#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3n04 n ILE 2 N 0.00 0.00 -4.58 0.00 5.41 -1.26 -5.02 119.36 113.91 3n04 n ILE 2 Ca 0.00 0.00 -0.28 0.00 1.00 0.00 0.00 62.75 63.47 3n04 n ILE 2 Cb 0.00 0.00 -0.14 0.00 -0.71 0.00 0.00 39.64 38.79 3n04 n ILE 2 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 176.55 176.42 3n04 s ARG 3 N 0.00 1.46 -0.17 0.38 0.52 -0.73 -4.98 118.95 115.43 3n04 s ARG 3 Ca 0.00 -1.15 -0.02 0.00 -0.52 0.00 0.00 55.73 54.04 3n04 s ARG 3 Cb 0.00 -1.73 -0.01 0.00 0.52 0.00 0.00 34.95 33.73 3n04 s ARG 3 CO 0.00 0.43 -0.10 0.21 0.02 0.00 0.00 175.30 175.86 3n04 s LYS 4 N -1.59 3.37 -0.21 3.54 2.20 -1.25 -0.59 119.74 125.20 3n04 s LYS 4 Ca 0.10 -0.66 -0.05 0.00 -0.36 0.00 0.00 55.97 55.01 3n04 s LYS 4 Cb -0.10 -2.79 -0.02 0.00 -1.51 0.00 0.00 37.83 33.41 3n04 s LYS 4 CO 0.04 0.02 -0.02 0.71 -0.36 0.00 0.00 175.35 175.74 3n04 s TYR 5 N 0.86 3.00 -0.18 4.03 2.02 0.11 -0.41 117.35 126.78 3n04 s TYR 5 Ca -0.03 -0.62 -0.08 0.00 -0.37 0.00 0.00 57.07 55.98 3n04 s TYR 5 Cb -0.15 -2.09 -0.04 0.00 -0.40 0.00 0.00 41.96 39.28 3n04 s TYR 5 CO 0.00 -0.34 0.08 0.50 -1.57 0.00 0.00 175.55 174.22 3n04 s ARG 6 N 1.16 4.00 -0.12 -0.62 3.52 -1.26 -0.08 118.95 125.55 3n04 s ARG 6 Ca 0.03 -0.31 0.03 0.00 -0.13 0.00 0.00 55.73 55.34 3n04 s ARG 6 Cb -0.14 -3.25 0.00 0.00 -1.56 0.00 0.00 34.95 29.99 3n04 s ARG 6 CO 0.01 0.30 -0.22 0.71 -0.81 0.00 0.00 175.30 175.29 3n04 s TYR 7 N 0.31 2.63 0.00 5.12 2.02 0.86 -5.01 117.35 123.29 3n04 s TYR 7 Ca 0.04 -1.07 0.00 0.00 -0.37 0.00 0.00 57.07 55.67 3n04 s TYR 7 Cb -0.12 -1.76 0.00 0.00 -0.40 0.00 0.00 41.96 39.68 3n04 s TYR 7 CO -0.00 -0.45 0.00 0.41 -1.57 0.00 0.00 175.55 173.94 3n04 n GLY 8 N 3.69 3.08 2.92 0.71 0.00 -1.08 -0.89 105.19 113.61 3n04 n GLY 8 Ca -0.19 -0.25 -0.29 0.00 0.00 0.00 0.00 46.02 45.29 3n04 n GLY 8 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3n04 s ALA 9 N -1.89 3.60 0.44 4.61 0.00 -1.26 -4.87 121.76 122.39 3n04 s ALA 9 Ca 0.00 -3.60 -0.24 0.00 0.00 0.00 0.00 51.96 48.12 3n04 s ALA 9 Cb 0.00 -2.16 -0.08 0.00 0.00 0.00 0.00 23.12 20.88 3n04 s ALA 9 CO 0.00 -2.07 1.16 -1.25 0.00 0.00 0.00 175.76 173.61 3n04 s PRO 10 N -0.97 3.86 0.27 0.00 0.04 -1.26 -4.81 135.00 132.13 3n04 s PRO 10 Ca 0.22 1.79 -0.29 0.00 0.04 0.00 0.00 61.00 62.75 3n04 s PRO 10 Cb -0.13 -2.49 -0.10 0.00 0.04 0.00 0.00 34.50 31.82 3n04 s PRO 10 CO -0.10 -0.47 1.22 0.12 0.04 0.00 0.00 177.00 177.82 3n04 s PHE 11 N -1.51 3.31 -0.59 0.56 5.36 -1.26 -4.96 117.98 118.89 3n04 s PHE 11 Ca 0.61 1.48 -0.28 0.00 -0.96 0.00 0.00 56.93 57.78 3n04 s PHE 11 Cb -0.29 -3.50 0.03 0.00 -0.34 0.00 0.00 43.02 38.92 3n04 s PHE 11 CO 0.36 -1.34 1.18 0.34 -1.46 0.00 0.00 175.22 174.30 3n04 s ASP 12 N -0.41 6.43 0.33 6.13 3.68 -1.26 -4.86 116.67 126.71 3n04 s ASP 12 Ca 0.49 0.05 0.19 0.00 2.13 0.00 0.00 52.55 55.42 3n04 s ASP 12 Cb -0.36 -2.55 0.16 0.00 -1.45 0.00 0.00 42.92 38.73 3n04 s ASP 12 CO 0.44 -1.48 1.44 0.71 0.13 0.00 0.00 175.17 176.41 3n04 h THR 13 N 6.14 0.41 -1.57 1.71 1.35 -1.95 -3.48 112.91 115.52 3n04 h THR 13 Ca -0.25 -1.59 -0.28 0.00 -0.55 0.00 0.00 66.41 63.73 3n04 h THR 13 Cb 1.06 2.15 -0.05 0.00 -1.73 0.00 0.00 68.15 69.58 3n04 h THR 13 CO 1.19 0.23 -0.33 -0.62 -0.25 0.00 0.00 175.52 175.74 3n04 n GLU 14 N -3.11 -1.07 -0.08 4.72 1.02 -1.26 -4.94 120.64 115.92 3n04 n GLU 14 Ca 0.02 0.78 -0.11 0.00 -0.02 0.00 0.00 57.16 57.83 3n04 n GLU 14 Cb 0.64 -5.00 -0.04 0.00 -0.02 0.00 0.00 31.44 27.02 3n04 n GLU 14 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3n04 h ALA 15 N 0.45 0.34 -2.64 0.62 0.00 -1.93 -3.44 119.26 112.67 3n04 h ALA 15 Ca -0.32 -0.18 -0.54 0.00 0.00 0.00 0.00 54.91 53.86 3n04 h ALA 15 Cb 1.14 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 18.80 3n04 h ALA 15 CO 0.40 0.02 0.06 -0.51 0.00 0.00 0.00 179.25 179.22 3n04 s LEU 16 N -9.60 4.46 0.13 0.00 1.02 -1.26 -4.14 118.68 109.29 3n04 s LEU 16 Ca -0.14 1.38 0.22 0.00 0.02 0.00 0.00 54.13 55.61 3n04 s LEU 16 Cb 0.08 -3.26 -0.09 0.00 0.02 0.00 0.00 46.19 42.94 3n04 s LEU 16 CO 0.74 0.16 0.89 0.35 0.02 0.00 0.00 176.35 178.50 3n04 n THR 17 N 1.25 0.59 -3.11 5.49 -2.24 -0.24 -4.89 114.28 111.13 3n04 n THR 17 Ca -0.06 -0.56 -0.39 0.00 -2.27 0.00 0.00 64.05 60.76 3n04 n THR 17 Cb 0.50 -0.33 -0.05 0.00 -2.10 0.00 0.00 70.33 68.36 3n04 n THR 17 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 3n04 s GLU 18 N -3.32 4.39 -0.30 -0.78 2.56 -1.01 -5.04 118.70 115.20 3n04 s GLU 18 Ca -0.02 0.76 -0.28 0.00 0.00 0.00 0.00 54.97 55.42 3n04 s GLU 18 Cb 0.10 -3.46 0.01 0.00 2.00 0.00 0.00 34.13 32.78 3n04 s GLU 18 CO 0.82 0.04 1.02 0.21 -0.56 0.00 0.00 175.26 176.79 3n04 s LYS 19 N 0.91 4.09 -0.08 4.30 2.47 -1.26 -5.04 119.74 125.14 3n04 s LYS 19 Ca 0.34 1.06 0.01 0.00 -1.56 0.00 0.00 55.97 55.82 3n04 s LYS 19 Cb -0.17 -3.71 -0.03 0.00 -1.46 0.00 0.00 37.83 32.46 3n04 s LYS 19 CO 0.15 -0.81 -0.09 0.42 0.16 0.00 0.00 175.35 175.18 3n04 s ILE 20 N 3.45 3.48 0.49 5.43 -1.09 -1.26 -5.12 121.20 126.58 3n04 s ILE 20 Ca 0.43 -0.55 -0.20 0.00 -2.23 0.00 0.00 60.65 58.09 3n04 s ILE 20 Cb -0.13 -2.42 -0.08 0.00 -1.58 0.00 0.00 42.46 38.25 3n04 s ILE 20 CO 0.13 0.58 1.07 -0.70 -1.23 0.00 0.00 174.94 174.78 3n04 s GLU 21 N -0.53 3.71 -0.05 2.79 2.12 -1.26 -4.93 118.70 120.56 3n04 s GLU 21 Ca 0.08 1.45 -0.30 0.00 0.36 0.00 0.00 54.97 56.56 3n04 s GLU 21 Cb -0.12 -2.12 -0.05 0.00 0.26 0.00 0.00 34.13 32.10 3n04 s GLU 21 CO 0.02 -0.52 1.57 0.99 -0.54 0.00 0.00 175.26 176.78 3n04 s THR 22 N -1.89 3.65 0.60 -1.70 2.01 -1.26 -3.97 115.64 113.08 3n04 s THR 22 Ca 0.68 0.85 -0.17 0.00 0.31 0.00 0.00 61.69 63.36 3n04 s THR 22 Cb -0.19 -3.55 -0.03 0.00 0.01 0.00 0.00 72.50 68.74 3n04 s THR 22 CO 0.23 -0.06 1.10 0.00 -0.69 0.00 0.00 174.62 175.19 3n04 s ALA 23 N 3.65 2.62 -0.24 7.40 0.00 0.45 -4.99 121.76 130.65 3n04 s ALA 23 Ca 0.70 0.58 0.12 0.00 0.00 0.00 0.00 51.96 53.35 3n04 s ALA 23 Cb -0.32 -3.30 -0.16 0.00 0.00 0.00 0.00 23.12 19.34 3n04 s ALA 23 CO 0.27 -0.97 0.36 0.39 0.00 0.00 0.00 175.76 175.81 3n04 n GLU 24 N -1.96 1.51 -2.23 0.00 -0.58 -1.26 -4.79 120.64 111.33 3n04 n GLU 24 Ca 0.10 -0.06 -0.26 0.00 -0.42 0.00 0.00 57.16 56.52 3n04 n GLU 24 Cb 0.52 -1.19 0.08 0.00 -0.57 0.00 0.00 31.44 30.28 3n04 n GLU 24 CO 0.00 0.00 0.00 -1.83 -0.48 0.00 0.00 177.13 174.82 3n04 s GLU 25 N -2.53 2.01 0.53 3.49 1.03 -1.26 -5.04 118.70 116.93 3n04 s GLU 25 Ca -0.01 -0.38 -0.22 0.00 0.03 0.00 0.00 54.97 54.40 3n04 s GLU 25 Cb 0.08 -2.17 -0.06 0.00 -0.80 0.00 0.00 34.13 31.18 3n04 s GLU 25 CO 0.49 -1.35 1.22 0.00 -1.33 0.00 0.00 175.26 174.29 3n04 n ALA 26 N -2.97 1.07 -1.75 -0.84 0.00 -1.26 -4.91 120.51 109.85 3n04 n ALA 26 Ca 0.09 0.12 -0.42 0.00 0.00 0.00 0.00 53.44 53.24 3n04 n ALA 26 Cb 0.60 -2.26 -0.03 0.00 0.00 0.00 0.00 19.45 17.76 3n04 n ALA 26 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.50 177.62 3n04 s PHE 27 N -1.33 2.88 -0.54 0.00 5.36 -1.26 -4.88 117.98 118.21 3n04 s PHE 27 Ca 0.71 0.35 0.25 0.00 -0.96 0.00 0.00 56.93 57.28 3n04 s PHE 27 Cb -0.44 -4.12 0.66 0.00 -0.34 0.00 0.00 43.02 38.78 3n04 s PHE 27 CO 0.50 -4.25 1.72 -1.00 -1.46 0.00 0.00 175.22 170.73 3n04 h PRO 28 N 6.90 0.00 -4.55 10.12 0.13 -2.04 -3.44 132.00 139.12 3n04 h PRO 28 Ca -0.43 0.00 -0.43 0.00 -0.87 0.00 0.00 66.00 64.26 3n04 h PRO 28 Cb 1.20 0.00 -0.31 0.00 0.13 0.00 0.00 31.00 32.02 3n04 h PRO 28 CO 0.95 0.00 -0.79 0.71 -0.23 0.00 0.00 178.00 178.64 3n04 s TYR 29 N -3.19 0.99 0.00 1.56 2.02 -1.26 -5.11 117.35 112.35 3n04 s TYR 29 Ca 0.08 -0.26 0.00 0.00 -0.37 0.00 0.00 57.07 56.52 3n04 s TYR 29 Cb 0.09 -0.71 0.00 0.00 -0.40 0.00 0.00 41.96 40.93 3n04 s TYR 29 CO 0.61 -0.12 0.00 0.41 -1.57 0.00 0.00 175.55 174.88 3n04 n GLY 30 N 3.39 0.66 2.95 0.71 0.00 -1.26 -4.85 105.19 106.79 3n04 n GLY 30 Ca -0.19 -0.81 -0.18 0.00 0.00 0.00 0.00 46.02 44.84 3n04 n GLY 30 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3n04 s GLU 31 N 0.00 0.65 -0.13 1.61 2.02 -0.26 -4.98 118.70 117.60 3n04 s GLU 31 Ca 0.00 -0.19 -0.05 0.00 0.02 0.00 0.00 54.97 54.75 3n04 s GLU 31 Cb 0.00 -0.64 -0.04 0.00 0.10 0.00 0.00 34.13 33.55 3n04 s GLU 31 CO 0.00 0.06 0.05 0.42 0.02 0.00 0.00 175.26 175.80 3n04 s ILE 32 N 0.26 4.67 0.01 -1.63 -1.09 -1.26 -0.99 121.20 121.16 3n04 s ILE 32 Ca -0.03 -0.09 0.02 0.00 -2.23 0.00 0.00 60.65 58.32 3n04 s ILE 32 Cb -0.07 -3.04 -0.01 0.00 -1.58 0.00 0.00 42.46 37.76 3n04 s ILE 32 CO -0.00 0.54 -0.08 -0.55 -1.23 0.00 0.00 174.94 173.62 3n04 s SER 33 N -0.33 0.92 -0.10 3.58 0.15 0.41 -5.01 113.70 113.32 3n04 s SER 33 Ca 0.08 -0.23 0.14 0.00 0.70 0.00 0.00 55.95 56.64 3n04 s SER 33 Cb -0.12 -0.07 0.22 0.00 -1.71 0.00 0.00 66.02 64.34 3n04 s SER 33 CO 0.02 0.03 1.12 0.00 1.20 0.00 0.00 173.24 175.61 3n04 n GLN 34 N 2.57 1.79 -0.04 5.44 6.02 -1.26 -0.40 117.38 131.51 3n04 n GLN 34 Ca -0.15 -2.30 -0.05 0.00 -0.01 0.00 0.00 57.00 54.48 3n04 n GLN 34 Cb 0.57 -1.38 0.15 0.00 1.02 0.00 0.00 30.24 30.60 3n04 n GLN 34 CO 0.00 0.00 0.00 -0.22 -1.01 0.00 0.00 177.06 175.83 3n04 h LYS 35 N 0.08 0.62 -1.57 -1.09 3.64 -1.97 -3.32 116.57 112.96 3n04 h LYS 35 Ca 0.00 -0.24 -0.57 0.00 -1.27 0.00 0.00 60.65 58.57 3n04 h LYS 35 Cb 0.88 -0.03 -0.42 0.00 -0.41 0.00 0.00 32.23 32.25 3n04 h LYS 35 CO 0.01 0.81 -0.77 0.39 -2.27 0.00 0.00 179.45 177.61 3n04 n GLU 36 N -4.12 3.14 0.00 1.90 -0.58 -1.26 -5.02 120.64 114.70 3n04 n GLU 36 Ca -0.00 -4.41 0.00 0.00 -0.42 0.00 0.00 57.16 52.33 3n04 n GLU 36 Cb 0.42 -2.14 0.00 0.00 -0.57 0.00 0.00 31.44 29.15 3n04 n GLU 36 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3n04 n GLY 37 N -0.40 1.35 2.85 0.62 0.00 -1.25 -4.81 105.19 103.55 3n04 n GLY 37 Ca 0.35 -0.67 -0.15 0.00 0.00 0.00 0.00 46.02 45.55 3n04 n GLY 37 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 3n04 s PHE 38 N 0.00 0.20 -0.06 1.61 5.36 0.03 -4.31 117.98 120.81 3n04 s PHE 38 Ca 0.00 0.01 -0.03 0.00 -0.96 0.00 0.00 56.93 55.95 3n04 s PHE 38 Cb 0.00 -0.24 0.04 0.00 -0.34 0.00 0.00 43.02 42.48 3n04 s PHE 38 CO 0.00 -0.06 0.14 0.00 -1.46 0.00 0.00 175.22 173.83 3n04 s ALA 39 N 0.54 -0.22 -0.19 11.12 0.00 0.46 -1.36 121.76 132.11 3n04 s ALA 39 Ca -0.05 0.64 -0.07 0.00 0.00 0.00 0.00 51.96 52.48 3n04 s ALA 39 Cb -0.08 -0.48 -0.04 0.00 0.00 0.00 0.00 23.12 22.53 3n04 s ALA 39 CO -0.01 -0.20 0.05 0.12 0.00 0.00 0.00 175.76 175.71 3n04 s PHE 40 N 1.30 3.17 -0.08 0.00 5.36 0.78 -0.45 117.98 128.07 3n04 s PHE 40 Ca -0.08 -0.09 0.02 0.00 -0.96 0.00 0.00 56.93 55.83 3n04 s PHE 40 Cb -0.12 -2.09 0.01 0.00 -0.34 0.00 0.00 43.02 40.49 3n04 s PHE 40 CO -0.06 0.02 -0.13 0.99 -1.46 0.00 0.00 175.22 174.58 3n04 s THR 41 N 0.62 1.26 -0.04 0.12 2.01 -0.16 -0.64 115.64 118.80 3n04 s THR 41 Ca 0.02 -0.54 0.02 0.00 0.31 0.00 0.00 61.69 61.50 3n04 s THR 41 Cb -0.13 -1.14 0.01 0.00 0.01 0.00 0.00 72.50 71.25 3n04 s THR 41 CO 0.02 0.38 -0.07 -0.47 -0.69 0.00 0.00 174.62 173.79 3n04 s TYR 42 N 0.72 0.92 0.66 4.92 6.14 0.97 -1.10 117.35 130.57 3n04 s TYR 42 Ca -0.13 -0.27 -0.00 0.00 0.64 0.00 0.00 57.07 57.31 3n04 s TYR 42 Cb -0.16 -0.72 0.09 0.00 0.42 0.00 0.00 41.96 41.59 3n04 s TYR 42 CO 0.03 -0.17 0.91 0.42 0.64 0.00 0.00 175.55 177.38 3n04 s ILE 43 N 0.62 2.33 0.08 3.14 -1.09 -1.26 -0.55 121.20 124.47 3n04 s ILE 43 Ca -0.10 -0.61 0.06 0.00 -2.23 0.00 0.00 60.65 57.78 3n04 s ILE 43 Cb -0.13 -2.72 -0.04 0.00 -1.58 0.00 0.00 42.46 37.99 3n04 s ILE 43 CO 0.01 0.00 -0.10 -0.62 -1.23 0.00 0.00 174.94 173.00 3n04 s ASP 45 N -4.61 4.39 0.40 3.58 2.15 -1.26 -5.01 116.67 116.31 3n04 s ASP 45 Ca 0.63 -0.34 0.16 0.00 0.43 0.00 0.00 52.55 53.42 3n04 s ASP 45 Cb -0.07 -0.87 1.02 0.00 -0.30 0.00 0.00 42.92 42.70 3n04 s ASP 45 CO 0.42 0.21 1.85 -0.33 -0.17 0.00 0.00 175.17 177.15 3n04 h GLU 46 N 3.88 0.46 -0.01 4.34 5.08 -2.02 -1.51 114.58 124.79 3n04 h GLU 46 Ca -0.49 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 57.85 3n04 h GLU 46 Cb 1.17 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 30.31 3n04 h GLU 46 CO 0.52 0.30 -0.15 -0.25 -1.00 0.00 0.00 179.01 178.44 3n04 n ASP 47 N -4.54 1.15 -4.76 1.42 8.00 -1.26 -4.95 116.55 111.62 3n04 n ASP 47 Ca 0.19 -1.10 -0.39 0.00 0.71 0.00 0.00 54.79 54.20 3n04 n ASP 47 Cb 0.66 0.07 0.03 0.00 -0.02 0.00 0.00 41.12 41.85 3n04 n ASP 47 CO 0.00 0.00 0.00 -1.81 -0.39 0.00 0.00 177.20 175.00 3n04 s ASP 48 N -2.30 5.57 0.09 -2.24 1.01 -0.57 -4.86 116.67 113.36 3n04 s ASP 48 Ca 0.30 2.84 0.08 0.00 0.71 0.00 0.00 52.55 56.48 3n04 s ASP 48 Cb 0.20 -2.64 -0.04 0.00 1.01 0.00 0.00 42.92 41.45 3n04 s ASP 48 CO 0.45 -1.38 -0.14 -0.63 0.21 0.00 0.00 175.17 173.68 3n04 s ILE 49 N -1.25 3.08 -0.19 0.77 1.01 0.22 -4.96 121.20 119.87 3n04 s ILE 49 Ca 0.66 -1.31 