#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1tll s VAL 2753N 0.00 4.73 -0.20 8.89 1.01 -1.26 -4.82 120.40 128.75 1tll s VAL 2753Ca 0.00 -0.32 -0.28 0.00 0.00 0.00 0.00 61.98 61.38 1tll s VAL 2753Cb 0.00 -3.12 -0.00 0.00 0.00 0.00 0.00 36.38 33.26 1tll s VAL 2753CO 0.00 0.42 0.97 -1.59 0.00 0.00 0.00 175.10 174.90 1tll s LYS 2754N -1.51 4.29 -0.28 2.72 -2.85 -1.26 0.20 119.74 121.04 1tll s LYS 2754Ca 0.20 1.26 -0.02 0.00 -1.00 0.00 0.00 55.97 56.41 1tll s LYS 2754Cb -0.12 -3.61 0.04 0.00 -2.06 0.00 0.00 37.83 32.08 1tll s LYS 2754CO 0.11 -0.50 -0.01 0.00 0.10 0.00 0.00 175.35 175.05 1tll s ALA 2755N 2.73 2.80 -0.31 0.59 0.00 0.22 -3.01 121.76 124.78 1tll s ALA 2755Ca 0.43 -1.63 -0.15 0.00 0.00 0.00 0.00 51.96 50.61 1tll s ALA 2755Cb -0.16 -1.88 -0.02 0.00 0.00 0.00 0.00 23.12 21.06 1tll s ALA 2755CO 0.10 -1.09 0.37 0.99 0.00 0.00 0.00 175.76 176.13 1tll s THR 2756N 1.30 5.16 -0.45 0.00 2.01 0.16 -0.73 115.64 123.10 1tll s THR 2756Ca -0.03 0.29 -0.15 0.00 0.31 0.00 0.00 61.69 62.11 1tll s THR 2756Cb -0.18 -3.77 0.06 0.00 0.01 0.00 0.00 72.50 68.61 1tll s THR 2756CO -0.02 0.01 0.35 -0.63 -0.69 0.00 0.00 174.62 173.65 1tll s ILE 2757N 2.06 5.18 -0.19 1.82 1.01 -0.30 0.52 121.20 131.30 1tll s ILE 2757Ca 0.13 -0.95 -0.12 0.00 0.00 0.00 0.00 60.65 59.72 1tll s ILE 2757Cb -0.16 -4.03 -0.05 0.00 0.01 0.00 0.00 42.46 38.24 1tll s ILE 2757CO 0.11 -0.48 0.22 -0.76 0.00 0.00 0.00 174.94 174.02 1tll s LEU 2758N 1.64 4.20 0.06 2.97 1.43 0.40 -2.80 118.68 126.59 1tll s LEU 2758Ca 0.04 0.34 0.06 0.00 -1.03 0.00 0.00 54.13 53.54 1tll s LEU 2758Cb -0.22 -2.23 -0.03 0.00 0.03 0.00 0.00 46.19 43.74 1tll s LEU 2758CO 0.07 0.11 -0.16 -0.72 0.23 0.00 0.00 176.35 175.89 1tll s TYR 2759N 0.58 1.37 0.00 0.29 -0.85 -0.89 -0.88 117.35 116.98 1tll s TYR 2759Ca 0.12 -0.41 0.08 0.00 -0.52 0.00 0.00 57.07 56.35 1tll s TYR 2759Cb -0.12 -0.79 -0.02 0.00 0.38 0.00 0.00 41.96 41.41 1tll s TYR 2759CO 0.02 0.08 -0.26 0.00 -1.52 0.00 0.00 175.55 173.87 1tll s ALA 2760N -1.06 2.19 -0.13 9.51 0.00 -0.53 -3.00 121.76 128.74 1tll s ALA 2760Ca 0.02 -1.17 -0.30 0.00 0.00 0.00 0.00 51.96 50.51 1tll s ALA 2760Cb -0.09 -0.52 0.09 0.00 0.00 0.00 0.00 23.12 22.60 1tll s ALA 2760CO 0.02 0.53 0.82 -0.08 0.00 0.00 0.00 175.76 177.05 1tll s THR 2761N -0.67 0.00 0.01 0.00 -1.32 -1.26 -3.20 115.64 109.19 1tll s THR 2761Ca 0.11 0.00 -0.02 0.00 -1.21 0.00 0.00 61.69 60.56 1tll s THR 2761Cb -0.10 -1.00 -0.01 0.00 -1.51 0.00 0.00 72.50 69.88 1tll s THR 2761CO -0.00 0.00 -0.04 1.21 -2.21 0.00 0.00 174.62 173.58 1tll n GLU 2762N 1.16 0.07 -0.05 7.08 4.07 -1.26 -4.70 120.64 127.00 1tll n GLU 2762Ca -0.15 0.03 0.03 0.00 -0.06 0.00 0.00 57.16 57.01 1tll n GLU 2762Cb 0.57 -0.41 0.11 0.00 -0.06 0.00 0.00 31.44 31.65 1tll n GLU 2762CO 0.00 0.00 0.00 0.25 -0.06 0.00 0.00 177.13 177.32 1tll n THR 2763N -3.03 0.14 -1.18 6.31 -2.24 -1.26 -4.93 114.28 108.09 1tll n THR 2763Ca -0.02 -0.15 -0.05 0.00 -2.27 0.00 0.00 64.05 61.56 1tll n THR 2763Cb 0.07 0.06 -0.02 0.00 -2.10 0.00 0.00 70.33 68.33 1tll n THR 2763CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1tll n GLY 2764N 0.71 0.76 0.13 3.38 0.00 -1.26 -4.96 105.19 103.95 1tll n GLY 2764Ca 0.05 -0.82 -0.22 0.00 0.00 0.00 0.00 46.02 45.03 1tll n GLY 2764CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1tll h LYS 2765N 0.00 0.34 0.00 1.61 1.57 -1.94 -3.22 116.57 114.93 1tll h LYS 2765Ca -0.11 -0.58 -0.03 0.00 -1.87 0.00 0.00 60.65 58.07 1tll h LYS 2765Cb 0.36 0.22 -0.00 0.00 0.08 0.00 0.00 32.23 32.89 1tll h LYS 2765CO 0.15 1.28 -0.13 0.77 -0.57 0.00 0.00 179.45 180.96 1tll h SER 2766N -0.12 0.00 -0.21 0.86 0.02 -1.92 -1.29 113.55 110.88 1tll h SER 2766Ca -0.29 0.00 -0.04 0.00 -0.84 0.00 0.00 61.79 60.62 1tll h SER 2766Cb 1.91 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 64.44 1tll h SER 2766CO 0.14 0.13 -0.03 -0.61 -1.14 0.00 0.00 176.83 175.32 1tll h GLN 2767N 0.00 0.39 -0.28 3.45 4.15 -1.83 -1.62 115.11 119.38 1tll h GLN 2767Ca -0.00 -0.14 -0.00 0.00 0.77 0.00 0.00 58.65 59.28 1tll h GLN 2767Cb 0.28 -0.03 -0.01 0.00 0.21 0.00 0.00 27.48 27.93 1tll h GLN 2767CO 0.02 0.61 0.17 0.00 -1.93 0.00 0.00 178.83 177.71 1tll h ALA 2768N 0.77 0.36 -0.94 3.38 0.00 -1.37 -1.97 119.26 119.48 1tll h ALA 2768Ca 0.06 -0.04 0.06 0.00 0.00 0.00 0.00 54.91 54.99 1tll h ALA 2768Cb 0.45 -0.11 -0.06 0.00 0.00 0.00 0.00 17.79 18.07 1tll h ALA 2768CO 0.02 -0.15 0.60 1.88 0.00 0.00 0.00 179.25 181.60 1tll h TYR 2769N 0.36 1.12 -0.25 0.00 0.05 -1.13 -2.12 116.97 115.00 1tll h TYR 2769Ca 0.10 0.03 -0.06 0.00 0.05 0.00 0.00 58.73 58.85 1tll h TYR 2769Cb -0.00 -0.37 -0.01 0.00 1.01 0.00 0.00 36.73 37.36 1tll h TYR 2769CO -0.05 0.59 -0.08 0.00 -1.05 0.00 0.00 178.16 177.57 1tll h ALA 2770N 1.42 0.35 -0.20 3.88 0.00 -0.99 0.50 119.26 124.22 1tll h ALA 2770Ca 0.40 -0.28 0.02 0.00 0.00 0.00 0.00 54.91 55.05 1tll h ALA 2770Cb 0.14 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 1tll h ALA 2770CO -0.16 0.17 0.14 0.87 0.00 0.00 0.00 179.25 180.26 1tll h LYS 2771N 0.23 0.17 0.06 0.00 1.79 -1.05 0.82 116.57 118.59 1tll h LYS 2771Ca 0.06 -0.01 -0.17 0.00 -2.18 0.00 0.00 60.65 58.35 1tll h LYS 2771Cb 0.56 -0.04 0.02 0.00 -1.58 0.00 0.00 32.23 31.19 1tll h LYS 2771CO 0.03 0.11 -0.69 1.15 -1.08 0.00 0.00 179.45 178.97 1tll h THR 2772N 0.17 1.47 -0.41 -0.16 2.02 -1.22 -2.46 112.91 112.32 1tll h THR 2772Ca 0.08 -2.28 0.06 0.00 0.77 0.00 0.00 66.41 65.04 1tll h THR 2772Cb 0.12 2.87 -0.02 0.00 -1.74 0.00 0.00 68.15 69.37 1tll h THR 2772CO -0.01 0.65 0.28 0.25 0.37 0.00 0.00 175.52 177.06 1tll h LEU 2773N -0.23 0.28 -0.38 2.58 5.85 0.53 0.25 115.31 124.18 1tll h LEU 2773Ca -0.10 -0.00 -0.18 0.00 0.84 0.00 0.00 57.88 58.43 1tll h LEU 2773Cb 1.45 -0.06 -0.00 0.00 0.37 0.00 0.00 40.66 42.42 1tll h LEU 2773CO 0.13 0.18 -0.63 0.00 -0.34 0.00 0.00 178.44 177.78 1tll h GLU 2775N 0.46 0.00 0.05 0.00 4.39 -0.49 -2.55 114.58 116.44 1tll h GLU 2775Ca -0.01 0.00 -0.27 0.00 0.34 0.00 0.00 59.36 59.42 1tll h GLU 2775Cb 1.21 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 29.84 1tll h GLU 2775CO 0.12 0.07 -1.45 0.97 -1.16 0.00 0.00 179.01 177.56 1tll h ILE 2776N 0.00 0.88 0.00 3.13 2.10 -1.16 -3.34 117.51 119.12 1tll h ILE 2776Ca -0.00 -2.26 0.00 0.00 1.08 0.00 0.00 64.86 63.68 1tll h ILE 2776Cb 0.50 2.41 0.00 0.00 -1.09 0.00 0.00 36.82 38.64 1tll h ILE 2776CO 0.01 0.55 0.00 0.49 -1.08 0.00 0.00 178.15 178.12 1tll n PHE 2777N -4.09 0.00 -0.21 2.19 3.01 -0.71 -2.14 117.46 115.51 1tll n PHE 2777Ca -0.30 0.00 -0.09 0.00 1.01 0.00 0.00 57.45 58.07 1tll n PHE 2777Cb 0.81 -0.27 0.02 0.00 -0.01 0.00 0.00 39.48 40.04 1tll n PHE 2777CO 0.00 0.00 0.00 0.87 1.01 0.00 0.00 176.76 178.64 1tll h LYS 2778N 0.00 1.03 -0.66 -1.08 1.79 -1.58 0.79 116.57 116.86 1tll h LYS 2778Ca 0.00 -0.31 0.12 0.00 -2.18 0.00 0.00 60.65 58.28 1tll h LYS 2778Cb 0.09 -0.10 -0.13 0.00 -1.58 0.00 0.00 32.23 30.51 1tll h LYS 2778CO 0.00 1.00 -0.28 0.45 -1.08 0.00 0.00 179.45 179.53 1tll h HIS 2779N 0.93 -0.74 -0.00 -1.35 3.86 -1.65 -3.19 115.15 113.01 1tll h HIS 2779Ca 0.17 0.07 0.00 0.00 -1.16 0.00 0.00 60.37 59.46 1tll h HIS 2779Cb 0.50 0.43 0.00 0.00 1.06 0.00 0.00 27.41 29.40 1tll h HIS 2779CO 0.04 -0.36 -0.17 0.00 0.86 0.00 0.00 177.93 178.30 1tll n ALA 2780N -3.19 2.65 -2.36 2.45 0.00 -1.23 -4.93 120.51 113.90 1tll n ALA 2780Ca 0.06 -0.30 -0.19 0.00 0.00 0.00 0.00 53.44 53.02 1tll n ALA 2780Cb 0.36 -0.21 -0.10 0.00 0.00 0.00 0.00 19.45 19.51 1tll n ALA 2780CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 1tll s PHE 2781N -1.17 1.65 -0.78 0.00 0.40 0.27 -4.49 117.98 113.87 1tll s PHE 2781Ca 0.04 -1.18 -0.15 0.00 -0.60 0.00 0.00 56.93 55.04 1tll s PHE 2781Cb 0.05 -0.99 0.18 0.00 0.51 0.00 0.00 43.02 42.77 1tll s PHE 2781CO 0.18 -0.30 0.78 0.34 0.70 0.00 0.00 175.22 176.92 1tll s ASP 2782N -3.38 6.61 -0.04 1.36 -1.08 0.13 -4.16 116.67 116.11 1tll s ASP 2782Ca 0.36 -2.36 -0.03 0.00 -0.52 0.00 0.00 52.55 50.00 1tll s ASP 2782Cb 0.07 -2.25 -0.04 0.00 -1.46 0.00 0.00 42.92 39.24 1tll s ASP 2782CO 0.15 -0.74 0.13 0.00 0.52 0.00 0.00 175.17 175.23 1tll s ALA 2783N 0.98 3.77 0.21 3.66 0.00 -1.26 0.72 121.76 129.83 1tll s ALA 2783Ca 0.18 -0.78 0.02 0.00 0.00 0.00 0.00 51.96 51.38 1tll s ALA 2783Cb -0.13 -1.77 -0.05 0.00 0.00 0.00 0.00 23.12 21.17 1tll s ALA 2783CO -0.06 0.69 0.02 0.15 0.00 0.00 0.00 175.76 176.55 1tll s LYS 2784N -1.60 1.26 -0.11 0.00 -0.14 0.09 -4.94 119.74 114.31 1tll s LYS 2784Ca 0.22 -1.63 -0.08 0.00 -1.36 0.00 0.00 55.97 53.11 1tll s LYS 2784Cb -0.12 -0.41 0.03 0.00 -1.68 0.00 0.00 37.83 35.65 1tll s LYS 2784CO 0.13 -0.14 0.28 0.00 -0.76 0.00 0.00 175.35 174.85 1tll s ALA 2785N -3.57 -0.67 0.09 5.17 0.00 -1.26 -1.14 121.76 120.37 1tll s ALA 2785Ca 0.28 0.88 -0.27 0.00 0.00 0.00 0.00 51.96 52.86 1tll s ALA 2785Cb 0.06 -0.53 0.09 0.00 0.00 0.00 0.00 23.12 22.74 1tll s ALA 2785CO 0.08 -0.16 1.11 0.00 0.00 0.00 0.00 175.76 176.79 1tll s MET 2786N 0.52 0.88 0.62 0.00 0.23 -1.12 -5.01 119.30 115.42 1tll s MET 2786Ca -0.03 -0.51 -0.12 0.00 -1.03 0.00 0.00 55.69 54.00 1tll s MET 2786Cb -0.05 0.29 -0.04 0.00 -1.53 0.00 0.00 34.83 33.50 1tll s MET 2786CO -0.03 -0.41 1.03 -1.12 -2.03 0.00 0.00 175.02 172.46 1tll s SER 2787N -3.10 6.14 0.00 -1.18 0.01 -1.26 -2.09 113.70 112.22 1tll s SER 2787Ca 0.16 1.47 0.15 0.00 1.31 0.00 0.00 55.95 59.04 1tll s SER 2787Cb 0.01 -2.48 0.90 0.00 0.21 0.00 0.00 66.02 64.66 1tll s SER 2787CO 0.01 -0.93 1.33 0.23 0.41 0.00 0.00 173.24 174.28 1tll n MET 2788N -2.65 0.55 -0.10 12.44 0.00 -1.16 -2.34 117.12 123.85 1tll n MET 2788Ca 0.06 0.00 -0.17 0.00 0.00 0.00 0.00 57.70 57.59 1tll n MET 2788Cb 0.54 -1.43 -0.09 0.00 0.00 0.00 0.00 33.22 32.24 1tll n MET 2788CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 175.97 175.12 1tll n GLU 2789N -0.93 0.49 -0.17 0.03 0.28 -1.25 -4.42 120.64 114.67 1tll n GLU 2789Ca 0.11 0.15 0.00 0.00 -0.16 0.00 0.00 57.16 57.26 1tll n GLU 2789Cb 0.05 -1.36 0.00 0.00 1.43 0.00 0.00 31.44 31.56 1tll n GLU 2789CO 0.00 0.00 0.00 -1.91 -0.16 0.00 0.00 177.13 175.06 1tll n GLU 2790N -3.38 0.80 -3.78 3.44 2.13 -0.99 -4.75 120.64 114.11 1tll n GLU 2790Ca -0.38 0.00 -0.13 0.00 0.66 0.00 0.00 57.16 57.31 1tll n GLU 2790Cb 0.86 -1.10 -0.10 0.00 0.27 0.00 0.00 31.44 31.36 1tll n GLU 2790CO 0.00 0.00 0.00 -0.47 -0.41 0.00 0.00 177.13 176.25 1tll s TYR 2791N 0.29 -0.24 -0.32 4.31 5.04 -1.24 -4.78 117.35 120.41 1tll s TYR 2791Ca 0.00 0.53 -0.29 0.00 -2.44 0.00 0.00 57.07 54.87 1tll s TYR 2791Cb 0.00 0.09 0.01 0.00 0.35 0.00 0.00 41.96 42.41 1tll s TYR 2791CO 0.00 -0.23 1.13 -0.51 -1.34 0.00 0.00 175.55 174.60 1tll s ASP 2792N -0.41 6.87 0.00 4.32 1.11 -1.26 -4.88 116.67 122.42 1tll s ASP 2792Ca -0.05 1.07 0.11 0.00 0.18 0.00 0.00 52.55 53.86 1tll s ASP 2792Cb -0.03 -2.54 0.53 0.00 1.07 0.00 0.00 42.92 41.94 1tll s ASP 2792CO 0.02 -0.94 1.28 0.00 1.18 0.00 0.00 175.17 176.71 1tll n ILE 2793N 5.97 0.89 0.08 0.77 0.13 -1.26 -1.88 119.36 124.06 1tll n ILE 2793Ca 0.13 0.22 -0.05 0.00 -1.10 0.00 0.00 62.75 61.94 1tll n ILE 2793Cb 0.47 -1.04 -0.04 0.00 -0.84 0.00 0.00 39.64 38.19 1tll n ILE 2793CO 0.00 0.00 0.00 1.62 2.80 0.00 0.00 176.55 180.97 1tll h VAL 2794N 0.00 1.62 0.00 9.51 3.04 -2.04 -3.23 116.25 125.16 1tll h VAL 2794Ca 0.00 -3.07 -0.00 0.00 -1.01 0.00 0.00 66.70 62.62 1tll h VAL 2794Cb 0.13 2.66 -0.00 0.00 -2.01 0.00 0.00 31.29 32.07 1tll h VAL 2794CO 0.00 0.87 -0.02 0.45 -1.01 0.00 0.00 177.57 177.86 1tll h HIS 2795N 0.00 0.00 -0.71 3.17 3.86 -1.79 -3.37 115.15 116.31 1tll h HIS 2795Ca -0.01 0.00 0.06 0.00 -1.16 0.00 0.00 60.37 59.27 1tll h HIS 2795Cb 1.59 0.00 -0.09 0.00 1.06 0.00 0.00 27.41 29.97 1tll h HIS 2795CO 0.00 0.02 -0.42 -0.11 0.86 0.00 0.00 177.93 178.28 1tll n LEU 2796N -3.11 -0.76 0.25 2.43 7.94 -1.22 -0.06 117.00 122.48 1tll n LEU 2796Ca 0.02 1.51 0.14 0.00 -1.11 0.00 0.00 56.01 56.58 1tll n LEU 2796Cb 0.44 -0.28 0.74 0.00 0.53 0.00 0.00 43.42 44.85 1tll n LEU 2796CO 0.31 -1.16 0.99 -0.08 -1.11 0.00 0.00 177.39 176.35 1tll h GLU 2797N 0.00 0.00 -0.58 1.96 4.57 -1.82 0.13 114.58 118.84 1tll h GLU 2797Ca 0.11 0.00 -0.05 0.00 -1.18 0.00 0.00 59.36 58.24 1tll h GLU 2797Cb 0.29 0.00 -0.03 0.00 -0.16 0.00 0.00 28.75 28.85 1tll h GLU 2797CO -0.67 0.00 0.06 0.72 -1.18 0.00 0.00 179.01 177.94 1tll n HIS 2798N -2.58 2.06 -4.00 0.92 -0.00 0.92 -4.75 115.22 107.80 1tll n HIS 2798Ca -0.02 -0.87 -0.36 0.00 -0.00 0.00 0.00 57.72 56.47 1tll n HIS 2798Cb 0.22 -0.54 -0.07 0.00 -0.00 0.00 0.00 29.99 29.60 1tll n HIS 2798CO 0.00 0.00 0.00 -1.21 -0.00 0.00 0.00 176.34 175.13 1tll s GLU 2799N -2.84 3.32 -0.12 -0.41 0.41 0.47 -5.01 118.70 114.51 1tll s GLU 2799Ca 0.54 -0.23 -0.14 0.00 -0.41 0.00 0.00 54.97 54.73 1tll s GLU 2799Cb 0.42 -3.08 -0.26 0.00 -1.78 0.00 0.00 34.13 29.43 1tll s GLU 2799CO 0.15 0.75 0.45 0.00 -0.49 0.00 0.00 175.26 176.11 1tll h ALA 2800N 4.85 0.27 -3.32 5.21 0.00 -1.87 -3.28 119.26 121.11 1tll h ALA 2800Ca -0.53 -1.20 -0.38 0.00 0.00 0.00 0.00 54.91 52.79 1tll h ALA 2800Cb 1.21 0.59 -0.38 0.00 0.00 0.00 0.00 17.79 19.21 1tll h ALA 2800CO 0.59 0.96 -0.75 -1.17 0.00 0.00 0.00 179.25 178.88 1tll s LEU 2801N -7.43 0.38 -0.16 0.00 2.96 -1.16 -1.32 118.68 111.95 1tll s LEU 2801Ca -0.22 0.02 0.01 0.00 -0.22 0.00 0.00 54.13 53.73 1tll s LEU 2801Cb 0.05 -0.23 0.02 0.00 0.50 0.00 0.00 46.19 46.53 1tll s LEU 2801CO 0.75 -0.22 -0.18 -0.69 -1.32 0.00 0.00 176.35 174.68 1tll s VAL 2802N 1.98 1.87 -0.15 1.68 1.01 -0.21 0.38 120.40 126.97 1tll s VAL 2802Ca 0.03 -0.83 -0.03 0.00 0.00 0.00 0.00 61.98 61.15 1tll s VAL 2802Cb -0.12 -1.70 -0.03 0.00 0.00 0.00 0.00 36.38 34.54 1tll s VAL 2802CO -0.04 0.51 -0.05 -0.76 0.00 0.00 0.00 175.10 174.76 1tll s LEU 2803N 1.21 3.16 -0.20 3.92 1.43 0.19 -3.20 118.68 125.19 1tll s LEU 2803Ca 0.01 -0.16 -0.02 0.00 -1.03 0.00 0.00 54.13 52.93 1tll s LEU 2803Cb -0.14 -1.75 0.00 0.00 0.03 0.00 0.00 46.19 44.33 1tll s LEU 2803CO -0.09 0.17 -0.11 -0.69 0.23 0.00 0.00 176.35 175.87 1tll s VAL 2804N 0.34 2.88 -0.27 -1.59 1.01 -0.87 0.15 120.40 122.04 1tll s VAL 2804Ca -0.05 -0.67 0.01 0.00 0.00 0.00 0.00 61.98 61.27 1tll s VAL 2804Cb -0.14 -2.27 0.06 0.00 0.00 0.00 0.00 36.38 34.02 1tll s VAL 2804CO 0.03 0.47 -0.07 -0.69 0.00 0.00 0.00 175.10 174.84 1tll s VAL 2805N 1.31 2.44 -0.08 2.92 1.01 -0.06 -0.50 120.40 127.44 1tll s VAL 2805Ca 0.04 -1.56 -0.11 0.00 0.00 0.00 0.00 61.98 60.35 1tll s VAL 2805Cb -0.14 -2.43 0.03 0.00 0.00 0.00 0.00 36.38 33.84 1tll s VAL 2805CO -0.06 -0.06 0.29 0.28 0.00 0.00 0.00 175.10 175.55 1tll s THR 2806N 1.15 0.02 0.59 3.92 -1.32 -0.69 -1.46 115.64 117.85 1tll s THR 2806Ca -0.08 -0.15 0.01 0.00 -1.21 0.00 0.00 61.69 60.26 1tll s THR 2806Cb -0.20 -0.46 0.06 0.00 -1.51 0.00 0.00 72.50 70.39 1tll s THR 2806CO -0.04 -0.08 0.83 -0.94 -2.21 0.00 0.00 174.62 172.18 1tll s SER 2807N -0.27 5.06 -0.05 8.08 1.04 -1.19 -0.69 113.70 125.68 1tll s SER 2807Ca -0.04 -0.11 0.05 0.00 0.48 0.00 0.00 55.95 56.33 1tll s SER 2807Cb -0.03 -0.65 -0.01 0.00 0.10 0.00 0.00 66.02 65.43 1tll s SER 2807CO 0.01 -1.31 -0.20 -0.89 0.98 0.00 0.00 173.24 171.83 1tll s THR 2808N -2.85 1.64 0.23 2.02 2.01 -1.17 -4.27 115.64 113.25 1tll s THR 2808Ca 0.59 -0.83 0.00 0.00 0.31 0.00 0.00 61.69 61.76 1tll s THR 2808Cb -0.09 -1.40 -0.00 0.00 0.01 0.00 0.00 72.50 71.01 1tll s THR 2808CO 0.40 0.47 0.01 0.49 -0.69 0.00 0.00 174.62 175.29 1tll n PHE 2809N 3.11 0.49 0.00 4.92 3.01 0.31 -4.90 117.46 124.39 1tll n PHE 2809Ca -0.18 -1.16 0.00 0.00 1.01 0.00 0.00 57.45 57.12 1tll n PHE 2809Cb 0.53 -0.14 0.00 0.00 -0.01 0.00 0.00 39.48 39.86 1tll n PHE 2809CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1tll n GLY 2810N 2.05 3.92 2.73 1.37 0.00 -1.26 -0.42 105.19 113.57 1tll n GLY 2810Ca -0.09 0.04 -0.24 0.00 0.00 0.00 0.00 46.02 45.73 1tll n GLY 2810CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1tll n ASN 2811N 6.66 3.46 0.00 1.61 5.15 -1.26 -4.71 115.26 126.17 1tll n ASN 2811Ca 0.00 -3.50 0.00 0.00 -0.60 0.00 0.00 54.58 50.48 1tll n ASN 2811Cb 0.00 -0.58 0.00 0.00 -0.53 0.00 0.00 39.78 38.67 1tll n ASN 2811CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1tll n GLY 2812N -0.10 0.53 3.82 8.20 0.00 -1.02 -4.83 105.19 111.79 1tll n GLY 2812Ca 0.29 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.99 1tll n GLY 2812CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1tll s ASP 2813N -2.85 5.79 0.43 1.61 1.11 0.44 -4.11 116.67 119.10 1tll s ASP 2813Ca 0.00 1.69 -0.23 0.00 0.18 0.00 0.00 52.55 54.19 1tll s ASP 2813Cb 0.00 -2.51 -0.08 0.00 1.07 0.00 0.00 42.92 41.39 1tll s ASP 2813CO 0.00 -1.16 1.08 -2.84 1.18 0.00 0.00 175.17 173.43 1tll s PRO 2814N -4.45 3.97 1.14 8.23 0.02 -1.26 -0.53 135.00 142.11 1tll s PRO 2814Ca 0.61 1.57 -0.14 0.00 0.02 0.00 0.00 61.00 63.06 1tll s PRO 2814Cb -0.14 -2.42 0.23 0.00 0.02 0.00 0.00 34.50 32.19 1tll s PRO 2814CO 0.43 -0.32 0.77 -0.35 -0.33 0.00 0.00 177.00 177.20 1tll n PRO 2815N -0.36 -2.06 0.32 5.54 -0.04 -1.26 -4.56 135.00 132.58 1tll n PRO 2815Ca 0.06 -0.57 -0.17 0.00 -0.04 0.00 0.00 63.50 62.78 1tll n PRO 2815Cb 0.50 -2.07 -0.09 0.00 -0.04 0.00 0.00 33.50 31.80 1tll n PRO 2815CO 0.00 0.00 0.00 1.49 -0.04 0.00 0.00 175.50 176.95 1tll h GLU 2816N -2.46 -0.88 0.00 0.54 4.81 -1.94 -1.20 114.58 113.45 1tll h GLU 2816Ca -0.58 0.06 0.00 0.00 -0.13 0.00 0.00 59.36 58.71 1tll h GLU 2816Cb 1.33 0.20 0.00 0.00 0.63 0.00 0.00 28.75 30.91 1tll h GLU 2816CO 0.45 -0.59 0.00 0.27 -0.73 0.00 0.00 179.01 178.42 1tll n ASN 2817N -5.51 0.00 -0.38 1.04 0.23 -1.26 -0.72 115.26 108.66 1tll n ASN 2817Ca -0.12 -0.22 0.09 0.00 -0.53 0.00 0.00 54.58 53.80 1tll n ASN 2817Cb 0.40 0.00 0.18 0.00 -2.08 0.00 0.00 39.78 38.28 1tll n ASN 2817CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1tll n GLY 2818N -0.55 4.62 0.10 4.83 0.00 -0.46 -3.90 105.19 109.82 1tll n GLY 2818Ca 0.02 -1.11 -0.18 0.00 0.00 0.00 0.00 46.02 44.75 1tll n GLY 2818CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1tll h GLU 2819N 0.65 0.11 0.11 1.61 4.57 -0.84 -3.08 114.58 117.71 1tll h GLU 2819Ca 0.00 -0.18 0.01 0.00 -1.18 0.00 0.00 59.36 58.01 1tll h GLU 2819Cb 1.16 0.07 -0.04 0.00 -0.16 0.00 0.00 28.75 29.78 1tll h GLU 2819CO 0.08 1.09 -0.44 0.87 -1.18 0.00 0.00 179.01 179.43 1tll h LYS 2820N -0.74 -0.60 -0.68 1.92 1.57 -1.83 -2.67 116.57 113.53 1tll h LYS 2820Ca -0.16 0.04 0.14 0.00 -1.87 0.00 0.00 60.65 58.80 1tll h LYS 2820Cb 1.34 0.14 -0.11 0.00 0.08 0.00 0.00 32.23 33.68 1tll h LYS 2820CO -0.00 -0.40 0.09 0.35 -0.57 0.00 0.00 179.45 178.92 1tll h PHE 2821N -0.63 0.12 0.17 -1.35 3.04 -1.77 -2.33 116.94 114.19 1tll h PHE 2821Ca -0.01 0.04 0.01 0.00 3.98 0.00 0.00 57.97 62.00 1tll h PHE 2821Cb 0.63 0.05 -0.04 0.00 2.56 0.00 0.00 35.95 39.15 1tll h PHE 2821CO -0.42 -0.12 -0.52 0.78 -2.02 0.00 0.00 178.31 176.01 1tll h GLY 2822N 0.20 -1.18 1.96 2.40 0.00 -1.38 -2.34 103.07 102.73 1tll h GLY 2822Ca 0.37 0.64 -0.06 0.00 0.00 0.00 0.00 47.33 48.28 1tll h GLY 2822CO -0.52 -0.28 -0.26 0.00 0.00 0.00 0.00 176.54 175.48 1tll h ALA 2824N 1.70 0.35 -0.00 0.00 0.00 -1.02 0.12 119.26 120.40 1tll h ALA 2824Ca 0.01 0.03 -0.10 0.00 0.00 0.00 0.00 54.91 54.84 1tll h ALA 2824Cb 0.49 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.26 1tll h ALA 2824CO 0.04 -0.28 -0.49 -0.07 0.00 0.00 0.00 179.25 178.45 1tll h LEU 2825N 0.25 0.00 0.35 0.00 3.38 -1.20 -0.86 115.31 117.23 1tll h LEU 2825Ca 0.13 -0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.08 1tll h LEU 2825Cb 0.09 -0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.84 1tll h LEU 2825CO -0.12 0.49 -0.17 0.24 0.09 0.00 0.00 178.44 178.97 1tll h MET 2826N 0.00 -0.45 0.16 1.13 2.86 -0.60 -0.36 114.93 117.68 1tll h MET 2826Ca -0.00 0.03 -0.01 0.00 -2.06 0.00 0.00 59.70 57.66 1tll h MET 2826Cb 0.86 0.10 0.00 0.00 0.06 0.00 0.00 31.60 32.63 1tll h MET 2826CO 0.06 -0.18 -0.08 1.49 1.06 0.00 0.00 176.91 179.26 1tll h GLU 2827N -0.67 -0.21 -0.99 1.72 4.57 -0.84 -3.15 114.58 115.01 1tll h GLU 2827Ca -0.05 0.01 0.30 0.00 -1.18 0.00 0.00 59.36 58.44 1tll h GLU 2827Cb 0.48 0.05 -0.14 0.00 -0.16 0.00 0.00 28.75 28.97 1tll h GLU 2827CO 0.08 0.22 0.56 1.98 -1.18 0.00 0.00 179.01 180.66 1tll h MET 2828N -0.78 0.37 0.00 1.92 4.05 -1.25 -3.51 114.93 115.73 1tll h MET 2828Ca -0.02 -0.02 0.00 0.00 -0.28 0.00 0.00 59.70 59.38 1tll h MET 2828Cb 0.52 -0.08 0.00 0.00 -0.80 0.00 0.00 31.60 31.24 1tll h MET 2828CO 0.04 0.25 0.00 0.54 0.23 0.00 0.00 176.91 177.96 1tll n ARG 2829N -5.02 0.00 -3.03 0.39 3.00 -0.14 -5.04 116.66 106.82 1tll n ARG 2829Ca 0.30 0.00 -0.19 0.00 -0.01 0.00 0.00 57.85 57.95 1tll n ARG 2829Cb 0.91 -0.06 0.06 0.00 0.00 0.00 0.00 32.46 33.36 1tll n ARG 2829CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.63 176.51 1tll s SER 2840N -1.00 5.16 0.01 0.55 0.01 -1.26 -5.02 113.70 112.15 