#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3k2h n TYR 5 N 0.00 0.19 -1.59 1.43 4.01 -1.26 -4.87 117.16 115.06 3k2h n TYR 5 Ca 0.00 -0.97 -0.48 0.00 -0.16 0.00 0.00 57.90 56.28 3k2h n TYR 5 Cb 0.00 -0.18 -0.04 0.00 -0.31 0.00 0.00 39.34 38.81 3k2h n TYR 5 CO 0.00 0.00 0.00 -0.85 -0.46 0.00 0.00 176.86 175.55 3k2h n GLU 6 N -1.25 1.31 -1.27 -0.72 -0.00 -1.26 -1.37 120.64 116.08 3k2h n GLU 6 Ca 0.17 0.47 -0.09 0.00 -0.00 0.00 0.00 57.16 57.70 3k2h n GLU 6 Cb 0.69 -2.01 -0.04 0.00 -0.00 0.00 0.00 31.44 30.08 3k2h n GLU 6 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 3k2h n GLY 7 N 2.12 1.01 0.72 -1.84 0.00 -1.26 -4.90 105.19 101.02 3k2h n GLY 7 Ca 0.15 -0.16 0.08 0.00 0.00 0.00 0.00 46.02 46.08 3k2h n GLY 7 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3k2h n GLY 9 N -0.37 0.92 4.00 0.00 0.00 -1.26 -4.55 105.19 103.93 3k2h n GLY 9 Ca 0.18 -2.02 -0.27 0.00 0.00 0.00 0.00 46.02 43.90 3k2h n GLY 9 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 3k2h n ASP 10 N -2.92 -0.95 -4.76 1.61 2.03 -0.34 -4.95 116.55 106.27 3k2h n ASP 10 Ca 0.07 -1.00 -0.38 0.00 0.52 0.00 0.00 54.79 54.00 3k2h n ASP 10 Cb 0.26 -3.01 -0.06 0.00 -0.72 0.00 0.00 41.12 37.59 3k2h n ASP 10 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 3k2h s LEU 11 N -7.04 4.37 -0.23 -2.67 1.43 0.95 -4.83 118.68 110.67 3k2h s LEU 11 Ca 0.15 0.97 -0.07 0.00 -1.03 0.00 0.00 54.13 54.15 3k2h s LEU 11 Cb -0.08 -2.75 -0.03 0.00 0.03 0.00 0.00 46.19 43.36 3k2h s LEU 11 CO 0.90 0.12 0.07 -0.89 0.23 0.00 0.00 176.35 176.77 3k2h s THR 12 N -0.09 4.39 -0.00 5.49 2.01 -1.12 -3.30 115.64 123.02 3k2h s THR 12 Ca 0.27 -0.15 -0.19 0.00 0.31 0.00 0.00 61.69 61.93 3k2h s THR 12 Cb -0.17 -3.04 -0.06 0.00 0.01 0.00 0.00 72.50 69.25 3k2h s THR 12 CO 0.13 0.37 0.54 -0.63 -0.69 0.00 0.00 174.62 174.34 3k2h s ILE 13 N 1.34 4.93 -0.10 1.82 1.01 -0.94 0.01 121.20 129.27 3k2h s ILE 13 Ca 0.05 1.13 0.03 0.00 0.00 0.00 0.00 60.65 61.85 3k2h s ILE 13 Cb -0.15 -3.87 -0.01 0.00 0.01 0.00 0.00 42.46 38.44 3k2h s ILE 13 CO 0.03 0.47 -0.19 -0.36 0.00 0.00 0.00 174.94 174.89 3k2h s PHE 14 N -0.46 2.65 0.06 3.97 0.40 -0.87 -0.25 117.98 123.48 3k2h s PHE 14 Ca 0.28 -0.74 -0.15 0.00 -0.60 0.00 0.00 56.93 55.72 3k2h s PHE 14 Cb -0.18 -1.73 0.03 0.00 0.51 0.00 0.00 43.02 41.65 3k2h s PHE 14 CO 0.16 -0.24 0.35 0.54 0.70 0.00 0.00 175.22 176.73 3k2h s VAL 15 N 0.14 0.08 -0.13 -0.44 0.11 -0.61 -4.49 120.40 115.05 3k2h s VAL 15 Ca -0.10 -0.62 0.03 0.00 -2.93 0.00 0.00 61.98 58.36 3k2h s VAL 15 Cb -0.16 -1.02 0.00 0.00 -1.53 0.00 0.00 36.38 33.67 3k2h s VAL 15 CO 0.06 -0.34 -0.22 0.00 -3.33 0.00 0.00 175.10 171.27 3k2h s ALA 16 N -2.90 2.26 -0.09 1.54 0.00 -1.26 -1.66 121.76 119.66 3k2h s ALA 16 Ca -0.03 -1.04 0.02 0.00 0.00 0.00 0.00 51.96 50.91 3k2h s ALA 16 Cb 0.00 -0.96 0.02 0.00 0.00 0.00 0.00 23.12 22.17 3k2h s ALA 16 CO -0.05 0.09 -0.13 0.08 0.00 0.00 0.00 175.76 175.75 3k2h s VAL 17 N 0.63 1.26 0.79 0.00 1.01 -0.20 -4.69 120.40 119.21 3k2h s VAL 17 Ca -0.11 -0.51 -0.11 0.00 0.00 0.00 0.00 61.98 61.24 3k2h s VAL 17 Cb -0.16 -1.16 0.07 0.00 0.00 0.00 0.00 36.38 35.12 3k2h s VAL 17 CO 0.02 0.39 1.09 0.00 0.00 0.00 0.00 175.10 176.60 3k2h s ALA 18 N 0.93 2.21 0.46 5.51 0.00 -0.46 -0.87 121.76 129.54 3k2h s ALA 18 Ca -0.09 -0.10 0.16 0.00 0.00 0.00 0.00 51.96 51.94 3k2h s ALA 18 Cb -0.15 -3.14 1.12 0.00 0.00 0.00 0.00 23.12 20.94 3k2h s ALA 18 CO 0.00 -1.75 1.99 1.25 0.00 0.00 0.00 175.76 177.25 3k2h h LEU 19 N -1.10 0.27 -2.35 0.00 5.85 -0.08 0.11 115.31 118.02 3k2h h LEU 19 Ca -0.47 0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.26 3k2h h LEU 19 Cb 1.26 -0.05 0.00 0.00 0.37 0.00 0.00 40.66 42.24 3k2h h LEU 19 CO 0.57 0.16 0.00 -0.46 -0.34 0.00 0.00 178.44 178.38 3k2h n ASN 20 N -4.46 3.54 0.00 1.25 6.94 -1.26 -4.89 115.26 116.38 3k2h n ASN 20 Ca 0.09 -2.45 0.00 0.00 -0.02 0.00 0.00 54.58 52.21 3k2h n ASN 20 Cb 0.41 -0.55 0.00 0.00 -2.36 0.00 0.00 39.78 37.29 3k2h n ASN 20 CO 0.00 0.00 0.00 0.29 -1.03 0.00 0.00 177.26 176.52 3k2h n LYS 21 N 0.46 -0.06 -2.21 -3.83 5.02 0.40 -5.00 118.16 112.94 3k2h n LYS 21 Ca 0.16 0.02 -0.41 0.00 -2.02 0.00 0.00 58.31 56.06 3k2h n LYS 21 Cb 0.73 -2.94 -0.03 0.00 -0.02 0.00 0.00 35.03 32.77 3k2h n LYS 21 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 3k2h s VAL 22 N -3.17 3.01 0.00 -0.18 1.01 -1.26 -0.75 120.40 119.06 3k2h s VAL 22 Ca 0.00 0.94 0.00 0.00 0.00 0.00 0.00 61.98 62.92 3k2h s VAL 22 Cb 0.00 -3.60 0.00 0.00 0.00 0.00 0.00 36.38 32.78 3k2h s VAL 22 CO 0.00 0.19 0.00 2.30 0.00 0.00 0.00 175.10 177.59 3k2h n ILE 23 N 1.58 0.00 -3.80 2.22 -5.35 0.30 -1.36 119.36 112.95 3k2h n ILE 23 Ca 0.02 -0.14 -0.12 0.00 -0.27 0.00 0.00 62.75 62.23 3k2h n ILE 23 Cb 0.43 0.62 -0.09 0.00 -1.74 0.00 0.00 39.64 38.85 3k2h n ILE 23 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 3k2h s GLY 24 N -1.22 -0.08 -0.14 3.28 0.00 -1.01 -4.38 107.32 103.77 3k2h s GLY 24 Ca 0.00 0.18 -0.06 0.00 0.00 0.00 0.00 44.72 44.84 3k2h s GLY 24 CO 0.00 0.00 0.31 -1.58 0.00 0.00 0.00 173.10 171.83 3k2h s HIS 25 N -1.28 -0.50 -1.66 1.90 2.46 -0.17 -1.12 115.29 114.93 3k2h s HIS 25 Ca -0.13 1.08 -0.13 0.00 0.47 0.00 0.00 55.06 56.34 3k2h s HIS 25 Cb -0.06 0.11 0.12 0.00 -0.13 0.00 0.00 32.58 32.62 3k2h s HIS 25 CO 0.03 -0.34 0.56 1.63 -2.47 0.00 0.00 174.74 174.16 3k2h n LYS 26 N 4.80 -2.39 -2.41 2.88 5.02 -1.26 -0.42 118.16 124.39 3k2h n LYS 26 Ca -0.16 0.29 -0.19 0.00 -2.02 0.00 0.00 58.31 56.23 3k2h n LYS 26 Cb 0.52 -4.69 -0.01 0.00 -0.02 0.00 0.00 35.03 30.83 3k2h n LYS 26 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 3k2h n ASN 27 N -2.72 -5.51 -4.22 4.39 5.15 -1.26 -4.99 115.26 106.10 3k2h n ASN 27 Ca -0.05 0.03 -0.13 0.00 -0.60 0.00 0.00 54.58 53.83 3k2h n ASN 27 Cb 0.55 -4.60 -0.10 0.00 -0.53 0.00 0.00 39.78 35.10 3k2h n ASN 27 CO 0.00 0.00 0.00 -1.10 1.40 0.00 0.00 177.26 177.56 3k2h s GLN 28 N -5.04 1.19 0.17 1.20 -0.21 0.44 -4.48 119.66 112.93 3k2h s GLN 28 Ca 0.00 -1.62 -0.31 0.00 0.02 0.00 0.00 55.36 53.45 3k2h s GLN 28 Cb 0.00 0.13 -0.09 0.00 1.00 0.00 0.00 33.01 34.05 3k2h s GLN 28 CO 0.00 -0.33 1.41 0.42 -2.12 0.00 0.00 175.29 174.67 3k2h s ILE 29 N -4.03 3.04 -0.30 1.08 1.01 -1.26 -1.00 121.20 119.74 3k2h s ILE 29 Ca 0.35 0.79 0.28 0.00 0.00 0.00 0.00 60.65 62.07 3k2h s ILE 29 Cb 0.07 -3.51 0.33 0.00 0.01 0.00 0.00 42.46 39.36 3k2h s ILE 29 CO 0.10 0.09 1.80 -0.65 0.00 0.00 0.00 174.94 176.28 3k2h h PRO 30 N 6.13 0.00 -6.18 2.79 0.11 -1.85 -3.45 132.00 129.55 3k2h h PRO 30 Ca -0.44 0.00 -0.51 0.00 0.11 0.00 0.00 66.00 65.17 3k2h h PRO 30 Cb 1.21 0.00 -0.05 0.00 0.11 0.00 0.00 31.00 32.27 3k2h h PRO 30 CO 0.83 0.00 -0.49 1.67 -0.21 0.00 0.00 178.00 179.80 3k2h s TRP 31 N -3.38 2.93 0.48 0.65 -2.14 -1.26 -4.81 118.94 111.41 3k2h s TRP 31 Ca 0.05 -0.25 -0.24 0.00 2.66 0.00 0.00 56.10 58.32 3k2h s TRP 31 Cb 0.09 -1.62 -0.07 0.00 -3.10 0.00 0.00 33.47 28.76 3k2h s TRP 31 CO 0.54 0.33 1.34 -2.30 -2.66 0.00 0.00 176.95 174.20 3k2h n PRO 32 N -1.26 1.91 -1.69 3.25 -0.02 -1.26 -4.88 135.00 131.05 3k2h n PRO 32 Ca -0.04 0.69 -0.44 0.00 -2.02 0.00 0.00 63.50 61.69 3k2h n PRO 32 Cb 0.59 -2.52 -0.02 0.00 -0.02 0.00 0.00 33.50 31.53 3k2h n PRO 32 CO 0.00 0.00 0.00 0.72 1.98 0.00 0.00 175.50 178.20 3k2h n HIS 33 N -0.56 2.35 -3.61 6.00 8.25 -1.26 -4.96 115.22 121.43 3k2h n HIS 33 Ca 0.08 0.39 -0.40 0.00 -0.26 0.00 0.00 57.72 57.54 3k2h n HIS 33 Cb 0.42 -2.49 -0.09 0.00 1.12 0.00 0.00 29.99 28.95 3k2h n HIS 33 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 3k2h s ILE 34 N -0.10 4.08 0.47 1.59 1.01 -1.26 -4.96 121.20 122.03 3k2h s ILE 34 Ca 0.66 -2.26 0.20 0.00 0.00 0.00 0.00 60.65 59.26 3k2h s ILE 34 Cb -0.61 -3.67 0.25 0.00 0.01 0.00 0.00 42.46 38.44 3k2h s ILE 34 CO 0.50 -0.82 2.07 0.71 0.00 0.00 0.00 174.94 177.40 3k2h h THR 35 N 5.76 0.88 -0.53 2.92 1.35 -2.00 -0.16 112.91 121.13 3k2h h THR 35 Ca -0.10 -0.45 0.03 0.00 -0.55 0.00 0.00 66.41 65.34 3k2h h THR 35 Cb 1.03 1.26 -0.04 0.00 -1.73 0.00 0.00 68.15 68.67 3k2h h THR 35 CO 0.78 0.12 0.30 -0.74 -0.25 0.00 0.00 175.52 175.73 3k2h h HIS 36 N 0.00 0.55 -0.63 4.73 -0.00 -1.99 -1.12 115.15 116.70 3k2h h HIS 36 Ca -0.00 0.02 -0.00 0.00 -0.00 0.00 0.00 60.37 60.39 3k2h h HIS 36 Cb 0.25 -0.17 -0.03 0.00 -0.00 0.00 0.00 27.41 27.45 3k2h h HIS 36 CO 0.00 0.30 0.39 0.22 -0.00 0.00 0.00 177.93 178.84 3k2h h ASP 37 N 0.59 0.75 -0.76 3.26 3.58 -1.47 -0.63 116.42 121.73 3k2h h ASP 37 Ca 0.22 -0.05 0.03 0.00 0.42 0.00 0.00 57.03 57.65 3k2h h ASP 37 Cb 0.07 -0.19 -0.04 0.00 1.72 0.00 0.00 39.33 40.89 3k2h h ASP 37 CO -0.12 0.58 0.50 -0.26 -2.88 0.00 0.00 179.24 177.05 3k2h h PHE 38 N 0.85 0.91 -0.18 0.28 0.04 -0.93 -0.39 116.94 117.53 3k2h h PHE 38 Ca 0.23 0.02 -0.11 0.00 2.80 0.00 0.00 57.97 60.91 3k2h h PHE 38 Cb -0.04 -0.31 0.00 0.00 2.20 0.00 0.00 35.95 37.80 3k2h h PHE 38 CO -0.02 0.55 -0.33 -0.09 -0.60 0.00 0.00 178.31 177.82 3k2h h ARG 39 N 0.96 0.54 -0.19 1.51 2.43 -0.79 -0.31 114.38 118.54 3k2h h ARG 39 Ca 0.29 -0.34 0.04 0.00 -0.81 0.00 0.00 59.98 59.16 3k2h h ARG 39 Cb -0.01 0.04 -0.04 0.00 -0.42 0.00 0.00 29.97 29.55 3k2h h ARG 39 CO -0.08 0.95 -0.05 0.35 -1.51 0.00 0.00 179.97 179.63 3k2h h PHE 40 N 0.19 -0.11 -0.27 2.20 3.57 -0.77 -0.31 116.94 121.44 3k2h h PHE 40 Ca 0.01 0.02 0.06 0.00 3.53 0.00 0.00 57.97 61.59 3k2h h PHE 40 Cb 0.92 0.08 -0.06 0.00 2.79 0.00 0.00 35.95 39.68 3k2h h PHE 40 CO 0.09 -0.09 -0.15 1.25 -2.23 0.00 0.00 178.31 177.19 3k2h h LEU 41 N -0.01 -0.48 -0.67 0.59 5.85 -0.96 -0.13 115.31 119.50 3k2h h LEU 41 Ca 0.09 0.11 -0.04 0.00 0.84 0.00 0.00 57.88 58.89 3k2h h LEU 41 Cb 0.15 0.26 -0.03 0.00 0.37 0.00 0.00 40.66 41.41 3k2h h LEU 41 CO -0.20 -0.18 0.28 -0.09 -0.34 0.00 0.00 178.44 177.91 3k2h h ARG 42 N -0.11 0.99 -0.51 1.25 2.43 -0.77 -1.31 114.38 116.35 3k2h h ARG 42 Ca 0.14 -0.17 -0.09 0.00 -0.81 0.00 0.00 59.98 59.05 3k2h h ARG 42 Cb 0.33 -0.16 -0.02 0.00 -0.42 0.00 0.00 29.97 29.70 3k2h h ARG 42 CO -0.34 0.82 -0.05 -0.91 -1.51 0.00 0.00 179.97 177.97 3k2h h ASN 43 N 0.94 0.92 -0.35 -3.80 2.35 -0.87 -2.22 115.58 112.54 3k2h h ASN 43 Ca 0.22 -0.33 -0.08 0.00 -0.55 0.00 0.00 56.30 55.56 3k2h h ASN 43 Cb 0.19 -0.25 -0.02 0.00 0.05 0.00 0.00 38.32 38.29 3k2h h ASN 43 CO -0.02 1.03 -0.06 1.23 -1.65 0.00 0.00 177.43 177.95 3k2h h GLY 44 N 0.79 0.83 0.72 2.83 0.00 -0.75 -3.11 103.07 104.37 3k2h h GLY 44 Ca 0.14 -0.59 0.00 0.00 0.00 0.00 0.00 47.33 46.88 3k2h h GLY 44 CO 0.04 0.54 -0.90 -1.30 0.00 0.00 0.00 176.54 174.92 3k2h n THR 45 N -4.19 0.18 0.99 4.70 -2.24 -0.52 -3.89 114.28 109.31 3k2h n THR 45 Ca 0.02 -0.22 0.11 0.00 -2.27 0.00 0.00 64.05 61.69 3k2h n THR 45 Cb 0.33 0.18 0.02 0.00 -2.10 0.00 0.00 70.33 68.76 3k2h n THR 45 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 3k2h n THR 46 N -1.93 0.00 -2.35 4.28 -2.24 -0.84 -4.63 114.28 106.57 3k2h n THR 46 Ca 0.03 -0.32 -0.42 0.00 -2.27 0.00 0.00 64.05 61.07 3k2h n THR 46 Cb 0.42 1.31 -0.03 0.00 -2.10 0.00 0.00 70.33 69.93 3k2h n THR 46 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 3k2h s TYR 47 N -2.34 3.39 -0.09 4.78 5.04 -1.17 -4.92 117.35 122.04 3k2h s TYR 47 Ca 0.20 1.31 0.02 0.00 -2.44 0.00 0.00 57.07 56.17 3k2h s TYR 47 Cb 0.18 -3.47 0.01 0.00 0.35 0.00 0.00 41.96 39.03 3k2h s TYR 47 CO 0.51 -1.43 -0.17 0.42 -1.34 0.00 0.00 175.55 173.54 3k2h s ILE 48 N 0.44 1.56 0.33 3.14 -1.09 -1.26 -4.91 121.20 119.41 3k2h s ILE 48 Ca 0.56 -0.70 -0.29 0.00 -2.23 0.00 0.00 60.65 57.99 3k2h s ILE 48 Cb -0.32 -1.39 -0.11 0.00 -1.58 0.00 0.00 42.46 39.05 3k2h s ILE 48 CO 0.34 0.45 1.56 -2.84 -1.23 0.00 0.00 174.94 173.22 3k2h s PRO 49 N 0.72 4.10 0.25 2.79 0.02 -1.26 -4.78 135.00 136.85 3k2h s PRO 49 Ca -0.12 2.60 -0.02 0.00 0.02 0.00 0.00 61.00 63.47 3k2h s PRO 49 Cb -0.16 -2.99 0.51 0.00 0.02 0.00 0.00 34.50 31.88 3k2h s PRO 49 CO 0.03 -0.61 1.72 -1.35 -0.33 0.00 0.00 177.00 176.46 3k2h h PRO 50 N 4.05 0.43 -0.35 5.54 0.11 -2.00 0.28 132.00 140.05 3k2h h PRO 50 Ca -0.49 -0.03 0.05 0.00 0.11 0.00 0.00 66.00 65.65 3k2h h PRO 50 Cb 1.23 -0.10 -0.05 0.00 0.11 0.00 0.00 31.00 32.19 3k2h h PRO 50 CO 0.73 0.28 0.06 0.93 -0.21 0.00 0.00 178.00 179.79 3k2h h GLU 51 N 0.44 0.17 -0.50 1.05 3.07 -2.01 -1.77 114.58 115.03 3k2h h GLU 51 Ca 0.45 -0.01 -0.09 0.00 -0.50 0.00 0.00 59.36 59.21 3k2h h GLU 51 Cb 0.71 -0.04 -0.02 0.00 -0.84 0.00 0.00 28.75 28.56 3k2h h GLU 51 CO -0.43 0.11 -0.03 0.28 -1.40 0.00 0.00 179.01 177.54 3k2h h VAL 52 N 0.17 1.25 -0.51 3.13 2.07 -1.38 -3.20 116.25 117.78 3k2h h VAL 52 Ca 0.17 -1.10 -0.12 0.00 0.82 0.00 0.00 66.70 66.47 3k2h h VAL 52 Cb 0.20 0.90 -0.02 0.00 -1.52 0.00 0.00 31.29 30.86 3k2h h VAL 52 CO -0.23 0.39 -0.16 0.25 0.02 0.00 0.00 177.57 177.84 3k2h h LEU 53 N 0.80 1.00 -0.55 2.57 5.85 -0.67 -2.51 115.31 121.80 3k2h h LEU 53 Ca 0.15 -0.35 -0.06 0.00 0.84 0.00 0.00 57.88 58.45 3k2h h LEU 53 Cb 0.52 -0.27 -0.02 0.00 0.37 0.00 0.00 40.66 41.26 3k2h h LEU 53 CO 0.03 1.14 0.10 0.77 -0.34 0.00 0.00 178.44 180.14 3k2h h SER 54 N 0.87 0.87 -0.77 1.25 4.64 -1.34 -1.03 113.55 118.04 3k2h h SER 54 Ca 0.13 -0.25 -0.02 0.00 -0.47 0.00 0.00 61.79 61.17 3k2h h SER 54 Cb 0.72 -0.23 -0.04 0.00 -0.31 0.00 0.00 62.40 62.55 3k2h h SER 54 CO 0.06 0.90 0.39 0.11 -0.87 0.00 0.00 176.83 177.42 3k2h h LYS 55 N 0.80 1.09 -2.93 4.77 6.56 -1.55 -3.36 116.57 121.95 3k2h h LYS 55 Ca 0.17 -0.15 -0.61 0.00 -1.06 0.00 0.00 60.65 59.01 3k2h h LYS 55 Cb 0.39 -0.20 -0.40 0.00 -0.57 0.00 0.00 32.23 31.45 3k2h h LYS 55 CO 0.01 0.83 -0.75 -0.80 -2.06 0.00 0.00 179.45 176.68 3k2h s ASN 56 N -6.15 3.54 0.00 0.86 0.01 -0.95 -5.01 114.94 107.24 3k2h s ASN 56 Ca -0.13 -2.57 0.20 0.00 -0.71 0.00 0.00 52.86 49.65 3k2h s ASN 56 Cb 0.15 -0.94 1.17 0.00 0.41 0.00 0.00 41.25 42.03 3k2h s ASN 56 CO 0.81 -0.27 1.58 -0.81 -1.51 0.00 0.00 177.10 176.90 3k2h n PRO 57 N 3.60 0.59 -0.06 -0.60 -0.04 -0.40 -1.81 135.00 136.28 3k2h n PRO 57 Ca 0.09 0.01 0.07 0.00 -0.04 0.00 0.00 63.50 63.63 3k2h n PRO 57 Cb 0.35 -1.50 0.09 0.00 -0.04 0.00 0.00 33.50 32.40 3k2h n PRO 57 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 3k2h n ASP 58 N -1.03 2.41 -4.78 3.54 8.00 -1.26 -5.03 116.55 118.40 3k2h n ASP 58 Ca 0.14 -1.69 -0.41 0.00 0.71 0.00 0.00 54.79 53.55 3k2h n ASP 58 Cb 0.08 -0.08 0.00 0.00 -0.02 0.00 0.00 41.12 41.10 3k2h n ASP 58 CO 0.00 0.00 0.00 -0.51 -0.39 0.00 0.00 177.20 176.30 3k2h s ILE 59 N -1.10 2.06 0.19 0.53 2.07 -0.75 -5.02 121.20 119.18 3k2h s ILE 59 Ca 0.19 0.06 0.04 0.00 -1.41 0.00 0.00 60.65 59.53 3k2h s ILE 59 Cb 0.12 -3.04 -0.05 0.00 0.13 0.00 0.00 42.46 39.63 3k2h s ILE 59 CO 0.18 0.01 -0.05 -1.10 -1.91 0.00 0.00 174.94 172.07 3k2h s GLN 60 N -2.17 1.21 0.65 3.50 -0.21 -1.26 -4.92 119.66 116.46 3k2h s GLN 60 Ca 0.54 -1.57 -0.07 0.00 0.02 0.00 0.00 55.36 54.28 3k2h s GLN 60 Cb -0.46 -0.60 0.03 0.00 1.00 0.00 0.00 33.01 32.97 3k2h s GLN 60 CO 0.62 -0.02 0.97 -0.80 -2.12 0.00 0.00 175.29 173.94 3k2h s ASN 61 N -3.24 5.33 -0.08 5.90 0.01 -1.26 0.16 114.94 121.76 3k2h s ASN 61 Ca 0.23 0.72 -0.03 0.00 -0.71 0.00 0.00 52.86 53.07 3k2h s ASN 61 Cb 0.04 -1.57 -0.04 0.00 0.41 0.00 0.00 41.25 40.10 3k2h s ASN 61 CO 0.05 -1.28 0.04 -0.69 -1.51 0.00 0.00 177.10 173.71 3k2h s VAL 62 N -3.14 4.58 -0.08 1.60 1.01 0.12 -0.55 120.40 123.95 3k2h s VAL 62 Ca 0.56 -0.18 0.05 0.00 0.00 0.00 0.00 61.98 62.41 3k2h s VAL 62 Cb -0.11 -2.96 -0.00 0.00 0.00 0.00 0.00 36.38 33.31 3k2h s VAL 62 CO 0.46 0.58 -0.24 0.68 0.00 0.00 0.00 175.10 176.58 3k2h s VAL 63 N -0.95 2.03 -0.13 2.92 -7.23 -0.25 0.23 120.40 117.02 3k2h s VAL 63 Ca 0.15 -1.02 -0.00 0.00 -1.81 0.00 0.00 61.98 59.29 3k2h s VAL 63 Cb -0.12 -1.74 -0.02 0.00 0.56 0.00 0.00 36.38 35.07 3k2h s VAL 63 CO 0.04 0.56 -0.13 -0.63 -0.31 0.00 0.00 175.10 174.63 3k2h s ILE 64 N 0.14 3.08 0.13 -0.62 1.01 0.10 -0.53 121.20 124.52 3k2h s ILE 64 Ca -0.12 -0.65 0.06 0.00 0.00 0.00 0.00 60.65 59.93 3k2h s ILE 64 Cb -0.16 -2.29 -0.04 0.00 0.01 0.00 0.00 42.46 39.98 3k2h s ILE 64 CO 0.07 0.53 -0.14 -0.36 0.00 0.00 0.00 174.94 175.04 3k2h s PHE 65 N 0.28 1.39 0.75 3.97 0.08 0.64 -0.68 117.98 124.41 3k2h s PHE 65 Ca -0.09 -0.58 -0.14 0.00 0.12 0.00 0.00 56.93 56.25 3k2h s PHE 65 Cb -0.16 -0.72 0.05 0.00 -0.57 0.00 0.00 43.02 41.62 3k2h s PHE 65 CO 0.05 0.14 1.16 0.20 -0.10 0.00 0.00 175.22 176.68 3k2h s GLY 66 N -2.55 2.11 0.18 4.36 0.00 0.10 -0.59 107.32 110.93 3k2h s GLY 66 Ca 0.10 0.68 -0.17 0.00 0.00 0.00 0.00 44.72 45.33 3k2h s GLY 66 CO 0.03 1.07 1.63 -0.09 0.00 0.00 0.00 173.10 175.74 3k2h h ARG 67 N -0.60 -0.08 -0.64 2.90 2.43 -1.82 -2.30 114.38 114.27 3k2h h ARG 67 Ca -0.46 0.01 -0.03 0.00 -0.81 0.00 0.00 59.98 58.68 3k2h h ARG 67 Cb 1.27 0.02 -0.03 0.00 -0.42 0.00 0.00 29.97 30.81 3k2h h ARG 67 CO 0.49 -0.05 0.27 0.87 -1.51 0.00 0.00 179.97 180.04 3k2h h LYS 68 N -0.08 0.95 -0.65 0.20 1.57 -1.93 -1.14 116.57 115.48 3k2h h LYS 68 Ca 0.23 -0.16 -0.05 0.00 -1.87 0.00 0.00 60.65 58.79 3k2h h LYS 68 Cb 0.43 -0.16 -0.03 0.00 0.08 0.00 0.00 32.23 32.55 3k2h h LYS 68 CO -0.53 0.79 0.21 1.15 -0.57 0.00 0.00 179.45 180.50 3k2h h THR 69 N 0.90 1.24 0.52 -0.16 2.02 -1.82 -1.24 112.91 114.37 3k2h h THR 69 Ca 0.22 -0.82 -0.03 0.00 0.77 0.00 0.00 66.41 66.55 3k2h h THR 69 Cb 0.19 0.52 0.01 0.00 -1.74 0.00 0.00 68.15 67.12 3k2h h THR 69 CO -0.02 0.32 -0.25 0.22 0.37 0.00 0.00 175.52 176.16 3k2h h TYR 70 N 0.96 -0.64 -0.14 3.16 3.20 -0.90 -2.03 116.97 120.57 3k2h h TYR 70 Ca 0.21 -0.02 0.04 0.00 3.14 0.00 0.00 58.73 62.11 3k2h h TYR 70 Cb 0.27 0.21 -0.01 0.00 1.54 0.00 0.00 36.73 38.74 3k2h h TYR 70 CO 0.02 -0.39 0.47 0.93 -1.64 0.00 0.00 178.16 177.55 3k2h h GLU 71 N -0.71 0.00 0.00 1.82 5.08 -0.99 -0.73 114.58 119.06 3k2h h GLU 71 Ca -0.07 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.29 3k2h h GLU 71 Cb 0.54 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.79 3k2h h GLU 71 CO 0.12 0.00 0.00 0.45 -1.00 0.00 0.00 179.01 178.58 3k2h n SER 72 N -3.06 0.80 -4.81 1.42 2.88 -0.49 -4.79 113.62 105.58 3k2h n SER 72 Ca 0.02 0.61 -0.34 0.00 -1.33 0.00 0.00 58.87 57.83 3k2h n SER 72 Cb 0.56 -0.81 -0.07 0.00 -0.75 0.00 0.00 64.21 63.14 3k2h n SER 72 CO 0.00 0.00 0.00 -0.63 -1.23 0.00 0.00 175.04 173.18 3k2h s ILE 73 N -3.17 4.94 0.19 2.46 1.01 -0.28 -4.81 121.20 121.54 3k2h s ILE 73 Ca 0.09 -0.24 -0.31 0.00 0.00 0.00 0.00 60.65 60.18 3k2h s ILE 73 Cb 0.11 -3.23 -0.16 0.00 0.01 0.00 0.00 42.46 39.19 3k2h s ILE 73 CO 0.54 0.42 0.95 -0.81 0.00 0.00 0.00 174.94 176.04 3k2h n PRO 74 N 1.37 0.81 0.27 2.79 -0.04 -1.26 -4.85 135.00 134.09 3k2h n PRO 74 Ca -0.14 0.29 0.17 0.00 -0.04 0.00 0.00 63.50 63.78 3k2h n PRO 74 Cb 0.53 -1.63 0.93 0.00 -0.04 0.00 0.00 33.50 33.29 3k2h n PRO 74 CO 0.00 0.00 0.00 1.57 -0.04 0.00 0.00 175.50 177.03 3k2h h LYS 75 N 2.38 0.00 0.22 0.54 -0.00 -1.92 -2.74 116.57 115.04 3k2h h LYS 75 Ca -0.39 0.00 -0.33 0.00 -0.00 0.00 0.00 60.65 59.93 3k2h h LYS 75 Cb 1.37 0.00 0.02 0.00 -0.00 0.00 0.00 32.23 33.63 3k2h h LYS 75 CO 0.64 0.00 -1.52 0.00 -0.00 0.00 0.00 179.45 178.56 3k2h h ALA 76 N 1.92 -0.03 0.00 0.07 0.00 -2.01 -3.27 119.26 115.94 3k2h h ALA 76 Ca 0.00 -0.95 0.00 0.00 0.00 0.00 0.00 54.91 53.96 3k2h h ALA 76 Cb 0.07 0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.09 3k2h h ALA 76 CO 0.00 0.84 0.00 0.45 0.00 0.00 0.00 179.25 180.54 3k2h n SER 77 N -3.64 0.00 -4.20 0.00 2.88 -1.04 -4.86 113.62 102.76 3k2h n SER 77 Ca -0.18 -1.43 -0.21 0.00 -1.33 0.00 0.00 58.87 55.72 3k2h n SER 77 Cb 1.09 0.00 -0.13 0.00 -0.75 0.00 0.00 64.21 64.42 3k2h n SER 77 CO 0.00 0.00 0.00 -0.76 -1.23 0.00 0.00 175.04 173.05 3k2h s LEU 78 N -1.56 2.23 0.57 2.46 1.43 -1.22 -3.77 118.68 118.82 3k2h s LEU 78 Ca 0.27 -0.56 -0.21 0.00 -1.03 0.00 0.00 54.13 52.59 3k2h s LEU 78 Cb 0.12 -0.69 -0.04 0.00 0.03 0.00 0.00 46.19 45.61 3k2h s LEU 78 CO 0.21 0.02 1.35 -2.16 0.23 0.00 0.00 176.35 176.00 3k2h s PRO 79 N -1.49 3.02 -0.03 1.29 0.04 -1.26 -4.94 135.00 131.63 3k2h s PRO 79 Ca 0.02 2.20 -0.37 0.00 0.04 0.00 0.00 61.00 62.90 3k2h s PRO 79 Cb -0.09 -2.17 -0.15 0.00 0.04 0.00 0.00 34.50 32.13 3k2h s PRO 79 CO 0.02 -1.27 1.61 1.28 0.04 0.00 0.00 177.00 178.68 3k2h n LEU 80 N -1.21 2.51 -4.77 -3.56 4.77 -1.25 -4.87 117.00 108.63 3k2h n LEU 80 Ca 0.11 1.07 -0.41 0.00 -0.03 0.00 0.00 56.01 56.76 3k2h n LEU 80 Cb 0.46 -1.26 -0.02 0.00 -2.33 0.00 0.00 43.42 40.26 3k2h n LEU 80 CO 0.52 -0.52 1.01 -0.75 -1.33 0.00 0.00 177.39 176.31 3k2h s LYS 81 N 2.13 4.32 -0.19 3.23 2.20 -1.26 -3.45 119.74 126.72 3k2h s LYS 81 Ca 0.89 2.26 0.00 0.00 -0.36 0.00 0.00 55.97 58.75 3k2h s LYS 81 Cb -0.88 -3.07 0.00 0.00 -1.51 0.00 0.00 37.83 32.37 3k2h s LYS 81 CO 0.51 -0.25 0.00 0.09 -0.36 0.00 0.00 175.35 175.34 3k2h n ASN 82 N 1.02 -4.37 -4.26 1.43 3.02 -1.26 -4.98 115.26 105.86 3k2h n ASN 82 Ca 0.01 0.04 -0.15 0.00 -0.03 0.00 0.00 54.58 54.46 3k2h n ASN 82 Cb 0.41 -2.03 -0.10 0.00 -0.61 0.00 0.00 39.78 37.46 3k2h n ASN 82 CO 0.00 0.00 0.00 -0.13 -2.62 0.00 0.00 177.26 174.51 3k2h s ARG 83 N -1.28 1.09 -0.27 3.52 0.52 -1.22 -4.43 118.95 116.88 3k2h s ARG 83 Ca 0.00 -1.48 -0.23 0.00 -0.52 0.00 0.00 55.73 53.50 3k2h s ARG 83 Cb 0.00 -0.63 -0.01 0.00 0.52 0.00 0.00 34.95 34.83 3k2h s ARG 83 CO 0.00 0.06 0.76 0.42 0.02 0.00 0.00 175.30 176.56 3k2h s ILE 84 N -3.33 4.86 -0.14 1.52 1.01 0.29 -4.87 121.20 120.54 3k2h s ILE 84 Ca 0.18 1.29 -0.20 0.00 0.00 0.00 0.00 60.65 61.91 3k2h s ILE 84 Cb 0.03 -4.08 -0.04 0.00 0.01 0.00 0.00 42.46 38.38 3k2h s ILE 84 CO 0.01 -0.12 0.57 0.20 0.00 0.00 0.00 174.94 175.61 3k2h s ASN 85 N 1.49 6.74 -0.08 3.58 0.02 -1.26 -1.10 114.94 124.34 3k2h s ASN 85 Ca 0.31 0.89 0.03 0.00 -1.02 0.00 0.00 52.86 53.08 3k2h s ASN 85 Cb -0.15 -2.33 0.01 0.00 0.02 0.00 0.00 41.25 38.80 3k2h s ASN 85 CO 0.10 -0.12 -0.17 -0.69 0.02 0.00 0.00 177.10 176.24 3k2h s VAL 86 N 1.11 1.50 -0.07 1.60 1.01 0.31 -0.87 120.40 124.99 3k2h s VAL 86 Ca 0.29 -0.70 0.03 0.00 0.00 0.00 0.00 61.98 61.61 3k2h s VAL 86 Cb -0.16 -1.33 -0.02 0.00 0.00 0.00 0.00 36.38 34.87 3k2h s VAL 86 CO 0.12 0.44 -0.17 -0.63 0.00 0.00 0.00 175.10 174.86 3k2h s ILE 87 N 0.48 2.82 -0.13 2.22 1.01 -0.45 -0.26 121.20 126.88 3k2h s ILE 87 Ca -0.15 -0.79 -0.05 0.00 0.00 0.00 0.00 60.65 59.65 3k2h s ILE 87 Cb -0.16 -2.11 -0.04 0.00 0.01 0.00 0.00 42.46 40.16 3k2h s ILE 87 CO 0.05 0.57 0.06 -0.76 0.00 0.00 0.00 174.94 174.86 3k2h s LEU 88 N -0.34 3.87 -0.27 2.97 1.43 0.24 -1.17 118.68 125.42 3k2h s LEU 88 Ca 0.03 0.20 -0.27 0.00 -1.03 0.00 0.00 54.13 53.06 3k2h s LEU 88 Cb -0.13 -1.94 0.16 0.00 0.03 0.00 0.00 46.19 44.32 3k2h s LEU 88 CO 0.02 0.30 1.24 -0.55 0.23 0.00 0.00 176.35 177.60 3k2h s SER 89 N -0.41 -0.21 0.00 2.29 0.15 -0.08 -2.32 113.70 113.12 3k2h s SER 89 Ca 0.09 0.34 0.13 0.00 0.70 0.00 0.00 55.95 57.22 3k2h s SER 89 Cb -0.12 0.32 0.04 0.00 -1.71 0.00 0.00 66.02 64.55 3k2h s SER 89 CO 0.02 -0.12 0.82 0.54 1.20 0.00 0.00 173.24 175.70 3k2h n ARG 90 N 1.36 1.52 0.00 5.44 1.74 -1.26 -3.95 116.66 121.51 3k2h n ARG 90 Ca -0.09 -0.94 0.01 0.00 -0.77 0.00 0.00 57.85 56.06 3k2h n ARG 90 Cb 0.57 -1.21 -0.00 0.00 -1.02 0.00 0.00 32.46 30.79 3k2h n ARG 90 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 3k2h n THR 91 N 0.18 0.00 -4.38 0.55 -2.24 -1.26 -4.99 114.28 102.14 3k2h n THR 91 Ca 0.06 -0.47 -0.20 0.00 -2.27 0.00 0.00 64.05 61.17 3k2h n THR 91 Cb 0.30 1.01 -0.15 0.00 -2.10 0.00 0.00 70.33 69.39 3k2h n THR 91 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 3k2h s VAL 92 N -0.87 0.78 -0.20 2.28 1.01 -1.26 -5.06 120.40 117.07 3k2h s VAL 92 Ca 0.01 -0.36 0.10 0.00 0.00 0.00 0.00 61.98 61.73 3k2h s VAL 92 Cb 0.01 -0.69 -0.19 0.00 0.00 0.00 0.00 36.38 35.51 3k2h s VAL 92 CO 0.05 0.24 -0.06 2.29 0.00 0.00 0.00 175.10 177.63 3k2h n LYS 93 N 3.30 0.84 -4.25 2.72 0.00 -1.26 -4.74 118.16 114.77 3k2h n LYS 93 Ca -0.18 0.05 -0.19 0.00 -0.00 0.00 0.00 58.31 57.99 3k2h n LYS 93 Cb 0.54 -1.47 -0.16 0.00 -0.00 0.00 0.00 35.03 33.95 3k2h n LYS 93 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 177.40 175.57 3k2h s GLU 94 N -2.45 0.80 -0.04 -1.58 1.03 -1.26 -4.69 118.70 110.50 3k2h s GLU 94 Ca -0.19 -0.19 0.00 0.00 0.03 0.00 0.00 54.97 54.62 3k2h s GLU 94 Cb 0.07 -0.77 0.03 0.00 -0.80 0.00 0.00 34.13 32.65 3k2h s GLU 94 CO 0.65 0.03 -0.01 0.08 -1.33 0.00 0.00 175.26 174.67 3k2h s VAL 95 N 0.46 0.33 -0.51 1.83 1.01 -1.26 -5.10 120.40 117.15 3k2h s VAL 95 Ca -0.06 0.04 -0.37 0.00 0.00 0.00 0.00 61.98 61.59 3k2h s VAL 95 Cb -0.10 -0.42 -0.15 0.00 0.00 0.00 0.00 36.38 35.71 3k2h s VAL 95 CO 0.00 0.20 2.28 -2.65 0.00 0.00 0.00 175.10 174.93 3k2h n PRO 96 N 4.38 0.56 -1.03 2.72 -0.02 -1.26 -1.72 135.00 138.63 3k2h n PRO 96 Ca -0.21 0.13 -0.01 0.00 -2.02 0.00 0.00 63.50 61.39 3k2h n PRO 96 Cb 0.50 -2.08 -0.01 0.00 -0.02 0.00 0.00 33.50 31.90 3k2h n PRO 96 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3k2h n GLY 97 N 6.80 0.49 3.46 -1.23 0.00 -1.26 -4.75 105.19 108.70 3k2h n GLY 97 Ca 0.49 -0.78 -0.23 0.00 0.00 0.00 0.00 46.02 45.49 3k2h n GLY 97 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3k2h s LEU 99 N -3.49 4.14 -0.07 0.00 1.43 -0.05 -4.64 118.68 115.99 3k2h s LEU 99 Ca 0.29 0.75 0.01 0.00 -1.03 0.00 0.00 54.13 54.15 3k2h s LEU 99 Cb -0.03 -3.53 0.02 0.00 0.03 0.00 0.00 46.19 42.68 3k2h s LEU 99 CO 0.14 -0.10 -0.08 -0.69 0.23 0.00 0.00 176.35 175.84 3k2h s VAL 100 N -1.91 0.91 0.20 -1.59 1.01 -1.26 -1.35 120.40 116.42 3k2h s VAL 100 Ca 0.44 -0.31 0.09 0.00 0.00 0.00 0.00 61.98 62.20 3k2h s VAL 100 Cb -0.11 -0.88 -0.05 0.00 0.00 0.00 0.00 36.38 35.34 3k2h s VAL 100 CO 0.26 0.32 -0.18 -0.31 0.00 0.00 0.00 175.10 175.19 3k2h s TYR 101 N 1.02 1.90 -0.07 5.22 2.02 -0.32 -4.99 117.35 122.13 3k2h s TYR 101 Ca -0.09 -0.47 0.13 0.00 -0.37 0.00 0.00 57.07 56.27 3k2h s TYR 101 Cb -0.15 -0.90 -0.06 0.00 -0.40 0.00 0.00 41.96 40.45 3k2h s TYR 101 CO -0.00 0.42 1.24 0.93 -1.57 0.00 0.00 175.55 176.57 3k2h h GLU 102 N 2.82 0.00 -3.37 -0.62 5.08 -1.88 -0.19 114.58 116.42 3k2h h GLU 102 Ca -0.41 0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 57.91 3k2h h GLU 102 Cb 1.22 0.00 -0.12 0.00 0.50 0.00 0.00 28.75 30.35 3k2h h GLU 102 CO 0.56 0.60 -0.03 0.16 -1.00 0.00 0.00 179.01 179.30 3k2h s ASP 103 N -6.38 -0.24 0.15 1.42 1.47 -1.26 -4.47 116.67 107.36 3k2h s ASP 103 Ca 0.01 -0.41 -0.16 0.00 1.18 0.00 0.00 52.55 53.17 3k2h s ASP 103 Cb 0.08 0.52 0.05 0.00 -0.34 0.00 0.00 42.92 43.23 3k2h s ASP 103 CO 0.78 -0.95 1.77 0.25 0.68 0.00 0.00 175.17 177.71 3k2h h LEU 104 N 2.29 0.25 -0.15 2.11 5.85 -1.99 -1.69 115.31 121.98 3k2h h LEU 104 Ca -0.32 0.02 0.01 0.00 0.84 0.00 0.00 57.88 58.44 3k2h h LEU 104 Cb 1.26 -0.03 -0.02 0.00 0.37 0.00 0.00 40.66 42.25 3k2h h LEU 104 CO 0.42 0.19 0.05 0.77 -0.34 0.00 0.00 178.44 179.53 3k2h h SER 105 N 0.36 0.06 -0.07 1.25 4.64 -1.98 -0.01 113.55 117.81 3k2h h SER 105 Ca 0.16 0.01 0.03 0.00 -0.47 0.00 0.00 61.79 61.52 3k2h h SER 105 Cb 0.07 0.01 -0.04 0.00 -0.31 0.00 0.00 62.40 62.13 3k2h h SER 105 CO -0.12 0.06 -0.16 0.74 -0.87 0.00 0.00 176.83 176.48 3k2h h THR 106 N 0.13 0.60 -0.07 2.95 2.02 -1.89 -2.04 112.91 114.61 3k2h h THR 106 Ca 0.06 0.00 0.04 0.00 0.77 0.00 0.00 66.41 67.28 3k2h h THR 106 Cb 0.03 0.60 -0.05 0.00 -1.74 0.00 0.00 68.15 66.99 3k2h h THR 106 CO -0.06 0.00 -0.29 0.00 0.37 0.00 0.00 175.52 175.54 3k2h h ALA 107 N 0.76 -0.36 0.02 6.16 0.00 -0.48 0.16 119.26 125.53 3k2h h ALA 107 Ca 0.07 0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.99 3k2h h ALA 107 Cb 0.33 0.53 0.00 0.00 0.00 0.00 0.00 17.79 18.65 3k2h h ALA 107 CO -0.20 -0.78 -0.01 0.82 0.00 0.00 0.00 179.25 179.08 3k2h h ILE 108 N -0.40 1.05 -0.43 0.00 1.08 -0.96 -1.42 117.51 116.43 3k2h h ILE 108 Ca 0.08 -0.22 0.08 0.00 -0.39 0.00 0.00 64.86 64.41 3k2h h ILE 108 Cb 0.52 1.20 -0.07 0.00 -3.07 0.00 0.00 36.82 35.39 3k2h h ILE 108 CO -0.29 0.06 -0.04 0.03 -0.69 0.00 0.00 178.15 177.21 3k2h h ARG 109 N -0.12 0.06 -0.59 2.37 3.08 -1.13 -0.45 114.38 117.60 3k2h h ARG 109 Ca -0.00 -0.00 -0.00 0.00 0.07 0.00 0.00 59.98 60.04 3k2h h ARG 109 Cb 0.11 -0.01 -0.03 0.00 0.08 0.00 0.00 29.97 30.12 3k2h h ARG 109 CO 0.00 0.04 0.37 0.22 -1.07 0.00 0.00 179.97 179.53 3k2h h ASP 110 N 0.06 0.70 0.13 7.04 3.58 -0.46 -1.74 116.42 125.74 3k2h h ASP 110 Ca 0.21 -0.05 -0.01 0.00 0.42 0.00 0.00 57.03 57.61 3k2h h ASP 110 Cb 0.31 -0.18 0.00 0.00 1.72 0.00 0.00 39.33 41.19 3k2h h ASP 110 CO -0.39 0.54 -0.06 -0.07 -2.88 0.00 0.00 179.24 176.38 3k2h h LEU 111 N 0.80 -0.15 -1.15 2.28 3.38 -0.88 0.12 115.31 119.71 3k2h h LEU 111 Ca 0.21 -0.17 -0.06 0.00 0.09 0.00 0.00 57.88 57.95 3k2h h LEU 111 Cb -0.04 0.04 -0.01 0.00 0.09 0.00 0.00 40.66 40.74 3k2h h LEU 111 CO -0.04 0.08 -0.31 0.03 0.09 0.00 0.00 178.44 178.29 3k2h h ARG 112 N -0.38 0.00 0.10 1.13 3.08 -1.04 -1.02 114.38 116.25 3k2h h ARG 112 Ca -0.02 0.00 -0.31 0.00 0.07 0.00 0.00 59.98 59.72 3k2h h ARG 112 Cb 0.31 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.34 3k2h h ARG 112 CO 0.03 0.31 -1.60 0.00 -1.07 0.00 0.00 179.97 177.64 3k2h h ALA 113 N 1.69 0.36 0.00 0.04 0.00 -1.33 -3.45 119.26 116.58 3k2h h ALA 113 Ca -0.00 -1.19 0.00 0.00 0.00 0.00 0.00 54.91 53.72 3k2h h ALA 113 Cb 0.76 0.35 0.00 0.00 0.00 0.00 0.00 17.79 18.90 3k2h h ALA 113 CO 0.04 1.22 -0.34 0.09 0.00 0.00 0.00 179.25 180.26 3k2h n ASN 114 N -3.40 1.71 -4.08 0.00 3.02 0.41 -4.96 115.26 107.95 3k2h n ASN 114 Ca -0.18 -0.13 -0.34 0.00 -0.03 0.00 0.00 54.58 53.91 3k2h n ASN 114 Cb 1.04 0.60 -0.13 0.00 -0.61 0.00 0.00 39.78 40.67 3k2h n ASN 114 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 3k2h s VAL 115 N -0.94 2.76 0.24 2.41 1.01 -0.39 -5.00 120.40 120.49 3k2h s VAL 115 Ca 0.00 -2.04 -0.31 0.00 0.00 0.00 0.00 61.98 59.63 3k2h s VAL 115 Cb 0.00 -2.88 -0.13 0.00 0.00 0.00 0.00 36.38 33.37 3k2h s VAL 115 CO 0.00 -0.52 1.52 -2.65 0.00 0.00 0.00 175.10 173.45 3k2h n PRO 116 N 4.45 2.32 -3.64 2.72 -0.02 -1.26 -4.64 135.00 134.94 3k2h n PRO 116 Ca -0.02 0.83 -0.03 0.00 -2.02 0.00 0.00 63.50 62.25 3k2h n PRO 116 Cb 0.42 -2.56 -0.01 0.00 -0.02 0.00 0.00 33.50 31.33 3k2h n PRO 116 CO 0.00 0.00 0.00 -3.38 1.98 0.00 0.00 175.50 174.10 3k2h s HIS 117 N 0.21 -0.15 0.00 6.00 -3.43 -1.26 -4.73 115.29 111.92 3k2h s HIS 117 Ca 0.69 -0.02 0.00 0.00 -0.80 0.00 0.00 55.06 54.93 3k2h s HIS 117 Cb -0.59 0.57 0.00 0.00 -1.43 0.00 0.00 32.58 31.13 3k2h s HIS 117 CO 0.46 -0.50 0.00 -1.71 -2.00 0.00 0.00 174.74 170.99 3k2h n ASN 118 N -0.36 0.00 -4.21 7.38 5.15 0.12 -4.91 115.26 118.43 3k2h n ASN 118 Ca -0.06 0.11 -0.21 0.00 -0.60 0.00 0.00 54.58 53.81 3k2h n ASN 118 Cb 0.61 -0.22 -0.13 0.00 -0.53 0.00 0.00 39.78 39.52 3k2h n ASN 118 CO 0.00 0.00 0.00 -0.75 1.40 0.00 0.00 177.26 177.91 3k2h s LYS 119 N -0.44 1.00 -0.20 1.20 2.20 -1.26 -5.00 119.74 117.23 3k2h s LYS 119 Ca 0.00 -0.98 -0.12 0.00 -0.36 0.00 0.00 55.97 54.51 3k2h s LYS 119 Cb 0.00 -1.10 -0.05 0.00 -1.51 0.00 0.00 37.83 35.17 3k2h s LYS 119 CO 0.00 0.26 0.23 0.42 -0.36 0.00 0.00 175.35 175.89 3k2h s ILE 120 N -1.10 5.33 0.02 5.43 1.01 -1.26 -0.70 121.20 129.93 3k2h s ILE 120 Ca 0.02 0.36 0.05 0.00 0.00 0.00 0.00 60.65 61.08 3k2h s ILE 120 Cb -0.09 -3.56 -0.03 0.00 0.01 0.00 0.00 42.46 38.78 3k2h s ILE 120 CO 0.03 0.36 -0.10 -0.36 0.00 0.00 0.00 174.94 174.87 3k2h s PHE 121 N 0.79 2.78 -0.29 3.97 0.08 0.13 -2.81 117.98 122.63 3k2h s PHE 121 Ca 0.12 -0.11 -0.06 0.00 0.12 0.00 0.00 56.93 56.99 3k2h s PHE 121 Cb -0.13 -1.55 0.01 0.00 -0.57 0.00 0.00 43.02 40.78 3k2h s PHE 121 CO 0.03 0.34 0.07 0.42 -0.10 0.00 0.00 175.22 175.98 3k2h s ILE 122 N -1.00 3.84 -0.21 0.64 -1.09 0.10 0.02 121.20 123.50 3k2h s ILE 122 Ca 0.17 -0.77 0.14 0.00 -2.23 0.00 0.00 60.65 57.96 3k2h s ILE 122 Cb -0.11 -3.00 0.49 0.00 -1.58 0.00 0.00 42.46 38.26 3k2h s ILE 122 CO 0.08 0.06 1.40 0.18 -1.23 0.00 0.00 174.94 175.43 3k2h n LEU 123 N 4.84 3.73 0.00 2.97 4.77 0.15 -2.06 117.00 131.40 3k2h n LEU 123 Ca -0.14 -3.30 0.00 0.00 -0.03 0.00 0.00 56.01 52.54 3k2h n LEU 123 Cb 0.47 -0.56 0.00 0.00 -2.33 0.00 0.00 43.42 41.01 3k2h n LEU 123 CO 0.31 0.89 0.00 0.61 -1.33 0.00 0.00 177.39 177.87 3k2h n GLY 124 N -0.86 -2.14 0.00 -0.72 0.00 -1.25 -4.89 105.19 95.33 3k2h n GLY 124 Ca 0.25 -1.68 0.00 0.00 0.00 0.00 0.00 46.02 44.59 3k2h n GLY 124 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3k2h n GLY 125 N -0.11 1.22 0.24 -0.02 0.00 -1.26 -0.72 105.19 104.53 3k2h n GLY 125 Ca 0.00 -1.50 -0.06 0.00 0.00 0.00 0.00 46.02 44.45 3k2h n GLY 125 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 3k2h h SER 126 N 0.00 0.69 -0.58 1.61 0.02 -1.96 -0.20 113.55 113.13 3k2h h SER 126 Ca 0.00 -0.05 0.12 0.00 -0.84 0.00 0.00 61.79 61.02 3k2h h SER 126 Cb 0.00 -0.17 -0.10 0.00 0.14 0.00 0.00 62.40 62.27 3k2h h SER 126 CO 0.00 0.54 -0.02 -0.26 -1.14 0.00 0.00 176.83 175.95 3k2h h PHE 127 N 0.78 -0.08 -0.05 3.45 0.04 -1.96 0.40 116.94 119.53 3k2h h PHE 127 Ca 0.21 0.04 -0.09 0.00 2.80 0.00 0.00 57.97 60.93 3k2h h PHE 127 Cb -0.04 0.12 0.01 0.00 2.20 0.00 0.00 35.95 38.24 3k2h h PHE 127 CO -0.02 -0.16 -0.33 1.25 -0.60 0.00 0.00 178.31 178.44 3k2h h LEU 128 N 0.10 0.38 -0.71 1.54 5.85 -1.79 -1.77 115.31 118.92 3k2h h LEU 128 Ca 0.30 -0.68 0.01 0.00 0.84 0.00 0.00 57.88 58.35 3k2h h LEU 128 Cb 0.47 -0.11 -0.04 0.00 0.37 0.00 0.00 40.66 41.35 3k2h h LEU 128 CO -0.51 1.00 0.47 1.88 -0.34 0.00 0.00 178.44 180.94 3k2h h TYR 129 N -0.21 0.89 -0.06 1.25 0.05 -0.71 -0.93 116.97 117.25 3k2h h TYR 129 Ca -0.03 0.02 -0.00 0.00 0.05 0.00 0.00 58.73 58.77 3k2h h TYR 129 Cb 1.00 -0.30 -0.00 0.00 1.01 0.00 0.00 36.73 38.44 3k2h h TYR 129 CO 0.14 0.56 0.03 -0.22 -1.05 0.00 0.00 178.16 177.62 3k2h h LYS 130 N 0.95 0.08 -0.79 4.88 1.63 -0.23 -0.34 116.57 122.76 3k2h h LYS 130 Ca 0.26 -0.01 0.03 0.00 -0.85 0.00 0.00 60.65 60.08 3k2h h LYS 130 Cb -0.11 -0.02 -0.05 0.00 -0.60 0.00 0.00 32.23 31.46 3k2h h LYS 