.68 3.01 -1.26 -2.55 119.74 122.60 3kyd s LYS 505 Ca 0.49 1.53 0.14 0.00 -1.01 0.00 0.00 55.97 57.12 3kyd s LYS 505 Cb -0.29 -2.03 0.73 0.00 -1.01 0.00 0.00 37.83 35.24 3kyd s LYS 505 CO 0.37 -0.76 1.81 -0.07 0.51 0.00 0.00 175.35 177.20 3kyd h LEU 506 N 1.20 0.00 -1.71 3.17 3.38 -1.63 -2.76 115.31 116.96 3kyd h LEU 506 Ca -0.50 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.45 3kyd h LEU 506 Cb 1.25 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.00 3kyd h LEU 506 CO 0.57 0.38 -0.10 0.77 0.09 0.00 0.00 178.44 180.15 3kyd h SER 507 N 0.00 0.00 0.61 -0.43 4.64 -1.72 -2.35 113.55 114.30 3kyd h SER 507 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3kyd h SER 507 Cb 0.70 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.79 3kyd h SER 507 CO 0.05 0.10 0.00 -0.62 -0.87 0.00 0.00 176.83 175.49 3kyd n GLU 508 N -3.37 0.12 -0.34 4.77 1.02 -1.04 -2.09 120.64 119.71 3kyd n GLU 508 Ca -0.01 0.37 0.09 0.00 -0.02 0.00 0.00 57.16 57.58 3kyd n GLU 508 Cb 0.29 -1.73 0.26 0.00 -0.02 0.00 0.00 31.44 30.23 3kyd n GLU 508 CO 0.00 0.00 0.00 1.19 1.18 0.00 0.00 177.13 179.50 3kyd n PHE 509 N -1.95 0.85 -2.03 -0.32 3.01 -0.89 -4.95 117.46 111.17 3kyd n PHE 509 Ca 0.02 -0.54 -0.06 0.00 1.01 0.00 0.00 57.45 57.89 3kyd n PHE 509 Cb 0.20 -0.07 -0.00 0.00 -0.01 0.00 0.00 39.48 39.59 3kyd n PHE 509 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3kyd n GLY 510 N 0.97 0.19 3.73 1.37 0.00 -0.89 -5.04 105.19 105.52 3kyd n GLY 510 Ca 0.19 -0.66 -0.35 0.00 0.00 0.00 0.00 46.02 45.20 3kyd n GLY 510 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3kyd s ILE 511 N -2.28 5.31 0.00 -0.61 1.01 -1.21 -5.03 121.20 118.40 3kyd s ILE 511 Ca 0.00 0.15 0.00 0.00 0.00 0.00 0.00 60.65 60.80 3kyd s ILE 511 Cb 0.00 -3.41 0.00 0.00 0.01 0.00 0.00 42.46 39.06 3kyd s ILE 511 CO 0.00 0.46 0.00 -2.11 0.00 0.00 0.00 174.94 173.29 3kyd n ARG 512 N 3.38 0.00 -2.19 2.79 1.85 -1.26 -4.17 116.66 117.06 3kyd n ARG 512 Ca -0.16 0.00 -0.42 0.00 -1.00 0.00 0.00 57.85 56.27 3kyd n ARG 512 Cb 0.52 0.00 -0.03 0.00 -1.05 0.00 0.00 32.46 31.90 3kyd n ARG 512 CO 0.00 0.00 0.00 1.21 -0.01 0.00 0.00 177.63 178.83 3kyd s ASN 513 N 1.81 6.86 0.00 2.89 2.47 -1.26 -3.25 114.94 124.46 3kyd s ASN 513 Ca 0.00 2.38 0.00 0.00 0.42 0.00 0.00 52.86 55.66 3kyd s ASN 513 Cb 0.00 -2.60 0.00 0.00 -1.45 0.00 0.00 41.25 37.20 3kyd