1tll s SER 2840Ca 0.00 -0.79 -0.02 0.00 1.31 0.00 0.00 55.95 56.45 1tll s SER 2840Cb 0.00 0.17 -0.00 0.00 0.21 0.00 0.00 66.02 66.40 1tll s SER 2840CO 0.00 -1.28 1.03 0.22 0.41 0.00 0.00 173.24 173.63 1tll h TYR 2841N 0.23 -0.11 -0.93 2.43 3.20 -2.00 0.38 116.97 120.17 1tll h TYR 2841Ca -0.31 0.01 0.20 0.00 3.14 0.00 0.00 58.73 61.77 1tll h TYR 2841Cb 1.29 0.06 -0.18 0.00 1.54 0.00 0.00 36.73 39.44 1tll h TYR 2841CO 0.42 -0.02 -0.16 0.87 -1.64 0.00 0.00 178.16 177.63 1tll h LYS 2842N -0.00 0.01 0.00 1.82 1.79 -1.93 0.14 116.57 118.39 1tll h LYS 2842Ca 0.01 -0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.48 1tll h LYS 2842Cb 0.03 -0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.67 1tll h LYS 2842CO -0.05 0.01 0.00 0.28 -1.08 0.00 0.00 179.45 178.60 1tll n VAL 2843N -5.55 0.00 -0.13 0.50 0.31 -0.03 -1.71 118.33 111.72 1tll n VAL 2843Ca 0.16 1.16 -0.04 0.00 -0.01 0.00 0.00 64.34 65.61 1tll n VAL 2843Cb 0.53 -1.92 0.04 0.00 -0.91 0.00 0.00 33.84 31.58 1tll n VAL 2843CO 0.00 0.00 0.00 0.03 -1.32 0.00 0.00 176.83 175.54 1tll h ARG 2844N 0.00 0.20 -0.34 5.55 3.08 -0.19 -3.26 114.38 119.42 1tll h ARG 2844Ca 0.00 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.04 1tll h ARG 2844Cb 0.00 -0.05 0.00 0.00 0.08 0.00 0.00 29.97 30.00 1tll h ARG 2844CO 0.00 0.13 0.00 1.19 -1.07 0.00 0.00 179.97 180.22 1tll n PHE 2845N -5.11 0.82 -1.76 3.04 3.01 0.39 -5.09 117.46 112.76 1tll n PHE 2845Ca 0.04 -0.69 0.00 0.00 1.01 0.00 0.00 57.45 57.81 1tll n PHE 2845Cb 0.20 -0.19 0.01 0.00 -0.01 0.00 0.00 39.48 39.48 1tll n PHE 2845CO 0.00 0.00 0.00 0.09 1.01 0.00 0.00 176.76 177.86 1tll n ASN 2846N 0.09 0.13 -0.92 4.37 3.02 -0.69 -4.68 115.26 116.57 1tll n ASN 2846Ca 0.18 -1.88 0.00 0.00 -0.03 0.00 0.00 54.58 52.86 1tll n ASN 2846Cb 0.71 -0.17 -0.00 0.00 -0.61 0.00 0.00 39.78 39.70 1tll n ASN 2846CO 0.00 0.00 0.00 0.52 -2.62 0.00 0.00 177.26 175.16 1tll n VAL 2877N -0.07 -1.67 -4.31 2.41 0.31 -1.21 -4.81 118.33 108.98 1tll n VAL 2877Ca 0.01 0.85 -0.25 0.00 -0.01 0.00 0.00 64.34 64.94 1tll n VAL 2877Cb 0.66 -1.41 -0.08 0.00 -0.91 0.00 0.00 33.84 32.10 1tll n VAL 2877CO 0.00 0.00 0.00 -0.13 -1.32 0.00 0.00 176.83 175.38 1tll s ARG 2878N -4.80 2.11 -0.14 5.55 1.81 -0.43 -1.55 118.95 121.50 1tll s ARG 2878Ca 0.00 -1.75 -0.34 0.00 -1.72 0.00 0.00 55.73 51.92 1tll s ARG 2878Cb 0.00 -1.95 0.14 0.00 -0.45 0.00 0.00 34.95 32.70 1tll s ARG 2878CO 0.00 0.11 1.34 -0.59 -0.68 0.00 0.00 175.30 175.48 1tll s PHE 2879N -2.52 -0.04 -0.23 -0.53 -0.12 -1.05 -1.05 117.98 112.44 1tll s PHE 2879Ca 0.35 0.00 -0.26 0.00 -0.05 0.00 0.00 56.93 56.97 1tll s PHE 2879Cb 0.00 0.52 0.08 0.00 -0.63 0.00 0.00 43.02 42.99 1tll s PHE 2879CO 0.20 -0.12 0.75 0.45 -0.05 0.00 0.00 175.22 176.45 1tll s SER 2880N -2.58 -0.69 0.01 1.98 0.15 -1.19 -1.00 113.70 110.37 1tll s SER 2880Ca 0.13 1.22 0.06 0.00 0.70 0.00 0.00 55.95 58.06 1tll s SER 2880Cb 0.03 1.20 -0.03 0.00 -1.71 0.00 0.00 66.02 65.51 1tll s SER 2880CO -0.04 -0.31 -0.16 -0.69 1.20 0.00 0.00 173.24 173.24 1tll s VAL 2881N 0.04 2.97 -0.20 4.45 1.01 -1.26 -2.05 120.40 125.35 1tll s VAL 2881Ca -0.02 -1.00 -0.01 0.00 0.00 0.00 0.00 61.98 60.96 1tll s VAL 2881Cb -0.04 -2.23 0.05 0.00 0.00 0.00 0.00 36.38 34.17 1tll s VAL 2881CO 0.02 0.42 -0.03 0.12 0.00 0.00 0.00 175.10 175.63 1tll s PHE 2882N -0.87 1.75 -0.23 5.22 5.36 0.35 -2.23 117.98 127.32 1tll s PHE 2882Ca 0.14 -1.24 -0.06 0.00 -0.96 0.00 0.00 56.93 54.80 1tll s PHE 2882Cb -0.11 -1.32 -0.03 0.00 -0.34 0.00 0.00 43.02 41.22 1tll s PHE 2882CO 0.04 -0.67 0.04 0.20 -1.46 0.00 0.00 175.22 173.38 1tll s GLY 2883N 1.61 1.76 0.42 13.12 0.00 -0.90 -1.70 107.32 121.63 1tll s GLY 2883Ca -0.02 -1.05 -0.20 0.00 0.00 0.00 0.00 44.72 43.45 1tll s GLY 2883CO -0.07 0.39 0.92 1.08 0.00 0.00 0.00 173.10 175.42 1tll s LEU 2884N 1.30 3.95 0.00 0.66 1.02 0.13 -1.81 118.68 123.93 1tll s LEU 2884Ca 0.04 1.63 0.00 0.00 0.02 0.00 0.00 54.13 55.83 1tll s LEU 2884Cb -0.15 -4.48 0.00 0.00 0.02 0.00 0.00 46.19 41.58 1tll s LEU 2884CO 0.02 -0.35 0.00 0.61 0.02 0.00 0.00 176.35 176.66 1tll n GLY 2885N -0.63 1.60 3.47 -3.19 0.00 -0.43 -3.05 105.19 102.96 1tll n GLY 2885Ca 0.07 -0.46 -0.09 0.00 0.00 0.00 0.00 46.02 45.54 1tll n GLY 2885CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1tll s SER 2886N 2.00 -0.75 0.00 1.61 0.15 -1.26 -0.43 113.70 115.02 1tll s SER 2886Ca 0.00 1.23 0.04 0.00 0.70 0.00 0.00 55.95 57.92 1tll s SER 2886Cb 0.00 1.12 0.22 0.00 -1.71 0.00 0.00 66.02 65.64 1tll s SER 2886CO 0.00 -0.22 0.80 0.54 1.20 0.00 0.00 173.24 175.57 1tll n ARG 2887N 4.21 0.63 0.02 5.44 1.74 -1.26 -2.11 116.66 125.33 1tll n ARG 2887Ca -0.21 0.00 0.12 0.00 -0.77 0.00 0.00 57.85 56.99 1tll n ARG 2887Cb 0.57 -1.09 0.25 0.00 -1.02 0.00 0.00 32.46 31.17 1tll n ARG 2887CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1tll n ALA 2888N -0.59 3.27 -2.78 7.54 0.00 -1.26 -4.82 120.51 121.87 1tll n ALA 2888Ca 0.03 -0.30 -0.34 0.00 0.00 0.00 0.00 53.44 52.82 1tll n ALA 2888Cb 0.01 -1.16 -0.11 0.00 0.00 0.00 0.00 19.45 18.19 1tll n ALA 2888CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 1tll s TYR 2889N -3.05 3.03 0.15 0.00 2.02 -0.90 -4.72 117.35 113.89 1tll s TYR 2889Ca 0.10 -0.09 -0.30 0.00 -0.37 0.00 0.00 57.07 56.40 1tll s TYR 2889Cb 0.16 -1.85 -0.07 0.00 -0.40 0.00 0.00 41.96 39.80 1tll s TYR 2889CO 0.70 0.19 1.53 -1.35 -1.57 0.00 0.00 175.55 175.04 1tll h PRO 2890N 5.92 -0.06 -3.01 -1.71 0.11 -1.87 -3.04 132.00 128.33 1tll h PRO 2890Ca -0.41 0.00 -0.76 0.00 0.11 0.00 0.00 66.00 64.95 1tll h PRO 2890Cb 1.19 0.01 -0.16 0.00 0.11 0.00 0.00 31.00 32.15 1tll h PRO 2890CO 0.58 -0.04 2.03 0.72 -0.21 0.00 0.00 178.00 181.08 1tll n HIS 2891N -5.21 2.71 -1.64 0.65 8.25 -1.26 -5.00 115.22 113.72 1tll n HIS 2891Ca 0.01 -2.77 -0.52 0.00 -0.26 0.00 0.00 57.72 54.19 1tll n HIS 2891Cb 0.27 -1.80 -0.06 0.00 1.12 0.00 0.00 29.99 29.52 1tll n HIS 2891CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 1tll n PHE 2892N 2.53 1.88 -2.33 4.41 7.35 -1.15 -1.43 117.46 128.73 1tll n PHE 2892Ca 0.48 0.46 -0.09 0.00 -0.76 0.00 0.00 57.45 57.55 1tll n PHE 2892Cb 0.31 -2.44 -0.01 0.00 0.35 0.00 0.00 39.48 37.69 1tll n PHE 2892CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 1tll h ALA 2894N 1.02 1.17 -0.19 0.00 0.00 -1.52 -0.76 119.26 118.98 1tll h ALA 2894Ca -0.21 0.28 -0.06 0.00 0.00 0.00 0.00 54.91 54.92 1tll h ALA 2894Cb 1.09 0.45 -0.00 0.00 0.00 0.00 0.00 17.79 19.33 1tll h ALA 2894CO 0.25 -0.52 -0.11 0.35 0.00 0.00 0.00 179.25 179.22 1tll h PHE 2895N 0.10 0.47 -0.71 0.00 3.57 -1.85 -1.48 116.94 117.03 1tll h PHE 2895Ca 0.55 -0.12 0.01 0.00 3.53 0.00 0.00 57.97 61.95 1tll h PHE 2895Cb 1.12 -0.11 -0.04 0.00 2.79 0.00 0.00 35.95 39.72 1tll h PHE 2895CO -0.38 0.72 0.46 0.78 -2.23 0.00 0.00 178.31 177.66 1tll h GLY 2896N 0.09 1.01 2.00 2.40 0.00 -1.52 0.75 103.07 107.79 1tll h GLY 2896Ca 0.04 -0.36 -0.04 0.00 0.00 0.00 0.00 47.33 46.97 1tll h GLY 2896CO 0.03 0.34 -0.18 0.45 0.00 0.00 0.00 176.54 177.19 1tll h HIS 2897N 0.94 0.00 0.05 5.60 3.86 -1.15 -0.46 115.15 123.99 1tll h HIS 2897Ca 0.27 0.00 -0.07 0.00 -1.16 0.00 0.00 60.37 59.41 1tll h HIS 2897Cb -0.07 0.00 0.01 0.00 1.06 0.00 0.00 27.41 28.40 1tll h HIS 2897CO -0.03 0.18 -0.33 0.00 0.86 0.00 0.00 177.93 178.61 1tll h ALA 2898N 1.82 -0.01 -0.70 2.45 0.00 -0.29 -2.84 119.26 119.68 1tll h ALA 2898Ca -0.00 -0.60 0.00 0.00 0.00 0.00 0.00 54.91 54.31 1tll h ALA 2898Cb 0.46 0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.29 1tll h ALA 2898CO 0.02 0.16 0.45 0.28 0.00 0.00 0.00 179.25 180.17 1tll h VAL 2899N -0.79 1.19 -0.34 0.00 2.07 -0.74 -0.78 116.25 116.86 1tll h VAL 2899Ca -0.06 -0.36 -0.02 0.00 0.82 0.00 0.00 66.70 67.08 1tll h VAL 2899Cb 1.23 0.16 -0.01 0.00 -1.52 0.00 0.00 31.29 31.15 1tll h VAL 2899CO 0.04 0.18 0.13 -0.78 0.02 0.00 0.00 177.57 177.17 1tll h ASP 2900N 0.96 0.47 -0.43 0.57 3.58 -1.17 -1.20 116.42 119.20 1tll h ASP 2900Ca 0.26 -0.17 -0.04 0.00 0.42 0.00 0.00 57.03 57.50 1tll h ASP 2900Cb -0.09 -0.12 -0.02 0.00 1.72 0.00 0.00 39.33 40.82 1tll h ASP 2900CO -0.05 0.51 0.11 0.74 -2.88 0.00 0.00 179.24 177.66 1tll h THR 2901N 0.40 1.23 0.00 2.25 2.02 -1.15 -3.24 112.91 114.41 1tll h THR 2901Ca 0.11 -0.78 -0.12 0.00 0.77 0.00 0.00 66.41 66.39 1tll h THR 2901Cb 0.18 0.93 -0.02 0.00 -1.74 0.00 0.00 68.15 67.51 1tll h THR 2901CO -0.01 0.28 -0.55 -0.07 0.37 0.00 0.00 175.52 175.54 1tll h LEU 2902N 0.55 0.00 -0.54 2.58 3.38 -1.12 -3.21 115.31 116.95 1tll h LEU 2902Ca 0.13 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.08 1tll h LEU 2902Cb 0.30 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.03 1tll h LEU 2902CO 0.00 0.55 0.24 -0.07 0.09 0.00 0.00 178.44 179.25 1tll h LEU 2903N 0.00 0.73 -0.62 1.67 3.38 -1.24 -2.55 115.31 116.68 1tll h LEU 2903Ca -0.01 -0.15 0.08 0.00 0.09 0.00 0.00 57.88 57.89 1tll h LEU 2903Cb 1.27 -0.19 -0.06 0.00 0.09 0.00 0.00 40.66 41.77 1tll h LEU 2903CO 0.07 0.68 0.29 -0.08 0.09 0.00 0.00 178.44 179.50 1tll h GLU 2904N 0.74 0.52 -0.74 1.13 4.81 -1.59 -1.31 114.58 118.13 1tll h GLU 2904Ca 0.18 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.38 1tll h GLU 2904Cb 0.16 -0.12 0.00 0.00 0.63 0.00 0.00 28.75 29.42 1tll h GLU 2904CO -0.02 0.34 0.00 0.39 -0.73 0.00 0.00 179.01 178.99 1tll n GLU 2905N -4.90 0.66 -2.68 1.92 1.02 -0.96 -3.15 120.64 112.56 1tll n GLU 2905Ca 0.08 0.00 -0.08 0.00 -0.02 0.00 0.00 57.16 57.14 1tll n GLU 2905Cb 0.22 -1.31 0.05 0.00 -0.02 0.00 0.00 31.44 30.38 1tll n GLU 2905CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 1tll n LEU 2906N 0.23 0.83 -3.38 -4.62 4.77 -0.50 -4.70 117.00 109.63 1tll n LEU 2906Ca 0.00 -3.63 -0.19 0.00 -0.03 0.00 0.00 56.01 52.16 1tll n LEU 2906Cb 0.19 0.36 0.08 0.00 -2.33 0.00 0.00 43.42 41.71 1tll n LEU 2906CO 0.00 1.60 0.16 0.61 -1.33 0.00 0.00 177.39 178.43 1tll n GLY 2907N -0.19 -0.39 3.33 -0.72 0.00 -1.22 -4.92 105.19 101.07 1tll n GLY 2907Ca 0.07 0.14 -0.31 0.00 0.00 0.00 0.00 46.02 45.91 1tll n GLY 2907CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1tll s GLY 2908N -3.86 1.31 -0.18 -0.02 0.00 -1.19 -3.30 107.32 100.08 1tll s GLY 2908Ca 0.25 -1.09 0.00 0.00 0.00 0.00 0.00 44.72 43.88 1tll s GLY 2908CO 0.70 -0.87 -0.17 1.85 0.00 0.00 0.00 173.10 174.60 1tll s GLU 2909N -0.58 3.07 -0.13 2.90 2.12 -0.59 -4.49 118.70 121.00 1tll s GLU 2909Ca 0.09 -0.79 -0.29 0.00 0.36 0.00 0.00 54.97 54.33 1tll s GLU 2909Cb -0.10 -2.64 -0.01 0.00 0.26 0.00 0.00 34.13 31.64 1tll s GLU 2909CO -0.00 -0.18 1.06 0.50 -0.54 0.00 0.00 175.26 176.10 1tll s ARG 2910N 1.25 4.36 0.00 4.30 3.52 -1.26 -2.53 118.95 128.59 1tll s ARG 2910Ca 0.03 1.45 0.00 0.00 -0.13 0.00 0.00 55.73 57.08 1tll s ARG 2910Cb -0.14 -3.58 0.00 0.00 -1.56 0.00 0.00 34.95 29.67 1tll s ARG 2910CO -0.10 -0.43 0.19 -0.89 -0.81 0.00 0.00 175.30 173.26 1tll n ILE 2911N 4.79 0.00 -4.25 4.11 5.41 -0.17 -4.93 119.36 124.31 1tll n ILE 2911Ca 0.10 0.66 -0.26 0.00 1.00 0.00 0.00 62.75 64.25 1tll n ILE 2911Cb 0.47 -1.59 -0.08 0.00 -0.71 0.00 0.00 39.64 37.73 1tll n ILE 2911CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 176.55 176.33 1tll s LEU 2912N -3.76 3.18 0.13 1.39 2.96 -1.26 -5.06 118.68 116.26 1tll s LEU 2912Ca 0.00 -0.51 -0.31 0.00 -0.22 0.00 0.00 54.13 53.08 1tll s LEU 2912Cb 0.00 -1.81 -0.10 0.00 0.50 0.00 0.00 46.19 44.78 1tll s LEU 2912CO 0.00 0.07 1.64 -0.75 -1.32 0.00 0.00 176.35 175.99 1tll s LYS 2913N -3.09 4.19 0.13 1.98 2.20 -1.26 -4.60 119.74 119.29 1tll s LYS 2913Ca 0.28 2.40 -0.34 0.00 -0.36 0.00 0.00 55.97 57.94 1tll s LYS 2913Cb -0.08 -3.36 -0.14 0.00 -1.51 0.00 0.00 37.83 32.73 1tll s LYS 2913CO 0.18 -0.69 1.55 -0.12 -0.36 0.00 0.00 175.35 175.91 1tll n MET 2914N 4.76 1.96 -3.96 4.03 0.00 -1.26 -4.88 117.12 117.78 1tll n MET 2914Ca 0.15 0.71 -0.21 0.00 -0.00 0.00 0.00 57.70 58.35 1tll n MET 2914Cb 0.39 -2.46 -0.03 0.00 0.00 0.00 0.00 33.22 31.13 1tll n MET 2914CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 175.97 176.47 1tll s ARG 2915N 1.05 3.25 0.10 2.12 3.52 -0.95 -5.02 118.95 123.02 1tll s ARG 2915Ca 0.81 -0.88 0.10 0.00 -0.13 0.00 0.00 55.73 55.63 1tll s ARG 2915Cb -0.73 -2.78 -0.04 0.00 -1.56 0.00 0.00 34.95 29.84 1tll s ARG 2915CO 0.41 0.38 -0.25 -1.21 -0.81 0.00 0.00 175.30 173.81 1tll s GLU 2916N -3.96 1.60 -0.33 5.12 2.02 -1.26 -2.11 118.70 119.78 1tll s GLU 2916Ca 0.35 -1.24 0.01 0.00 0.02 0.00 0.00 54.97 54.11 1tll s GLU 2916Cb -0.09 -1.97 0.10 0.00 0.10 0.00 0.00 34.13 32.27 1tll s GLU 2916CO 0.28 0.48 0.09 0.20 0.02 0.00 0.00 175.26 176.32 1tll s GLY 2917N -1.84 1.39 -0.39 -1.39 0.00 -0.75 -4.88 107.32 99.45 1tll s GLY 2917Ca 0.14 -2.00 -0.29 0.00 0.00 0.00 0.00 44.72 42.57 1tll s GLY 2917CO 0.06 1.39 1.26 -0.35 0.00 0.00 0.00 173.10 175.46 1tll s ASP 2918N 1.32 6.59 0.65 1.64 2.15 -1.26 -1.32 116.67 126.44 1tll s ASP 2918Ca 0.11 0.85 0.29 0.00 0.43 0.00 0.00 52.55 54.22 1tll s ASP 2918Cb -0.18 -2.54 1.53 0.00 -0.30 0.00 0.00 42.92 41.43 1tll s ASP 2918CO -0.19 -1.22 1.88 -0.08 -0.17 0.00 0.00 175.17 175.40 1tll h GLU 2919N 9.57 0.00 0.00 4.34 4.57 -1.12 0.55 114.58 132.49 1tll h GLU 2919Ca -0.25 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 57.93 1tll h GLU 2919Cb 1.08 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.67 1tll h GLU 2919CO 1.08 0.00 -0.81 1.28 -1.18 0.00 0.00 179.01 179.38 1tll n LEU 2920N -3.09 0.68 -3.15 1.64 4.77 -1.26 -4.83 117.00 111.76 1tll n LEU 2920Ca 0.01 0.16 0.04 0.00 -0.03 0.00 0.00 56.01 56.19 1tll n LEU 2920Cb 0.47 -0.14 -0.01 0.00 -2.33 0.00 0.00 43.42 41.42 1tll n LEU 2920CO 0.17 -0.04 0.21 0.00 -1.33 0.00 0.00 177.39 176.40 1tll n GLY 2922N 5.41 -0.04 0.01 0.00 0.00 -1.26 -4.41 105.19 104.91 1tll n GLY 2922Ca 0.01 -0.10 -0.00 0.00 0.00 0.00 0.00 46.02 45.92 1tll n GLY 2922CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 1tll h GLN 2923N -1.40 -0.03 -0.43 1.61 4.15 -1.87 -2.25 115.11 114.89 1tll h GLN 2923Ca -0.37 0.00 0.12 0.00 0.77 0.00 0.00 58.65 59.18 1tll h GLN 2923Cb 1.22 0.01 -0.02 0.00 0.21 0.00 0.00 27.48 28.90 1tll h GLN 2923CO 0.33 -0.02 0.56 1.49 -1.93 0.00 0.00 178.83 179.26 1tll h GLU 2924N -0.04 0.00 0.05 1.69 4.57 -1.91 -1.60 114.58 117.34 1tll h GLU 2924Ca -0.00 0.00 -0.00 0.00 -1.18 0.00 0.00 59.36 58.17 1tll h GLU 2924Cb 0.02 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.61 1tll h GLU 2924CO 0.00 0.00 -0.02 1.49 -1.18 0.00 0.00 179.01 179.30 1tll h GLU 2925N 0.00 -0.06 0.00 1.92 4.57 -1.75 -2.42 114.58 116.84 1tll h GLU 2925Ca 0.20 0.00 -0.05 0.00 -1.18 0.00 0.00 59.36 58.34 1tll h GLU 2925Cb 1.32 0.01 -0.01 0.00 -0.16 0.00 0.00 28.75 29.92 1tll h GLU 2925CO -0.00 0.53 -0.23 0.00 -1.18 0.00 0.00 179.01 178.13 1tll h ALA 2926N 0.15 1.44 0.30 2.92 0.00 -0.69 -2.69 119.26 120.69 1tll h ALA 2926Ca -0.01 -0.21 -0.01 0.00 0.00 0.00 0.00 54.91 54.68 1tll h ALA 2926Cb 0.61 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.37 1tll h ALA 2926CO 0.01 0.28 -0.14 0.35 0.00 0.00 0.00 179.25 179.75 1tll h PHE 2927N 0.00 -0.37 -0.75 0.00 3.57 -1.43 -0.91 116.94 117.04 1tll h PHE 2927Ca -0.00 -0.01 0.17 0.00 3.53 0.00 0.00 57.97 61.66 1tll h PHE 2927Cb 0.45 0.12 -0.11 0.00 2.79 0.00 0.00 35.95 39.20 1tll h PHE 2927CO 0.00 -0.03 0.17 0.00 -2.23 0.00 0.00 178.31 176.23 1tll h ARG 2928N -0.91 0.25 0.04 1.11 3.08 -1.36 0.78 114.38 117.36 1tll h ARG 2928Ca -0.04 -0.01 -0.00 0.00 0.07 0.00 0.00 59.98 59.99 1tll h ARG 2928Cb 0.51 -0.06 0.00 0.00 0.08 0.00 0.00 29.97 30.51 1tll h ARG 2928CO 0.07 0.16 -0.02 1.15 -1.07 0.00 0.00 179.97 180.26 1tll h THR 2929N 0.25 0.00 -1.22 2.04 2.02 -1.50 -1.64 112.91 112.87 1tll h THR 2929Ca 0.43 -0.00 0.36 0.00 0.77 0.00 0.00 66.41 67.97 1tll h THR 2929Cb 0.75 0.00 -0.10 0.00 -1.74 0.00 0.00 68.15 67.06 1tll h THR 2929CO -0.53 0.00 0.80 -0.25 0.37 0.00 0.00 175.52 175.91 1tll h TRP 2930N -0.06 0.49 -0.21 3.16 7.01 -0.86 0.37 115.95 125.85 1tll h TRP 2930Ca -0.01 0.02 0.00 0.00 2.11 0.00 0.00 58.89 61.02 1tll h TRP 2930Cb 0.04 -0.13 -0.01 0.00 -2.10 0.00 0.00 29.16 26.96 1tll h TRP 2930CO 0.21 -0.06 0.14 0.00 -2.79 0.00 0.00 178.44 175.93 1tll h ALA 2931N 1.56 0.27 -0.14 2.65 0.00 0.85 0.11 119.26 124.55 1tll h ALA 2931Ca 0.70 -0.02 -0.19 0.00 0.00 0.00 0.00 54.91 55.40 1tll h ALA 2931Cb 2.15 -0.09 0.01 0.00 0.00 0.00 0.00 17.79 19.86 1tll h ALA 2931CO -0.30 -0.25 -0.67 0.87 0.00 0.00 0.00 179.25 178.90 1tll h LYS 2932N 0.28 0.71 -0.24 0.00 1.79 0.60 -2.59 116.57 117.11 1tll h LYS 2932Ca 0.08 -0.57 -0.03 0.00 -2.18 0.00 0.00 60.65 57.95 1tll h LYS 2932Cb -0.02 0.12 -0.01 0.00 -1.58 0.00 0.00 32.23 30.73 1tll h LYS 2932CO -0.02 1.18 0.01 0.87 -1.08 0.00 0.00 179.45 180.42 1tll h LYS 2933N 0.40 0.35 0.00 3.15 1.79 -0.75 -2.19 116.57 119.33 1tll h LYS 2933Ca -0.04 -0.06 -0.14 0.00 -2.18 0.00 0.00 60.65 58.23 1tll h LYS 2933Cb 1.31 -0.06 -0.02 0.00 -1.58 0.00 0.00 32.23 31.87 1tll h LYS 2933CO 0.14 0.37 -0.96 0.28 -1.08 0.00 0.00 179.45 178.20 1tll h VAL 2934N 0.35 0.72 0.12 0.50 2.07 -0.82 -2.55 116.25 116.64 1tll h VAL 2934Ca 0.08 -2.15 -0.01 0.00 0.82 0.00 0.00 66.70 65.44 1tll h VAL 2934Cb 0.22 2.25 0.00 0.00 -1.52 0.00 0.00 31.29 32.23 1tll h VAL 2934CO 0.00 0.41 -0.06 0.15 0.02 0.00 0.00 177.57 178.10 1tll h PHE 2935N 0.00 -0.15 -0.42 1.57 3.57 -1.11 -1.21 116.94 119.19 1tll h PHE 2935Ca -0.08 -0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.41 1tll h PHE 2935Cb 1.49 0.05 -0.02 0.00 2.79 0.00 0.00 35.95 40.26 1tll h PHE 2935CO 0.00 0.23 0.24 -0.22 -2.23 0.00 0.00 178.31 176.33 1tll h LYS 2936N -0.56 0.58 -0.55 1.11 1.63 -1.53 0.21 116.57 117.46 1tll h LYS 2936Ca -0.02 -0.06 0.10 0.00 -0.85 0.00 0.00 60.65 59.82 1tll h LYS 2936Cb 0.45 -0.12 -0.08 0.00 -0.60 0.00 0.00 32.23 31.88 1tll h LYS 2936CO 0.03 0.46 0.09 0.00 -3.45 0.00 0.00 179.45 176.57 1tll h ALA 2937N 1.09 0.61 0.03 5.00 0.00 -1.38 -0.84 119.26 123.76 1tll h ALA 2937Ca 0.15 0.13 -0.22 0.00 0.00 0.00 0.00 54.91 54.97 1tll h ALA 2937Cb 0.04 0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 1tll h ALA 2937CO -0.03 -0.33 -0.97 0.00 0.00 0.00 0.00 179.25 177.93 1tll h ALA 2938N 1.44 0.40 -0.94 0.00 0.00 -1.04 -2.07 119.26 117.06 1tll h ALA 2938Ca 0.28 -0.79 0.15 0.00 0.00 0.00 0.00 54.91 54.55 1tll h ALA 2938Cb 0.41 -0.07 -0.08 0.00 0.00 0.00 0.00 17.79 18.05 1tll h ALA 2938CO -0.38 0.98 0.60 0.00 0.00 0.00 0.00 179.25 180.44 1tll n ASP 2940N -4.60 1.66 -0.32 0.00 8.00 -0.51 -1.61 116.55 119.16 1tll n ASP 2940Ca 0.19 0.15 0.14 0.00 0.71 0.00 0.00 54.79 55.97 1tll n ASP 2940Cb 0.48 -0.44 0.32 0.00 -0.02 0.00 0.00 41.12 41.46 1tll n ASP 2940CO 0.00 0.00 0.00 0.58 -0.39 0.00 0.00 177.20 177.39 1tll h VAL 2941N 0.04 0.57 -0.46 2.53 2.07 -1.02 0.66 116.25 120.63 1tll h VAL 2941Ca -0.45 -0.19 0.00 0.00 0.82 0.00 0.00 66.70 66.89 1tll h VAL 2941Cb 2.02 -0.03 0.00 0.00 -1.52 0.00 0.00 31.29 31.76 1tll h VAL 2941CO 0.04 0.10 0.00 0.49 0.02 0.00 0.00 177.57 178.22 1tll n PHE 2942N -4.93 0.61 -3.52 1.57 3.01 0.14 -5.01 117.46 109.33 1tll n PHE 2942Ca 0.23 -0.31 -0.21 0.00 1.01 0.00 0.00 57.45 58.18 1tll n PHE 2942Cb 0.64 0.00 0.02 0.00 -0.01 0.00 0.00 39.48 40.13 1tll n PHE 2942CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1tll s VAL 2944N -3.23 4.16 0.00 0.00 -7.23 -0.64 -5.02 120.40 108.43 1tll s VAL 2944Ca 0.25 -1.04 0.00 0.00 -1.81 0.00 0.00 61.98 59.38 1tll s VAL 2944Cb -0.08 -3.03 0.00 0.00 0.56 0.00 0.00 36.38 33.83 1tll s VAL 2944CO 0.83 0.04 0.00 0.61 -0.31 0.00 0.00 175.10 176.27 1tll n GLY 2945N 0.25 0.69 3.31 2.32 0.00 -1.26 -4.63 105.19 105.87 1tll n GLY 2945Ca -0.10 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.48 1tll n GLY 2945CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1tll s ASP 2946N -1.00 6.08 0.20 1.61 -0.00 -1.26 -5.04 116.67 117.27 1tll s ASP 2946Ca 0.00 -1.72 0.03 0.00 -0.00 0.00 0.00 52.55 50.86 1tll s ASP 2946Cb 0.00 -2.16 -0.05 0.00 -0.00 0.00 0.00 42.92 40.71 1tll s ASP 2946CO 0.00 -0.79 -0.00 -0.62 -0.00 0.00 0.00 175.17 173.76 1tll s ASP 2947N 3.23 1.57 0.00 0.27 -1.08 -1.26 -5.01 116.67 114.38 1tll s ASP 2947Ca 0.04 -1.19 -0.01 0.00 -0.52 0.00 0.00 52.55 50.86 1tll s ASP 2947Cb -0.28 0.06 -0.01 0.00 -1.46 0.00 0.00 42.92 41.22 1tll s ASP 2947CO 0.03 -0.53 0.35 0.52 0.52 0.00 0.00 175.17 176.06 1tll n VAL 2948N -0.34 0.00 -1.19 1.11 0.31 -1.26 -4.64 118.33 112.32 1tll n VAL 2948Ca -0.06 -0.27 -0.26 0.00 -0.01 0.00 0.00 64.34 63.74 1tll n VAL 2948Cb 0.63 -0.11 0.05 0.00 -0.91 0.00 0.00 33.84 33.50 1tll n VAL 2948CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 1tll n ASN 2949N 3.34 7.03 0.00 4.52 3.02 -1.26 -3.81 115.26 128.09 1tll n ASN 2949Ca 0.02 -3.41 0.00 0.00 -0.03 0.00 0.00 54.58 51.16 1tll n ASN 2949Cb 0.15 -1.05 0.00 0.00 -0.61 0.00 0.00 39.78 38.28 1tll n ASN 2949CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1tll n ILE 2950N -0.15 