0.01 0.00 0.00 0.00 0.00 60.65 60.01 3n04 s ILE 49 Cb -0.42 -2.40 0.03 0.00 0.01 0.00 0.00 42.46 39.68 3n04 s ILE 49 CO 0.52 0.17 -0.18 -0.69 0.00 0.00 0.00 174.94 174.76 3n04 s VAL 50 N -1.12 2.00 0.24 2.92 1.01 -1.26 -0.69 120.40 123.50 3n04 s VAL 50 Ca 0.18 -0.98 0.06 0.00 0.00 0.00 0.00 61.98 61.24 3n04 s VAL 50 Cb -0.11 -1.85 -0.03 0.00 0.00 0.00 0.00 36.38 34.39 3n04 s VAL 50 CO 0.10 0.46 0.26 -0.31 0.00 0.00 0.00 175.10 175.61 3n04 s TYR 51 N 1.30 3.27 -0.78 5.22 2.02 -0.55 -0.40 117.35 127.43 3n04 s TYR 51 Ca 0.03 -0.06 0.00 0.00 -0.37 0.00 0.00 57.07 56.67 3n04 s TYR 51 Cb -0.14 -1.49 0.00 0.00 -0.40 0.00 0.00 41.96 39.93 3n04 s TYR 51 CO -0.12 0.49 0.00 0.41 -1.57 0.00 0.00 175.55 174.76 3n04 n GLY 52 N -1.19 0.47 2.58 0.71 0.00 -1.26 -1.08 105.19 105.42 3n04 n GLY 52 Ca -0.08 -2.10 0.00 0.00 0.00 0.00 0.00 46.02 43.83 3n04 n GLY 52 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3n04 n LEU 53 N 0.00 0.53 0.00 0.99 4.77 0.14 -4.89 117.00 118.54 3n04 n LEU 53 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.98 3n04 n LEU 53 Cb 0.00 -1.53 0.00 0.00 -2.33 0.00 0.00 43.42 39.56 3n04 n LEU 53 CO 0.00 -0.52 0.00 0.61 -1.33 0.00 0.00 177.39 176.15 3n04 n GLY 54 N -0.93 3.29 3.57 -0.72 0.00 -1.25 -3.15 105.19 106.00 3n04 n GLY 54 Ca 0.00 0.21 -0.41 0.00 0.00 0.00 0.00 46.02 45.83 3n04 n GLY 54 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3n04 s GLU 55 N 0.00 3.63 0.23 1.61 2.12 -1.26 -4.23 118.70 120.80 3n04 s GLU 55 Ca 0.00 -1.30 -0.01 0.00 0.36 0.00 0.00 54.97 54.02 3n04 s GLU 55 Cb 0.00 -5.39 -0.03 0.00 0.26 0.00 0.00 34.13 28.97 3n04 s GLU 55 CO 0.00 -2.30 0.20 -1.54 -0.54 0.00 0.00 175.26 171.08 3n04 s SER 56 N 4.95 0.39 0.89 -1.70 1.04 -1.19 -4.37 113.70 113.72 3n04 s SER 56 Ca 0.49 -1.41 -0.12 0.00 0.48 0.00 0.00 55.95 55.40 3n04 s SER 56 Cb 0.01 0.44 0.12 0.00 0.10 0.00 0.00 66.02 66.69 3n04 s SER 56 CO -0.05 -0.92 1.10 0.21 0.98 0.00 0.00 173.24 174.56 3n04 s ASN 57 N -3.18 3.63 0.58 7.02 3.84 -1.26 -4.91 114.94 120.65 3n04 s ASN 57 Ca 0.37 1.29 0.00 0.00 0.21 0.00 0.00 52.86 54.73 3n04 s ASN 57 Cb 0.05 -1.96 0.00 0.00 -0.55 0.00 0.00 41.25 38.79 3n04 s ASN 57 CO 0.14 -2.51 0.00 0.54 -2.79 0.00 0.00 177.10 172.48 3n04 n ARG 58 N -3.78 0.00 -1.66 0.43 1.74 -1.26 -4.97 116.66 107.16 3n04 n ARG 58 Ca 0.07 0.00 -0.06 0.00 -0.77 0.00 0.00 57.85 57.08 3n04 n ARG 58 Cb 0.57 0.00 0.02 0.00 -1.02 0.00 0.00 32.46 32.03 3n04 n ARG 58 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3n04 n GLY 59 N 0.00 2.01 0.19 -0.13 0.00 -1.26 -4.90 105.19 101.09 3n04 n GLY 59 Ca 0.00 -2.16 -0.13 0.00 0.00 0.00 0.00 46.02 43.72 3n04 n GLY 59 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 3n04 h ILE 60 N 0.07 1.32 -3.54 -0.61 2.04 -1.90 -3.37 117.51 111.51 3n04 h ILE 60 Ca -0.09 -1.46 -0.58 0.00 1.00 0.00 0.00 64.86 63.73 3n04 h ILE 60 Cb 0.39 1.71 -0.08 0.00 -0.74 0.00 0.00 36.82 38.10 3n04 h ILE 60 CO 0.12 0.46 0.78 0.21 0.00 0.00 0.00 178.15 179.72 3n04 s ASN 61 N -6.47 6.71 0.11 1.72 2.47 -1.26 -4.36 114.94 113.86 3n04 s ASN 61 Ca -0.13 0.61 0.26 0.00 0.42 0.00 0.00 52.86 54.03 3n04 s ASN 61 Cb 0.08 -2.51 0.99 0.00 -1.45 0.00 0.00 41.25 38.35 3n04 s ASN 61 CO 0.81 -1.03 1.82 0.29 -3.72 0.00 0.00 177.10 175.27 3n04 n LYS 62 N 7.23 0.13 -1.59 0.43 4.76 0.47 -4.92 118.16 124.67 3n04 n LYS 62 Ca 0.10 0.14 -0.39 0.00 -2.87 0.00 0.00 58.31 55.29 3n04 n LYS 62 Cb 0.48 -1.66 0.04 0.00 -1.84 0.00 0.00 35.03 32.04 3n04 n LYS 62 CO 0.00 0.00 0.00 0.54 -1.37 0.00 0.00 177.40 176.57 3n04 n ARG 63 N -1.90 1.01 -0.52 1.97 1.74 -1.26 -3.74 116.66 113.96 3n04 n ARG 63 Ca 0.06 0.38 0.00 0.00 -0.77 0.00 0.00 57.85 57.52 3n04 n ARG 63 Cb 0.36 -2.06 0.00 0.00 -1.02 0.00 0.00 32.46 29.74 3n04 n ARG 63 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3n04 n GLY 64 N 1.32 0.68 3.75 -0.13 0.00 0.55 -5.02 105.19 106.34 3n04 n GLY 64 Ca 0.12 -0.50 -0.08 0.00 0.00 0.00 0.00 46.02 45.56 3n04 n GLY 64 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 3n04 s TYR 65 N -2.00 0.11 -0.12 1.61 5.04 -1.12 -4.76 117.35 116.11 3n04 s TYR 65 Ca 0.00 -0.58 0.01 0.00 -2.44 0.00 0.00 57.07 54.06 3n04 s TYR 65 Cb 0.00 0.55 -0.01 0.00 0.35 0.00 0.00 41.96 42.85 3n04 s TYR 65 CO 0.00 -1.25 -0.16 0.00 -1.34 0.00 0.00 175.55 172.80 3n04 s TYR 67 N 0.40 1.99 -0.17 0.00 2.02 0.04 -4.78 117.35 116.86 3n04 s TYR 67 Ca -0.12 -0.72 0.00 0.00 -0.37 0.00 0.00 57.07 55.86 3n04 s TYR 67 Cb -0.16 -1.36 0.01 0.00 -0.40 0.00 0.00 41.96 40.04 3n04 s TYR 67 CO 0.06 -0.29 -0.17 0.42 -1.57 0.00 0.00 175.55 174.00 3n04 s ILE 68 N 0.31 2.42 -0.63 2.71 1.01 0.19 0.68 121.20 127.90 3n04 s ILE 68 Ca -0.12 -0.84 -0.27 0.00 0.00 0.00 0.00 60.65 59.42 3n04 s ILE 68 Cb -0.15 -2.02 0.03 0.00 0.01 0.00 0.00 42.46 40.33 3n04 s ILE 68 CO 0.05 0.52 1.19 -0.44 0.00 0.00 0.00 174.94 176.26 3n04 s SER 69 N 1.05 6.35 -0.35 3.58 0.01 0.33 -4.20 113.70 120.47 3n04 s SER 69 Ca -0.01 -0.12 -0.01 0.00 1.31 0.00 0.00 55.95 57.12 3n04 s SER 69 Cb -0.14 -2.54 0.19 0.00 0.21 0.00 0.00 66.02 63.73 3n04 s SER 69 CO -0.05 -1.56 0.84 0.21 0.41 0.00 0.00 173.24 173.08 3n04 s ASN 70 N 3.19 -0.95 -0.20 2.44 2.47 -1.26 -2.48 114.94 118.14 3n04 s ASN 70 Ca 0.39 -0.32 -0.34 0.00 0.42 0.00 0.00 52.86 53.01 3n04 s ASN 70 Cb -0.08 1.31 -0.11 0.00 -1.45 0.00 0.00 41.25 40.92 3n04 s ASN 70 CO 0.21 -0.12 2.02 0.00 -3.72 0.00 0.00 177.10 175.49 3n04 s THR 72 N 5.73 0.02 -0.75 0.00 -4.23 -1.00 -4.89 115.64 110.52 3n04 s THR 72 Ca 1.00 -0.16 -0.15 0.00 -1.18 0.00 0.00 61.69 61.20 3n04 s THR 72 Cb -0.71 -0.58 0.19 0.00 1.34 0.00 0.00 72.50 72.74 3n04 s THR 72 CO 0.49 -0.09 0.71 -0.62 -0.54 0.00 0.00 174.62 174.58 3n04 s ASP 73 N -0.36 6.58 -0.20 3.99 3.68 -1.26 -4.08 116.67 125.02 3n04 s ASP 73 Ca -0.05 -2.37 -0.20 0.00 2.13 0.00 0.00 52.55 52.06 3n04 s ASP 73 Cb -0.03 -2.22 -0.03 0.00 -1.45 0.00 0.00 42.92 39.19 3n04 s ASP 73 CO 0.02 -0.70 0.59 -0.62 0.13 0.00 0.00 175.17 174.60 3n04 s ASP 74 N 2.68 6.63 -1.42 -0.34 -1.08 -1.26 -4.98 116.67 116.90 3n04 s ASP 74 Ca 0.15 0.77 -0.07 0.00 -0.52 0.00 0.00 52.55 52.87 3n04 s ASP 74 Cb -0.16 -2.33 0.05 0.00 -1.46 0.00 0.00 42.92 39.03 3n04 s ASP 74 CO -0.05 -0.25 2.56 -0.81 0.52 0.00 0.00 175.17 177.14 3n04 n PRO 75 N 5.03 4.29 -4.22 4.34 -0.04 -1.26 -4.86 135.00 138.28 3n04 n PRO 75 Ca -0.02 -3.06 -0.13 0.00 -0.04 0.00 0.00 63.50 60.25 3n04 n PRO 75 Cb 0.50 -2.69 -0.10 0.00 -0.04 0.00 0.00 33.50 31.16 3n04 n PRO 75 CO 0.00 0.00 0.00 0.96 -0.04 0.00 0.00 175.50 176.42 3n04 s ILE 76 N -0.05 0.59 0.37 0.52 -4.36 -1.26 -5.13 121.20 111.87 3n04 s ILE 76 Ca 0.59 -1.96 -0.27 0.00 -0.26 0.00 0.00 60.65 58.75 3n04 s ILE 76 Cb 0.18 -2.05 -0.12 0.00 1.25 0.00 0.00 42.46 41.72 3n04 s ILE 76 CO -0.08 -0.52 1.16 1.57 0.24 0.00 0.00 174.94 177.31 3n04 n HIS 77 N -0.19 1.78 0.23 1.37 -0.00 -1.26 -4.88 115.22 112.26 3n04 n HIS 77 Ca -0.07 0.57 0.14 0.00 -0.00 0.00 0.00 57.72 58.36 3n04 n HIS 77 Cb 0.63 -2.33 0.77 0.00 -0.00 0.00 0.00 29.99 29.06 3n04 n HIS 77 CO 0.00 0.00 0.00 1.15 -0.00 0.00 0.00 176.34 177.49 3n04 h THR 78 N 2.10 0.71 0.00 3.57 2.02 -1.97 -2.44 112.91 116.90 3n04 h THR 78 Ca -0.45 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 66.72 3n04 h THR 78 Cb 1.31 0.93 -0.00 0.00 -1.74 0.00 0.00 68.15 68.65 3n04 h THR 78 CO 0.60 0.00 -0.04 -0.08 0.37 0.00 0.00 175.52 176.37 3n04 h GLU 79 N 0.00 0.00 -0.01 6.66 4.81 -2.04 -1.47 114.58 122.53 3n04 h GLU 79 Ca 0.05 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.28 3n04 h GLU 79 Cb 0.24 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.62 3n04 h GLU 79 CO -0.00 0.04 -0.31 -0.25 -0.73 0.00 0.00 179.01 177.76 3n04 n ASP 80 N -3.30 1.30 -4.70 1.04 8.00 -0.92 -4.97 116.55 113.00 3n04 n ASP 80 Ca -0.02 -1.07 -0.42 0.00 0.71 0.00 0.00 54.79 54.00 3n04 n ASP 80 Cb 0.20 0.23 -0.03 0.00 -0.02 0.00 0.00 41.12 41.50 3n04 n ASP 80 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 3n04 s LYS 81 N -2.49 4.51 0.10 -1.24 1.02 -0.55 -4.92 119.74 116.15 3n04 s LYS 81 Ca 0.23 1.38 0.08 0.00 0.02 0.00 0.00 55.97 57.68 3n04 s LYS 81 Cb 0.19 -3.49 -0.21 0.00 -0.52 0.00 0.00 37.83 33.80 3n04 s LYS 81 CO 0.53 -0.13 1.19 0.00 -0.92 0.00 0.00 175.35 176.01 3n04 h ARG 82 N 6.90 0.00 -4.20 1.68 2.47 -1.89 -3.46 114.38 115.89 3n04 h ARG 82 Ca -0.38 -0.00 -0.36 0.00 -1.26 0.00 0.00 59.98 57.98 3n04 h ARG 82 Cb 1.19 0.00 -0.31 0.00 -1.65 0.00 0.00 29.97 29.21 3n04 h ARG 82 CO 0.79 0.93 -0.76 -1.12 0.56 0.00 0.00 179.97 180.36 3n04 s SER 83 N -6.62 0.75 0.00 7.04 0.01 -1.26 -0.63 113.70 112.99 3n04 s SER 83 Ca 0.00 -0.11 0.00 0.00 1.31 0.00 0.00 55.95 57.15 3n04 s SER 83 Cb 0.10 -0.22 0.00 0.00 0.21 0.00 0.00 66.02 66.11 3n04 s SER 83 CO 0.82 0.01 0.00 0.18 0.41 0.00 0.00 173.24 174.66 3n04 n LEU 84 N 3.43 0.00 0.01 2.44 4.77 -1.26 -4.80 117.00 121.58 3n04 n LEU 84 Ca -0.19 0.00 0.12 0.00 -0.03 0.00 0.00 56.01 55.91 3n04 n LEU 84 Cb 0.55 0.00 0.23 0.00 -2.33 0.00 0.00 43.42 41.87 3n04 n LEU 84 CO 0.24 0.00 0.43 -1.22 -1.33 0.00 0.00 177.39 175.51 3n04 n TYR 85 N 0.00 0.11 -4.27 -1.77 4.01 -1.26 -2.37 117.16 111.61 3n04 n TYR 85 Ca 0.00 0.03 -0.25 0.00 -0.16 0.00 0.00 57.90 57.52 3n04 n TYR 85 Cb 0.00 -0.33 -0.08 0.00 -0.31 0.00 0.00 39.34 38.62 3n04 n TYR 85 CO 0.00 0.00 0.00 0.20 -0.46 0.00 0.00 176.86 176.60 3n04 s GLY 86 N -3.14 1.70 -0.38 2.72 0.00 -1.26 -3.25 107.32 103.71 3n04 s GLY 86 Ca 0.10 -1.51 0.02 0.00 0.00 0.00 0.00 44.72 43.33 3n04 s GLY 86 CO 0.70 -1.54 0.14 0.00 0.00 0.00 0.00 173.10 172.40 3n04 s ALA 87 N -1.95 2.27 -0.50 3.20 0.00 -0.62 -4.56 121.76 119.60 3n04 s ALA 87 Ca 0.28 -2.34 0.04 0.00 0.00 0.00 0.00 51.96 49.94 3n04 s ALA 87 Cb -0.08 -1.85 0.13 0.00 0.00 0.00 0.00 23.12 21.32 3n04 s ALA 87 CO 0.18 -1.82 0.25 -1.01 0.00 0.00 0.00 175.76 173.36 3n04 s HIS 88 N 0.86 3.05 -0.18 0.00 3.76 -1.26 -3.76 115.29 117.76 3n04 s HIS 88 Ca 0.13 -3.08 -0.00 0.00 -0.15 0.00 0.00 55.06 51.96 3n04 s HIS 88 Cb -0.21 -2.71 0.14 0.00 1.11 0.00 0.00 32.58 30.91 3n04 s HIS 88 CO -0.11 -0.75 1.87 0.09 -0.85 0.00 0.00 174.74 174.99 3n04 n ASN 89 N 3.20 5.51 -4.30 1.40 3.02 -1.26 -3.78 115.26 119.04 3n04 n ASN 89 Ca 0.05 -2.74 -0.35 0.00 -0.03 0.00 0.00 54.58 51.52 3n04 n ASN 89 Cb 0.33 -1.00 -0.14 0.00 -0.61 0.00 0.00 39.78 38.36 3n04 n ASN 89 CO 0.00 0.00 0.00 0.12 -2.62 0.00 0.00 177.26 174.76 3n04 s PHE 90 N -1.05 2.94 0.15 3.10 5.36 -1.26 -1.46 117.98 125.76 3n04 s PHE 90 Ca 0.18 -0.96 0.08 0.00 -0.96 0.00 0.00 56.93 55.27 3n04 s PHE 90 Cb 0.14 -2.08 -0.04 0.00 -0.34 0.00 0.00 43.02 40.70 3n04 s PHE 90 CO 0.00 -0.54 -0.18 0.96 -1.46 0.00 0.00 175.22 174.00 3n04 s ILE 91 N 1.40 1.73 -0.10 3.12 -4.36 -0.46 -0.68 121.20 121.84 3n04 s ILE 91 Ca 0.05 -1.85 0.01 0.00 -0.26 0.00 0.00 60.65 58.60 3n04 s ILE 91 Cb -0.14 -1.77 0.02 0.00 1.25 0.00 0.00 42.46 41.82 3n04 s ILE 91 CO -0.03 -0.31 -0.11 -0.63 0.24 0.00 0.00 174.94 174.10 3n04 s ILE 92 N -1.99 1.20 -0.20 8.37 1.09 -0.24 -0.74 121.20 128.70 3n04 s ILE 92 Ca 0.14 -0.44 -0.20 0.00 -1.10 0.00 0.00 60.65 59.04 3n04 s ILE 92 Cb -0.06 -1.14 -0.03 0.00 -1.06 0.00 0.00 42.46 40.17 3n04 s ILE 92 CO 0.06 0.39 0.60 -0.69 -0.10 0.00 0.00 174.94 175.20 3n04 s VAL 93 N 1.25 5.04 -0.16 2.92 1.01 -0.20 -1.48 120.40 128.78 3n04 s VAL 93 Ca -0.03 1.13 0.00 0.00 0.00 0.00 0.00 61.98 63.08 3n04 s VAL 93 Cb -0.14 -3.92 0.03 0.00 0.00 0.00 0.00 36.38 32.35 3n04 s VAL 93 CO -0.04 0.12 -0.12 -0.55 0.00 0.00 0.00 175.10 174.52 3n04 s SER 94 N 1.20 2.82 0.00 3.32 0.15 0.14 -1.37 113.70 119.96 3n04 s SER 94 Ca 0.28 -0.58 0.00 0.00 0.70 0.00 0.00 55.95 56.34 3n04 s SER 94 Cb -0.16 -1.13 0.00 0.00 -1.71 0.00 0.00 66.02 63.03 3n04 s SER 94 CO 0.10 -0.10 0.00 0.61 1.20 0.00 0.00 173.24 175.05 3n04 n GLY 95 N 4.78 -0.99 0.24 9.45 0.00 -1.26 -0.61 105.19 116.80 3n04 n GLY 95 Ca -0.15 -0.01 -0.07 0.00 0.00 0.00 0.00 46.02 45.79 3n04 n GLY 95 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3n04 h LYS 96 N 0.00 0.80 -5.27 1.61 1.57 -1.97 -3.37 116.57 109.95 3n04 h LYS 96 Ca 0.00 -0.08 -0.62 0.00 -1.87 0.00 0.00 60.65 58.08 3n04 h LYS 96 Cb 0.00 -0.16 -0.17 0.00 0.08 0.00 0.00 32.23 31.97 3n04 h LYS 96 CO 0.00 0.59 -0.58 0.99 -0.57 0.00 0.00 179.45 179.88 3n04 s THR 97 N -5.93 4.61 -0.03 -0.16 2.01 -1.26 -5.11 115.64 109.77 3n04 s THR 97 Ca -0.13 -0.10 0.04 0.00 0.31 0.00 0.00 61.69 61.81 3n04 s THR 97 Cb 0.13 -3.07 -0.00 0.00 0.01 0.00 0.00 72.50 69.56 3n04 s THR 97 CO 0.77 0.46 -0.13 -0.89 -0.69 0.00 0.00 174.62 174.13 3n04 s THR 98 N 0.42 1.12 -0.01 -0.82 2.01 -1.26 -4.39 115.64 112.71 3n04 s THR 98 Ca 0.02 -0.56 -0.29 0.00 0.31 0.00 0.00 61.69 61.17 3n04 s THR 98 Cb -0.13 -0.97 0.10 0.00 0.01 0.00 0.00 72.50 