s ASN 513 CO 0.00 -0.59 0.00 0.61 -3.72 0.00 0.00 177.10 173.40 3kyd n GLY 514 N 2.81 3.28 3.75 1.21 0.00 -0.61 -5.00 105.19 110.63 3kyd n GLY 514 Ca 0.08 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.73 3kyd n GLY 514 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3kyd s SER 515 N -1.04 5.03 -0.02 1.61 0.01 -1.20 -4.77 113.70 113.33 3kyd s SER 515 Ca 0.00 2.54 0.06 0.00 1.31 0.00 0.00 55.95 59.86 3kyd s SER 515 Cb 0.00 -2.61 -0.01 0.00 0.21 0.00 0.00 66.02 63.60 3kyd s SER 515 CO 0.00 -1.71 -0.18 -0.13 0.41 0.00 0.00 173.24 171.62 3kyd s ARG 516 N -3.24 1.55 -0.19 12.44 0.52 -1.26 -1.53 118.95 127.25 3kyd s ARG 516 Ca 0.78 -0.66 0.01 0.00 -0.52 0.00 0.00 55.73 55.34 3kyd s ARG 516 Cb -0.35 -1.47 0.02 0.00 0.52 0.00 0.00 34.95 33.67 3kyd s ARG 516 CO 0.38 0.38 -0.19 -0.51 0.02 0.00 0.00 175.30 175.38 3kyd s LEU 517 N -0.37 2.22 -0.61 2.53 1.43 0.41 -0.53 118.68 123.77 3kyd s LEU 517 Ca 0.06 -0.67 -0.20 0.00 -1.03 0.00 0.00 54.13 52.29 3kyd s LEU 517 Cb -0.08 -1.50 0.09 0.00 0.03 0.00 0.00 46.19 44.74 3kyd s LEU 517 CO -0.00 -0.01 0.78 -1.58 0.23 0.00 0.00 176.35 175.77 3kyd s GLN 518 N 1.29 3.07 -0.23 1.70 0.74 -0.18 -0.15 119.66 125.90 3kyd s GLN 518 Ca 0.04 -1.15 -0.14 0.00 0.05 0.00 0.00 55.36 54.17 3kyd s GLN 518 Cb -0.13 -4.25 -0.04 0.00 1.10 0.00 0.00 33.01 29.69 3kyd s GLN 518 CO -0.12 -1.61 0.31 0.00 -0.55 0.00 0.00 175.29 173.32 3kyd s ALA 519 N 3.09 3.57 -0.11 1.58 0.00 -0.39 -2.59 121.76 126.92 3kyd s ALA 519 Ca 0.15 -0.74 -0.00 0.00 0.00 0.00 0.00 51.96 51.36 3kyd s ALA 519 Cb -0.22 -2.55 -0.02 0.00 0.00 0.00 0.00 23.12 20.33 3kyd s ALA 519 CO 0.08 -0.37 -0.09 -0.51 0.00 0.00 0.00 175.76 174.87 3kyd s ASP 520 N 1.23 4.39 -0.43 0.00 1.01 0.50 -0.96 116.67 122.41 3kyd s ASP 520 Ca 0.14 -0.18 -0.02 0.00 0.71 0.00 0.00 52.55 53.20 3kyd s ASP 520 Cb -0.15 -1.45 0.12 0.00 1.01 0.00 0.00 42.92 42.45 3kyd s ASP 520 CO 0.08 0.24 0.21 -0.62 0.21 0.00 0.00 175.17 175.29 3kyd s ASP 521 N -0.07 5.15 0.48 0.27 -1.08 -0.45 0.87 116.67 121.84 3kyd s ASP 521 Ca -0.01 -2.19 0.27 0.00 -0.52 0.00 0.00 52.55 50.10 3kyd s ASP 521 Cb -0.14 -1.80 1.11 0.00 -1.46 0.00 0.00 42.92 40.64 3kyd s ASP 521 CO 0.03 -0.49 1.90 -0.26 0.52 0.00 0.00 175.17 176.88 3kyd h PHE 522 N 7.81 0.00 -0.08 -5.34 -1.00 -1.84 0.17 116.94 116.65 3kyd h PHE 522 Ca -0.10 0.00 -0.02 0.00 2.81 0.00 