0.00 -0.05 2.41 3.06 -1.26 -4.87 119.36 118.50 1tll n ILE 2950Ca 0.46 -0.01 -0.09 0.00 -2.50 0.00 0.00 62.75 60.61 1tll n ILE 2950Cb 0.59 0.88 -0.03 0.00 0.54 0.00 0.00 39.64 41.62 1tll n ILE 2950CO 0.00 0.00 0.00 -0.33 -2.50 0.00 0.00 176.55 173.72 1tll h GLU 2951N 0.00 0.23 -6.10 9.51 4.39 -1.97 -3.55 114.58 117.09 1tll h GLU 2951Ca 0.00 -0.01 -0.78 0.00 0.34 0.00 0.00 59.36 58.91 1tll h GLU 2951Cb 0.00 -0.05 0.01 0.00 -0.10 0.00 0.00 28.75 28.61 1tll h GLU 2951CO 0.00 0.15 0.86 0.36 -1.16 0.00 0.00 179.01 179.22 1tll n LYS 2952N -4.99 0.79 -0.94 2.33 -0.00 -1.26 -5.09 118.16 109.01 1tll n LYS 2952Ca -0.03 0.29 0.00 0.00 -0.00 0.00 0.00 58.31 58.57 1tll n LYS 2952Cb 0.05 -1.92 0.00 0.00 -0.00 0.00 0.00 35.03 33.16 1tll n LYS 2952CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.40 176.27 1tll n SER 2959N 5.12 -1.10 -4.29 -5.58 3.41 -1.26 -5.19 113.62 104.73 1tll n SER 2959Ca 0.29 0.07 -0.16 0.00 -0.26 0.00 0.00 58.87 58.80 1tll n SER 2959Cb 0.07 -0.26 0.04 0.00 -0.26 0.00 0.00 64.21 63.80 1tll n SER 2959CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1tll n ASN 2960N 1.46 1.80 -0.06 4.04 4.13 -1.26 -5.02 115.26 120.34 1tll n ASN 2960Ca 0.00 -2.26 -0.07 0.00 1.68 0.00 0.00 54.58 53.92 1tll n ASN 2960Cb 0.08 -0.28 -0.01 0.00 -1.54 0.00 0.00 39.78 38.04 1tll n ASN 2960CO 0.00 0.00 0.00 0.44 0.28 0.00 0.00 177.26 177.98 1tll h ASP 2961N 0.16 -0.43 0.00 6.41 3.32 -2.01 -1.91 116.42 121.96 1tll h ASP 2961Ca -0.22 0.10 0.00 0.00 0.02 0.00 0.00 57.03 56.93 1tll h ASP 2961Cb 0.98 0.24 0.00 0.00 0.22 0.00 0.00 39.33 40.77 1tll h ASP 2961CO 0.33 -0.16 0.00 0.54 -1.72 0.00 0.00 179.24 178.22 1tll n ARG 2962N -5.30 0.20 -3.07 3.56 3.00 -1.26 -4.63 116.66 109.16 1tll n ARG 2962Ca -0.01 0.00 -0.39 0.00 -0.01 0.00 0.00 57.85 57.44 1tll n ARG 2962Cb 0.21 -1.34 -0.05 0.00 0.00 0.00 0.00 32.46 31.28 1tll n ARG 2962CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.63 176.51 1tll s SER 2963N -1.93 7.13 0.01 0.55 0.01 -0.72 -4.99 113.70 113.76 1tll s SER 2963Ca 0.07 1.35 -0.38 0.00 1.31 0.00 0.00 55.95 58.30 1tll s SER 2963Cb 0.03 -2.43 -0.19 0.00 0.21 0.00 0.00 66.02 63.64 1tll s SER 2963CO 0.05 0.07 1.00 1.87 0.41 0.00 0.00 173.24 176.64 1tll n TRP 2964N 2.65 0.55 -4.31 2.43 -0.00 -1.26 -5.00 117.44 112.49 1tll n TRP 2964Ca -0.05 1.02 -0.15 0.00 -0.00 0.00 0.00 57.50 58.32 1tll n TRP 2964Cb 0.50 -2.02 -0.04 0.00 -0.00 0.00 0.00 31.31 29.76 1tll n TRP 2964CO 0.00 0.00 0.00 1.63 -0.00 0.00 0.00 177.69 179.32 1tll n LYS 2965N 1.42 0.84 -0.68 5.87 5.02 -1.26 -5.11 118.16 124.27 1tll n LYS 2965Ca 0.19 -2.00 0.08 0.00 -2.02 0.00 0.00 58.31 54.56 1tll n LYS 2965Cb 0.09 0.98 0.35 0.00 -0.02 0.00 0.00 35.03 36.43 1tll n LYS 2965CO 0.00 0.00 0.00 -2.13 -0.52 0.00 0.00 177.40 174.75 1tll n ARG 2966N -0.56 4.03 -0.88 1.97 3.00 -1.26 -4.36 116.66 118.60 1tll n ARG 2966Ca -0.05 -2.95 -0.03 0.00 -0.00 0.00 0.00 57.85 54.82 1tll n ARG 2966Cb 0.35 -2.00 -0.03 0.00 0.00 0.00 0.00 32.46 30.79 1tll n ARG 2966CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.63 175.92 1tll n ASN 2967N 0.69 -0.31 -0.00 6.15 2.85 -1.26 -4.76 115.26 118.62 1tll n ASN 2967Ca 0.25 -1.70 0.09 0.00 -0.11 0.00 0.00 54.58 53.11 1tll n ASN 2967Cb 0.99 0.07 -0.11 0.00 1.24 0.00 0.00 39.78 41.97 1tll n ASN 2967CO 0.00 0.00 0.00 1.17 -2.11 0.00 0.00 177.26 176.32 1tll n LYS 2968N 0.07 0.53 -3.88 1.20 3.00 -1.26 -4.62 118.16 113.20 1tll n LYS 2968Ca -0.12 -0.01 -0.11 0.00 -0.00 0.00 0.00 58.31 58.07 1tll n LYS 2968Cb 0.71 -1.43 -0.13 0.00 0.00 0.00 0.00 35.03 34.18 1tll n LYS 2968CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.40 177.34 1tll s PHE 2969N -2.88 0.02 0.00 5.64 2.99 -1.26 -0.40 117.98 122.09 1tll s PHE 2969Ca 0.07 -0.04 -0.19 0.00 0.00 0.00 0.00 56.93 56.77 1tll s PHE 2969Cb 0.15 -0.03 0.04 0.00 0.00 0.00 0.00 43.02 43.17 1tll s PHE 2969CO 0.81 -0.09 0.41 -0.98 -0.00 0.00 0.00 175.22 175.36 1tll s ARG 2970N -0.46 0.83 -0.58 0.44 1.70 -0.58 -5.00 118.95 115.30 1tll s ARG 2970Ca -0.05 -0.19 -0.11 0.00 -0.47 0.00 0.00 55.73 54.91 1tll s ARG 2970Cb -0.03 0.37 0.15 0.00 -0.57 0.00 0.00 34.95 34.87 1tll s ARG 2970CO -0.00 -0.26 0.47 -0.51 -1.08 0.00 0.00 175.30 173.93 1tll s LEU 2971N -1.58 5.96 -0.21 -1.89 1.43 -1.26 -0.97 118.68 120.16 1tll s LEU 2971Ca -0.10 -2.17 -0.15 0.00 -1.03 0.00 0.00 54.13 50.68 1tll s LEU 2971Cb -0.03 -2.07 -0.04 0.00 0.03 0.00 0.00 46.19 44.08 1tll s LEU 2971CO 0.03 -0.66 0.37 0.42 0.23 0.00 0.00 176.35 176.74 1tll s THR 2972N 0.98 5.22 0.84 5.49 -4.23 -0.89 -4.81 115.64 118.23 1tll s THR 2972Ca 0.09 0.65 -0.15 0.00 -1.18 0.00 0.00 61.69 61.10 1tll s THR 2972Cb -0.23 -3.70 -0.01 0.00 1.34 0.00 0.00 72.50 69.90 1tll s THR 2972CO -0.02 0.26 0.45 -1.22 -0.54 0.00 0.00 174.62 173.55 1tll n TYR 2973N 4.44 -1.19 -3.72 3.99 4.02 -1.26 -2.35 117.16 121.09 1tll n TYR 2973Ca -0.09 0.29 -0.13 0.00 -0.01 0.00 0.00 57.90 57.95 1tll n TYR 2973Cb 0.51 -1.84 -0.09 0.00 -0.02 0.00 0.00 39.34 37.89 1tll n TYR 2973CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 176.86 175.93 1tll s VAL 2974N -2.14 0.01 -1.80 -0.72 1.01 -0.99 -4.81 120.40 110.95 1tll s VAL 2974Ca 0.61 -0.07 0.21 0.00 0.00 0.00 0.00 61.98 62.73 1tll s VAL 2974Cb -0.28 -0.63 0.62 0.00 0.00 0.00 0.00 36.38 36.09 1tll s VAL 2974CO 0.63 -0.04 1.52 0.00 0.00 0.00 0.00 175.10 177.21 1tll n ALA 2975N 2.53 2.41 -3.65 5.51 0.00 -1.26 -4.33 120.51 121.72 1tll n ALA 2975Ca -0.15 -1.32 -0.29 0.00 0.00 0.00 0.00 53.44 51.69 1tll n ALA 2975Cb 0.57 -0.88 -0.16 0.00 0.00 0.00 0.00 19.45 18.98 1tll n ALA 2975CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 1tll s GLU 2976N -1.07 0.43 -0.13 0.00 2.12 -1.26 -5.08 118.70 113.70 1tll s GLU 2976Ca 0.47 -0.61 -0.03 0.00 0.36 0.00 0.00 54.97 55.16 1tll s GLU 2976Cb 0.25 -1.69 -0.03 0.00 0.26 0.00 0.00 34.13 32.92 1tll s GLU 2976CO 0.31 -0.89 -0.02 0.00 -0.54 0.00 0.00 175.26 174.13 1tll s ALA 2977N 1.91 3.14 1.24 6.30 0.00 -1.26 -4.83 121.76 128.26 1tll s ALA 2977Ca 0.06 -0.81 -0.17 0.00 0.00 0.00 0.00 51.96 51.04 1tll s ALA 2977Cb -0.17 -1.54 0.28 0.00 0.00 0.00 0.00 23.12 21.70 1tll s ALA 2977CO -0.24 0.36 0.77 -0.35 0.00 0.00 0.00 175.76 176.30 1tll n PRO 2978N 2.96 -2.97 -3.04 0.00 -0.04 -1.26 -4.99 135.00 125.66 1tll n PRO 2978Ca -0.18 -0.85 -0.34 0.00 -0.04 0.00 0.00 63.50 62.09 1tll n PRO 2978Cb 0.53 -1.99 -0.06 0.00 -0.04 0.00 0.00 33.50 31.94 1tll n PRO 2978CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 1tll s ASP 2979N -2.41 6.95 0.18 3.54 -1.08 -1.26 -4.83 116.67 117.75 1tll s ASP 2979Ca 0.65 1.44 -0.25 0.00 -0.52 0.00 0.00 52.55 53.87 1tll s ASP 2979Cb -0.19 -2.43 0.06 0.00 -1.46 0.00 0.00 42.92 38.89 1tll s ASP 2979CO 0.62 -0.14 1.57 0.25 0.52 0.00 0.00 175.17 177.99 1tll h LEU 2980N 2.68 -1.49 -1.37 -1.34 5.85 -1.98 0.40 115.31 118.06 1tll h LEU 2980Ca -0.48 0.25 0.04 0.00 0.84 0.00 0.00 57.88 58.54 1tll h LEU 2980Cb 1.18 0.69 -0.04 0.00 0.37 0.00 0.00 40.66 42.86 1tll h LEU 2980CO 0.65 -0.32 0.46 0.71 -0.34 0.00 0.00 178.44 179.59 1tll h THR 2981N -0.19 1.07 -0.13 1.05 1.35 -1.93 0.16 112.91 114.29 1tll h THR 2981Ca 0.20 -0.27 -0.21 0.00 -0.55 0.00 0.00 66.41 65.57 1tll h THR 2981Cb 0.56 0.20 0.01 0.00 -1.73 0.00 0.00 68.15 67.19 1tll h THR 2981CO -0.73 0.15 -0.77 -0.61 -0.25 0.00 0.00 175.52 173.31 1tll h GLN 2982N 0.80 0.70 -0.40 4.72 5.75 -1.52 -1.73 115.11 123.43 1tll h GLN 2982Ca 0.29 -0.57 0.02 0.00 -0.15 0.00 0.00 58.65 58.23 1tll h GLN 2982Cb 0.13 0.12 -0.03 0.00 1.07 0.00 0.00 27.48 28.77 1tll h GLN 2982CO -0.09 1.18 0.23 0.78 -2.65 0.00 0.00 178.83 178.29 1tll h GLY 2983N 0.75 0.55 1.03 2.39 0.00 0.84 -1.57 103.07 107.05 1tll h GLY 2983Ca -0.05 -0.17 -0.03 0.00 0.00 0.00 0.00 47.33 47.09 1tll h GLY 2983CO 0.15 0.14 0.44 1.41 0.00 0.00 0.00 176.54 178.69 1tll h LEU 2984N 0.46 1.10 -1.20 3.11 3.38 -0.66 -0.34 115.31 121.16 1tll h LEU 2984Ca 0.16 -0.12 -0.03 0.00 0.09 0.00 0.00 57.88 57.98 1tll h LEU 2984Cb 0.02 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.46 1tll h LEU 2984CO -0.08 0.91 0.20 0.28 0.09 0.00 0.00 178.44 179.84 1tll h SER 2985N 1.22 0.69 -0.06 -0.43 0.02 -0.93 0.50 113.55 114.55 1tll h SER 2985Ca 0.30 -0.08 -0.02 0.00 -0.84 0.00 0.00 61.79 61.14 1tll h SER 2985Cb 0.08 -0.18 -0.00 0.00 0.14 0.00 0.00 62.40 62.44 1tll h SER 2985CO -0.04 0.63 -0.05 0.78 -1.14 0.00 0.00 176.83 177.01 1tll h ASN 2986N 0.75 0.15 0.05 3.07 -0.26 -0.33 0.68 115.58 119.69 1tll h ASN 2986Ca 0.18 -0.46 -0.00 0.00 -0.56 0.00 0.00 56.30 55.46 1tll h ASN 2986Cb 0.16 -0.04 -0.00 0.00 -1.06 0.00 0.00 38.32 37.37 1tll h ASN 2986CO -0.02 0.58 -0.03 0.58 -1.06 0.00 0.00 177.43 177.48 1tll h VAL 2987N -0.28 0.93 -0.33 2.81 2.07 -0.85 -3.10 116.25 117.50 1tll h VAL 2987Ca 0.01 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.53 1tll h VAL 2987Cb 0.53 0.93 0.00 0.00 -1.52 0.00 0.00 31.29 31.23 1tll h VAL 2987CO 0.01 0.00 0.00 1.41 0.02 0.00 0.00 177.57 179.01 1tll n HIS 2988N -5.13 0.43 -3.98 1.57 8.25 0.15 -4.95 115.22 111.54 1tll n HIS 2988Ca -0.07 -0.21 -0.29 0.00 -0.26 0.00 0.00 57.72 56.88 1tll n HIS 2988Cb 0.07 0.00 -0.00 0.00 1.12 0.00 0.00 29.99 31.17 1tll n HIS 2988CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 1tll n LYS 2989N 0.84 -4.01 -3.72 -0.41 5.02 0.21 -4.95 118.16 111.13 1tll n LYS 2989Ca 0.17 0.47 -0.12 0.00 -2.02 0.00 0.00 58.31 56.81 1tll n LYS 2989Cb 0.43 -5.00 -0.07 0.00 -0.02 0.00 0.00 35.03 30.37 1tll n LYS 2989CO 0.00 0.00 0.00 -1.59 -0.52 0.00 0.00 177.40 175.29 1tll s LYS 2990N -6.59 0.86 -0.33 1.97 -2.85 -1.10 -5.06 119.74 106.64 1tll s LYS 2990Ca 0.36 -0.50 -0.29 0.00 -1.00 0.00 0.00 55.97 54.54 1tll s LYS 2990Cb -0.19 0.38 0.01 0.00 -2.06 0.00 0.00 37.83 35.97 1tll s LYS 2990CO 0.88 -0.29 1.25 0.50 0.10 0.00 0.00 175.35 177.78 1tll s ARG 2991N -2.68 3.90 -0.15 1.78 6.06 -1.26 -4.18 118.95 122.42 1tll s ARG 2991Ca -0.04 1.12 -0.03 0.00 -2.50 0.00 0.00 55.73 54.28 1tll s ARG 2991Cb -0.00 -3.86 -0.03 0.00 0.06 0.00 0.00 34.95 31.12 1tll s ARG 2991CO -0.04 -1.13 -0.04 0.08 -2.50 0.00 0.00 175.30 171.66 1tll s VAL 2992N 4.31 3.85 0.24 7.11 1.01 -1.26 -4.72 120.40 130.95 1tll s VAL 2992Ca 0.54 -0.38 0.07 0.00 0.00 0.00 0.00 61.98 62.20 1tll s VAL 2992Cb -0.15 -2.67 -0.04 0.00 0.00 0.00 0.00 36.38 33.53 1tll s VAL 2992CO 0.23 0.51 0.21 -0.44 0.00 0.00 0.00 175.10 175.61 1tll s SER 2993N 0.24 5.61 -0.33 3.32 0.01 0.03 -4.76 113.70 117.81 1tll s SER 2993Ca -0.03 -0.21 -0.15 0.00 1.31 0.00 0.00 55.95 56.88 1tll s SER 2993Cb -0.14 -1.45 -0.02 0.00 0.21 0.00 0.00 66.02 64.62 1tll s SER 2993CO 0.03 -0.03 0.33 0.00 0.41 0.00 0.00 173.24 173.98 1tll s ALA 2994N -2.09 3.51 0.32 1.44 0.00 -1.26 -2.41 121.76 121.25 1tll s ALA 2994Ca 0.33 -1.19 0.08 0.00 0.00 0.00 0.00 51.96 51.18 1tll s ALA 2994Cb -0.08 -2.76 -0.04 0.00 0.00 0.00 0.00 23.12 20.23 1tll s ALA 2994CO 0.25 -0.98 0.13 0.00 0.00 0.00 0.00 175.76 175.16 1tll s ALA 2995N 1.96 3.47 0.08 0.00 0.00 -0.74 -4.87 121.76 121.66 1tll s ALA 2995Ca 0.11 -1.75 0.09 0.00 0.00 0.00 0.00 51.96 50.41 1tll s ALA 2995Cb -0.17 -0.82 -0.03 0.00 0.00 0.00 0.00 23.12 22.10 1tll s ALA 2995CO 0.11 0.10 -0.23 1.03 0.00 0.00 0.00 175.76 176.77 1tll s ARG 2996N -3.82 1.38 -0.03 0.00 0.52 -0.80 -0.10 118.95 116.10 1tll s ARG 2996Ca 0.36 -1.14 -0.30 0.00 -0.52 0.00 0.00 55.73 54.13 1tll s ARG 2996Cb -0.04 -1.65 -0.04 0.00 0.52 0.00 0.00 34.95 33.74 1tll s ARG 2996CO 0.23 0.40 1.20 -1.17 0.02 0.00 0.00 175.30 175.98 1tll s LEU 2997N -1.63 4.30 -0.23 2.53 2.96 -1.20 -0.54 118.68 124.88 1tll s LEU 2997Ca 0.09 1.86 -0.18 0.00 -0.22 0.00 0.00 54.13 55.69 1tll s LEU 2997Cb -0.10 -3.56 -0.17 0.00 0.50 0.00 0.00 46.19 42.86 1tll s LEU 2997CO 0.04 -0.55 0.01 0.18 -1.32 0.00 0.00 176.35 174.71 1tll n LEU 2998N 4.87 1.94 -3.58 -0.68 4.77 0.21 -2.09 117.00 122.44 1tll n LEU 2998Ca 0.10 0.37 -0.06 0.00 -0.03 0.00 0.00 56.01 56.40 1tll n LEU 2998Cb 0.46 -0.92 -0.02 0.00 -2.33 0.00 0.00 43.42 40.62 1tll n LEU 2998CO 0.55 0.41 0.81 -0.94 -1.33 0.00 0.00 177.39 176.90 1tll s SER 2999N -7.08 -0.24 -0.05 -1.43 1.04 -1.10 -4.89 113.70 99.94 1tll s SER 2999Ca -0.32 -0.08 -0.05 0.00 0.48 0.00 0.00 55.95 55.98 1tll s SER 2999Cb 0.09 0.32 0.01 0.00 0.10 0.00 0.00 66.02 66.55 1tll s SER 2999CO 0.56 -0.54 0.14 0.00 0.98 0.00 0.00 173.24 174.38 1tll s ARG 3000N -2.91 0.16 -0.05 4.02 1.70 -1.25 -0.55 118.95 120.06 1tll s ARG 3000Ca 0.08 0.20 -0.11 0.00 -0.47 0.00 0.00 55.73 55.44 1tll s ARG 3000Cb -0.00 0.06 0.02 0.00 -0.57 0.00 0.00 34.95 34.46 1tll s ARG 3000CO -0.05 -0.03 0.26 1.14 -1.08 0.00 0.00 175.30 175.53 1tll s GLN 3001N 0.14 0.47 0.14 3.89 -2.07 -0.62 -4.93 119.66 116.68 1tll s GLN 3001Ca -0.01 0.03 -0.30 0.00 -1.82 0.00 0.00 55.36 53.26 1tll s GLN 3001Cb -0.02 0.21 -0.07 0.00 -1.09 0.00 0.00 33.01 32.05 1tll s GLN 3001CO -0.00 -0.10 1.15 -0.80 -1.32 0.00 0.00 175.29 174.22 1tll s ASN 3002N -0.65 7.17 0.00 12.60 0.01 -1.26 0.49 114.94 133.29 1tll s ASN 3002Ca -0.07 2.09 0.22 0.00 -0.71 0.00 0.00 52.86 54.38 1tll s ASN 3002Cb -0.04 -2.60 -0.04 0.00 0.41 0.00 0.00 41.25 38.98 1tll s ASN 3002CO 0.02 -0.33 1.04 0.18 -1.51 0.00 0.00 177.10 176.50 1tll n LEU 3003N 2.91 1.36 -4.93 0.60 4.77 -0.40 -4.89 117.00 116.42 1tll n LEU 3003Ca 0.05 -0.55 -0.28 0.00 -0.03 0.00 0.00 56.01 55.20 1tll n LEU 3003Cb 0.46 -0.02 -0.03 0.00 -2.33 0.00 0.00 43.42 41.49 1tll n LEU 3003CO 0.55 0.29 -0.10 -1.10 -1.33 0.00 0.00 177.39 175.70 1tll s GLN 3004N -2.77 3.45 0.41 3.23 -0.21 -1.25 -4.42 119.66 118.09 1tll s GLN 3004Ca 0.13 -0.51 -0.27 0.00 0.02 0.00 0.00 55.36 54.74 1tll s GLN 3004Cb 0.17 -2.97 -0.10 0.00 1.00 0.00 0.00 33.01 31.11 1tll s GLN 3004CO 0.73 0.54 1.41 0.45 -2.12 0.00 0.00 175.29 176.29 1tll n SER 3005N -0.28 3.29 -0.02 5.90 2.88 -1.10 -4.86 113.62 119.42 1tll n SER 3005Ca -0.06 1.16 0.16 0.00 -1.33 0.00 0.00 58.87 58.81 1tll n SER 3005Cb 0.53 -1.58 0.61 0.00 -0.75 0.00 0.00 64.21 63.02 1tll n SER 3005CO 0.00 0.00 0.00 -0.65 -1.23 0.00 0.00 175.04 173.16 1tll h PRO 3006N 2.50 0.15 -0.09 -1.46 0.11 -1.95 0.35 132.00 131.62 1tll h PRO 3006Ca -0.50 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.60 1tll h PRO 3006Cb 1.27 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.34 1tll h PRO 3006CO 0.62 0.10 0.00 1.63 -0.21 0.00 0.00 178.00 180.14 1tll n LYS 3007N -4.43 0.73 -3.28 1.05 5.02 -1.26 -4.75 118.16 111.24 1tll n LYS 3007Ca 0.09 0.00 -0.31 0.00 -2.02 0.00 0.00 58.31 56.07 1tll n LYS 3007Cb 0.49 -1.04 -0.05 0.00 -0.02 0.00 0.00 35.03 34.41 1tll n LYS 3007CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 1tll s SER 3008N -1.15 6.60 -0.06 4.39 0.15 0.12 -4.98 113.70 118.78 1tll s SER 3008Ca 0.00 0.97 -0.06 0.00 0.70 0.00 0.00 55.95 57.56 1tll s SER 3008Cb 0.00 -2.25 -0.28 0.00 -1.71 0.00 0.00 66.02 61.78 1tll s SER 3008CO 0.00 -0.16 0.62 0.77 1.20 0.00 0.00 173.24 175.67 1tll h SER 3009N 2.16 0.45 -2.76 5.45 4.64 -1.86 -3.47 113.55 118.17 1tll h SER 3009Ca -0.47 -0.77 -0.08 0.00 -0.47 0.00 0.00 61.79 60.00 1tll h SER 3009Cb 1.18 -0.15 0.03 0.00 -0.31 0.00 0.00 62.40 63.15 1tll h SER 3009CO 0.67 1.66 0.06 0.54 -0.87 0.00 0.00 176.83 178.89 1tll n ARG 3010N -3.48 -0.00 -3.62 4.77 1.74 -1.26 -5.12 116.66 109.68 1tll n ARG 3010Ca -0.24 -0.41 -0.10 0.00 -0.77 0.00 0.00 57.85 56.33 1tll n ARG 3010Cb 1.06 -0.21 -0.07 0.00 -1.02 0.00 0.00 32.46 32.23 1tll n ARG 3010CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 1tll s SER 3011N -1.83 -0.43 0.01 0.55 0.15 -1.26 -4.98 113.70 105.91 1tll s SER 3011Ca 0.13 0.74 0.02 0.00 0.70 0.00 0.00 55.95 57.54 1tll s SER 3011Cb -0.00 0.72 -0.01 0.00 -1.71 0.00 0.00 66.02 65.02 1tll s SER 3011CO 0.09 -0.20 -0.07 -0.89 1.20 0.00 0.00 173.24 173.37 1tll s THR 3012N -0.14 0.55 0.17 6.45 2.01 -1.26 -1.45 115.64 121.97 1tll s THR 3012Ca 0.02 -0.45 0.10 0.00 0.31 0.00 0.00 61.69 61.67 1tll s THR 3012Cb -0.04 -0.49 -0.04 0.00 0.01 0.00 0.00 72.50 71.94 1tll s THR 3012CO -0.04 0.05 -0.23 0.27 -0.69 0.00 0.00 174.62 173.98 1tll s ILE 3013N -0.39 2.16 -0.20 1.82 -4.36 -0.06 -1.27 121.20 118.90 1tll s ILE 3013Ca 0.00 -1.91 -0.09 0.00 -0.26 0.00 0.00 60.65 58.39 1tll s ILE 3013Cb -0.04 -1.98 -0.05 0.00 1.25 0.00 0.00 42.46 41.64 1tll s ILE 3013CO -0.00 -0.11 0.12 0.12 0.24 0.00 0.00 174.94 175.30 1tll s PHE 3014N -1.58 3.37 -0.09 1.37 5.36 0.18 -1.35 117.98 125.24 1tll s PHE 3014Ca 0.17 0.27 0.03 0.00 -0.96 0.00 0.00 56.93 56.44 1tll s PHE 3014Cb -0.08 -2.15 0.01 0.00 -0.34 0.00 0.00 43.02 40.46 1tll s PHE 3014CO 0.08 0.25 -0.19 0.08 -1.46 0.00 0.00 175.22 173.99 1tll s VAL 3015N 0.39 1.65 -0.18 3.12 1.01 -0.15 -1.58 120.40 124.65 1tll s VAL 3015Ca 0.07 -0.78 -0.01 0.00 0.00 0.00 0.00 61.98 61.26 1tll s VAL 3015Cb -0.11 -1.46 0.00 0.00 0.00 0.00 0.00 36.38 34.81 1tll s VAL 3015CO -0.01 0.47 -0.13 -0.13 0.00 0.00 0.00 175.10 175.30 1tll s ARG 3016N 0.52 3.22 0.04 2.72 0.52 0.29 -0.32 118.95 125.94 1tll s ARG 3016Ca -0.16 -0.73 0.08 0.00 -0.52 0.00 0.00 55.73 54.40 1tll s ARG 3016Cb -0.17 -2.73 -0.03 0.00 0.52 0.00 0.00 34.95 32.54 1tll s ARG 3016CO 0.06 -0.09 -0.20 -0.51 0.02 0.00 0.00 175.30 174.58 1tll s LEU 3017N 1.09 2.51 -0.22 2.53 1.43 0.16 0.68 118.68 126.86 1tll s LEU 3017Ca 0.00 -0.46 -0.09 0.00 -1.03 0.00 0.00 54.13 52.55 1tll s LEU 3017Cb -0.14 -1.47 -0.04 0.00 0.03 0.00 0.00 46.19 44.57 1tll s LEU 3017CO -0.04 0.26 0.12 -2.28 0.23 0.00 0.00 176.35 174.63 1tll s HIS 3018N -0.90 3.27 -0.56 0.29 5.65 0.30 -0.74 115.29 122.59 1tll s HIS 3018Ca 0.14 0.09 0.24 0.00 0.25 0.00 0.00 55.06 55.79 1tll s HIS 3018Cb -0.10 -2.20 0.53 0.00 -1.18 0.00 0.00 32.58 29.62 1tll s HIS 3018CO 0.05 0.04 1.67 1.15 -0.65 0.00 0.00 174.74 177.00 1tll h THR 3019N 5.03 0.00 -5.02 0.89 2.02 -1.68 -2.13 112.91 112.03 1tll h THR 3019Ca -0.38 -0.78 -0.28 0.00 0.77 0.00 0.00 66.41 65.74 1tll h THR 3019Cb 1.17 1.78 0.14 0.00 -1.74 0.00 0.00 68.15 69.49 1tll h THR 3019CO 0.66 0.00 -0.63 0.59 0.37 0.00 0.00 175.52 176.52 1tll n ASN 3020N -2.75 -2.56 0.00 4.18 5.03 -1.26 -2.67 115.26 115.23 1tll n ASN 3020Ca 0.05 -0.50 0.00 0.00 0.87 0.00 0.00 54.58 54.99 1tll n ASN 3020Cb 0.49 -4.32 0.00 0.00 -1.02 0.00 0.00 39.78 34.93 1tll n ASN 3020CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1tll n GLY 3021N -1.20 0.00 3.55 7.41 0.00 -1.26 -4.87 105.19 108.82 1tll n GLY 3021Ca -0.20 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.45 1tll n GLY 3021CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1tll n ASN 3022N -0.20 2.22 -0.13 1.61 4.05 -1.09 -4.87 115.26 116.85 1tll n ASN 3022Ca 0.00 -0.45 0.21 0.00 0.45 0.00 0.00 54.58 54.79 1tll n ASN 3022Cb 0.39 -1.55 0.63 0.00 1.23 0.00 0.00 39.78 40.48 1tll n ASN 3022CO 0.00 0.00 0.00 0.06 -3.05 0.00 0.00 177.26 174.27 1tll h GLN 3023N 19.08 0.16 0.00 1.20 -0.00 -1.91 0.36 115.11 134.00 1tll h GLN 3023Ca -0.23 -0.01 -0.00 0.00 -0.00 0.00 0.00 58.65 58.41 1tll h GLN 3023Cb 1.27 -0.04 -0.00 0.00 -0.00 0.00 0.00 27.48 28.72 1tll h GLN 3023CO 1.17 0.11 -0.01 0.93 -0.00 0.00 0.00 178.83 181.03 1tll h GLU 3024N 0.17 0.00 -0.89 0.06 5.08 -1.98 -2.84 114.58 114.18 1tll h GLU 3024Ca 0.37 0.00 -0.54 0.00 -1.00 0.00 0.00 59.36 58.20 1tll h GLU 3024Cb 1.22 0.00 -0.28 0.00 0.50 0.00 0.00 28.75 30.18 1tll h GLU 3024CO -0.06 0.01 0.52 1.28 -1.00 0.00 0.00 179.01 179.76 1tll n LEU 3025N -3.18 6.60 -4.75 1.33 4.77 0.13 -4.58 117.00 117.32 1tll n LEU 3025Ca -0.02 -3.99 -0.40 0.00 -0.03 0.00 0.00 56.01 51.57 1tll n LEU 3025Cb 0.14 -0.83 -0.05 0.00 -2.33 0.00 0.00 43.42 40.35 1tll n LEU 3025CO 0.23 1.33 0.47 -1.10 -1.33 0.00 0.00 177.39 176.98 1tll s GLN 3026N -3.52 4.50 0.22 3.23 -1.52 -1.07 -5.01 119.66 116.49 1tll s GLN 3026Ca 0.58 1.08 -0.05 0.00 -1.95 0.00 0.00 55.36 55.01 1tll s GLN 3026Cb 0.48 -3.34 -0.03 0.00 -0.22 0.00 0.00 33.01 29.89 1tll s GLN 3026CO 0.04 0.34 0.26 1.52 -0.25 0.00 0.00 175.29 177.20 1tll s TYR 3027N -0.25 0.90 0.12 0.91 -0.85 -1.26 -4.97 117.35 111.95 1tll s TYR 3027Ca 0.38 -1.16 0.09 0.00 -0.52 0.00 0.00 57.07 55.86 1tll s TYR 3027Cb -0.21 -0.30 -0.04 0.00 0.38 0.00 0.00 41.96 41.80 1tll s TYR 3027CO 0.23 -0.78 -0.21 -0.65 -1.52 0.00 0.00 175.55 172.63 1tll s GLN 3028N -4.07 1.19 0.25 -3.49 -0.21 -1.26 -4.75 119.66 107.31 1tll s GLN 3028Ca 0.33 -1.24 -0.30 0.00 0.02 0.00 0.00 55.36 54.17 1tll s GLN 3028Cb 0.04 -1.43 -0.14 0.00 1.00 0.00 0.00 33.01 32.48 1tll s GLN 3028CO 0.11 0.32 1.26 -2.30 -2.12 0.00 0.00 175.29 172.57 1tll n PRO 3029N 0.89 1.75 0.00 2.91 -0.02 -1.26 -1.65 135.00 137.62 1tll n PRO 3029Ca -0.18 0.62 0.00 0.00 -2.02 0.00 0.00 63.50 61.92 1tll n PRO 3029Cb 0.54 -2.18 0.00 0.00 -0.02 0.00 0.00 33.50 31.84 1tll n PRO 3029CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1tll n GLY 3030N 1.71 2.75 3.86 -1.23 0.00 -1.26 -4.47 105.19 106.54 1tll n GLY 3030Ca 0.11 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.82 