71.52 3n04 s THR 98 CO 0.01 0.33 0.90 0.72 -0.69 0.00 0.00 174.62 175.89 3n04 s PHE 99 N 0.02 -0.34 0.07 4.92 -0.12 -0.47 -4.61 117.98 117.43 3n04 s PHE 99 Ca -0.01 0.22 0.07 0.00 -0.05 0.00 0.00 56.93 57.16 3n04 s PHE 99 Cb -0.09 0.53 -0.04 0.00 -0.63 0.00 0.00 43.02 42.80 3n04 s PHE 99 CO 0.01 -0.53 -0.16 0.20 -0.05 0.00 0.00 175.22 174.68 3n04 s GLY 100 N -2.43 1.64 -0.09 1.99 0.00 0.33 -1.03 107.32 107.73 3n04 s GLY 100 Ca 0.05 -1.23 0.01 0.00 0.00 0.00 0.00 44.72 43.55 3n04 s GLY 100 CO -0.09 -1.15 -0.11 1.08 0.00 0.00 0.00 173.10 172.83 3n04 s LEU 101 N -1.72 1.51 -0.24 0.66 1.43 0.08 -0.37 118.68 120.04 3n04 s LEU 101 Ca 0.16 -0.33 -0.05 0.00 -1.03 0.00 0.00 54.13 52.88 3n04 s LEU 101 Cb -0.11 -0.89 -0.01 0.00 0.03 0.00 0.00 46.19 45.21 3n04 s LEU 101 CO 0.08 -0.02 0.01 0.12 0.23 0.00 0.00 176.35 176.76 3n04 s PHE 102 N 1.08 3.02 -0.59 0.29 5.36 -0.24 -1.36 117.98 125.55 3n04 s PHE 102 Ca -0.06 -0.77 -0.20 0.00 -0.96 0.00 0.00 56.93 54.94 3n04 s PHE 102 Cb -0.14 -2.16 0.09 0.00 -0.34 0.00 0.00 43.02 40.46 3n04 s PHE 102 CO -0.02 -0.49 0.75 -0.06 -1.46 0.00 0.00 175.22 173.94 3n04 s PHE 103 N 1.53 2.94 -0.97 10.12 0.08 -0.54 -0.73 117.98 130.41 3n04 s PHE 103 Ca 0.06 -0.82 -0.19 0.00 0.12 0.00 0.00 56.93 56.10 3n04 s PHE 103 Cb -0.15 -4.01 0.12 0.00 -0.57 0.00 0.00 43.02 38.42 3n04 s PHE 103 CO -0.00 -1.33 1.20 0.34 -0.10 0.00 0.00 175.22 175.33 3n04 s ASP 104 N 3.51 6.66 -0.14 1.36 2.15 0.91 -4.70 116.67 126.42 3n04 s ASP 104 Ca 0.14 -2.08 -0.06 0.00 0.43 0.00 0.00 52.55 50.99 3n04 s ASP 104 Cb -0.22 -2.42 0.06 0.00 -0.30 0.00 0.00 42.92 40.04 3n04 s ASP 104 CO 0.08 -1.09 0.31 -0.47 -0.17 0.00 0.00 175.17 173.83 3n04 s TYR 105 N 2.86 -0.49 -2.27 -5.34 5.04 -1.26 -2.58 117.35 113.31 3n04 s TYR 105 Ca 0.36 1.07 0.25 0.00 -2.44 0.00 0.00 57.07 56.31 3n04 s TYR 105 Cb -0.04 0.08 1.13 0.00 0.35 0.00 0.00 41.96 43.49 3n04 s TYR 105 CO -0.08 -0.35 1.77 -0.35 -1.34 0.00 0.00 175.55 175.20 3n04 n PRO 106 N 4.95 1.47 -1.80 4.97 -0.04 -1.26 -4.93 135.00 138.36 3n04 n PRO 106 Ca -0.13 -0.69 0.00 0.00 -0.04 0.00 0.00 63.50 62.64 3n04 n PRO 106 Cb 0.51 -1.43 0.00 0.00 -0.04 0.00 0.00 33.50 32.54 3n04 n PRO 106 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 3n04 n SER 107 N -0.14 1.87 -4.62 3.54 2.88 -1.26 -1.33 113.62 114.57 3n04 n SER 107 Ca 0.18 -0.90 -0.43 0.00 -1.33 0.00 0.00 58.87 56.40 3n04 n SER 107 Cb 0.26 0.00 -0.03 0.00 -0.75 0.00 0.00 64.21 63.69 3n04 n SER 107 CO 0.00 0.00 0.00 -0.75 -1.23 0.00 0.00 175.04 173.06 3n04 s LYS 108 N -1.69 3.45 -0.15 -1.46 2.20 -1.26 -4.84 119.74 115.99 3n04 s LYS 108 Ca 0.00 2.05 0.01 0.00 -0.36 0.00 0.00 55.97 57.66 3n04 s LYS 108 Cb 0.00 -4.27 0.02 0.00 -1.51 0.00 0.00 37.83 32.07 3n04 s LYS 108 CO 0.00 -1.73 -0.16 -1.17 -0.36 0.00 0.00 175.35 171.92 3n04 s LEU 109 N 6.95 1.84 -0.25 5.43 2.96 -1.04 -4.45 118.68 130.12 3n04 s LEU 109 Ca 0.92 -0.54 -0.11 0.00 -0.22 0.00 0.00 54.13 54.19 3n04 s LEU 109 Cb -0.33 -1.28 -0.05 0.00 0.50 0.00 0.00 46.19 45.03 3n04 s LEU 109 CO 0.36 -0.03 0.17 -0.89 -1.32 0.00 0.00 176.35 174.64 3n04 s THR 110 N 1.35 5.30 -0.49 3.68 2.01 0.03 -0.52 115.64 127.01 3n04 s THR 110 Ca 0.03 0.16 -0.13 0.00 0.31 0.00 0.00 61.69 62.07 3n04 s THR 110 Cb -0.13 -3.49 0.11 0.00 0.01 0.00 0.00 72.50 68.99 3n04 s THR 110 CO -0.10 0.31 0.40 -0.36 -0.69 0.00 0.00 174.62 174.18 3n04 s PHE 111 N 1.33 3.31 -0.86 4.92 0.08 0.21 -1.29 117.98 125.69 3n04 s PHE 111 Ca 0.07 -1.43 -0.16 0.00 0.12 0.00 0.00 56.93 55.53 3n04 s PHE 111 Cb -0.14 -3.47 0.18 0.00 -0.57 0.00 0.00 43.02 39.02 3n04 s PHE 111 CO 0.07 -0.95 0.90 0.34 -0.10 0.00 0.00 175.22 175.48 3n04 s ASP 112 N 2.93 6.69 -1.11 1.36 -1.08 0.84 -0.78 116.67 125.52 3n04 s ASP 112 Ca 0.04 -2.40 -0.11 0.00 -0.52 0.00 0.00 52.55 49.56 3n04 s ASP 112 Cb -0.27 -2.28 0.25 0.00 -1.46 0.00 0.00 42.92 39.16 3n04 s ASP 112 CO 0.02 -0.78 1.16 -0.63 0.52 0.00 0.00 175.17 175.47 3n04 s ILE 113 N 1.20 5.75 -0.26 4.11 1.01 -0.76 -1.08 121.20 131.17 3n04 s ILE 113 Ca 0.23 -3.16 0.00 0.00 0.00 0.00 0.00 60.65 57.73 3n04 s ILE 113 Cb -0.09 -4.67 0.00 0.00 0.01 0.00 0.00 42.46 37.72 3n04 s ILE 113 CO -0.09 -1.28 0.00 0.61 0.00 0.00 0.00 174.94 174.19 3n04 n GLY 114 N 3.14 0.54 0.07 6.18 0.00 -0.31 -0.33 105.19 114.48 3n04 n GLY 114 Ca 0.26 -0.26 -0.12 0.00 0.00 0.00 0.00 46.02 45.89 3n04 n GLY 114 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 3n04 h TYR 115 N 0.00 -0.03 -0.02 1.61 3.20 -1.79 -3.37 116.97 116.58 3n04 h TYR 115 Ca -0.05 -0.00 -0.03 0.00 3.14 0.00 0.00 58.73 61.79 3n04 h TYR 115 Cb 0.37 0.01 0.00 0.00 1.54 0.00 0.00 36.73 38.65 3n04 h TYR 115 CO 0.20 0.70 -0.11 1.15 -1.64 0.00 0.00 178.16 178.45 3n04 h THR 116 N -0.85 1.50 -0.49 1.81 2.02 -1.89 -3.48 112.91 111.54 3n04 h THR 116 Ca -0.00 -1.64 0.00 0.00 0.77 0.00 0.00 66.41 65.54 3n04 h THR 116 Cb 0.74 2.53 0.00 0.00 -1.74 0.00 0.00 68.15 69.67 3n04 h THR 116 CO 0.01 0.44 0.00 -1.14 0.37 0.00 0.00 175.52 175.20 3n04 n ARG 117 N -4.65 0.49 0.00 6.66 3.00 -1.26 -5.11 116.66 115.80 3n04 n ARG 117 Ca -0.09 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.76 3n04 n ARG 117 Cb 0.39 0.00 0.00 0.00 0.00 0.00 0.00 32.46 32.85 3n04 n ARG 117 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.63 177.23 3n04 n ASP 119 N 0.00 0.00 -4.23 6.15 5.68 -1.26 -4.07 116.55 118.82 3n04 n ASP 119 Ca 0.00 0.00 -0.34 0.00 -0.50 0.00 0.00 54.79 53.95 3n04 n ASP 119 Cb 0.00 0.00 -0.15 0.00 -1.14 0.00 0.00 41.12 39.83 3n04 n ASP 119 CO 0.00 0.00 0.00 -0.89 -1.33 0.00 0.00 177.20 174.98 3n04 s THR 120 N 0.00 2.68 -0.28 2.12 2.01 -1.26 -4.32 115.64 116.59 3n04 s THR 120 Ca 0.00 -0.74 -0.11 0.00 0.31 0.00 0.00 61.69 61.15 3n04 s THR 120 Cb 0.00 -2.16 -0.05 0.00 0.01 0.00 0.00 72.50 70.30 3n04 s THR 120 CO 0.00 0.50 0.19 -0.22 -0.69 0.00 0.00 174.62 174.40 3n04 s LEU 121 N 1.16 4.04 -0.10 4.42 2.96 0.28 -1.16 118.68 130.28 3n04 s LEU 121 Ca 0.01 -0.04 0.02 0.00 -0.22 0.00 0.00 54.13 53.90 3n04 s LEU 121 Cb -0.14 -2.12 0.01 0.00 0.50 0.00 0.00 46.19 44.44 3n04 s LEU 121 CO -0.05 -0.06 -0.16 -0.75 -1.32 0.00 0.00 176.35 174.01 3n04 s LYS 122 N 1.75 2.23 -0.17 1.98 2.20 -0.24 -0.02 119.74 127.47 3n04 s LYS 122 Ca 0.07 -0.57 0.00 0.00 -0.36 0.00 0.00 55.97 55.11 3n04 s LYS 122 Cb -0.16 -1.85 0.00 0.00 -1.51 0.00 0.00 37.83 34.31 3n04 s LYS 122 CO 0.11 -0.02 -0.16 0.08 -0.36 0.00 0.00 175.35 175.00 3n04 s VAL 123 N 0.85 2.52 0.07 4.02 1.01 0.19 -0.11 120.40 128.95 3n04 s VAL 123 Ca -0.09 -0.81 -0.01 0.00 0.00 0.00 0.00 61.98 61.07 3n04 s VAL 123 Cb -0.15 -2.07 -0.04 0.00 0.00 0.00 0.00 36.38 34.12 3n04 s VAL 123 CO 0.01 0.51 -0.02 -0.94 0.00 0.00 0.00 175.10 174.66 3n04 s SER 124 N 1.01 0.57 0.26 3.32 1.04 -0.41 -0.15 113.70 119.33 3n04 s SER 124 Ca -0.02 -1.03 -0.18 0.00 0.48 0.00 0.00 55.95 55.20 3n04 s SER 124 Cb -0.15 0.20 0.01 0.00 0.10 0.00 0.00 66.02 66.18 3n04 s SER 124 CO -0.04 -0.60 0.62 0.00 0.98 0.00 0.00 173.24 174.20 3n04 h GLU 126 N 2.11 0.06 -4.98 0.00 4.81 -1.86 0.13 114.58 114.84 3n04 h GLU 126 Ca -0.23 -0.04 -0.59 0.00 -0.13 0.00 0.00 59.36 58.37 3n04 h GLU 126 Cb 1.25 0.01 -0.33 0.00 0.63 0.00 0.00 28.75 30.31 3n04 h GLU 126 CO 0.29 0.64 -0.84 -0.80 -0.73 0.00 0.00 179.01 177.56 3n04 s ASN 127 N -6.86 2.37 -1.37 1.04 0.01 -1.26 -4.20 114.94 104.67 3n04 s ASN 127 Ca -0.02 -0.41 -0.08 0.00 -0.71 0.00 0.00 52.86 51.63 3n04 s ASN 127 Cb 0.13 -1.04 -0.04 0.00 0.41 0.00 0.00 41.25 40.71 3n04 s ASN 127 CO 0.77 0.10 2.86 0.00 -1.51 0.00 0.00 177.10 179.33 3n04 n ALA 128 N 3.60 7.25 -3.70 0.60 0.00 -1.26 -4.64 120.51 122.36 3n04 n ALA 128 Ca -0.21 -3.52 -0.29 0.00 0.00 0.00 0.00 53.44 49.42 3n04 n ALA 128 Cb 0.52 -3.09 -0.13 0.00 0.00 0.00 0.00 19.45 16.76 3n04 n ALA 128 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3n04 s ASP 129 N 1.62 3.58 0.02 0.00 1.01 -1.25 -2.64 116.67 119.02 3n04 s ASP 129 Ca 0.65 -2.71 -0.28 0.00 0.71 0.00 0.00 52.55 50.93 3n04 s ASP 129 Cb 0.20 -1.02 0.10 0.00 1.01 0.00 0.00 42.92 43.21 3n04 s ASP 129 CO -0.07 -0.25 0.86 -1.48 0.21 0.00 0.00 175.17 174.44 3n04 s LEU 130 N 0.26 -0.38 -0.14 1.23 2.34 -0.06 -4.49 118.68 117.44 3n04 s LEU 130 Ca 0.19 -0.02 -0.04 0.00 0.06 0.00 0.00 54.13 54.31 3n04 s LEU 130 Cb -0.22 2.10 -0.03 0.00 -0.56 0.00 0.00 46.19 47.48 3n04 s LEU 130 CO -0.02 -0.68 0.01 -1.81 -1.06 0.00 0.00 176.35 172.79 3n04 s ASP 131 N -2.54 5.23 -0.22 1.48 1.01 -1.07 -0.10 116.67 120.47 3n04 s ASP 131 Ca 0.05 0.05 -0.03 0.00 0.71 0.00 0.00 52.55 53.33 3n04 s ASP 131 Cb -0.01 -1.72 0.00 0.00 1.01 0.00 0.00 42.92 42.20 3n04 s ASP 131 CO -0.09 0.26 -0.07 -0.63 0.21 0.00 0.00 175.17 174.84 3n04 s ILE 132 N -0.14 3.08 -0.19 0.77 1.01 0.89 -0.06 121.20 126.54 3n04 s ILE 132 Ca 0.05 -0.63 -0.16 0.00 0.00 0.00 0.00 60.65 59.91 3n04 s ILE 132 Cb -0.13 -2.40 -0.04 0.00 0.01 0.00 0.00 42.46 39.90 3n04 s ILE 132 CO 0.02 0.42 0.38 -0.31 0.00 0.00 0.00 174.94 175.45 3n04 s TYR 133 N 1.43 3.39 -0.22 3.97 2.02 0.09 0.05 117.35 128.08 3n04 s TYR 133 Ca 0.05 0.61 -0.09 0.00 -0.37 0.00 0.00 57.07 57.28 3n04 s TYR 133 Cb -0.14 -2.50 -0.04 0.00 -0.40 0.00 0.00 41.96 38.88 3n04 s TYR 133 CO -0.05 0.03 0.11 0.08 -1.57 0.00 0.00 175.55 174.15 3n04 s VAL 134 N 1.18 4.95 -0.20 0.71 1.01 0.24 -1.07 120.40 127.22 3n04 s VAL 134 Ca 0.19 0.04 -0.03 0.00 0.00 0.00 0.00 61.98 62.18 3n04 s VAL 134 Cb -0.15 -3.29 -0.00 0.00 0.00 0.00 0.00 36.38 32.94 3n04 s VAL 134 CO 0.08 0.38 -0.08 -0.63 0.00 0.00 0.00 175.10 174.84 3n04 s ILE 135 N 0.97 3.11 0.32 2.22 1.09 0.50 -1.77 121.20 127.64 3n04 s ILE 135 Ca 0.06 -0.59 -0.03 0.00 -1.10 0.00 0.00 60.65 58.99 3n04 s ILE 135 Cb -0.14 -2.39 -0.04 0.00 -1.06 0.00 0.00 42.46 38.83 3n04 s ILE 135 CO 0.03 0.46 0.56 -1.61 -0.10 0.00 0.00 174.94 174.28 3n04 s GLU 136 N 1.29 3.57 0.00 2.79 0.41 -1.26 -0.51 118.70 124.98 3n04 s GLU 136 Ca 0.03 -0.12 0.00 0.00 -0.41 0.00 0.00 54.97 54.48 3n04 s GLU 136 Cb -0.14 -2.65 0.00 0.00 -1.78 0.00 0.00 34.13 29.56 3n04 s GLU 136 CO -0.04 0.17 0.00 0.41 -0.49 0.00 0.00 175.26 175.32 3n04 n GLY 137 N -1.30 2.03 0.24 -1.39 0.00 -1.26 -4.75 105.19 98.75 3n04 n GLY 137 Ca -0.03 -0.78 0.12 0.00 0.00 0.00 0.00 46.02 45.34 3n04 n GLY 137 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3n04 h GLU 138 N 0.00 0.00 -3.21 1.61 5.08 -1.94 -3.45 114.58 112.66 3n04 h GLU 138 Ca 0.00 0.00 0.01 0.00 -1.00 0.00 0.00 59.36 58.37 3n04 h GLU 138 Cb 0.00 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.20 3n04 h GLU 138 CO 0.00 0.15 0.13 0.54 -1.00 0.00 0.00 179.01 178.84 3n04 s ASN 139 N -6.06 -0.12 0.21 1.42 2.20 -1.26 -5.01 114.94 106.32 3n04 s ASN 139 Ca 0.01 -0.82 -0.09 0.00 -0.94 0.00 0.00 52.86 51.02 3n04 s ASN 139 Cb 0.09 0.71 0.15 0.00 -2.00 0.00 0.00 41.25 40.21 3n04 s ASN 139 CO 0.61 -1.35 1.82 0.00 -2.94 0.00 0.00 177.10 175.24 3n04 h ALA 140 N 2.07 0.98 -0.49 3.54 0.00 -1.93 -2.30 119.26 121.12 3n04 h ALA 140 Ca -0.23 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 54.54 3n04 h ALA 140 Cb 1.25 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 18.71 3n04 h ALA 140 CO 0.30 0.50 0.27 -0.92 0.00 0.00 0.00 179.25 179.40 3n04 h TYR 141 N 1.06 0.67 -0.96 0.00 3.20 -1.95 -0.23 116.97 118.76 3n04 h TYR 141 Ca 0.27 -0.02 0.08 0.00 3.14 0.00 0.00 58.73 62.20 3n04 h TYR 141 Cb 0.05 -0.21 -0.07 0.00 1.54 0.00 0.00 36.73 38.04 3n04 h TYR 141 CO 0.00 0.50 0.61 0.22 -1.64 0.00 0.00 178.16 177.85 3n04 h ASP 142 N 0.65 0.95 -0.22 -2.11 1.82 -1.93 -1.32 116.42 114.26 3n04 h ASP 142 Ca 0.17 0.02 -0.16 0.00 -0.39 0.00 0.00 57.03 56.67 3n04 h ASP 142 Cb 0.05 -0.18 -0.01 0.00 0.68 0.00 0.00 39.33 39.87 3n04 h ASP 142 CO -0.03 0.59 -0.46 0.40 -1.61 0.00 0.00 179.24 178.13 3n04 h ILE 143 N 1.08 1.29 -0.09 2.25 2.04 -0.83 -2.54 117.51 120.70 3n04 h ILE 143 Ca 0.43 -1.65 -0.00 0.00 1.00 0.00 0.00 64.86 64.64 3n04 h ILE 143 Cb 0.24 1.54 -0.00 0.00 -0.74 0.00 0.00 36.82 37.85 3n04 h ILE 143 CO -0.19 0.53 0.05 0.58 0.00 0.00 0.00 178.15 179.12 3n04 h VAL 144 N 0.63 1.07 -0.69 1.67 2.07 -0.40 -1.67 116.25 118.93 3n04 h VAL 144 Ca 0.04 -0.17 0.01 0.00 0.82 0.00 0.00 66.70 67.39 3n04 h VAL 144 Cb 1.03 1.02 -0.04 0.00 -1.52 0.00 0.00 31.29 31.78 3n04 h VAL 144 CO 0.10 0.06 0.45 0.11 0.02 0.00 0.00 177.57 178.31 3n04 h LYS 145 N 0.07 0.88 -0.30 1.57 1.57 -1.23 0.14 116.57 119.29 3n04 h LYS 145 Ca 0.03 -0.05 0.07 0.00 -1.87 0.00 0.00 60.65 58.83 3n04 h LYS 145 Cb 0.05 -0.20 -0.08 0.00 0.08 0.00 0.00 32.23 32.08 3n04 h LYS 145 CO -0.01 0.58 -0.24 1.96 -0.57 0.00 0.00 179.45 181.17 3n04 h GLN 146 N 0.91 -0.21 -0.47 3.15 1.08 -1.32 -1.87 115.11 116.38 3n04 h GLN 146 Ca 0.26 0.01 -0.01 0.00 -1.45 0.00 0.00 58.65 57.46 3n04 h GLN 146 Cb -0.08 