0.00 57.97 60.66 3kyd h PHE 522 Cb 1.03 0.00 -0.00 0.00 3.61 0.00 0.00 35.95 40.58 3kyd h PHE 522 CO 0.56 0.16 -0.02 1.25 -1.61 0.00 0.00 178.31 178.65 3kyd h LEU 523 N 0.00 0.15 -0.05 1.54 5.85 -1.94 -3.13 115.31 117.73 3kyd h LEU 523 Ca -0.00 -0.37 0.00 0.00 0.84 0.00 0.00 57.88 58.35 3kyd h LEU 523 Cb 0.63 -0.04 0.00 0.00 0.37 0.00 0.00 40.66 41.62 3kyd h LEU 523 CO 0.02 0.49 0.00 0.00 -0.34 0.00 0.00 178.44 178.61 3kyd n GLN 524 N -4.80 0.09 -3.39 1.25 6.02 -0.98 -4.52 117.38 111.05 3kyd n GLN 524 Ca -0.07 0.13 -0.19 0.00 -0.01 0.00 0.00 57.00 56.86 3kyd n GLN 524 Cb 0.23 -1.62 0.05 0.00 1.02 0.00 0.00 30.24 29.92 3kyd n GLN 524 CO 0.00 0.00 0.00 -3.47 -1.01 0.00 0.00 177.06 172.58 3kyd n ASP 525 N -1.78 -6.31 -3.67 1.08 2.03 0.52 -4.57 116.55 103.85 3kyd n ASP 525 Ca 0.06 -0.72 -0.10 0.00 0.52 0.00 0.00 54.79 54.55 3kyd n ASP 525 Cb 0.34 -4.42 -0.10 0.00 -0.72 0.00 0.00 41.12 36.22 3kyd n ASP 525 CO 0.00 0.00 0.00 -0.47 -1.92 0.00 0.00 177.20 174.81 3kyd s TYR 526 N -3.33 -0.68 -0.15 -0.67 5.04 -0.84 -4.93 117.35 111.78 3kyd s TYR 526 Ca 0.37 1.38 -0.04 0.00 -2.44 0.00 0.00 57.07 56.33 3kyd s TYR 526 Cb -0.09 0.26 -0.03 0.00 0.35 0.00 0.00 41.96 42.46 3kyd s TYR 526 CO 0.79 -0.41 -0.03 0.99 -1.34 0.00 0.00 175.55 175.55 3kyd s THR 527 N 2.06 3.95 -0.10 4.34 2.01 -1.26 -1.34 115.64 125.30 3kyd s THR 527 Ca -0.05 -0.34 0.01 0.00 0.31 0.00 0.00 61.69 61.63 3kyd s THR 527 Cb -0.10 -2.73 0.02 0.00 0.01 0.00 0.00 72.50 69.69 3kyd s THR 527 CO -0.12 0.49 -0.13 -0.22 -0.69 0.00 0.00 174.62 173.95 3kyd s LEU 528 N 0.32 1.60 -0.27 4.42 2.96 -0.13 -4.45 118.68 123.13 3kyd s LEU 528 Ca -0.03 -0.38 -0.19 0.00 -0.22 0.00 0.00 54.13 53.31 3kyd s LEU 528 Cb -0.14 -0.99 -0.02 0.00 0.50 0.00 0.00 46.19 45.54 3kyd s LEU 528 CO 0.03 -0.01 0.55 -0.76 -1.32 0.00 0.00 176.35 174.84 3kyd s LEU 529 N 1.09 4.09 -0.27 -0.68 1.43 -1.11 -1.26 118.68 121.96 3kyd s LEU 529 Ca -0.05 0.50 -0.06 0.00 -1.03 0.00 0.00 54.13 53.49 3kyd s LEU 529 Cb -0.14 -2.71 -0.00 0.00 0.03 0.00 0.00 46.19 43.36 3kyd s LEU 529 CO -0.02 -0.34 0.06 -0.63 0.23 0.00 0.00 176.35 175.64 3kyd s ILE 530 N 2.39 3.92 0.01 -0.59 1.01 0.78 -0.90 121.20 127.83 3kyd s ILE 530 Ca 0.22 -0.57 -0.20 0.00 0.00 0.00 0.00 60.65 60.10 3kyd s ILE 530 Cb -0.15 -2.95 -0.06 0.00 0.01 0.00 0.00 42.46 39.31 3kyd s ILE 530 CO 0.10 0.19 0.59 0.20 0.00 