1tll n GLY 3030CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1tll s ASP 3031N -1.37 6.05 0.24 1.61 -0.00 -0.66 -4.44 116.67 118.09 1tll s ASP 3031Ca 0.00 1.42 0.08 0.00 -0.00 0.00 0.00 52.55 54.05 1tll s ASP 3031Cb 0.00 -2.43 -0.04 0.00 -0.00 0.00 0.00 42.92 40.45 1tll s ASP 3031CO 0.00 -0.99 0.07 -1.00 -0.00 0.00 0.00 175.17 173.25 1tll s HIS 3032N -3.18 2.88 -0.18 4.23 3.76 -0.77 -1.62 115.29 120.41 1tll s HIS 3032Ca 0.56 -0.16 -0.01 0.00 -0.15 0.00 0.00 55.06 55.30 1tll s HIS 3032Cb -0.11 -1.31 0.00 0.00 1.11 0.00 0.00 32.58 32.27 1tll s HIS 3032CO 0.54 0.56 -0.13 -1.17 -0.85 0.00 0.00 174.74 173.69 1tll s LEU 3033N -3.57 2.49 -0.18 0.89 2.96 0.55 -1.10 118.68 120.71 1tll s LEU 3033Ca 0.31 -0.50 -0.21 0.00 -0.22 0.00 0.00 54.13 53.51 1tll s LEU 3033Cb -0.08 -1.59 -0.03 0.00 0.50 0.00 0.00 46.19 45.00 1tll s LEU 3033CO 0.22 0.03 0.62 -0.83 -1.32 0.00 0.00 176.35 175.06 1tll s GLY 3034N 1.17 2.11 -0.07 7.98 0.00 0.71 -1.13 107.32 118.07 1tll s GLY 3034Ca 0.01 -0.25 0.04 0.00 0.00 0.00 0.00 44.72 44.52 1tll s GLY 3034CO -0.05 1.26 -0.18 0.14 0.00 0.00 0.00 173.10 174.27 1tll s VAL 3035N 1.75 2.69 -0.37 1.40 1.01 0.69 -0.81 120.40 126.76 1tll s VAL 3035Ca 0.29 -0.83 -0.11 0.00 0.00 0.00 0.00 61.98 61.32 1tll s VAL 3035Cb -0.16 -2.05 0.02 0.00 0.00 0.00 0.00 36.38 34.19 1tll s VAL 3035CO 0.11 0.57 0.21 -0.36 0.00 0.00 0.00 175.10 175.62 1tll s PHE 3036N -0.25 3.23 0.50 5.22 0.08 -0.53 -0.15 117.98 126.09 1tll s PHE 3036Ca 0.00 -0.83 -0.01 0.00 0.12 0.00 0.00 56.93 56.21 1tll s PHE 3036Cb -0.13 -2.44 0.10 0.00 -0.57 0.00 0.00 43.02 39.98 1tll s PHE 3036CO 0.03 -0.60 0.69 -0.35 -0.10 0.00 0.00 175.22 174.89 1tll n PRO 3037N 5.01 0.08 -5.25 0.24 -0.04 -1.26 -4.39 135.00 129.40 1tll n PRO 3037Ca -0.12 -1.84 -0.31 0.00 -0.04 0.00 0.00 63.50 61.19 1tll n PRO 3037Cb 0.47 -0.47 -0.16 0.00 -0.04 0.00 0.00 33.50 33.29 1tll n PRO 3037CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 1tll s GLY 3038N -4.27 1.27 0.73 0.55 0.00 -1.26 -4.67 107.32 99.67 1tll s GLY 3038Ca 0.45 -1.04 -0.12 0.00 0.00 0.00 0.00 44.72 44.01 1tll s GLY 3038CO 0.30 -0.66 1.10 -1.31 0.00 0.00 0.00 173.10 172.53 1tll s ASN 3039N -0.20 4.71 0.46 1.64 0.01 0.58 -4.76 114.94 117.38 1tll s ASN 3039Ca -0.02 1.91 -0.24 0.00 -0.71 0.00 0.00 52.86 53.79 1tll s ASN 3039Cb -0.13 -2.54 -0.08 0.00 0.41 0.00 0.00 41.25 38.92 1tll s ASN 3039CO 0.03 -1.90 1.36 -2.28 -1.51 0.00 0.00 177.10 172.80 1tll s HIS 3040N -2.66 2.55 0.15 2.20 2.46 -1.26 -4.86 115.29 113.87 1tll s HIS 3040Ca 0.64 1.35 -0.14 0.00 0.47 0.00 0.00 55.06 57.38 1tll s HIS 3040Cb -0.19 -3.78 0.03 0.00 -0.13 0.00 0.00 32.58 28.51 1tll s HIS 3040CO 0.50 -2.59 1.70 0.93 -2.47 0.00 0.00 174.74 172.81 1tll h GLU 3041N 2.20 0.73 -0.90 2.88 5.08 -1.99 -2.28 114.58 120.30 1tll h GLU 3041Ca -0.50 -0.13 0.11 0.00 -1.00 0.00 0.00 59.36 57.84 1tll h GLU 3041Cb 1.27 -0.12 -0.08 0.00 0.50 0.00 0.00 28.75 30.32 1tll h GLU 3041CO 0.61 0.65 0.53 -0.44 -1.00 0.00 0.00 179.01 179.36 1tll h ASP 3042N 0.65 0.76 0.87 1.42 3.45 -1.98 0.21 116.42 121.80 1tll h ASP 3042Ca 0.16 0.05 -0.10 0.00 0.43 0.00 0.00 57.03 57.58 1tll h ASP 3042Cb 0.19 -0.09 -0.01 0.00 -0.56 0.00 0.00 39.33 38.85 1tll h ASP 3042CO -0.01 0.41 -0.46 -0.07 -1.57 0.00 0.00 179.24 177.53 1tll h LEU 3043N 0.86 0.00 -0.10 1.55 3.38 -1.91 -1.71 115.31 117.38 1tll h LEU 3043Ca 0.45 0.00 -0.24 0.00 0.09 0.00 0.00 57.88 58.18 1tll h LEU 3043Cb 0.45 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.21 1tll h LEU 3043CO -0.27 0.46 -0.88 0.58 0.09 0.00 0.00 178.44 178.43 1tll h VAL 3044N 0.00 1.28 0.00 1.22 2.07 -0.32 -2.77 116.25 117.73 1tll h VAL 3044Ca -0.00 -2.07 -0.06 0.00 0.82 0.00 0.00 66.70 65.39 1tll h VAL 3044Cb 1.02 2.13 -0.01 0.00 -1.52 0.00 0.00 31.29 32.92 1tll h VAL 3044CO 0.06 0.65 -0.27 0.78 0.02 0.00 0.00 177.57 178.81 1tll h ASN 3045N 0.48 0.00 1.03 0.57 2.35 -0.66 -2.21 115.58 117.14 1tll h ASN 3045Ca -0.08 0.00 -0.17 0.00 -0.55 0.00 0.00 56.30 55.50 1tll h ASN 3045Cb 1.52 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 39.86 1tll h ASN 3045CO 0.18 0.27 -0.81 0.00 -1.65 0.00 0.00 177.43 175.42 1tll h ALA 3046N 1.73 0.55 0.02 -0.83 0.00 -1.35 -2.23 119.26 117.15 1tll h ALA 3046Ca -0.00 -0.74 -0.22 0.00 0.00 0.00 0.00 54.91 53.95 1tll h ALA 3046Cb 1.13 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.79 1tll h ALA 3046CO 0.04 1.01 -0.97 1.25 0.00 0.00 0.00 179.25 180.58 1tll h LEU 3047N 0.00 0.44 -0.14 0.00 5.85 -1.36 -3.03 115.31 117.06 1tll h LEU 3047Ca -0.01 -0.37 -0.24 0.00 0.84 0.00 0.00 57.88 58.11 1tll h LEU 3047Cb 1.54 -0.14 0.01 0.00 0.37 0.00 0.00 40.66 42.44 1tll h LEU 3047CO 0.11 1.18 -0.94 0.40 -0.34 0.00 0.00 178.44 178.85 1tll h ILE 3048N 0.17 1.35 0.00 4.05 2.04 -1.36 -3.13 117.51 120.62 1tll h ILE 3048Ca -0.08 -2.30 0.00 0.00 1.00 0.00 0.00 64.86 63.48 1tll h ILE 3048Cb 1.62 2.33 0.00 0.00 -0.74 0.00 0.00 36.82 40.02 1tll h ILE 3048CO 0.16 0.70 0.00 1.21 0.00 0.00 0.00 178.15 180.22 1tll n GLU 3049N -3.81 0.04 -0.01 2.37 0.00 -0.84 -1.77 120.64 116.62 1tll n GLU 3049Ca -0.08 0.18 0.09 0.00 0.00 0.00 0.00 57.16 57.36 1tll n GLU 3049Cb 0.83 -1.56 0.08 0.00 0.00 0.00 0.00 31.44 30.79 1tll n GLU 3049CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.13 175.00 1tll n ARG 3050N -1.64 1.61 -2.85 5.31 3.00 -1.15 -4.97 116.66 115.98 1tll n ARG 3050Ca 0.05 -1.63 -0.39 0.00 -0.00 0.00 0.00 57.85 55.87 1tll n ARG 3050Cb 0.25 -1.36 -0.06 0.00 0.00 0.00 0.00 32.46 31.29 1tll n ARG 3050CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.63 176.46 1tll s LEU 3051N -1.51 4.53 -0.12 6.15 2.96 -0.73 -4.63 118.68 125.34 1tll s LEU 3051Ca 0.22 1.80 -0.07 0.00 -0.22 0.00 0.00 54.13 55.86 1tll s LEU 3051Cb 0.16 -3.63 -0.05 0.00 0.50 0.00 0.00 46.19 43.16 1tll s LEU 3051CO 0.23 0.10 0.11 -0.08 -1.32 0.00 0.00 176.35 175.40 1tll h GLU 3052N 3.88 0.00 -6.13 1.98 4.81 0.25 -3.47 114.58 115.90 1tll h GLU 3052Ca -0.46 0.00 -0.56 0.00 -0.13 0.00 0.00 59.36 58.20 1tll h GLU 3052Cb 1.20 0.00 0.22 0.00 0.63 0.00 0.00 28.75 30.80 1tll h GLU 3052CO 0.66 0.20 -1.42 -3.47 -0.73 0.00 0.00 179.01 174.26 1tll n ASP 3053N -4.72 -4.59 -0.05 1.04 -0.08 -1.21 -4.93 116.55 102.02 1tll n ASP 3053Ca -0.04 0.36 0.11 0.00 -1.51 0.00 0.00 54.79 53.71 1tll n ASP 3053Cb 0.14 -0.87 0.04 0.00 2.34 0.00 0.00 41.12 42.77 1tll n ASP 3053CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1tll n ALA 3054N -2.31 4.18 -1.30 -1.67 0.00 -1.26 -4.78 120.51 113.37 1tll n ALA 3054Ca 0.03 -0.51 -0.57 0.00 0.00 0.00 0.00 53.44 52.38 1tll n ALA 3054Cb 0.53 -0.91 -0.11 0.00 0.00 0.00 0.00 19.45 18.96 1tll n ALA 3054CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 1tll n PRO 3055N -1.33 0.20 -0.94 0.00 -0.02 -1.26 -4.88 135.00 126.77 1tll n PRO 3055Ca 0.05 0.05 -0.34 0.00 -2.02 0.00 0.00 63.50 61.25 1tll n PRO 3055Cb 0.34 -1.69 0.11 0.00 -0.02 0.00 0.00 33.50 32.24 1tll n PRO 3055CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 1tll n PRO 3056N 7.68 -0.10 0.06 0.52 -0.02 -1.26 -4.86 135.00 137.03 1tll n PRO 3056Ca 0.53 0.02 0.12 0.00 -2.02 0.00 0.00 63.50 62.15 1tll n PRO 3056Cb 0.02 -1.88 0.28 0.00 -0.02 0.00 0.00 33.50 31.90 1tll n PRO 3056CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1tll n ALA 3057N -3.24 2.75 0.32 3.55 0.00 -1.26 -3.87 120.51 118.76 1tll n ALA 3057Ca 0.08 -0.18 0.11 0.00 0.00 0.00 0.00 53.44 53.45 1tll n ALA 3057Cb 0.52 -1.28 0.27 0.00 0.00 0.00 0.00 19.45 18.96 1tll n ALA 3057CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 1tll n ASN 3058N -2.05 3.09 -4.64 0.00 6.94 -1.26 -3.53 115.26 113.82 1tll n ASN 3058Ca 0.04 -1.96 -0.34 0.00 -0.02 0.00 0.00 54.58 52.30 1tll n ASN 3058Cb 0.42 -0.31 -0.10 0.00 -2.36 0.00 0.00 39.78 37.43 1tll n ASN 3058CO 0.00 0.00 0.00 -1.00 -1.03 0.00 0.00 177.26 175.23 1tll s HIS 3059N -1.38 3.07 0.07 -2.53 3.76 -1.25 -4.97 115.29 112.06 1tll s HIS 3059Ca 0.39 0.10 -0.30 0.00 -0.15 0.00 0.00 55.06 55.10 1tll s HIS 3059Cb 0.21 -1.77 -0.05 0.00 1.11 0.00 0.00 32.58 32.08 1tll s HIS 3059CO 0.29 0.39 1.11 0.08 -0.85 0.00 0.00 174.74 175.76 1tll s VAL 3060N -0.78 4.25 0.32 -0.90 1.01 -1.26 -3.95 120.40 119.10 1tll s VAL 3060Ca 0.12 1.68 0.06 0.00 0.00 0.00 0.00 61.98 63.84 1tll s VAL 3060Cb -0.11 -4.08 -0.03 0.00 0.00 0.00 0.00 36.38 32.16 1tll s VAL 3060CO 0.02 0.17 0.24 0.68 0.00 0.00 0.00 175.10 176.21 1tll s VAL 3061N 0.75 0.05 0.06 2.92 -7.23 -0.80 -2.36 120.40 113.80 1tll s VAL 3061Ca 0.55 -2.00 -0.09 0.00 -1.81 0.00 0.00 61.98 58.62 1tll s VAL 3061Cb -0.27 -2.49 0.00 0.00 0.56 0.00 0.00 36.38 34.19 1tll s VAL 3061CO 0.30 0.00 0.20 -0.75 -0.31 0.00 0.00 175.10 174.54 1tll s LYS 3062N -3.57 0.77 -0.30 4.82 2.20 -0.99 -1.87 119.74 120.79 1tll s LYS 3062Ca 0.39 -0.79 -0.08 0.00 -0.36 0.00 0.00 55.97 55.14 1tll s LYS 3062Cb 0.03 0.32 0.01 0.00 -1.51 0.00 0.00 37.83 36.67 1tll s LYS 3062CO 0.24 -0.23 0.10 0.08 -0.36 0.00 0.00 175.35 175.18 1tll s VAL 3063N -3.19 4.12 0.06 4.02 1.01 -1.26 -2.10 120.40 123.05 1tll s VAL 3063Ca -0.00 -0.66 0.00 0.00 0.00 0.00 0.00 61.98 61.32 1tll s VAL 3063Cb 0.02 -3.13 -0.04 0.00 0.00 0.00 0.00 36.38 33.23 1tll s VAL 3063CO -0.07 0.05 0.18 -1.61 0.00 0.00 0.00 175.10 173.65 1tll s GLU 3064N 1.52 3.33 0.06 2.72 2.02 -0.14 0.76 118.70 128.96 1tll s GLU 3064Ca 0.03 -0.48 0.06 0.00 0.02 0.00 0.00 54.97 54.60 1tll s GLU 3064Cb -0.17 -2.98 -0.03 0.00 0.10 0.00 0.00 34.13 31.05 1tll s GLU 3064CO 0.03 0.61 -0.17 0.00 0.02 0.00 0.00 175.26 175.75 1tll s MET 3065N -2.42 1.09 -0.31 1.61 0.23 0.13 -1.53 119.30 118.09 1tll s MET 3065Ca 0.33 -0.91 -0.29 0.00 -1.03 0.00 0.00 55.69 53.79 1tll s MET 3065Cb -0.13 -1.17 0.01 0.00 -1.53 0.00 0.00 34.83 32.01 1tll s MET 3065CO 0.26 0.29 1.13 -1.17 -2.03 0.00 0.00 175.02 173.50 1tll s LEU 3066N -1.36 3.93 -0.37 0.18 2.96 0.46 -1.15 118.68 123.33 1tll s LEU 3066Ca 0.04 1.11 -0.12 0.00 -0.22 0.00 0.00 54.13 54.93 1tll s LEU 3066Cb -0.09 -3.54 0.01 0.00 0.50 0.00 0.00 46.19 43.07 1tll s LEU 3066CO 0.02 -0.92 0.23 -0.70 -1.32 0.00 0.00 176.35 173.66 1tll s GLU 3067N 3.77 3.07 -0.04 1.98 2.12 -0.38 -4.94 118.70 124.27 1tll s GLU 3067Ca 0.48 -0.93 0.04 0.00 0.36 0.00 0.00 54.97 54.92 1tll s GLU 3067Cb -0.13 -3.79 -0.03 0.00 0.26 0.00 0.00 34.13 30.44 1tll s GLU 3067CO 0.17 -0.63 -0.15 -1.83 -0.54 0.00 0.00 175.26 172.28 1tll s GLU 3068N 1.63 2.44 -0.33 4.30 -1.05 -1.26 -1.66 118.70 122.77 1tll s GLU 3068Ca 0.04 -0.73 0.02 0.00 -0.15 0.00 0.00 54.97 54.15 1tll s GLU 3068Cb -0.18 -2.34 0.10 0.00 -0.44 0.00 0.00 34.13 31.27 1tll s GLU 3068CO 0.08 0.61 0.07 0.50 0.95 0.00 0.00 175.26 177.48 1tll s ARG 3069N -0.77 1.15 0.81 -4.83 3.52 -0.69 -4.99 118.95 113.14 1tll s ARG 3069Ca 0.12 -1.53 -0.17 0.00 -0.13 0.00 0.00 55.73 54.02 1tll s ARG 3069Cb -0.11 -2.68 -0.11 0.00 -1.56 0.00 0.00 34.95 30.50 1tll s ARG 3069CO 0.01 -0.96 -0.24 -1.71 -0.81 0.00 0.00 175.30 171.59 1tll n ASN 3070N 4.50 -4.06 -0.28 -2.12 2.85 -1.26 -2.09 115.26 112.80 1tll n ASN 3070Ca 0.01 0.40 0.00 0.00 -0.11 0.00 0.00 54.58 54.88 1tll n ASN 3070Cb 0.42 -0.92 0.00 0.00 1.24 0.00 0.00 39.78 40.52 1tll n ASN 3070CO 0.00 0.00 0.00 0.35 -2.11 0.00 0.00 177.26 175.50 1tll n THR 3071N -2.35 0.00 0.45 -0.44 -2.24 0.07 -4.72 114.28 105.06 1tll n THR 3071Ca 0.04 0.00 0.12 0.00 -2.27 0.00 0.00 64.05 61.94 1tll n THR 3071Cb 0.52 0.00 0.11 0.00 -2.10 0.00 0.00 70.33 68.86 1tll n THR 3071CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1tll h ALA 3072N 1.00 0.53 -0.06 6.98 0.00 -2.01 -3.38 119.26 122.33 1tll h ALA 3072Ca 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 54.91 54.75 1tll h ALA 3072Cb 0.00 0.00 -0.33 0.00 0.00 0.00 0.00 17.79 17.46 1tll h ALA 3072CO 0.00 0.00 -0.96 1.28 0.00 0.00 0.00 179.25 179.57 1tll n LEU 3073N -2.25 1.41 0.00 0.00 4.77 -1.26 -5.10 117.00 114.57 1tll n LEU 3073Ca 0.02 -2.46 0.00 0.00 -0.03 0.00 0.00 56.01 53.54 1tll n LEU 3073Cb 0.47 -0.05 0.00 0.00 -2.33 0.00 0.00 43.42 41.51 1tll n LEU 3073CO 0.38 0.73 0.00 0.61 -1.33 0.00 0.00 177.39 177.78 1tll n GLY 3074N 0.11 0.40 3.11 -0.72 0.00 -1.26 -5.12 105.19 101.71 1tll n GLY 3074Ca 0.09 -1.23 -0.11 0.00 0.00 0.00 0.00 46.02 44.77 1tll n GLY 3074CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1tll s VAL 3075N -4.00 0.08 -0.33 1.61 -7.23 -1.26 -0.75 120.40 108.52 1tll s VAL 3075Ca 0.00 -0.70 -0.07 0.00 -1.81 0.00 0.00 61.98 59.40 1tll s VAL 3075Cb 0.00 -0.45 0.03 0.00 0.56 0.00 0.00 36.38 36.51 1tll s VAL 3075CO 0.00 -0.38 0.12 -0.51 -0.31 0.00 0.00 175.10 174.01 1tll s ILE 3076N -1.43 4.01 0.25 -0.62 2.07 -0.89 -4.94 121.20 119.66 1tll s ILE 3076Ca -0.14 -0.91 0.01 0.00 -1.41 0.00 0.00 60.65 58.20 1tll s ILE 3076Cb -0.07 -3.19 -0.04 0.00 0.13 0.00 0.00 42.46 39.28 1tll s ILE 3076CO 0.02 -0.09 0.14 -0.94 -1.91 0.00 0.00 174.94 172.15 1tll s SER 3077N 1.47 0.90 -0.09 4.50 1.04 -1.26 -1.71 113.70 118.55 1tll s SER 3077Ca 0.01 -1.45 -0.31 0.00 0.48 0.00 0.00 55.95 54.68 1tll s SER 3077Cb -0.19 0.33 0.09 0.00 0.10 0.00 0.00 66.02 66.35 1tll s SER 3077CO 0.03 -0.83 0.79 0.54 0.98 0.00 0.00 173.24 174.75 1tll s ASN 3078N -3.27 -0.56 -0.51 7.02 2.20 -0.67 -5.02 114.94 114.13 1tll s ASN 3078Ca 0.38 0.63 -0.25 0.00 -0.94 0.00 0.00 52.86 52.68 1tll s ASN 3078Cb 0.06 0.48 0.03 0.00 -2.00 0.00 0.00 41.25 39.83 1tll s ASN 3078CO 0.15 -0.51 0.93 0.26 -2.94 0.00 0.00 177.10 174.99 1tll s TRP 3079N -1.12 2.85 0.11 1.54 0.52 -1.26 -1.25 118.94 120.33 1tll s TRP 3079Ca -0.08 0.17 0.01 0.00 0.02 0.00 0.00 56.10 56.22 1tll s TRP 3079Cb -0.00 -4.01 -0.04 0.00 -1.15 0.00 0.00 33.47 28.27 1tll s TRP 3079CO 0.07 -1.23 0.26 0.15 0.02 0.00 0.00 176.95 176.22 1tll s LYS 3080N 3.85 3.46 0.23 4.98 -0.14 -0.30 -4.84 119.74 126.96 1tll s LYS 3080Ca 0.33 -0.47 -0.30 0.00 -1.36 0.00 0.00 55.97 54.17 1tll s LYS 3080Cb -0.11 -2.98 -0.10 0.00 -1.68 0.00 0.00 37.83 32.96 1tll s LYS 3080CO 0.23 0.55 1.39 -0.51 -0.76 0.00 0.00 175.35 176.25 1tll s ASP 3081N -2.85 6.75 0.16 2.83 -0.00 -1.26 0.19 116.67 122.49 1tll s ASP 3081Ca 0.35 2.56 -0.15 0.00 -0.00 0.00 0.00 52.55 55.31 1tll s ASP 3081Cb -0.12 -2.62 0.05 0.00 -0.00 0.00 0.00 42.92 40.23 1tll s ASP 3081CO 0.28 -0.64 1.82 -0.08 -0.00 0.00 0.00 175.17 176.55 1tll h GLU 3082N 5.24 0.58 -3.80 8.23 4.81 0.05 -3.44 114.58 126.24 1tll h GLU 3082Ca -0.45 -0.03 -0.23 0.00 -0.13 0.00 0.00 59.36 58.51 1tll h GLU 3082Cb 1.22 -0.13 0.08 0.00 0.63 0.00 0.00 28.75 30.55 1tll h GLU 3082CO 0.78 0.38 -0.40 0.45 -0.73 0.00 0.00 179.01 179.50 1tll n SER 3083N -4.79 -4.56 -0.09 1.04 2.88 -1.26 -4.92 113.62 101.91 1tll n SER 3083Ca 0.02 -0.31 -0.17 0.00 -1.33 0.00 0.00 58.87 57.07 1tll n SER 3083Cb 0.04 -3.15 -0.07 0.00 -0.75 0.00 0.00 64.21 60.27 1tll n SER 3083CO 0.00 0.00 0.00 -1.14 -1.23 0.00 0.00 175.04 172.67 1tll n ARG 3084N -3.12 0.42 -4.12 -1.46 0.63 -1.26 -4.99 116.66 102.75 1tll n ARG 3084Ca 0.00 0.15 -0.22 0.00 -0.92 0.00 0.00 57.85 56.86 1tll n ARG 3084Cb 0.54 -1.25 -0.05 0.00 0.45 0.00 0.00 32.46 32.14 1tll n ARG 3084CO 0.00 0.00 0.00 -0.51 -2.51 0.00 0.00 177.63 174.61 1tll s LEU 3085N -6.64 3.69 0.61 6.15 1.43 -1.26 -4.61 118.68 118.05 1tll s LEU 3085Ca -0.26 -0.34 0.00 0.00 -1.03 0.00 0.00 54.13 52.50 1tll s LEU 3085Cb 0.09 -2.22 0.06 0.00 0.03 0.00 0.00 46.19 44.14 1tll s LEU 3085CO 0.37 -0.06 0.85 -2.16 0.23 0.00 0.00 176.35 175.58 1tll s PRO 3086N -3.83 2.30 0.08 1.29 0.04 -1.26 -4.90 135.00 128.72 1tll s PRO 3086Ca 0.33 -0.82 -0.31 0.00 0.04 0.00 0.00 61.00 60.24 1tll s PRO 3086Cb -0.07 -2.42 -0.08 0.00 0.04 0.00 0.00 34.50 31.97 1tll s PRO 3086CO 0.24 -0.94 1.47 -2.14 0.04 0.00 0.00 177.00 175.67 1tll s PRO 3087N -4.90 4.27 0.18 0.56 0.02 -1.26 -4.88 135.00 129.00 1tll s PRO 3087Ca 0.60 2.13 -0.23 0.00 0.02 0.00 0.00 61.00 63.52 1tll s PRO 3087Cb -0.09 -3.41 0.05 0.00 0.02 0.00 0.00 34.50 31.07 1tll s PRO 3087CO 0.40 -0.56 0.78 0.00 -0.33 0.00 0.00 177.00 177.29 1tll s THR 3089N -3.61 3.47 0.50 0.00 -4.23 -1.25 -1.91 115.64 108.60 1tll s THR 3089Ca 0.08 0.83 0.27 0.00 -1.18 0.00 0.00 61.69 61.69 1tll s THR 3089Cb -0.03 -3.32 0.31 0.00 1.34 0.00 0.00 72.50 70.80 1tll s THR 3089CO -0.01 -0.28 2.15 -0.29 -0.54 0.00 0.00 174.62 175.65 1tll h ILE 3090N 0.95 0.63 -0.41 2.99 2.10 -1.71 -0.57 117.51 121.48 1tll h ILE 3090Ca -0.49 -0.29 -0.06 0.00 1.08 0.00 0.00 64.86 65.10 1tll h ILE 3090Cb 1.24 1.18 -0.02 0.00 -1.09 0.00 0.00 36.82 38.14 1tll h ILE 3090CO 0.57 0.07 0.03 0.15 -1.08 0.00 0.00 178.15 177.89 1tll h PHE 3091N 0.00 0.77 0.00 2.19 3.57 -1.91 -2.58 116.94 118.98 1tll h PHE 3091Ca -0.00 -0.12 -0.07 0.00 3.53 0.00 0.00 57.97 61.30 1tll h PHE 3091Cb 0.18 -0.20 -0.01 0.00 2.79 0.00 0.00 35.95 38.70 1tll h PHE 3091CO 0.00 0.76 -0.35 1.96 -2.23 0.00 0.00 178.31 178.45 1tll h GLN 3092N 0.55 0.00 -0.03 1.11 4.20 -1.43 0.57 115.11 120.09 1tll h GLN 3092Ca 0.12 0.00 -0.26 0.00 0.06 0.00 0.00 58.65 58.57 1tll h GLN 3092Cb 0.44 0.00 0.02 0.00 0.30 0.00 0.00 27.48 28.24 1tll h GLN 3092CO 0.02 0.35 -0.99 0.00 -0.67 0.00 0.00 178.83 177.54 1tll h ALA 3093N 1.65 0.18 -0.12 3.87 0.00 -1.21 -1.01 119.26 122.62 1tll h ALA 3093Ca -0.00 -0.68 -0.21 0.00 0.00 0.00 0.00 54.91 54.01 1tll h ALA 3093Cb 0.66 0.04 0.01 0.00 0.00 0.00 0.00 17.79 18.49 1tll h ALA 3093CO 0.05 0.69 -0.78 0.74 0.00 0.00 0.00 179.25 179.95 1tll h PHE 3094N 0.42 0.89 0.09 0.00 0.04 -1.28 0.16 116.94 117.26 1tll h PHE 3094Ca -0.11 -0.40 -0.26 0.00 2.80 0.00 0.00 57.97 60.00 1tll h PHE 3094Cb 1.63 -0.14 0.01 0.00 2.20 0.00 0.00 35.95 39.66 1tll h PHE 3094CO 0.10 1.21 -1.14 -0.22 -0.60 0.00 0.00 178.31 177.66 1tll h LYS 3095N 0.44 0.35 0.00 1.51 3.64 -0.93 -3.39 116.57 118.19 1tll h LYS 3095Ca -0.05 -0.50 0.00 0.00 -1.27 0.00 0.00 60.65 58.83 1tll h LYS 3095Cb 1.39 0.17 0.00 0.00 -0.41 0.00 0.00 32.23 33.38 1tll h LYS 3095CO 0.15 1.19 -0.86 0.66 -2.27 0.00 0.00 179.45 178.32 1tll n TYR 3096N -3.64 0.00 0.03 1.91 4.01 -0.39 -0.31 117.16 118.77 1tll n TYR 3096Ca -0.08 0.00 0.03 0.00 -0.16 0.00 0.00 57.90 57.68 1tll n TYR 3096Cb 0.95 -0.04 -0.04 0.00 -0.31 0.00 0.00 39.34 39.90 1tll n TYR 3096CO 0.00 0.00 0.00 0.66 -0.46 0.00 0.00 176.86 177.06 1tll n TYR 3097N -1.45 0.00 -4.90 -0.72 4.02 -0.55 -4.80 117.16 108.76 1tll n TYR 3097Ca -0.00 0.00 -0.30 0.00 -0.01 0.00 0.00 57.90 57.58 1tll n TYR 3097Cb 0.05 -0.12 -0.14 0.00 -0.02 0.00 0.00 39.34 39.11 1tll n TYR 3097CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 176.86 175.34 1tll s LEU 3098N -3.28 2.23 -0.57 7.72 1.43 0.45 -0.53 118.68 126.13 1tll s LEU 3098Ca -0.02 -0.55 -0.28 0.00 -1.03 0.00 0.00 54.13 52.25 1tll s LEU 3098Cb 0.04 -1.33 0.03 0.00 0.03 0.00 0.00 46.19 44.96 1tll s LEU 3098CO 0.24 0.26 1.18 -0.62 0.23 0.00 0.00 176.35 177.64 1tll s ASP 3099N -1.21 6.45 0.00 2.29 -1.08 0.08 -4.48 116.67 118.73 1tll s ASP 3099Ca 0.12 0.11 0.15 0.00 -0.52 0.00 0.00 52.55 52.41 1tll s ASP 3099Cb -0.10 -2.55 0.41 0.00 -1.46 0.00 0.00 42.92 39.22 1tll s ASP 3099CO 0.02 -1.46 1.33 2.30 0.52 0.00 0.00 175.17 177.89 1tll n ILE 3100N 6.66 0.93 -0.04 4.11 -5.35 -1.26 -4.43 119.36 119.99 1tll n ILE 3100Ca 0.08 -0.97 -0.04 0.00 -0.27 0.00 0.00 62.75 61.55 1tll n ILE 3100Cb 0.49 0.55 -0.05 0.00 -1.74 0.00 0.00 39.64 38.90 1tll n ILE 3100CO 0.00 0.00 0.00 0.35 -1.76 0.00 0.00 176.55 175.14 1tll n THR 3101N 0.92 0.46 -1.80 7.28 -2.24 -1.26 -1.68 114.28 115.97 1tll n THR 3101Ca 0.16 -0.24 -0.42 0.00 -2.27 0.00 0.00 64.05 61.28 1tll n THR 3101Cb 0.49 -0.81 -0.02 0.00 -2.10 0.00 0.00 70.33 67.89 1tll n THR 3101CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 1tll s THR 3102N -2.16 2.13 0.37 4.28 2.01 -1.26 -4.05 115.64 116.96 1tll s THR 3102Ca -0.06 0.11 -0.27 0.00 0.31 0.00 0.00 61.69 61.77 1tll s THR 3102Cb 0.02 -3.07 -0.11 0.00 0.01 0.00 0.00 72.50 69.35 1tll s THR 3102CO 0.24 0.02 1.33 -2.65 -0.69 0.00 0.00 174.62 172.87 1tll n PRO 3103N 2.42 2.21 -1.69 4.92 -0.02 -1.24 -4.65 135.00 136.94 1tll n PRO 3103Ca 0.09 0.78 -0.42 0.00 -2.02 0.00 0.00 63.50 61.93 1tll n PRO 3103Cb 0.37 -2.42 0.00 0.00 -0.02 0.00 0.00 33.50 31.43 1tll n PRO 3103CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 1tll n PRO 3104N 0.40 2.01 -1.91 0.52 -0.02 -1.26 -4.98 135.00 129.76 1tll n PRO 3104Ca 0.04 0.71 -0.30 0.00 -2.02 0.00 0.00 63.50 61.93 1tll n PRO 3104Cb 0.38 -2.32 0.05 0.00 -0.02 0.00 0.00 33.50 31.59 1tll n PRO 3104CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 1tll s THR 3105N -1.14 3.31 0.48 3.45 -4.23 -1.26 -4.87 115.64 111.38 1tll s THR 3105Ca 0.58 0.40 0.18 0.00 -1.18 0.00 0.00 61.69 61.66 1tll s THR 3105Cb -0.55 -3.42 0.34 0.00 1.34 0.00 0.00 72.50 70.21 1tll s THR 3105CO 0.61 -0.55 2.02 -0.65 -0.54 0.00 0.00 174.62 175.51 1tll h PRO 3106N -0.68 0.20 -0.36 3.99 0.11 -1.86 -1.70 132.00 131.69 1tll h PRO 3106Ca -0.45 -0.01 -0.13 0.00 0.11 0.00 0.00 66.00 65.51 1tll h PRO 3106Cb 1.26 -0.05 -0.01 0.00 