0.05 -0.02 0.00 -0.05 0.00 0.00 27.48 27.38 3n04 h GLN 146 CO -0.07 -0.14 0.24 0.35 -0.95 0.00 0.00 178.83 178.26 3n04 h PHE 147 N -0.22 0.65 -0.23 2.96 3.57 -0.27 -2.75 116.94 120.65 3n04 h PHE 147 Ca 0.15 -0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.63 3n04 h PHE 147 Cb 0.46 -0.21 -0.01 0.00 2.79 0.00 0.00 35.95 38.99 3n04 h PHE 147 CO -0.42 0.51 0.12 0.00 -2.23 0.00 0.00 178.31 176.28 3n04 h ARG 148 N 0.61 0.31 0.13 1.11 2.47 -0.54 -2.55 114.38 115.93 3n04 h ARG 148 Ca 0.16 -0.03 -0.00 0.00 -1.26 0.00 0.00 59.98 58.86 3n04 h ARG 148 Cb 0.08 -0.07 -0.01 0.00 -1.65 0.00 0.00 29.97 28.33 3n04 h ARG 148 CO -0.02 0.24 -0.10 -0.09 0.56 0.00 0.00 179.97 180.56 3n04 h ARG 149 N 0.32 -0.22 0.00 0.04 2.43 -1.04 -3.27 114.38 112.63 3n04 h ARG 149 Ca 0.08 0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.27 3n04 h ARG 149 Cb 0.02 0.05 0.00 0.00 -0.42 0.00 0.00 29.97 29.62 3n04 h ARG 149 CO -0.01 -0.15 0.00 -0.39 -1.51 0.00 0.00 179.97 177.91 3n04 h VAL 150 N -0.23 0.00 -0.01 0.20 -1.51 -1.37 -3.06 116.25 110.27 3n04 h VAL 150 Ca -0.01 -0.63 0.00 0.00 -1.23 0.00 0.00 66.70 64.83 3n04 h VAL 150 Cb 0.20 1.59 0.00 0.00 -2.13 0.00 0.00 31.29 30.96 3n04 h VAL 150 CO -0.00 0.00 -0.21 2.30 -1.23 0.00 0.00 177.57 178.43 3n04 n ILE 151 N -2.71 0.00 0.00 7.19 -5.35 -1.07 -1.08 119.36 116.34 3n04 n ILE 151 Ca 0.04 -0.15 0.00 0.00 -0.27 0.00 0.00 62.75 62.37 3n04 n ILE 151 Cb 0.41 0.40 0.00 0.00 -1.74 0.00 0.00 39.64 38.71 3n04 n ILE 151 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3n04 n GLY 152 N 1.31 -1.22 3.77 3.28 0.00 -1.16 -4.36 105.19 106.81 3n04 n GLY 152 Ca 0.13 -1.55 -0.41 0.00 0.00 0.00 0.00 46.02 44.19 3n04 n GLY 152 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3n04 s ARG 153 N -3.21 4.12 0.60 1.61 3.52 -1.26 -4.88 118.95 119.44 3n04 s ARG 153 Ca 0.00 2.57 -0.18 0.00 -0.13 0.00 0.00 55.73 57.99 3n04 s ARG 153 Cb 0.00 -2.98 -0.03 0.00 -1.56 0.00 0.00 34.95 30.37 3n04 s ARG 153 CO 0.00 -0.56 1.16 -1.12 -0.81 0.00 0.00 175.30 173.98 3n04 s SER 154 N 0.03 5.29 0.27 -2.12 0.01 -1.26 -4.42 113.70 111.50 3n04 s SER 154 Ca 0.56 2.25 -0.29 0.00 1.31 0.00 0.00 55.95 59.78 3n04 s SER 154 Cb -0.47 -2.58 -0.14 0.00 0.21 0.00 0.00 66.02 63.03 3n04 s SER 154 CO 0.59 -1.52 0.99 0.00 0.41 0.00 0.00 173.24 173.70 3n04 n TYR 155 N -1.70 1.12 -3.99 2.43 9.36 0.82 -4.91 117.16 120.29 3n04 n TYR 155 Ca 0.12 0.72 -0.34 0.00 3.32 0.00 0.00 57.90 61.73 3n04 n TYR 155 Cb 0.50 -2.23 -0.14 0.00 -0.63 0.00 0.00 39.34 36.84 3n04 n TYR 155 CO 0.00 0.00 0.00 0.42 0.22 0.00 0.00 176.86 177.50 3n04 s ILE 156 N -0.94 2.66 0.67 2.97 1.01 -1.26 -4.84 121.20 121.47 3n04 s ILE 156 Ca 0.61 -1.23 -0.11 0.00 0.00 0.00 0.00 60.65 59.92 3n04 s ILE 156 Cb -0.74 -2.42 -0.01 0.00 0.01 0.00 0.00 42.46 39.30 3n04 s ILE 156 CO 0.59 0.12 1.06 -2.16 0.00 0.00 0.00 174.94 174.54 3n04 s PRO 157 N 1.26 3.20 0.63 2.79 0.04 -1.26 -4.79 135.00 136.87 3n04 s PRO 157 Ca -0.03 0.63 -0.18 0.00 0.04 0.00 0.00 61.00 61.46 3n04 s PRO 157 Cb -0.18 -2.05 -0.02 0.00 0.04 0.00 0.00 34.50 32.30 3n04 s PRO 157 CO -0.05 -0.83 1.23 -1.25 0.04 0.00 0.00 177.00 176.15 3n04 s PRO 158 N -5.25 2.71 0.34 0.56 0.04 -1.26 -4.93 135.00 127.20 3n04 s PRO 158 Ca 0.57 1.88 0.03 0.00 0.04 0.00 0.00 61.00 63.52 3n04 s PRO 158 Cb -0.11 -1.89 0.64 0.00 0.04 0.00 0.00 34.50 33.18 3n04 s PRO 158 CO 0.53 -1.42 1.94 -0.22 0.04 0.00 0.00 177.00 177.87 3n04 h LYS 159 N 0.58 0.85 -0.16 4.56 3.64 -1.41 -2.33 116.57 122.31 3n04 h LYS 159 Ca -0.50 -0.05 0.05 0.00 -1.27 0.00 0.00 60.65 58.87 3n04 h LYS 159 Cb 1.31 -0.19 -0.01 0.00 -0.41 0.00 0.00 32.23 32.93 3n04 h LYS 159 CO 0.54 0.56 0.16 0.27 -2.27 0.00 0.00 179.45 178.71 3n04 h PHE 160 N 0.88 0.00 0.00 1.91 -5.15 -1.92 0.71 116.94 113.37 3n04 h PHE 160 Ca 0.34 0.00 0.00 0.00 -0.20 0.00 0.00 57.97 58.11 3n04 h PHE 160 Cb 0.21 0.00 0.00 0.00 0.22 0.00 0.00 35.95 36.38 3n04 h PHE 160 CO -0.00 0.00 0.00 0.00 -2.00 0.00 0.00 178.31 176.31 3n04 n ALA 161 N -2.36 1.79 1.36 12.09 0.00 -0.87 -1.14 120.51 131.38 3n04 n ALA 161 Ca 0.01 -0.06 0.12 0.00 0.00 0.00 0.00 53.44 53.50 3n04 n ALA 161 Cb 0.28 -1.26 0.44 0.00 0.00 0.00 0.00 19.45 18.91 3n04 n ALA 161 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 3n04 n PHE 162 N -1.41 0.14 -0.00 0.00 3.72 0.24 -4.72 117.46 115.43 3n04 n PHE 162 Ca 0.05 -0.07 0.00 0.00 -0.05 0.00 0.00 57.45 57.39 3n04 n PHE 162 Cb 0.16 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.70 3n04 n PHE 162 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3n04 n GLY 163 N 1.12 -0.43 3.57 1.37 0.00 -0.29 -4.92 105.19 105.61 3n04 n GLY 163 Ca 0.17 -1.60 -0.30 0.00 0.00 0.00 0.00 46.02 44.29 3n04 n GLY 163 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 3n04 s PHE 164 N 0.00 2.73 0.03 1.61 5.36 -1.26 -4.92 117.98 121.52 3n04 s PHE 164 Ca 0.00 -0.16 0.03 0.00 -0.96 0.00 0.00 56.93 55.84 3n04 s PHE 164 Cb 0.00 -1.43 -0.02 0.00 -0.34 0.00 0.00 43.02 41.23 3n04 s PHE 164 CO 0.00 0.42 -0.09 0.20 -1.46 0.00 0.00 175.22 174.29 3n04 s GLY 165 N -2.16 0.52 -0.02 13.12 0.00 -1.26 -0.65 107.32 116.87 3n04 s GLY 165 Ca 0.21 -0.63 0.06 0.00 0.00 0.00 0.00 44.72 44.36 3n04 s GLY 165 CO 0.13 -0.63 -0.19 1.62 0.00 0.00 0.00 173.10 174.04 3n04 s GLN 166 N -1.02 1.58 0.34 2.90 2.00 -1.26 -1.03 119.66 123.17 3n04 s GLN 166 Ca -0.03 -0.66 -0.02 0.00 -2.00 0.00 0.00 55.36 52.64 3n04 s GLN 166 Cb -0.07 -1.49 -0.00 0.00 0.80 0.00 0.00 33.01 32.24 3n04 s GLN 166 CO 0.00 0.38 0.46 -1.12 -0.50 0.00 0.00 175.29 174.51 3n04 s SER 167 N -0.36 0.93 -0.29 6.67 0.01 -0.03 -0.59 113.70 120.04 3n04 s SER 167 Ca 0.05 -1.49 -0.16 0.00 1.31 0.00 0.00 55.95 55.66 3n04 s SER 167 Cb -0.08 0.65 0.13 0.00 0.21 0.00 0.00 66.02 66.93 3n04 s SER 167 CO -0.00 -1.27 0.92 -0.60 0.41 0.00 0.00 173.24 172.69 3n04 s ARG 168 N -3.12 0.44 -0.45 12.44 3.52 -1.26 -2.65 118.95 127.87 3n04 s ARG 168 Ca 0.31 0.77 -0.27 0.00 -0.13 0.00 0.00 55.73 56.41 3n04 s ARG 168 Cb -0.00 0.09 -0.04 0.00 -1.56 0.00 0.00 34.95 33.44 3n04 s ARG 168 CO 0.20 -0.09 2.09 -0.46 -0.81 0.00 0.00 175.30 176.23 3n04 s TRP 169 N 1.40 1.41 0.00 5.12 -0.00 -0.15 -2.18 118.94 124.54 3n04 s TRP 169 Ca -0.09 0.98 0.00 0.00 -0.00 0.00 0.00 56.10 56.99 3n04 s TRP 169 Cb -0.04 -3.90 0.00 0.00 -0.00 0.00 0.00 33.47 29.53 3n04 s TRP 169 CO -0.16 -2.81 0.00 0.41 -0.00 0.00 0.00 176.95 174.39 3n04 n GLY 170 N 5.75 1.28 3.64 5.86 0.00 -1.26 -4.87 105.19 115.59 3n04 n GLY 170 Ca 0.28 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.88 3n04 n GLY 170 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3n04 s TYR 171 N -0.24 1.27 0.00 1.61 2.02 -0.93 -4.78 117.35 116.31 3n04 s TYR 171 Ca 0.00 -0.10 0.00 0.00 -0.37 0.00 0.00 57.07 56.60 3n04 s TYR 171 Cb 0.00 -4.13 0.00 0.00 -0.40 0.00 0.00 41.96 37.43 3n04 s TYR 171 CO 0.00 -5.00 0.00 -2.37 -1.57 0.00 0.00 175.55 166.61 3n04 n THR 172 N 6.30 0.00 -4.12 -0.71 5.66 -1.26 -4.53 114.28 115.62 3n04 n THR 172 Ca 0.23 0.00 -0.22 0.00 -3.05 0.00 0.00 64.05 61.01 3n04 n THR 172 Cb 0.42 -0.17 -0.05 0.00 -1.55 0.00 0.00 70.33 68.99 3n04 n THR 172 CO 0.00 0.00 0.00 0.42 -3.05 0.00 0.00 175.07 172.44 3n04 s THR 173 N -1.09 4.19 0.28 1.09 -4.23 -1.26 -4.82 115.64 109.81 3n04 s THR 173 Ca 0.00 -1.49 0.02 0.00 -1.18 0.00 0.00 61.69 59.05 3n04 s THR 173 Cb 0.00 -3.29 0.27 0.00 1.34 0.00 0.00 72.50 70.82 3n04 s THR 173 CO 0.00 -0.34 1.74 0.11 -0.54 0.00 0.00 174.62 175.59 3n04 h LYS 174 N 1.53 0.54 -0.98 3.99 1.57 -2.00 -1.36 116.57 119.86 3n04 h LYS 174 Ca -0.47 -0.03 0.05 0.00 -1.87 0.00 0.00 60.65 58.33 3n04 h LYS 174 Cb 1.24 -0.12 -0.06 0.00 0.08 0.00 0.00 32.23 33.37 3n04 h LYS 174 CO 0.60 0.36 0.64 1.49 -0.57 0.00 0.00 179.45 181.97 3n04 h GLU 175 N 0.56 1.16 -0.14 3.15 4.81 -1.95 0.05 114.58 122.21 3n04 h GLU 175 Ca 0.52 -0.07 0.00 0.00 -0.13 0.00 0.00 59.36 59.68 3n04 h GLU 175 Cb 0.86 -0.26 -0.01 0.00 0.63 0.00 0.00 28.75 29.97 3n04 h GLU 175 CO -0.43 0.77 0.09 -0.44 -0.73 0.00 0.00 179.01 178.27 3n04 h ASP 176 N 1.19 0.17 -0.25 1.04 3.32 -1.65 -1.46 116.42 118.78 3n04 h ASP 176 Ca 0.41 -0.01 -0.13 0.00 0.02 0.00 0.00 57.03 57.32 3n04 h ASP 176 Cb 0.09 -0.04 -0.01 0.00 0.22 0.00 0.00 39.33 39.59 3n04 h ASP 176 CO -0.15 0.12 -0.31 -0.26 -1.72 0.00 0.00 179.24 176.92 3n04 h PHE 177 N 0.19 0.89 -0.46 4.55 0.04 -1.21 -2.82 116.94 118.12 3n04 h PHE 177 Ca 0.05 -0.23 -0.08 0.00 2.80 0.00 0.00 57.97 60.50 3n04 h PHE 177 Cb -0.02 -0.20 -0.02 0.00 2.20 0.00 0.00 35.95 37.91 3n04 h PHE 177 CO -0.07 0.98 -0.06 0.00 -0.60 0.00 0.00 178.31 178.57 3n04 h ARG 178 N 0.65 0.79 -0.56 1.51 3.08 -0.90 -1.46 114.38 117.50 3n04 h ARG 178 Ca 0.07 -0.24 -0.09 0.00 0.07 0.00 0.00 59.98 59.79 3n04 h ARG 178 Cb 0.85 -0.08 -0.02 0.00 0.08 0.00 0.00 29.97 30.80 3n04 h ARG 178 CO 0.07 0.84 -0.03 0.00 -1.07 0.00 0.00 179.97 179.78 3n04 h ALA 179 N 1.21 0.90 -0.20 0.04 0.00 -1.22 -0.47 119.26 119.52 3n04 h ALA 179 Ca 0.13 -0.31 -0.01 0.00 0.00 0.00 0.00 54.91 54.73 3n04 h ALA 179 Cb 0.53 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 3n04 h ALA 179 CO 0.03 0.65 0.10 0.28 0.00 0.00 0.00 179.25 180.31 3n04 h VAL 180 N 0.89 1.12 -0.23 0.00 2.07 -1.20 0.47 116.25 119.37 3n04 h VAL 180 Ca 0.16 -0.34 0.01 0.00 0.82 0.00 0.00 66.70 67.35 3n04 h VAL 180 Cb 0.56 0.98 -0.02 0.00 -1.52 0.00 0.00 31.29 31.29 3n04 h VAL 180 CO 0.03 0.12 0.12 0.00 0.02 0.00 0.00 177.57 177.86 3n04 h ALA 181 N 0.98 0.28 -0.75 1.67 0.00 -1.07 -1.73 119.26 118.64 3n04 h ALA 181 Ca 0.07 0.00 -0.04 0.00 0.00 0.00 0.00 54.91 54.95 3n04 h ALA 181 Cb 0.09 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 17.80 3n04 h ALA 181 CO -0.01 -0.28 0.33 -0.22 0.00 0.00 0.00 179.25 179.07 3n04 h LYS 182 N 0.25 1.11 -0.37 0.00 3.64 -1.05 -0.61 116.57 119.55 3n04 h LYS 182 Ca 0.09 -0.18 -0.08 0.00 -1.27 0.00 0.00 60.65 59.21 3n04 h LYS 182 Cb 0.02 -0.19 -0.02 0.00 -0.41 0.00 0.00 32.23 31.63 3n04 h LYS 182 CO -0.06 0.89 -0.10 0.78 -2.27 0.00 0.00 179.45 178.69 3n04 h GLY 183 N 1.07 0.68 0.00 5.01 0.00 -0.50 -0.37 103.07 108.97 3n04 h GLY 183 Ca 0.25 -0.48 -0.01 0.00 0.00 0.00 0.00 47.33 47.09 3n04 h GLY 183 CO -0.03 0.45 -0.06 -0.97 0.00 0.00 0.00 176.54 175.93 3n04 h TYR 184 N 0.58 0.00 -0.29 5.60 -1.99 -1.30 -3.32 116.97 116.25 3n04 h TYR 184 Ca 0.11 0.00 -0.16 0.00 2.00 0.00 0.00 58.73 60.68 3n04 h TYR 184 Cb 0.52 0.00 -0.01 0.00 2.00 0.00 0.00 36.73 39.24 3n04 h TYR 184 CO 0.02 0.92 -0.45 0.00 -0.00 0.00 0.00 178.16 178.66 3n04 h ARG 185 N -1.00 0.75 0.00 4.88 2.47 -1.06 -0.86 114.38 119.57 3n04 h ARG 185 Ca -0.02 -0.42 -0.05 0.00 -1.26 0.00 0.00 59.98 58.24 3n04 h ARG 185 Cb 0.92 0.03 -0.01 0.00 -1.65 0.00 0.00 29.97 29.26 3n04 h ARG 185 CO -0.01 1.05 -0.22 0.93 0.56 0.00 0.00 179.97 182.27 3n04 h GLU 186 N 0.60 0.00 -0.48 0.04 5.08 -1.26 -2.67 114.58 115.88 3n04 h GLU 186 Ca 0.04 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.40 3n04 h GLU 186 Cb 1.01 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.26 3n04 h GLU 186 CO 0.10 0.22 0.00 0.09 -1.00 0.00 0.00 179.01 178.42 3n04 n ASN 187 N -3.38 3.19 -3.44 1.42 3.02 -1.03 -4.96 115.26 110.09 3n04 n ASN 187 Ca 0.00 -1.96 -0.25 0.00 -0.03 0.00 0.00 54.58 52.34 3n04 n ASN 187 Cb 0.44 -0.32 0.04 0.00 -0.61 0.00 0.00 39.78 39.32 3n04 n ASN 187 CO 0.00 0.00 0.00 1.41 -2.62 0.00 0.00 177.26 176.05 3n04 n HIS 188 N 1.27 -2.24 -3.38 3.10 8.25 -0.80 -4.97 115.22 116.46 3n04 n HIS 188 Ca 0.20 0.72 -0.39 0.00 -0.26 0.00 0.00 57.72 58.00 3n04 n HIS 188 Cb 0.53 -4.21 -0.08 0.00 1.12 0.00 0.00 29.99 27.35 3n04 n HIS 188 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 3n04 s ILE 189 N -3.20 5.18 0.53 1.59 1.01 -0.40 -4.99 121.20 120.93 3n04 s ILE 189 Ca 0.48 0.66 -0.22 0.00 0.00 0.00 0.00 60.65 61.57 3n04 s ILE 189 Cb -0.23 -3.72 -0.05 0.00 0.01 0.00 0.00 42.46 38.47 3n04 s ILE 189 CO 0.59 0.21 1.33 -2.84 0.00 0.00 0.00 174.94 174.23 3n04 s PRO 190 N 1.64 3.27 -0.19 2.79 0.02 -1.26 -4.48 135.00 136.78 3n04 s PRO 190 Ca 0.17 2.18 -0.28 0.00 0.02 0.00 0.00 61.00 63.09 3n04 s PRO 190 Cb -0.15 -2.30 0.12 0.00 0.02 0.00 0.00 34.50 32.18 3n04 s PRO 190 CO 0.08 -1.07 0.97 -1.50 -0.33 0.00 0.00 177.00 175.15 3n04 s ILE 191 N -1.33 0.00 0.00 2.83 2.07 -0.77 -4.82 121.20 119.18 3n04 s ILE 191 Ca 0.70 0.00 0.00 0.00 -1.41 0.00 0.00 60.65 59.94 3n04 s ILE 191 Cb -0.39 -1.00 0.00 0.00 0.13 0.00 0.00 42.46 41.20 3n04 s ILE 191 CO 0.46 0.00 0.87 0.47 -1.91 0.00 0.00 174.94 174.83 3n04 n ASP 192 N 1.27 1.65 -3.67 4.50 8.00 0.17 -4.55 116.55 123.93 3n04 n ASP 192 Ca -0.12 -1.76 -0.08 0.00 0.71 0.00 0.00 54.79 53.55 3n04 n ASP 192 Cb 0.57 0.00 -0.09 0.00 -0.02 0.00 0.00 41.12 41.59 3n04 n ASP 192 