130 CO -0.06 0.13 0.50 1.49 -3.45 0.00 0.00 179.45 178.07 3k2h h GLU 131 N 0.01 0.94 -0.52 1.90 4.81 -1.10 0.26 114.58 120.88 3k2h h GLU 131 Ca 0.02 -0.06 -0.07 0.00 -0.13 0.00 0.00 59.36 59.13 3k2h h GLU 131 Cb 0.08 -0.21 -0.02 0.00 0.63 0.00 0.00 28.75 29.22 3k2h h GLU 131 CO -0.00 0.63 0.07 0.28 -0.73 0.00 0.00 179.01 179.25 3k2h h VAL 132 N 0.97 1.25 0.02 0.32 2.07 -0.88 -2.39 116.25 117.62 3k2h h VAL 132 Ca 0.31 -0.97 -0.05 0.00 0.82 0.00 0.00 66.70 66.81 3k2h h VAL 132 Cb 0.01 0.87 0.00 0.00 -1.52 0.00 0.00 31.29 30.66 3k2h h VAL 132 CO -0.11 0.35 -0.21 -0.07 0.02 0.00 0.00 177.57 177.55 3k2h h LEU 133 N 0.75 0.15 -1.85 2.57 3.38 -0.76 0.23 115.31 119.79 3k2h h LEU 133 Ca 0.16 -0.88 0.15 0.00 0.09 0.00 0.00 57.88 57.39 3k2h h LEU 133 Cb 0.42 -0.05 -0.03 0.00 0.09 0.00 0.00 40.66 41.10 3k2h h LEU 133 CO 0.01 1.01 0.42 0.44 0.09 0.00 0.00 178.44 180.41 3k2h h ASP 134 N -0.70 0.15 -0.66 -0.43 5.19 -0.54 -1.50 116.42 117.92 3k2h h ASP 134 Ca -0.03 0.01 0.00 0.00 -0.62 0.00 0.00 57.03 56.39 3k2h h ASP 134 Cb 1.06 -0.02 0.00 0.00 0.18 0.00 0.00 39.33 40.55 3k2h h ASP 134 CO 0.04 0.08 0.00 0.59 -3.12 0.00 0.00 179.24 176.83 3k2h n ASN 135 N -4.42 4.68 -1.94 6.45 3.02 -0.90 -4.97 115.26 117.18 3k2h n ASN 135 Ca 0.11 -2.39 -0.20 0.00 -0.03 0.00 0.00 54.58 52.07 3k2h n ASN 135 Cb 0.56 -0.57 -0.04 0.00 -0.61 0.00 0.00 39.78 39.12 3k2h n ASN 135 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3k2h n GLY 136 N 1.20 0.51 0.07 7.41 0.00 -0.56 -4.89 105.19 108.93 3k2h n GLY 136 Ca 0.26 -0.06 0.14 0.00 0.00 0.00 0.00 46.02 46.36 3k2h n GLY 136 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3k2h n LEU 137 N -2.58 0.32 -4.47 0.99 4.77 0.06 -4.77 117.00 111.31 3k2h n LEU 137 Ca -0.22 0.11 -0.33 0.00 -0.03 0.00 0.00 56.01 55.54 3k2h n LEU 137 Cb 0.66 -0.23 -0.13 0.00 -2.33 0.00 0.00 43.42 41.39 3k2h n LEU 137 CO 0.28 0.06 -0.38 0.00 -1.33 0.00 0.00 177.39 176.02 3k2h n ASP 139 N 3.37 0.72 -3.73 0.00 8.00 -1.21 -4.82 116.55 118.89 3k2h n ASP 139 Ca -0.18 -0.69 -0.13 0.00 0.71 0.00 0.00 54.79 54.50 3k2h n ASP 139 Cb 0.53 1.06 -0.10 0.00 -0.02 0.00 0.00 41.12 42.58 3k2h n ASP 139 CO 0.00 0.00 0.00 -0.75 -0.39 0.00 0.00 177.20 176.06 3k2h s LYS 140 N -2.17 0.47 -0.08 -1.24 2.20 -1.26 -1.57 119.74 116.09 3k2h s LYS 140 Ca 0.03 0.59 0.01 0.00 -0.36 0.00 0.00 55.97 56.24 3k2h s LYS 140 Cb 0.09 0.20 0.02 0.00 -1.51 0.00 0.00 37.83 36.63 3k2h s LYS 140 CO 0.48 -0.07 -0.08 0.42 -0.36 0.00 0.00 175.35 175.74 3k2h s ILE 141 N 0.34 0.91 -0.38 5.43 1.01 0.54 -2.21 121.20 126.85 3k2h s ILE 141 Ca -0.01 -0.29 -0.16 0.00 0.00 0.00 0.00 60.65 60.18 3k2h s ILE 141 Cb -0.03 -0.90 0.01 0.00 0.01 0.00 0.00 42.46 41.54 3k2h s ILE 141 CO -0.01 0.32 0.41 -0.31 0.00 0.00 0.00 174.94 175.36 3k2h s TYR 142 N 1.16 3.19 -0.11 3.97 1.51 0.66 -0.47 117.35 127.25 3k2h s TYR 142 Ca -0.06 -0.18 -0.00 0.00 -1.01 0.00 0.00 57.07 55.81 3k2h s TYR 142 Cb -0.14 -2.80 0.02 0.00 -0.11 0.00 0.00 41.96 38.93 3k2h s TYR 142 CO -0.02 -0.57 -0.08 -1.17 -1.11 0.00 0.00 175.55 172.60 3k2h s LEU 143 N 2.10 1.24 -0.35 -1.29 0.20 0.07 -1.57 118.68 119.08 3k2h s LEU 143 Ca 0.12 -0.32 -0.23 0.00 0.69 0.00 0.00 54.13 54.40 3k2h s LEU 143 Cb -0.17 -0.87 0.01 0.00 -0.43 0.00 0.00 46.19 44.73 3k2h s LEU 143 CO 0.13 -0.11 0.77 -0.89 -0.29 0.00 0.00 176.35 175.96 3k2h s THR 144 N 1.66 4.76 -0.22 3.68 2.01 -0.66 -0.35 115.64 126.52 3k2h s THR 144 Ca 0.04 0.90 -0.19 0.00 0.31 0.00 0.00 61.69 62.76 3k2h s THR 144 Cb -0.13 -4.18 -0.03 0.00 0.01 0.00 0.00 72.50 68.17 3k2h s THR 144 CO -0.08 -0.39 0.57 -0.13 -0.69 0.00 0.00 174.62 173.90 3k2h s ARG 145 N 3.03 4.17 -0.17 4.92 0.52 -0.10 -1.03 118.95 130.30 3k2h s ARG 145 Ca 0.31 0.48 -0.07 0.00 -0.52 0.00 0.00 55.73 55.93 3k2h s ARG 145 Cb -0.13 -3.59 -0.04 0.00 0.52 0.00 0.00 34.95 31.70 3k2h s ARG 145 CO 0.16 -0.24 0.06 -0.51 0.02 0.00 0.00 175.30 174.78 3k2h s LEU 146 N 1.94 3.82 -0.04 2.53 1.02 -0.05 -2.15 118.68 125.75 3k2h s LEU 146 Ca 0.25 0.11 0.02 0.00 0.02 0.00 0.00 54.13 54.53 3k2h s LEU 146 Cb -0.16 -1.95 0.15 0.00 0.02 0.00 0.00 46.19 44.25 3k2h s LEU 146 CO 0.10 0.21 0.72 0.59 0.02 0.00 0.00 176.35 177.98 3k2h n ASN 147 N 3.32 1.84 -4.13 2.29 4.13 -0.49 -1.79 115.26 120.43 3k2h n ASN 147 Ca -0.17 -2.17 -0.19 0.00 1.68 0.00 0.00 54.58 53.74 3k2h n ASN 147 Cb 0.52 -0.53 -0.13 0.00 -1.54 0.00 0.00 39.78 38.10 3k2h n ASN 147 CO 0.00 0.00 0.00 -0.75 0.28 0.00 0.00 177.26 176.79 3k2h s LYS 148 N -1.31 0.84 0.17 3.52 2.20 -1.26 -4.66 119.74 119.23 3k2h s LYS 148 Ca 0.10 -0.77 -0.28 0.00 -0.36 0.00 0.00 55.97 54.65 3k2h s LYS 148 Cb 0.07 -0.83 -0.08 0.00 -1.51 0.00 0.00 37.83 35.49 3k2h s LYS 148 CO 0.03 0.20 0.89 -1.21 -0.36 0.00 0.00 175.35 174.90 3k2h s GLU 149 N -1.26 4.72 0.04 4.03 2.02 -1.26 -0.67 118.70 126.32 3k2h s GLU 149 Ca -0.00 1.37 0.07 0.00 0.02 0.00 0.00 54.97 56.43 3k2h s GLU 149 Cb -0.08 -3.31 -0.02 0.00 0.10 0.00 0.00 34.13 30.81 3k2h s GLU 149 CO 0.01 0.43 -0.20 0.71 0.02 0.00 0.00 175.26 176.22 3k2h s TYR 150 N -0.75 1.79 0.50 1.61 1.51 -1.26 -4.94 117.35 115.81 3k2h s TYR 150 Ca 0.41 -0.37 -0.23 0.00 -1.01 0.00 0.00 57.07 55.86 3k2h s TYR 150 Cb -0.24 -1.07 -0.07 0.00 -0.11 0.00 0.00 41.96 40.48 3k2h s TYR 150 CO 0.29 0.09 1.38 -2.14 -1.11 0.00 0.00 175.55 174.06 3k2h s PRO 151 N -1.18 3.43 -0.09 -1.71 0.02 -1.26 -4.82 135.00 129.40 3k2h s PRO 151 Ca 0.07 2.29 -0.32 0.00 0.02 0.00 0.00 61.00 63.07 3k2h s PRO 151 Cb -0.09 -2.45 0.13 0.00 0.02 0.00 0.00 34.50 32.11 3k2h s PRO 151 CO 0.02 -0.98 1.41 0.20 -0.33 0.00 0.00 177.00 177.32 3k2h s GLY 152 N -0.77 -0.39 0.00 0.52 0.00 -1.26 -4.71 107.32 100.71 3k2h s GLY 152 Ca 0.66 0.65 0.00 0.00 0.00 0.00 0.00 44.72 46.03 3k2h s GLY 152 CO 0.51 2.64 0.16 2.09 0.00 0.00 0.00 173.10 178.50 3k2h n ASP 153 N -0.69 0.32 -4.08 1.64 5.68 -0.27 -4.97 116.55 114.18 3k2h n ASP 153 Ca -0.04 -0.89 -0.26 0.00 -0.50 0.00 0.00 54.79 53.10 3k2h n ASP 153 Cb 0.62 0.05 -0.16 0.00 -1.14 0.00 0.00 41.12 40.48 3k2h n ASP 153 CO 0.00 0.00 0.00 -0.89 -1.33 0.00 0.00 177.20 174.98 3k2h s THR 154 N -0.05 1.33 0.06 2.12 2.01 -1.00 -5.02 115.64 115.10 3k2h s THR 154 Ca 0.00 -0.61 0.06 0.00 0.31 0.00 0.00 61.69 61.45 3k2h s THR 154 Cb 0.00 -1.18 -0.03 0.00 0.01 0.00 0.00 72.50 71.30 3k2h s THR 154 CO 0.00 0.40 -0.17 -0.31 -0.69 0.00 0.00 174.62 173.85 3k2h s TYR 155 N 0.46 1.48 0.02 4.92 1.51 -1.26 -0.54 117.35 123.94 3k2h s TYR 155 Ca -0.13 -0.39 -0.30 0.00 -1.01 0.00 0.00 57.07 55.24 3k2h s TYR 155 Cb -0.15 -0.86 -0.04 0.00 -0.11 0.00 0.00 41.96 40.81 3k2h s TYR 155 CO 0.04 0.09 1.03 0.12 -1.11 0.00 0.00 175.55 175.72 3k2h s PHE 156 N -0.97 3.62 0.94 2.71 5.36 0.07 -4.70 117.98 125.00 3k2h s PHE 156 Ca 0.03 1.62 -0.11 0.00 -0.96 0.00 0.00 56.93 57.51 3k2h s PHE 156 Cb -0.09 -3.18 0.13 0.00 -0.34 0.00 0.00 43.02 39.54 3k2h s PHE 156 CO 0.02 -0.28 0.98 -2.30 -1.46 0.00 0.00 175.22 172.18 3k2h n PRO 157 N 3.84 -0.52 -2.02 10.12 -0.02 -1.26 -4.93 135.00 140.22 3k2h n PRO 157 Ca 0.06 -0.09 -0.39 0.00 -2.02 0.00 0.00 63.50 61.07 3k2h n PRO 157 Cb 0.50 -2.26 0.01 0.00 -0.02 0.00 0.00 33.50 31.73 3k2h n PRO 157 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 3k2h s ASP 158 N -2.49 6.02 -0.14 2.55 1.01 -1.26 -4.97 116.67 117.39 3k2h s ASP 158 Ca 0.65 2.63 -0.25 0.00 0.71 0.00 0.00 52.55 56.28 3k2h s ASP 158 Cb -0.23 -2.63 -0.02 0.00 1.01 0.00 0.00 42.92 41.05 3k2h s ASP 158 CO 0.60 -1.05 0.81 -0.63 0.21 0.00 0.00 175.17 175.12 3k2h s ILE 159 N -1.33 4.92 0.73 0.77 1.01 -1.26 -5.02 121.20 121.01 3k2h s ILE 159 Ca 0.62 1.61 -0.16 0.00 0.00 0.00 0.00 60.65 62.72 3k2h s ILE 159 Cb -0.37 -4.12 0.04 0.00 0.01 0.00 0.00 42.46 38.01 3k2h s ILE 159 CO 0.46 0.08 1.26 -2.84 0.00 0.00 0.00 174.94 173.90 3k2h s PRO 160 N 1.81 2.09 0.00 2.79 0.02 -1.26 -4.87 135.00 135.58 3k2h s PRO 160 Ca 0.39 1.93 0.05 0.00 0.02 0.00 0.00 61.00 63.39 3k2h s PRO 160 Cb -0.17 -1.81 0.31 0.00 0.02 0.00 0.00 34.50 32.85 3k2h s PRO 160 CO 0.14 -1.91 1.06 -0.40 -0.33 0.00 0.00 177.00 175.56 3k2h n ASP 161 N -2.58 0.00 0.12 2.53 5.68 -1.26 -1.61 116.55 119.42 3k2h n ASP 161 Ca 0.15 -1.53 0.13 0.00 -0.50 0.00 0.00 54.79 53.03 3k2h n ASP 161 Cb 0.49 0.00 0.39 0.00 -1.14 0.00 0.00 41.12 40.86 3k2h n ASP 161 CO 0.00 0.00 0.00 0.71 -1.33 0.00 0.00 177.20 176.58 3k2h h THR 162 N 0.00 0.00 -2.91 2.12 1.35 -1.96 -3.46 112.91 108.05 3k2h h THR 162 Ca 0.00 -0.51 -0.54 0.00 -0.55 0.00 0.00 66.41 64.81 3k2h h THR 162 Cb 0.00 1.49 -0.02 0.00 -1.73 0.00 0.00 68.15 67.89 3k2h h THR 162 CO 0.00 0.00 -0.32 -0.36 -0.25 0.00 0.00 175.52 174.59 3k2h s PHE 163 N -3.13 3.48 0.04 4.73 0.40 -0.64 -0.75 117.98 122.13 3k2h s PHE 163 Ca 0.10 0.38 -0.02 0.00 -0.60 0.00 0.00 56.93 56.79 3k2h s PHE 163 Cb 0.11 -1.88 -0.03 0.00 0.51 0.00 0.00 43.02 41.73 3k2h s PHE 163 CO 0.59 0.38 0.00 -1.83 0.70 0.00 0.00 175.22 175.06 3k2h s GLU 164 N -3.22 0.56 -0.07 0.44 -1.05 -0.26 -4.87 118.70 110.23 3k2h s GLU 164 Ca 0.39 -1.02 -0.30 0.00 -0.15 0.00 0.00 54.97 53.90 3k2h s GLU 164 Cb -0.11 0.20 -0.02 0.00 -0.44 0.00 0.00 34.13 33.76 3k2h s GLU 164 CO 0.28 -0.11 1.05 0.42 0.95 0.00 0.00 175.26 177.85 3k2h s ILE 165 N -3.25 4.66 -0.20 1.83 1.01 -1.26 -0.92 121.20 123.07 3k2h s ILE 165 Ca 0.01 1.93 0.02 0.00 0.00 0.00 0.00 60.65 62.61 3k2h s ILE 165 Cb 0.03 -4.24 -0.01 0.00 0.01 0.00 0.00 42.46 38.25 3k2h s ILE 165 CO -0.08 0.04 0.30 0.35 0.00 0.00 0.00 174.94 175.55 3k2h n THR 166 N 4.41 0.00 -3.74 2.92 -2.24 0.38 -4.06 114.28 111.95 3k2h n THR 166 Ca 0.09 -0.47 -0.13 0.00 -2.27 0.00 0.00 64.05 61.27 3k2h n THR 166 Cb 0.49 1.02 -0.10 0.00 -2.10 0.00 0.00 70.33 69.64 3k2h n THR 166 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3k2h s ALA 167 N -0.80 -0.96 -0.06 6.98 0.00 -1.18 -1.10 121.76 124.65 3k2h s ALA 167 Ca 0.02 0.99 -0.02 0.00 0.00 0.00 0.00 51.96 52.94 3k2h s ALA 167 Cb 0.02 -0.51 0.04 0.00 0.00 0.00 0.00 23.12 22.66 3k2h s ALA 167 CO 0.07 -0.20 0.11 0.42 0.00 0.00 0.00 175.76 176.16 3k2h s ILE 168 N -0.07 -0.10 0.97 0.00 1.01 0.31 -1.77 121.20 121.55 3k2h s ILE 168 Ca -0.02 0.25 -0.15 0.00 0.00 0.00 0.00 60.65 60.73 3k2h s ILE 168 Cb -0.03 -0.21 0.18 0.00 0.01 0.00 0.00 42.46 42.42 3k2h s ILE 168 CO 0.01 0.10 1.21 -0.94 0.00 0.00 0.00 174.94 175.33 3k2h s SER 169 N 1.49 2.99 0.76 3.58 1.04 0.40 -1.26 113.70 122.69 3k2h s SER 169 Ca -0.05 0.60 -0.11 0.00 0.48 0.00 0.00 55.95 56.87 3k2h s SER 169 Cb -0.12 -0.89 0.05 0.00 0.10 0.00 0.00 66.02 65.16 3k2h s SER 169 CO -0.05 -2.84 1.10 -2.84 0.98 0.00 0.00 173.24 169.59 3k2h s PRO 170 N -5.59 2.25 0.16 4.02 0.02 -1.22 -3.07 135.00 131.58 3k2h s PRO 170 Ca 0.69 1.25 -0.30 0.00 0.02 0.00 0.00 61.00 62.66 3k2h s PRO 170 Cb -0.09 -1.89 -0.07 0.00 0.02 0.00 0.00 34.50 32.46 3k2h s PRO 170 CO 0.53 -1.66 1.15 0.99 -0.33 0.00 0.00 177.00 177.69 3k2h s THR 171 N -2.76 3.78 0.41 0.99 2.01 -1.26 -4.54 115.64 114.26 3k2h s THR 171 Ca 0.63 1.47 0.07 0.00 0.31 0.00 0.00 61.69 64.17 3k2h s THR 171 Cb -0.18 -3.94 -0.08 0.00 0.01 0.00 0.00 72.50 68.31 3k2h s THR 171 CO 0.53 0.23 0.01 -0.36 -0.69 0.00 0.00 174.62 174.34 3k2h s PHE 172 N 0.03 2.52 -0.06 4.92 0.08 0.12 -4.51 117.98 121.09 3k2h s PHE 172 Ca 0.52 -0.66 -0.20 0.00 0.12 0.00 0.00 56.93 56.71 3k2h s PHE 172 Cb -0.31 -1.77 0.04 0.00 -0.57 0.00 0.00 43.02 40.41 3k2h s PHE 172 CO 0.35 0.44 0.46 -1.54 -0.10 0.00 0.00 175.22 174.83 3k2h s SER 173 N -3.71 -0.40 0.49 1.36 1.04 -1.16 -1.42 113.70 109.90 3k2h s SER 173 Ca 0.35 0.47 0.07 0.00 0.48 0.00 0.00 55.95 57.32 3k2h s SER 173 Cb 0.09 0.53 0.08 0.00 0.10 0.00 0.00 66.02 66.82 3k2h s SER 173 CO 0.18 -0.44 0.67 0.35 0.98 0.00 0.00 173.24 174.99 3k2h n THR 174 N 1.49 0.00 0.75 2.02 -2.24 -0.41 -5.00 114.28 110.89 3k2h n THR 174 Ca -0.19 -1.56 0.07 0.00 -2.27 0.00 0.00 64.05 60.11 3k2h n THR 174 Cb 0.56 -0.64 0.39 0.00 -2.10 0.00 0.00 70.33 68.54 3k2h n THR 174 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 3k2h n ASP 175 N -2.50 0.00 0.00 3.42 2.03 -1.26 -3.62 116.55 114.62 3k2h n ASP 175 Ca 0.13 -0.02 0.00 0.00 0.52 0.00 0.00 54.79 55.42 3k2h n ASP 175 Cb 0.49 -0.24 0.00 0.00 -0.72 0.00 0.00 41.12 40.65 3k2h n ASP 175 CO 0.00 0.00 0.00 2.22 -1.92 0.00 0.00 177.20 177.50 3k2h n PHE 176 N -1.24 0.00 -3.56 -0.67 1.16 -1.26 -5.09 117.46 106.81 3k2h n PHE 176 Ca 0.08 0.00 -0.15 0.00 -1.87 0.00 0.00 57.45 55.51 3k2h n PHE 176 Cb 0.11 0.00 -0.06 0.00 -1.61 0.00 0.00 39.48 37.92 3k2h n PHE 176 CO 0.00 0.00 0.00 0.54 -1.87 0.00 0.00 176.76 175.43 3k2h s VAL 177 N -0.92 0.00 0.06 1.97 0.11 -1.24 -5.03 120.40 115.35 3k2h s VAL 177 Ca 0.00 0.00 -0.11 0.00 -2.93 0.00 0.00 61.98 58.94 3k2h s VAL 177 Cb 0.00 -1.00 -0.06 0.00 -1.53 0.00 0.00 36.38 33.79 3k2h s VAL 177 CO 0.00 0.00 0.40 -0.44 -3.33 0.00 0.00 175.10 171.73 3k2h s SER 178 N -0.86 6.66 0.07 3.54 0.01 -1.26 -1.29 113.70 120.57 3k2h s SER 178 Ca -0.06 0.81 -0.26 0.00 1.31 0.00 0.00 55.95 57.75 3k2h s SER 178 Cb -0.01 -2.19 0.08 0.00 0.21 0.00 0.00 66.02 64.11 3k2h s SER 178 CO 0.06 0.20 0.70 -0.72 0.41 0.00 0.00 173.24 173.88 3k2h s TYR 179 N -1.34 -0.51 0.22 2.43 -0.85 -0.51 -1.40 117.35 115.39 3k2h s TYR 179 Ca 0.31 0.47 0.04 0.00 -0.52 0.00 0.00 57.07 57.37 3k2h s TYR 179 Cb -0.14 0.52 -0.01 0.00 0.38 0.00 0.00 41.96 42.70 3k2h s TYR 179 CO 0.17 -0.71 0.21 -0.40 -1.52 0.00 0.00 175.55 173.29 3k2h n ASP 180 N -0.06 -0.54 -4.44 -0.18 5.68 -0.91 0.15 116.55 116.26 3k2h n ASP 180 Ca -0.15 -2.38 -0.32 0.00 -0.50 0.00 0.00 54.79 51.43 3k2h n ASP 180 Cb 0.62 1.18 -0.14 0.00 -1.14 0.00 0.00 41.12 41.65 3k2h n ASP 180 CO 0.00 0.00 0.00 -0.36 -1.33 0.00 0.00 177.20 175.51 3k2h s PHE 181 N -3.01 2.64 0.12 2.11 0.08 -1.26 -0.92 117.98 117.73 3k2h s PHE 181 Ca 0.24 -0.25 0.03 0.00 0.12 0.00 0.00 56.93 57.08 3k2h s PHE 181 Cb 0.01 -1.62 -0.04 0.00 -0.57 0.00 0.00 43.02 40.80 3k2h s PHE 181 CO 0.17 0.12 -0.09 0.14 -0.10 0.00 0.00 175.22 175.46 3k2h s VAL 182 N -0.64 0.94 -0.14 -0.44 -7.23 0.53 -0.46 120.40 112.97 3k2h s VAL 182 Ca 0.10 -1.94 0.01 0.00 -1.81 0.00 0.00 61.98 58.33 3k2h s VAL 182 Cb -0.11 -1.70 -0.00 0.00 0.56 0.00 0.00 36.38 35.13 3k2h s VAL 182 CO 0.01 -0.77 -0.17 -0.63 -0.31 0.00 0.00 175.10 173.23 3k2h s ILE 183 N -3.30 2.59 -0.07 -0.62 1.01 -0.73 -0.75 121.20 119.34 3k2h s ILE 183 Ca 0.13 -0.81 -0.08 0.00 0.00 0.00 0.00 60.65 59.89 3k2h s ILE 183 Cb 0.03 -2.07 -0.04 0.00 0.01 0.00 0.00 42.46 40.38 3k2h s ILE 183 CO -0.02 0.53 0.21 -0.31 0.00 0.00 0.00 174.94 175.35 3k2h s TYR 184 N 0.64 3.61 0.09 3.97 2.02 0.38 -0.47 117.35 127.59 3k2h s TYR 184 Ca -0.09 0.60 0.07 0.00 -0.37 0.00 0.00 57.07 57.28 3k2h s TYR 184 Cb -0.16 -1.99 -0.03 0.00 -0.40 0.00 0.00 41.96 39.37 3k2h s TYR 184 CO 0.03 0.69 -0.18 -1.21 -1.57 0.00 0.00 175.55 173.31 3k2h s GLU 185 N -1.25 1.02 0.01 -0.62 2.02 -0.09 -0.34 118.70 119.45 3k2h s GLU 185 Ca 0.20 -1.11 -0.30 0.00 0.02 0.00 0.00 54.97 53.78 3k2h s GLU 185 Cb -0.13 -1.18 -0.07 0.00 0.10 0.00 0.00 34.13 32.85 3k2h s GLU 185 CO 0.09 0.27 1.69 0.50 0.02 0.00 0.00 175.26 177.83 3k2h s ARG 186 N -1.92 4.19 0.18 1.61 3.52 -0.61 -1.10 118.95 124.82 3k2h s ARG 186 Ca 0.04 2.30 -0.13 0.00 -0.13 0.00 0.00 55.73 57.80 3k2h s ARG 186 Cb -0.10 -3.84 0.16 0.00 -1.56 0.00 0.00 34.95 29.61 3k2h s ARG 186 CO 0.04 -0.81 1.74 0.87 -0.81 0.00 0.00 175.30 176.33 3k2h h LYS 187 N 9.12 0.30 0.00 5.12 1.57 -1.28 -1.49 116.57 129.91 3k2h h LYS 187 Ca -0.42 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.34 3k2h h LYS 187 Cb 1.20 -0.07 0.00 0.00 0.08 0.00 0.00 32.23 33.44 3k2h h LYS 187 CO 0.94 0.20 0.00 -0.40 -0.57 0.00 0.00 179.45 179.62 3k2h n ASP 188 N -5.04 0.00 -0.01 0.86 5.75 -1.26 -3.08 116.55 113.76 3k2h n ASP 188 Ca 0.05 0.41 0.00 0.00 -0.01 0.00 0.00 54.79 55.23 3k2h n ASP 188 Cb 0.20 -0.45 0.00 0.00 -1.03 0.00 0.00 41.12 39.84 3k2h n ASP 188 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3k2h n LYS 190 N -0.16 0.00 -3.68 0.00 4.76 -0.58 -4.98 118.16 113.52 3k2h n LYS 190 Ca 0.00 0.00 -0.09 0.00 -2.87 0.00 0.00 58.31 55.35 3k2h n LYS 190 Cb 0.44 0.00 -0.10 0.00 -1.84 0.00 0.00 35.03 33.53 3k2h n LYS 190 CO 0.00 0.00 0.00 -1.25 -1.37 0.00 0.00 177.40 174.78 3k2h s PRO 196 N 0.00 0.47 0.61 1.97 0.04 -1.26 -5.09 135.00 131.74 3k2h s PRO 196 Ca 0.00 0.94 -0.18 0.00 0.04 0.00 0.00 61.00 61.79 3k2h s PRO 196 Cb 0.00 0.07 -0.04 0.00 0.04 0.00 0.00 34.50 34.57 3k2h s PRO 196 CO 0.00 -0.17 1.07 -2.30 0.04 0.00 0.00 177.00 175.64 3k2h n PRO 197 N 4.40 0.98 -0.29 0.56 -0.02 -1.26 -4.89 135.00 134.48 3k2h n PRO 197 Ca -0.21 0.38 0.07 0.00 -2.02 0.00 0.00 63.50 61.72 3k2h n PRO 197 Cb 0.55 -2.28 0.29 0.00 -0.02 0.00 0.00 33.50 32.04 3k2h n PRO 197 CO 0.00 0.00 0.00 0.35 1.98 0.00 0.00 175.50 177.83 3k2h h PHE 198 N 0.53 0.97 -1.00 6.00 3.57 -2.04 -1.54 116.94 123.43 3k2h h PHE 198 Ca -0.49 0.03 0.19 0.00 3.53 0.00 0.00 57.97 61.22 3k2h h PHE 198 Cb 1.36 -0.32 -0.11 0.00 2.79 0.00 0.00 35.95 39.67 3k2h h PHE 198 