0.00 0.00 174.94 176.02 3kyd s ASN 531 N 1.52 7.00 -0.17 3.58 0.01 -0.84 -0.44 114.94 125.59 3kyd s ASN 531 Ca 0.04 1.19 -0.04 0.00 -0.71 0.00 0.00 52.86 53.34 3kyd s ASN 531 Cb -0.16 -2.37 -0.03 0.00 0.41 0.00 0.00 41.25 39.10 3kyd s ASN 531 CO 0.02 0.14 -0.03 -0.63 -1.51 0.00 0.00 177.10 175.09 3kyd s ILE 532 N -0.40 3.91 -0.12 0.60 -1.09 -0.58 -0.08 121.20 123.45 3kyd s ILE 532 Ca 0.31 -0.34 0.02 0.00 -2.23 0.00 0.00 60.65 58.41 3kyd s ILE 532 Cb -0.19 -2.73 0.01 0.00 -1.58 0.00 0.00 42.46 37.97 3kyd s ILE 532 CO 0.18 0.47 -0.18 -0.76 -1.23 0.00 0.00 174.94 173.42 3kyd s LEU 533 N 0.55 1.89 0.00 2.97 1.43 -0.78 -1.57 118.68 123.18 3kyd s LEU 533 Ca -0.02 -0.50 -0.14 0.00 -1.03 0.00 0.00 54.13 52.45 3kyd s LEU 533 Cb -0.14 -1.23 -0.06 0.00 0.03 0.00 0.00 46.19 44.79 3kyd s LEU 533 CO 0.02 0.05 0.39 -2.28 0.23 0.00 0.00 176.35 174.77 3kyd s HIS 534 N 0.85 3.70 -0.22 0.29 5.65 -1.26 -2.15 115.29 122.14 3kyd s HIS 534 Ca -0.08 0.94 -0.08 0.00 0.25 0.00 0.00 55.06 56.08 3kyd s HIS 534 Cb -0.15 -2.25 0.10 0.00 -1.18 0.00 0.00 32.58 29.09 3kyd s HIS 534 CO -0.00 0.63 0.49 0.45 -0.65 0.00 0.00 174.74 175.66 3kyd s SER 535 N -1.17 -0.54 0.27 9.88 0.15 -0.96 -4.92 113.70 116.40 3kyd s SER 535 Ca 0.24 1.15 0.26 0.00 0.70 0.00 0.00 55.95 58.31 3kyd s SER 535 Cb -0.16 1.52 0.86 0.00 -1.71 0.00 0.00 66.02 66.52 3kyd s SER 535 CO 0.13 -0.22 1.76 -0.33 1.20 0.00 0.00 173.24 175.77 3kyd h GLU 536 N 7.93 0.00 -5.07 5.44 5.08 -1.98 -3.25 114.58 122.74 3kyd h GLU 536 Ca -0.20 0.00 -0.63 0.00 -1.00 0.00 0.00 59.36 57.53 3kyd h GLU 536 Cb 1.12 0.00 -0.19 0.00 0.50 0.00 0.00 28.75 30.18 3kyd h GLU 536 CO 0.14 0.00 -0.58 -0.51 -1.00 0.00 0.00 179.01 177.06 3kyd s ASP 537 N -4.69 5.50 0.00 1.42 1.01 -1.26 -4.91 116.67 113.74 3kyd s ASP 537 Ca 0.08 -0.05 0.00 0.00 0.71 0.00 0.00 52.55 53.28 3kyd s ASP 537 Cb 0.10 -1.98 0.00 0.00 1.01 0.00 0.00 42.92 42.06 3kyd s ASP 537 CO 0.54 0.05 0.00 0.18 0.21 0.00 0.00 175.17 176.14 3kyd n LEU 538 N 4.39 0.00 0.00 1.23 4.77 -1.26 -5.02 117.00 121.11 3kyd n LEU 538 Ca -0.16 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.82 3kyd n LEU 538 Cb 0.52 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.61 3kyd n LEU 538 CO 0.33 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 177.00 3kyd n GLY 539 N 0.80 -1.60 3.70 -0.72 0.00 -1.26 -4.78 105.19 101.33 