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 3n04 s ILE 194 N -0.76 -0.34 0.00 0.53 1.01 -0.84 -1.27 121.20 119.54 3n04 s ILE 194 Ca 0.00 0.08 0.00 0.00 0.00 0.00 0.00 60.65 60.73 3n04 s ILE 194 Cb 0.00 -0.78 0.00 0.00 0.01 0.00 0.00 42.46 41.69 3n04 s ILE 194 CO 0.00 0.03 0.00 -1.22 0.00 0.00 0.00 174.94 173.75 3n04 n TYR 195 N 4.76 0.00 -3.52 3.97 4.02 0.24 -1.33 117.16 125.30 3n04 n TYR 195 Ca -0.17 0.00 -0.06 0.00 -0.01 0.00 0.00 57.90 57.66 3n04 n TYR 195 Cb 0.54 0.00 0.01 0.00 -0.02 0.00 0.00 39.34 39.87 3n04 n TYR 195 CO 0.00 0.00 0.00 -3.47 -1.01 0.00 0.00 176.86 172.38 3n04 n ASP 197 N 0.00 -1.24 0.25 7.72 -0.08 -1.26 -4.48 116.55 117.47 3n04 n ASP 197 Ca 0.00 -1.95 0.14 0.00 -1.51 0.00 0.00 54.79 51.47 3n04 n ASP 197 Cb 0.00 2.09 0.75 0.00 2.34 0.00 0.00 41.12 46.30 3n04 n ASP 197 CO 0.00 0.00 0.00 0.16 0.12 0.00 0.00 177.20 177.48 3n04 h ILE 198 N 1.57 0.00 0.00 5.18 3.07 -1.92 -2.50 117.51 122.91 3n04 h ILE 198 Ca -0.19 0.00 0.00 0.00 1.55 0.00 0.00 64.86 66.22 3n04 h ILE 198 Cb 0.71 0.61 0.00 0.00 -0.27 0.00 0.00 36.82 37.87 3n04 h ILE 198 CO 0.24 0.00 0.00 0.47 -1.05 0.00 0.00 178.15 177.81 3n04 n ASP 199 N -2.59 0.10 -1.91 2.16 8.00 -1.26 -4.56 116.55 116.48 3n04 n ASP 199 Ca -0.02 0.52 -0.03 0.00 0.71 0.00 0.00 54.79 55.97 3n04 n ASP 199 Cb 0.21 -0.54 -0.05 0.00 -0.02 0.00 0.00 41.12 40.72 3n04 n ASP 199 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3n04 n TYR 200 N -1.60 0.00 -3.68 1.24 0.18 -0.95 -4.83 117.16 107.52 3n04 n TYR 200 Ca 0.04 -0.75 -0.39 0.00 1.88 0.00 0.00 57.90 58.69 3n04 n TYR 200 Cb 0.22 -0.73 -0.12 0.00 -0.38 0.00 0.00 39.34 38.34 3n04 n TYR 200 CO 0.00 0.00 0.00 -1.14 -2.08 0.00 0.00 176.86 173.64 3n04 s GLN 202 N 1.22 2.91 -1.50 -3.48 2.00 -1.26 0.28 119.66 119.83 3n04 s GLN 202 Ca 0.18 -1.00 -0.03 0.00 -2.00 0.00 0.00 55.36 52.51 3n04 s GLN 202 Cb 0.09 -3.57 0.03 0.00 0.80 0.00 0.00 33.01 30.36 3n04 s GLN 202 CO 0.00 -0.60 0.33 -0.25 -0.50 0.00 0.00 175.29 174.27 3n04 n ASP 203 N 4.92 -0.29 -1.92 6.67 8.00 -1.26 -1.39 116.55 131.29 3n04 n ASP 203 Ca -0.13 -1.10 -0.20 0.00 0.71 0.00 0.00 54.79 54.07 3n04 n ASP 203 Cb 0.47 -2.50 -0.05 0.00 -0.02 0.00 0.00 41.12 39.01 3n04 n ASP 203 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 3n04 n PHE 204 N -4.45 -0.48 -3.12 1.24 3.72 -1.26 -4.77 117.46 108.34 3n04 n PHE 204 Ca -0.26 0.00 -0.41 0.00 -0.05 0.00 0.00 57.45 56.73 3n04 n PHE 204 Cb 0.66 -3.54 -0.06 0.00 -0.94 0.00 0.00 39.48 35.60 3n04 n PHE 204 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 176.76 176.86 3n04 s LYS 205 N -4.24 3.98 0.27 -1.08 1.02 -0.49 -4.62 119.74 114.58 3n04 s LYS 205 Ca 0.00 0.39 -0.29 0.00 0.02 0.00 0.00 55.97 56.08 3n04 s LYS 205 Cb 0.00 -3.70 -0.14 0.00 -0.52 0.00 0.00 37.83 33.47 3n04 s LYS 205 CO 0.00 -0.51 1.13 -0.25 -0.92 0.00 0.00 175.35 174.80 3n04 n ASP 206 N 5.81 1.72 -1.80 2.83 8.00 -1.26 -2.46 116.55 129.38 3n04 n ASP 206 Ca -0.01 1.17 -0.15 0.00 0.71 0.00 0.00 54.79 56.51 3n04 n ASP 206 Cb 0.49 -1.32 -0.00 0.00 -0.02 0.00 0.00 41.12 40.26 3n04 n ASP 206 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 3n04 n PHE 207 N 0.67 -0.85 -4.42 1.24 3.72 -1.26 -4.96 117.46 111.60 3n04 n PHE 207 Ca 0.10 0.08 -0.21 0.00 -0.05 0.00 0.00 57.45 57.37 3n04 n PHE 207 Cb 0.31 -3.20 -0.10 0.00 -0.94 0.00 0.00 39.48 35.55 3n04 n PHE 207 CO 0.00 0.00 0.00 0.95 -0.05 0.00 0.00 176.76 177.66 3n04 s THR 208 N -2.79 1.49 0.04 4.37 -4.23 -1.03 -5.02 115.64 108.46 3n04 s THR 208 Ca 0.05 -2.08 0.06 0.00 -1.18 0.00 0.00 61.69 58.53 3n04 s THR 208 Cb -0.02 -2.51 -0.02 0.00 1.34 0.00 0.00 72.50 71.29 3n04 s THR 208 CO 0.06 -0.25 -0.17 0.68 -0.54 0.00 0.00 174.62 174.40 3n04 s VAL 209 N -3.11 1.33 -0.10 2.29 -7.23 -1.26 -4.36 120.40 107.95 3n04 s VAL 209 Ca 0.31 -1.05 -0.31 0.00 -1.81 0.00 0.00 61.98 59.11 3n04 s VAL 209 Cb 0.05 -1.17 -0.09 0.00 0.56 0.00 0.00 36.38 35.73 3n04 s VAL 209 CO 0.12 0.10 2.03 -3.20 -0.31 0.00 0.00 175.10 173.84 3n04 n ASN 210 N 1.93 3.53 -0.02 4.85 2.85 0.14 -3.99 115.26 124.55 3n04 n ASN 210 Ca -0.17 0.70 -0.06 0.00 -0.11 0.00 0.00 54.58 54.94 3n04 n ASN 210 Cb 0.54 -1.46 0.13 0.00 1.24 0.00 0.00 39.78 40.23 3n04 n ASN 210 CO 0.00 0.00 0.00 1.05 -2.11 0.00 0.00 177.26 176.20 3n04 h GLU 211 N 11.45 0.58 -0.28 1.20 4.11 -1.90 -0.13 114.58 129.60 3n04 h GLU 211 Ca -0.45 -0.26 -0.05 0.00 0.07 0.00 0.00 59.36 58.67 3n04 h GLU 211 Cb 1.26 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 30.48 3n04 h GLU 211 CO 0.96 0.83 -0.04 -0.22 0.07 0.00 0.00 179.01 180.60 3n04 h LYS 212 N 0.49 0.52 0.00 1.06 3.11 -2.00 -3.16 116.57 116.59 3n04 h LYS 212 Ca 0.06 -0.18 -0.14 0.00 -2.81 0.00 0.00 60.65 57.57 3n04 h LYS 212 Cb 0.80 -0.04 -0.02 0.00 -1.00 0.00 0.00 32.23 31.97 3n04 h LYS 212 CO 0.06 0.70 -0.87 -0.91 -2.81 0.00 0.00 179.45 175.63 3n04 h ASN 213 N 0.29 0.00 -2.05 4.20 2.35 -1.90 -3.40 115.58 115.07 3n04 h ASN 213 Ca 0.07 0.00 -0.55 0.00 -0.55 0.00 0.00 56.30 55.27 3n04 h ASN 213 Cb 0.49 0.00 -0.40 0.00 0.05 0.00 0.00 38.32 38.46 3n04 h ASN 213 CO 0.02 0.60 -1.02 0.49 -1.65 0.00 0.00 177.43 175.88 3n04 n PHE 214 N -3.14 0.70 0.22 1.19 3.72 -0.07 -4.39 117.46 115.69 3n04 n PHE 214 Ca -0.02 -3.75 0.08 0.00 -0.05 0.00 0.00 57.45 53.72 3n04 n PHE 214 Cb 0.80 -0.41 0.47 0.00 -0.94 0.00 0.00 39.48 39.40 3n04 n PHE 214 CO 0.00 0.00 0.00 -1.00 -0.05 0.00 0.00 176.76 175.71 3n04 h PRO 215 N 3.72 0.00 -2.12 -1.08 0.13 -1.76 -3.28 132.00 127.61 3n04 h PRO 215 Ca 0.10 0.00 -0.58 0.00 -0.87 0.00 0.00 66.00 64.66 3n04 h PRO 215 Cb 0.84 0.00 -0.41 0.00 0.13 0.00 0.00 31.00 31.56 3n04 h PRO 215 CO 0.55 0.27 -0.82 -3.47 -0.23 0.00 0.00 178.00 174.30 3n04 n ASP 216 N -3.56 2.41 -0.19 1.44 -0.08 -1.26 -4.98 116.55 110.32 3n04 n ASP 216 Ca -0.01 -3.19 -0.07 0.00 -1.51 0.00 0.00 54.79 50.02 3n04 n ASP 216 Cb 0.41 -0.64 0.03 0.00 2.34 0.00 0.00 41.12 43.26 3n04 n ASP 216 CO 0.00 0.00 0.00 0.15 0.12 0.00 0.00 177.20 177.47 3n04 h PHE 217 N 3.87 0.72 -0.84 -0.67 3.57 -1.98 -2.49 116.94 119.12 3n04 h PHE 217 Ca 0.14 0.01 0.13 0.00 3.53 0.00 0.00 57.97 61.78 3n04 h PHE 217 Cb 0.74 -0.24 -0.09 0.00 2.79 0.00 0.00 35.95 39.15 3n04 h PHE 217 CO 0.60 0.46 0.45 -1.35 -2.23 0.00 0.00 178.31 176.24 3n04 h PRO 218 N 0.76 0.65 -0.38 6.41 0.11 -1.94 -0.53 132.00 137.09 3n04 h PRO 218 Ca 0.20 -0.04 -0.00 0.00 0.11 0.00 0.00 66.00 66.27 3n04 h PRO 218 Cb -0.07 -0.15 -0.02 0.00 0.11 0.00 0.00 31.00 30.88 3n04 h PRO 218 CO -0.04 0.43 0.23 1.49 -0.21 0.00 0.00 178.00 179.89 3n04 h GLU 219 N 0.67 0.52 -0.18 1.05 4.22 -1.80 -2.04 114.58 117.01 3n04 h GLU 219 Ca 0.44 -0.05 -0.11 0.00 0.08 0.00 0.00 59.36 59.72 3n04 h GLU 219 Cb 0.57 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.70 3n04 h GLU 219 CO -0.33 0.39 -0.38 0.35 -2.18 0.00 0.00 179.01 176.86 3n04 h PHE 220 N 0.49 0.46 -0.68 0.92 3.57 -0.95 0.66 116.94 121.42 3n04 h PHE 220 Ca 0.14 -0.12 -0.05 0.00 3.53 0.00 0.00 57.97 61.46 3n04 h PHE 220 Cb 0.01 -0.10 -0.03 0.00 2.79 0.00 0.00 35.95 38.61 3n04 h PHE 220 CO -0.04 0.73 0.24 0.28 -2.23 0.00 0.00 178.31 177.29 3n04 h VAL 221 N 0.33 1.24 -0.19 1.41 2.07 -0.95 -2.88 116.25 117.28 3n04 h VAL 221 Ca 0.03 -0.80 -0.21 0.00 0.82 0.00 0.00 66.70 66.54 3n04 h VAL 221 Cb 0.82 0.46 0.01 0.00 -1.52 0.00 0.00 31.29 31.06 3n04 h VAL 221 CO 0.07 0.32 -0.70 0.50 0.02 0.00 0.00 177.57 177.78 3n04 h LYS 222 N 1.00 0.79 0.00 1.57 3.64 -0.90 -0.28 116.57 122.39 3n04 h LYS 222 Ca 0.23 -0.59 0.00 0.00 -1.27 0.00 0.00 60.65 59.01 3n04 h LYS 222 Cb 0.24 0.11 0.00 0.00 -0.41 0.00 0.00 32.23 32.17 3n04 h LYS 222 CO -0.01 1.21 0.00 -1.91 -2.27 0.00 0.00 179.45 176.47 3n04 n GLU 223 N -3.95 0.00 0.00 1.90 2.13 0.18 -0.33 120.64 120.57 3n04 n GLU 223 Ca -0.06 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.76 3n04 n GLU 223 Cb 0.70 -0.89 0.00 0.00 0.27 0.00 0.00 31.44 31.52 3n04 n GLU 223 CO 0.00 0.00 0.00 1.17 -0.41 0.00 0.00 177.13 177.89 3n04 n LYS 225 N 0.02 0.00 0.33 5.31 4.81 -0.12 -3.79 118.16 124.72 3n04 n LYS 225 Ca 0.00 0.00 0.20 0.00 -0.87 0.00 0.00 58.31 57.64 3n04 n LYS 225 Cb 0.00 0.00 1.05 0.00 0.02 0.00 0.00 35.03 36.10 3n04 n LYS 225 CO 0.00 0.00 0.00 -0.44 1.17 0.00 0.00 177.40 178.13 3n04 h ASP 226 N 0.00 0.00 -0.48 3.14 3.32 -0.94 0.22 116.42 121.68 3n04 h ASP 226 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 3n04 h ASP 226 Cb 0.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.55 3n04 h ASP 226 CO 0.00 0.00 0.00 0.00 -1.72 0.00 0.00 179.24 177.52 3n04 n GLN 227 N -2.96 3.74 -3.78 3.56 6.02 -1.25 -4.95 117.38 117.77 3n04 n GLN 227 Ca -0.03 -2.87 -0.27 0.00 -0.01 0.00 0.00 57.00 53.82 3n04 n GLN 227 Cb 0.17 -1.92 0.05 0.00 1.02 0.00 0.00 30.24 29.56 3n04 n GLN 227 CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 177.06 176.44 3n04 n GLU 228 N 0.43 -6.58 -4.06 -1.09 -0.58 0.77 -5.00 120.64 104.54 3n04 n GLU 228 Ca 0.24 0.70 -0.33 0.00 -0.42 0.00 0.00 57.16 57.34 3n04 n GLU 228 Cb 0.93 -5.66 -0.15 0.00 -0.57 0.00 0.00 31.44 25.99 3n04 n GLU 228 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 3n04 s LEU 229 N -7.28 2.70 -0.26 -4.62 1.43 -1.26 -4.42 118.68 104.97 3n04 s LEU 229 Ca 0.62 -0.85 -0.11 0.00 -1.03 0.00 0.00 54.13 52.75 3n04 s LEU 229 Cb -0.29 -1.55 -0.05 0.00 0.03 0.00 0.00 46.19 44.33 3n04 s LEU 229 CO 0.79 -0.07 0.19 -0.13 0.23 0.00 0.00 176.35 177.35 3n04 s ARG 230 N 1.26 4.00 0.08 1.70 0.52 -0.39 -2.30 118.95 123.82 3n04 s ARG 230 Ca 0.01 -0.29 -0.30 0.00 -0.52 0.00 0.00 55.73 54.63 3n04 s ARG 230 Cb -0.15 -3.62 -0.05 0.00 0.52 0.00 0.00 34.95 31.65 3n04 s ARG 230 CO -0.09 -0.09 1.07 -0.51 0.02 0.00 0.00 175.30 175.70 3n04 s LEU 231 N 1.51 4.42 -0.43 2.53 1.43 -1.26 -1.98 118.68 124.90 3n04 s LEU 231 Ca 0.08 1.90 0.03 0.00 -1.03 0.00 0.00 54.13 55.11 3n04 s LEU 231 Cb -0.15 -3.58 0.12 0.00 0.03 0.00 0.00 46.19 42.61 3n04 s LEU 231 CO 0.09 -0.28 0.19 -0.63 0.23 0.00 0.00 176.35 175.95 3n04 s ILE 232 N 0.51 1.98 0.33 -0.59 -1.09 -0.44 -4.44 121.20 117.46 3n04 s ILE 232 Ca 0.52 -2.67 -0.15 0.00 -2.23 0.00 0.00 60.65 56.12 3n04 s ILE 232 Cb -0.26 -2.41 -0.09 0.00 -1.58 0.00 0.00 42.46 38.12 3n04 s ILE 232 CO 0.30 -0.77 0.74 -2.16 -1.23 0.00 0.00 174.94 171.83 3n04 s PRO 233 N 0.37 4.00 0.31 2.79 0.05 -1.25 -4.44 135.00 136.83 3n04 s PRO 233 Ca 0.15 0.68 -0.21 0.00 0.05 0.00 0.00 61.00 61.66 3n04 s PRO 233 Cb -0.23 -2.42 -0.09 0.00 0.05 0.00 0.00 34.50 31.80 3n04 s PRO 233 CO -0.04 0.15 0.84 -1.50 0.05 0.00 0.00 177.00 176.49 3n04 s ILE 234 N -2.00 4.43 -0.06 0.56 2.07 -1.26 -2.54 121.20 122.40 3n04 s ILE 234 Ca 0.54 1.46 0.04 0.00 -1.41 0.00 0.00 60.65 61.28 3n04 s ILE 234 Cb -0.10 -3.84 0.00 0.00 0.13 0.00 0.00 42.46 38.66 3n04 s ILE 234 CO 0.17 0.04 -0.17 -0.63 -1.91 0.00 0.00 174.94 172.45 3n04 s ILE 235 N -1.73 1.42 0.18 2.00 -1.09 0.57 -4.92 121.20 117.62 3n04 s ILE 235 Ca 0.50 -0.68 0.02 0.00 -2.23 0.00 0.00 60.65 58.26 3n04 s ILE 235 Cb -0.15 -1.24 -0.04 0.00 -1.58 0.00 0.00 42.46 39.46 3n04 s ILE 235 CO 0.20 0.41 0.32 -1.81 -1.23 0.00 0.00 174.94 172.83 3n04 s ASP 236 N 0.25 6.34 0.31 3.58 1.01 -1.26 -0.92 116.67 125.98 3n04 s ASP 236 Ca -0.09 0.19 0.03 0.00 0.71 0.00 0.00 52.55 53.39 3n04 s ASP 236 Cb -0.13 -1.92 0.50 0.00 1.01 0.00 0.00 42.92 42.37 3n04 s ASP 236 CO 0.03 0.01 1.80 0.00 0.21 0.00 0.00 175.17 177.23 3n04 h ALA 237 N 1.93 1.24 -2.53 5.23 0.00 -1.91 -3.44 119.26 119.77 3n04 h ALA 237 Ca -0.49 -0.26 -0.57 0.00 0.00 0.00 0.00 54.91 53.59 3n04 h ALA 237 Cb 1.20 -0.14 -0.06 0.00 0.00 0.00 0.00 17.79 18.79 3n04 h ALA 237 CO 0.67 0.50 0.24 0.20 0.00 0.00 0.00 179.25 180.86 3n04 s GLY 238 N -3.89 2.45 -0.31 0.00 0.00 -1.26 -4.22 107.32 100.09 3n04 s GLY 238 Ca -0.08 0.14 -0.14 0.00 0.00 0.00 0.00 44.72 44.65 3n04 s GLY 238 CO 0.78 1.44 0.30 0.14 0.00 0.00 0.00 173.10 175.76 3n04 s VAL 239 N 1.38 5.23 0.18 1.40 1.01 -0.25 -4.72 120.40 124.62 3n04 s VAL 239 Ca 0.39 0.15 -0.33 0.00 0.00 0.00 0.00 61.98 62.19 3n04 s VAL 239 Cb -0.18 -3.70 -0.14 0.00 0.00 0.00 0.00 36.38 32.37 3n04 s VAL 239 CO 0.17 0.06 1.57 1.17 0.00 0.00 0.00 175.10 178.08 3n04 n LYS 240 N 5.24 2.22 -2.26 2.72 4.81 -1.26 -1.14 118.16 128.48 3n04 n LYS 240 Ca -0.11 0.80 -0.43 0.00 -0.87 0.00 0.00 58.31 57.70 3n04 n LYS 240 Cb 0.50 -2.56 -0.02 0.00 0.02 0.00 0.00 35.03 32.97 3n04 n LYS 240 CO 0.00 0.00 0.00 0.08 1.17 0.00 0.00 177.40 178.65 3n04 s VAL 241 N 0.78 3.87 -0.29 3.15 1.01 -0.60 -4.59 120.40 123.73 3n04 s VAL 241 Ca 0.77 0.95 -0.13 0.00 0.00 0.00 0.00 61.98 63.56 3n04 s VAL 241 Cb -0.65 -3.97 0.11 0.00 0.00 0.00 0.00 36.38 31.86 3n04 s VAL 241 CO 0.39 -0.48 0.70 -0.70 0.00 0.00 0.00 175.10 175.01 3n04 s GLU 242 N 4.67 0.62 0.19 2.72 2.12 -1.26 -4.92 118.70 122.85 3n04 s GLU 242 Ca 0.65 1.28 -0.33 0.00 0.36 0.00 0.00 54.97 56.93 3n04 s GLU 242 Cb -0.19 0.46 -0.15 0.00 0.26 0.00 0.00 34.13 34.52 3n04 s GLU 242 CO 0.28 -0.17 1.34 1.17 -0.54 0.00 0.00 175.26 177.35 3n04 n LYS 243 N 4.79 1.68 -0.57 4.30 4.81 -1.26 -2.30 118.16 129.61 3n04 n LYS 243 Ca -0.16 0.60 0.00 0.00 -0.87 0.00 0.00 58.31 57.88 3n04 n LYS 243 Cb 0.54 -2.22 0.00 0.00 0.02 0.00 0.00 35.03 33.38 3n04 n LYS 243 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3n04 n GLY 244 N 2.32 1.77 3.61 3.14 0.00 -1.26 -4.98 105.19 109.79 3n04 n GLY 244 Ca 0.14 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.74 3n04 n GLY 244 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 3n04 s TYR 245 N -3.47 3.10 0.30 1.61 5.04 -0.97 -4.94 117.35 118.00 3n04 s TYR 245 Ca 0.00 0.85 -0.01 0.00 -2.44 0.00 0.00 57.07 55.48 3n04 s TYR 245 Cb 0.00 -3.64 0.46 0.00 0.35 0.00 0.00 41.96 39.14 3n04 s TYR 245 CO 0.00 -0.80 1.89 1.49 -1.34 0.00 0.00 175.55 176.79 3n04 h GLU 246 N 8.39 0.88 -0.03 4.97 4.57 -1.94 -0.02 114.58 131.40 3n04 h GLU 246 Ca -0.23 -0.12 -0.00 0.00 -1.18 0.00 0.00 59.36 57.83 3n04 h GLU 246 Cb 1.08 -0.16 -0.00 0.00 -0.16 0.00 0.00 28.75 29.50 3n04 h GLU 246 CO 0.99 0.70 0.01 0.28 -1.18 0.00 0.00 179.01 179.81 3n04 h VAL 247 N 0.87 1.12 0.09 0.32 2.07 -1.92 -1.02 116.25 117.77 3n04 h VAL 247 Ca 0.21 -0.35 0.02 0.00 0.82 0.00 0.00 66.70 67.40 3n04 h VAL 247 Cb 0.13 1.30 -0.03 0.00 -1.52 0.00 0.00 31.29 31.16 3n04 h VAL 247 CO -0.02 0.10 -0.24 0.22 0.02 0.00 0.00 177.57 177.64 3n04 h TYR 248 N -0.09 -0.64 -0.79 1.57 3.20 -1.68 -1.88 116.97 116.66 3n04 h TYR 248 Ca 0.01 0.01 0.04 0.00 3.14 0.00 0.00 58.73 61.93 3n04 h TYR 248 Cb 0.14 0.27 -0.05 0.00 1.54 0.00 0.00 36.73 38.64 3n04 h TYR 248 CO -0.03 -0.34 0.50 0.93 -1.64 0.00 0.00 178.16 177.58 3n04 h GLU 249 N -0.43 0.93 -0.38 1.82 4.39 -0.86 -0.34 114.58 119.72 3n04 h GLU 249 Ca 0.04 -0.06 -0.14 0.00 0.34 0.00 0.00 59.36 59.54 3n04 h GLU 249 Cb 0.47 -0.21 -0.01 0.00 -0.10 0.00 0.00 28.75 28.89 3n04 h GLU 249 CO -0.16 0.62 -0.31 0.93 -1.16 0.00 0.00 179.01 178.93 3n04 h GLU 250 N 0.96 0.83 -0.55 2.33 5.08 -1.19 -1.20 114.58 120.85 3n04 h GLU 250 Ca 0.32 -0.39 -0.03 0.00 -1.00 0.00 0.00 59.36 58.26 3n04 h GLU 250 Cb 0.04 -0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.25 3n04 h GLU 250 CO -0.12 1.02 0.21 0.78 -1.00 0.00 0.00 179.01 179.90 3n04 h GLY 251 N 0.91 0.89 0.80 -3.84 0.00 -0.79 -1.78 103.07 99.26 3n04 h GLY 251 Ca 0.08 -0.49 -0.02 0.00 0.00 0.00 0.00 47.33 46.90 3n04 h GLY 251 CO 0.08 0.46 -0.15 -2.08 0.00 0.00 0.00 176.54 174.85 3n04 h VAL 252 N 0.75 0.72 -0.52 4.60 2.07 -0.97 -1.41 116.25 121.49 3n04 h VAL 252 Ca 0.18 -0.38 -0.04 0.00 0.82 0.00 0.00 66.70 67.28 3n04 h VAL 252 Cb 0.22 0.92 -0.02 0.00 -1.52 0.00 0.00 31.29 30.88 3n04 h VAL 252 CO -0.01 0.08 0.16 0.11 0.02 0.00 0.00 177.57 177.92 3n04 h LYS 253 N -0.63 0.77 -0.48 1.57 1.79 -1.17 -2.78 116.57 115.65 3n04 h LYS 253 Ca -0.04 -0.14 0.00 0.00 -2.18 0.00 0.00 60.65 58.29 3n04 h LYS 253 Cb 0.45 -0.13 0.00 0.00 -1.58 0.00 0.00 32.23 30.97 3n04 h LYS 253 CO 0.07 0.67 0.00 0.09 -1.08 0.00 0.00 179.45 179.20 3n04 n ASN 254 N -4.30 3.11 -3.74 0.86 3.02 -0.67 -4.97 115.26 108.57 3n04 n ASN 254 Ca 0.04 -1.96 -0.24 0.00 -0.03 0.00 0.00 54.58 52.39 3n04 n ASN 254 Cb 0.20 -0.31 0.04 0.00 -0.61 0.00 0.00 39.78 39.09 3n04 n ASN 254 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 3n04 n ASN 255 N 1.22 -2.48 -0.64 6.41 3.02 -1.05 -4.93 115.26 116.82 3n04 n ASN 255 Ca 0.19 -0.78 0.13 0.00 -0.03 0.00 0.00 54.58 54.10 3n04 n ASN 255 Cb 0.52 -4.13 0.39 0.00 -0.61 0.00 0.00 39.78 35.94 3n04 n ASN 255 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 3n04 n TYR 256 N -4.42 0.02 -3.88 3.10 4.01 -0.55 -4.95 117.16 110.49 3n04 n TYR 256 Ca -0.19 -0.01 -0.27 0.00 -0.16 0.00 0.00 57.90 57.27 3n04 n TYR 256 Cb 0.63 0.00 -0.03 0.00 -0.31 0.00 0.00 39.34 39.63 3n04 n TYR 256 CO 0.00 0.00 0.00 -0.06 -0.46 0.00 0.00 176.86 176.34 3n04 s PHE 257 N -1.98 3.49 0.30 -0.72 0.08 -1.25 -0.11 117.98 117.79 3n04 s PHE 257 Ca 0.35 0.19 -0.29 0.00 0.12 0.00 0.00 56.93 57.30 3n04 s PHE 257 Cb 0.21 -1.72 -0.10 0.00 -0.57 0.00 0.00 43.02 40.83 3n04 s PHE 257 CO 0.32 0.49 1.30 0.00 -0.10 0.00 0.00 175.22 177.23 3n04 s LYS 259 N -1.45 1.46 0.94 0.00 1.02 -1.18 -1.63 119.74 118.90 3n04 s LYS 259 Ca 0.50 -1.45 -0.12 0.00 0.02 0.00 0.00 55.97 54.93 3n04 s LYS 259 Cb -0.39 -1.84 0.15 0.00 -0.52 0.00 0.00 37.83 35.24 3n04 s LYS 259 CO 0.49 0.41 1.09 1.03 -0.92 0.00 0.00 175.35 177.46 3n04 s ARG 260 N -2.43 0.94 0.56 1.68 0.52 0.63 -0.46 118.95 120.39 3n04 s ARG 260 Ca 0.18 0.70 0.23 0.00 -0.52 0.00 0.00 55.73 56.32 3n04 s ARG 260 Cb -0.09 -1.78 1.56 0.00 0.52 0.00 0.00 34.95 35.16 3n04 s ARG 260 CO 0.08 -2.43 2.19 1.05 0.02 0.00 0.00 175.30 176.22 3n04 h GLU 261 N -1.68 0.00 0.00 3.54 4.11 -1.89 0.90 114.58 119.56 3n04 h GLU 261 Ca -0.51 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.92 3n04 h GLU 261 Cb 1.30 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.55 3n04 h GLU 261 CO 0.56 0.00 0.00 -0.40 0.07 0.00 0.00 179.01 179.24 3n04 n ASP 262 N -4.17 0.00 0.00 3.06 5.75 -1.26 -4.90 116.55 115.03 3n04 n ASP 262 Ca -0.02 -0.80 0.00 0.00 -0.01 0.00 0.00 54.79 53.95 3n04 n ASP 262 Cb 0.11 -0.01 0.00 0.00 -1.03 0.00 0.00 41.12 40.19 3n04 n ASP 262 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3n04 n GLY 263 N 0.69 1.06 3.78 6.12 0.00 0.31 -5.06 105.19 112.09 3n04 n GLY 263 Ca 0.20 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.87 3n04 n GLY 263 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3n04 s SER 264 N -3.06 5.72 -0.12 1.61 1.04 -1.26 -4.73 113.70 112.90 3n04 s SER 264 Ca 0.00 2.11 -0.29 0.00 0.48 0.00 0.00 55.95 58.25 3n04 s SER 264 Cb 0.00 -2.57 -0.04 0.00 0.10 0.00 0.00 66.02 63.51 3n04 s SER 264 CO 0.00 -1.22 1.57 -1.81 0.98 0.00 0.00 173.24 172.76 3n04 s ASP 265 N -1.93 6.64 0.27 7.02 1.01 -1.26 -0.27 116.67 128.15 3n04 s ASP 265 Ca 0.71 1.97 -0.30 0.00 0.71 0.00 0.00 52.55 55.65 3n04 s ASP 265 Cb -0.22 -2.53 -0.10 0.00 1.01 0.00 0.00 42.92 41.07 3n04 s ASP 265 CO 0.28 -0.98 1.38 0.12 0.21 0.00 0.00 175.17 176.18 3n04 s PHE 266 N 4.25 3.06 -0.22 4.23 5.36 -0.65 -4.83 117.98 129.18 3n04 s PHE 266 Ca 0.69 1.17 -0.07 0.00 -0.96 0.00 0.00 56.93 57.77 3n04 s PHE 266 Cb -0.29 -3.75 -0.03 0.00 -0.34 0.00 0.00 43.02 38.61 3n04 s PHE 266 CO 0.27 -2.31 0.05 0.08 -1.46 0.00 0.00 175.22 171.85 3n04 s VAL 267 N -0.34 4.30 -0.04 3.12 1.01 -1.26 -4.37 120.40 122.82 3n04 s VAL 267 Ca 0.56 -0.19 0.05 0.00 0.00 0.00 0.00 61.98 62.40 3n04 s VAL 267 Cb -0.40 -2.98 -0.01 0.00 0.00 0.00 0.00 36.38 32.99 3n04 s VAL 267 CO 0.46 0.38 -0.19 0.00 0.00 0.00 0.00 175.10 175.75 3n04 s ALA 268 N 1.23 1.64 -0.06 5.51 0.00 -0.34 -3.67 121.76 126.07 3n04 s ALA 268 Ca 0.04 -0.78 -0.27 0.00 0.00 0.00 0.00 51.96 50.95 3n04 s ALA 268 Cb -0.14 -0.50 -0.03 0.00 0.00 0.00 0.00 23.12 22.45 3n04 s ALA 268 CO 0.03 0.33 0.87 0.00 0.00 0.00 0.00 175.76 176.99 3n04 s ALA 269 N -0.15 3.31 0.00 0.00 0.00 0.17 -0.07 121.76 125.01 3n04 s ALA 269 Ca -0.00 0.30 0.00 0.00 0.00 0.00 0.00 51.96 52.26 3n04 s ALA 269 Cb -0.10 -3.21 0.00 0.00 0.00 0.00 0.00 23.12 19.81 3n04 s ALA 269 CO 0.01 -0.31 0.00 0.28 0.00 0.00 0.00 175.76 175.74 3n04 n VAL 270 N 4.09 0.00 -0.33 0.00 0.31 -0.30 -1.18 118.33 120.93 3n04 n VAL 270 Ca 0.04 0.00 0.17 0.00 -0.01 0.00 0.00 64.34 64.54 3n04 n VAL 270 Cb 0.50 0.00 0.37 0.00 -0.91 0.00 0.00 33.84 33.81 3n04 n VAL 270 CO 0.00 0.00 0.00 -0.50 -1.32 0.00 0.00 176.83 175.01 3n04 h TRP 271 N 0.00 0.84 -0.05 3.52 4.06 -1.96 0.08 115.95 122.45 3n04 h TRP 271 Ca 0.00 0.04 0.00 0.00 2.06 0.00 0.00 58.89 60.99 3n04 h TRP 271 Cb 0.00 -0.22 0.00 0.00 -1.00 0.00 0.00 29.16 27.94 3n04 h TRP 271 CO 0.00 -0.04 0.00 -2.30 -3.56 0.00 0.00 178.44 172.54 3n04 n PRO 272 N -4.99 1.14 0.00 0.49 -0.02 -1.26 -4.96 135.00 125.40 3n04 n PRO 272 Ca 0.26 -0.22 0.00 0.00 -2.02 0.00 0.00 63.50 61.52 3n04 n PRO 272 Cb 0.76 -1.19 0.00 0.00 -0.02 0.00 0.00 33.50 33.05 3n04 n PRO 272 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3n04 n GLY 273 N 0.74 0.54 3.74 -1.23 0.00 0.01 -4.93 105.19 104.06 3n04 n GLY 273 Ca 0.09 -1.11 -0.42 0.00 0.00 0.00 0.00 46.02 44.58 3n04 n GLY 273 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3n04 s ASP 274 N -4.00 6.43 0.18 1.61 1.01 -1.26 -1.14 116.67 119.50 3n04 s ASP 274 Ca 0.00 2.85 -0.01 0.00 0.71 0.00 0.00 52.55 56.10 3n04 s ASP 274 Cb 0.00 -2.62 -0.04 0.00 1.01 0.00 0.00 42.92 41.27 3n04 s ASP 274 CO 0.00 -0.90 0.09 0.42 0.21 0.00 0.00 175.17 175.00 3n04 s THR 275 N 0.51 0.13 0.22 -1.27 -4.23 0.89 -1.56 115.64 110.33 3n04 s THR 275 Ca 0.67 -1.97 0.10 0.00 -1.18 0.00 0.00 61.69 59.31 3n04 s THR 275 Cb -0.47 -2.33 -0.04 0.00 1.34 0.00 0.00 72.50 70.99 3n04 s THR 275 CO 0.40 -0.19 -0.09 -1.00 -0.54 0.00 0.00 174.62 173.20 3n04 s HIS 276 N -4.05 2.59 -0.23 3.99 3.76 -0.30 -1.20 115.29 119.85 3n04 s HIS 276 Ca 0.33 -0.24 -0.10 0.00 -0.15 0.00 0.00 55.06 54.89 3n04 s HIS 276 Cb 0.07 -1.21 -0.05 0.00 1.11 0.00 0.00 32.58 32.50 3n04 s HIS 276 CO 0.08 0.57 0.15 -0.06 -0.85 0.00 0.00 174.74 174.63 3n04 s PHE 277 N -1.98 3.31 0.42 1.40 0.08 -1.26 -1.09 117.98 118.85 3n04 s PHE 277 Ca 0.27 0.20 -0.26 0.00 0.12 0.00 0.00 56.93 57.26 3n04 s PHE 277 Cb -0.08 -2.24 -0.10 0.00 -0.57 0.00 0.00 43.02 40.03 3n04 s PHE 277 CO 0.16 0.08 1.39 -2.30 -0.10 0.00 0.00 175.22 174.45 3n04 n PRO 278 N 4.17 2.24 -2.06 0.24 -0.02 -1.26 -0.28 135.00 138.03 3n04 n PRO 278 Ca -0.15 0.79 -0.29 0.00 -2.02 0.00 0.00 63.50 61.83 3n04 n PRO 278 Cb 0.52 -2.54 0.03 0.00 -0.02 0.00 0.00 33.50 31.49 3n04 n PRO 278 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 3n04 s ASP 279 N -0.40 5.70 0.00 2.55 -1.08 0.84 -4.61 116.67 119.67 3n04 s ASP 279 Ca 0.59 1.07 0.00 0.00 -0.52 0.00 0.00 52.55 53.69 3n04 s ASP 279 Cb -0.48 -2.01 0.00 0.00 -1.46 0.00 0.00 42.92 38.97 3n04 s ASP 279 CO 0.59 -1.12 0.00 0.18 0.52 0.00 0.00 175.17 175.35 3n04 n LEU 281 N -2.79 0.00 -4.60 -1.34 4.32 -1.26 -4.39 117.00 106.93 3n04 n LEU 281 Ca 0.06 0.00 -0.42 0.00 -0.02 0.00 0.00 56.01 55.62 3n04 n LEU 281 Cb 0.56 0.00 -0.04 0.00 -1.62 0.00 0.00 43.42 42.32 3n04 n LEU 281 CO 0.56 0.00 0.66 0.21 -1.22 0.00 0.00 177.39 177.60 3n04 s ASN 282 N 0.00 6.65 0.27 -1.43 3.84 -1.25 -4.62 114.94 118.39 3n04 s ASN 282 Ca 0.00 0.56 -0.02 0.00 0.21 0.00 0.00 52.86 53.61 3n04 s ASN 282 Cb 0.00 -2.43 0.42 0.00 -0.55 0.00 0.00 41.25 38.69 3n04 s ASN 282 CO 0.00 -0.74 1.89 -0.65 -2.79 0.00 0.00 177.10 174.80 3n04 h PRO 283 N 8.34 1.13 -0.31 0.43 0.11 -1.86 0.59 132.00 140.43 3n04 h PRO 283 Ca -0.24 -0.07 -0.09 0.00 0.11 0.00 0.00 66.00 65.71 3n04 h PRO 283 Cb 1.09 -0.26 -0.02 0.00 0.11 0.00 0.00 31.00 31.93 3n04 h PRO 283 CO 0.93 0.75 -0.19 0.93 -0.21 0.00 0.00 178.00 180.21 3n04 h GLU 284 N 1.17 0.58 -0.18 1.05 4.39 -1.94 -1.86 114.58 117.79 3n04 h GLU 284 Ca 0.43 -0.20 -0.15 0.00 0.34 0.00 0.00 59.36 59.78 3n04 h GLU 284 Cb 0.17 -0.04 -0.01 0.00 -0.10 0.00 0.00 28.75 28.77 3n04 h GLU 284 CO -0.17 0.74 -0.51 0.00 -1.16 0.00 0.00 179.01 177.91 3n04 h ALA 285 N 1.28 0.79 -0.60 3.43 0.00 -1.55 -1.79 119.26 120.81 3n04 h ALA 285 Ca 0.08 -0.49 0.00 0.00 0.00 0.00 0.00 54.91 54.51 3n04 h ALA 285 Cb 0.62 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.29 3n04 h ALA 285 CO 0.04 0.67 0.39 0.00 0.00 0.00 0.00 179.25 180.36 3n04 h ARG 286 N 0.39 0.80 0.00 0.00 3.08 -0.70 0.13 114.38 118.08 3n04 h ARG 286 Ca 0.02 -0.05 -0.00 0.00 0.07 0.00 0.00 59.98 60.01 3n04 h ARG 286 Cb 1.02 -0.18 0.00 0.00 0.08 0.00 0.00 29.97 30.89 3n04 h ARG 286 CO 0.09 0.54 -0.00 -0.22 -1.07 0.00 0.00 179.97 179.31 3n04 h LYS 287 N 0.82 -0.00 -0.23 0.04 3.64 -1.18 -0.52 116.57 119.13 3n04 h LYS 287 Ca 0.22 0.00 0.04 0.00 -1.27 0.00 0.00 60.65 59.64 3n04 h LYS 287 Cb -0.08 0.00 -0.04 0.00 -0.41 0.00 0.00 32.23 31.71 3n04 h LYS 287 CO -0.05 0.19 -0.02 2.35 -2.27 0.00 0.00 179.45 179.66 3n04 h TRP 288 N -0.20 -0.05 -0.08 1.91 7.01 -1.21 -0.24 115.95 123.09 3n04 h TRP 288 Ca -0.00 0.02 -0.01 0.00 2.11 0.00 0.00 58.89 61.01 3n04 h TRP 288 Cb 0.20 0.06 -0.00 0.00 -2.10 0.00 0.00 29.16 27.31 3n04 h TRP 288 CO -0.01 -0.06 0.01 0.35 -2.79 0.00 0.00 178.44 175.94 3n04 h PHE 289 N 0.04 0.14 -0.71 2.65 3.57 -0.90 -3.10 116.94 118.64 3n04 h PHE 289 Ca 0.11 -0.02 0.07 0.00 3.53 0.00 0.00 57.97 61.66 3n04 h PHE 289 Cb 0.15 -0.04 -0.06 0.00 2.79 0.00 0.00 35.95 38.79 3n04 h PHE 289 CO -0.21 0.36 0.39 0.78 -2.23 0.00 0.00 178.31 177.40 3n04 h GLY 290 N -0.11 1.06 1.79 2.40 0.00 -1.03 -2.34 103.07 104.83 3n04 h GLY 290 Ca 0.02 -0.26 0.01 0.00 0.00 0.00 0.00 47.33 47.11 3n04 h GLY 290 CO 0.00 0.13 0.09 -0.55 0.00 0.00 0.00 176.54 176.21 3n04 h ASP 291 N 0.69 0.00 0.61 0.19 3.32 -0.96 -2.09 116.42 118.17 3n04 h ASP 291 Ca 0.33 0.00 -0.03 0.00 0.02 0.00 0.00 57.03 57.35 3n04 h ASP 291 Cb 0.26 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.81 3n04 h ASP 291 CO -0.22 0.00 -0.13 0.11 -1.72 0.00 0.00 179.24 177.29 3n04 h LYS 292 N 0.00 0.00 0.00 3.56 1.79 -1.37 -2.11 116.57 118.44 3n04 h LYS 292 Ca 0.02 0.00 -0.00 0.00 -2.18 0.00 0.00 60.65 58.49 3n04 h LYS 292 Cb 0.21 0.00 -0.00 0.00 -1.58 0.00 0.00 32.23 30.86 3n04 h LYS 292 CO -0.00 0.13 -0.01 1.88 -1.08 0.00 0.00 179.45 180.37 3n04 h TYR 293 N 0.00 0.00 -0.68 -1.35 -1.99 -1.52 -2.03 116.97 109.40 3n04 h TYR 293 Ca -0.00 0.00 0.10 0.00 2.00 0.00 0.00 58.73 60.83 3n04 h TYR 293 Cb 0.47 0.00 -0.04 0.00 2.00 0.00 0.00 36.73 39.15 3n04 h TYR 293 CO 0.00 0.01 0.45 -0.09 -0.00 0.00 0.00 178.16 178.53 3n04 h ARG 294 N 0.00 0.52 -0.99 4.88 2.43 -1.58 -1.61 114.38 118.04 3n04 h ARG 294 Ca -0.00 -0.03 0.18 0.00 -0.81 0.00 0.00 59.98 59.32 3n04 h ARG 294 Cb 0.07 -0.12 -0.10 0.00 -0.42 0.00 0.00 29.97 29.41 3n04 h ARG 294 CO 0.00 0.34 0.61 0.35 -1.51 0.00 0.00 179.97 179.77 3n04 h PHE 295 N 0.53 1.01 0.15 2.20 3.57 -1.58 -0.72 116.94 122.09 3n04 h PHE 295 Ca 0.31 0.03 -0.36 0.00 3.53 0.00 0.00 57.97 61.49 3n04 h PHE 295 Cb 0.51 -0.31 -0.01 0.00 2.79 0.00 0.00 35.95 38.94 3n04 h PHE 295 CO -0.00 0.27 -1.89 -0.07 -2.23 0.00 0.00 178.31 174.38 3n04 h LEU 296 N 0.76 0.50 -0.98 0.59 3.38 -1.51 -3.34 115.31 114.70 3n04 h LEU 296 Ca 0.55 -0.95 0.05 0.00 0.09 0.00 0.00 57.88 57.61 3n04 h LEU 296 Cb 0.86 -0.16 -0.06 0.00 0.09 0.00 0.00 40.66 41.38 3n04 h LEU 296 CO -0.33 1.83 0.64 0.40 0.09 0.00 0.00 178.44 181.07 3n04 h ILE 297 N 0.08 1.14 0.00 1.22 2.04 -1.14 -1.14 117.51 119.71 3n04 h ILE 297 Ca -0.39 -0.42 -0.00 0.00 1.00 0.00 0.00 64.86 65.05 3n04 h ILE 297 Cb 2.06 -0.18 -0.00 0.00 -0.74 0.00 0.00 36.82 37.96 3n04 h ILE 297 CO 0.12 0.22 -0.00 0.44 0.00 0.00 0.00 178.15 178.93 3n04 h ASP 298 N 1.21 0.00 -0.09 1.72 3.32 -1.29 -1.52 116.42 119.77 3n04 h ASP 298 Ca 0.40 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.45 3n04 h ASP 298 Cb 0.05 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.60 3n04 h ASP 298 CO -0.14 0.00 0.00 0.00 -1.72 0.00 0.00 179.24 177.38 3n04 n GLN 299 N -3.11 1.95 0.00 3.56 6.02 -0.45 -4.93 117.38 120.42 3n04 n GLN 299 Ca -0.02 -1.40 0.00 0.00 -0.01 0.00 0.00 57.00 55.58 3n04 n GLN 299 Cb 0.15 -1.46 0.00 0.00 1.02 0.00 0.00 30.24 29.95 3n04 n GLN 299 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3n04 n GLY 300 N 1.25 1.17 3.75 1.08 0.00 -0.57 -4.53 105.19 107.34 3n04 n GLY 300 Ca 0.17 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.79 3n04 n GLY 300 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3n04 s ILE 301 N -2.00 4.52 -0.02 -0.61 -1.09 -1.08 -4.96 121.20 115.97 3n04 s ILE 301 Ca 0.00 1.74 0.03 0.00 -2.23 0.00 0.00 60.65 60.19 3n04 s ILE 301 Cb 0.00 -4.16 0.04 0.00 -1.58 0.00 0.00 42.46 36.76 3n04 s ILE 301 CO 0.00 0.43 0.99 -0.62 -1.23 0.00 0.00 174.94 174.51 3n04 n GLU 302 N 2.27 2.54 0.00 2.79 1.02 -1.26 -4.33 120.64 123.67 3n04 n GLU 302 Ca -0.03 -1.58 0.00 0.00 -0.02 0.00 0.00 57.16 55.53 3n04 n GLU 302 Cb 0.49 -1.03 0.00 0.00 -0.02 0.00 0.00 31.44 30.88 3n04 n GLU 302 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3n04 n GLY 303 N -0.60 0.69 3.19 0.62 0.00 -1.26 -1.98 105.19 105.85 3n04 n GLY 303 Ca 0.02 -0.60 -0.08 0.00 0.00 0.00 0.00 46.02 45.36 3n04 n GLY 303 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3n04 s PHE 304 N -2.00 0.25 -0.04 1.61 0.08 0.25 -3.78 117.98 114.34 3n04 s PHE 304 Ca 0.00 -0.70 0.04 0.00 0.12 0.00 0.00 56.93 56.39 3n04 s PHE 304 Cb 0.00 -0.13 -0.00 0.00 -0.57 0.00 0.00 43.02 42.32 3n04 s PHE 304 CO 0.00 -0.52 -0.16 1.67 -0.10 0.00 0.00 175.22 176.11 3n04 s TRP 305 N -3.88 1.64 -0.15 0.36 1.48 -1.05 -2.86 118.94 114.47 3n04 s TRP 305 Ca 0.06 -0.47 -0.14 0.00 -1.06 0.00 0.00 56.10 54.50 3n04 s TRP 305 Cb 0.05 -1.11 -0.05 0.00 -1.16 0.00 0.00 33.47 31.21 3n04 s TRP 305 CO -0.10 -0.16 0.31 -0.80 -4.06 0.00 0.00 176.95 172.14 3n04 s ASN 306 N 0.06 6.46 -0.39 -2.66 0.02 -0.24 -0.32 114.94 117.88 3n04 s ASN 306 Ca -0.04 0.54 0.01 0.00 -1.02 0.00 0.00 52.86 52.35 3n04 s ASN 306 Cb -0.11 -2.19 0.13 0.00 0.02 0.00 0.00 41.25 39.10 3n04 s ASN 306 CO 0.02 0.09 0.21 -0.62 0.02 0.00 0.00 177.10 176.82 3n04 s ASP 307 N 0.47 3.39 0.00 -1.22 2.15 -0.09 -2.19 116.67 119.18 3n04 s ASP 307 Ca 0.17 -2.30 0.00 0.00 0.43 0.00 0.00 52.55 50.85 3n04 s ASP 307 Cb -0.13 -0.73 0.00 0.00 -0.30 0.00 0.00 42.92 41.76 3n04 s ASP 307 CO 0.05 -0.30 0.00 -0.46 -0.17 0.00 0.00 175.17 174.28 3n04 n ASN 309 N 3.93 0.00 -0.28 -0.34 6.94 -1.26 -2.54 115.26 121.71 3n04 n ASN 309 Ca 0.08 0.00 0.00 0.00 -0.02 0.00 0.00 54.58 54.65 3n04 n ASN 309 Cb 0.36 0.00 0.13 0.00 -2.36 0.00 0.00 39.78 37.91 3n04 n ASN 309 CO 0.00 0.00 0.00 -0.33 -1.03 0.00 0.00 177.26 175.90 3n04 h GLU 310 N 0.00 0.83 -6.56 -3.83 3.07 -1.94 -2.47 114.58 103.67 3n04 h GLU 310 Ca 0.00 -0.05 -0.52 0.00 -0.50 0.00 0.00 59.36 58.29 3n04 h GLU 310 Cb 0.00 -0.19 -0.02 0.00 -0.84 0.00 0.00 28.75 27.70 3n04 h GLU 310 CO 0.00 0.55 0.31 -1.25 -1.40 0.00 0.00 179.01 177.22 3n04 s PRO 311 N -6.07 4.69 0.34 2.33 0.04 -1.26 -4.62 135.00 130.44 3n04 s PRO 311 Ca -0.13 1.37 -0.29 0.00 0.04 0.00 0.00 61.00 62.00 3n04 s PRO 311 Cb 0.18 -3.34 -0.10 0.00 0.04 0.00 0.00 34.50 31.27 3n04 s PRO 311 CO 0.78 0.32 1.36 0.00 0.04 0.00 0.00 177.00 179.50 3n04 s ALA 312 N -0.36 3.52 -0.14 8.56 0.00 -1.26 -5.01 121.76 127.07 3n04 s ALA 312 Ca 0.43 1.35 -0.02 0.00 0.00 0.00 0.00 51.96 53.72 3n04 s ALA 312 Cb -0.23 -3.52 0.04 0.00 0.00 0.00 0.00 23.12 19.41 3n04 s ALA 312 CO 0.29 -0.76 0.02 0.42 0.00 0.00 0.00 175.76 175.73 3n04 s ILE 313 N -1.09 0.48 0.20 0.00 1.01 -1.26 -4.90 121.20 115.64 3n04 s ILE 313 Ca 0.50 -0.26 -0.07 0.00 0.00 0.00 0.00 60.65 60.82 3n04 s ILE 313 Cb -0.42 -0.82 0.06 0.00 0.01 0.00 0.00 42.46 41.29 3n04 s ILE 313 CO 0.55 0.01 1.64 -0.26 0.00 0.00 0.00 174.94 176.89 3n04 h PHE 314 N 8.28 1.07 -1.30 3.97 0.04 -1.46 0.75 116.94 128.29 3n04 h PHE 314 Ca -0.18 -0.20 0.22 0.00 2.80 0.00 0.00 57.97 60.60 3n04 h PHE 314 Cb 1.12 -0.27 -0.23 0.00 2.20 0.00 0.00 35.95 38.77 3n04 h PHE 314 CO 0.37 0.99 0.83 1.52 -0.60 0.00 0.00 178.31 181.42 3n04 s TYR 315 N -4.87 -0.13 0.43 -0.55 -0.85 -1.25 -3.79 117.35 106.34 3n04 s TYR 315 Ca -0.11 0.17 0.05 0.00 -0.52 0.00 0.00 57.07 56.66 3n04 s TYR 315 Cb 0.13 0.49 0.01 0.00 0.38 0.00 0.00 41.96 42.98 3n04 s TYR 315 CO 0.85 -0.15 0.60 -1.54 -1.52 0.00 0.00 175.55 173.79 3n04 s SER 316 N -1.51 5.68 0.37 -0.18 1.04 -1.26 -0.66 113.70 117.18 3n04 s SER 316 Ca 0.07 -0.19 0.05 0.00 0.48 0.00 0.00 55.95 56.36 3n04 s SER 316 Cb -0.01 -0.95 0.74 0.00 0.10 0.00 0.00 66.02 65.90 3n04 s SER 316 CO -0.05 -0.75 2.01 0.28 0.98 0.00 0.00 173.24 175.71 3n04 h SER 317 N 0.56 0.62 -0.19 7.02 0.02 -1.98 -0.93 113.55 118.67 3n04 h SER 317 Ca -0.43 -0.01 -0.06 0.00 -0.84 0.00 0.00 61.79 60.45 3n04 h SER 317 Cb 1.27 -0.15 -0.00 0.00 0.14 0.00 0.00 62.40 63.66 3n04 h SER 317 CO 0.50 0.44 -0.13 -0.33 -1.14 0.00 0.00 176.83 176.16 3n04 h GLU 318 N 0.73 0.43 -0.69 3.45 3.07 -1.95 -2.68 114.58 116.94 3n04 h GLU 318 Ca 0.23 -0.20 -0.04 0.00 -0.50 0.00 0.00 59.36 58.85 3n04 h GLU 318 Cb 0.03 -0.00 -0.03 0.00 -0.84 0.00 0.00 28.75 27.91 3n04 h GLU 318 CO -0.06 0.75 0.27 0.78 -1.40 0.00 0.00 179.01 179.35 3n04 h GLY 319 N 0.10 1.10 1.01 -3.84 0.00 -1.88 -2.38 103.07 97.19 3n04 h GLY 319 Ca 0.04 -0.60 -0.01 0.00 0.00 0.00 0.00 47.33 46.76 3n04 h GLY 319 CO 0.04 0.57 0.44 -2.00 0.00 0.00 0.00 176.54 175.59 3n04 h LEU 320 N 0.98 0.93 -0.26 3.11 6.46 -1.18 -0.87 115.31 124.47 3n04 h LEU 320 Ca 0.23 -0.08 -0.07 0.00 -0.12 0.00 0.00 57.88 57.84 3n04 h LEU 320 Cb 0.21 -0.24 -0.01 0.00 -0.73 0.00 0.00 40.66 39.90 3n04 h LEU 320 CO -0.02 0.74 -0.12 0.00 -0.62 0.00 0.00 178.44 178.41 3n04 h ALA 321 N 1.23 0.37 -0.66 1.25 0.00 -1.34 -1.35 119.26 118.76 3n04 h ALA 321 Ca 0.27 -0.31 0.06 0.00 0.00 0.00 0.00 54.91 54.93 3n04 h ALA 321 Cb -0.01 -0.09 -0.06 0.00 0.00 0.00 0.00 17.79 17.63 3n04 h ALA 321 CO -0.05 0.23 0.36 0.93 0.00 0.00 0.00 179.25 180.73 3n04 h GLU 322 N 0.28 0.64 -0.47 0.00 5.08 -1.35 -1.34 114.58 117.41 3n04 h GLU 322 Ca 0.06 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.38 3n04 h GLU 322 Cb 0.63 -0.14 -0.02 0.00 0.50 0.00 0.00 28.75 29.71 3n04 h GLU 322 CO 0.04 0.42 0.31 0.00 -1.00 0.00 0.00 179.01 178.78 3n04 h ALA 323 N 1.35 0.60 -0.18 3.43 0.00 -1.03 -1.42 119.26 122.02 3n04 h ALA 323 Ca 0.30 -0.04 -0.11 0.00 0.00 0.00 0.00 54.91 55.06 3n04 h ALA 323 Cb 0.21 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 3n04 h ALA 323 CO -0.19 0.05 -0.38 0.87 0.00 0.00 0.00 179.25 179.61 3n04 h LYS 324 N 0.64 0.39 -0.10 0.00 1.57 -1.05 -1.03 116.57 116.99 3n04 h LYS 324 Ca 0.17 -0.18 -0.01 0.00 -1.87 0.00 0.00 60.65 58.76 3n04 h LYS 324 Cb -0.07 -0.01 -0.00 0.00 0.08 0.00 0.00 32.23 32.24 3n04 h LYS 324 CO -0.04 0.71 0.01 1.49 -0.57 0.00 0.00 179.45 181.06 3n04 h GLU 325 N 0.33 0.17 -0.35 3.15 4.81 -1.09 -1.86 114.58 119.74 3n04 h GLU 325 Ca 0.03 -0.05 -0.02 0.00 -0.13 0.00 0.00 59.36 59.20 3n04 h GLU 325 Cb 0.81 -0.02 -0.02 0.00 0.63 0.00 0.00 28.75 30.16 3n04 h GLU 325 CO 0.07 0.39 0.15 0.35 -0.73 0.00 0.00 179.01 179.23 3n04 h PHE 326 N -0.07 0.48 -0.40 0.92 3.57 -1.10 -2.23 116.94 118.11 3n04 h PHE 326 Ca 0.03 -0.01 -0.11 0.00 3.53 0.00 0.00 57.97 61.41 3n04 h PHE 326 Cb 0.30 -0.15 -0.01 0.00 2.79 0.00 0.00 35.95 38.88 3n04 h PHE 326 CO 0.02 0.38 -0.20 0.00 -2.23 0.00 0.00 178.31 176.28 3n04 h ALA 327 N 1.68 0.56 -0.77 2.41 0.00 -1.00 -1.42 119.26 120.72 3n04 h ALA 327 Ca 0.12 -0.37 -0.01 0.00 0.00 0.00 0.00 54.91 54.65 3n04 h ALA 327 Cb 0.09 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 17.71 3n04 h ALA 327 CO -0.01 0.52 0.44 0.78 0.00 0.00 0.00 179.25 180.98 3n04 h GLY 328 N 0.65 1.14 0.63 0.00 0.00 -1.06 0.96 103.07 105.38 3n04 h GLY 328 Ca 0.09 -0.50 0.01 0.00 0.00 0.00 0.00 47.33 46.93 3n04 h GLY 328 CO 0.06 0.48 -0.28 0.83 0.00 0.00 0.00 176.54 177.62 3n04 h GLU 329 N 1.06 -0.55 -0.61 4.80 5.08 -1.22 -2.10 114.58 121.04 3n04 h GLU 329 Ca 0.27 0.04 0.11 0.00 -1.00 0.00 0.00 59.36 58.78 3n04 h GLU 329 Cb 0.00 0.12 -0.08 0.00 0.50 0.00 0.00 28.75 29.29 3n04 h GLU 329 CO -0.05 -0.37 0.17 0.35 -1.00 0.00 0.00 179.01 178.12 3n04 h PHE 330 N -0.57 0.29 -0.92 4.33 3.57 -1.08 0.27 116.94 122.83 3n04 h PHE 330 Ca 0.00 0.03 0.06 0.00 3.53 0.00 0.00 57.97 61.60 3n04 h PHE 330 Cb 0.54 -0.03 -0.06 0.00 2.79 0.00 0.00 35.95 39.19 3n04 h PHE 330 CO -0.20 0.02 0.60 0.00 -2.23 0.00 0.00 178.31 176.49 3n04 h ALA 331 N 1.46 1.49 0.00 2.41 0.00 -0.66 -2.93 119.26 121.04 3n04 h ALA 331 Ca 0.32 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.20 3n04 h ALA 331 Cb 0.45 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 17.96 3n04 h ALA 331 CO -0.37 0.37 -0.84 1.63 0.00 0.00 0.00 179.25 180.04 3n04 n LYS 332 N -4.49 0.14 -1.63 0.00 5.02 -0.80 -4.92 118.16 111.47 3n04 n LYS 332 Ca 0.14 0.00 -0.44 0.00 -2.02 0.00 0.00 58.31 55.99 3n04 n LYS 332 Cb 0.20 -1.55 -0.04 0.00 -0.02 0.00 0.00 35.03 33.62 3n04 n LYS 332 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 3n04 n ASP 333 N -1.73 3.68 -0.02 4.39 4.64 0.02 -4.86 116.55 122.68 3n04 n ASP 333 Ca 0.04 0.68 0.03 0.00 -1.38 0.00 0.00 54.79 54.15 3n04 n ASP 333 Cb 0.38 -1.50 -0.09 0.00 -1.04 0.00 0.00 41.12 38.88 3n04 n ASP 333 CO 0.00 0.00 0.00 0.35 -0.82 0.00 0.00 177.20 176.73 3n04 n THR 334 N 6.24 0.15 1.53 5.18 -2.24 -1.26 -4.58 114.28 119.30 3n04 n THR 334 Ca 0.25 -0.30 0.14 0.00 -2.27 0.00 0.00 64.05 61.86 3n04 n THR 334 Cb 0.39 0.04 0.55 0.00 -2.10 0.00 0.00 70.33 69.21 3n04 n THR 334 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3n04 n GLU 335 N -2.00 1.57 -3.04 -0.78 -0.58 -1.26 -4.96 120.64 109.60 3n04 n GLU 335 Ca -0.05 -0.84 -0.13 0.00 -0.42 0.00 0.00 57.16 55.72 3n04 n GLU 335 Cb 0.41 -1.46 0.04 0.00 -0.57 0.00 0.00 31.44 29.86 3n04 n GLU 335 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3n04 n GLY 336 N 1.13 0.16 0.05 0.62 0.00 -1.26 -4.96 105.19 100.94 3n04 n GLY 336 Ca 0.19 -0.20 0.12 0.00 0.00 0.00 0.00 46.02 46.13 3n04 n GLY 336 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3n04 n LYS 337 N -2.84 0.27 -4.04 1.61 5.02 -1.26 -4.74 118.16 112.18 3n04 n LYS 337 Ca -0.00 0.06 -0.32 0.00 -2.02 0.00 0.00 58.31 56.03 3n04 n LYS 337 Cb 0.53 -1.66 -0.15 0.00 -0.02 0.00 0.00 35.03 33.74 3n04 n LYS 337 