CO 0.38 0.46 0.61 -0.44 -2.23 0.00 0.00 178.31 177.10 3k2h h ASP 199 N 0.91 0.79 -0.57 0.41 3.32 -1.98 0.25 116.42 119.54 3k2h h ASP 199 Ca 0.41 0.10 0.01 0.00 0.02 0.00 0.00 57.03 57.56 3k2h h ASP 199 Cb 0.37 -0.04 -0.03 0.00 0.22 0.00 0.00 39.33 39.85 3k2h h ASP 199 CO -0.17 0.28 0.38 1.56 -1.72 0.00 0.00 179.24 179.56 3k2h h GLN 200 N 0.76 0.75 0.10 3.56 4.20 -1.62 0.06 115.11 122.91 3k2h h GLN 200 Ca 0.58 -0.05 -0.17 0.00 0.06 0.00 0.00 58.65 59.08 3k2h h GLN 200 Cb 0.90 -0.17 0.02 0.00 0.30 0.00 0.00 27.48 28.53 3k2h h GLN 200 CO -0.38 0.50 -0.71 -0.07 -0.67 0.00 0.00 178.83 177.50 3k2h h LEU 201 N 0.77 0.46 -0.70 1.46 3.38 -0.65 -3.34 115.31 116.68 3k2h h LEU 201 Ca 0.21 -0.90 -0.09 0.00 0.09 0.00 0.00 57.88 57.19 3k2h h LEU 201 Cb -0.09 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 40.49 3k2h h LEU 201 CO -0.04 1.32 0.04 0.25 0.09 0.00 0.00 178.44 180.10 3k2h h LEU 202 N -0.34 1.01 0.00 1.67 5.85 -0.86 -3.19 115.31 119.45 3k2h h LEU 202 Ca -0.12 -0.26 0.00 0.00 0.84 0.00 0.00 57.88 58.34 3k2h h LEU 202 Cb 1.52 -0.27 0.00 0.00 0.37 0.00 0.00 40.66 42.28 3k2h h LEU 202 CO 0.13 1.04 0.00 0.23 -0.34 0.00 0.00 178.44 179.50 3k2h n MET 203 N -4.20 0.85 0.16 1.25 2.81 -0.00 -1.55 117.12 116.44 3k2h n MET 203 Ca 0.04 0.00 0.04 0.00 -1.81 0.00 0.00 57.70 55.96 3k2h n MET 203 Cb 0.32 -1.39 0.18 0.00 -0.71 0.00 0.00 33.22 31.62 3k2h n MET 203 CO 0.00 0.00 0.00 1.79 1.51 0.00 0.00 175.97 179.27 3k2h h THR 204 N 0.00 0.90 0.00 2.03 1.35 -1.67 -3.47 112.91 112.04 3k2h h THR 204 Ca 0.00 -1.90 0.00 0.00 -0.55 0.00 0.00 66.41 63.96 3k2h h THR 204 Cb 0.00 2.19 0.00 0.00 -1.73 0.00 0.00 68.15 68.61 3k2h h THR 204 CO 0.00 0.45 0.00 0.61 -0.25 0.00 0.00 175.52 176.33 3k2h n GLY 205 N 0.72 0.58 3.73 5.82 0.00 -0.60 -5.02 105.19 110.42 3k2h n GLY 205 Ca 0.01 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.72 3k2h n GLY 205 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3k2h s THR 206 N -2.46 1.51 -0.41 2.61 -4.23 -1.26 -5.07 115.64 106.33 3k2h s THR 206 Ca 0.00 -1.95 -0.39 0.00 -1.18 0.00 0.00 61.69 58.18 3k2h s THR 206 Cb 0.00 -2.46 -0.16 0.00 1.34 0.00 0.00 72.50 71.22 3k2h s THR 206 CO 0.00 0.00 1.38 -0.67 -0.54 0.00 0.00 174.62 174.79 3k2h n ASP 207 N -1.21 0.95 0.16 3.99 -0.08 -1.26 -4.85 116.55 114.25 3k2h n ASP 207 Ca -0.13 0.93 0.02 0.00 -1.51 0.00 0.00 54.79 54.10 3k2h n ASP 207 Cb 0.67 -0.73 0.23 0.00 2.34 0.00 0.00 41.12 43.63 3k2h n ASP 207 CO 0.00 0.00 0.00 0.16 0.12 0.00 0.00 177.20 177.48 3k2h h ILE 208 N 4.36 1.15 -3.20 5.18 3.07 -1.98 -3.38 117.51 122.72 3k2h h ILE 208 Ca -0.33 -1.89 -0.75 0.00 1.55 0.00 0.00 64.86 63.45 3k2h h ILE 208 Cb 1.14 2.08 -0.23 0.00 -0.27 0.00 0.00 36.82 39.54 3k2h h ILE 208 CO 0.82 0.50 -0.26 -0.94 -1.05 0.00 0.00 178.15 177.22 3k2h s SER 209 N -6.62 6.17 -0.41 2.16 1.04 -1.26 -4.96 113.70 109.81 3k2h s SER 209 Ca -0.00 -1.51 -0.20 0.00 0.48 0.00 0.00 55.95 54.71 3k2h s SER 209 Cb 0.11 -2.20 0.02 0.00 0.10 0.00 0.00 66.02 64.05 3k2h s SER 209 CO 0.73 -0.76 0.60 0.68 0.98 0.00 0.00 173.24 175.47 3k2h s VAL 210 N 1.69 4.89 -0.16 5.02 -7.23 -1.26 -5.02 120.40 118.33 3k2h s VAL 210 Ca 0.04 0.17 -0.32 0.00 -1.81 0.00 0.00 61.98 60.06 3k2h s VAL 210 Cb -0.27 -4.14 -0.09 0.00 0.56 0.00 0.00 36.38 32.44 3k2h s VAL 210 CO 0.05 -0.49 2.06 -2.65 -0.31 0.00 0.00 175.10 173.76 3k2h n PRO 211 N 6.10 2.02 -1.61 4.82 -0.02 -1.26 -4.89 135.00 140.16 3k2h n PRO 211 Ca -0.03 0.67 -0.40 0.00 -2.02 0.00 0.00 63.50 61.73 3k2h n PRO 211 Cb 0.48 -2.85 0.03 0.00 -0.02 0.00 0.00 33.50 31.14 3k2h n PRO 211 CO 0.00 0.00 0.00 0.36 1.98 0.00 0.00 175.50 177.84 3k2h n LYS 212 N 7.71 1.16 -1.64 -0.52 0.00 -1.26 -4.86 118.16 118.76 3k2h n LYS 212 Ca 0.28 0.43 -0.39 0.00 -0.00 0.00 0.00 58.31 58.63 3k2h n LYS 212 Cb 0.35 -2.11 0.04 0.00 -0.00 0.00 0.00 35.03 33.30 3k2h n LYS 212 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.40 177.05 3k2h n PRO 213 N -0.37 1.20 0.05 -1.58 -0.04 -1.26 -4.89 135.00 128.11 3k2h n PRO 213 Ca 0.11 0.45 -0.01 0.00 -0.04 0.00 0.00 63.50 64.01 3k2h n PRO 213 Cb 0.43 -2.21 0.28 0.00 -0.04 0.00 0.00 33.50 31.96 3k2h n PRO 213 CO 0.00 0.00 0.00 -0.22 -0.04 0.00 0.00 175.50 175.24 3k2h h LYS 214 N 1.00 0.39 -5.47 0.54 3.64 -1.89 -3.42 116.57 111.36 3k2h h LYS 214 Ca -0.48 -0.12 -0.65 0.00 -1.27 0.00 0.00 60.65 58.13 3k2h h LYS 214 Cb 1.34 -0.04 -0.32 0.00 -0.41 0.00 0.00 32.23 32.80 3k2h h LYS 214 CO 0.54 0.56 -0.87 0.71 -2.27 0.00 0.00 179.45 178.12 3k2h s TYR 215 N -4.63 2.29 -0.06 1.91 2.02 -1.26 -5.03 117.35 112.60 3k2h s TYR 215 Ca -0.06 -0.82 0.01 0.00 -0.37 0.00 0.00 57.07 55.82 3k2h s TYR 215 Cb 0.15 -1.53 0.02 0.00 -0.40 0.00 0.00 41.96 40.19 3k2h s TYR 215 CO 0.77 -0.31 -0.04 0.08 -1.57 0.00 0.00 175.55 174.48 3k2h s VAL 216 N 0.17 0.58 0.19 0.71 1.01 -1.26 -4.64 120.40 117.16 3k2h s VAL 216 Ca -0.12 -0.11 -0.30 0.00 0.00 0.00 0.00 61.98 61.45 3k2h s VAL 216 Cb -0.16 -0.62 -0.09 0.00 0.00 0.00 0.00 36.38 35.51 3k2h s VAL 216 CO 0.06 0.25 1.39 0.00 0.00 0.00 0.00 175.10 176.80 3k2h s ALA 217 N 1.15 3.59 -1.11 5.51 0.00 -1.26 -4.17 121.76 125.47 3k2h s ALA 217 Ca -0.07 1.20 -0.25 0.00 0.00 0.00 0.00 51.96 52.84 3k2h s ALA 217 Cb -0.14 -3.53 0.03 0.00 0.00 0.00 0.00 23.12 19.48 3k2h s ALA 217 CO -0.01 -0.63 0.69 0.00 0.00 0.00 0.00 175.76 175.81 3k2h h PRO 219 N -1.96 0.00 0.00 0.00 0.13 -1.89 0.05 132.00 128.33 3k2h h PRO 219 Ca -0.67 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.46 3k2h h PRO 219 Cb 1.39 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.52 3k2h h PRO 219 CO 0.48 0.00 0.00 0.78 -0.23 0.00 0.00 178.00 179.03 3k2h h GLY 220 N 0.00 0.00 -7.17 1.56 0.00 -1.88 -3.42 103.07 92.17 3k2h h GLY 220 Ca 0.16 0.00 -0.66 0.00 0.00 0.00 0.00 47.33 46.83 3k2h h GLY 220 CO -0.00 0.00 0.04 0.14 0.00 0.00 0.00 176.54 176.72 3k2h s VAL 221 N -3.53 4.91 -0.06 4.60 1.01 0.00 -4.37 120.40 122.97 3k2h s VAL 221 Ca 0.03 0.15 0.04 0.00 0.00 0.00 0.00 61.98 62.19 3k2h s VAL 221 Cb 0.09 -4.11 -0.25 0.00 0.00 0.00 0.00 36.38 32.11 3k2h s VAL 221 CO 0.53 -0.46 0.61 0.08 0.00 0.00 0.00 175.10 175.87 3k2h h ARG 222 N 8.72 0.12 -4.67 2.72 -0.00 -1.37 -3.43 114.38 116.45 3k2h h ARG 222 Ca -0.26 -0.20 -0.70 0.00 -0.00 0.00 0.00 59.98 58.82 3k2h h ARG 222 Cb 1.11 0.08 -0.26 0.00 -0.00 0.00 0.00 29.97 30.89 3k2h h ARG 222 CO 0.85 0.82 -0.57 0.42 -0.00 0.00 0.00 179.97 181.48 3k2h s ILE 223 N -2.59 4.14 -0.67 0.08 1.01 -0.88 -5.01 121.20 117.27 3k2h s ILE 223 Ca -0.11 -0.93 0.04 0.00 0.00 0.00 0.00 60.65 59.66 3k2h s ILE 223 Cb 0.07 -3.28 0.31 0.00 0.01 0.00 0.00 42.46 39.57 3k2h s ILE 223 CO 0.81 -0.14 1.01 0.54 0.00 0.00 0.00 174.94 177.16 3k2h n ARG 224 N 4.90 3.35 0.00 2.79 1.74 -1.26 -0.53 116.66 127.64 3k2h n ARG 224 Ca -0.13 -4.78 0.12 0.00 -0.77 0.00 0.00 57.85 52.29 3k2h n ARG 224 Cb 0.46 -2.28 0.16 0.00 -1.02 0.00 0.00 32.46 29.77 3k2h n ARG 224 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 3k2h n ASN 225 N 0.17 1.13 -4.70 0.55 3.02 -0.39 -4.84 115.26 110.19 3k2h n ASN 225 Ca 0.32 -0.91 -0.42 0.00 -0.03 0.00 0.00 54.58 53.54 3k2h n ASN 225 Cb 0.38 0.41 -0.03 0.00 -0.61 0.00 0.00 39.78 39.93 3k2h n ASN 225 CO 0.00 0.00 0.00 -2.28 -2.62 0.00 0.00 177.26 172.36 3k2h s HIS 226 N -2.71 2.93 0.59 3.10 2.46 -1.17 -3.45 115.29 117.04 3k2h s HIS 226 Ca 0.17 0.73 0.29 0.00 0.47 0.00 0.00 55.06 56.71 3k2h s HIS 226 Cb 0.18 -3.78 1.73 0.00 -0.13 0.00 0.00 32.58 30.58 3k2h s HIS 226 CO 0.64 -2.89 2.16 0.93 -2.47 0.00 0.00 174.74 173.11 3k2h h GLU 227 N 7.40 0.00 -0.04 2.88 5.08 -1.88 -1.20 114.58 126.82 3k2h h GLU 227 Ca -0.41 0.00 0.01 0.00 -1.00 0.00 0.00 59.36 57.96 3k2h h GLU 227 Cb 1.20 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.45 3k2h h GLU 227 CO 0.90 0.00 0.04 1.49 -1.00 0.00 0.00 179.01 180.44 3k2h h GLU 228 N 0.00 0.00 -0.21 2.33 4.81 -1.96 -1.76 114.58 117.79 3k2h h GLU 228 Ca 0.05 0.00 0.06 0.00 -0.13 0.00 0.00 59.36 59.34 3k2h h GLU 228 Cb 0.29 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.66 3k2h h GLU 228 CO -0.00 0.00 0.19 0.74 -0.73 0.00 0.00 179.01 179.21 3k2h h PHE 229 N 0.00 0.00 -0.77 0.92 0.04 -1.54 -1.16 116.94 114.42 3k2h h PHE 229 Ca 0.02 0.00 -0.04 0.00 2.80 0.00 0.00 57.97 60.75 3k2h h PHE 229 Cb 0.10 0.00 -0.03 0.00 2.20 0.00 0.00 35.95 38.22 3k2h h PHE 229 CO 0.00 0.00 0.33 1.96 -0.60 0.00 0.00 178.31 180.00 3k2h h GLN 230 N 0.00 1.15 -0.02 1.51 4.20 -1.52 0.24 115.11 120.67 3k2h h GLN 230 Ca 0.10 -0.20 -0.23 0.00 0.06 0.00 0.00 58.65 58.39 3k2h h GLN 230 Cb 0.48 -0.19 0.02 0.00 0.30 0.00 0.00 27.48 28.09 3k2h h GLN 230 CO -0.00 0.92 -0.88 -0.92 -0.67 0.00 0.00 178.83 177.28 3k2h h TYR 231 N 1.11 0.92 -0.42 2.96 3.20 -1.42 -2.04 116.97 121.29 3k2h h TYR 231 Ca 0.26 -0.49 -0.11 0.00 3.14 0.00 0.00 58.73 61.54 3k2h h TYR 231 Cb 0.19 -0.11 -0.02 0.00 1.54 0.00 0.00 36.73 38.33 3k2h h TYR 231 CO 0.02 1.32 -0.18 -0.07 -1.64 0.00 0.00 178.16 177.61 3k2h h LEU 232 N 0.27 0.81 -0.68 2.82 3.38 -1.11 -1.64 115.31 119.16 3k2h h LEU 232 Ca -0.10 -0.27 -0.06 0.00 0.09 0.00 0.00 57.88 57.53 3k2h h LEU 232 Cb 1.54 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 42.04 3k2h h LEU 232 CO 0.17 0.98 0.19 0.44 0.09 0.00 0.00 178.44 180.31 3k2h h ASP 233 N 0.71 1.01 -0.13 -0.43 3.32 -0.45 -0.95 116.42 119.51 3k2h h ASP 233 Ca 0.11 -0.22 -0.01 0.00 0.02 0.00 0.00 57.03 56.92 3k2h h ASP 233 Cb 0.69 -0.27 -0.01 0.00 0.22 0.00 0.00 39.33 39.96 3k2h h ASP 233 CO 0.05 0.97 0.03 0.40 -1.72 0.00 0.00 179.24 178.97 3k2h h ILE 234 N 1.01 1.20 -0.47 0.35 2.04 -1.20 0.28 117.51 120.72 3k2h h ILE 234 Ca 0.22 -0.63 0.09 0.00 1.00 0.00 0.00 64.86 65.53 3k2h h ILE 234 Cb 0.34 1.37 -0.10 0.00 -0.74 0.00 0.00 36.82 37.69 3k2h h ILE 234 CO -0.00 0.19 -0.36 -0.07 0.00 0.00 0.00 178.15 177.91 3k2h h LEU 235 N 0.01 -1.20 -1.20 1.44 3.38 -1.13 -0.60 115.31 116.02 3k2h h LEU 235 Ca 0.04 0.21 0.03 0.00 0.09 0.00 0.00 57.88 58.25 3k2h h LEU 235 Cb 0.26 0.56 -0.05 0.00 0.09 0.00 0.00 40.66 41.53 3k2h h LEU 235 CO 0.00 -0.33 0.55 0.00 0.09 0.00 0.00 178.44 178.76 3k2h h ALA 236 N 0.75 1.48 -0.51 1.53 0.00 -0.81 -0.96 119.26 120.74 3k2h h ALA 236 Ca 0.18 -0.04 -0.12 0.00 0.00 0.00 0.00 54.91 54.93 3k2h h ALA 236 Cb 0.55 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 18.03 3k2h h ALA 236 CO -0.60 0.44 -0.15 0.22 0.00 0.00 0.00 179.25 179.16 3k2h h ASP 237 N 1.05 1.01 0.06 0.00 3.58 0.31 -1.15 116.42 121.27 3k2h h ASP 237 Ca 0.33 -0.35 -0.24 0.00 0.42 0.00 0.00 57.03 57.19 3k2h h ASP 237 Cb 0.02 -0.28 0.01 0.00 1.72 0.00 0.00 39.33 40.80 3k2h h ASP 237 CO -0.10 1.15 -0.91 0.58 -2.88 0.00 0.00 179.24 177.08 3k2h h VAL 238 N 0.88 1.31 -0.73 2.25 2.07 -0.77 -0.31 116.25 120.96 3k2h h VAL 238 Ca 0.13 -2.19 -0.00 0.00 0.82 0.00 0.00 66.70 65.45 3k2h h VAL 238 Cb 0.72 2.24 -0.04 0.00 -1.52 0.00 0.00 31.29 32.69 3k2h h VAL 238 CO 0.06 0.68 0.44 -0.07 0.02 0.00 0.00 177.57 178.69 3k2h h LEU 239 N 0.39 0.87 -0.20 2.57 3.38 -1.18 -0.52 115.31 120.63 3k2h h LEU 239 Ca -0.09 -0.06 -0.17 0.00 0.09 0.00 0.00 57.88 57.65 3k2h h LEU 239 Cb 1.54 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 42.08 3k2h h LEU 239 CO 0.17 0.68 -0.53 0.28 0.09 0.00 0.00 178.44 179.13 3k2h h SER 240 N 0.99 0.81 0.00 -0.43 0.02 -1.08 -3.41 113.55 110.46 3k2h h SER 240 Ca 0.26 -0.58 0.00 0.00 -0.84 0.00 0.00 61.79 60.63 3k2h h SER 240 Cb -0.03 -0.24 0.00 0.00 0.14 0.00 0.00 62.40 62.27 3k2h h SER 240 CO -0.05 1.24 0.00 1.41 -1.14 0.00 0.00 176.83 178.29 3k2h n HIS 241 N -4.12 0.00 -1.48 3.45 8.25 -0.14 -4.75 115.22 116.43 3k2h n HIS 241 Ca -0.06 0.00 -0.33 0.00 -0.26 0.00 0.00 57.72 57.07 3k2h n HIS 241 Cb 0.61 0.00 0.08 0.00 1.12 0.00 0.00 29.99 31.81 3k2h n HIS 241 CO 0.00 0.00 0.00 0.20 0.64 0.00 0.00 176.34 177.18 3k2h s GLY 242 N -0.31 2.16 -0.17 -1.41 0.00 -0.20 -4.96 107.32 102.42 3k2h s GLY 242 Ca 0.00 0.68 -0.10 0.00 0.00 0.00 0.00 44.72 45.30 3k2h s GLY 242 CO 0.00 1.06 0.16 0.14 0.00 0.00 0.00 173.10 174.46 3k2h s VAL 243 N -2.25 5.41 -0.25 1.40 1.01 0.01 -4.65 120.40 121.08 3k2h s VAL 243 Ca 0.70 0.26 -0.29 0.00 0.00 0.00 0.00 61.98 62.65 3k2h s VAL 243 Cb -0.24 -3.48 -0.02 0.00 0.00 0.00 0.00 36.38 32.64 3k2h s VAL 243 CO 0.46 0.48 1.49 -0.22 0.00 0.00 0.00 175.10 177.31 3k2h s LEU 244 N -0.00 3.90 0.06 3.92 2.96 -1.26 -0.50 118.68 127.75 3k2h s LEU 244 Ca 0.11 1.47 0.04 0.00 -0.22 0.00 0.00 54.13 55.54 3k2h s LEU 244 Cb -0.12 -3.54 -0.03 0.00 0.50 0.00 0.00 46.19 43.01 3k2h s LEU 244 CO 0.01 -1.17 -0.12 -0.54 -1.32 0.00 0.00 176.35 173.21 3k2h s LYS 245 N 4.44 0.72 0.86 1.98 1.02 -0.53 -4.97 119.74 123.25 3k2h s LYS 245 Ca 0.65 -0.85 -0.12 0.00 0.02 0.00 0.00 55.97 55.67 3k2h s LYS 245 Cb -0.22 -0.64 0.10 0.00 -0.52 0.00 0.00 37.83 36.56 3k2h s LYS 245 CO 0.27 0.14 1.10 -2.14 -0.92 0.00 0.00 175.35 173.79 3k2h s PRO 246 N -1.60 1.60 0.24 -1.68 0.02 -1.26 -1.60 135.00 130.72 3k2h s PRO 246 Ca -0.04 0.67 -0.06 0.00 0.02 0.00 0.00 61.00 61.58 3k2h s PRO 246 Cb -0.10 -1.86 0.02 0.00 0.02 0.00 0.00 34.50 32.59 3k2h s PRO 246 CO 0.01 -1.96 0.42 0.27 -0.33 0.00 0.00 177.00 175.41 3k2h n ASN 247 N -3.67 -1.20 -0.20 2.53 0.23 -1.26 -4.88 115.26 106.81 3k2h n ASN 247 Ca 0.07 -2.07 0.12 0.00 -0.53 0.00 0.00 54.58 52.17 3k2h n ASN 247 Cb 0.56 2.07 0.42 0.00 -2.08 0.00 0.00 39.78 40.75 3k2h n ASN 247 CO 0.00 0.00 0.00 -0.09 -0.93 0.00 0.00 177.26 176.24 3k2h h ARG 248 N 0.00 0.57 0.00 -3.83 2.43 -1.97 -2.82 114.38 108.76 3k2h h ARG 248 Ca -0.19 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 58.94 3k2h h ARG 248 Cb 0.76 -0.13 0.00 0.00 -0.42 0.00 0.00 29.97 30.18 3k2h h ARG 248 CO 0.25 0.38 0.00 1.79 -1.51 0.00 0.00 179.97 180.88 3k2h h THR 249 N 0.59 0.00 0.00 0.20 1.35 -1.93 -3.47 112.91 109.65 3k2h h THR 249 Ca 0.38 -0.69 0.00 0.00 -0.55 0.00 0.00 66.41 65.55 3k2h h THR 249 Cb 0.66 1.66 0.00 0.00 -1.73 0.00 0.00 68.15 68.74 3k2h h THR 249 CO -0.15 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.73 3k2h n GLY 250 N 0.87 1.87 3.58 5.82 0.00 -1.07 -4.80 105.19 111.47 3k2h n GLY 250 Ca 0.04 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.67 3k2h n GLY 250 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3k2h s THR 251 N -3.50 5.28 0.98 2.61 2.01 -1.26 -4.99 115.64 116.76 3k2h s THR 251 Ca 0.00 0.18 -0.11 0.00 0.31 0.00 0.00 61.69 62.07 3k2h s THR 251 Cb 0.00 -3.60 0.18 0.00 0.01 0.00 0.00 72.50 69.09 3k2h s THR 251 CO 0.00 0.18 1.11 0.47 -0.69 0.00 0.00 174.62 175.69 3k2h n ASP 252 N 5.13 -0.15 -3.76 3.53 8.00 -1.26 -4.57 116.55 123.47 3k2h n ASP 252 Ca -0.13 0.29 -0.13 0.00 0.71 0.00 0.00 54.79 55.54 3k2h n ASP 252 Cb 0.51 -1.43 -0.11 0.00 -0.02 0.00 0.00 41.12 40.07 3k2h n ASP 252 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3k2h s ALA 253 N -2.58 -0.73 0.12 2.24 0.00 -0.62 -1.82 121.76 118.36 3k2h s ALA 253 Ca 0.67 0.92 -0.31 0.00 0.00 0.00 0.00 51.96 53.24 3k2h s ALA 253 Cb -0.23 -0.55 -0.08 0.00 0.00 0.00 0.00 23.12 22.26 3k2h s ALA 253 CO 0.60 -0.16 1.37 0.71 0.00 0.00 0.00 175.76 178.28 3k2h s TYR 254 N 0.43 3.26 -0.01 0.00 1.51 -0.67 -1.45 117.35 120.41 3k2h s TYR 254 Ca -0.02 0.99 0.01 0.00 -1.01 0.00 0.00 57.07 57.04 3k2h s TYR 254 Cb -0.04 -3.66 0.01 0.00 -0.11 0.00 0.00 41.96 38.16 3k2h s TYR 254 CO -0.02 -2.29 -0.02 0.45 -1.11 0.00 0.00 175.55 172.56 3k2h s SER 255 N 1.05 0.38 0.02 2.29 0.15 0.34 -0.32 113.70 117.61 3k2h s SER 255 Ca 0.64 -0.05 -0.02 0.00 0.70 0.00 0.00 55.95 57.22 3k2h s SER 255 Cb -0.36 -0.10 -0.02 0.00 -1.71 0.00 0.00 66.02 63.83 3k2h s SER 255 CO 0.31 -0.00 0.00 -0.75 1.20 0.00 0.00 173.24 174.00 3k2h s LYS 256 N 0.26 0.37 -0.15 5.44 2.20 -0.16 -0.81 119.74 126.89 3k2h s LYS 256 Ca -0.02 -0.63 -0.03 0.00 -0.36 0.00 0.00 55.97 54.93 3k2h s LYS 256 Cb -0.05 0.14 -0.02 0.00 -1.51 0.00 0.00 37.83 36.38 3k2h s LYS 256 CO -0.01 -0.07 -0.06 0.12 -0.36 0.00 0.00 175.35 174.97 3k2h s PHE 257 N -1.68 2.97 0.00 4.03 5.36 -1.26 -1.34 117.98 126.05 3k2h s PHE 257 Ca -0.14 -0.40 0.00 0.00 -0.96 0.00 0.00 56.93 55.44 3k2h s PHE 257 Cb -0.08 -1.93 0.00 0.00 -0.34 0.00 0.00 43.02 40.67 3k2h s PHE 257 CO -0.01 -0.09 0.00 0.41 -1.46 0.00 0.00 175.22 174.07 3k2h n GLY 258 N 3.54 -1.48 3.17 13.12 0.00 -0.41 -5.01 105.19 118.12 3k2h n GLY 258 Ca -0.18 -0.58 -0.11 0.00 0.00 0.00 0.00 46.02 45.16 3k2h n GLY 258 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3k2h s TYR 259 N 0.00 0.94 -0.04 1.61 2.02 -0.31 -4.98 117.35 116.60 3k2h s TYR 259 Ca 0.00 -1.15 -0.01 0.00 -0.37 0.00 0.00 57.07 55.54 3k2h s TYR 259 Cb 0.00 -0.54 0.03 0.00 -0.40 0.00 0.00 41.96 41.05 3k2h s TYR 259 CO 0.00 -0.40 0.05 -1.14 -1.57 0.00 0.00 175.55 172.48 3k2h s GLN 260 N -3.99 -0.02 0.12 -0.62 0.74 -1.26 -1.22 119.66 113.40 3k2h s GLN 260 Ca 0.22 0.31 0.08 0.00 0.05 0.00 0.00 55.36 56.02 3k2h s GLN 260 Cb 0.07 -0.47 -0.04 0.00 1.10 0.00 0.00 33.01 33.68 3k2h s GLN 260 CO 0.01 -0.28 -0.14 -1.64 -0.55 0.00 0.00 175.29 172.69 3k2h s