0.11 0.00 0.00 31.00 32.32 1tll h PRO 3106CO 0.64 0.13 -0.31 1.25 -0.21 0.00 0.00 178.00 179.50 1tll h LEU 3107N 0.21 0.82 -0.70 2.35 5.85 -1.92 -2.93 115.31 118.99 1tll h LEU 3107Ca 0.21 -0.34 -0.10 0.00 0.84 0.00 0.00 57.88 58.49 1tll h LEU 3107Cb 0.56 -0.23 -0.01 0.00 0.37 0.00 0.00 40.66 41.34 1tll h LEU 3107CO -0.04 1.07 -0.46 1.56 -0.34 0.00 0.00 178.44 180.23 1tll h GLN 3108N 0.67 0.00 0.14 1.25 4.20 -1.69 -3.28 115.11 116.40 1tll h GLN 3108Ca 0.07 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.78 1tll h GLN 3108Cb 0.85 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.63 1tll h GLN 3108CO 0.07 0.46 -0.07 -0.07 -0.67 0.00 0.00 178.83 178.56 1tll h LEU 3109N 0.00 -0.16 -0.95 1.46 3.38 -1.33 -2.88 115.31 114.84 1tll h LEU 3109Ca -0.00 -0.36 0.29 0.00 0.09 0.00 0.00 57.88 57.89 1tll h LEU 3109Cb 1.06 0.04 -0.16 0.00 0.09 0.00 0.00 40.66 41.69 1tll h LEU 3109CO 0.06 0.33 0.26 0.06 0.09 0.00 0.00 178.44 179.24 1tll h GLN 3110N -0.70 0.12 -0.80 1.13 3.07 -1.58 1.22 115.11 117.55 1tll h GLN 3110Ca -0.02 -0.01 -0.02 0.00 0.09 0.00 0.00 58.65 58.70 1tll h GLN 3110Cb 0.51 -0.03 -0.04 0.00 0.08 0.00 0.00 27.48 28.01 1tll h GLN 3110CO 0.03 0.08 0.44 1.96 0.09 0.00 0.00 178.83 181.42 1tll h GLN 3111N 0.12 1.12 -0.13 0.06 4.20 -1.60 -1.27 115.11 117.61 1tll h GLN 3111Ca 0.64 -0.13 -0.09 0.00 0.06 0.00 0.00 58.65 59.13 1tll h GLN 3111Cb 1.41 -0.22 -0.01 0.00 0.30 0.00 0.00 27.48 28.96 1tll h GLN 3111CO -0.75 0.82 -0.34 0.74 -0.67 0.00 0.00 178.83 178.63 1tll h PHE 3112N 1.12 0.29 -0.01 2.96 0.05 0.16 -3.15 116.94 118.35 1tll h PHE 3112Ca 0.28 -0.07 0.02 0.00 3.82 0.00 0.00 57.97 62.03 1tll h PHE 3112Cb 0.03 -0.07 -0.06 0.00 2.00 0.00 0.00 35.95 37.86 1tll h PHE 3112CO 0.01 0.56 -0.52 0.00 -0.18 0.00 0.00 178.31 178.18 1tll h ALA 3113N 1.43 -0.91 0.00 2.45 0.00 0.31 0.13 119.26 122.67 1tll h ALA 3113Ca 0.03 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.86 1tll h ALA 3113Cb 0.71 0.93 0.00 0.00 0.00 0.00 0.00 17.79 19.43 1tll h ALA 3113CO 0.05 -1.09 0.00 -1.13 0.00 0.00 0.00 179.25 177.08 1tll n SER 3114N -5.46 0.04 0.00 0.00 3.41 -1.16 -1.54 113.62 108.91 1tll n SER 3114Ca -0.07 -0.33 0.00 0.00 -0.26 0.00 0.00 58.87 58.21 1tll n SER 3114Cb 0.39 -0.02 0.00 0.00 -0.26 0.00 0.00 64.21 64.33 1tll n SER 3114CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1tll n LEU 3115N -0.29 0.59 -4.77 1.04 4.77 0.42 -5.04 117.00 113.72 1tll n LEU 3115Ca 0.00 -0.68 -0.39 0.00 -0.03 0.00 0.00 56.01 54.91 1tll n LEU 3115Cb 0.01 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.04 1tll n LEU 3115CO 0.00 0.15 0.37 0.00 -1.33 0.00 0.00 177.39 176.58 1tll s ALA 3116N -0.17 3.47 -0.75 -1.18 0.00 -0.59 -1.25 121.76 121.28 1tll s ALA 3116Ca 0.00 0.16 0.01 0.00 0.00 0.00 0.00 51.96 52.13 1tll s ALA 3116Cb 0.00 -2.83 0.36 0.00 0.00 0.00 0.00 23.12 20.65 1tll s ALA 3116CO 0.00 0.21 1.59 0.25 0.00 0.00 0.00 175.76 177.81 1tll n THR 3117N 2.30 3.86 -3.89 0.00 -2.24 -0.98 -4.83 114.28 108.50 1tll n THR 3117Ca -0.06 -5.08 -0.11 0.00 -2.27 0.00 0.00 64.05 56.53 1tll n THR 3117Cb 0.50 -1.35 -0.01 0.00 -2.10 0.00 0.00 70.33 67.37 1tll n THR 3117CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 1tll n ASN 3118N -0.36 -1.41 -0.04 3.42 2.85 -1.26 -4.95 115.26 113.51 1tll n ASN 3118Ca 0.45 -2.54 -0.07 0.00 -0.11 0.00 0.00 54.58 52.32 1tll n ASN 3118Cb 0.36 2.51 -0.03 0.00 1.24 0.00 0.00 39.78 43.86 1tll n ASN 3118CO 0.00 0.00 0.00 1.21 -2.11 0.00 0.00 177.26 176.36 1tll n GLU 3119N -0.48 0.18 0.24 1.20 4.07 -1.26 -4.12 120.64 120.46 1tll n GLU 3119Ca -0.02 0.06 -0.16 0.00 -0.06 0.00 0.00 57.16 56.98 1tll n GLU 3119Cb 0.50 -0.97 -0.08 0.00 -0.06 0.00 0.00 31.44 30.83 1tll n GLU 3119CO 0.00 0.00 0.00 0.87 -0.06 0.00 0.00 177.13 177.94 1tll h LYS 3120N -0.14 -0.53 -0.20 5.31 1.57 -1.99 -0.93 116.57 119.66 1tll h LYS 3120Ca -0.18 0.04 0.06 0.00 -1.87 0.00 0.00 60.65 58.69 1tll h LYS 3120Cb 1.22 0.12 -0.07 0.00 0.08 0.00 0.00 32.23 33.58 1tll h LYS 3120CO -0.07 -0.34 -0.32 0.93 -0.57 0.00 0.00 179.45 179.08 1tll h GLU 3121N -0.57 -0.34 -0.02 3.15 5.08 -1.99 0.43 114.58 120.32 1tll h GLU 3121Ca -0.06 0.02 0.01 0.00 -1.00 0.00 0.00 59.36 58.33 1tll h GLU 3121Cb 0.43 0.08 -0.00 0.00 0.50 0.00 0.00 28.75 29.76 1tll h GLU 3121CO 0.09 -0.23 0.03 -0.22 -1.00 0.00 0.00 179.01 177.68 1tll h LYS 3122N -0.35 0.00 0.19 2.33 3.64 -1.69 -0.75 116.57 119.94 1tll h LYS 3122Ca 0.12 0.00 -0.34 0.00 -1.27 0.00 0.00 60.65 59.15 1tll h LYS 3122Cb 0.54 0.00 0.01 0.00 -0.41 0.00 0.00 32.23 32.37 1tll h LYS 3122CO -0.40 0.00 -1.66 0.37 -2.27 0.00 0.00 179.45 175.50 1tll h GLN 3123N 0.00 0.41 -0.36 1.90 5.75 0.66 -2.65 115.11 120.82 1tll h GLN 3123Ca 0.01 -0.70 -0.03 0.00 -0.15 0.00 0.00 58.65 57.77 1tll h GLN 3123Cb 0.06 0.26 -0.01 0.00 1.07 0.00 0.00 27.48 28.86 1tll h GLN 3123CO -0.00 1.32 0.10 -0.09 -2.65 0.00 0.00 178.83 177.51 1tll h ARG 3124N 0.11 0.57 -0.78 1.69 1.12 0.12 -0.43 114.38 116.79 1tll h ARG 3124Ca -0.31 -0.13 0.13 0.00 -1.11 0.00 0.00 59.98 58.56 1tll h ARG 3124Cb 2.11 -0.08 -0.09 0.00 -0.01 0.00 0.00 29.97 31.90 1tll h ARG 3124CO 0.20 0.61 0.37 -0.07 -3.11 0.00 0.00 179.97 177.97 1tll h LEU 3125N 0.43 0.43 -0.43 3.80 3.38 -1.23 -0.15 115.31 121.55 1tll h LEU 3125Ca 0.11 0.09 -0.03 0.00 0.09 0.00 0.00 57.88 58.14 1tll h LEU 3125Cb 0.29 0.03 -0.02 0.00 0.09 0.00 0.00 40.66 41.04 1tll h LEU 3125CO -0.00 0.20 0.14 -0.07 0.09 0.00 0.00 178.44 178.79 1tll h LEU 3126N 0.56 0.61 0.27 1.67 3.38 -0.99 0.20 115.31 121.01 1tll h LEU 3126Ca 0.41 -0.20 0.01 0.00 0.09 0.00 0.00 57.88 58.19 1tll h LEU 3126Cb 0.56 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 41.12 1tll h LEU 3126CO -0.35 0.65 -0.36 0.58 0.09 0.00 0.00 178.44 179.05 1tll h VAL 3127N 0.55 0.26 0.00 1.22 2.07 0.34 -2.09 116.25 118.61 1tll h VAL 3127Ca 0.14 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.64 1tll h VAL 3127Cb 0.25 0.26 -0.00 0.00 -1.52 0.00 0.00 31.29 30.28 1tll h VAL 3127CO -0.01 0.00 -0.09 -0.07 0.02 0.00 0.00 177.57 177.43 1tll h LEU 3128N -0.69 0.00 -2.79 2.57 3.38 -0.96 -2.28 115.31 114.53 1tll h LEU 3128Ca -0.01 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.96 1tll h LEU 3128Cb 0.65 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.40 1tll h LEU 3128CO -0.11 0.09 -0.00 0.77 0.09 0.00 0.00 178.44 179.27 1tll h SER 3129N 0.00 0.00 -3.19 -0.43 4.64 0.13 -3.22 113.55 111.48 1tll h SER 3129Ca -0.00 0.00 -0.78 0.00 -0.47 0.00 0.00 61.79 60.53 1tll h SER 3129Cb 0.19 0.00 -0.25 0.00 -0.31 0.00 0.00 62.40 62.02 1tll h SER 3129CO 0.01 0.00 0.70 0.29 -0.87 0.00 0.00 176.83 176.96 1tll n LYS 3130N -3.32 3.53 -0.67 4.77 5.02 -0.86 -4.58 118.16 122.04 1tll n LYS 3130Ca -0.03 -4.31 0.00 0.00 -2.02 0.00 0.00 58.31 51.95 1tll n LYS 3130Cb 0.08 -2.67 0.00 0.00 -0.02 0.00 0.00 35.03 32.42 1tll n LYS 3130CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1tll n GLY 3131N 2.98 0.00 3.32 0.72 0.00 -1.22 -4.67 105.19 106.33 1tll n GLY 3131Ca 0.27 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 46.13 1tll n GLY 3131CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1tll s LEU 3132N 0.00 1.84 0.00 0.99 1.43 -1.26 -4.38 118.68 117.31 1tll s LEU 3132Ca 0.00 -1.33 0.00 0.00 -1.03 0.00 0.00 54.13 51.77 1tll s LEU 3132Cb 0.00 -0.07 0.00 0.00 0.03 0.00 0.00 46.19 46.15 1tll s LEU 3132CO 0.00 -0.66 0.00 1.67 0.23 0.00 0.00 176.35 177.59 1tll n GLN 3133N -0.45 0.00 -0.01 1.70 7.27 -1.26 0.18 117.38 124.81 1tll n GLN 3133Ca -0.02 0.00 -0.10 0.00 0.07 0.00 0.00 57.00 56.95 1tll n GLN 3133Cb 0.65 0.00 -0.04 0.00 2.41 0.00 0.00 30.24 33.26 1tll n GLN 3133CO 0.00 0.00 0.00 0.93 0.07 0.00 0.00 177.06 178.06 1tll h GLU 3134N 0.00 0.14 -0.27 3.69 4.39 -1.92 -0.77 114.58 119.84 1tll h GLU 3134Ca 0.00 -0.01 -0.13 0.00 0.34 0.00 0.00 59.36 59.56 1tll h GLU 3134Cb 0.00 -0.03 -0.00 0.00 -0.10 0.00 0.00 28.75 28.62 1tll h GLU 3134CO 0.00 0.09 -0.35 -0.92 -1.16 0.00 0.00 179.01 176.68 1tll h TYR 3135N 0.15 0.88 -0.92 4.33 3.20 0.17 -2.38 116.97 122.40 1tll h TYR 3135Ca 0.05 -0.28 -0.02 0.00 3.14 0.00 0.00 58.73 61.62 1tll h TYR 3135Cb 0.00 -0.18 -0.04 0.00 1.54 0.00 0.00 36.73 38.05 1tll h TYR 3135CO -0.09 1.05 0.51 0.93 -1.64 0.00 0.00 178.16 178.92 1tll h GLU 3136N 0.46 1.27 -0.51 1.82 5.08 -1.38 0.12 114.58 121.43 1tll h GLU 3136Ca 0.03 -0.14 -0.13 0.00 -1.00 0.00 0.00 59.36 58.13 1tll h GLU 3136Cb 0.93 -0.25 -0.01 0.00 0.50 0.00 0.00 28.75 29.91 1tll h GLU 3136CO 0.08 0.92 -0.17 0.93 -1.00 0.00 0.00 179.01 179.78 1tll h GLU 3137N 1.28 1.02 0.95 2.33 5.08 -1.14 -1.61 114.58 122.49 1tll h GLU 3137Ca 0.32 -0.41 -0.05 0.00 -1.00 0.00 0.00 59.36 58.23 1tll h GLU 3137Cb 0.01 -0.05 0.01 0.00 0.50 0.00 0.00 28.75 29.22 1tll h GLU 3137CO -0.05 1.10 -0.45 2.35 -1.00 0.00 0.00 179.01 180.95 1tll h TRP 3138N 0.89 -1.18 0.38 4.33 7.01 -0.94 -0.99 115.95 125.44 1tll h TRP 3138Ca 0.12 -0.03 -0.00 0.00 2.11 0.00 0.00 58.89 61.09 1tll h TRP 3138Cb 0.75 0.39 -0.03 0.00 -2.10 0.00 0.00 29.16 28.17 1tll h TRP 3138CO 0.05 -0.73 -0.45 -0.22 -2.79 0.00 0.00 178.44 174.30 1tll h LYS 3139N -1.32 -0.83 -0.63 2.65 3.64 -0.78 -1.03 116.57 118.26 1tll h LYS 3139Ca -0.13 0.06 -0.01 0.00 -1.27 0.00 0.00 60.65 59.30 1tll h LYS 3139Cb 0.97 0.19 -0.03 0.00 -0.41 0.00 0.00 32.23 32.95 1tll h LYS 3139CO 0.21 -0.55 0.35 -1.49 -2.27 0.00 0.00 179.45 175.71 1tll h TRP 3140N -0.86 0.87 -0.26 1.91 -0.00 -1.39 1.22 115.95 117.44 1tll h TRP 3140Ca -0.03 -0.02 -0.04 0.00 -0.00 0.00 0.00 58.89 58.80 1tll h TRP 3140Cb 0.78 -0.28 -0.01 0.00 -0.00 0.00 0.00 29.16 29.65 1tll h TRP 3140CO -0.27 0.62 0.01 0.78 -0.00 0.00 0.00 178.44 179.58 1tll h GLY 3141N 0.86 0.49 0.07 1.49 0.00 -1.08 -3.35 103.07 101.55 1tll h GLY 3141Ca 0.22 -0.35 -0.37 0.00 0.00 0.00 0.00 47.33 46.83 1tll h GLY 3141CO -0.04 0.32 -2.35 0.28 0.00 0.00 0.00 176.54 174.76 1tll n LYS 3142N -4.63 0.68 -3.79 4.80 5.02 -0.40 -1.62 118.16 118.22 1tll n LYS 3142Ca -0.03 0.03 -0.36 0.00 -2.02 0.00 0.00 58.31 55.93 1tll n LYS 3142Cb 0.23 -1.54 0.04 0.00 -0.02 0.00 0.00 35.03 33.74 1tll n LYS 3142CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 1tll n ASN 3143N -2.84 -4.96 -4.75 4.39 4.05 0.42 -4.62 115.26 106.95 1tll n ASN 3143Ca -0.33 -1.10 -0.41 0.00 0.45 0.00 0.00 54.58 53.19 1tll n ASN 3143Cb 1.13 -2.91 -0.03 0.00 1.23 0.00 0.00 39.78 39.21 1tll n ASN 3143CO 0.00 0.00 0.00 -2.16 -3.05 0.00 0.00 177.26 172.05 1tll s PRO 3144N -6.39 4.34 0.81 1.20 0.04 -1.26 -4.88 135.00 128.85 1tll s PRO 3144Ca 0.48 2.18 -0.12 0.00 0.04 0.00 0.00 61.00 63.58 1tll s PRO 3144Cb -0.20 -3.14 0.08 0.00 0.04 0.00 0.00 34.50 31.28 1tll s PRO 3144CO 0.89 -0.30 1.17 0.95 0.04 0.00 0.00 177.00 179.75 1tll s THR 3145N -0.17 2.10 0.41 1.26 -4.23 -1.26 -3.69 115.64 110.06 1tll s THR 3145Ca 0.56 0.03 0.09 0.00 -1.18 0.00 0.00 61.69 61.19 1tll s THR 3145Cb -0.39 -3.02 0.21 0.00 1.34 0.00 0.00 72.50 70.64 1tll s THR 3145CO 0.43 -0.04 1.99 0.24 -0.54 0.00 0.00 174.62 176.70 1tll h MET 3146N -1.05 0.35 -0.48 3.99 2.86 -1.54 -2.03 114.93 117.04 1tll h MET 3146Ca -0.46 -0.05 -0.10 0.00 -2.06 0.00 0.00 59.70 57.03 1tll h MET 3146Cb 1.32 -0.06 -0.02 0.00 0.06 0.00 0.00 31.60 32.91 1tll h MET 3146CO 0.66 0.34 -0.10 0.28 1.06 0.00 0.00 176.91 179.15 1tll h VAL 3147N 0.34 1.27 0.00 -2.22 2.07 -1.92 -2.47 116.25 113.32 1tll h VAL 3147Ca 0.08 -1.22 -0.08 0.00 0.82 0.00 0.00 66.70 66.30 1tll h VAL 3147Cb 0.17 1.08 -0.01 0.00 -1.52 0.00 0.00 31.29 31.01 1tll h VAL 3147CO -0.00 0.42 -0.40 -0.33 0.02 0.00 0.00 177.57 177.28 1tll h GLU 3148N 0.76 0.00 -0.19 1.57 5.08 -1.77 -2.45 114.58 117.57 1tll h GLU 3148Ca 0.12 0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.44 1tll h GLU 3148Cb 0.65 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.89 1tll h GLU 3148CO 0.04 0.40 -0.04 0.28 -1.00 0.00 0.00 179.01 178.69 1tll h VAL 3149N 0.00 1.28 0.00 3.13 2.07 -1.18 -0.36 116.25 121.19 1tll h VAL 3149Ca -0.00 -1.02 0.00 0.00 0.82 0.00 0.00 66.70 66.50 1tll h VAL 3149Cb 0.73 1.56 0.00 0.00 -1.52 0.00 0.00 31.29 32.06 1tll h VAL 3149CO 0.05 0.31 0.00 0.18 0.02 0.00 0.00 177.57 178.13 1tll n LEU 3150N -4.64 0.27 -0.04 2.57 4.77 -0.95 -1.95 117.00 117.03 1tll n LEU 3150Ca -0.05 0.57 0.04 0.00 -0.03 0.00 0.00 56.01 56.54 1tll n LEU 3150Cb 0.27 -0.53 -0.16 0.00 -2.33 0.00 0.00 43.42 40.67 1tll n LEU 3150CO 0.38 -0.39 -0.87 -0.62 -1.33 0.00 0.00 177.39 174.56 1tll n GLU 3151N -1.80 0.67 0.17 3.23 1.02 -0.95 -3.31 120.64 119.68 1tll n GLU 3151Ca 0.03 -0.12 0.06 0.00 -0.02 0.00 0.00 57.16 57.10 1tll n GLU 3151Cb 0.19 -1.53 0.12 0.00 -0.02 0.00 0.00 31.44 30.19 1tll n GLU 3151CO 0.00 0.00 0.00 1.49 1.18 0.00 0.00 177.13 179.80 1tll h GLU 3152N 0.00 0.00 -2.52 3.49 4.81 -0.69 -3.36 114.58 116.31 1tll h GLU 3152Ca -0.18 0.00 -0.60 0.00 -0.13 0.00 0.00 59.36 58.45 1tll h GLU 3152Cb 1.42 0.00 -0.40 0.00 0.63 0.00 0.00 28.75 30.40 1tll h GLU 3152CO 0.01 0.36 -0.85 1.19 -0.73 0.00 0.00 179.01 178.98 1tll n PHE 3153N -3.22 0.61 0.49 0.92 3.01 -0.82 -5.00 117.46 113.45 1tll n PHE 3153Ca 0.02 -3.67 0.05 0.00 1.01 0.00 0.00 57.45 54.86 1tll n PHE 3153Cb 0.65 -0.11 0.27 0.00 -0.01 0.00 0.00 39.48 40.28 1tll n PHE 3153CO 0.00 0.00 0.00 -0.35 1.01 0.00 0.00 176.76 177.42 1tll n PRO 3154N 2.31 0.13 0.00 -1.08 -0.04 -1.21 -2.94 135.00 132.17 1tll n PRO 3154Ca 0.26 0.21 0.12 0.00 -0.04 0.00 0.00 63.50 64.05 1tll n PRO 3154Cb 0.44 -1.50 0.31 0.00 -0.04 0.00 0.00 33.50 32.72 1tll n PRO 3154CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 1tll n SER 3155N -1.32 0.85 -4.70 3.54 3.41 -1.26 -4.87 113.62 109.26 1tll n SER 3155Ca 0.05 -0.67 -0.42 0.00 -0.26 0.00 0.00 58.87 57.57 1tll n SER 3155Cb 0.09 0.20 -0.03 0.00 -0.26 0.00 0.00 64.21 64.22 1tll n SER 3155CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 1tll s ILE 3156N -2.70 3.03 -0.45 -1.33 1.01 -1.15 -2.32 121.20 117.29 1tll s ILE 3156Ca 0.19 0.60 -0.13 0.00 0.00 0.00 0.00 60.65 61.31 1tll s ILE 3156Cb 0.18 -3.39 0.07 0.00 0.01 0.00 0.00 42.46 39.34 1tll s ILE 3156CO 0.59 0.02 0.34 -1.10 0.00 0.00 0.00 174.94 174.80 1tll s GLN 3157N 1.98 2.87 -0.35 2.79 -0.21 -0.38 -4.96 119.66 121.40 1tll s GLN 3157Ca 0.70 -1.35 -0.16 0.00 0.02 0.00 0.00 55.36 54.57 1tll s GLN 3157Cb -0.40 -4.01 -0.01 0.00 1.00 0.00 0.00 33.01 29.60 1tll s GLN 3157CO 0.31 -0.98 0.42 1.41 -2.12 0.00 0.00 175.29 174.33 1tll s MET 3158N 1.58 3.56 0.26 2.91 1.75 -1.26 -4.90 119.30 123.19 1tll s MET 3158Ca 0.04 -0.34 -0.22 0.00 -1.25 0.00 0.00 55.69 53.91 1tll s MET 3158Cb -0.23 -3.81 -0.09 0.00 2.84 0.00 0.00 34.83 33.53 1tll s MET 3158CO 0.06 -0.58 0.81 -2.14 -0.65 0.00 0.00 175.02 172.51 1tll s PRO 3159N 2.16 4.40 0.37 4.11 0.02 -1.26 0.93 135.00 145.72 1tll s PRO 3159Ca 0.14 1.06 0.06 0.00 0.02 0.00 0.00 61.00 62.28 1tll s PRO 3159Cb -0.16 -2.87 0.71 0.00 0.02 0.00 0.00 34.50 32.20 1tll s PRO 3159CO 0.12 0.36 1.96 0.00 -0.33 0.00 0.00 177.00 179.11 1tll h ALA 3160N 3.37 1.52 0.00 -1.55 0.00 -1.91 -2.71 119.26 117.97 1tll h ALA 3160Ca -0.47 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.31 1tll h ALA 3160Cb 1.19 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.82 1tll h ALA 3160CO 0.65 0.37 0.00 0.25 0.00 0.00 0.00 179.25 180.52 1tll n THR 3161N -4.36 0.76 0.04 0.00 -2.24 -1.26 -1.53 114.28 105.69 1tll n THR 3161Ca 0.02 0.08 -0.20 0.00 -2.27 0.00 0.00 64.05 61.69 1tll n THR 3161Cb 0.16 -1.01 -0.14 0.00 -2.10 0.00 0.00 70.33 67.24 1tll n THR 3161CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 1tll h LEU 3162N 0.00 0.44 0.14 3.22 5.85 -1.89 -2.85 115.31 120.22 1tll h LEU 3162Ca 0.00 -0.96 -0.01 0.00 0.84 0.00 0.00 57.88 57.76 1tll h LEU 3162Cb 0.48 -0.14 0.00 0.00 0.37 0.00 0.00 40.66 41.37 1tll h LEU 3162CO 0.00 1.37 -0.07 -0.07 -0.34 0.00 0.00 178.44 179.34 1tll h LEU 3163N -0.41 -0.15 -1.17 2.25 3.38 -1.56 0.43 115.31 118.07 1tll h LEU 3163Ca -0.14 -0.19 0.00 0.00 0.09 0.00 0.00 57.88 57.64 1tll h LEU 3163Cb 1.60 0.04 0.00 0.00 0.09 0.00 0.00 40.66 42.39 1tll h LEU 3163CO 0.14 0.11 0.07 0.18 0.09 0.00 0.00 178.44 179.02 1tll n LEU 3164N -5.06 0.46 -0.00 1.67 4.77 -0.58 -1.13 117.00 117.12 1tll n LEU 3164Ca -0.09 0.69 0.01 0.00 -0.03 0.00 0.00 56.01 56.59 1tll n LEU 3164Cb 0.18 -0.72 -0.01 0.00 -2.33 0.00 0.00 43.42 40.54 1tll n LEU 3164CO 0.33 -0.84 -0.52 0.35 -1.33 0.00 0.00 177.39 175.38 1tll n THR 3165N -2.13 0.00 -0.04 -5.08 -2.24 -1.04 -4.79 114.28 98.97 1tll n THR 3165Ca -0.01 -0.04 0.01 0.00 -2.27 0.00 0.00 64.05 61.74 1tll n THR 3165Cb 0.10 0.41 -0.13 0.00 -2.10 0.00 0.00 70.33 68.60 1tll n THR 3165CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1tll n GLN 3166N -1.57 0.90 -2.10 -0.78 1.13 0.15 -4.97 117.38 110.14 1tll n GLN 3166Ca -0.00 -0.09 -0.38 0.00 -1.94 0.00 0.00 57.00 54.59 1tll n GLN 3166Cb 0.06 -1.41 0.01 0.00 0.11 0.00 0.00 30.24 29.01 1tll n GLN 3166CO 0.00 0.00 0.00 -0.51 -1.44 0.00 0.00 177.06 175.11 1tll s LEU 3167N -4.64 3.97 0.72 1.08 1.43 -0.29 -4.99 118.68 115.97 1tll s LEU 3167Ca -0.07 2.46 -0.13 0.00 -1.03 0.00 0.00 54.13 55.36 1tll s LEU 3167Cb 0.08 -4.24 0.03 0.00 0.03 0.00 0.00 46.19 42.09 1tll s LEU 3167CO 0.69 -1.12 1.11 -0.44 0.23 0.00 0.00 176.35 176.82 1tll s SER 3168N -1.21 4.71 0.34 2.29 0.01 -1.26 -4.85 113.70 113.72 1tll s SER 3168Ca 0.66 1.95 -0.27 0.00 1.31 0.00 0.00 55.95 59.60 1tll s SER 3168Cb -0.33 -2.54 -0.09 0.00 0.21 0.00 0.00 66.02 63.27 1tll s SER 3168CO 0.39 -1.90 1.11 -0.76 0.41 0.00 0.00 173.24 172.49 1tll s LEU 3169N -5.41 4.37 -0.05 2.44 1.43 -1.26 -0.74 118.68 119.47 1tll s LEU 3169Ca 0.65 2.25 -0.30 0.00 -1.03 0.00 0.00 54.13 55.70 1tll s LEU 3169Cb -0.20 -3.85 -0.06 0.00 0.03 0.00 0.00 46.19 42.12 1tll s LEU 3169CO 0.49 -0.36 1.73 -0.22 0.23 0.00 0.00 176.35 178.22 1tll s LEU 3170N -1.98 4.31 0.46 1.79 2.96 0.31 -4.33 118.68 122.19 1tll s LEU 3170Ca 0.51 2.29 -0.15 0.00 -0.22 0.00 0.00 54.13 56.56 1tll s LEU 3170Cb -0.30 -3.53 -0.08 0.00 0.50 0.00 0.00 46.19 42.78 1tll s LEU 3170CO 0.38 -0.99 0.89 -1.58 -1.32 0.00 0.00 176.35 173.72 1tll s GLN 3171N 4.22 3.91 0.32 1.98 2.00 -1.26 -4.89 119.66 125.94 1tll s GLN 3171Ca 0.77 0.78 -0.12 0.00 -2.00 0.00 0.00 55.36 54.79 1tll s GLN 3171Cb -0.35 -2.25 -0.08 0.00 0.80 0.00 0.00 33.01 31.14 1tll s GLN 3171CO 0.32 -0.14 0.70 -1.25 -0.50 0.00 0.00 175.29 174.42 1tll s PRO 3172N -3.86 3.88 -0.14 1.67 0.04 -1.26 -4.74 135.00 130.59 1tll s PRO 3172Ca 0.56 0.50 -0.08 0.00 0.04 0.00 0.00 61.00 62.02 1tll s PRO 3172Cb -0.10 -2.48 -0.04 0.00 0.04 0.00 0.00 34.50 31.92 1tll s PRO 3172CO 0.29 0.14 0.13 1.03 0.04 0.00 0.00 177.00 178.64 1tll s ARG 3173N -3.21 3.64 0.10 4.56 3.00 0.79 -4.78 118.95 123.05 1tll s ARG 3173Ca 0.51 -0.16 -0.16 0.00 0.00 0.00 0.00 55.73 55.92 1tll s ARG 3173Cb -0.10 -3.24 -0.07 0.00 0.00 0.00 0.00 34.95 31.54 1tll s ARG 3173CO 0.23 0.65 0.54 0.71 0.00 0.00 0.00 175.30 177.42 1tll s TYR 3174N -0.64 3.69 -0.02 -0.53 2.02 -1.26 -0.22 117.35 120.38 1tll s TYR 3174Ca 0.13 1.13 0.00 0.00 -0.37 0.00 0.00 57.07 57.96 1tll s TYR 3174Cb -0.12 -2.40 0.03 0.00 -0.40 0.00 0.00 41.96 39.07 1tll s TYR 3174CO 0.02 0.51 0.01 0.71 -1.57 0.00 0.00 175.55 175.24 1tll s TYR 3175N -1.29 0.18 0.02 2.71 2.02 -0.29 -4.95 117.35 115.76 1tll s TYR 3175Ca 0.33 0.05 -0.30 0.00 -0.37 0.00 0.00 57.07 56.78 1tll s TYR 3175Cb -0.17 -0.30 -0.06 0.00 -0.40 0.00 0.00 41.96 41.02 1tll s TYR 3175CO 0.18 -0.10 1.51 -1.12 -1.57 0.00 0.00 175.55 174.45 1tll s SER 3176N 0.93 6.75 0.04 2.29 0.01 -1.26 -0.33 113.70 122.13 1tll s SER 3176Ca -0.09 2.25 -0.30 0.00 1.31 0.00 0.00 55.95 59.12 1tll s SER 3176Cb -0.12 -2.56 -0.07 0.00 0.21 0.00 0.00 66.02 63.48 1tll s SER 3176CO -0.02 -0.79 1.57 -0.63 0.41 0.00 0.00 173.24 173.77 1tll s ILE 3177N 2.60 3.27 -0.42 1.44 1.01 -0.64 -4.41 121.20 124.05 1tll s ILE 3177Ca 0.68 0.69 0.05 0.00 0.00 0.00 0.00 60.65 62.07 1tll s ILE 3177Cb -0.34 -3.45 0.68 0.00 0.01 0.00 0.00 42.46 39.36 1tll s ILE 3177CO 0.29 -0.00 1.89 -1.20 0.00 0.00 0.00 174.94 175.92 1tll n SER 3178N 5.56 3.96 -3.99 3.58 7.64 0.89 -4.40 113.62 126.85 1tll n SER 3178Ca 0.15 -3.52 -0.09 0.00 1.01 0.00 0.00 58.87 56.42 1tll n SER 3178Cb 0.42 -0.82 -0.10 0.00 -1.01 0.00 0.00 64.21 62.69 1tll n SER 3178CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 1tll s SER 3179N -1.22 0.28 -0.03 6.43 1.04 -1.26 -4.26 113.70 114.69 1tll s SER 3179Ca 0.56 -0.63 -0.14 0.00 0.48 0.00 0.00 55.95 56.23 1tll s SER 3179Cb 0.47 0.16 -0.05 0.00 0.10 0.00 0.00 66.02 66.69 1tll s SER 3179CO 0.11 -0.42 0.37 -0.55 0.98 0.00 0.00 173.24 173.73 1tll s SER 3180N -1.98 6.74 0.49 7.02 0.15 -1.26 -4.70 113.70 120.15 1tll s SER 3180Ca -0.08 0.88 0.28 0.00 0.70 0.00 0.00 55.95 57.73 1tll s SER 3180Cb -0.03 -2.23 0.88 0.00 -1.71 0.00 0.00 66.02 62.93 1tll s SER 3180CO -0.04 0.32 1.80 1.55 1.20 0.00 0.00 173.24 178.07 1tll h PRO 3181N 4.89 0.00 -0.12 