3kyd n GLY 539 Ca 0.00 -2.23 -0.42 0.00 0.00 0.00 0.00 46.02 43.37 3kyd n GLY 539 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3kyd s LYS 540 N -0.97 4.35 -1.60 1.61 2.20 -1.26 -3.30 119.74 120.77 3kyd s LYS 540 Ca 0.00 1.86 0.00 0.00 -0.36 0.00 0.00 55.97 57.47 3kyd s LYS 540 Cb 0.00 -3.45 0.00 0.00 -1.51 0.00 0.00 37.83 32.87 3kyd s LYS 540 CO 0.00 -0.43 0.00 -0.25 -0.36 0.00 0.00 175.35 174.31 3kyd n ASP 541 N 4.66 -5.37 -4.38 1.43 8.00 -1.26 -5.01 116.55 114.63 3kyd n ASP 541 Ca 0.11 0.00 -0.34 0.00 0.71 0.00 0.00 54.79 55.28 3kyd n ASP 541 Cb 0.45 -4.43 -0.14 0.00 -0.02 0.00 0.00 41.12 36.98 3kyd n ASP 541 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 3kyd s VAL 542 N -2.92 3.26 -0.04 2.53 1.01 -1.21 -4.98 120.40 118.05 3kyd s VAL 542 Ca 0.00 -0.57 0.01 0.00 0.00 0.00 0.00 61.98 61.42 3kyd s VAL 542 Cb 0.00 -2.41 -0.03 0.00 0.00 0.00 0.00 36.38 33.94 3kyd s VAL 542 CO 0.00 0.50 -0.03 -0.62 0.00 0.00 0.00 175.10 174.95 3kyd n GLU 543 N 3.84 0.90 -3.80 2.72 1.02 -1.26 -4.74 120.64 119.31 3kyd n GLU 543 Ca -0.18 0.02 -0.12 0.00 -0.02 0.00 0.00 57.16 56.86 3kyd n GLU 543 Cb 0.52 -1.09 -0.09 0.00 -0.02 0.00 0.00 31.44 30.75 3kyd n GLU 543 CO 0.00 0.00 0.00 -0.59 1.18 0.00 0.00 177.13 177.72 3kyd s PHE 544 N -2.09 -0.11 -0.05 -0.32 -0.12 -1.26 -3.77 117.98 110.26 3kyd s PHE 544 Ca -0.05 0.16 -0.01 0.00 -0.05 0.00 0.00 56.93 56.98 3kyd s PHE 544 Cb 0.02 0.04 0.03 0.00 -0.63 0.00 0.00 43.02 42.47 3kyd s PHE 544 CO 0.12 -0.32 0.01 -1.21 -0.05 0.00 0.00 175.22 173.76 3kyd s GLU 545 N -1.20 0.39 -0.04 1.99 2.02 0.58 -5.01 118.70 117.43 3kyd s GLU 545 Ca -0.13 0.13 -0.26 0.00 0.02 0.00 0.00 54.97 54.74 3kyd s GLU 545 Cb -0.06 -0.69 -0.03 0.00 0.10 0.00 0.00 34.13 33.44 3kyd s GLU 545 CO 0.03 -0.23 0.79 0.08 0.02 0.00 0.00 175.26 175.96 3kyd s VAL 546 N 1.56 4.98 -0.09 2.63 1.01 -1.26 -0.61 120.40 128.63 3kyd s VAL 546 Ca -0.02 1.65 0.02 0.00 0.00 0.00 0.00 61.98 63.64 3kyd s VAL 546 Cb -0.13 -4.13 0.01 0.00 0.00 0.00 0.00 36.38 32.13 3kyd s VAL 546 CO -0.03 0.22 -0.15 -0.69 0.00 0.00 0.00 175.10 174.45 3kyd s VAL 547 N 0.86 1.43 0.00 2.92 1.01 -0.80 -4.97 120.40 120.85 3kyd s VAL 547 Ca 0.42 -0.63 0.00 0.00 0.00 0.00 0.00 61.98 61.78 3kyd s VAL 547 Cb -0.19 -1.29 0.00 0.00 0.00 0.00 0.00 36.38 34.90 3kyd s VAL 547 CO 0.21 0.42 0.00 0.61 0.00 0.00 0.00 175.10 176.35