MET 261 N 1.85 1.92 0.03 1.67 -1.94 0.09 -4.95 119.30 117.97 3k2h s MET 261 Ca 0.01 -1.14 0.01 0.00 -1.71 0.00 0.00 55.69 52.86 3k2h s MET 261 Cb -0.12 -2.18 -0.02 0.00 2.01 0.00 0.00 34.83 34.52 3k2h s MET 261 CO -0.03 0.48 -0.05 -0.98 -0.01 0.00 0.00 175.02 174.43 3k2h s ARG 262 N -2.24 0.41 -0.06 2.03 1.70 -1.26 0.75 118.95 120.29 3k2h s ARG 262 Ca 0.20 -0.61 0.00 0.00 -0.47 0.00 0.00 55.73 54.85 3k2h s ARG 262 Cb -0.11 -0.15 0.02 0.00 -0.57 0.00 0.00 34.95 34.15 3k2h s ARG 262 CO 0.12 0.02 -0.03 -0.06 -1.08 0.00 0.00 175.30 174.27 3k2h s PHE 263 N -1.20 0.74 -0.64 5.89 0.08 0.34 -4.98 117.98 118.21 3k2h s PHE 263 Ca -0.10 -0.21 -0.25 0.00 0.12 0.00 0.00 56.93 56.48 3k2h s PHE 263 Cb -0.09 -0.73 0.04 0.00 -0.57 0.00 0.00 43.02 41.68 3k2h s PHE 263 CO -0.00 -0.25 1.10 0.34 -0.10 0.00 0.00 175.22 176.31 3k2h s ASP 264 N 1.29 6.27 0.01 1.36 -1.08 -1.26 -0.52 116.67 122.75 3k2h s ASP 264 Ca -0.05 -0.42 0.28 0.00 -0.52 0.00 0.00 52.55 51.83 3k2h s ASP 264 Cb -0.14 -2.49 1.16 0.00 -1.46 0.00 0.00 42.92 39.99 3k2h s ASP 264 CO -0.02 -1.51 1.88 0.18 0.52 0.00 0.00 175.17 176.22 3k2h n LEU 265 N 8.28 0.05 0.24 -1.34 4.77 -0.03 -2.52 117.00 126.46 3k2h n LEU 265 Ca 0.02 0.51 0.13 0.00 -0.03 0.00 0.00 56.01 56.64 3k2h n LEU 265 Cb 0.48 -0.49 0.40 0.00 -2.33 0.00 0.00 43.42 41.48 3k2h n LEU 265 CO 0.68 -0.04 0.86 0.77 -1.33 0.00 0.00 177.39 178.33 3k2h h SER 266 N 0.00 0.00 0.04 -1.43 4.64 -1.68 -3.36 113.55 111.76 3k2h h SER 266 Ca 0.00 0.00 -0.35 0.00 -0.47 0.00 0.00 61.79 60.97 3k2h h SER 266 Cb 0.49 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.54 3k2h h SER 266 CO 0.00 0.06 -1.99 0.54 -0.87 0.00 0.00 176.83 174.57 3k2h n ARG 267 N -3.14 0.65 -3.82 4.77 1.74 -1.05 -4.88 116.66 110.93 3k2h n ARG 267 Ca 0.02 0.33 -0.08 0.00 -0.77 0.00 0.00 57.85 57.35 3k2h n ARG 267 Cb 0.44 -1.64 0.01 0.00 -1.02 0.00 0.00 32.46 30.26 3k2h n ARG 267 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 3k2h s SER 268 N -6.99 -0.07 -0.27 0.55 1.04 -1.18 -3.00 113.70 103.78 3k2h s SER 268 Ca -0.30 -0.97 -0.06 0.00 0.48 0.00 0.00 55.95 55.09 3k2h s SER 268 Cb 0.09 0.81 -0.00 0.00 0.10 0.00 0.00 66.02 67.01 3k2h s SER 268 CO 0.62 -1.57 0.05 0.12 0.98 0.00 0.00 173.24 173.45 3k2h s PHE 269 N -2.79 3.10 -1.53 5.02 5.36 0.59 -4.42 117.98 123.30 3k2h s PHE 269 Ca 0.14 -0.85 -0.12 0.00 -0.96 0.00 0.00 56.93 55.15 3k2h s PHE 269 Cb -0.05 -2.22 -0.02 0.00 -0.34 0.00 0.00 43.02 40.39 3k2h s PHE 269 CO 0.10 -0.52 2.59 -0.35 -1.46 0.00 0.00 175.22 175.58 3k2h n PRO 270 N 4.86 3.35 -3.42 10.12 -0.04 -1.26 -3.66 135.00 144.95 3k2h n PRO 270 Ca -0.16 -2.46 -0.40 0.00 -0.04 0.00 0.00 63.50 60.45 3k2h n PRO 270 Cb 0.49 -3.02 -0.09 0.00 -0.04 0.00 0.00 33.50 30.84 3k2h n PRO 270 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 3k2h s LEU 271 N 1.00 4.17 0.37 1.53 2.96 -1.26 -4.25 118.68 123.20 3k2h s LEU 271 Ca 0.58 0.07 -0.27 0.00 -0.22 0.00 0.00 54.13 54.30 3k2h s LEU 271 Cb 0.16 -2.36 -0.11 0.00 0.50 0.00 0.00 46.19 44.38 3k2h s LEU 271 CO -0.07 -0.22 1.23 0.18 -1.32 0.00 0.00 176.35 176.15 3k2h n LEU 272 N 5.32 3.47 -0.00 -0.68 4.77 -1.26 -4.67 117.00 123.95 3k2h n LEU 272 Ca -0.09 1.15 0.07 0.00 -0.03 0.00 0.00 56.01 57.11 3k2h n LEU 272 Cb 0.50 -1.46 -0.09 0.00 -2.33 0.00 0.00 43.42 40.04 3k2h n LEU 272 CO 0.38 -0.71 -0.47 0.35 -1.33 0.00 0.00 177.39 175.60 3k2h n THR 273 N 0.06 0.00 0.70 -5.08 -2.24 -1.26 -4.38 114.28 102.08 3k2h n THR 273 Ca 0.06 -0.27 0.08 0.00 -2.27 0.00 0.00 64.05 61.65 3k2h n THR 273 Cb 0.37 0.44 0.40 0.00 -2.10 0.00 0.00 70.33 69.43 3k2h n THR 273 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 3k2h n THR 274 N -1.77 0.67 -3.67 4.28 -2.24 -1.26 -0.94 114.28 109.35 3k2h n THR 274 Ca -0.01 0.17 -0.11 0.00 -2.27 0.00 0.00 64.05 61.83 3k2h n THR 274 Cb 0.30 -0.88 -0.05 0.00 -2.10 0.00 0.00 70.33 67.60 3k2h n THR 274 CO 0.00 0.00 0.00 -1.59 -0.57 0.00 0.00 175.07 172.91 3k2h s LYS 275 N -2.79 1.00 -0.43 -0.78 -2.85 -1.26 -4.66 119.74 107.97 3k2h s LYS 275 Ca 0.12 -0.68 -0.29 0.00 -1.00 0.00 0.00 55.97 54.13 3k2h s LYS 275 Cb 0.11 0.44 0.02 0.00 -2.06 0.00 0.00 37.83 36.34 3k2h s LYS 275 CO 0.28 -0.37 1.18 0.21 0.10 0.00 0.00 175.35 176.75 3k2h s LYS 276 N -3.54 3.78 -0.01 1.78 2.20 -1.02 -4.69 119.74 118.25 3k2h s LYS 276 Ca 0.01 0.75 -0.19 0.00 -0.36 0.00 0.00 55.97 56.19 3k2h s LYS 276 Cb 0.02 -3.89 -0.05 0.00 -1.51 0.00 0.00 37.83 32.39 3k2h s LYS 276 CO -0.10 -1.31 0.54 0.08 -0.36 0.00 0.00 175.35 174.21 3k2h s VAL 277 N 4.44 4.94 -1.04 4.02 1.01 -1.26 -4.55 120.40 127.97 3k2h s VAL 277 Ca 0.50 1.13 -0.21 0.00 0.00 0.00 0.00 61.98 63.40 3k2h s VAL 277 Cb -0.09 -3.87 -0.09 0.00 0.00 0.00 0.00 36.38 32.32 3k2h s VAL 277 CO 0.28 0.46 1.94 0.00 0.00 0.00 0.00 175.10 177.78 3k2h n ALA 278 N 2.52 3.08 -0.24 5.51 0.00 -1.26 -4.79 120.51 125.33 3k2h n ALA 278 Ca -0.09 -3.33 -0.04 0.00 0.00 0.00 0.00 53.44 49.98 3k2h n ALA 278 Cb 0.51 -3.57 0.06 0.00 0.00 0.00 0.00 19.45 16.45 3k2h n ALA 278 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 3k2h h LEU 279 N 14.58 0.71 -0.83 0.00 5.85 -2.00 -2.10 115.31 131.52 3k2h h LEU 279 Ca 0.37 -0.01 0.18 0.00 0.84 0.00 0.00 57.88 59.27 3k2h h LEU 279 Cb 0.78 -0.16 -0.11 0.00 0.37 0.00 0.00 40.66 41.53 3k2h h LEU 279 CO 1.66 0.50 0.33 -0.09 -0.34 0.00 0.00 178.44 180.51 3k2h h ARG 280 N 0.85 0.40 -0.75 1.25 2.43 -2.00 0.22 114.38 116.77 3k2h h ARG 280 Ca 0.26 -0.02 -0.05 0.00 -0.81 0.00 0.00 59.98 59.35 3k2h h ARG 280 Cb -0.03 -0.09 -0.03 0.00 -0.42 0.00 0.00 29.97 29.40 3k2h h ARG 280 CO -0.08 0.26 0.26 0.77 -1.51 0.00 0.00 179.97 179.67 3k2h h SER 281 N 0.41 1.06 -0.32 -3.80 0.02 -1.78 -1.97 113.55 107.17 3k2h h SER 281 Ca 0.49 -0.18 -0.02 0.00 -0.84 0.00 0.00 61.79 61.24 3k2h h SER 281 Cb 0.85 -0.28 -0.01 0.00 0.14 0.00 0.00 62.40 63.10 3k2h h SER 281 CO -0.48 0.97 0.12 0.40 -1.14 0.00 0.00 176.83 176.69 3k2h h ILE 282 N 1.10 1.19 -0.47 3.27 2.04 -0.76 -2.17 117.51 121.72 3k2h h ILE 282 Ca 0.24 -0.58 -0.01 0.00 1.00 0.00 0.00 64.86 65.51 3k2h h ILE 282 Cb 0.27 0.98 -0.02 0.00 -0.74 0.00 0.00 36.82 37.31 3k2h h ILE 282 CO -0.01 0.20 0.24 0.40 0.00 0.00 0.00 178.15 178.98 3k2h h ILE 283 N 0.36 1.18 -0.64 -0.67 2.04 -1.02 -1.85 117.51 116.92 3k2h h ILE 283 Ca 0.10 -0.48 -0.09 0.00 1.00 0.00 0.00 64.86 65.39 3k2h h ILE 283 Cb 0.20 0.64 -0.02 0.00 -0.74 0.00 0.00 36.82 36.90 3k2h h ILE 283 CO -0.01 0.19 0.04 -0.33 0.00 0.00 0.00 178.15 178.04 3k2h h GLU 284 N 0.61 1.10 -0.43 2.37 4.39 -1.32 -0.61 114.58 120.69 3k2h h GLU 284 Ca 0.16 -0.33 -0.02 0.00 0.34 0.00 0.00 59.36 59.51 3k2h h GLU 284 Cb 0.09 -0.11 -0.02 0.00 -0.10 0.00 0.00 28.75 28.61 3k2h h GLU 284 CO -0.02 1.05 0.21 1.49 -1.16 0.00 0.00 179.01 180.57 3k2h h GLU 285 N 1.01 0.63 -0.60 2.33 4.81 -1.31 0.66 114.58 122.11 3k2h h GLU 285 Ca 0.19 -0.09 -0.02 0.00 -0.13 0.00 0.00 59.36 59.30 3k2h h GLU 285 Cb 0.53 -0.11 -0.03 0.00 0.63 0.00 0.00 28.75 29.77 3k2h h GLU 285 CO 0.03 0.54 0.29 1.25 -0.73 0.00 0.00 179.01 180.39 3k2h h LEU 286 N 0.56 0.78 -1.40 1.64 5.85 -0.86 0.17 115.31 122.05 3k2h h LEU 286 Ca 0.15 -0.13 -0.05 0.00 0.84 0.00 0.00 57.88 58.69 3k2h h LEU 286 Cb 0.13 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 40.95 3k2h h LEU 286 CO -0.02 0.69 -0.18 -0.07 -0.34 0.00 0.00 178.44 178.52 3k2h h LEU 287 N 0.82 0.17 -0.23 2.25 3.38 -0.87 -0.32 115.31 120.51 3k2h h LEU 287 Ca 0.21 -0.04 -0.05 0.00 0.09 0.00 0.00 57.88 58.09 3k2h h LEU 287 Cb 0.11 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 40.81 3k2h h LEU 287 CO -0.03 0.36 -0.04 -0.25 0.09 0.00 0.00 178.44 178.57 3k2h h TRP 288 N 0.17 0.48 0.14 1.13 7.01 -0.28 -2.18 115.95 122.41 3k2h h TRP 288 Ca 0.03 -0.10 0.00 0.00 2.11 0.00 0.00 58.89 60.94 3k2h h TRP 288 Cb 0.42 -0.12 -0.01 0.00 -2.10 0.00 0.00 29.16 27.35 3k2h h TRP 288 CO 0.00 0.65 -0.14 0.74 -2.79 0.00 0.00 178.44 176.91 3k2h h PHE 289 N 0.17 -0.36 -0.65 2.65 0.04 -0.11 -2.48 116.94 116.20 3k2h h PHE 289 Ca 0.06 0.00 0.13 0.00 2.80 0.00 0.00 57.97 60.96 3k2h h PHE 289 Cb 0.49 0.14 -0.10 0.00 2.20 0.00 0.00 35.95 38.69 3k2h h PHE 289 CO 0.05 -0.21 0.12 0.82 -0.60 0.00 0.00 178.31 178.49 3k2h h ILE 290 N -0.31 0.57 0.00 -0.55 2.04 -1.05 0.63 117.51 118.84 3k2h h ILE 290 Ca 0.00 -0.08 0.00 0.00 1.00 0.00 0.00 64.86 65.78 3k2h h ILE 290 Cb 0.29 0.31 0.00 0.00 -0.74 0.00 0.00 36.82 36.69 3k2h h ILE 290 CO -0.04 0.04 0.00 2.29 0.00 0.00 0.00 178.15 180.45 3k2h n LYS 291 N -5.16 0.96 -0.97 2.37 2.85 -0.83 -4.85 118.16 112.53 3k2h n LYS 291 Ca 0.11 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.37 3k2h n LYS 291 Cb 0.37 -1.42 0.00 0.00 -0.65 0.00 0.00 35.03 33.34 3k2h n LYS 291 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 3k2h n GLY 292 N 0.84 0.42 3.77 2.58 0.00 0.21 -5.03 105.19 107.99 3k2h n GLY 292 Ca 0.19 -0.83 -0.38 0.00 0.00 0.00 0.00 46.02 45.00 3k2h n GLY 292 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3k2h s SER 293 N -2.76 7.29 -0.07 1.61 0.15 -0.95 -3.64 113.70 115.33 3k2h s SER 293 Ca 0.00 1.92 0.10 0.00 0.70 0.00 0.00 55.95 58.67 3k2h s SER 293 Cb 0.00 -2.59 0.15 0.00 -1.71 0.00 0.00 66.02 61.87 3k2h s SER 293 CO 0.00 -0.11 1.06 0.35 1.20 0.00 0.00 173.24 175.74 3k2h n THR 294 N 0.66 1.36 -3.33 6.45 -2.24 -1.26 -4.11 114.28 111.81 3k2h n THR 294 Ca 0.02 -1.56 -0.41 0.00 -2.27 0.00 0.00 64.05 59.82 3k2h n THR 294 Cb 0.49 0.14 -0.09 0.00 -2.10 0.00 0.00 70.33 68.77 3k2h n THR 294 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 3k2h s ASN 295 N -1.92 6.23 0.54 3.42 3.84 -1.26 -2.64 114.94 123.14 3k2h s ASN 295 Ca 0.16 -0.28 0.29 0.00 0.21 0.00 0.00 52.86 53.24 3k2h s ASN 295 Cb 0.14 -2.23 1.55 0.00 -0.55 0.00 0.00 41.25 40.16 3k2h s ASN 295 CO 0.02 -0.45 2.11 1.23 -2.79 0.00 0.00 177.10 177.22 3k2h h GLY 296 N 8.94 0.00 2.00 1.21 0.00 -0.99 -2.36 103.07 111.88 3k2h h GLY 296 Ca -0.28 0.00 -0.04 0.00 0.00 0.00 0.00 47.33 47.00 3k2h h GLY 296 CO 0.75 0.00 -0.21 3.43 0.00 0.00 0.00 176.54 180.51 3k2h h ASN 297 N 0.00 0.00 0.16 0.19 2.35 -1.91 -1.58 115.58 114.79 3k2h h ASN 297 Ca -0.00 0.00 -0.04 0.00 -0.55 0.00 0.00 56.30 55.70 3k2h h ASN 297 Cb 0.27 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.63 3k2h h ASN 297 CO 0.01 0.21 -0.19 0.44 -1.65 0.00 0.00 177.43 176.25 3k2h h ASP 298 N 0.00 0.06 0.04 5.81 3.32 -1.82 0.22 116.42 124.05 3k2h h ASP 298 Ca -0.00 -0.01 -0.08 0.00 0.02 0.00 0.00 57.03 56.95 3k2h h ASP 298 Cb 0.42 -0.01 0.00 0.00 0.22 0.00 0.00 39.33 39.95 3k2h h ASP 298 CO 0.03 0.25 -0.41 -0.07 -1.72 0.00 0.00 179.24 177.32 3k2h h LEU 299 N 0.06 0.13 -1.36 1.55 3.38 -1.51 -3.31 115.31 114.24 3k2h h LEU 299 Ca 0.01 -0.93 0.12 0.00 0.09 0.00 0.00 57.88 57.17 3k2h h LEU 299 Cb 0.37 -0.04 -0.06 0.00 0.09 0.00 0.00 40.66 41.02 3k2h h LEU 299 CO 0.03 1.18 0.53 -0.07 0.09 0.00 0.00 178.44 180.20 3k2h h LEU 300 N -0.81 0.62 -2.13 1.67 3.38 -0.96 0.55 115.31 117.62 3k2h h LEU 300 Ca -0.09 0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.90 3k2h h LEU 300 Cb 1.23 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.87 3k2h h LEU 300 CO 0.02 0.35 0.00 0.00 0.09 0.00 0.00 178.44 178.89 3k2h h ALA 301 N 1.61 1.00 -0.70 1.53 0.00 -0.68 0.14 119.26 122.16 3k2h h ALA 301 Ca 0.39 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.30 3k2h h ALA 301 Cb 0.57 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.36 3k2h h ALA 301 CO -0.15 0.00 0.00 1.63 0.00 0.00 0.00 179.25 180.73 3k2h n LYS 302 N -3.03 3.35 -3.54 0.00 4.76 0.13 -4.95 118.16 114.89 3k2h n LYS 302 Ca -0.01 -2.81 -0.24 0.00 -2.87 0.00 0.00 58.31 52.38 3k2h n LYS 302 Cb 0.19 -1.77 0.07 0.00 -1.84 0.00 0.00 35.03 31.67 3k2h n LYS 302 CO 0.00 0.00 0.00 0.09 -1.37 0.00 0.00 177.40 176.12 3k2h n ASN 303 N 1.37 -6.17 -4.28 4.39 3.02 0.48 -5.01 115.26 109.06 3k2h n ASN 303 Ca 0.26 -0.52 -0.34 0.00 -0.03 0.00 0.00 54.58 53.94 3k2h n ASN 303 Cb 0.79 -4.88 -0.14 0.00 -0.61 0.00 0.00 39.78 34.93 3k2h n ASN 303 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 3k2h s VAL 304 N -3.29 3.10 -0.64 2.41 1.01 -0.87 -5.01 120.40 117.10 3k2h s VAL 304 Ca 0.55 -0.59 0.07 0.00 0.00 0.00 0.00 61.98 62.01 3k2h s VAL 304 Cb -0.25 -2.39 0.17 0.00 0.00 0.00 0.00 36.38 33.92 3k2h s VAL 304 CO 0.68 0.45 1.09 0.54 0.00 0.00 0.00 175.10 177.86 3k2h n ARG 305 N 4.64 2.41 0.03 2.72 1.74 -1.26 -3.04 116.66 123.90 3k2h n ARG 305 Ca -0.19 -1.69 0.14 0.00 -0.77 0.00 0.00 57.85 55.34 3k2h n ARG 305 Cb 0.51 -1.17 0.61 0.00 -1.02 0.00 0.00 32.46 31.39 3k2h n ARG 305 CO 0.00 0.00 0.00 -0.84 -1.52 0.00 0.00 177.63 175.27 3k2h h ILE 306 N 1.31 0.86 -0.08 0.55 3.07 -1.97 -2.47 117.51 118.78 3k2h h ILE 306 Ca 0.00 -0.05 0.00 0.00 1.55 0.00 0.00 64.86 66.36 3k2h h ILE 306 Cb 0.59 0.69 0.00 0.00 -0.27 0.00 0.00 36.82 37.83 3k2h h ILE 306 CO 0.00 0.03 0.00 0.79 -1.05 0.00 0.00 178.15 177.92 3k2h n TRP 307 N -4.45 0.07 -0.13 0.16 7.02 -1.26 -4.61 117.44 114.24 3k2h n TRP 307 Ca 0.07 -0.04 -0.10 0.00 -1.02 0.00 0.00 57.50 56.41 3k2h n TRP 307 Cb 0.39 0.00 -0.02 0.00 -2.42 0.00 0.00 31.31 29.27 3k2h n TRP 307 CO 0.00 0.00 0.00 1.49 -2.02 0.00 0.00 177.69 177.16 3k2h h GLU 308 N 4.20 0.66 -0.22 -0.99 4.81 -1.77 -2.93 114.58 118.35 3k2h h GLU 308 Ca 0.00 -0.20 -0.11 0.00 -0.13 0.00 0.00 59.36 58.91 3k2h h GLU 308 Cb 0.90 -0.06 -0.01 0.00 0.63 0.00 0.00 28.75 30.20 3k2h h GLU 308 CO 0.00 0.75 -0.34 -0.07 -0.73 0.00 0.00 179.01 178.62 3k2h h LEU 309 N 0.48 0.48 0.00 1.64 3.38 -1.81 -2.26 115.31 117.22 3k2h h LEU 309 Ca 0.11 -0.19 0.00 0.00 0.09 0.00 0.00 57.88 57.89 3k2h h LEU 309 Cb 0.45 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 41.06 3k2h h LEU 309 CO 0.02 0.79 0.00 0.59 0.09 0.00 0.00 178.44 179.93 3k2h n ASN 310 N -4.07 0.00 -0.30 -0.43 4.13 -1.17 -3.41 115.26 110.01 3k2h n ASN 310 Ca -0.01 -0.11 0.05 0.00 1.68 0.00 0.00 54.58 56.19 3k2h n ASN 310 Cb 0.46 -0.29 0.01 0.00 -1.54 0.00 0.00 39.78 38.42 3k2h n ASN 310 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 3k2h n GLY 311 N 1.17 -0.18 3.76 7.41 0.00 -0.95 -4.75 105.19 111.65 3k2h n GLY 311 Ca 0.14 -0.32 -0.37 0.00 0.00 0.00 0.00 46.02 45.47 3k2h n GLY 311 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3k2h s ARG 312 N -1.31 3.42 0.22 1.61 3.52 -0.89 -0.36 118.95 125.17 3k2h s ARG 312 Ca 0.10 1.86 -0.13 0.00 -0.13 0.00 0.00 55.73 57.44 3k2h s ARG 312 Cb 0.09 -2.23 0.27 0.00 -1.56 0.00 0.00 34.95 31.52 3k2h s ARG 312 CO 0.24 -0.85 1.62 -0.09 -0.81 0.00 0.00 175.30 175.40 3k2h h ARG 313 N 1.59 0.00 -0.64 5.12 9.65 -1.92 -0.88 114.38 127.31 3k2h h ARG 313 Ca -0.50 -0.00 -0.09 0.00 -1.10 0.00 0.00 59.98 58.29 3k2h h ARG 313 Cb 1.27 -0.00 -0.02 0.00 -1.39 0.00 0.00 29.97 29.83 3k2h h ARG 313 CO 0.58 0.00 0.05 0.38 2.80 0.00 0.00 179.97 183.79 3k2h h ASP 314 N 0.00 1.05 -0.26 -3.80 3.04 -1.95 -0.58 116.42 113.93 3k2h h ASP 314 Ca 0.33 -0.27 -0.02 0.00 -3.24 0.00 0.00 57.03 53.82 3k2h h ASP 314 Cb 0.50 -0.28 -0.01 0.00 -1.04 0.00 0.00 39.33 38.50 3k2h h ASP 314 CO -0.71 1.07 0.07 0.15 -2.04 0.00 0.00 179.24 177.78 3k2h h PHE 315 N 1.00 0.43 0.15 4.15 3.57 -1.64 -0.22 116.94 124.39 3k2h h PHE 315 Ca 0.19 -0.05 0.01 0.00 3.53 0.00 0.00 57.97 61.65 3k2h h PHE 315 Cb 0.50 -0.12 -0.02 0.00 2.79 0.00 0.00 35.95 39.10 3k2h h PHE 315 CO 0.04 0.49 -0.19 -0.07 -2.23 0.00 0.00 178.31 176.35 3k2h h LEU 316 N 0.25 -0.52 -0.36 0.59 3.38 -1.07 -2.08 115.31 115.49 3k2h h LEU 316 Ca 0.08 0.05 0.07 0.00 0.09 0.00 0.00 57.88 58.17 3k2h h LEU 316 Cb 0.27 0.19 -0.06 0.00 0.09 0.00 0.00 40.66 41.15 3k2h h LEU 316 CO 0.00 -0.28 -0.01 0.44 0.09 0.00 0.00 178.44 178.68 3k2h h ASP 317 N -0.39 -0.18 1.11 -0.43 3.32 -0.96 0.46 116.42 119.35 3k2h h ASP 317 Ca 0.01 0.09 0.00 0.00 0.02 0.00 0.00 57.03 57.15 3k2h h ASP 317 Cb 0.39 0.16 0.00 0.00 0.22 0.00 0.00 39.33 40.10 3k2h h ASP 317 CO -0.07 -0.05 0.00 0.07 -1.72 0.00 0.00 179.24 177.47 3k2h h LYS 318 N 0.08 0.00 -0.64 3.56 2.10 -0.94 0.14 116.57 120.87 3k2h h LYS 318 Ca 0.18 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.83 3k2h h LYS 318 Cb 0.25 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.58 3k2h h LYS 318 CO -0.31 0.00 0.00 0.09 -2.00 0.00 0.00 179.45 177.23 3k2h n ASN 319 N -2.78 4.86 0.00 7.07 3.02 -0.75 -4.95 115.26 121.73 3k2h n ASN 319 Ca 0.02 -2.67 0.00 0.00 -0.03 0.00 0.00 54.58 51.90 3k2h n ASN 319 Cb 0.32 -0.62 0.00 0.00 -0.61 0.00 0.00 39.78 38.87 3k2h n ASN 319 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3k2h n GLY 320 N 0.73 0.88 2.41 7.41 0.00 0.04 -4.94 105.19 111.72 3k2h n GLY 320 Ca 0.24 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.88 3k2h n GLY 320 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3k2h n PHE 321 N -2.22 2.43 0.22 1.61 3.72 0.16 -4.64 117.46 118.73 3k2h n PHE 321 Ca 0.00 -2.84 0.12 0.00 -0.05 0.00 0.00 57.45 54.68 3k2h n PHE 321 Cb 0.00 -2.03 0.23 0.00 -0.94 0.00 0.00 39.48 36.74 3k2h n PHE 321 CO 0.00 0.00 0.00 1.79 -0.05 0.00 0.00 