5.44 0.13 -1.85 -1.38 132.00 139.11 1tll h PRO 3181Ca -0.51 0.00 -0.23 0.00 -0.87 0.00 0.00 66.00 64.39 1tll h PRO 3181Cb 1.22 0.00 0.01 0.00 0.13 0.00 0.00 31.00 32.36 1tll h PRO 3181CO 0.62 0.05 -0.83 -0.44 -0.23 0.00 0.00 178.00 177.17 1tll h ASP 3182N 0.00 0.91 0.47 1.44 3.45 -1.95 -3.05 116.42 117.69 1tll h ASP 3182Ca -0.00 -0.62 -0.28 0.00 0.43 0.00 0.00 57.03 56.56 1tll h ASP 3182Cb 0.76 -0.27 0.01 0.00 -0.56 0.00 0.00 39.33 39.27 1tll h ASP 3182CO 0.01 1.42 -1.21 -0.03 -1.57 0.00 0.00 179.24 177.85 1tll h MET 3183N 0.50 0.37 -2.60 3.56 4.05 -1.84 -3.39 114.93 115.57 1tll h MET 3183Ca -0.07 -0.56 -0.60 0.00 -0.28 0.00 0.00 59.70 58.19 1tll h MET 3183Cb 1.46 0.20 -0.41 0.00 -0.80 0.00 0.00 31.60 32.04 1tll h MET 3183CO 0.17 1.24 -0.69 0.66 0.23 0.00 0.00 176.91 178.52 1tll n TYR 3184N -3.63 2.41 -1.71 1.39 4.01 -0.53 -5.03 117.16 114.07 1tll n TYR 3184Ca -0.10 -4.05 -0.42 0.00 -0.16 0.00 0.00 57.90 53.17 1tll n TYR 3184Cb 0.99 -0.45 -0.01 0.00 -0.31 0.00 0.00 39.34 39.57 1tll n TYR 3184CO 0.00 0.00 0.00 -2.30 -0.46 0.00 0.00 176.86 174.10 1tll n PRO 3185N 1.70 2.25 -2.04 -0.72 -0.02 -1.15 -1.92 135.00 133.09 1tll n PRO 3185Ca 0.25 0.79 -0.20 0.00 -2.02 0.00 0.00 63.50 62.31 1tll n PRO 3185Cb 0.40 -2.41 -0.04 0.00 -0.02 0.00 0.00 33.50 31.44 1tll n PRO 3185CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 1tll n ASP 3186N 0.79 -5.58 -4.12 2.55 8.00 -1.26 -4.97 116.55 111.95 1tll n ASP 3186Ca 0.04 0.20 -0.15 0.00 0.71 0.00 0.00 54.79 55.60 1tll n ASP 3186Cb 0.36 -4.70 -0.11 0.00 -0.02 0.00 0.00 41.12 36.65 1tll n ASP 3186CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 1tll s GLU 3187N -4.44 0.69 -0.05 -1.24 2.02 -0.81 -1.85 118.70 113.02 1tll s GLU 3187Ca 0.00 -0.93 -0.01 0.00 0.02 0.00 0.00 54.97 54.05 1tll s GLU 3187Cb 0.00 -0.48 0.03 0.00 0.10 0.00 0.00 34.13 33.78 1tll s GLU 3187CO 0.00 0.09 0.01 0.08 0.02 0.00 0.00 175.26 175.46 1tll s VAL 3188N -1.71 0.23 0.04 2.63 1.01 0.08 -4.88 120.40 117.80 1tll s VAL 3188Ca -0.03 0.17 0.05 0.00 0.00 0.00 0.00 61.98 62.16 1tll s VAL 3188Cb -0.08 -0.38 -0.04 0.00 0.00 0.00 0.00 36.38 35.88 1tll s VAL 3188CO 0.01 0.21 -0.07 -1.00 0.00 0.00 0.00 175.10 174.25 1tll s HIS 3189N 1.72 2.86 0.07 5.22 3.76 -1.26 0.36 115.29 128.02 1tll s HIS 3189Ca 0.00 -0.07 0.04 0.00 -0.15 0.00 0.00 55.06 54.89 1tll s HIS 3189Cb -0.13 -1.55 -0.03 0.00 1.11 0.00 0.00 32.58 31.99 1tll s HIS 3189CO -0.04 0.40 -0.12 -0.51 -0.85 0.00 0.00 174.74 173.62 1tll s LEU 3190N -1.76 2.28 -0.36 0.89 1.43 0.56 -0.08 118.68 121.65 1tll s LEU 3190Ca 0.19 -0.62 -0.04 0.00 -1.03 0.00 0.00 54.13 52.63 1tll s LEU 3190Cb -0.11 -0.41 0.07 0.00 0.03 0.00 0.00 46.19 45.77 1tll s LEU 3190CO 0.11 -0.13 0.12 -0.89 0.23 0.00 0.00 176.35 175.80 1tll s THR 3191N -1.41 3.43 -0.22 5.49 2.01 -1.26 -0.98 115.64 122.70 1tll s THR 3191Ca -0.03 -1.55 -0.01 0.00 0.31 0.00 0.00 61.69 60.41 1tll s THR 3191Cb -0.09 -3.11 0.02 0.00 0.01 0.00 0.00 72.50 69.33 1tll s THR 3191CO 0.02 -0.37 -0.10 -0.69 -0.69 0.00 0.00 174.62 172.79 1tll s VAL 3192N 1.27 2.68 -0.06 3.82 1.01 -0.46 -4.91 120.40 123.76 1tll s VAL 3192Ca 0.01 -0.94 -0.30 0.00 0.00 0.00 0.00 61.98 60.76 1tll s VAL 3192Cb -0.21 -2.28 -0.02 0.00 0.00 0.00 0.00 36.38 33.86 1tll s VAL 3192CO -0.01 0.33 1.00 0.00 0.00 0.00 0.00 175.10 176.42 1tll s ALA 3193N 1.33 3.30 -0.71 5.51 0.00 -1.26 -0.88 121.76 129.05 1tll s ALA 3193Ca 0.02 0.46 -0.27 0.00 0.00 0.00 0.00 51.96 52.17 1tll s ALA 3193Cb -0.15 -3.39 0.03 0.00 0.00 0.00 0.00 23.12 19.61 1tll s ALA 3193CO -0.07 -0.44 1.23 0.42 0.00 0.00 0.00 175.76 176.91 1tll s ILE 3194N 1.56 3.83 0.21 0.00 -1.09 -0.53 -4.85 121.20 120.33 1tll s ILE 3194Ca 0.50 0.41 -0.30 0.00 -2.23 0.00 0.00 60.65 59.04 1tll s ILE 3194Cb -0.20 -4.86 -0.08 0.00 -1.58 0.00 0.00 42.46 35.74 1tll s ILE 3194CO 0.23 -1.73 1.13 -0.69 -1.23 0.00 0.00 174.94 172.64 1tll s VAL 3195N 5.44 3.66 -0.30 2.92 1.01 -1.26 -4.71 120.40 127.17 1tll s VAL 3195Ca 0.35 1.50 -0.17 0.00 0.00 0.00 0.00 61.98 63.65 1tll s VAL 3195Cb -0.09 -3.95 0.18 0.00 0.00 0.00 0.00 36.38 32.52 1tll s VAL 3195CO 0.16 0.29 1.14 -0.55 0.00 0.00 0.00 175.10 176.14 1tll s SER 3196N -0.29 -0.31 0.16 3.32 0.15 -1.26 -1.22 113.70 114.25 1tll s SER 3196Ca 0.49 0.43 -0.07 0.00 0.70 0.00 0.00 55.95 57.50 1tll s SER 3196Cb -0.31 1.32 -0.02 0.00 -1.71 0.00 0.00 66.02 65.30 1tll s SER 3196CO 0.37 -0.06 0.22 -0.72 1.20 0.00 0.00 173.24 174.25 1tll s TYR 3197N 2.09 0.53 -0.15 3.44 1.13 -0.78 -4.98 117.35 118.63 1tll s TYR 3197Ca -0.02 -0.90 -0.07 0.00 -1.41 0.00 0.00 57.07 54.67 1tll s TYR 3197Cb -0.03 -0.18 -0.04 0.00 -1.10 0.00 0.00 41.96 40.61 1tll s TYR 3197CO -0.16 -0.66 0.09 -1.01 -2.51 0.00 0.00 175.55 171.29 1tll s HIS 3198N -3.99 3.37 1.11 -3.49 3.76 -1.26 0.30 115.29 115.08 1tll s HIS 3198Ca 0.19 0.27 -0.19 0.00 -0.15 0.00 0.00 55.06 55.18 1tll s HIS 3198Cb 0.04 -2.01 0.28 0.00 1.11 0.00 0.00 32.58 32.00 1tll s HIS 3198CO 0.01 0.39 0.99 0.25 -0.85 0.00 0.00 174.74 175.53 1tll n THR 3199N 2.88 0.00 -4.07 1.30 -2.24 -0.82 -2.26 114.28 109.08 1tll n THR 3199Ca -0.18 -0.44 -0.31 0.00 -2.27 0.00 0.00 64.05 60.85 1tll n THR 3199Cb 0.53 -1.22 -0.03 0.00 -2.10 0.00 0.00 70.33 67.51 1tll n THR 3199CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1tll n ARG 3200N -4.51 -1.84 -3.42 -0.78 1.74 -0.64 0.01 116.66 107.22 1tll n ARG 3200Ca 0.14 0.26 -0.14 0.00 -0.77 0.00 0.00 57.85 57.33 1tll n ARG 3200Cb 0.53 -3.88 0.00 0.00 -1.02 0.00 0.00 32.46 28.10 1tll n ARG 3200CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 1tll n ASP 3201N -2.80 -6.29 0.00 0.55 4.64 -1.26 -2.07 116.55 109.32 1tll n ASP 3201Ca -0.27 -0.47 0.00 0.00 -1.38 0.00 0.00 54.79 52.67 1tll n ASP 3201Cb 0.66 -3.41 0.00 0.00 -1.04 0.00 0.00 41.12 37.34 1tll n ASP 3201CO 0.00 0.00 0.00 0.61 -0.82 0.00 0.00 177.20 176.99 1tll n GLY 3202N -1.57 0.00 0.02 0.27 0.00 -0.95 -4.73 105.19 98.23 1tll n GLY 3202Ca -0.15 0.00 0.07 0.00 0.00 0.00 0.00 46.02 45.94 1tll n GLY 3202CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1tll n GLU 3203N 0.54 0.64 -0.37 1.61 -0.58 -0.72 -4.90 120.64 116.85 1tll n GLU 3203Ca 0.00 -0.15 0.00 0.00 -0.42 0.00 0.00 57.16 56.59 1tll n GLU 3203Cb 0.33 -1.44 0.00 0.00 -0.57 0.00 0.00 31.44 29.77 1tll n GLU 3203CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1tll n GLY 3204N 1.52 0.49 3.77 0.62 0.00 0.10 -4.96 105.19 106.73 1tll n GLY 3204Ca -0.07 -1.89 -0.33 0.00 0.00 0.00 0.00 46.02 43.74 1tll n GLY 3204CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1tll s PRO 3205N -1.40 2.85 0.28 1.61 0.02 -1.26 -4.10 135.00 133.00 1tll s PRO 3205Ca 0.00 1.36 -0.29 0.00 0.02 0.00 0.00 61.00 62.08 1tll s PRO 3205Cb 0.00 -1.96 -0.10 0.00 0.02 0.00 0.00 34.50 32.47 1tll s PRO 3205CO 0.00 -1.21 1.14 0.54 -0.33 0.00 0.00 177.00 177.14 1tll s VAL 3206N -2.37 3.37 -0.11 3.83 0.11 -1.26 -1.95 120.40 122.01 1tll s VAL 3206Ca 0.66 1.36 0.03 0.00 -2.93 0.00 0.00 61.98 61.10 1tll s VAL 3206Cb -0.20 -3.87 -0.01 0.00 -1.53 0.00 0.00 36.38 30.78 1tll s VAL 3206CO 0.41 0.32 -0.20 -1.00 -3.33 0.00 0.00 175.10 171.30 1tll s HIS 3207N -1.08 2.65 -0.09 1.54 3.76 0.15 -4.95 115.29 117.27 1tll s HIS 3207Ca 0.46 -0.89 -0.08 0.00 -0.15 0.00 0.00 55.06 54.40 1tll s HIS 3207Cb -0.33 -1.75 -0.04 0.00 1.11 0.00 0.00 32.58 31.56 1tll s HIS 3207CO 0.43 -0.33 0.19 -1.01 -0.85 0.00 0.00 174.74 173.16 1tll s HIS 3208N 0.32 3.61 0.34 1.40 3.76 -1.26 -1.86 115.29 121.59 1tll s HIS 3208Ca -0.15 0.58 -0.29 0.00 -0.15 0.00 0.00 55.06 55.05 1tll s HIS 3208Cb -0.17 -1.98 -0.11 0.00 1.11 0.00 0.00 32.58 31.42 1tll s HIS 3208CO 0.08 0.71 1.52 0.41 -0.85 0.00 0.00 174.74 176.61 1tll n GLY 3209N 1.82 1.21 0.30 -2.22 0.00 -0.35 -4.93 105.19 101.02 1tll n GLY 3209Ca -0.18 0.38 -0.12 0.00 0.00 0.00 0.00 46.02 46.11 1tll n GLY 3209CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1tll h VAL 3210N 3.10 0.00 -0.13 1.61 2.07 -1.96 -2.57 116.25 118.36 1tll h VAL 3210Ca -0.49 -0.12 -0.06 0.00 0.82 0.00 0.00 66.70 66.84 1tll h VAL 3210Cb 1.24 0.00 -0.00 0.00 -1.52 0.00 0.00 31.29 31.01 1tll h VAL 3210CO 0.71 0.00 -0.17 0.00 0.02 0.00 0.00 177.57 178.13 1tll h SER 3212N -0.04 0.91 0.76 0.00 4.64 -1.89 0.12 113.55 118.04 1tll h SER 3212Ca 0.02 -0.01 -0.18 0.00 -0.47 0.00 0.00 61.79 61.15 1tll h SER 3212Cb 0.72 -0.20 -0.02 0.00 -0.31 0.00 0.00 62.40 62.58 1tll h SER 3212CO 0.04 0.62 -0.85 0.77 -0.87 0.00 0.00 176.83 176.54 1tll h SER 3213N 1.06 0.08 -0.23 4.97 4.64 -1.50 -2.42 113.55 120.15 1tll h SER 3213Ca 0.34 -0.07 -0.06 0.00 -0.47 0.00 0.00 61.79 61.53 1tll h SER 3213Cb 0.01 -0.03 -0.01 0.00 -0.31 0.00 0.00 62.40 62.07 1tll h SER 3213CO -0.12 0.90 -0.08 -0.25 -0.87 0.00 0.00 176.83 176.41 1tll h TRP 3214N 0.03 0.53 0.00 4.77 7.01 -0.78 -1.67 115.95 125.84 1tll h TRP 3214Ca -0.02 -0.12 0.00 0.00 2.11 0.00 0.00 58.89 60.86 1tll h TRP 3214Cb 1.49 -0.13 0.00 0.00 -2.10 0.00 0.00 29.16 28.43 1tll h TRP 3214CO 0.01 0.72 0.00 -0.07 -2.79 0.00 0.00 178.44 176.31 1tll h LEU 3215N 0.19 0.00 -1.83 0.65 3.38 -0.76 -1.72 115.31 115.22 1tll h LEU 3215Ca 0.06 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.03 1tll h LEU 3215Cb 0.56 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.31 1tll h LEU 3215CO 0.03 0.00 0.00 -3.20 0.09 0.00 0.00 178.44 175.36 1tll n ASN 3216N -2.46 2.72 0.00 -0.43 5.15 -0.64 -4.34 115.26 115.27 1tll n ASN 3216Ca -0.00 -1.90 0.00 0.00 -0.60 0.00 0.00 54.58 52.07 1tll n ASN 3216Cb 0.12 -0.23 0.00 0.00 -0.53 0.00 0.00 39.78 39.14 1tll n ASN 3216CO 0.00 0.00 0.00 -2.11 1.40 0.00 0.00 177.26 176.55 1tll n ARG 3217N 1.00 0.00 -2.04 1.20 1.85 -0.72 -5.04 116.66 112.90 1tll n ARG 3217Ca 0.18 0.00 -0.38 0.00 -1.00 0.00 0.00 57.85 56.65 1tll n ARG 3217Cb 0.48 -0.17 0.01 0.00 -1.05 0.00 0.00 32.46 31.72 1tll n ARG 3217CO 0.00 0.00 0.00 0.96 -0.01 0.00 0.00 177.63 178.58 1tll s ILE 3218N 0.00 2.63 0.31 8.89 -4.36 -0.75 -5.00 121.20 122.92 1tll s ILE 3218Ca 0.00 0.50 -0.06 0.00 -0.26 0.00 0.00 60.65 60.83 1tll s ILE 3218Cb 0.00 -3.27 -0.06 0.00 1.25 0.00 0.00 42.46 40.39 1tll s ILE 3218CO 0.00 0.02 0.60 -1.10 0.24 0.00 0.00 174.94 174.70 1tll s GLN 3219N -2.60 3.67 0.11 0.37 -0.21 -1.26 -4.97 119.66 114.77 1tll s GLN 3219Ca 0.64 0.12 -0.35 0.00 0.02 0.00 0.00 55.36 55.79 1tll s GLN 3219Cb -0.35 -2.59 -0.18 0.00 1.00 0.00 0.00 33.01 30.89 1tll s GLN 3219CO 0.44 0.16 1.01 0.00 -2.12 0.00 0.00 175.29 174.78 1tll n ALA 3220N -0.99 -2.22 -0.86 6.09 0.00 -1.26 -0.49 120.51 120.78 1tll n ALA 3220Ca -0.01 0.51 0.00 0.00 0.00 0.00 0.00 53.44 53.94 1tll n ALA 3220Cb 0.54 -1.85 0.00 0.00 0.00 0.00 0.00 19.45 18.14 1tll n ALA 3220CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1tll n ASP 3221N 1.87 0.00 -4.73 0.00 9.92 -0.89 -4.94 116.55 117.78 1tll n ASP 3221Ca 0.18 0.00 -0.32 0.00 -0.53 0.00 0.00 54.79 54.11 1tll n ASP 3221Cb 0.19 -0.54 0.11 0.00 -0.64 0.00 0.00 41.12 40.23 1tll n ASP 3221CO 0.00 0.00 0.00 -1.81 0.13 0.00 0.00 177.20 175.52 1tll s ASP 3222N -2.80 4.06 0.20 -2.24 1.01 0.36 -4.69 116.67 112.57 1tll s ASP 3222Ca 0.00 2.12 -0.30 0.00 0.71 0.00 0.00 52.55 55.08 1tll s ASP 3222Cb 0.00 -2.56 -0.08 0.00 1.01 0.00 0.00 42.92 41.29 1tll s ASP 3222CO 0.00 -2.34 0.96 -0.69 0.21 0.00 0.00 175.17 173.30 1tll s VAL 3223N -2.46 4.17 -0.36 -1.27 1.01 -1.26 -3.23 120.40 117.00 1tll s VAL 3223Ca 0.68 2.05 0.03 0.00 0.00 0.00 0.00 61.98 64.74 1tll s VAL 3223Cb -0.23 -4.30 0.11 0.00 0.00 0.00 0.00 36.38 31.95 1tll s VAL 3223CO 0.51 0.43 0.09 -0.69 0.00 0.00 0.00 175.10 175.44 1tll s VAL 3224N -0.80 2.11 0.16 2.92 1.01 0.86 -4.95 120.40 121.71 1tll s VAL 3224Ca 0.43 -2.36 -0.30 0.00 0.00 0.00 0.00 61.98 59.74 1tll s VAL 3224Cb -0.26 -2.55 -0.08 0.00 0.00 0.00 0.00 36.38 33.50 1tll s VAL 3224CO 0.32 -0.65 1.24 -2.84 0.00 0.00 0.00 175.10 173.17 1tll s PRO 3225N 0.82 4.44 0.04 2.72 0.02 -1.26 -1.79 135.00 139.99 1tll s PRO 3225Ca 0.12 1.91 -0.28 0.00 0.02 0.00 0.00 61.00 62.77 1tll s PRO 3225Cb -0.20 -3.25 0.10 0.00 0.02 0.00 0.00 34.50 31.17 1tll s PRO 3225CO -0.09 -0.18 1.12 0.00 -0.33 0.00 0.00 177.00 177.52 1tll s PHE 3227N -2.82 0.76 -0.07 0.00 -0.12 0.01 -0.79 117.98 114.94 1tll s PHE 3227Ca 0.12 -1.06 0.02 0.00 -0.05 0.00 0.00 56.93 55.97 1tll s PHE 3227Cb 0.02 0.01 -0.03 0.00 -0.63 0.00 0.00 43.02 42.39 1tll s PHE 3227CO -0.02 -1.04 -0.12 0.08 -0.05 0.00 0.00 175.22 174.08 1tll s VAL 3228N -3.54 3.27 -0.21 -2.49 1.01 -1.26 -0.21 120.40 116.97 1tll s VAL 3228Ca 0.28 -0.63 0.00 0.00 0.00 0.00 0.00 61.98 61.62 1tll s VAL 3228Cb 0.00 -2.32 0.05 0.00 0.00 0.00 0.00 36.38 34.12 1tll s VAL 3228CO 0.14 0.58 -0.05 -0.60 0.00 0.00 0.00 175.10 175.18 1tll s ARG 3229N -0.56 1.52 0.60 2.72 3.52 -0.26 -4.93 118.95 121.56 1tll s ARG 3229Ca 0.08 -0.79 -0.19 0.00 -0.13 0.00 0.00 55.73 54.70 1tll s ARG 3229Cb -0.12 -2.37 -0.03 0.00 -1.56 0.00 0.00 34.95 30.88 1tll s ARG 3229CO 0.02 -0.54 1.25 0.20 -0.81 0.00 0.00 175.30 175.42 1tll s GLY 3230N 1.51 2.80 -0.61 8.12 0.00 -1.26 -1.85 107.32 116.04 1tll s GLY 3230Ca -0.03 1.12 0.06 0.00 0.00 0.00 0.00 44.72 45.86 1tll s GLY 3230CO -0.07 1.54 0.57 0.00 0.00 0.00 0.00 173.10 175.14 1tll n ALA 3231N -1.59 3.47 0.32 3.20 0.00 -1.26 -4.84 120.51 119.81 1tll n ALA 3231Ca 0.14 -4.31 0.19 0.00 0.00 0.00 0.00 53.44 49.46 1tll n ALA 3231Cb 0.48 -0.92 1.03 0.00 0.00 0.00 0.00 19.45 20.04 1tll n ALA 3231CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 1tll h PRO 3232N 4.81 0.00 -0.28 0.00 0.13 -1.94 0.33 132.00 135.06 1tll h PRO 3232Ca 0.17 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.30 1tll h PRO 3232Cb 0.75 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.88 1tll h PRO 3232CO 0.69 0.00 0.00 -1.13 -0.23 0.00 0.00 178.00 177.33 1tll n SER 3233N -2.93 2.64 -2.42 1.44 3.41 -1.26 -4.11 113.62 110.39 1tll n SER 3233Ca -0.03 -1.87 -0.13 0.00 -0.26 0.00 0.00 58.87 56.58 1tll n SER 3233Cb 0.17 -0.18 0.03 0.00 -0.26 0.00 0.00 64.21 63.98 1tll n SER 3233CO 0.00 0.00 0.00 0.33 -0.16 0.00 0.00 175.04 175.21 1tll n PHE 3234N 0.97 2.07 -4.05 7.33 7.35 0.10 -4.64 117.46 126.59 1tll n PHE 3234Ca 0.18 -2.25 -0.28 0.00 -0.76 0.00 0.00 57.45 54.33 1tll n PHE 3234Cb 0.48 -0.28 -0.06 0.00 0.35 0.00 0.00 39.48 39.97 1tll n PHE 3234CO 0.00 0.00 0.00 -1.01 -0.76 0.00 0.00 176.76 174.99 1tll s HIS 3235N -3.67 3.21 0.66 -5.13 3.76 -1.24 -4.21 115.29 108.68 1tll s HIS 3235Ca 0.39 0.05 -0.17 0.00 -0.15 0.00 0.00 55.06 55.18 1tll s HIS 3235Cb 0.37 -1.58 -0.02 0.00 1.11 0.00 0.00 32.58 32.46 1tll s HIS 3235CO -0.01 0.52 1.01 1.28 -0.85 0.00 0.00 174.74 176.70 1tll n LEU 3236N 0.05 3.97 -4.70 0.89 4.77 -1.26 -4.93 117.00 115.78 1tll n LEU 3236Ca -0.08 0.74 -0.31 0.00 -0.03 0.00 0.00 56.01 56.33 1tll n LEU 3236Cb 0.53 -1.42 0.14 0.00 -2.33 0.00 0.00 43.42 40.34 1tll n LEU 3236CO 0.44 -1.83 0.70 -2.84 -1.33 0.00 0.00 177.39 172.54 1tll s PRO 3237N -3.10 1.44 0.15 3.23 0.02 -1.26 -4.91 135.00 130.57 1tll s PRO 3237Ca 0.76 1.49 0.03 0.00 0.02 0.00 0.00 61.00 63.31 1tll s PRO 3237Cb -0.38 -1.78 -0.06 0.00 0.02 0.00 0.00 34.50 32.31 1tll s PRO 3237CO 0.47 -2.31 1.35 -0.09 -0.33 0.00 0.00 177.00 176.09 1tll h ARG 3238N -1.50 0.15 -6.20 5.54 2.43 -2.01 -3.40 114.38 109.39 1tll h ARG 3238Ca -0.44 -0.18 -0.59 0.00 -0.81 0.00 0.00 59.98 57.96 1tll h ARG 3238Cb 1.26 0.06 -0.10 0.00 -0.42 0.00 0.00 29.97 30.77 1tll h ARG 3238CO 0.45 0.97 0.63 1.21 -1.51 0.00 0.00 179.97 181.71 1tll s ASN 3239N -6.90 6.57 -0.00 -3.80 3.84 -1.26 -4.90 114.94 108.48 1tll s ASN 3239Ca -0.02 0.31 0.10 0.00 0.21 0.00 0.00 52.86 53.46 1tll s ASN 3239Cb 0.10 -2.47 0.29 0.00 -0.55 0.00 0.00 41.25 38.63 1tll s ASN 3239CO 0.83 -1.01 1.23 -0.81 -2.79 0.00 0.00 177.10 174.55 1tll n PRO 3240N 7.12 1.81 -0.80 0.43 -0.04 -1.26 -3.97 135.00 138.28 1tll n PRO 3240Ca 0.07 -1.19 0.01 0.00 -0.04 0.00 0.00 63.50 62.35 1tll n PRO 3240Cb 0.48 -1.28 0.29 0.00 -0.04 0.00 0.00 33.50 32.96 1tll n PRO 3240CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 1tll n GLN 3241N 0.45 3.42 -4.53 0.54 1.13 -1.26 -1.25 117.38 115.87 1tll n GLN 3241Ca 0.11 -3.04 -0.29 0.00 -1.94 0.00 0.00 57.00 51.84 1tll n GLN 3241Cb 0.30 -2.06 -0.13 0.00 0.11 0.00 0.00 30.24 28.45 1tll n GLN 3241CO 0.00 0.00 0.00 0.08 -1.44 0.00 0.00 177.06 175.70 1tll s VAL 3242N -2.95 2.15 0.40 5.09 1.01 -1.25 -4.69 120.40 120.15 1tll s VAL 3242Ca 0.50 -1.62 -0.24 0.00 0.00 0.00 0.00 61.98 60.62 1tll s VAL 3242Cb 0.40 -1.89 -0.09 0.00 0.00 0.00 0.00 36.38 34.80 1tll s VAL 3242CO 0.11 0.16 1.05 -2.16 0.00 0.00 0.00 175.10 174.26 1tll s PRO 3243N -1.79 4.17 -0.07 2.72 0.04 -1.26 -4.60 135.00 134.21 1tll s PRO 3243Ca 0.12 1.52 0.03 0.00 0.04 0.00 0.00 61.00 62.72 1tll s PRO 3243Cb -0.10 -2.55 0.00 0.00 0.04 0.00 0.00 34.50 31.90 1tll s PRO 3243CO 0.05 -0.14 -0.17 0.00 0.04 0.00 0.00 177.00 176.77 1tll s ILE 3245N 0.41 3.39 -0.55 0.00 1.01 0.26 -1.69 121.20 124.02 1tll s ILE 3245Ca -0.13 -1.54 -0.23 0.00 0.00 0.00 0.00 60.65 58.76 1tll s ILE 3245Cb -0.15 -3.07 0.05 0.00 0.01 0.00 0.00 42.46 39.29 1tll s ILE 3245CO 0.05 -0.35 0.86 -0.76 0.00 0.00 0.00 174.94 174.74 1tll s LEU 3246N 1.27 4.37 -0.19 2.97 1.43 0.41 -0.84 118.68 128.10 1tll s LEU 3246Ca 0.01 -0.58 -0.04 0.00 -1.03 0.00 0.00 54.13 52.49 1tll s LEU 3246Cb -0.21 -2.68 -0.02 0.00 0.03 0.00 0.00 46.19 43.31 1tll s LEU 3246CO -0.01 -1.16 -0.04 0.68 0.23 0.00 0.00 176.35 176.05 1tll s VAL 3247N 3.61 3.67 0.00 -1.59 -7.23 0.63 -0.22 120.40 119.27 1tll s VAL 3247Ca 0.25 -0.42 0.00 0.00 -1.81 0.00 0.00 61.98 60.01 1tll s VAL 3247Cb -0.15 -2.64 0.00 0.00 0.56 0.00 0.00 36.38 34.16 1tll s VAL 3247CO 0.16 0.45 0.00 0.61 -0.31 0.00 0.00 175.10 176.02 1tll n GLY 3248N 4.12 0.75 3.89 2.32 0.00 -0.53 -1.80 105.19 113.95 1tll n GLY 3248Ca -0.18 0.57 -0.29 0.00 0.00 0.00 0.00 46.02 46.13 1tll n GLY 3248CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1tll s PRO 3249N 0.00 3.26 0.16 1.61 0.04 -1.26 -3.89 135.00 134.92 1tll s PRO 3249Ca 0.00 0.38 0.00 0.00 0.04 0.00 0.00 61.00 61.42 1tll s PRO 3249Cb 0.00 -2.18 0.00 0.00 0.04 0.00 0.00 34.50 32.36 1tll s PRO 3249CO 0.00 -0.62 0.00 0.41 0.04 0.00 0.00 177.00 176.83 1tll n GLY 3250N -2.65 1.74 0.13 0.56 0.00 0.45 0.16 105.19 105.58 1tll n GLY 3250Ca 0.05 -0.18 0.08 0.00 0.00 0.00 0.00 46.02 45.97 1tll n GLY 3250CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1tll n THR 3251N 0.00 1.10 0.23 2.61 -2.24 -1.26 -0.84 114.28 113.87 1tll n THR 3251Ca 0.00 0.69 0.14 0.00 -2.27 0.00 0.00 64.05 62.61 1tll n THR 3251Cb 0.00 -1.69 0.71 0.00 -2.10 0.00 0.00 70.33 67.25 1tll n THR 3251CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 1tll h GLY 3252N 0.00 0.00 2.00 3.38 0.00 -0.50 0.41 103.07 108.36 1tll h GLY 3252Ca 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 47.33 47.24 1tll h GLY 3252CO 0.00 0.00 -0.45 1.19 0.00 0.00 0.00 176.54 177.28 1tll h ILE 3253N 0.00 1.16 -0.32 2.60 2.10 -1.08 -3.38 117.51 118.58 1tll h ILE 3253Ca 0.00 -1.63 0.05 0.00 1.08 0.00 0.00 64.86 64.36 1tll h ILE 3253Cb 0.06 1.92 -0.05 0.00 -1.09 0.00 0.00 36.82 37.66 1tll h ILE 3253CO 0.00 0.44 -0.13 0.00 -1.08 0.00 0.00 178.15 177.38 1tll n ALA 3254N -2.38 -0.05 0.22 0.18 0.00 0.13 0.31 120.51 118.92 1tll n ALA 3254Ca -0.01 0.32 0.11 0.00 0.00 0.00 0.00 53.44 53.86 1tll n ALA 3254Cb 0.51 -0.14 0.33 0.00 0.00 0.00 0.00 19.45 20.15 1tll n ALA 3254CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 1tll h PRO 3255N 0.00 0.00 0.00 0.00 0.13 -1.77 -3.13 132.00 127.23 1tll h PRO 3255Ca 0.11 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 65.19 1tll h PRO 3255Cb 0.19 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.31 1tll h PRO 3255CO -0.32 0.15 -0.25 0.74 -0.23 0.00 0.00 178.00 178.09 1tll h PHE 3256N 0.00 0.00 0.00 1.56 0.04 -0.41 -1.53 116.94 116.60 1tll h PHE 3256Ca -0.00 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.77 1tll h PHE 3256Cb 0.90 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.05 1tll h PHE 3256CO 0.00 0.25 0.00 -0.09 -0.60 0.00 0.00 178.31 177.87 1tll h ARG 3257N 0.00 0.00 0.00 1.51 2.43 -1.48 0.25 114.38 117.09 1tll h ARG 3257Ca -0.00 0.00 -0.33 0.00 -0.81 0.00 0.00 59.98 58.83 1tll h ARG 3257Cb 0.63 0.00 -0.06 0.00 -0.42 0.00 0.00 29.97 30.12 1tll h ARG 3257CO 0.03 0.00 -2.14 -1.13 -1.51 0.00 0.00 179.97 175.22 1tll n SER 3258N -2.32 0.31 -0.05 -3.80 3.41 -0.63 -2.99 113.62 107.54 1tll n SER 3258Ca 0.02 0.15 -0.11 0.00 -0.26 0.00 0.00 58.87 58.67 1tll n SER 3258Cb 0.23 0.65 -0.04 0.00 -0.26 0.00 0.00 64.21 64.79 1tll n SER 3258CO 0.00 0.00 0.00 -0.26 -0.16 0.00 0.00 175.04 174.62 1tll h PHE 3259N 0.00 0.26 0.00 7.33 -1.00 -0.81 -0.98 116.94 121.74 1tll h PHE 3259Ca -0.45 -0.01 0.00 0.00 2.81 0.00 0.00 57.97 60.33 1tll h PHE 3259Cb 2.14 -0.08 0.00 0.00 3.61 0.00 0.00 35.95 41.61 1tll h PHE 3259CO 0.00 0.26 0.00 0.11 -1.61 0.00 0.00 178.31 177.07 