176.76 178.50 3k2h h THR 322 N 2.69 0.09 -0.01 4.37 1.35 -1.83 -3.04 112.91 116.53 3k2h h THR 322 Ca 0.74 -1.04 0.00 0.00 -0.55 0.00 0.00 66.41 65.56 3k2h h THR 322 Cb 0.34 1.97 0.00 0.00 -1.73 0.00 0.00 68.15 68.73 3k2h h THR 322 CO 1.52 0.05 -0.37 0.47 -0.25 0.00 0.00 175.52 176.94 3k2h n ASP 323 N -3.12 1.37 -4.72 5.36 8.00 -1.26 -4.94 116.55 117.25 3k2h n ASP 323 Ca 0.03 -1.10 -0.40 0.00 0.71 0.00 0.00 54.79 54.03 3k2h n ASP 323 Cb 0.52 0.29 -0.04 0.00 -0.02 0.00 0.00 41.12 41.86 3k2h n ASP 323 CO 0.00 0.00 0.00 -0.60 -0.39 0.00 0.00 177.20 176.21 3k2h s ARG 324 N -2.52 4.47 0.54 -1.24 6.06 -1.15 -5.03 118.95 120.08 3k2h s ARG 324 Ca 0.21 1.02 -0.22 0.00 -2.50 0.00 0.00 55.73 54.25 3k2h s ARG 324 Cb 0.19 -3.45 -0.05 0.00 0.06 0.00 0.00 34.95 31.70 3k2h s ARG 324 CO 0.56 0.04 1.32 -2.00 -2.50 0.00 0.00 175.30 172.72 3k2h s GLU 325 N 0.82 3.19 0.29 5.12 2.12 -1.26 -4.92 118.70 124.07 3k2h s GLU 325 Ca 0.41 2.15 -0.30 0.00 0.36 0.00 0.00 54.97 57.59 3k2h s GLU 325 Cb -0.19 -2.25 -0.11 0.00 0.26 0.00 0.00 34.13 31.84 3k2h s GLU 325 CO 0.21 -1.12 1.59 -2.00 -0.54 0.00 0.00 175.26 173.40 3k2h s GLU 326 N -2.92 4.12 0.00 4.30 2.12 -1.26 -1.72 118.70 123.34 3k2h s GLU 326 Ca 0.71 2.58 0.00 0.00 0.36 0.00 0.00 54.97 58.62 3k2h s GLU 326 Cb -0.38 -3.02 0.00 0.00 0.26 0.00 0.00 34.13 30.99 3k2h s GLU 326 CO 0.45 -0.63 0.00 0.72 -0.54 0.00 0.00 175.26 175.26 3k2h n HIS 327 N 2.15 0.00 -2.60 5.30 8.25 0.51 -4.90 115.22 123.93 3k2h n HIS 327 Ca 0.08 0.00 -0.41 0.00 -0.26 0.00 0.00 57.72 57.13 3k2h n HIS 327 Cb 0.37 -0.85 -0.03 0.00 1.12 0.00 0.00 29.99 30.60 3k2h n HIS 327 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 3k2h s ASP 328 N -2.29 6.17 0.00 0.41 -1.08 -0.70 -0.27 116.67 118.90 3k2h s ASP 328 Ca 0.00 -0.56 0.25 0.00 -0.52 0.00 0.00 52.55 51.72 3k2h s ASP 328 Cb 0.00 -2.54 1.09 0.00 -1.46 0.00 0.00 42.92 40.01 3k2h s ASP 328 CO 0.00 -1.77 1.81 0.18 0.52 0.00 0.00 175.17 175.91 3k2h n LEU 329 N 9.10 0.00 0.00 -1.34 4.77 -1.08 -4.81 117.00 123.63 3k2h n LEU 329 Ca 0.02 0.48 0.00 0.00 -0.03 0.00 0.00 56.01 56.48 3k2h n LEU 329 Cb 0.48 -0.48 0.00 0.00 -2.33 0.00 0.00 43.42 41.10 3k2h n LEU 329 CO 0.70 -0.07 0.00 0.61 -1.33 0.00 0.00 177.39 177.30 3k2h n GLY 330 N 1.07 -1.92 2.39 -0.72 0.00 -1.26 -0.77 105.19 103.97 3k2h n GLY 330 Ca 0.07 -1.59 -0.39 0.00 0.00 0.00 0.00 46.02 44.11 3k2h n GLY 330 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3k2h n PRO 331 N 0.00 3.52 0.00 1.61 -0.04 -1.26 -4.79 135.00 134.04 3k2h n PRO 331 Ca 0.00 -2.24 0.00 0.00 -0.04 0.00 0.00 63.50 61.22 3k2h n PRO 331 Cb 0.00 -2.87 0.00 0.00 -0.04 0.00 0.00 33.50 30.59 3k2h n PRO 331 CO 0.00 0.00 0.00 0.44 -0.04 0.00 0.00 175.50 175.90 3k2h n ILE 332 N 3.85 0.00 -0.17 0.52 -5.35 -1.26 -4.51 119.36 112.43 3k2h n ILE 332 Ca 0.74 0.00 -0.12 0.00 -0.27 0.00 0.00 62.75 63.10 3k2h n ILE 332 Cb 0.25 -0.35 -0.09 0.00 -1.74 0.00 0.00 39.64 37.72 3k2h n ILE 332 CO 0.00 0.00 0.00 1.88 -1.76 0.00 0.00 176.55 176.67 3k2h h TYR 333 N 0.00 -1.56 -0.80 4.28 0.05 -1.90 -1.68 116.97 115.36 3k2h h TYR 333 Ca 0.00 0.08 0.16 0.00 0.05 0.00 0.00 58.73 59.02 3k2h h TYR 333 Cb 0.00 0.74 -0.10 0.00 1.01 0.00 0.00 36.73 38.38 3k2h h TYR 333 CO 0.00 -0.42 0.34 0.78 -1.05 0.00 0.00 178.16 177.81 3k2h h GLY 334 N -0.29 1.25 0.92 3.88 0.00 -1.75 0.25 103.07 107.34 3k2h h GLY 334 Ca 0.08 -0.16 -0.07 0.00 0.00 0.00 0.00 47.33 47.17 3k2h h GLY 334 CO -0.59 -0.12 -0.07 -2.75 0.00 0.00 0.00 176.54 173.01 3k2h h PHE 335 N 0.46 0.72 -0.35 5.60 3.57 -1.40 -2.77 116.94 122.77 3k2h h PHE 335 Ca 0.45 -0.15 -0.16 0.00 3.53 0.00 0.00 57.97 61.64 3k2h h PHE 335 Cb 0.72 -0.18 -0.01 0.00 2.79 0.00 0.00 35.95 39.27 3k2h h PHE 335 CO -0.15 0.80 -0.41 1.96 -2.23 0.00 0.00 178.31 178.28 3k2h h GLN 336 N 0.43 0.88 -0.93 1.11 1.08 -0.49 0.25 115.11 117.44 3k2h h GLN 336 Ca 0.09 -0.48 0.10 0.00 -1.45 0.00 0.00 58.65 56.91 3k2h h GLN 336 Cb 0.56 0.02 -0.08 0.00 -0.05 0.00 0.00 27.48 27.94 3k2h h GLN 336 CO 0.03 1.12 0.57 -1.49 -0.95 0.00 0.00 178.83 178.11 3k2h h TRP 337 N 0.71 1.04 0.00 2.96 4.06 -0.53 -3.02 115.95 121.17 3k2h h TRP 337 Ca 0.05 0.03 0.00 0.00 2.06 0.00 0.00 58.89 61.03 3k2h h TRP 337 Cb 1.00 -0.33 0.00 0.00 -1.00 0.00 0.00 29.16 28.83 3k2h h TRP 337 CO 0.06 0.44 -1.20 0.54 -3.56 0.00 0.00 178.44 174.72 3k2h n ARG 338 N -4.65 1.31 -1.43 0.49 5.12 -1.05 -1.40 116.66 115.04 3k2h n ARG 338 Ca 0.16 -0.07 0.01 0.00 -1.93 0.00 0.00 57.85 56.02 3k2h n ARG 338 Cb 0.29 -1.19 -0.00 0.00 -1.16 0.00 0.00 32.46 30.40 3k2h n ARG 338 CO 0.00 0.00 0.00 0.72 -1.93 0.00 0.00 177.63 176.42 3k2h n HIS 339 N -1.69 0.02 -1.67 -1.55 8.25 0.86 -3.36 115.22 116.07 3k2h n HIS 339 Ca -0.01 -0.57 -0.53 0.00 -0.26 0.00 0.00 57.72 56.35 3k2h n HIS 339 Cb 0.26 0.03 -0.06 0.00 1.12 0.00 0.00 29.99 31.33 3k2h n HIS 339 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 3k2h n PHE 340 N 0.32 1.99 0.00 4.41 7.35 -0.57 -1.23 117.46 129.72 3k2h n PHE 340 Ca -0.03 0.44 0.00 0.00 -0.76 0.00 0.00 57.45 57.10 3k2h n PHE 340 Cb 1.02 -2.47 0.00 0.00 0.35 0.00 0.00 39.48 38.38 3k2h n PHE 340 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 3k2h n GLY 341 N 3.74 2.48 3.72 7.13 0.00 -1.26 -0.60 105.19 120.40 3k2h n GLY 341 Ca 0.23 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.90 3k2h n GLY 341 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3k2h s ALA 342 N -2.64 2.11 -0.28 4.61 0.00 -0.37 -4.79 121.76 120.41 3k2h s ALA 342 Ca 0.00 0.97 -0.26 0.00 0.00 0.00 0.00 51.96 52.67 3k2h s ALA 342 Cb 0.00 -3.50 0.01 0.00 0.00 0.00 0.00 23.12 19.62 3k2h s ALA 342 CO 0.00 -1.92 0.92 -2.00 0.00 0.00 0.00 175.76 172.77 3k2h s GLU 343 N -3.81 4.11 -0.16 0.00 2.12 -1.26 -4.97 118.70 114.72 3k2h s GLU 343 Ca 0.77 0.96 -0.29 0.00 0.36 0.00 0.00 54.97 56.76 3k2h s GLU 343 Cb -0.32 -3.69 -0.01 0.00 0.26 0.00 0.00 34.13 30.38 3k2h s GLU 343 CO 0.45 -0.68 1.11 -0.47 -0.54 0.00 0.00 175.26 175.13 3k2h s TYR 344 N 3.15 3.22 0.00 5.30 5.04 -1.26 -4.92 117.35 127.89 3k2h s TYR 344 Ca 0.39 1.34 0.00 0.00 -2.44 0.00 0.00 57.07 56.35 3k2h s TYR 344 Cb -0.14 -3.34 0.00 0.00 0.35 0.00 0.00 41.96 38.83 3k2h s TYR 344 CO 0.11 -0.87 0.00 1.28 -1.34 0.00 0.00 175.55 174.73 3k2h n LEU 345 N 5.97 0.40 0.00 6.97 4.77 -1.26 -5.08 117.00 128.77 3k2h n LEU 345 Ca 0.12 0.03 -0.10 0.00 -0.03 0.00 0.00 56.01 56.02 3k2h n LEU 345 Cb 0.46 -0.15 -0.02 0.00 -2.33 0.00 0.00 43.42 41.38 3k2h n LEU 345 CO 0.53 -0.15 0.10 -0.90 -1.33 0.00 0.00 177.39 175.65 3k2h n ASP 346 N -1.64 -0.89 0.00 -1.43 5.68 -1.26 -5.05 116.55 111.96 3k2h n ASP 346 Ca 0.00 -2.30 0.11 0.00 -0.50 0.00 0.00 54.79 52.10 3k2h n ASP 346 Cb 0.00 1.68 0.59 0.00 -1.14 0.00 0.00 41.12 42.25 3k2h n ASP 346 CO 0.00 0.00 0.00 1.15 -1.33 0.00 0.00 177.20 177.02 3k2h n MET 347 N -0.39 0.45 -0.00 0.11 0.00 -1.26 -2.32 117.12 113.70 3k2h n MET 347 Ca 0.01 0.05 0.09 0.00 0.00 0.00 0.00 57.70 57.85 3k2h n MET 347 Cb 0.40 -1.50 -0.12 0.00 0.00 0.00 0.00 33.22 31.99 3k2h n MET 347 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 175.97 176.69 3k2h n HIS 348 N -1.18 0.00 -1.85 3.17 8.25 -1.26 -4.77 115.22 117.57 3k2h n HIS 348 Ca 0.13 0.00 -0.36 0.00 -0.26 0.00 0.00 57.72 57.23 3k2h n HIS 348 Cb 0.14 -0.21 0.05 0.00 1.12 0.00 0.00 29.99 31.09 3k2h n HIS 348 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3k2h s ALA 349 N -3.00 2.44 -0.30 -1.41 0.00 -0.98 -4.97 121.76 113.54 3k2h s ALA 349 Ca 0.00 1.03 -0.24 0.00 0.00 0.00 0.00 51.96 52.75 3k2h s ALA 349 Cb 0.13 -3.48 -0.00 0.00 0.00 0.00 0.00 23.12 19.77 3k2h s ALA 349 CO 0.76 -1.38 0.80 0.34 0.00 0.00 0.00 175.76 176.27 3k2h s ASP 350 N -1.64 6.69 -0.12 0.00 2.15 -1.26 -4.92 116.67 117.57 3k2h s ASP 350 Ca 0.78 0.72 0.15 0.00 0.43 0.00 0.00 52.55 54.63 3k2h s ASP 350 Cb -0.32 -2.41 0.50 0.00 -0.30 0.00 0.00 42.92 40.39 3k2h s ASP 350 CO 0.37 -0.60 1.41 -1.22 -0.17 0.00 0.00 175.17 174.96 3k2h n TYR 351 N 6.19 0.92 -1.69 -5.34 4.01 -1.26 -5.00 117.16 114.99 3k2h n TYR 351 Ca 0.04 -0.72 -0.44 0.00 -0.16 0.00 0.00 57.90 56.62 3k2h n TYR 351 Cb 0.48 -0.23 -0.04 0.00 -0.31 0.00 0.00 39.34 39.25 3k2h n TYR 351 CO 0.00 0.00 0.00 2.41 -0.46 0.00 0.00 176.86 178.81 3k2h n THR 352 N 0.07 0.13 -1.05 -0.72 -1.04 -1.26 -0.79 114.28 109.62 3k2h n THR 352 Ca 0.19 -0.02 -0.02 0.00 -2.04 0.00 0.00 64.05 62.16 3k2h n THR 352 Cb 0.77 -1.88 -0.01 0.00 -1.82 0.00 0.00 70.33 67.39 3k2h n THR 352 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 3k2h n GLY 353 N 3.89 0.29 3.73 3.41 0.00 -1.26 -5.01 105.19 110.25 3k2h n GLY 353 Ca 0.17 -0.03 -0.33 0.00 0.00 0.00 0.00 46.02 45.83 3k2h n GLY 353 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3k2h s LYS 354 N -1.65 2.92 0.71 1.61 1.02 0.03 -5.02 119.74 119.36 3k2h s LYS 354 Ca 0.00 -0.55 0.00 0.00 0.02 0.00 0.00 55.97 55.44 3k2h s LYS 354 Cb 0.00 -2.76 0.00 0.00 -0.52 0.00 0.00 37.83 34.55 3k2h s LYS 354 CO 0.00 0.63 0.00 0.41 -0.92 0.00 0.00 175.35 175.47 3k2h n GLY 355 N 1.27 -1.85 3.70 -3.33 0.00 -1.26 -4.51 105.19 99.19 3k2h n GLY 355 Ca -0.14 -1.29 -0.35 0.00 0.00 0.00 0.00 46.02 44.25 3k2h n GLY 355 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3k2h s ILE 356 N -0.97 5.17 -1.20 -0.61 1.01 0.23 -4.78 121.20 120.06 3k2h s ILE 356 Ca 0.00 0.10 -0.14 0.00 0.00 0.00 0.00 60.65 60.61 3k2h s ILE 356 Cb 0.00 -3.35 0.16 0.00 0.01 0.00 0.00 42.46 39.28 3k2h s ILE 356 CO 0.00 0.45 1.44 -0.62 0.00 0.00 0.00 174.94 176.21 3k2h s ASP 357 N 0.34 7.04 0.22 3.58 -1.08 -1.21 -1.51 116.67 124.04 3k2h s ASP 357 Ca 0.06 -2.92 -0.08 0.00 -0.52 0.00 0.00 52.55 49.09 3k2h s ASP 357 Cb -0.12 -2.41 0.34 0.00 -1.46 0.00 0.00 42.92 39.27 3k2h s ASP 357 CO -0.01 -0.79 1.74 1.56 0.52 0.00 0.00 175.17 178.19 3k2h h GLN 358 N 7.25 0.40 -0.21 4.34 4.20 -1.48 -0.30 115.11 129.32 3k2h h GLN 358 Ca 0.32 -0.02 0.00 0.00 0.06 0.00 0.00 58.65 59.01 3k2h h GLN 358 Cb 0.88 -0.09 -0.01 0.00 0.30 0.00 0.00 27.48 28.56 3k2h h GLN 358 CO 1.25 0.26 0.14 1.25 -0.67 0.00 0.00 178.83 181.06 3k2h h LEU 359 N 0.41 0.24 -0.68 1.46 5.85 -1.67 0.05 115.31 120.97 3k2h h LEU 359 Ca 0.34 -0.01 -0.05 0.00 0.84 0.00 0.00 57.88 59.00 3k2h h LEU 359 Cb 0.47 -0.06 -0.03 0.00 0.37 0.00 0.00 40.66 41.41 3k2h h LEU 359 CO -0.35 0.18 0.25 0.00 -0.34 0.00 0.00 178.44 178.18 3k2h h ALA 360 N 1.07 0.89 -0.36 1.25 0.00 -1.75 -2.29 119.26 118.05 3k2h h ALA 360 Ca 0.08 -0.19 -0.04 0.00 0.00 0.00 0.00 54.91 54.75 3k2h h ALA 360 Cb -0.02 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.49 3k2h h ALA 360 CO -0.02 0.53 0.08 0.93 0.00 0.00 0.00 179.25 180.77 3k2h h GLU 361 N 0.98 0.59 -0.41 0.00 5.08 -0.54 -1.92 114.58 118.35 3k2h h GLU 361 Ca 0.22 -0.15 -0.09 0.00 -1.00 0.00 0.00 59.36 58.35 3k2h h GLU 361 Cb 0.25 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.41 3k2h h GLU 361 CO -0.01 0.64 -0.10 0.82 -1.00 0.00 0.00 179.01 179.36 3k2h h ILE 362 N 0.44 1.27 -0.90 3.13 1.08 -0.95 0.56 117.51 122.14 3k2h h ILE 362 Ca 0.11 -1.19 -0.01 0.00 -0.39 0.00 0.00 64.86 63.38 3k2h h ILE 362 Cb 0.33 1.20 -0.04 0.00 -3.07 0.00 0.00 36.82 35.24 3k2h h ILE 362 CO 0.00 0.40 0.51 0.40 -0.69 0.00 0.00 178.15 178.78 3k2h h ILE 363 N 0.60 1.25 -0.28 -0.67 2.04 -1.39 0.15 117.51 119.22 3k2h h ILE 363 Ca 0.10 -0.60 -0.15 0.00 1.00 0.00 0.00 64.86 65.21 3k2h h ILE 363 Cb 0.62 0.02 -0.01 0.00 -0.74 0.00 0.00 36.82 36.71 3k2h h ILE 363 CO 0.04 0.28 -0.44 -1.13 0.00 0.00 0.00 178.15 176.90 3k2h h ASN 364 N 1.25 0.78 -0.05 1.72 -1.24 -1.16 -2.71 115.58 114.18 3k2h h ASN 364 Ca 0.32 -0.37 -0.09 0.00 0.71 0.00 0.00 56.30 56.87 3k2h h ASN 364 Cb -0.01 -0.22 -0.01 0.00 0.73 0.00 0.00 38.32 38.81 3k2h h ASN 364 CO -0.06 1.11 -0.22 -0.09 -1.29 0.00 0.00 177.43 176.88 3k2h h ARG 365 N 0.58 0.45 -0.83 6.67 2.43 -0.32 -1.35 114.38 122.00 3k2h h ARG 365 Ca 0.04 -0.16 0.00 0.00 -0.81 0.00 0.00 59.98 59.05 3k2h h ARG 365 Cb 1.00 -0.03 -0.04 0.00 -0.42 0.00 0.00 29.97 30.47 3k2h h ARG 365 CO 0.09 0.65 0.52 0.82 -1.51 0.00 0.00 179.97 180.54 3k2h h ILE 366 N 0.40 1.22 -0.25 1.20 2.04 -0.53 0.26 117.51 121.86 3k2h h ILE 366 Ca 0.06 -0.46 -0.09 0.00 1.00 0.00 0.00 64.86 65.37 3k2h h ILE 366 Cb 0.62 0.03 -0.00 0.00 -0.74 0.00 0.00 36.82 36.72 3k2h h ILE 366 CO 0.04 0.23 -0.20 0.11 0.00 0.00 0.00 178.15 178.34 3k2h h LYS 367 N 1.14 0.57 0.01 2.37 1.57 -1.10 -3.19 116.57 117.93 3k2h h LYS 367 Ca 0.30 -0.28 -0.33 0.00 -1.87 0.00 0.00 60.65 58.47 3k2h h LYS 367 Cb -0.08 0.00 -0.06 0.00 0.08 0.00 0.00 32.23 32.17 3k2h h LYS 367 CO -0.06 0.87 -2.04 0.25 -0.57 0.00 0.00 179.45 177.90 3k2h n THR 368 N -4.40 1.52 -3.18 -0.16 -2.24 -0.56 -4.66 114.28 100.60 3k2h n THR 368 Ca -0.04 -0.81 -0.23 0.00 -2.27 0.00 0.00 64.05 60.70 3k2h n THR 368 Cb 0.40 -0.84 -0.06 0.00 -2.10 0.00 0.00 70.33 67.73 3k2h n THR 368 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 3k2h n ASN 369 N -2.95 -0.37 0.27 3.42 5.15 0.89 -4.99 115.26 116.68 3k2h n ASN 369 Ca -0.25 -2.68 0.15 0.00 -0.60 0.00 0.00 54.58 51.20 3k2h n ASN 369 Cb 1.09 -0.32 0.89 0.00 -0.53 0.00 0.00 39.78 40.91 3k2h n ASN 369 CO 0.00 0.00 0.00 1.55 1.40 0.00 0.00 177.26 180.21 3k2h h PRO 370 N 4.39 0.00 -0.25 1.20 0.13 -1.57 -2.05 132.00 133.85 3k2h h PRO 370 Ca 0.09 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.22 3k2h h PRO 370 Cb 0.91 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.04 3k2h h PRO 370 CO 0.41 0.00 0.00 0.09 -0.23 0.00 0.00 178.00 178.27 3k2h n ASN 371 N -3.86 1.55 -4.76 1.44 3.02 -1.26 -4.34 115.26 107.06 3k2h n ASN 371 Ca -0.02 -1.90 -0.38 0.00 -0.03 0.00 0.00 54.58 52.26 3k2h n ASN 371 Cb 0.15 -0.17 0.02 0.00 -0.61 0.00 0.00 39.78 39.17 3k2h n ASN 371 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 3k2h s ASP 372 N -1.17 5.61 -0.20 6.41 2.15 -0.77 -4.93 116.67 123.77 3k2h s ASP 372 Ca 0.24 2.56 0.15 0.00 0.43 0.00 0.00 52.55 55.93 3k2h s ASP 372 Cb 0.12 -2.62 0.58 0.00 -0.30 0.00 0.00 42.92 40.71 3k2h s ASP 372 CO 0.17 -1.32 1.49 0.54 -0.17 0.00 0.00 175.17 175.89 3k2h n ARG 373 N -0.86 3.16 -1.59 4.34 1.74 -1.26 -4.49 116.66 117.69 3k2h n ARG 373 Ca 0.09 -2.93 -0.10 0.00 -0.77 0.00 0.00 57.85 54.14 3k2h n ARG 373 Cb 0.46 -1.93 0.09 0.00 -1.02 0.00 0.00 32.46 30.07 3k2h n ARG 373 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 3k2h n ARG 374 N -0.39 2.54 -1.84 5.56 3.00 -1.26 -4.96 116.66 119.31 3k2h n ARG 374 Ca 0.24 -3.69 -0.42 0.00 -0.01 0.00 0.00 57.85 53.98 3k2h n ARG 374 Cb 0.98 -1.85 -0.00 0.00 0.00 0.00 0.00 32.46 31.58 3k2h n ARG 374 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.63 178.91 3k2h n LEU 375 N -0.76 7.07 -4.22 0.55 4.77 -1.26 -4.92 117.00 118.24 3k2h n LEU 375 Ca 0.30 -4.32 -0.29 0.00 -0.03 0.00 0.00 56.01 51.67 3k2h n LEU 375 Cb 0.87 -1.59 -0.16 0.00 -2.33 0.00 0.00 43.42 40.21 3k2h n LEU 375 CO 0.19 1.32 -0.54 -0.63 -1.33 0.00 0.00 177.39 176.40 3k2h s ILE 376 N 2.23 1.80 -0.20 -0.08 1.01 -1.26 -0.50 121.20 124.20 3k2h s ILE 376 Ca 0.48 -0.93 -0.02 0.00 0.00 0.00 0.00 60.65 60.18 3k2h s ILE 376 Cb 0.14 -1.52 -0.00 0.00 0.01 0.00 0.00 42.46 41.08 3k2h s ILE 376 CO -0.06 0.51 -0.10 -0.69 0.00 0.00 0.00 174.94 174.60 3k2h s VAL 377 N -0.13 2.96 -0.20 2.92 1.01 -0.38 -4.92 120.40 121.66 3k2h s VAL 377 Ca -0.02 -0.64 0.00 0.00 0.00 0.00 0.00 61.98 61.32 3k2h s VAL 377 Cb -0.12 -2.31 0.02 0.00 0.00 0.00 0.00 36.38 33.96 3k2h s VAL 377 CO 0.03 0.47 -0.16 0.00 0.00 0.00 0.00 175.10 175.43 3k2h n SER 379 N 4.63 2.40 -3.74 0.00 7.64 0.14 -4.65 113.62 120.04 3k2h n SER 379 Ca -0.20 -1.70 -0.42 0.00 1.01 0.00 0.00 58.87 57.56 3k2h n SER 379 Cb 0.49 0.29 -0.00 0.00 -1.01 0.00 0.00 64.21 63.98 3k2h n SER 379 CO 0.00 0.00 0.00 1.87 -3.01 0.00 0.00 175.04 173.90 3k2h n TRP 380 N 0.51 3.06 -2.66 1.43 -0.00 -1.12 -4.78 117.44 113.88 3k2h n TRP 380 Ca 0.11 -2.87 -0.42 0.00 -0.00 0.00 0.00 57.50 54.32 3k2h n TRP 380 Cb 0.52 -2.18 -0.03 0.00 -0.00 0.00 0.00 31.31 29.62 3k2h n TRP 380 CO 0.00 0.00 0.00 1.21 -0.00 0.00 0.00 177.69 178.90 3k2h s ASN 381 N 1.67 6.17 0.32 5.87 3.84 -1.26 -4.88 114.94 126.67 3k2h s ASN 381 Ca 0.45 -0.64 -0.00 0.00 0.21 0.00 0.00 52.86 52.89 3k2h s ASN 381 Cb 0.13 -2.51 0.53 0.00 -0.55 0.00 0.00 41.25 38.84 3k2h s ASN 381 CO -0.04 -1.69 1.98 0.58 -2.79 0.00 0.00 177.10 175.14 3k2h h VAL 382 N 6.01 1.17 -0.22 -5.21 2.07 -2.00 0.13 116.25 118.21 3k2h h VAL 382 Ca -0.28 -0.35 0.06 0.00 0.82 0.00 0.00 66.70 66.95 3k2h h VAL 382 Cb 1.06 0.07 -0.01 0.00 -1.52 0.00 0.00 31.29 30.89 3k2h h VAL 382 CO 1.24 0.18 0.16 0.28 0.02 0.00 0.00 177.57 179.46 3k2h h SER 383 N 1.01 0.00 -0.00 0.57 0.02 -2.02 -3.17 113.55 109.97 3k2h h SER 383 Ca 0.29 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.24 3k2h h SER 383 Cb -0.07 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.47 3k2h h SER 383 CO -0.07 0.00 -0.85 0.47 -1.14 0.00 0.00 176.83 175.24 3k2h n ASP 384 N -4.40 1.15 -0.23 3.07 8.00 0.42 -4.58 116.55 119.97 3k2h n ASP 384 Ca 0.02 -1.07 0.03 0.00 0.71 0.00 0.00 54.79 54.48 3k2h n ASP 384 Cb 0.30 0.90 0.14 0.00 -0.02 0.00 0.00 41.12 42.44 3k2h n ASP 384 CO 0.00 0.00 0.00 -0.07 -0.39 0.00 0.00 177.20 176.74 3k2h h LEU 385 N 0.45 -0.21 -2.19 0.64 3.38 -1.44 -0.31 115.31 115.63 3k2h h LEU 385 Ca 0.00 0.16 0.00 0.00 0.09 0.00 0.00 57.88 58.13 3k2h h LEU 385 Cb 0.52 0.27 0.00 0.00 0.09 0.00 0.00 40.66 41.54 3k2h h LEU 385 CO 0.00 -0.11 0.00 0.11 0.09 0.00 0.00 178.44 178.53 3k2h h LYS 386 N 0.16 0.00 -0.00 1.13 1.57 -1.82 -1.70 116.57 115.90 3k2h h LYS 386 Ca 0.37 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.15 3k2h h LYS 386 Cb 0.62 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.93 3k2h h LYS 386 CO -0.56 0.00 -0.34 1.63 -0.57 0.00 0.00 179.45 179.62 3k2h n LYS 387 N -2.78 0.15 -3.40 3.15 5.02 -0.13 -4.94 118.16 115.23 3k2h n LYS 387 Ca -0.02 -0.07 -0.38 0.00 -2.02 0.00 0.00 58.31 55.82 3k2h n LYS 387 Cb 0.10 -1.50 -0.06 0.00 -0.02 0.00 0.00 35.03 33.55 3k2h n LYS 387 CO 0.00 0.00 0.00 -1.64 -0.52 0.00 0.00 177.40 175.24 3k2h s MET 388 N -2.90 4.21 0.31 1.97 -1.94 -0.64 -4.38 119.30 115.93 3k2h s MET 388 Ca 0.15 0.39 0.00 0.00 -1.71 0.00 0.00 55.69 54.52 3k2h s MET 388 Cb 0.18 -3.37 0.49 0.00 2.01 0.00 0.00 34.83 34.15 3k2h s MET 388 CO 0.63 0.33 1.91 0.00 -0.01 0.00 0.00 175.02 177.87 3k2h h ALA 389 N 6.10 1.36 -1.78 3.03 0.00 -1.27 -3.40 119.26 123.30 3k2h h ALA 389 Ca -0.44 -0.13 -0.15 0.00 0.00 0.00 0.00 54.91 54.18 3k2h h ALA 389 Cb 1.19 -0.24 -0.29 0.00 0.00 0.00 0.00 17.79 18.45 3k2h h ALA 389 CO 0.71 0.50 -0.49 -1.17 0.00 0.00 0.00 179.25 178.80 3k2h s LEU 390 N -9.53 -0.73 0.41 0.00 2.96 -1.26 -5.07 118.68 105.46 3k2h s LEU 390 Ca -0.10 0.04 -0.24 0.00 -0.22 0.00 0.00 54.13 53.60 3k2h s LEU 390 Cb 0.16 1.17 -0.11 0.00 0.50 0.00 0.00 46.19 47.91 3k2h s LEU 390 CO 0.79 -0.32 0.91 -2.65 -1.32 0.00 0.00 176.35 173.76 3k2h n PRO 391 N 5.36 1.16 -1.68 0.98 -0.02 -1.26 -4.81 135.00 134.73 3k2h n PRO 391 Ca -0.02 0.42 -0.45 0.00 -2.02 0.00 0.00 63.50 61.43 3k2h n PRO 391 Cb 0.50 -1.90 -0.03 0.00 -0.02 0.00 0.00 33.50 32.04 3k2h n PRO 391 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 3k2h n PRO 392 N 0.28 2.20 -0.05 0.52 -0.02 -1.26 -4.94 135.00 131.73 3k2h n PRO 392 Ca 0.10 0.79 -0.11 0.00 -2.02 0.00 0.00 63.50 62.26 3k2h n PRO 392 Cb 0.38 -2.52 -0.10 0.00 -0.02 0.00 0.00 33.50 31.24 3k2h n PRO 392 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3k2h s HIS 394 N -2.26 2.71 -2.57 0.00 0.00 -1.26 -0.53 115.29 111.38 3k2h s HIS 394 Ca -0.14 -0.84 0.23 0.00 -3.00 0.00 0.00 55.06 51.32 3k2h s HIS 394 Cb -0.02 -4.47 0.10 0.00 -4.00 0.00 0.00 32.58 24.19 3k2h s HIS 394 CO 0.52 -1.76 1.18 0.00 -1.00 0.00 0.00 174.74 173.68 3k2h s PHE 396 N -2.20 -0.70 0.05 0.00 2.19 -1.25 -0.69 117.98 115.38 3k2h s PHE 396 Ca 0.24 1.38 -0.02 0.00 0.33 0.00 0.00 56.93 58.85 3k2h s PHE 396 Cb 0.19 0.42 -0.03 0.00 -1.31 0.00 0.00 43.02 42.29 3k2h s PHE 396 CO 0.42 -0.35 0.01 -0.59 1.83 0.00 0.00 175.22 176.54 3k2h s PHE 397 N 1.49 0.41 -0.08 10.12 -0.71 -0.23 -1.23 117.98 127.75 3k2h s PHE 397 Ca -0.09 -0.88 -0.04 0.00 -1.04 0.00 0.00 56.93 54.88 3k2h s PHE 397 Cb -0.04 -0.30 0.04 0.00 -1.21 0.00 0.00 43.02 41.51 3k2h s PHE 397 CO -0.16 -0.37 0.18 -1.14 -1.34 0.00 0.00 175.22 172.39 3k2h s GLN 398 N -3.45 0.14 0.44 1.99 0.74 0.00 -1.25 119.66 118.28 3k2h s GLN 398 Ca 0.02 0.42 -0.00 0.00 0.05 0.00 0.00 55.36 55.85 3k2h s GLN 398 Cb 0.04 -0.15 -0.01 0.00 1.10 0.00 0.00 33.01 34.00 3k2h s GLN 398 CO -0.08 -0.16 0.67 -0.06 -0.55 0.00 0.00 175.29 175.11 3k2h s PHE 399 N 1.15 3.27 -0.17 1.67 0.08 0.35 -0.99 117.98 123.34 3k2h s PHE 399 Ca -0.09 0.28 -0.18 0.00 0.12 0.00 0.00 56.93 57.06 3k2h s PHE 399 Cb -0.11 -2.28 0.05 0.00 -0.57 0.00 0.00 43.02 40.12 3k2h s PHE 399 CO -0.07 -0.31 0.50 -0.47 -0.10 0.00 0.00 175.22 174.77 3k2h s TYR 400 N -2.55 -0.53 -0.10 0.36 5.04 -0.52 -4.59 117.35 114.45 3k2h s TYR 400 Ca 0.47 1.26 0.02 0.00 -2.44 0.00 0.00 57.07 56.38 3k2h s TYR 400 Cb -0.10 0.19 0.01 0.00 0.35 0.00 0.00 41.96 42.42 3k2h s TYR 400 CO 0.38 -0.29 -0.15 0.08 -1.34 0.00 0.00 175.55 174.23 3k2h s VAL 401 N 0.07 1.46 0.02 3.14 1.01 -1.26 -0.07 120.40 124.77 3k2h s VAL 401 Ca -0.02 -0.63 -0.20 0.00 0.00 0.00 0.00 61.98 61.14 3k2h s VAL 401 Cb -0.03 -1.33 0.04 0.00 0.00 0.00 0.00 36.38 35.05 3k2h s VAL 401 CO 0.01 0.43 0.45 -0.94 0.00 0.00 0.00 175.10 175.06 3k2h s SER 402 N 0.93 -0.35 -1.26 3.32 1.04 -0.92 -4.86 113.70 111.60 3k2h s SER 402 Ca -0.08 0.15 -0.06 0.00 0.48 0.00 0.00 55.95 56.44 3k2h s SER 402 Cb -0.15 0.43 0.04 0.00 0.10 0.00 0.00 66.02 66.44 3k2h s SER 402 CO -0.00 -0.62 0.37 0.47 0.98 0.00 0.00 173.24 174.43 3k2h n ASP 403 N 0.69 -4.17 -1.92 7.02 8.00 -1.26 -1.33 116.55 123.59 3k2h n ASP 403 Ca -0.19 -0.20 -0.19 0.00 0.71 0.00 0.00 54.79 54.92 3k2h n ASP 403 Cb 0.59 -3.46 -0.03 0.00 -0.02 0.00 0.00 41.12 38.20 3k2h n ASP 403 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 3k2h n ASN 404 N -2.19 -5.36 -4.24 -2.24 3.02 -1.26 -4.96 115.26 98.03 3k2h n ASN 404 Ca -0.07 0.13 -0.30 0.00 -0.03 0.00 0.00 54.58 54.31 3k2h n ASN 404 Cb 0.57 -4.44 -0.16 0.00 -0.61 0.00 0.00 39.78 35.14 3k2h n ASN 404 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 3k2h s LYS 405 N -4.52 2.34 -0.20 3.52 1.02 -0.44 -0.60 119.74 120.86 3k2h s LYS 405 Ca 0.00 -0.85 -0.17 0.00 0.02 0.00 0.00 55.97 54.97 3k2h s LYS 405 Cb 0.00 -2.02 -0.04 0.00 -0.52 0.00 0.00 37.83 35.26 3k2h s LYS 405 CO 0.00 0.37 0.47 -1.17 -0.92 0.00 0.00 175.35 174.09 3k2h s LEU 406 N -0.17 4.15 0.26 3.17 2.96 -0.03 -2.16 118.68 126.86 3k2h s LEU 406 Ca -0.02 0.60 0.08 0.00 -0.22 0.00 0.00 54.13 54.57 3k2h s LEU 406 Cb -0.13 -2.62 -0.04 0.00 0.50 0.00 0.00 46.19 43.90 3k2h s LEU 406 CO 0.03 -0.14 0.13 -0.44 -1.32 0.00 0.00 176.35 174.62 3k2h s SER 407 N 1.12 5.19 -0.01 3.68 0.01 0.90 -0.67 113.70 123.92 3k2h s SER 407 Ca 0.22 -0.39 0.01 0.00 1.31 0.00 0.00 55.95 57.10 3k2h s SER 407 Cb -0.15 -1.21 0.00 0.00 0.21 0.00 0.00 66.02 64.88 3k2h s SER 407 CO 0.09 -0.04 -0.02 0.00 0.41 0.00 0.00 173.24 173.68 3k2h s MET 409 N 0.18 3.29 -0.02 0.00 1.75 -0.16 -0.11 119.30 124.23 3k2h s MET 409 Ca -0.02 -0.74 0.08 0.00 -1.25 0.00 0.00 55.69 53.77 3k2h s MET 409 Cb -0.04 -2.56 -0.02 0.00 2.84 0.00 0.00 34.83 35.05 3k2h s MET 409 CO -0.00 0.19 -0.25 1.41 -0.65 0.00 0.00 175.02 175.71 3k2h s MET 410 N 0.39 2.12 -0.28 4.11 1.75 -0.51 -0.82 119.30 126.06 3k2h s MET 410 Ca -0.12 -0.92 -0.10 0.00 -1.25 0.00 0.00 55.69 53.29 3k2h s MET 410 Cb -0.16 -2.06 -0.03 0.00 2.84 0.00 0.00 34.83 35.41 3k2h s MET 410 CO 0.06 0.56 0.16 -1.58 -0.65 0.00 0.00 175.02 173.57 3k2h s HIS 411 N -0.63 3.18 -0.33 4.11 2.46 -0.36 -1.31 115.29 122.41 3k2h s HIS 411 Ca 0.10 -0.16 -0.06 0.00 0.47 0.00 0.00 55.06 55.41 3k2h s HIS 411 Cb -0.10 -2.35 0.04 0.00 -0.13 0.00 0.00 32.58 30.04 3k2h s HIS 411 CO -0.01 -0.28 0.08 -1.14 -2.47 0.00 0.00 174.74 170.93 3k2h s GLN 412 N 1.70 2.67 0.41 2.88 0.74 -0.28 -2.04 119.66 125.73 3k2h s GLN 412 Ca 0.06 -1.14 0.13 0.00 0.05 0.00 0.00 55.36 54.46 3k2h s GLN 412 Cb -0.16 -3.40 0.88 0.00 1.10 0.00 0.00 33.01 31.42 3k2h s GLN 412 CO 0.08 -0.62 1.93 0.07 -0.55 0.00 0.00 175.29 176.20 3k2h h ARG 413 N 8.19 0.03 -2.82 1.67 0.11 -1.12 -1.41 114.38 119.04 3k2h h ARG 413 Ca -0.24 -0.01 -0.17 0.00 0.10 0.00 0.00 59.98 59.66 3k2h h ARG 413 Cb 1.09 -0.00 -0.29 0.00 1.11 0.00 0.00 29.97 31.87 3k2h h ARG 413 CO 0.59 0.27 -0.44 0.45 0.10 0.00 0.00 179.97 180.95 3k2h s SER 414 N -6.96 -0.15 -0.31 0.08 0.15 -1.26 -2.06 113.70 103.19 3k2h s SER 414 Ca -0.04 0.70 0.00 0.00 0.70 0.00 0.00 55.95 57.31 3k2h s SER 414 Cb 0.15 0.70 0.10 0.00 -1.71 0.00 0.00 66.02 65.26 3k2h s SER 414 CO 0.71 -0.20 0.08 0.00 1.20 0.00 0.00 173.24 175.03 3k2h s ASP 416 N 1.49 5.68 0.38 0.00 -1.08 -1.26 -1.58 116.67 120.30 3k2h s ASP 416 Ca 0.09 -0.56 0.06 0.00 -0.52 0.00 0.00 52.55 51.62 3k2h s ASP 416 Cb -0.18 -2.55 0.75 0.00 -1.46 0.00 0.00 42.92 39.48 3k2h s ASP 416 CO -0.21 -2.20 1.97 -0.07 0.52 0.00 0.00 175.17 175.18 3k2h h LEU 417 N 15.44 0.44 -0.04 -1.34 3.38 -1.68 -1.09 115.31 130.42 3k2h h LEU 417 Ca -0.04 -0.05 -0.01 0.00 0.09 0.00 0.00 57.88 57.87 3k2h h LEU 417 Cb 1.05 -0.11 -0.00 0.00 0.09 0.00 0.00 40.66 41.69 3k2h h LEU 417 CO 1.28 0.43 -0.01 1.23 0.09 0.00 0.00 178.44 181.46 3k2h h GLY 418 N 0.68 0.08 0.00 0.83 0.00 -1.88 -3.40 103.07 99.38 3k2h h GLY 418 Ca 0.12 -0.07 -0.18 0.00 0.00 0.00 0.00 47.33 47.20 3k2h h GLY 418 CO -0.01 0.06 -1.52 1.04 0.00 0.00 0.00 176.54 176.11 3k2h n LEU 419 N -4.85 1.73 0.03 3.11 4.77 -1.09 -4.73 117.00 115.96 3k2h n LEU 419 Ca -0.07 0.29 -0.22 0.00 -0.03 0.00 0.00 56.01 55.98 3k2h n LEU 419 Cb 0.22 -0.68 -0.14 0.00 -2.33 0.00 0.00 43.42 40.49 3k2h n LEU 419 CO 0.34 0.04 -0.43 1.23 -1.33 0.00 0.00 177.39 177.25 3k2h h GLY 420 N -0.83 0.32 -0.08 -0.72 0.00 -1.50 -3.33 103.07 96.93 3k2h h GLY 420 Ca -0.28 -0.83 0.11 0.00 0.00 0.00 0.00 47.33 46.34 3k2h h GLY 420 CO -0.17 0.73 -0.09 -2.08 0.00 0.00 0.00 176.54 174.93 3k2h h VAL 421 N -0.21 0.47 -0.63 4.60 2.07 -1.53 0.30 116.25 121.32 3k2h h VAL 421 Ca -0.31 -0.01 0.10 0.00 0.82 0.00 0.00 66.70 67.30 3k2h h VAL 421 Cb 1.84 0.43 -0.04 0.00 -1.52 0.00 0.00 31.29 31.99 3k2h h VAL 421 CO 0.09 0.01 0.42 -0.65 0.02 0.00 0.00 177.57 177.46 3k2h h PRO 422 N 0.04 0.45 0.03 1.57 0.11 -1.77 -0.34 132.00 132.08 3k2h h PRO 422 Ca 0.28 -0.03 -0.00 0.00 0.11 0.00 0.00 66.00 66.36 3k2h h PRO 422 Cb 0.44 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 31.45 3k2h h PRO 422 CO -0.55 0.30 -0.01 0.74 -0.21 0.00 0.00 178.00 178.27 3k2h h PHE 423 N 0.46 -0.03 -0.73 0.65 0.05 -0.67 -3.13 116.94 113.55 3k2h h PHE 423 Ca 0.29 -0.00 0.06 0.00 3.82 0.00 0.00 57.97 62.14 3k2h h PHE 423 Cb 0.52 0.01 -0.06 0.00 2.00 0.00 0.00 35.95 38.43 3k2h h PHE 423 CO -0.00 0.37 0.42 -0.91 -0.18 0.00 0.00 178.31 178.00 3k2h h ASN 424 N -0.44 0.63 0.22 2.17 -0.26 -0.21 0.35 115.58 118.03 3k2h h ASN 424 Ca -0.00 0.03 -0.00 0.00 -0.56 0.00 0.00 56.30 55.76 3k2h h ASN 424 Cb 0.41 -0.10 -0.01 0.00 -1.06 0.00 0.00 38.32 37.56 3k2h h ASN 424 CO 0.01 0.40 -0.18 0.40 -1.06 0.00 0.00 177.43 177.00 3k2h h ILE 425 N 0.76 0.61 -0.47 2.81 2.04 -1.15 -2.42 117.51 119.70 3k2h h ILE 425 Ca 0.32 0.00 -0.12 0.00 1.00 0.00 0.00 64.86 66.06 3k2h h ILE 425 Cb 0.20 0.61 -0.01 0.00 -0.74 0.00 0.00 36.82 36.87 3k2h h ILE 425 CO -0.18 0.00 -0.20 0.00 0.00 0.00 0.00 178.15 177.76 3k2h h ALA 426 N 0.33 0.76 -0.26 1.87 0.00 -1.45 -2.84 119.26 117.67 3k2h h ALA 426 Ca -0.01 -0.38 0.05 0.00 0.00 0.00 0.00 54.91 54.57 3k2h h ALA 426 Cb 0.37 -0.17 -0.05 0.00 0.00 0.00 0.00 17.79 17.95 3k2h h ALA 426 CO -0.02 0.66 -0.08 1.03 0.00 0.00 0.00 179.25 180.84 3k2h h SER 427 N 0.81 -0.27 0.97 0.00 0.87 -0.81 -1.54 113.55 113.58 3k2h h SER 427 Ca 0.11 0.08 -0.09 0.00 -1.23 0.00 0.00 61.79 60.67 3k2h h SER 427 Cb 0.76 0.17 -0.01 0.00 -0.44 0.00 0.00 62.40 62.88 3k2h h SER 427 CO 0.06 -0.10 -0.41 1.88 -0.53 0.00 0.00 176.83 177.73 3k2h h TYR 428 N -0.02 0.00 -0.44 2.24 -1.99 -1.48 -0.81 116.97 114.47 3k2h h TYR 428 Ca 0.13 0.00 -0.13 0.00 2.00 0.00 0.00 58.73 60.72 3k2h h TYR 428 Cb 0.21 0.00 -0.01 0.00 2.00 0.00 0.00 36.73 38.93 3k2h h TYR 428 CO -0.27 0.41 -0.25 0.77 -0.00 0.00 0.00 178.16 178.82 3k2h h SER 429 N 0.00 0.95 -0.19 3.88 0.02 -1.20 -0.17 113.55 116.83 3k2h h SER 429 Ca -0.00 -0.37 -0.10 0.00 -0.84 0.00 0.00 61.79 60.48 3k2h h SER 429 Cb 1.00 -0.26 -0.00 0.00 0.14 0.00 0.00 62.40 63.28 3k2h h SER 429 CO 0.05 1.14 -0.26 0.40 -1.14 0.00 0.00 176.83 177.02 3k2h h ILE 430 N 0.79 1.34 -0.47 3.27 2.04 -0.89 -1.66 117.51 121.93 3k2h h ILE 430 Ca 0.10 -1.47 0.02 0.00 1.00 0.00 0.00 64.86 64.51 3k2h h ILE 430 Cb 0.82 1.83 -0.03 0.00 -0.74 0.00 0.00 36.82 38.69 3k2h h ILE 430 CO 0.07 0.45 0.28 0.25 0.00 0.00 0.00 178.15 179.19 3k2h h LEU 431 N 0.18 0.45 -0.41 1.44 5.85 -1.11 0.29 115.31 122.00 3k2h h LEU 431 Ca 0.02 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.75 3k2h h LEU 431 Cb 0.83 -0.09 -0.02 0.00 0.37 0.00 0.00 40.66 41.75 3k2h h LEU 431 CO 0.06 0.32 0.27 0.74 -0.34 0.00 0.00 178.44 179.49 3k2h h THR 432 N 0.56 1.11 -0.85 1.05 2.02 -0.96 -0.37 112.91 115.47 3k2h h THR 432 Ca 0.18 -0.22 -0.01 0.00 0.77 0.00 0.00 66.41 67.13 3k2h h THR 432 Cb 0.01 0.52 -0.04 0.00 -1.74 0.00 0.00 68.15 66.90 3k2h h THR 432 CO -0.08 0.11 0.48 0.00 0.37 0.00 0.00 175.52 176.40 3k2h h ALA 433 N 1.14 1.24 0.07 6.16 0.00 -0.78 0.22 119.26 127.31 3k2h h ALA 433 Ca 0.15 -0.12 -0.00 0.00 0.00 0.00 0.00 54.91 54.94 3k2h h ALA 433 Cb -0.05 -0.34 0.00 0.00 0.00 0.00 0.00 17.79 17.40 3k2h h ALA 433 CO -0.03 0.62 -0.03 0.52 0.00 0.00 0.00 179.25 180.33 3k2h h MET 434 N 1.18 -0.09 -0.70 0.00 2.07 -0.56 -0.28 114.93 116.56 3k2h h MET 434 Ca 0.30 0.01 -0.01 0.00 -2.07 0.00 0.00 59.70 57.93 3k2h h MET 434 Cb 0.00 0.02 -0.03 0.00 -1.87 0.00 0.00 31.60 29.72 3k2h h MET 434 CO -0.05 0.12 0.40 0.28 1.07 0.00 0.00 176.91 178.73 3k2h h VAL 435 N -0.29 1.21 -0.77 -2.22 2.07 -0.83 -1.72 116.25 113.70 3k2h h VAL 435 Ca -0.01 -0.51 0.07 0.00 0.82 0.00 0.00 66.70 67.07 3k2h h VAL 435 Cb 0.25 0.27 -0.06 0.00 -1.52 0.00 0.00 31.29 30.23 3k2h h VAL 435 CO 0.02 0.23 0.45 0.00 0.02 0.00 0.00 177.57 178.28 3k2h h ALA 436 N 1.20 1.06 -0.07 1.67 0.00 -0.81 -2.17 119.26 120.14 3k2h h ALA 436 Ca 0.25 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.16 3k2h h ALA 436 Cb 0.01 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 17.64 3k2h h ALA 436 CO -0.04 0.14 -0.01 0.37 0.00 0.00 0.00 179.25 179.70 3k2h h GLN 437 N 0.81 0.13 0.00 0.00 4.15 -0.48 0.45 115.11 120.17 3k2h h GLN 437 Ca 0.35 -0.05 0.00 0.00 0.77 0.00 0.00 58.65 59.72 3k2h h GLN 437 Cb 0.22 -0.01 0.00 0.00 0.21 0.00 0.00 27.48 27.90 3k2h h GLN 437 CO -0.19 0.45 0.00 -0.39 -1.93 0.00 0.00 178.83 176.77 3k2h h VAL 438 N -0.20 0.00 -0.66 2.39 -1.51 -1.14 -1.45 116.25 113.68 3k2h h VAL 438 Ca 0.02 -0.41 0.00 0.00 -1.23 0.00 0.00 66.70 65.08 3k2h h VAL 438 Cb 0.40 1.40 0.00 0.00 -2.13 0.00 0.00 31.29 30.96 3k2h h VAL 438 CO 0.01 0.00 0.00 0.00 -1.23 0.00 0.00 177.57 176.35 3k2h n GLY 440 N 1.49 0.23 3.86 0.00 0.00 -0.55 -4.93 105.19 105.30 3k2h n GLY 440 Ca 0.22 -0.02 -0.27 0.00 0.00 0.00 0.00 46.02 45.95 3k2h n GLY 440 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3k2h s LEU 441 N -5.57 4.07 0.00 0.99 1.43 0.15 -5.01 118.68 114.74 3k2h s LEU 441 Ca 0.00 0.05 -0.17 0.00 -1.03 0.00 0.00 54.13 52.97 3k2h s LEU 441 Cb 0.00 -2.67 0.25 0.00 0.03 0.00 0.00 46.19 43.80 3k2h s LEU 441 CO 0.00 0.09 1.03 0.61 0.23 0.00 0.00 176.35 178.32 3k2h n GLY 442 N -0.22 -2.39 3.57 -3.19 0.00 0.23 -4.30 105.19 98.89 3k2h n GLY 442 Ca -0.07 -1.55 -0.35 0.00 0.00 0.00 0.00 46.02 44.05 3k2h n GLY 442 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3k2h s LEU 443 N 0.00 3.62 0.00 0.99 1.43 -1.26 -0.85 118.68 122.61 3k2h s LEU 443 Ca 0.64 -0.01 0.00 0.00 -1.03 0.00 0.00 54.13 53.73 3k2h s LEU 443 Cb -0.05 -1.91 0.00 0.00 0.03 0.00 0.00 46.19 44.26 3k2h s LEU 443 CO 0.48 0.14 0.00 0.61 0.23 0.00 0.00 176.35 177.81 3k2h n GLY 444 N 3.74 0.79 3.33 -3.19 0.00 0.15 -3.92 105.19 106.08 3k2h n GLY 444 Ca -0.17 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.60 3k2h n GLY 444 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3k2h s GLU 445 N 3.15 1.25 -0.24 1.61 2.02 -1.25 -0.85 118.70 124.39 3k2h s GLU 445 Ca 0.00 -1.27 -0.09 0.00 0.02 0.00 0.00 54.97 53.62 3k2h s GLU 445 Cb 0.00 -1.57 -0.04 0.00 0.10 0.00 0.00 34.13 32.61 3k2h s GLU 445 CO 0.00 0.36 0.13 0.12 0.02 0.00 0.00 175.26 175.90 3k2h s PHE 446 N -1.26 3.23 -0.20 1.61 5.36 0.33 -0.04 117.98 127.00 3k2h s PHE 446 Ca 0.11 0.04 -0.03 0.00 -0.96 0.00 0.00 56.93 56.09 3k2h s PHE 446 Cb -0.09 -2.26 -0.01 0.00 -0.34 0.00 0.00 43.02 40.32 3k2h s PHE 446 CO 0.05 -0.07 -0.07 0.08 -1.46 0.00 0.00 175.22 173.76 3k2h s VAL 447 N 1.24 3.20 -0.28 3.12 1.01 0.84 -0.51 120.40 129.03 3k2h s VAL 447 Ca 0.06 -0.56 0.01 0.00 0.00 0.00 0.00 61.98 61.49 3k2h s VAL 447 Cb -0.14 -2.43 0.06 0.00 0.00 0.00 0.00 36.38 33.86 3k2h s VAL 447 CO 0.05 0.45 -0.05 -2.28 0.00 0.00 0.00 175.10 173.28 3k2h s HIS 448 N 1.29 3.28 -0.18 5.22 2.46 0.23 -1.43 115.29 126.17 3k2h s HIS 448 Ca 0.03 -2.12 -0.16 0.00 0.47 0.00 0.00 55.06 53.28 3k2h s HIS 448 Cb -0.14 -2.06 -0.04 0.00 -0.13 0.00 0.00 32.58 30.21 3k2h s HIS 448 CO -0.03 -0.85 0.40 -0.80 -2.47 0.00 0.00 174.74 171.00 3k2h s ASN 449 N 1.18 6.50 -0.17 9.88 0.01 -0.43 -0.73 114.94 131.18 3k2h s ASN 449 Ca -0.06 0.59 -0.03 0.00 -0.71 0.00 0.00 52.86 52.65 3k2h s ASN 449 Cb -0.20 -2.24 -0.02 0.00 0.41 0.00 0.00 41.25 39.21 3k2h s ASN 449 CO -0.03 -0.04 -0.07 -0.76 -1.51 0.00 0.00 177.10 174.70 3k2h s LEU 450 N 1.03 2.96 0.00 0.60 1.43 -0.36 -1.12 118.68 123.22 3k2h s LEU 450 Ca 0.20 -0.29 0.00 0.00 -1.03 0.00 0.00 54.13 53.02 3k2h s LEU 450 Cb -0.15 -1.72 0.00 0.00 0.03 0.00 0.00 46.19 44.36 