1tll h TRP 3260N 0.18 0.00 0.04 -0.55 0.09 -1.12 -1.41 115.95 113.17 1tll h TRP 3260Ca 0.06 0.00 -0.26 0.00 0.09 0.00 0.00 58.89 58.79 1tll h TRP 3260Cb 0.10 0.00 -0.03 0.00 0.08 0.00 0.00 29.16 29.31 1tll h TRP 3260CO -0.03 0.00 -1.32 1.96 0.09 0.00 0.00 178.44 179.14 1tll h GLN 3261N 0.00 0.08 0.50 0.12 4.20 -1.45 -2.38 115.11 116.18 1tll h GLN 3261Ca 0.00 -0.14 -0.02 0.00 0.06 0.00 0.00 58.65 58.55 1tll h GLN 3261Cb 0.80 0.05 0.00 0.00 0.30 0.00 0.00 27.48 28.63 1tll h GLN 3261CO 0.00 0.92 -0.24 0.37 -0.67 0.00 0.00 178.83 179.21 1tll h GLN 3262N 0.02 -0.65 -1.00 1.46 5.75 -1.00 -1.80 115.11 117.89 1tll h GLN 3262Ca -0.14 0.04 0.21 0.00 -0.15 0.00 0.00 58.65 58.62 1tll h GLN 3262Cb 1.90 0.15 -0.11 0.00 1.07 0.00 0.00 27.48 30.49 1tll h GLN 3262CO 0.13 -0.40 0.61 0.00 -2.65 0.00 0.00 178.83 176.52 1tll h ARG 3263N -1.15 0.66 -0.03 1.69 2.47 -1.39 0.48 114.38 117.13 1tll h ARG 3263Ca -0.07 -0.04 -0.06 0.00 -1.26 0.00 0.00 59.98 58.55 1tll h ARG 3263Cb 0.55 -0.15 -0.01 0.00 -1.65 0.00 0.00 29.97 28.71 1tll h ARG 3263CO 0.11 0.44 -0.25 0.37 0.56 0.00 0.00 179.97 181.20 1tll h GLN 3264N 0.68 0.04 0.16 0.04 4.15 -1.38 -1.82 115.11 116.99 1tll h GLN 3264Ca 0.60 -0.01 -0.29 0.00 0.77 0.00 0.00 58.65 59.72 1tll h GLN 3264Cb 1.04 -0.00 0.01 0.00 0.21 0.00 0.00 27.48 28.74 1tll h GLN 3264CO -0.41 0.29 -1.30 0.35 -1.93 0.00 0.00 178.83 175.82 1tll h PHE 3265N 0.04 0.62 -0.04 3.99 3.04 0.72 -1.11 116.94 124.21 1tll h PHE 3265Ca 0.01 -0.45 -0.06 0.00 3.98 0.00 0.00 57.97 61.44 1tll h PHE 3265Cb 0.47 -0.02 -0.01 0.00 2.56 0.00 0.00 35.95 38.94 1tll h PHE 3265CO 0.00 1.35 -0.27 -0.44 -2.02 0.00 0.00 178.31 176.93 1tll h ASP 3266N 0.09 0.06 0.08 0.41 3.45 -0.40 -0.46 116.42 119.66 1tll h ASP 3266Ca -0.16 -0.02 -0.00 0.00 0.43 0.00 0.00 57.03 57.27 1tll h ASP 3266Cb 2.02 -0.02 0.00 0.00 -0.56 0.00 0.00 39.33 40.78 1tll h ASP 3266CO 0.22 0.34 -0.04 0.40 -1.57 0.00 0.00 179.24 178.59 1tll h ILE 3267N 0.06 0.00 0.00 0.35 2.04 -1.35 -0.41 117.51 118.20 1tll h ILE 3267Ca 0.01 -0.49 0.00 0.00 1.00 0.00 0.00 64.86 65.38 1tll h ILE 3267Cb 0.52 0.00 0.00 0.00 -0.74 0.00 0.00 36.82 36.60 1tll h ILE 3267CO 0.04 0.00 0.00 1.56 0.00 0.00 0.00 178.15 179.75 1tll h GLN 3268N -0.60 0.00 0.00 2.37 4.20 -1.24 -3.25 115.11 116.59 1tll h GLN 3268Ca -0.01 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.70 1tll h GLN 3268Cb 0.09 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.87 1tll h GLN 3268CO 0.02 0.00 -0.43 0.72 -0.67 0.00 0.00 178.83 178.47 1tll n HIS 3269N -2.54 0.00 1.27 2.96 8.25 -0.20 -4.79 115.22 120.17 1tll n HIS 3269Ca 0.01 0.00 0.13 0.00 -0.26 0.00 0.00 57.72 57.59 1tll n HIS 3269Cb 0.19 0.00 0.34 0.00 1.12 0.00 0.00 29.99 31.64 1tll n HIS 3269CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 1tll n LYS 3270N -1.44 1.49 -3.63 -0.41 5.02 -1.07 -4.97 118.16 113.15 1tll n LYS 3270Ca 0.00 -1.01 -0.23 0.00 -2.02 0.00 0.00 58.31 55.06 1tll n LYS 3270Cb 0.21 -1.48 0.07 0.00 -0.02 0.00 0.00 35.03 33.81 1tll n LYS 3270CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1tll n GLY 3271N 1.29 -0.45 3.72 0.72 0.00 -0.61 -4.96 105.19 104.90 1tll n GLY 3271Ca 0.15 0.18 -0.24 0.00 0.00 0.00 0.00 46.02 46.11 1tll n GLY 3271CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 1tll s MET 3272N -6.07 2.24 -0.46 1.61 0.23 -0.26 -5.01 119.30 111.58 1tll s MET 3272Ca 0.36 -1.75 0.03 0.00 -1.03 0.00 0.00 55.69 53.29 1tll s MET 3272Cb -0.17 -2.03 0.14 0.00 -1.53 0.00 0.00 34.83 31.25 1tll s MET 3272CO 0.76 -0.02 0.28 -0.80 -2.03 0.00 0.00 175.02 173.21 1tll s ASN 3273N -3.86 3.41 0.36 -1.18 -0.87 -1.26 -4.29 114.94 107.25 1tll s ASN 3273Ca 0.39 -2.79 -0.21 0.00 -1.57 0.00 0.00 52.86 48.68 1tll s ASN 3273Cb 0.02 -0.96 -0.10 0.00 -0.02 0.00 0.00 41.25 40.18 1tll s ASN 3273CO 0.22 -0.24 0.88 -2.16 -2.57 0.00 0.00 177.10 173.24 1tll s PRO 3274N 0.17 4.27 -0.19 -0.60 0.04 -1.26 -4.88 135.00 132.55 1tll s PRO 3274Ca 0.21 1.05 -0.36 0.00 0.04 0.00 0.00 61.00 61.94 1tll s PRO 3274Cb -0.18 -2.45 -0.13 0.00 0.04 0.00 0.00 34.50 31.79 1tll s PRO 3274CO -0.05 0.12 1.88 0.00 0.04 0.00 0.00 177.00 179.00 1tll n PRO 3276N 6.46 0.17 -3.69 0.00 -0.02 -1.26 -4.72 135.00 131.94 1tll n PRO 3276Ca 0.26 0.10 -0.22 0.00 -2.02 0.00 0.00 63.50 61.62 1tll n PRO 3276Cb 0.23 -1.75 -0.04 0.00 -0.02 0.00 0.00 33.50 31.92 1tll n PRO 3276CO 0.00 0.00 0.00 -1.64 1.98 0.00 0.00 175.50 175.84 1tll s MET 3277N -2.80 2.46 -0.11 -0.52 -1.94 0.05 -4.36 119.30 112.08 1tll s MET 3277Ca 0.62 -1.62 0.03 0.00 -1.71 0.00 0.00 55.69 53.01 1tll s MET 3277Cb -0.32 -2.29 0.01 0.00 2.01 0.00 0.00 34.83 34.24 1tll s MET 3277CO 0.61 -0.19 -0.19 0.08 -0.01 0.00 0.00 175.02 175.32 1tll s VAL 3278N -2.51 1.79 -0.26 -6.03 1.01 -0.68 0.08 120.40 113.80 1tll s VAL 3278Ca 0.46 -0.84 -0.08 0.00 0.00 0.00 0.00 61.98 61.53 1tll s VAL 3278Cb -0.02 -1.59 -0.02 0.00 0.00 0.00 0.00 36.38 34.75 1tll s VAL 3278CO 0.27 0.50 0.08 -0.22 0.00 0.00 0.00 175.10 175.73 1tll s LEU 3279N 0.71 3.57 -0.55 3.92 2.96 -1.01 -0.44 118.68 127.83 1tll s LEU 3279Ca -0.11 -0.28 -0.03 0.00 -0.22 0.00 0.00 54.13 53.49 1tll s LEU 3279Cb -0.16 -1.94 0.14 0.00 0.50 0.00 0.00 46.19 44.74 1tll s LEU 3279CO 0.02 -0.07 0.36 -0.69 -1.32 0.00 0.00 176.35 174.66 1tll s VAL 3280N 1.61 3.58 0.50 1.68 1.01 0.69 0.32 120.40 129.79 1tll s VAL 3280Ca 0.06 -2.66 0.08 0.00 0.00 0.00 0.00 61.98 59.46 1tll s VAL 3280Cb -0.16 -3.37 0.05 0.00 0.00 0.00 0.00 36.38 32.90 1tll s VAL 3280CO 0.04 -0.82 0.68 0.12 0.00 0.00 0.00 175.10 175.13 1tll s PHE 3281N 0.33 2.21 -0.27 5.22 5.99 0.24 -1.45 117.98 130.25 1tll s PHE 3281Ca 0.14 -0.51 -0.21 0.00 0.00 0.00 0.00 56.93 56.35 1tll s PHE 3281Cb -0.21 -2.35 0.08 0.00 0.00 0.00 0.00 43.02 40.54 1tll s PHE 3281CO -0.04 -0.78 0.72 0.20 -0.00 0.00 0.00 175.22 175.33 1tll s GLY 3282N -4.49 -0.56 0.34 13.12 0.00 -1.26 -1.85 107.32 112.62 1tll s GLY 3282Ca 0.58 2.22 -0.08 0.00 0.00 0.00 0.00 44.72 47.44 1tll s GLY 3282CO 0.36 2.03 0.59 0.00 0.00 0.00 0.00 173.10 176.08 1tll h ARG 3284N 0.00 -0.00 -3.23 0.00 3.08 -1.85 -1.76 114.38 110.62 1tll h ARG 3284Ca -0.28 0.00 -0.40 0.00 0.07 0.00 0.00 59.98 59.37 1tll h ARG 3284Cb 1.09 0.00 -0.40 0.00 0.08 0.00 0.00 29.97 30.74 1tll h ARG 3284CO 0.36 0.40 -0.74 -1.14 -1.07 0.00 0.00 179.97 177.78 1tll s GLN 3285N -1.83 -0.03 0.47 0.04 0.74 -1.26 -0.64 119.66 117.15 1tll s GLN 3285Ca -0.08 0.23 0.41 0.00 0.05 0.00 0.00 55.36 55.97 1tll s GLN 3285Cb -0.01 -0.94 1.48 0.00 1.10 0.00 0.00 33.01 34.63 1tll s GLN 3285CO 0.28 -0.44 1.36 -1.13 -0.55 0.00 0.00 175.29 174.81 1tll n SER 3286N 5.29 0.03 -0.40 6.67 3.41 -1.26 0.19 113.62 127.56 1tll n SER 3286Ca -0.04 0.93 0.13 0.00 -0.26 0.00 0.00 58.87 59.63 1tll n SER 3286Cb 0.50 -0.46 0.36 0.00 -0.26 0.00 0.00 64.21 64.34 1tll n SER 3286CO 0.00 0.00 0.00 2.29 -0.16 0.00 0.00 175.04 177.17 1tll n LYS 3287N -3.81 1.24 0.05 4.33 2.85 -1.26 -4.21 118.16 117.35 1tll n LYS 3287Ca 0.38 -0.79 0.00 0.00 -1.05 0.00 0.00 58.31 56.85 1tll n LYS 3287Cb 1.70 -1.48 0.00 0.00 -0.65 0.00 0.00 35.03 34.59 1tll n LYS 3287CO 0.00 0.00 0.00 -0.89 -0.05 0.00 0.00 177.40 176.46 1tll n ILE 3288N -0.19 0.89 1.71 0.58 2.08 0.50 -4.68 119.36 120.25 1tll n ILE 3288Ca 0.14 0.29 0.14 0.00 0.56 0.00 0.00 62.75 63.88 1tll n ILE 3288Cb 0.38 -1.36 0.66 0.00 -0.75 0.00 0.00 39.64 38.57 1tll n ILE 3288CO 0.00 0.00 0.00 0.47 0.56 0.00 0.00 176.55 177.58 1tll n ASP 3289N -3.29 0.77 -3.57 4.38 10.43 -0.62 -2.71 116.55 121.95 1tll n ASP 3289Ca 0.00 -1.34 -0.41 0.00 2.57 0.00 0.00 54.79 55.61 1tll n ASP 3289Cb 0.00 -0.02 -0.01 0.00 1.84 0.00 0.00 41.12 42.93 1tll n ASP 3289CO 0.00 0.00 0.00 1.57 -1.07 0.00 0.00 177.20 177.70 1tll n HIS 3290N -0.36 3.08 -1.84 1.24 -0.00 -1.26 -4.74 115.22 111.34 1tll n HIS 3290Ca 0.20 -3.02 -0.41 0.00 0.46 0.00 0.00 57.72 54.95 1tll n HIS 3290Cb 0.22 -2.51 -0.01 0.00 -0.12 0.00 0.00 29.99 27.57 1tll n HIS 3290CO 0.00 0.00 0.00 0.96 0.46 0.00 0.00 176.34 177.76 1tll s ILE 3291N 2.68 2.16 -1.58 3.57 -4.36 -1.26 -2.45 121.20 119.97 1tll s ILE 3291Ca 0.56 0.15 -0.01 0.00 -0.26 0.00 0.00 60.65 61.09 1tll s ILE 3291Cb 0.16 -3.10 0.00 0.00 1.25 0.00 0.00 42.46 40.77 1tll s ILE 3291CO -0.08 0.03 0.13 -1.22 0.24 0.00 0.00 174.94 174.05 1tll n TYR 3292N 1.09 -1.12 0.03 1.37 4.01 -1.26 -4.92 117.16 116.35 1tll n TYR 3292Ca 0.03 0.11 -0.13 0.00 -0.16 0.00 0.00 57.90 57.76 1tll n TYR 3292Cb 0.39 -3.83 -0.09 0.00 -0.31 0.00 0.00 39.34 35.50 1tll n TYR 3292CO 0.00 0.00 0.00 -0.09 -0.46 0.00 0.00 176.86 176.31 1tll h ARG 3293N -0.30 -0.04 -0.37 -0.72 2.43 -1.89 -1.79 114.38 111.70 1tll h ARG 3293Ca -0.46 0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 58.70 1tll h ARG 3293Cb 1.33 0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 30.87 1tll h ARG 3293CO 0.53 0.22 0.19 1.49 -1.51 0.00 0.00 179.97 180.89 1tll h GLU 3294N -0.30 0.50 -0.31 0.20 4.81 -1.91 -0.96 114.58 116.62 1tll h GLU 3294Ca -0.00 -0.05 -0.13 0.00 -0.13 0.00 0.00 59.36 59.05 1tll h GLU 3294Cb 0.28 -0.10 -0.00 0.00 0.63 0.00 0.00 28.75 29.55 1tll h GLU 3294CO 0.01 0.39 -0.31 0.93 -0.73 0.00 0.00 179.01 179.29 1tll h GLU 3295N 0.51 0.76 -0.19 1.92 5.08 -1.91 0.68 114.58 121.43 1tll h GLU 3295Ca 0.13 -0.40 -0.16 0.00 -1.00 0.00 0.00 59.36 57.93 1tll h GLU 3295Cb 0.04 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.30 1tll h GLU 3295CO -0.02 1.03 -0.55 1.79 -1.00 0.00 0.00 179.01 180.25 1tll h THR 3296N 0.52 1.32 0.15 1.13 1.35 -1.14 -1.55 112.91 114.68 1tll h THR 3296Ca 0.05 -1.80 0.02 0.00 -0.55 0.00 0.00 66.41 64.12 1tll h THR 3296Cb 0.89 1.77 -0.04 0.00 -1.73 0.00 0.00 68.15 69.04 1tll h THR 3296CO 0.08 0.56 -0.35 0.25 -0.25 0.00 0.00 175.52 175.81 1tll h LEU 3297N 0.45 -1.00 -0.70 3.87 5.85 -1.03 -2.02 115.31 120.72 1tll h LEU 3297Ca 0.01 0.11 0.05 0.00 0.84 0.00 0.00 57.88 58.89 1tll h LEU 3297Cb 1.11 0.37 -0.05 0.00 0.37 0.00 0.00 40.66 42.46 1tll h LEU 3297CO 0.11 -0.44 0.41 -0.61 -0.34 0.00 0.00 178.44 177.56 1tll h GLN 3298N -0.60 0.74 -0.06 1.25 4.15 -0.74 -1.30 115.11 118.55 1tll h GLN 3298Ca 0.02 -0.04 0.02 0.00 0.77 0.00 0.00 58.65 59.41 1tll h GLN 3298Cb 0.61 -0.17 -0.00 0.00 0.21 0.00 0.00 27.48 28.13 1tll h GLN 3298CO -0.19 0.49 0.12 0.00 -1.93 0.00 0.00 178.83 177.33 1tll h ALA 3299N 1.34 1.41 0.01 3.38 0.00 -0.69 -0.87 119.26 123.86 1tll h ALA 3299Ca 0.31 -0.00 -0.03 0.00 0.00 0.00 0.00 54.91 55.18 1tll h ALA 3299Cb 0.15 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.95 1tll h ALA 3299CO -0.16 -0.16 -0.13 -0.22 0.00 0.00 0.00 179.25 178.58 1tll h LYS 3300N 0.00 0.06 0.00 0.00 3.64 -0.55 0.96 116.57 120.68 1tll h LYS 3300Ca 0.03 -0.08 0.00 0.00 -1.27 0.00 0.00 60.65 59.32 1tll h LYS 3300Cb 0.28 0.03 0.00 0.00 -0.41 0.00 0.00 32.23 32.12 1tll h LYS 3300CO -0.00 0.96 0.12 -0.91 -2.27 0.00 0.00 179.45 177.35 1tll h ASN 3301N -0.80 0.00 -0.21 4.20 2.35 -0.91 0.33 115.58 120.55 1tll h ASN 3301Ca -0.02 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.73 1tll h ASN 3301Cb 1.01 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.38 1tll h ASN 3301CO 0.02 0.00 0.00 0.29 -1.65 0.00 0.00 177.43 176.09 1tll n LYS 3302N -2.26 1.90 -0.54 0.81 5.02 -0.95 -4.97 118.16 117.19 1tll n LYS 3302Ca -0.01 -1.83 0.00 0.00 -2.02 0.00 0.00 58.31 54.45 1tll n LYS 3302Cb 0.15 -1.36 0.00 0.00 -0.02 0.00 0.00 35.03 33.80 1tll n LYS 3302CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1tll n GLY 3303N 1.01 0.75 0.08 0.72 0.00 0.11 -4.94 105.19 102.92 1tll n GLY 3303Ca 0.13 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 46.01 1tll n GLY 3303CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1tll h VAL 3304N 0.00 1.45 -3.23 1.61 2.07 -1.00 -3.41 116.25 113.75 1tll h VAL 3304Ca 0.00 -1.45 -0.66 0.00 0.82 0.00 0.00 66.70 65.41 1tll h VAL 3304Cb 0.00 2.34 -0.15 0.00 -1.52 0.00 0.00 31.29 31.96 1tll h VAL 3304CO 0.00 0.39 -0.60 -0.36 0.02 0.00 0.00 177.57 177.03 1tll s PHE 3305N -3.84 3.22 -0.11 1.57 0.40 -0.92 -0.77 117.98 117.52 1tll s PHE 3305Ca -0.16 0.14 -0.28 0.00 -0.60 0.00 0.00 56.93 56.03 1tll s PHE 3305Cb 0.02 -1.90 -0.25 0.00 0.51 0.00 0.00 43.02 41.39 1tll s PHE 3305CO 0.71 0.35 0.89 -0.09 0.70 0.00 0.00 175.22 177.78 1tll h ARG 3306N 5.74 0.03 -3.00 0.44 2.43 -0.63 -3.41 114.38 115.98 1tll h ARG 3306Ca -0.45 -0.04 -0.11 0.00 -0.81 0.00 0.00 59.98 58.57 1tll h ARG 3306Cb 1.19 0.01 -0.20 0.00 -0.42 0.00 0.00 29.97 30.56 1tll h ARG 3306CO 0.60 0.91 -0.24 -1.21 -1.51 0.00 0.00 179.97 178.52 1tll s GLU 3307N -2.68 0.71 -0.22 0.20 0.41 -1.23 -5.06 118.70 110.84 1tll s GLU 3307Ca -0.18 -0.20 -0.00 0.00 -0.41 0.00 0.00 54.97 54.18 1tll s GLU 3307Cb -0.02 0.32 0.02 0.00 -1.78 0.00 0.00 34.13 32.68 1tll s GLU 3307CO 0.70 -0.20 -0.11 -0.51 -0.49 0.00 0.00 175.26 174.64 1tll s LEU 3308N -1.41 2.82 -0.21 1.80 1.43 -1.26 -2.41 118.68 119.44 1tll s LEU 3308Ca -0.12 -0.81 -0.04 0.00 -1.03 0.00 0.00 54.13 52.12 1tll s LEU 3308Cb -0.04 -1.59 -0.01 0.00 0.03 0.00 0.00 46.19 44.57 1tll s LEU 3308CO 0.04 -0.08 -0.03 -0.31 0.23 0.00 0.00 176.35 176.20 1tll s TYR 3309N 1.30 2.98 0.01 0.29 1.51 0.15 -4.99 117.35 118.60 1tll s TYR 3309Ca 0.01 -0.74 0.06 0.00 -1.01 0.00 0.00 57.07 55.39 1tll s TYR 3309Cb -0.16 -2.08 -0.03 0.00 -0.11 0.00 0.00 41.96 39.58 1tll s TYR 3309CO -0.07 -0.42 -0.17 0.99 -1.11 0.00 0.00 175.55 174.77 1tll s THR 3310N 1.24 2.88 -0.07 -0.71 2.01 -1.26 -0.59 115.64 119.14 1tll s THR 3310Ca 0.03 -1.05 0.05 0.00 0.31 0.00 0.00 61.69 61.04 1tll s THR 3310Cb -0.14 -2.19 -0.01 0.00 0.01 0.00 0.00 72.50 70.17 1tll s THR 3310CO -0.01 0.41 -0.24 0.00 -0.69 0.00 0.00 174.62 174.10 1tll s ALA 3311N -0.87 2.20 -0.01 7.40 0.00 -0.77 -4.97 121.76 124.74 1tll s ALA 3311Ca 0.14 -1.02 0.06 0.00 0.00 0.00 0.00 51.96 51.13 1tll s ALA 3311Cb -0.11 -0.73 -0.03 0.00 0.00 0.00 0.00 23.12 22.25 1tll s ALA 3311CO 0.04 0.39 -0.18 0.71 0.00 0.00 0.00 175.76 176.73 1tll s TYR 3312N -0.07 2.58 -0.11 0.00 1.51 -1.19 -1.10 117.35 118.97 1tll s TYR 3312Ca -0.06 -0.24 0.09 0.00 -1.01 0.00 0.00 57.07 55.84 1tll s TYR 3312Cb -0.15 -1.54 -0.13 0.00 -0.11 0.00 0.00 41.96 40.04 1tll s TYR 3312CO 0.05 0.18 0.24 -1.13 -1.11 0.00 0.00 175.55 173.78 1tll n SER 3313N 2.00 2.29 -1.05 2.29 3.41 -0.66 -1.05 113.62 120.86 1tll n SER 3313Ca -0.16 -0.18 0.05 0.00 -0.26 0.00 0.00 58.87 58.32 1tll n SER 3313Cb 0.52 1.31 0.11 0.00 -0.26 0.00 0.00 64.21 65.89 1tll n SER 3313CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1tll n ARG 3314N -1.66 0.75 -2.27 4.33 1.74 0.19 -4.52 116.66 115.22 1tll n ARG 3314Ca -0.01 -2.59 -0.43 0.00 -0.77 0.00 0.00 57.85 54.05 1tll n ARG 3314Cb 0.21 -0.78 -0.02 0.00 -1.02 0.00 0.00 32.46 30.85 1tll n ARG 3314CO 0.00 0.00 0.00 -1.21 -1.52 0.00 0.00 177.63 174.90 1tll s GLU 3315N -1.54 3.72 0.09 5.56 0.41 -1.06 -4.72 118.70 121.16 1tll s GLU 3315Ca 0.35 1.28 0.05 0.00 -0.41 0.00 0.00 54.97 56.24 1tll s GLU 3315Cb 0.37 -4.00 0.25 0.00 -1.78 0.00 0.00 34.13 28.98 1tll s GLU 3315CO -0.12 -1.38 1.05 -2.30 -0.49 0.00 0.00 175.26 172.02 1tll n PRO 3316N 7.75 0.03 0.00 0.39 -0.02 -1.26 -3.75 135.00 138.14 1tll n PRO 3316Ca 0.17 0.45 0.00 0.00 -2.02 0.00 0.00 63.50 62.10 1tll n PRO 3316Cb 0.47 -1.73 0.00 0.00 -0.02 0.00 0.00 33.50 32.22 1tll n PRO 3316CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 1tll n ASP 3317N -1.60 0.00 -4.40 2.55 8.00 -1.26 -5.00 116.55 114.84 1tll n ASP 3317Ca -0.00 0.00 -0.31 0.00 0.71 0.00 0.00 54.79 55.18 1tll n ASP 3317Cb 0.13 0.00 0.18 0.00 -0.02 0.00 0.00 41.12 41.41 1tll n ASP 3317CO 0.00 0.00 0.00 -2.11 -0.39 0.00 0.00 177.20 174.70 1tll n ARG 3318N 0.00 -1.41 -0.84 -1.24 1.85 -1.25 -5.02 116.66 108.75 1tll n ARG 3318Ca 0.00 -0.38 -0.29 0.00 -1.00 0.00 0.00 57.85 56.18 1tll n ARG 3318Cb 0.00 -1.94 0.24 0.00 -1.05 0.00 0.00 32.46 29.71 1tll n ARG 3318CO 0.00 0.00 0.00 -2.14 -0.01 0.00 0.00 177.63 175.48 1tll s PRO 3319N -3.88 -1.02 -0.92 2.89 0.02 -1.26 -4.59 135.00 126.24 1tll s PRO 3319Ca 0.61 0.37 -0.23 0.00 0.02 0.00 0.00 61.00 61.76 1tll s PRO 3319Cb -0.19 -1.58 0.06 0.00 0.02 0.00 0.00 34.50 32.81 1tll s PRO 3319CO 0.65 -3.67 1.34 0.21 -0.33 0.00 0.00 177.00 175.21 1tll s LYS 3320N -4.96 3.47 -0.21 5.54 2.20 -1.26 -4.71 119.74 119.81 1tll s LYS 3320Ca 0.68 -0.97 -0.11 0.00 -0.36 0.00 0.00 55.97 55.21 1tll s LYS 3320Cb -0.17 -4.96 -0.05 0.00 -1.51 0.00 0.00 37.83 31.14 1tll s LYS 3320CO 0.59 -2.12 0.17 -1.59 -0.36 0.00 0.00 175.35 172.04 1tll s LYS 3321N 4.83 4.15 0.45 4.03 -2.85 -0.21 -4.94 119.74 125.21 1tll s LYS 3321Ca 0.40 -0.19 0.08 0.00 -1.00 0.00 0.00 55.97 55.26 1tll s LYS 3321Cb -0.03 -3.47 0.02 0.00 -2.06 0.00 0.00 37.83 32.29 1tll s LYS 3321CO -0.03 0.19 0.62 0.71 0.10 0.00 0.00 175.35 176.95 1tll s TYR 3322N 0.66 2.58 0.36 1.78 4.12 -1.26 -3.20 117.35 122.39 1tll s TYR 3322Ca 0.09 -0.43 0.22 0.00 0.02 0.00 0.00 57.07 56.97 1tll s TYR 3322Cb -0.12 -2.38 1.13 0.00 -1.52 0.00 0.00 41.96 39.06 1tll s TYR 3322CO 0.01 -0.57 1.95 -0.39 0.02 0.00 0.00 175.55 176.58 1tll h VAL 3323N 0.52 0.79 0.00 0.71 -1.51 -1.91 -0.86 116.25 113.99 1tll h VAL 3323Ca -0.38 -0.85 -0.06 0.00 -1.23 0.00 0.00 66.70 64.17 1tll h VAL 3323Cb 1.28 1.52 -0.01 0.00 -2.13 0.00 0.00 31.29 31.95 1tll h VAL 3323CO 0.45 0.21 -0.28 1.56 -1.23 0.00 0.00 177.57 178.28 1tll h GLN 3324N 0.00 0.00 0.00 5.19 7.50 -1.93 -2.24 115.11 123.62 1tll h GLN 3324Ca -0.00 0.00 -0.01 0.00 0.50 0.00 0.00 58.65 59.14 1tll h GLN 3324Cb 0.50 0.00 -0.00 0.00 0.05 0.00 0.00 27.48 28.03 1tll h GLN 3324CO 0.03 0.28 -0.05 -0.44 -1.50 0.00 0.00 178.83 177.14 1tll h ASP 3325N 0.00 0.00 0.68 1.46 3.32 -1.54 -3.18 116.42 117.16 1tll h ASP 3325Ca -0.00 0.00 -0.26 0.00 0.02 0.00 0.00 57.03 56.78 1tll h ASP 3325Cb 0.59 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.13 1tll h ASP 3325CO 0.04 0.05 -1.31 0.58 -1.72 0.00 0.00 179.24 176.88 1tll h VAL 3326N 0.00 1.38 0.29 -1.35 2.07 -1.18 -2.30 116.25 115.17 1tll h VAL 3326Ca -0.00 -3.06 -0.01 0.00 0.82 0.00 0.00 66.70 64.45 1tll h VAL 3326Cb 1.04 2.79 -0.01 0.00 -1.52 0.00 0.00 31.29 33.59 1tll h VAL 3326CO 0.01 0.85 -0.19 -0.07 0.02 0.00 0.00 177.57 178.18 1tll h LEU 3327N 0.04 -0.49 0.11 2.57 3.38 -1.45 -1.69 115.31 117.77 1tll h LEU 3327Ca -0.14 0.03 -0.01 0.00 0.09 0.00 0.00 57.88 57.85 1tll h LEU 3327Cb 1.92 0.15 0.00 0.00 0.09 0.00 0.00 40.66 42.82 1tll h LEU 3327CO 0.15 -0.31 -0.05 1.56 0.09 0.00 0.00 178.44 179.88 1tll h GLN 3328N -0.47 -0.14 0.00 1.13 4.20 -1.68 0.38 115.11 118.53 1tll h GLN 3328Ca -0.03 0.01 0.00 0.00 0.06 0.00 0.00 58.65 58.69 1tll h GLN 3328Cb 0.40 0.03 0.00 0.00 0.30 0.00 0.00 27.48 28.21 1tll h GLN 3328CO 0.02 0.37 0.00 0.39 -0.67 0.00 0.00 178.83 178.93 1tll n GLU 3329N -4.86 0.62 0.00 1.46 1.02 -0.86 -3.79 120.64 114.24 1tll n GLU 3329Ca -0.08 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.06 1tll n GLU 3329Cb 0.28 -1.31 0.00 0.00 -0.02 0.00 0.00 31.44 30.40 1tll n GLU 3329CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 1tll n GLN 3330N -0.81 1.90 -0.29 3.49 6.02 -0.65 -4.99 117.38 122.06 1tll n GLN 3330Ca 0.09 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.08 1tll n GLN 3330Cb 0.04 -0.16 0.00 0.00 1.02 0.00 0.00 30.24 31.14 1tll n GLN 3330CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 1tll n LEU 3331N -0.02 0.09 -0.30 1.08 4.32 -0.56 -4.88 117.00 116.73 1tll n LEU 3331Ca 0.00 -0.69 0.34 0.00 -0.02 0.00 0.00 56.01 55.65 1tll n LEU 3331Cb 0.00 -0.01 0.75 0.00 -1.62 0.00 0.00 43.42 42.54 1tll n LEU 3331CO 0.00 0.17 1.32 0.00 -1.22 0.00 0.00 177.39 177.66 1tll h ALA 3332N 0.00 3.09 0.12 -1.18 0.00 -0.39 -1.12 119.26 119.78 1tll h ALA 3332Ca 0.00 -0.04 -0.25 0.00 0.00 0.00 0.00 54.91 54.62 1tll h ALA 3332Cb 1.22 0.09 0.00 0.00 0.00 0.00 0.00 17.79 19.10 1tll h ALA 3332CO 0.00 -1.42 -1.25 0.93 0.00 0.00 0.00 179.25 177.51 1tll h GLU 3333N 0.00 0.26 -0.27 0.00 5.08 -1.90 -2.96 114.58 114.80 1tll h GLU 3333Ca 0.55 -0.45 -0.02 0.00 -1.00 0.00 0.00 59.36 58.44 1tll h GLU 3333Cb 2.20 0.17 -0.01 0.00 0.50 0.00 0.00 28.75 31.60 1tll h GLU 3333CO -0.01 1.21 0.09 0.77 -1.00 0.00 0.00 179.01 180.08 1tll h SER 3334N -0.32 0.33 -0.10 1.42 0.02 -1.67 -1.79 113.55 111.44 1tll h SER 3334Ca -0.26 -0.03 -0.17 0.00 -0.84 0.00 0.00 61.79 60.49 1tll h SER 3334Cb 1.73 -0.08 0.01 0.00 0.14 0.00 0.00 62.40 64.19 1tll h SER 3334CO 0.09 0.32 -0.60 0.58 -1.14 0.00 0.00 176.83 176.08 1tll h VAL 3335N 0.37 1.34 -0.50 2.27 2.07 -1.37 -2.72 116.25 117.72 1tll h VAL 3335Ca 0.09 -1.90 -0.04 0.00 0.82 0.00 0.00 66.70 65.68 1tll h VAL 3335Cb 0.11 2.18 -0.02 0.00 -1.52 0.00 0.00 31.29 32.03 1tll h VAL 3335CO -0.01 0.58 0.17 0.22 0.02 0.00 0.00 177.57 178.55 1tll h TYR 3336N 0.22 0.80 -0.38 1.57 3.20 -1.29 -1.79 116.97 119.30 1tll h TYR 3336Ca -0.05 -0.07 -0.09 0.00 3.14 0.00 0.00 58.73 61.66 1tll h TYR 3336Cb 1.25 -0.23 -0.02 0.00 1.54 