3k2h s LEU 450 CO 0.08 0.10 0.00 0.00 0.23 0.00 0.00 176.35 176.76 3k2h n ALA 451 N 4.00 0.00 -2.55 4.21 0.00 -0.53 -1.16 120.51 124.48 3k2h n ALA 451 Ca -0.18 0.00 -0.41 0.00 0.00 0.00 0.00 53.44 52.85 3k2h n ALA 451 Cb 0.52 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.94 3k2h n ALA 451 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 3k2h s ASP 452 N -1.00 6.23 -0.20 0.00 -1.08 -0.87 -1.29 116.67 118.45 3k2h s ASP 452 Ca 0.00 -0.26 -0.07 0.00 -0.52 0.00 0.00 52.55 51.71 3k2h s ASP 452 Cb 0.00 -2.56 -0.03 0.00 -1.46 0.00 0.00 42.92 38.87 3k2h s ASP 452 CO 0.00 -1.74 0.05 0.00 0.52 0.00 0.00 175.17 174.00 3k2h s ALA 453 N 5.57 3.23 0.12 3.66 0.00 -0.45 -0.42 121.76 133.47 3k2h s ALA 453 Ca 0.38 -0.91 -0.08 0.00 0.00 0.00 0.00 51.96 51.36 3k2h s ALA 453 Cb -0.08 -1.91 -0.01 0.00 0.00 0.00 0.00 23.12 21.12 3k2h s ALA 453 CO 0.18 -0.07 0.21 -3.38 0.00 0.00 0.00 175.76 172.71 3k2h s HIS 454 N 0.84 0.29 -0.17 0.00 -3.43 -0.61 -0.99 115.29 111.21 3k2h s HIS 454 Ca 0.03 -0.70 -0.00 0.00 -0.80 0.00 0.00 55.06 53.59 3k2h s HIS 454 Cb -0.14 -0.09 0.04 0.00 -1.43 0.00 0.00 32.58 30.96 3k2h s HIS 454 CO 0.02 -0.60 -0.05 0.42 -2.00 0.00 0.00 174.74 172.53 3k2h s ILE 455 N -3.91 1.14 0.55 -5.38 1.01 0.57 -1.56 121.20 113.63 3k2h s ILE 455 Ca 0.10 -0.67 -0.21 0.00 0.00 0.00 0.00 60.65 59.87 3k2h s ILE 455 Cb 0.05 -1.32 -0.05 0.00 0.01 0.00 0.00 42.46 41.15 3k2h s ILE 455 CO -0.06 0.12 1.36 -0.31 0.00 0.00 0.00 174.94 176.05 3k2h s TYR 456 N 1.62 2.25 0.39 3.97 2.02 -1.26 -1.67 117.35 124.66 3k2h s TYR 456 Ca 0.00 1.37 0.08 0.00 -0.37 0.00 0.00 57.07 58.16 3k2h s TYR 456 Cb -0.15 -3.81 0.84 0.00 -0.40 0.00 0.00 41.96 38.43 3k2h s TYR 456 CO -0.08 -2.97 1.98 -0.39 -1.57 0.00 0.00 175.55 172.52 3k2h h VAL 457 N 1.38 0.99 -0.02 0.71 -1.51 -1.69 -0.60 116.25 115.52 3k2h h VAL 457 Ca -0.51 -0.22 0.00 0.00 -1.23 0.00 0.00 66.70 64.75 3k2h h VAL 457 Cb 1.30 0.31 0.00 0.00 -2.13 0.00 0.00 31.29 30.77 3k2h h VAL 457 CO 0.57 0.11 0.00 -0.90 -1.23 0.00 0.00 177.57 176.12 3k2h n ASP 458 N -4.48 0.14 -0.11 4.19 5.75 -1.26 -2.75 116.55 118.03 3k2h n ASP 458 Ca 0.10 -1.65 0.05 0.00 -0.01 0.00 0.00 54.79 53.28 3k2h n ASP 458 Cb 0.25 -0.01 -0.04 0.00 -1.03 0.00 0.00 41.12 40.29 3k2h n ASP 458 CO 0.00 0.00 0.00 1.41 -0.11 0.00 0.00 177.20 178.50 3k2h n HIS 459 N -0.60 0.00 -0.11 2.11 8.25 -0.24 -4.76 115.22 119.88 3k2h n HIS 459 Ca 0.09 0.00 -0.05 0.00 -0.26 0.00 0.00 57.72 57.50 3k2h n HIS 459 Cb 0.06 0.00 0.01 0.00 1.12 0.00 0.00 29.99 31.18 3k2h n HIS 459 CO 0.00 0.00 0.00 0.28 0.64 0.00 0.00 176.34 177.26 3k2h h VAL 460 N 0.52 0.63 -0.02 1.59 2.07 -1.50 0.74 116.25 120.28 3k2h h VAL 460 Ca 0.00 -0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.52 3k2h h VAL 460 Cb 0.32 0.63 -0.00 0.00 -1.52 0.00 0.00 31.29 30.71 3k2h h VAL 460 CO 0.00 0.00 0.01 0.44 0.02 0.00 0.00 177.57 178.04 3k2h h ASP 461 N 0.00 0.03 -0.25 0.57 3.32 -1.86 0.57 116.42 118.80 3k2h h ASP 461 Ca 0.18 -0.09 0.06 0.00 0.02 0.00 0.00 57.03 57.20 3k2h h ASP 461 Cb 0.27 -0.01 -0.08 0.00 0.22 0.00 0.00 39.33 39.74 3k2h h ASP 461 CO -0.38 0.11 -0.39 0.00 -1.72 0.00 0.00 179.24 176.86 3k2h h ALA 462 N 0.92 -0.43 -0.06 3.45 0.00 -1.77 -0.22 119.26 121.15 3k2h h ALA 462 Ca 0.01 0.04 -0.11 0.00 0.00 0.00 0.00 54.91 54.85 3k2h h ALA 462 Cb 0.09 0.77 -0.01 0.00 0.00 0.00 0.00 17.79 18.63 3k2h h ALA 462 CO -0.00 -0.85 -0.45 -0.39 0.00 0.00 0.00 179.25 177.56 3k2h h VAL 463 N -0.39 1.33 0.10 0.00 -1.51 -0.76 -0.59 116.25 114.42 3k2h h VAL 463 Ca 0.11 -1.59 -0.00 0.00 -1.23 0.00 0.00 66.70 63.99 3k2h h VAL 463 Cb 0.58 1.78 0.00 0.00 -2.13 0.00 0.00 31.29 31.53 3k2h h VAL 463 CO -0.46 0.47 -0.05 0.74 -1.23 0.00 0.00 177.57 177.04 3k2h h THR 464 N 0.12 0.92 -0.52 7.19 2.02 -0.54 -0.09 112.91 122.02 3k2h h THR 464 Ca 0.01 -0.05 0.10 0.00 0.77 0.00 0.00 66.41 67.23 3k2h h THR 464 Cb 0.85 0.96 -0.08 0.00 -1.74 0.00 0.00 68.15 68.13 3k2h h THR 464 CO 0.07 0.01 0.02 0.74 0.37 0.00 0.00 175.52 176.73 3k2h h THR 465 N -0.15 0.61 -0.55 3.16 2.02 -0.89 -3.19 112.91 113.91 3k2h h THR 465 Ca -0.01 -0.05 -0.05 0.00 0.77 0.00 0.00 66.41 67.07 3k2h h THR 465 Cb 0.12 0.45 -0.02 0.00 -1.74 0.00 0.00 68.15 66.96 3k2h h THR 465 CO 0.02 0.03 0.16 -0.61 0.37 0.00 0.00 175.52 175.49 3k2h h GLN 466 N 0.14 0.86 0.00 6.66 4.15 -0.32 -3.00 115.11 123.60 3k2h h GLN 466 Ca 0.27 -0.19 0.00 0.00 0.77 0.00 0.00 58.65 59.50 3k2h h GLN 466 Cb 0.40 -0.12 0.00 0.00 0.21 0.00 0.00 27.48 27.97 3k2h h GLN 466 CO -0.42 0.79 0.00 0.44 -1.93 0.00 0.00 178.83 177.71 3k2h n ILE 467 N -4.44 0.84 0.93 2.39 -5.35 -0.12 -1.69 119.36 111.92 3k2h n ILE 467 Ca 0.02 0.20 0.13 0.00 -0.27 0.00 0.00 62.75 62.83 3k2h n ILE 467 Cb 0.21 -1.06 0.39 0.00 -1.74 0.00 0.00 39.64 37.45 3k2h n ILE 467 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 3k2h n ALA 468 N -1.68 2.94 -2.59 -1.28 0.00 -1.13 -0.54 120.51 116.21 3k2h n ALA 468 Ca 0.03 -0.22 -0.42 0.00 0.00 0.00 0.00 53.44 52.82 3k2h n ALA 468 Cb 0.23 -1.28 -0.03 0.00 0.00 0.00 0.00 19.45 18.37 3k2h n ALA 468 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 3k2h s ARG 469 N -3.02 4.49 -0.08 0.00 0.52 -0.68 -4.68 118.95 115.49 3k2h s ARG 469 Ca 0.12 1.55 -0.30 0.00 -0.52 0.00 0.00 55.73 56.58 3k2h s ARG 469 Cb 0.17 -3.44 -0.03 0.00 0.52 0.00 0.00 34.95 32.17 3k2h s ARG 469 CO 0.63 -0.18 1.26 0.42 0.02 0.00 0.00 175.30 177.45 3k2h s ILE 470 N 1.25 4.17 0.48 1.52 -1.09 -1.26 -4.86 121.20 121.41 3k2h s ILE 470 Ca 0.54 1.48 -0.23 0.00 -2.23 0.00 0.00 60.65 60.21 3k2h s ILE 470 Cb -0.24 -3.95 -0.07 0.00 -1.58 0.00 0.00 42.46 36.62 3k2h s ILE 470 CO 0.27 -0.04 1.31 -2.84 -1.23 0.00 0.00 174.94 172.41 3k2h s PRO 471 N 2.68 3.55 0.55 2.79 0.02 -1.26 -4.89 135.00 138.43 3k2h s PRO 471 Ca 0.57 2.14 -0.07 0.00 0.02 0.00 0.00 61.00 63.67 3k2h s PRO 471 Cb -0.25 -2.46 -0.02 0.00 0.02 0.00 0.00 34.50 31.78 3k2h s PRO 471 CO 0.20 -0.83 0.87 -1.01 -0.33 0.00 0.00 177.00 175.90 3k2h s HIS 472 N -1.33 3.48 0.31 6.54 3.76 -1.26 -5.03 115.29 121.76 3k2h s HIS 472 Ca 0.65 0.86 -0.29 0.00 -0.15 0.00 0.00 55.06 56.13 3k2h s HIS 472 Cb -0.38 -2.53 -0.13 0.00 1.11 0.00 0.00 32.58 30.66 3k2h s HIS 472 CO 0.46 -0.54 1.31 -2.30 -0.85 0.00 0.00 174.74 172.83 3k2h n PRO 473 N -2.47 2.06 -0.92 8.40 -0.02 -1.26 -4.85 135.00 135.95 3k2h n PRO 473 Ca 0.03 0.73 -0.33 0.00 -2.02 0.00 0.00 63.50 61.91 3k2h n PRO 473 Cb 0.56 -2.32 0.14 0.00 -0.02 0.00 0.00 33.50 31.85 3k2h n PRO 473 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 3k2h n PHE 474 N 0.81 0.46 -1.35 6.00 3.72 -1.26 -4.66 117.46 121.18 3k2h n PHE 474 Ca 0.07 0.37 -0.15 0.00 -0.05 0.00 0.00 57.45 57.69 3k2h n PHE 474 Cb 0.34 -2.00 0.11 0.00 -0.94 0.00 0.00 39.48 37.00 3k2h n PHE 474 CO 0.00 0.00 0.00 -0.35 -0.05 0.00 0.00 176.76 176.36 3k2h n PRO 475 N -3.10 -0.89 -4.24 -1.08 -0.04 -1.24 -4.65 135.00 119.76 3k2h n PRO 475 Ca 0.11 -1.00 -0.18 0.00 -0.04 0.00 0.00 63.50 62.40 3k2h n PRO 475 Cb 0.51 -0.71 -0.11 0.00 -0.04 0.00 0.00 33.50 33.16 3k2h n PRO 475 CO 0.00 0.00 0.00 -0.98 -0.04 0.00 0.00 175.50 174.48 3k2h s ARG 476 N -4.42 1.03 -0.11 0.54 1.70 -0.78 -0.30 118.95 116.60 3k2h s ARG 476 Ca 0.37 -1.26 -0.03 0.00 -0.47 0.00 0.00 55.73 54.34 3k2h s ARG 476 Cb -0.01 -0.88 -0.03 0.00 -0.57 0.00 0.00 34.95 33.45 3k2h s ARG 476 CO 0.27 0.16 -0.01 -1.17 -1.08 0.00 0.00 175.30 173.47 3k2h s LEU 477 N -2.54 3.47 -0.11 -1.89 2.96 -1.26 -0.38 118.68 118.94 3k2h s LEU 477 Ca 0.10 0.04 0.01 0.00 -0.22 0.00 0.00 54.13 54.06 3k2h s LEU 477 Cb -0.04 -1.81 0.02 0.00 0.50 0.00 0.00 46.19 44.86 3k2h s LEU 477 CO 0.03 0.30 -0.11 -0.60 -1.32 0.00 0.00 176.35 174.65 3k2h s ARG 478 N -0.39 1.79 0.05 1.98 3.52 0.73 -4.98 118.95 121.66 3k2h s ARG 478 Ca 0.07 -0.39 -0.03 0.00 -0.13 0.00 0.00 55.73 55.25 3k2h s ARG 478 Cb -0.12 -1.66 -0.05 0.00 -1.56 0.00 0.00 34.95 31.56 3k2h s ARG 478 CO 0.02 -0.16 0.26 -0.51 -0.81 0.00 0.00 175.30 174.10 3k2h s LEU 479 N 1.30 4.34 -0.13 -0.88 1.43 -1.26 -1.18 118.68 122.30 3k2h s LEU 479 Ca -0.02 0.43 -0.29 0.00 -1.03 0.00 0.00 54.13 53.22 3k2h s LEU 479 Cb -0.14 -2.91 -0.06 0.00 0.03 0.00 0.00 46.19 43.12 3k2h s LEU 479 CO -0.05 0.18 1.98 0.21 0.23 0.00 0.00 176.35 178.90 3k2h s ASN 480 N -2.19 6.03 0.13 2.29 3.84 0.40 -4.85 114.94 120.58 3k2h s ASN 480 Ca 0.33 2.09 0.19 0.00 0.21 0.00 0.00 52.86 55.68 3k2h s ASN 480 Cb -0.13 -2.52 0.81 0.00 -0.55 0.00 0.00 41.25 38.86 3k2h s ASN 480 CO 0.23 -1.47 1.59 -0.81 -2.79 0.00 0.00 177.10 173.85 3k2h n PRO 481 N 8.07 0.10 0.23 0.43 -0.04 -1.26 -2.27 135.00 140.25 3k2h n PRO 481 Ca 0.24 0.33 0.15 0.00 -0.04 0.00 0.00 63.50 64.18 3k2h n PRO 481 Cb 0.44 -1.69 0.56 0.00 -0.04 0.00 0.00 33.50 32.77 3k2h n PRO 481 CO 0.00 0.00 0.00 -0.44 -0.04 0.00 0.00 175.50 175.02 3k2h h ASP 482 N 0.00 0.00 -2.78 3.54 3.32 -2.00 -3.45 116.42 115.05 3k2h h ASP 482 Ca 0.00 0.00 -0.56 0.00 0.02 0.00 0.00 57.03 56.49 3k2h h ASP 482 Cb 0.31 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.84 3k2h h ASP 482 CO 0.00 0.00 0.98 -0.63 -1.72 0.00 0.00 179.24 177.87 3k2h s ILE 483 N -3.49 3.94 -0.50 0.35 -1.09 -0.96 -4.88 121.20 114.56 3k2h s ILE 483 Ca 0.03 1.15 0.11 0.00 -2.23 0.00 0.00 60.65 59.71 3k2h s ILE 483 Cb 0.09 -3.74 -0.12 0.00 -1.58 0.00 0.00 42.46 37.11 3k2h s ILE 483 CO 0.53 -0.09 0.45 0.54 -1.23 0.00 0.00 174.94 175.13 3k2h n ARG 484 N 6.74 3.47 -3.87 2.79 1.74 -1.26 -4.69 116.66 121.58 3k2h n ARG 484 Ca 0.15 -0.00 -0.13 0.00 -0.77 0.00 0.00 57.85 57.10 3k2h n ARG 484 Cb 0.44 -1.00 -0.15 0.00 -1.02 0.00 0.00 32.46 30.73 3k2h n ARG 484 CO 0.00 0.00 0.00 1.21 -1.52 0.00 0.00 177.63 177.32 3k2h s ASN 485 N -2.01 0.08 0.37 0.55 3.84 -1.26 -4.79 114.94 111.72 3k2h s ASN 485 Ca 0.04 0.00 0.11 0.00 0.21 0.00 0.00 52.86 53.22 3k2h s ASN 485 Cb 0.08 -0.04 0.73 0.00 -0.55 0.00 0.00 41.25 41.47 3k2h s ASN 485 CO 0.44 -0.04 1.85 -0.29 -2.79 0.00 0.00 177.10 176.28 3k2h h ILE 486 N 5.51 1.23 0.00 -5.21 2.10 -1.93 0.40 117.51 119.61 3k2h h ILE 486 Ca -0.31 -1.07 0.00 0.00 1.08 0.00 0.00 64.86 64.56 3k2h h ILE 486 Cb 1.18 1.48 0.00 0.00 -1.09 0.00 0.00 36.82 38.39 3k2h h ILE 486 CO 0.50 0.32 0.00 -0.33 -1.08 0.00 0.00 178.15 177.56 3k2h h GLU 487 N 0.12 0.00 0.00 2.19 5.08 -1.96 -3.01 114.58 117.00 3k2h h GLU 487 Ca 0.02 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.38 3k2h h GLU 487 Cb 0.55 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.80 3k2h h GLU 487 CO 0.04 0.00 -0.41 -0.25 -1.00 0.00 0.00 179.01 177.39 3k2h n ASP 488 N -2.78 0.57 -4.75 1.42 8.00 0.13 -4.89 116.55 114.25 3k2h n ASP 488 Ca -0.00 0.15 -0.42 0.00 0.71 0.00 0.00 54.79 55.24 3k2h n ASP 488 Cb 0.20 -0.06 -0.02 0.00 -0.02 0.00 0.00 41.12 41.23 3k2h n ASP 488 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 3k2h s PHE 489 N -3.09 2.78 0.37 1.24 0.08 -1.14 -5.02 117.98 113.20 3k2h s PHE 489 Ca 0.09 0.74 0.08 0.00 0.12 0.00 0.00 56.93 57.96 3k2h s PHE 489 Cb 0.15 -4.06 -0.07 0.00 -0.57 0.00 0.00 43.02 38.46 3k2h s PHE 489 CO 0.67 -3.63 -0.05 0.95 -0.10 0.00 0.00 175.22 173.06 3k2h s THR 490 N 0.15 2.09 0.39 0.64 -4.23 -1.26 -5.01 115.64 108.40 3k2h s THR 490 Ca 0.64 -2.11 0.14 0.00 -1.18 0.00 0.00 61.69 59.18 3k2h s THR 490 Cb -0.48 -2.79 0.36 0.00 1.34 0.00 0.00 72.50 70.93 3k2h s THR 490 CO 0.46 -0.12 1.84 -0.29 -0.54 0.00 0.00 174.62 175.97 3k2h h ILE 491 N 1.93 0.70 0.00 2.99 2.10 -1.94 0.83 117.51 124.12 3k2h h ILE 491 Ca -0.43 -0.18 0.00 0.00 1.08 0.00 0.00 64.86 65.34 3k2h h ILE 491 Cb 1.25 0.14 0.00 0.00 -1.09 0.00 0.00 36.82 37.11 3k2h h ILE 491 CO 0.75 0.09 0.00 0.47 -1.08 0.00 0.00 178.15 178.38 3k2h n ASP 492 N -4.57 0.00 -0.20 2.19 8.00 -1.26 -2.74 116.55 117.97 3k2h n ASP 492 Ca 0.20 0.50 0.13 0.00 0.71 0.00 0.00 54.79 56.33 3k2h n ASP 492 Cb 0.65 -0.50 0.46 0.00 -0.02 0.00 0.00 41.12 41.71 3k2h n ASP 492 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 3k2h n ASP 493 N -1.50 0.83 -3.92 -2.24 8.00 0.29 -4.76 116.55 113.24 3k2h n ASP 493 Ca 0.04 -0.77 -0.30 0.00 0.71 0.00 0.00 54.79 54.47 3k2h n ASP 493 Cb 0.22 0.06 -0.15 0.00 -0.02 0.00 0.00 41.12 41.22 3k2h n ASP 493 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 3k2h s ILE 494 N -2.49 1.64 -0.11 0.53 1.01 -1.11 -0.46 121.20 120.21 3k2h s ILE 494 Ca 0.26 -1.66 0.03 0.00 0.00 0.00 0.00 60.65 59.28 3k2h s ILE 494 Cb 0.19 -2.08 0.01 0.00 0.01 0.00 0.00 42.46 40.59 3k2h s ILE 494 CO 0.50 -0.41 -0.21 -0.69 0.00 0.00 0.00 174.94 174.13 3k2h s VAL 495 N 1.27 1.92 -0.28 2.92 1.01 -0.33 -5.00 120.40 121.92 3k2h s VAL 495 Ca 0.04 -0.92 -0.10 0.00 0.00 0.00 0.00 61.98 61.00 3k2h s VAL 495 Cb -0.19 -1.69 -0.04 0.00 0.00 0.00 0.00 36.38 34.46 3k2h s VAL 495 CO -0.12 0.53 0.17 -0.69 0.00 0.00 0.00 175.10 174.99 3k2h s VAL 496 N 0.63 5.08 0.08 2.92 1.01 -1.26 -0.19 120.40 128.67 3k2h s VAL 496 Ca -0.12 0.04 0.02 0.00 0.00 0.00 0.00 61.98 61.92 3k2h s VAL 496 Cb -0.16 -3.43 -0.04 0.00 0.00 0.00 0.00 36.38 32.74 3k2h s VAL 496 CO 0.03 0.24 0.13 -1.61 0.00 0.00 0.00 175.10 173.88 3k2h s GLU 497 N 1.72 3.06 -1.17 2.72 0.41 0.49 -4.65 118.70 121.29 3k2h s GLU 497 Ca 0.07 -0.62 -0.07 0.00 -0.41 0.00 0.00 54.97 53.93 3k2h s GLU 497 Cb -0.16 -2.82 0.01 0.00 -1.78 0.00 0.00 34.13 29.38 3k2h s GLU 497 CO 0.09 0.57 0.97 -0.25 -0.49 0.00 0.00 175.26 176.16 3k2h n ASP 498 N 0.33 -5.72 -4.63 -0.19 8.00 -1.26 -1.87 116.55 111.21 3k2h n ASP 498 Ca -0.07 -0.44 -0.43 0.00 0.71 0.00 0.00 54.79 54.56 3k2h n ASP 498 Cb 0.52 -4.35 -0.03 0.00 -0.02 0.00 0.00 41.12 37.24 3k2h n ASP 498 CO 0.00 0.00 0.00 -0.47 -0.39 0.00 0.00 177.20 176.34 3k2h s TYR 499 N -3.26 3.17 -0.12 1.24 5.04 -1.26 -4.19 117.35 117.97 3k2h s TYR 499 Ca 0.48 1.11 0.03 0.00 -2.44 0.00 0.00 57.07 56.25 3k2h s TYR 499 Cb -0.21 -3.55 0.01 0.00 0.35 0.00 0.00 41.96 38.56 3k2h s TYR 499 CO 0.60 -0.70 -0.23 0.08 -1.34 0.00 0.00 175.55 173.96 3k2h s VAL 500 N 3.45 2.07 0.05 3.14 1.01 -1.26 -5.06 120.40 123.79 3k2h s VAL 500 Ca 0.42 -1.00 -0.10 0.00 0.00 0.00 0.00 61.98 61.31 3k2h s VAL 500 Cb -0.13 -1.81 0.00 0.00 0.00 0.00 0.00 36.38 34.45 3k2h s VAL 500 CO 0.14 0.55 0.21 -0.94 0.00 0.00 0.00 175.10 175.06 3k2h s SER 501 N 0.61 0.03 1.10 3.32 1.04 -1.26 -4.72 113.70 113.82 3k2h s SER 501 Ca -0.12 -0.39 -0.15 0.00 0.48 0.00 0.00 55.95 55.77 3k2h s SER 501 Cb -0.17 0.31 0.24 0.00 0.10 0.00 0.00 66.02 66.50 3k2h s SER 501 CO 0.03 -0.60 1.08 -1.00 0.98 0.00 0.00 173.24 173.73 3k2h s HIS 502 N -2.80 1.47 0.76 5.02 3.76 -0.11 -4.89 115.29 118.50 3k2h s HIS 502 Ca -0.03 0.86 -0.14 0.00 -0.15 0.00 0.00 55.06 55.60 3k2h s HIS 502 Cb 0.00 -3.27 0.06 0.00 1.11 0.00 0.00 32.58 30.48 3k2h s HIS 502 CO -0.05 -3.42 1.17 -2.14 -0.85 0.00 0.00 174.74 169.45 3k2h s PRO 503 N -5.00 1.99 0.68 8.40 0.02 -1.26 -2.42 135.00 137.41 3k2h s PRO 503 Ca 0.67 1.62 -0.17 0.00 0.02 0.00 0.00 61.00 63.14 3k2h s PRO 503 Cb -0.17 -1.83 0.00 0.00 0.02 0.00 0.00 34.50 32.52 3k2h s PRO 503 CO 0.58 -1.92 1.15 -0.35 -0.33 0.00 0.00 177.00 176.14 3k2h n PRO 504 N -3.08 0.80 -4.02 5.54 -0.04 -1.26 -3.05 135.00 129.89 3k2h n PRO 504 Ca 0.12 0.33 -0.31 0.00 -0.04 0.00 0.00 63.50 63.60 3k2h n PRO 504 Cb 0.51 -2.39 -0.15 0.00 -0.04 0.00 0.00 33.50 31.43 3k2h n PRO 504 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 3k2h s ILE 505 N -1.61 1.91 0.27 0.52 1.01 -1.26 -4.82 121.20 117.22 3k2h s ILE 505 Ca 0.78 -1.40 -0.30 0.00 0.00 0.00 0.00 60.65 59.73 3k2h s ILE 505 Cb -0.36 -2.04 -0.12 0.00 0.01 0.00 0.00 42.46 39.94 3k2h s ILE 505 CO 0.45 0.00 1.58 -2.65 0.00 0.00 0.00 174.94 174.32 3k2h n PRO 506 N 4.54 2.60 -3.73 2.79 -0.02 -1.26 -4.99 135.00 134.93 3k2h n PRO 506 Ca -0.14 0.93 -0.12 0.00 -2.02 0.00 0.00 63.50 62.15 3k2h n PRO 506 Cb 0.44 -2.70 -0.13 0.00 -0.02 0.00 0.00 33.50 31.09 3k2h n PRO 506 CO 0.00 0.00 0.00 -1.64 1.98 0.00 0.00 175.50 175.84 3k2h s MET 507 N -0.30 0.22 0.06 -0.52 -1.94 -1.26 -4.91 119.30 110.65 3k2h s MET 507 Ca 0.66 0.55 -0.18 0.00 -1.71 0.00 0.00 55.69 55.01 3k2h s MET 507 Cb -0.52 -0.11 -0.06 0.00 2.01 0.00 0.00 34.83 36.15 3k2h s MET 507 CO 0.47 -0.16 0.52 0.00 -0.01 0.00 0.00 175.02 175.84 3k2h s ALA 508 N 1.25 3.62 0.04 3.03 0.00 -1.26 -5.05 121.76 123.38 3k2h s ALA 508 Ca -0.09 -0.05 -0.23 0.00 0.00 0.00 0.00 51.96 51.59 3k2h s ALA 508 Cb -0.10 -2.56 -0.06 0.00 0.00 0.00 0.00 23.12 20.41 3k2h s ALA 508 CO -0.09 0.43 0.69 1.41 0.00 0.00 0.00 175.76 178.21 3k2h s MET 509 N -1.20 4.42 -0.28 0.00 1.75 -1.26 -4.97 119.30 117.76 3k2h s MET 509 Ca 0.29 0.93 -0.15 0.00 -1.25 0.00 0.00 55.69 55.51 3k2h s MET 509 Cb -0.18 -3.34 -0.04 0.00 2.84 0.00 0.00 34.83 34.11 3k2h s MET 509 CO 0.18 0.35 0.35 -1.12 -0.65 0.00 0.00 175.02 174.13 3k2h s SER 510 N -0.22 6.22 0.00 1.11 0.01 -1.26 -5.15 113.70 114.41 3k2h s SER 510 Ca 0.35 0.20 0.31 0.00 1.31 0.00 0.00 55.95 58.12 3k2h s SER 510 Cb -0.20 -2.20 1.70 0.00 0.21 0.00 0.00 66.02 65.54 3k2h s SER 510 CO 0.21 -0.19 2.11 0.00 0.41 0.00 0.00 173.24 175.78