0.00 0.00 36.73 39.27 1tll h TYR 3336CO 0.11 0.69 -0.13 -0.09 -1.64 0.00 0.00 178.16 177.10 1tll h ARG 3337N 0.68 0.68 0.55 1.82 2.43 -1.42 -1.60 114.38 117.52 1tll h ARG 3337Ca 0.16 -0.22 -0.03 0.00 -0.81 0.00 0.00 59.98 59.09 1tll h ARG 3337Cb 0.25 -0.06 0.01 0.00 -0.42 0.00 0.00 29.97 29.75 1tll h ARG 3337CO -0.01 0.78 -0.26 0.00 -1.51 0.00 0.00 179.97 178.97 1tll h ALA 3338N 1.25 -0.74 0.00 2.80 0.00 -1.32 0.76 119.26 122.01 1tll h ALA 3338Ca 0.11 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.83 1tll h ALA 3338Cb 0.57 0.29 0.00 0.00 0.00 0.00 0.00 17.79 18.65 1tll h ALA 3338CO 0.04 -0.71 0.00 1.28 0.00 0.00 0.00 179.25 179.85 1tll n LEU 3339N -5.28 0.11 -0.04 0.00 4.77 -0.69 0.61 117.00 116.49 1tll n LEU 3339Ca -0.10 0.53 -0.05 0.00 -0.03 0.00 0.00 56.01 56.35 1tll n LEU 3339Cb 0.31 -0.51 -0.03 0.00 -2.33 0.00 0.00 43.42 40.86 1tll n LEU 3339CO 0.26 -0.30 -0.74 1.17 -1.33 0.00 0.00 177.39 176.45 1tll n LYS 3340N -1.62 0.18 -0.03 3.23 3.00 -0.60 -4.81 118.16 117.51 1tll n LYS 3340Ca 0.03 0.05 -0.04 0.00 -0.00 0.00 0.00 58.31 58.35 1tll n LYS 3340Cb 0.18 -1.11 -0.02 0.00 0.00 0.00 0.00 35.03 34.08 1tll n LYS 3340CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.40 177.79 1tll n GLU 3341N -2.78 0.12 -0.00 1.64 1.02 0.16 -4.70 120.64 116.11 1tll n GLU 3341Ca -0.13 0.03 0.13 0.00 -0.02 0.00 0.00 57.16 57.17 1tll n GLU 3341Cb 0.64 -1.07 0.76 0.00 -0.02 0.00 0.00 31.44 31.75 1tll n GLU 3341CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 1tll n GLN 3342N -2.69 1.07 -2.91 3.49 6.02 0.21 -4.90 117.38 117.68 1tll n GLN 3342Ca -0.09 -0.11 -0.19 0.00 -0.01 0.00 0.00 57.00 56.60 1tll n GLN 3342Cb 0.59 -1.42 0.03 0.00 1.02 0.00 0.00 30.24 30.46 1tll n GLN 3342CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1tll n GLY 3343N 0.94 -0.34 3.76 1.08 0.00 -0.84 -4.56 105.19 105.23 1tll n GLY 3343Ca 0.20 -0.01 -0.30 0.00 0.00 0.00 0.00 46.02 45.91 1tll n GLY 3343CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1tll s GLY 3344N -2.76 1.65 -0.01 -0.02 0.00 0.20 -4.74 107.32 101.65 1tll s GLY 3344Ca 0.26 -0.92 0.04 0.00 0.00 0.00 0.00 44.72 44.09 1tll s GLY 3344CO 0.32 -0.16 -0.11 0.30 0.00 0.00 0.00 173.10 173.45 1tll s HIS 3345N -3.37 1.03 -0.10 1.90 3.76 0.48 -4.65 115.29 114.34 1tll s HIS 3345Ca 0.70 -0.20 0.01 0.00 -0.15 0.00 0.00 55.06 55.43 1tll s HIS 3345Cb -0.09 -0.67 0.02 0.00 1.11 0.00 0.00 32.58 32.95 1tll s HIS 3345CO 0.54 -0.02 -0.13 -1.50 -0.85 0.00 0.00 174.74 172.79 1tll s ILE 3346N -0.26 1.30 -0.18 0.60 2.07 -0.65 0.89 121.20 124.97 1tll s ILE 3346Ca 0.04 -0.52 -0.03 0.00 -1.41 0.00 0.00 60.65 58.73 1tll s ILE 3346Cb -0.05 -1.22 -0.02 0.00 0.13 0.00 0.00 42.46 41.31 1tll s ILE 3346CO -0.00 0.40 -0.06 -0.31 -1.91 0.00 0.00 174.94 173.06 1tll s TYR 3347N 1.06 2.94 -0.13 3.50 1.51 -0.02 -0.81 117.35 125.40 1tll s TYR 3347Ca -0.06 -0.64 0.01 0.00 -1.01 0.00 0.00 57.07 55.36 1tll s TYR 3347Cb -0.15 -2.00 -0.01 0.00 -0.11 0.00 0.00 41.96 39.70 1tll s TYR 3347CO -0.02 -0.29 -0.16 0.08 -1.11 0.00 0.00 175.55 174.05 1tll s VAL 3348N 0.84 2.75 -0.02 0.71 1.01 0.16 -0.27 120.40 125.59 1tll s VAL 3348Ca -0.02 -0.76 0.00 0.00 0.00 0.00 0.00 61.98 61.20 1tll s VAL 3348Cb -0.15 -2.14 0.02 0.00 0.00 0.00 0.00 36.38 34.11 1tll s VAL 3348CO 0.01 0.53 0.02 0.00 0.00 0.00 0.00 175.10 175.66 1tll n GLY 3350N 3.94 0.75 3.60 0.00 0.00 -0.56 -4.28 105.19 108.64 1tll n GLY 3350Ca -0.24 -1.82 -0.45 0.00 0.00 0.00 0.00 46.02 43.51 1tll n GLY 3350CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1tll n ASP 3351N 0.00 1.52 -0.00 1.61 -0.08 -1.26 -2.23 116.55 116.10 1tll n ASP 3351Ca 0.00 1.18 0.03 0.00 -1.51 0.00 0.00 54.79 54.48 1tll n ASP 3351Cb 0.00 -1.31 0.38 0.00 2.34 0.00 0.00 41.12 42.54 1tll n ASP 3351CO 0.00 0.00 0.00 1.62 0.12 0.00 0.00 177.20 178.94 1tll h VAL 3352N 2.18 1.13 0.50 5.18 3.04 -1.76 -1.65 116.25 124.88 1tll h VAL 3352Ca -0.41 -0.37 -0.02 0.00 -1.01 0.00 0.00 66.70 64.89 1tll h VAL 3352Cb 1.33 0.62 0.00 0.00 -2.01 0.00 0.00 31.29 31.24 1tll h VAL 3352CO 0.63 0.15 -0.24 0.74 -1.01 0.00 0.00 177.57 177.84 1tll h THR 3353N 0.55 0.48 -0.23 3.17 2.02 -1.84 -1.68 112.91 115.38 1tll h THR 3353Ca 0.14 -0.18 0.06 0.00 0.77 0.00 0.00 66.41 67.20 1tll h THR 3353Cb 0.05 0.57 -0.07 0.00 -1.74 0.00 0.00 68.15 66.96 1tll h THR 3353CO -0.02 0.03 -0.21 -0.03 0.37 0.00 0.00 175.52 175.66 1tll h MET 3354N -0.79 -0.21 -0.49 6.66 -1.53 -1.88 0.16 114.93 116.85 1tll h MET 3354Ca -0.07 0.01 0.12 0.00 -3.44 0.00 0.00 59.70 56.33 1tll h MET 3354Cb 0.57 0.05 -0.02 0.00 -0.55 0.00 0.00 31.60 31.64 1tll h MET 3354CO 0.11 -0.14 0.34 0.00 0.14 0.00 0.00 176.91 177.37 1tll h ALA 3355N 0.86 2.32 0.16 0.39 0.00 -1.24 0.14 119.26 121.89 1tll h ALA 3355Ca 0.13 -0.01 -0.29 0.00 0.00 0.00 0.00 54.91 54.74 1tll h ALA 3355Cb 0.42 0.00 0.03 0.00 0.00 0.00 0.00 17.79 18.25 1tll h ALA 3355CO -0.36 -0.45 -1.22 0.00 0.00 0.00 0.00 179.25 177.22 1tll h ALA 3356N 1.76 -0.07 -0.19 0.00 0.00 -0.13 -2.11 119.26 118.52 1tll h ALA 3356Ca 0.23 -0.78 -0.03 0.00 0.00 0.00 0.00 54.91 54.33 1tll h ALA 3356Cb 0.78 0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.68 1tll h ALA 3356CO -0.02 0.62 -0.01 -0.44 0.00 0.00 0.00 179.25 179.39 1tll h ASP 3357N 0.12 0.26 -0.25 0.00 5.19 -0.05 -1.44 116.42 120.26 1tll h ASP 3357Ca -0.20 -0.03 -0.16 0.00 -0.62 0.00 0.00 57.03 56.02 1tll h ASP 3357Cb 1.93 -0.07 0.00 0.00 0.18 0.00 0.00 39.33 41.37 1tll h ASP 3357CO 0.23 0.32 -0.47 0.58 -3.12 0.00 0.00 179.24 176.78 1tll h VAL 3358N 0.28 1.30 0.29 -1.35 2.07 -0.99 -1.59 116.25 116.26 1tll h VAL 3358Ca 0.07 -1.68 -0.01 0.00 0.82 0.00 0.00 66.70 65.89 1tll h VAL 3358Cb 0.22 1.74 0.00 0.00 -1.52 0.00 0.00 31.29 31.73 1tll h VAL 3358CO 0.01 0.54 -0.14 0.25 0.02 0.00 0.00 177.57 178.24 1tll h LEU 3359N 0.49 -0.33 -2.44 2.57 6.46 -0.85 -0.07 115.31 121.14 1tll h LEU 3359Ca 0.01 -0.07 0.01 0.00 -0.12 0.00 0.00 57.88 57.71 1tll h LEU 3359Cb 1.08 0.08 -0.00 0.00 -0.73 0.00 0.00 40.66 41.09 1tll h LEU 3359CO 0.11 -0.14 0.04 0.11 -0.62 0.00 0.00 178.44 177.94 1tll h LYS 3360N -0.50 0.00 0.11 1.25 1.79 -1.32 -0.33 116.57 117.57 1tll h LYS 3360Ca -0.04 0.00 -0.01 0.00 -2.18 0.00 0.00 60.65 58.43 1tll h LYS 3360Cb 0.37 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.02 1tll h LYS 3360CO 0.06 0.00 -0.05 0.00 -1.08 0.00 0.00 179.45 178.38 1tll h ALA 3361N 1.95 -0.14 -0.95 3.86 0.00 -0.53 -3.19 119.26 120.25 1tll h ALA 3361Ca 0.02 -0.23 0.07 0.00 0.00 0.00 0.00 54.91 54.77 1tll h ALA 3361Cb 0.09 0.06 -0.07 0.00 0.00 0.00 0.00 17.79 17.87 1tll h ALA 3361CO -0.00 -0.18 0.61 0.82 0.00 0.00 0.00 179.25 180.49 1tll h ILE 3362N -0.94 1.05 -0.54 0.00 2.04 -0.69 0.12 117.51 118.56 1tll h ILE 3362Ca -0.01 -0.37 0.10 0.00 1.00 0.00 0.00 64.86 65.57 1tll h ILE 3362Cb 0.50 -0.13 -0.03 0.00 -0.74 0.00 0.00 36.82 36.43 1tll h ILE 3362CO 0.02 0.20 0.37 -0.61 0.00 0.00 0.00 178.15 178.13 1tll h GLN 3363N 1.08 0.31 0.24 2.37 4.15 -1.16 -0.71 115.11 121.39 1tll h GLN 3363Ca 0.42 -0.02 -0.34 0.00 0.77 0.00 0.00 58.65 59.49 1tll h GLN 3363Cb 0.21 -0.07 0.03 0.00 0.21 0.00 0.00 27.48 27.86 1tll h GLN 3363CO -0.19 0.20 -1.50 0.00 -1.93 0.00 0.00 178.83 175.42 1tll h ARG 3364N 0.32 0.51 0.00 1.69 -0.00 -1.04 -2.81 114.38 113.05 1tll h ARG 3364Ca 0.25 -0.87 0.00 0.00 -0.50 0.00 0.00 59.98 58.86 1tll h ARG 3364Cb 0.57 0.32 0.00 0.00 0.00 0.00 0.00 29.97 30.86 1tll h ARG 3364CO -0.06 1.41 0.07 0.82 0.00 0.00 0.00 179.97 182.22 1tll h ILE 3365N 0.14 0.00 0.22 2.04 2.04 0.20 0.41 117.51 122.56 1tll h ILE 3365Ca -0.26 0.00 -0.34 0.00 1.00 0.00 0.00 64.86 65.26 1tll h ILE 3365Cb 2.15 0.72 0.02 0.00 -0.74 0.00 0.00 36.82 38.98 1tll h ILE 3365CO 0.26 0.00 -1.60 0.24 0.00 0.00 0.00 178.15 177.05 1tll h MET 3366N 0.00 0.47 0.00 2.37 2.86 -1.05 -3.08 114.93 116.49 1tll h MET 3366Ca 0.00 -0.80 0.00 0.00 -2.06 0.00 0.00 59.70 56.84 1tll h MET 3366Cb 0.15 0.30 0.00 0.00 0.06 0.00 0.00 31.60 32.11 1tll h MET 3366CO 0.00 1.38 0.00 2.41 1.06 0.00 0.00 176.91 181.76 1tll n THR 3367N -3.65 0.00 0.00 2.22 -1.04 0.12 -2.26 114.28 109.67 1tll n THR 3367Ca -0.20 1.03 0.00 0.00 -2.04 0.00 0.00 64.05 62.84 1tll n THR 3367Cb 1.09 -1.93 0.00 0.00 -1.82 0.00 0.00 70.33 67.67 1tll n THR 3367CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1tll n GLN 3368N -1.21 0.00 0.24 -2.82 6.02 -0.14 0.14 117.38 119.61 1tll n GLN 3368Ca 0.00 0.97 0.07 0.00 -0.01 0.00 0.00 57.00 58.03 1tll n GLN 3368Cb 0.00 -1.47 0.58 0.00 1.02 0.00 0.00 30.24 30.38 1tll n GLN 3368CO 0.00 0.00 0.00 0.37 -1.01 0.00 0.00 177.06 176.42 1tll h GLN 3369N 0.00 0.00 0.00 -1.09 5.75 -1.71 -3.30 115.11 114.76 1tll h GLN 3369Ca 0.00 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.50 1tll h GLN 3369Cb 0.00 0.00 0.00 0.00 1.07 0.00 0.00 27.48 28.55 1tll h GLN 3369CO 0.00 0.11 -0.54 0.41 -2.65 0.00 0.00 178.83 176.16 1tll n GLY 3370N -1.19 0.26 2.38 2.39 0.00 -0.96 -5.07 105.19 103.00 1tll n GLY 3370Ca -0.03 -0.16 -0.04 0.00 0.00 0.00 0.00 46.02 45.80 1tll n GLY 3370CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1tll n LYS 3371N -1.29 -1.31 -3.76 1.61 4.76 0.38 -5.01 118.16 113.53 1tll n LYS 3371Ca 0.01 1.41 -0.13 0.00 -2.87 0.00 0.00 58.31 56.73 1tll n LYS 3371Cb 0.11 -4.13 -0.09 0.00 -1.84 0.00 0.00 35.03 29.08 1tll n LYS 3371CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 1tll s LEU 3372N -2.34 0.87 0.75 -0.35 1.43 -1.24 -5.03 118.68 112.77 1tll s LEU 3372Ca 0.11 0.05 -0.12 0.00 -1.03 0.00 0.00 54.13 53.15 1tll s LEU 3372Cb -0.03 1.26 0.04 0.00 0.03 0.00 0.00 46.19 47.49 1tll s LEU 3372CO 0.48 -0.46 1.13 -0.94 0.23 0.00 0.00 176.35 176.78 1tll s SER 3373N -1.40 5.06 0.00 2.29 1.04 -1.26 -4.29 113.70 115.14 1tll s SER 3373Ca -0.13 1.02 0.00 0.00 0.48 0.00 0.00 55.95 57.32 1tll s SER 3373Cb -0.05 -1.70 0.00 0.00 0.10 0.00 0.00 66.02 64.37 1tll s SER 3373CO 0.03 -1.57 0.34 -1.84 0.98 0.00 0.00 173.24 171.18 1tll n GLU 3374N -3.14 0.00 -0.00 4.02 0.00 -1.26 -0.02 120.64 120.24 1tll n GLU 3374Ca 0.07 0.00 0.01 0.00 0.00 0.00 0.00 57.16 57.24 1tll n GLU 3374Cb 0.58 -1.40 -0.02 0.00 0.00 0.00 0.00 31.44 30.61 1tll n GLU 3374CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.13 176.28 1tll n GLU 3375N -0.83 1.94 0.02 3.44 -0.00 -1.26 -3.89 120.64 120.07 1tll n GLU 3375Ca 0.00 -0.01 0.11 0.00 -0.00 0.00 0.00 57.16 57.26 1tll n GLU 3375Cb 0.00 -0.92 -0.11 0.00 -0.00 0.00 0.00 31.44 30.42 1tll n GLU 3375CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.13 176.88 1tll n ASP 3376N -1.42 0.33 -0.10 -1.84 10.43 0.98 -3.25 116.55 121.68 1tll n ASP 3376Ca -0.00 -0.03 -0.11 0.00 2.57 0.00 0.00 54.79 57.21 1tll n ASP 3376Cb 0.05 1.46 -0.13 0.00 1.84 0.00 0.00 41.12 44.34 1tll n ASP 3376CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 1tll n ALA 3377N -2.13 1.54 -0.05 2.24 0.00 -0.30 -3.71 120.51 118.10 1tll n ALA 3377Ca -0.02 -1.09 -0.06 0.00 0.00 0.00 0.00 53.44 52.27 1tll n ALA 3377Cb 0.53 -0.09 0.14 0.00 0.00 0.00 0.00 19.45 20.03 1tll n ALA 3377CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 1tll h GLY 3378N 2.82 0.71 1.49 0.00 0.00 -1.74 -2.51 103.07 103.84 1tll h GLY 3378Ca -0.49 -0.59 0.00 0.00 0.00 0.00 0.00 47.33 46.25 1tll h GLY 3378CO -0.01 0.54 -0.34 -0.62 0.00 0.00 0.00 176.54 176.11 1tll n VAL 3379N -4.12 0.29 0.11 4.60 0.31 -1.20 -2.93 118.33 115.38 1tll n VAL 3379Ca 0.00 -0.18 -0.02 0.00 -0.01 0.00 0.00 64.34 64.13 1tll n VAL 3379Cb 0.42 -0.24 0.01 0.00 -0.91 0.00 0.00 33.84 33.12 1tll n VAL 3379CO 0.00 0.00 0.00 0.15 -1.32 0.00 0.00 176.83 175.66 1tll h PHE 3380N 0.00 0.00 0.00 3.52 3.04 -1.56 -2.17 116.94 119.78 1tll h PHE 3380Ca 0.00 0.00 -0.03 0.00 3.98 0.00 0.00 57.97 61.92 1tll h PHE 3380Cb 0.65 0.00 -0.00 0.00 2.56 0.00 0.00 35.95 39.16 1tll h PHE 3380CO 0.00 0.75 -0.12 0.82 -2.02 0.00 0.00 178.31 177.74 1tll h ILE 3381N 0.00 0.22 -0.28 1.41 2.04 -1.39 -2.11 117.51 117.40 1tll h ILE 3381Ca -0.01 -1.26 -0.17 0.00 1.00 0.00 0.00 64.86 64.43 1tll h ILE 3381Cb 1.47 2.06 -0.00 0.00 -0.74 0.00 0.00 36.82 39.61 1tll h ILE 3381CO 0.10 0.12 -0.50 -1.28 0.00 0.00 0.00 178.15 176.59 1tll h SER 3382N 0.00 0.84 1.17 1.72 0.87 -1.34 -1.24 113.55 115.58 1tll h SER 3382Ca -0.00 -0.43 -0.04 0.00 -1.23 0.00 0.00 61.79 60.09 1tll h SER 3382Cb 1.05 -0.24 -0.01 0.00 -0.44 0.00 0.00 62.40 62.77 1tll h SER 3382CO 0.02 1.19 -0.19 -0.09 -0.53 0.00 0.00 176.83 177.23 1tll h ARG 3383N 0.60 0.00 -0.00 2.24 2.43 -1.13 -2.66 114.38 115.85 1tll h ARG 3383Ca 0.03 0.00 -0.04 0.00 -0.81 0.00 0.00 59.98 59.16 1tll h ARG 3383Cb 1.07 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.63 1tll h ARG 3383CO 0.11 0.19 -0.16 -0.07 -1.51 0.00 0.00 179.97 178.53 1tll h LEU 3384N 0.00 0.14 -2.28 3.80 3.38 -0.98 -1.58 115.31 117.80 1tll h LEU 3384Ca -0.00 -0.78 -0.00 0.00 0.09 0.00 0.00 57.88 57.19 1tll h LEU 3384Cb 0.83 -0.04 -0.00 0.00 0.09 0.00 0.00 40.66 41.54 1tll h LEU 3384CO 0.02 0.90 -0.02 0.03 0.09 0.00 0.00 178.44 179.46 1tll h ARG 3385N -0.60 0.00 0.00 1.13 3.08 -1.17 0.45 114.38 117.27 1tll h ARG 3385Ca -0.02 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.03 1tll h ARG 3385Cb 0.92 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.97 1tll h ARG 3385CO 0.03 0.02 -1.74 -0.25 -1.07 0.00 0.00 179.97 176.96 1tll n ASP 3386N -3.20 0.24 -0.06 7.04 8.00 -1.01 -3.71 116.55 123.85 1tll n ASP 3386Ca -0.02 -0.20 0.13 0.00 0.71 0.00 0.00 54.79 55.42 1tll n ASP 3386Cb 0.18 1.72 0.47 0.00 -0.02 0.00 0.00 41.12 43.47 1tll n ASP 3386CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 1tll n ASP 3387N -2.11 0.43 -2.38 -2.24 9.92 -0.59 -4.93 116.55 114.64 1tll n ASP 3387Ca -0.02 -0.24 -0.14 0.00 -0.53 0.00 0.00 54.79 53.85 1tll n ASP 3387Cb 0.52 -0.05 0.05 0.00 -0.64 0.00 0.00 41.12 41.00 1tll n ASP 3387CO 0.00 0.00 0.00 -3.20 0.13 0.00 0.00 177.20 174.13 1tll n ASN 3388N -1.23 -4.53 -0.00 -2.24 5.15 -0.01 -4.93 115.26 107.47 1tll n ASN 3388Ca 0.09 -0.33 0.03 0.00 -0.60 0.00 0.00 54.58 53.77 1tll n ASN 3388Cb 0.32 -3.25 -0.04 0.00 -0.53 0.00 0.00 39.78 36.28 1tll n ASN 3388CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 1tll n ARG 3389N -3.22 4.07 -3.92 1.20 1.74 -0.28 -4.84 116.66 111.41 1tll n ARG 3389Ca -0.00 -0.01 -0.33 0.00 -0.77 0.00 0.00 57.85 56.73 1tll n ARG 3389Cb 0.54 -0.86 -0.14 0.00 -1.02 0.00 0.00 32.46 30.99 1tll n ARG 3389CO 0.00 0.00 0.00 -0.47 -1.52 0.00 0.00 177.63 175.64 1tll s TYR 3390N -1.74 3.67 -0.14 -1.55 6.14 -1.19 -1.64 117.35 120.89 1tll s TYR 3390Ca 0.01 -2.71 -0.12 0.00 0.64 0.00 0.00 57.07 54.90 1tll s TYR 3390Cb 0.05 -3.00 -0.05 0.00 0.42 0.00 0.00 41.96 39.38 1tll s TYR 3390CO 0.26 -0.95 0.23 -1.01 0.64 0.00 0.00 175.55 174.72 1tll s HIS 3391N 1.02 3.51 -0.04 4.97 3.76 0.01 -4.45 115.29 124.06 1tll s HIS 3391Ca 0.09 0.57 0.04 0.00 -0.15 0.00 0.00 55.06 55.61 1tll s HIS 3391Cb -0.21 -2.20 -0.00 0.00 1.11 0.00 0.00 32.58 31.28 1tll s HIS 3391CO -0.06 0.41 -0.17 -1.21 -0.85 0.00 0.00 174.74 172.86 1tll s GLU 3392N -0.08 1.71 -0.35 1.40 2.02 -1.26 0.39 118.70 122.53 1tll s GLU 3392Ca 0.15 -0.61 -0.00 0.00 0.02 0.00 0.00 54.97 54.53 1tll s GLU 3392Cb -0.13 -1.51 0.12 0.00 0.10 0.00 0.00 34.13 32.71 1tll s GLU 3392CO 0.04 0.26 0.17 0.34 0.02 0.00 0.00 175.26 176.09 1tll s ASP 3393N -0.03 3.49 -0.10 -0.19 2.15 -0.07 -4.93 116.67 116.99 1tll s ASP 3393Ca -0.02 -1.98 -0.29 0.00 0.43 0.00 0.00 52.55 50.69 1tll s ASP 3393Cb -0.11 -0.65 -0.01 0.00 -0.30 0.00 0.00 42.92 41.85 1tll s ASP 3393CO 0.02 -0.35 0.98 -0.63 -0.17 0.00 0.00 175.17 175.01 1tll s ILE 3394N 1.24 4.81 -0.91 4.11 -1.09 -1.26 -1.50 121.20 126.60 1tll s ILE 3394Ca 0.14 1.99 0.24 0.00 -2.23 0.00 0.00 60.65 60.79 1tll s ILE 3394Cb -0.21 -4.29 -0.03 0.00 -1.58 0.00 0.00 42.46 36.36 1tll s ILE 3394CO -0.13 0.03 1.31 0.49 -1.23 0.00 0.00 174.94 175.42 1tll n PHE 3395N 4.86 0.10 0.00 3.97 0.99 -0.95 -4.85 117.46 121.58 1tll n PHE 3395Ca 0.08 0.03 0.00 0.00 -0.00 0.00 0.00 57.45 57.56 1tll n PHE 3395Cb 0.49 -0.30 0.00 0.00 -1.00 0.00 0.00 39.48 38.67 1tll n PHE 3395CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 1tll n GLY 3396N 1.47 -0.05 3.30 1.37 0.00 -1.26 -4.79 105.19 105.23 1tll n GLY 3396Ca 0.05 -1.98 -0.46 0.00 0.00 0.00 0.00 46.02 43.63 1tll n GLY 3396CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1tll s VAL 3397N 0.00 5.31 -0.12 1.61 1.01 -1.26 -1.89 120.40 125.06 1tll s VAL 3397Ca 0.00 -2.25 0.18 0.00 0.00 0.00 0.00 61.98 59.91 1tll s VAL 3397Cb 0.00 -4.33 -0.26 0.00 0.00 0.00 0.00 36.38 31.79 1tll s VAL 3397CO 0.00 -0.97 0.42 0.35 0.00 0.00 0.00 175.10 174.91 1tll n THR 3398N 4.28 0.00 -4.16 3.92 -2.24 -1.26 -4.81 114.28 110.00 1tll n THR 3398Ca 0.06 -0.36 -0.30 0.00 -2.27 0.00 0.00 64.05 61.17 1tll n THR 3398Cb 0.44 0.21 -0.08 0.00 -2.10 0.00 0.00 70.33 68.80 1tll n THR 3398CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 1tll s LEU 3399N -4.05 3.36 -1.64 3.22 1.43 -1.26 -4.52 118.68 115.23 1tll s LEU 3399Ca -0.05 -0.22 -0.11 0.00 -1.03 0.00 0.00 54.13 52.72 1tll s LEU 3399Cb 0.11 -2.10 0.10 0.00 0.03 0.00 0.00 46.19 44.34 1tll s LEU 3399CO 0.73 0.18 0.51 0.54 0.23 0.00 0.00 176.35 178.54 1tll n ARG 3400N 0.65 -2.33 0.02 1.70 5.12 -1.26 -4.77 116.66 115.79 1tll n ARG 3400Ca -0.12 0.28 -0.11 0.00 -1.93 0.00 0.00 57.85 55.97 1tll n ARG 3400Cb 0.52 -4.60 -0.05 0.00 -1.16 0.00 0.00 32.46 27.17 1tll n ARG 3400CO 0.00 0.00 0.00 1.15 -1.93 0.00 0.00 177.63 176.85 1tll h THR 3401N -1.53 0.24 0.74 0.55 2.02 -1.87 0.51 112.91 113.58 1tll h THR 3401Ca -0.62 0.00 -0.03 0.00 0.77 0.00 0.00 66.41 66.53 1tll h THR 3401Cb 1.39 0.24 0.00 0.00 -1.74 0.00 0.00 68.15 68.04 1tll h THR 3401CO 0.75 0.00 -0.39 0.22 0.37 0.00 0.00 175.52 176.47 1tll h TYR 3402N -0.45 -1.02 0.11 3.16 3.20 -1.98 -0.16 116.97 119.84 1tll h TYR 3402Ca 0.08 -0.02 0.02 0.00 3.14 0.00 0.00 58.73 61.95 1tll h TYR 3402Cb 0.58 0.35 -0.03 0.00 1.54 0.00 0.00 36.73 39.16 1tll h TYR 3402CO -0.41 -0.61 -0.26 1.49 -1.64 0.00 0.00 178.16 176.72 1tll h GLU 3403N -1.04 -0.45 0.40 1.82 4.81 -1.90 -2.31 114.58 115.91 1tll h GLU 3403Ca -0.10 0.03 -0.02 0.00 -0.13 0.00 0.00 59.36 59.14 1tll h GLU 3403Cb 0.81 0.10 0.00 0.00 0.63 0.00 0.00 28.75 30.30 1tll h GLU 3403CO 0.14 -0.30 -0.19 0.28 -0.73 0.00 0.00 179.01 178.22 1tll h VAL 3404N -0.46 0.61 0.00 0.32 2.07 0.02 -2.65 116.25 116.16 1tll h VAL 3404Ca 0.03 -0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.55 1tll h VAL 3404Cb 0.50 0.61 0.00 0.00 -1.52 0.00 0.00 31.29 30.88 1tll h VAL 3404CO -0.16 0.00 0.00 0.74 0.02 0.00 0.00 177.57 178.17 1tll h THR 3405N -0.54 0.00 0.03 2.57 2.02 -1.05 -2.61 112.91 113.33 1tll h THR 3405Ca -0.05 -0.29 -0.00 0.00 0.77 0.00 0.00 66.41 66.83 1tll h THR 3405Cb 0.41 1.18 0.00 0.00 -1.74 0.00 0.00 68.15 68.00 1tll h THR 3405CO 0.09 0.00 -0.01 0.78 0.37 0.00 0.00 175.52 176.75 1tll h ASN 3406N 0.00 -0.03 -1.21 4.18 2.35 -1.30 -2.49 115.58 117.09 1tll h ASN 3406Ca 0.00 -0.05 0.35 0.00 -0.55 0.00 0.00 56.30 56.05 1tll h ASN 3406Cb 0.32 0.01 -0.09 0.00 0.05 0.00 0.00 38.32 38.61 1tll h ASN 3406CO 0.00 0.48 0.80 -0.09 -1.65 0.00 0.00 177.43 176.98 1tll h ARG 3407N -1.01 0.19 0.00 0.81 2.43 -1.42 1.27 114.38 116.65 1tll h ARG 3407Ca -0.00 -0.01 -0.14 0.00 -0.81 0.00 0.00 59.98 59.02 1tll h ARG 3407Cb 0.08 -0.04 -0.02 0.00 -0.42 0.00 0.00 29.97 29.56 1tll h ARG 3407CO 0.01 0.12 -0.66 -0.07 -1.51 0.00 0.00 179.97 177.86 1tll h LEU 3408N 0.19 0.00 -0.31 3.80 3.38 -1.52 0.73 115.31 121.59 1tll h LEU 3408Ca 0.67 0.00 -0.20 0.00 0.09 0.00 0.00 57.88 58.44 1tll h LEU 3408Cb 2.11 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.86 1tll h LEU 3408CO -0.25 0.66 -0.75 0.03 0.09 0.00 0.00 178.44 178.22 1tll h ARG 3409N 0.00 0.56 0.00 1.13 3.08 0.19 -2.83 114.38 116.51 1tll h ARG 3409Ca -0.01 -0.46 -0.05 0.00 0.07 0.00 0.00 59.98 59.54 1tll h ARG 3409Cb 1.24 0.10 -0.01 0.00 0.08 0.00 0.00 29.97 31.38 1tll h ARG 3409CO 0.09 1.09 -0.22 0.77 -1.07 0.00 0.00 179.97 180.63 1tll h SER 3410N 0.39 0.00 0.32 7.04 0.02 0.04 -2.60 113.55 118.75 1tll h SER 3410Ca -0.04 0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 60.89 1tll h SER 3410Cb 1.35 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.89 1tll h SER 3410CO 0.14 0.22 -0.15 -0.08 -1.14 0.00 0.00 176.83 175.81 1tll h GLU 3411N 0.00 -0.41 0.00 3.45 4.57 0.73 -3.30 114.58 119.61 1tll h GLU 3411Ca -0.00 0.03 -0.20 0.00 -1.18 0.00 0.00 59.36 58.00 1tll h GLU 3411Cb 0.78 0.09 -0.03 0.00 -0.16 0.00 0.00 28.75 29.44 1tll h GLU 3411CO 0.03 -0.17 -1.07 0.66 -1.18 0.00 0.00 179.01 177.28 1tll h SER 3412N -0.61 0.00 -0.01 1.04 4.64 -1.61 -3.51 113.55 113.50 1tll h SER 3412Ca -0.04 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.28 1tll h SER 3412Cb 0.44 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.53 1tll h SER 3412CO 0.07 0.88 0.00 -0.38 -0.87 0.00 0.00 176.83 176.53