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 3n04 s ILE 338 N -3.16 2.30 0.34 -0.18 1.01 -1.26 -5.11 121.20 115.13 3n04 s ILE 338 Ca 0.06 -1.72 -0.19 0.00 0.00 0.00 0.00 60.65 58.80 3n04 s ILE 338 Cb 0.14 -2.41 -0.10 0.00 0.01 0.00 0.00 42.46 40.10 3n04 s ILE 338 CO 0.73 -0.14 0.83 -1.00 0.00 0.00 0.00 174.94 175.37 3n04 s HIS 339 N 1.09 3.45 0.48 3.97 3.76 -1.26 -4.96 115.29 121.81 3n04 s HIS 339 Ca -0.05 1.44 0.24 0.00 -0.15 0.00 0.00 55.06 56.54 3n04 s HIS 339 Cb -0.20 -2.70 1.28 0.00 1.11 0.00 0.00 32.58 32.07 3n04 s HIS 339 CO -0.05 0.09 1.90 -1.35 -0.85 0.00 0.00 174.74 174.48 3n04 h PRO 340 N 2.48 0.19 0.00 8.40 0.11 -2.00 -0.91 132.00 140.27 3n04 h PRO 340 Ca -0.48 -0.01 -0.08 0.00 0.11 0.00 0.00 66.00 65.54 3n04 h PRO 340 Cb 1.18 -0.04 -0.01 0.00 0.11 0.00 0.00 31.00 32.24 3n04 h PRO 340 CO 0.64 0.12 -0.37 0.11 -0.21 0.00 0.00 178.00 178.29 3n04 h TRP 341 N 0.19 0.00 0.00 0.65 0.09 -2.05 0.78 115.95 115.62 3n04 h TRP 341 Ca 0.40 0.00 0.00 0.00 0.09 0.00 0.00 58.89 59.38 3n04 h TRP 341 Cb 1.29 0.00 0.00 0.00 0.08 0.00 0.00 29.16 30.53 3n04 h TRP 341 CO -0.00 0.37 0.00 0.00 0.09 0.00 0.00 178.44 178.90 3n04 n ALA 342 N -2.29 1.93 0.00 0.11 0.00 -0.35 -1.52 120.51 118.39 3n04 n ALA 342 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 3n04 n ALA 342 Cb 0.51 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.96 3n04 n ALA 342 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 3n04 n GLN 344 N 0.48 0.00 -0.29 0.00 6.02 0.27 -1.79 117.38 122.06 3n04 n GLN 344 Ca 0.00 0.00 -0.05 0.00 -0.01 0.00 0.00 57.00 56.94 3n04 n GLN 344 Cb 0.20 0.00 0.08 0.00 1.02 0.00 0.00 30.24 31.54 3n04 n GLN 344 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3n04 h ALA 345 N 0.00 1.07 0.00 -1.58 0.00 -1.54 -2.46 119.26 114.76 3n04 h ALA 345 Ca 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.72 3n04 h ALA 345 Cb 0.00 -0.32 0.00 0.00 0.00 0.00 0.00 17.79 17.47 3n04 h ALA 345 CO 0.00 0.67 0.00 1.17 0.00 0.00 0.00 179.25 181.09 3n04 n LYS 346 N -4.28 0.25 0.00 0.00 3.00 -0.74 -1.31 118.16 115.09 3n04 n LYS 346 Ca 0.07 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.38 3n04 n LYS 346 Cb 0.18 -1.24 0.00 0.00 0.00 0.00 0.00 35.03 33.96 3n04 n LYS 346 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.40 179.03 3n04 n LYS 348 N 0.61 0.00 0.03 1.64 5.02 -0.93 -3.04 118.16 121.50 3n04 n LYS 348 Ca 0.00 0.00 0.19 0.00 -2.02 0.00 0.00 58.31 56.48 3n04 n LYS 348 Cb 0.09 0.00 0.69 0.00 -0.02 0.00 0.00 35.03 35.80 3n04 n LYS 348 CO 0.00 0.00 0.00 0.22 -0.52 0.00 0.00 177.40 177.10 3n04 h ASP 349 N 0.00 0.00 0.75 4.39 1.82 -1.48 -2.30 116.42 119.60 3n04 h ASP 349 Ca 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.64 3n04 h ASP 349 Cb 0.00 0.00 0.00 0.00 0.68 0.00 0.00 39.33 40.01 3n04 h ASP 349 CO 0.00 0.00 0.00 2.30 -1.61 0.00 0.00 179.24 179.93 3n04 n ILE 350 N -4.35 0.28 -3.12 2.25 -5.35 -1.17 -4.26 119.36 103.65 3n04 n ILE 350 Ca 0.09 0.07 -0.40 0.00 -0.27 0.00 0.00 62.75 62.24 3n04 n ILE 350 Cb 0.57 -0.65 -0.05 0.00 -1.74 0.00 0.00 39.64 37.76 3n04 n ILE 350 CO 0.00 0.00 0.00 -0.69 -1.76 0.00 0.00 176.55 174.10 3n04 s VAL 351 N -2.89 5.04 -1.58 7.28 1.01 -0.87 -4.00 120.40 124.40 3n04 s VAL 351 Ca 0.15 1.23 -0.07 0.00 0.00 0.00 0.00 61.98 63.30 3n04 s VAL 351 Cb 0.16 -3.96 0.06 0.00 0.00 0.00 0.00 36.38 32.65 3n04 s VAL 351 CO 0.43 0.17 0.35 0.59 0.00 0.00 0.00 175.10 176.64 3n04 n ASN 352 N 4.58 -0.58 -4.72 3.32 3.02 0.26 -4.86 115.26 116.27 3n04 n ASN 352 Ca -0.02 -1.14 -0.42 0.00 -0.03 0.00 0.00 54.58 52.97 3n04 n ASN 352 Cb 0.50 -2.25 -0.03 0.00 -0.61 0.00 0.00 39.78 37.39 3n04 n ASN 352 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 3n04 s SER 353 N -4.03 6.83 0.43 6.41 0.15 -1.26 -4.91 113.70 117.32 3n04 s SER 353 Ca 0.25 2.35 0.13 0.00 0.70 0.00 0.00 55.95 59.38 3n04 s SER 353 Cb -0.14 -2.59 1.02 0.00 -1.71 0.00 0.00 66.02 62.60 3n04 s SER 353 CO 0.96 -0.63 1.99 -0.65 1.20 0.00 0.00 173.24 176.10 3n04 h PRO 354 N 6.50 0.40 -0.40 5.44 0.11 -1.89 -0.84 132.00 141.32 3n04 h PRO 354 Ca -0.43 -0.02 0.03 0.00 0.11 0.00 0.00 66.00 65.69 3n04 h PRO 354 Cb 1.21 -0.09 -0.03 0.00 0.11 0.00 0.00 31.00 32.20 3n04 h PRO 354 CO 0.85 0.26 0.21 0.93 -0.21 0.00 0.00 178.00 180.04 3n04 h GLU 355 N 0.41 0.41 -0.80 1.05 4.39 -1.94 -2.85 114.58 115.24 3n04 h GLU 355 Ca 0.27 -0.02 0.05 0.00 0.34 0.00 0.00 59.36 59.99 3n04 h GLU 355 Cb 0.50 -0.09 -0.05 0.00 -0.10 0.00 0.00 28.75 29.01 3n04 h GLU 355 CO -0.07 0.27 0.53 -0.44 -1.16 0.00 0.00 179.01 178.13 3n04 h ASP 356 N 0.42 0.81 0.66 1.42 3.32 -1.54 -1.93 116.42 119.57 3n04 h ASP 356 Ca 0.17 -0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.22 3n04 h ASP 356 Cb 0.07 -0.18 0.00 0.00 0.22 0.00 0.00 39.33 39.44 3n04 h ASP 356 CO -0.11 0.54 0.00 1.88 -1.72 0.00 0.00 179.24 179.83 3n04 h TYR 357 N 0.93 0.00 -0.01 4.55 0.05 -1.24 -2.08 116.97 119.17 3n04 h TYR 357 Ca 0.33 0.00 0.00 0.00 0.05 0.00 0.00 58.73 59.11 3n04 h TYR 357 Cb 0.14 0.00 0.00 0.00 1.01 0.00 0.00 36.73 37.88 3n04 h TYR 357 CO -0.00 0.00 -0.16 1.63 -1.05 0.00 0.00 178.16 178.58 3n04 n LYS 358 N -2.41 1.36 0.06 4.88 5.02 -0.74 -1.29 118.16 125.04 3n04 n LYS 358 Ca 0.01 -0.90 0.12 0.00 -2.02 0.00 0.00 58.31 55.52 3n04 n LYS 358 Cb 0.21 -1.48 0.05 0.00 -0.02 0.00 0.00 35.03 33.79 3n04 n LYS 358 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 3n04 n ARG 359 N -0.03 0.40 -4.32 1.97 1.74 -0.78 -4.86 116.66 110.78 3n04 n ARG 359 Ca 0.15 0.05 -0.17 0.00 -0.77 0.00 0.00 57.85 57.11 3n04 n ARG 359 Cb 0.40 -1.69 -0.10 0.00 -1.02 0.00 0.00 32.46 30.05 3n04 n ARG 359 CO 0.00 0.00 0.00 -0.59 -1.52 0.00 0.00 177.63 175.52 3n04 s PHE 360 N -3.25 1.53 0.06 -1.55 -0.12 -1.26 -4.15 117.98 109.25 3n04 s PHE 360 Ca 0.03 -0.75 0.06 0.00 -0.05 0.00 0.00 56.93 56.21 3n04 s PHE 360 Cb 0.13 -0.80 -0.03 0.00 -0.63 0.00 0.00 43.02 41.69 3n04 s PHE 360 CO 0.78 0.14 -0.16 0.71 -0.05 0.00 0.00 175.22 176.64 3n04 s TYR 361 N -3.23 1.34 0.05 3.49 2.02 0.39 -0.30 117.35 121.12 3n04 s TYR 361 Ca 0.23 -0.41 -0.08 0.00 -0.37 0.00 0.00 57.07 56.43 3n04 s TYR 361 Cb 0.03 -0.77 -0.05 0.00 -0.40 0.00 0.00 41.96 40.76 3n04 s TYR 361 CO 0.06 0.07 0.34 -1.01 -1.57 0.00 0.00 175.55 173.44 3n04 s HIS 362 N -1.08 3.57 -0.51 2.71 3.76 0.82 -3.07 115.29 121.49 3n04 s HIS 362 Ca 0.01 0.68 -0.12 0.00 -0.15 0.00 0.00 55.06 55.48 3n04 s HIS 362 Cb -0.09 -2.08 0.13 0.00 1.11 0.00 0.00 32.58 31.65 3n04 s HIS 362 CO 0.02 0.55 0.43 1.21 -0.85 0.00 0.00 174.74 176.10 3n04 s ASN 363 N -1.78 5.94 -0.61 1.40 2.47 -1.26 -0.62 114.94 120.47 3n04 s ASN 363 Ca 0.31 -1.90 -0.15 0.00 0.42 0.00 0.00 52.86 51.54 3n04 s ASN 363 Cb -0.14 -2.10 0.15 0.00 -1.45 0.00 0.00 41.25 37.72 3n04 s ASN 363 CO 0.18 -0.76 0.56 -0.69 -3.72 0.00 0.00 177.10 172.67 3n04 s VAL 364 N 1.40 5.29 -1.44 -5.21 1.01 0.18 -3.93 120.40 117.70 3n04 s VAL 364 Ca 0.05 -1.75 -0.00 0.00 0.00 0.00 0.00 61.98 60.28 3n04 s VAL 364 Cb -0.27 -4.36 0.00 0.00 0.00 0.00 0.00 36.38 31.75 3n04 s VAL 364 CO 0.01 -0.91 0.31 0.59 0.00 0.00 0.00 175.10 175.10 3n04 n ASN 365 N 4.92 0.02 0.00 3.32 3.02 -1.26 -1.94 115.26 123.34 3n04 n ASN 365 Ca -0.07 -1.07 0.00 0.00 -0.03 0.00 0.00 54.58 53.41 3n04 n ASN 365 Cb 0.42 -2.69 0.00 0.00 -0.61 0.00 0.00 39.78 36.90 3n04 n ASN 365 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3n04 n GLY 366 N -2.13 3.20 3.65 7.41 0.00 -1.26 -5.03 105.19 111.02 3n04 n GLY 366 Ca -0.32 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.30 3n04 n GLY 366 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3n04 s LYS 367 N -0.49 4.17 -0.03 1.61 1.02 -0.82 -5.05 119.74 120.15 3n04 s LYS 367 Ca 0.00 0.55 -0.25 0.00 0.02 0.00 0.00 55.97 56.29 3n04 s LYS 367 Cb 0.00 -3.60 -0.04 0.00 -0.52 0.00 0.00 37.83 33.67 3n04 s LYS 367 CO 0.00 -0.28 0.77 0.15 -0.92 0.00 0.00 175.35 175.07 3n04 s LYS 368 N 2.05 4.47 -0.05 1.68 -0.14 -1.26 -0.65 119.74 125.86 3n04 s LYS 368 Ca 0.27 1.03 0.03 0.00 -1.36 0.00 0.00 55.97 55.93 3n04 s LYS 368 Cb -0.16 -3.43 0.01 0.00 -1.68 0.00 0.00 37.83 32.57 3n04 s LYS 368 CO 0.10 0.08 -0.12 -1.50 -0.76 0.00 0.00 175.35 173.14 3n04 s ILE 369 N 0.68 1.09 0.20 2.17 2.07 0.21 -4.96 121.20 122.66 3n04 s ILE 369 Ca 0.41 -0.50 -0.30 0.00 -1.41 0.00 0.00 60.65 58.85 3n04 s ILE 369 Cb -0.19 -0.97 -0.08 0.00 0.13 0.00 0.00 42.46 41.34 3n04 s ILE 369 CO 0.21 0.33 1.20 -0.60 -1.91 0.00 0.00 174.94 174.17 3n04 s ARG 370 N 0.36 4.49 0.24 3.50 3.52 -1.26 -0.13 118.95 129.68 3n04 s ARG 370 Ca -0.08 1.89 -0.06 0.00 -0.13 0.00 0.00 55.73 57.35 3n04 s ARG 370 Cb -0.12 -3.23 0.33 0.00 -1.56 0.00 0.00 34.95 30.37 3n04 s ARG 370 CO 0.02 -0.07 1.84 1.25 -0.81 0.00 0.00 175.30 177.53 3n04 h HIS 371 N 5.06 0.95 -0.85 5.12 -0.00 -0.75 -1.46 115.15 123.22 3n04 h HIS 371 Ca -0.45 0.03 0.19 0.00 -0.00 0.00 0.00 60.37 60.14 3n04 h HIS 371 Cb 1.21 -0.30 -0.06 0.00 -0.00 0.00 0.00 27.41 28.26 3n04 h HIS 371 CO 0.62 0.47 0.57 0.38 -0.00 0.00 0.00 177.93 179.97 3n04 h ASP 372 N 0.93 0.37 0.46 3.26 2.03 -1.45 0.14 116.42 122.16 3n04 h ASP 372 Ca 0.37 0.03 -0.01 0.00 -0.73 0.00 0.00 57.03 56.69 3n04 h ASP 372 Cb 0.19 -0.04 -0.00 0.00 -0.83 0.00 0.00 39.33 38.65 3n04 h ASP 372 CO -0.18 0.16 -0.04 0.11 -1.03 0.00 0.00 179.24 178.26 3n04 h LYS 373 N 0.37 0.00 0.00 4.15 1.57 -1.58 -3.10 116.57 117.98 3n04 h LYS 373 Ca 0.43 0.00 -0.04 0.00 -1.87 0.00 0.00 60.65 59.17 3n04 h LYS 373 Cb 1.11 0.00 -0.08 0.00 0.08 0.00 0.00 32.23 33.33 3n04 h LYS 373 CO -0.15 0.04 -0.51 1.33 -0.57 0.00 0.00 179.45 179.59 3n04 n VAL 374 N -3.25 0.60 -0.33 0.50 0.24 0.28 -4.03 118.33 112.34 3n04 n VAL 374 Ca -0.01 -0.99 0.12 0.00 -2.04 0.00 0.00 64.34 61.41 3n04 n VAL 374 Cb 0.20 0.38 0.30 0.00 -1.47 0.00 0.00 33.84 33.25 3n04 n VAL 374 CO 0.00 0.00 0.00 -0.74 -2.14 0.00 0.00 176.83 173.95 3n04 h HIS 375 N 0.31 0.90 0.00 6.34 6.17 -0.86 -1.40 115.15 126.62 3n04 h HIS 375 Ca -0.05 0.04 0.00 0.00 0.71 0.00 0.00 60.37 61.07 3n04 h HIS 375 Cb 1.39 -0.26 0.00 0.00 2.52 0.00 0.00 27.41 31.06 3n04 h HIS 375 CO 0.16 0.15 0.00 0.09 0.71 0.00 0.00 177.93 179.04 3n04 n ASN 376 N -4.86 0.00 -0.30 3.26 3.02 -0.44 -2.97 115.26 112.96 3n04 n ASN 376 Ca 0.22 -0.67 0.12 0.00 -0.03 0.00 0.00 54.58 54.21 3n04 n ASN 376 Cb 0.57 -0.08 0.14 0.00 -0.61 0.00 0.00 39.78 39.80 3n04 n ASN 376 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 3n04 n LEU 377 N -1.08 1.39 0.32 3.41 4.77 -0.53 -4.31 117.00 120.97 3n04 n LEU 377 Ca 0.19 -0.47 -0.16 0.00 -0.03 0.00 0.00 56.01 55.54 3n04 n LEU 377 Cb 0.13 -0.07 -0.08 0.00 -2.33 0.00 0.00 43.42 41.07 3n04 n LEU 377 CO 0.18 0.27 0.56 0.15 -1.33 0.00 0.00 177.39 177.22 3n04 h PHE 378 N 1.46 -0.74 -0.52 -1.77 3.57 -1.68 -1.43 116.94 115.82 3n04 h PHE 378 Ca 0.00 -0.02 -0.00 0.00 3.53 0.00 0.00 57.97 61.48 3n04 h PHE 378 Cb 0.61 0.24 -0.03 0.00 2.79 0.00 0.00 35.95 39.57 3n04 h PHE 378 CO 0.00 -0.41 0.33 0.78 -2.23 0.00 0.00 178.31 176.77 3n04 h GLY 379 N -0.96 0.75 -0.06 2.40 0.00 -1.70 -2.75 103.07 100.77 3n04 h GLY 379 Ca -0.08 -0.30 0.07 0.00 0.00 0.00 0.00 47.33 47.02 3n04 h GLY 379 CO 0.13 0.29 -0.31 -1.82 0.00 0.00 0.00 176.54 174.84 3n04 h TYR 380 N 0.70 -0.85 0.00 5.60 3.20 -1.71 -0.98 116.97 122.94 3n04 h TYR 380 Ca 0.19 0.05 0.00 0.00 3.14 0.00 0.00 58.73 62.11 3n04 h TYR 380 Cb -0.03 0.42 0.00 0.00 1.54 0.00 0.00 36.73 38.66 3n04 h TYR 380 CO -0.03 -0.37 0.00 0.09 -1.64 0.00 0.00 178.16 176.21 3n04 n ASN 381 N -5.41 2.29 0.00 -2.11 3.02 -0.54 -0.66 115.26 111.85 3n04 n ASN 381 Ca 0.00 -1.48 0.00 0.00 -0.03 0.00 0.00 54.58 53.07 3n04 n ASN 381 Cb 0.33 -0.46 0.00 0.00 -0.61 0.00 0.00 39.78 39.04 3n04 n ASN 381 CO 0.00 0.00 0.00 0.41 -2.62 0.00 0.00 177.26 175.05 3n04 n THR 383 N 1.44 0.00 -0.30 3.41 -1.04 -0.37 -0.82 114.28 116.59 3n04 n THR 383 Ca 0.00 0.00 -0.04 0.00 -2.04 0.00 0.00 64.05 61.97 3n04 n THR 383 Cb 0.25 0.00 0.08 0.00 -1.82 0.00 0.00 70.33 68.83 3n04 n THR 383 CO 0.00 0.00 0.00 -0.09 -0.64 0.00 0.00 175.07 174.34 3n04 h ARG 384 N 0.00 1.10 -0.45 -2.82 2.43 -1.14 -0.40 114.38 113.10 3n04 h ARG 384 Ca 0.00 -0.08 0.04 0.00 -0.81 0.00 0.00 59.98 59.13 3n04 h ARG 384 Cb 0.00 -0.24 -0.04 0.00 -0.42 0.00 0.00 29.97 29.27 3n04 h ARG 384 CO 0.00 0.75 0.22 0.00 -1.51 0.00 0.00 179.97 179.43 3n04 h ALA 385 N 1.29 0.56 -0.10 2.80 0.00 -1.24 -0.50 119.26 122.07 3n04 h ALA 385 Ca 0.30 0.02 -0.02 0.00 0.00 0.00 0.00 54.91 55.21 3n04 h ALA 385 Cb -0.10 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 17.63 3n04 h ALA 385 CO -0.06 -0.13 -0.02 0.00 0.00 0.00 0.00 179.25 179.04 3n04 h ALA 386 N 1.24 0.13 -0.70 0.00 0.00 -1.79 -1.62 119.26 116.52 3n04 h ALA 386 Ca 0.19 -0.21 0.12 0.00 0.00 0.00 0.00 54.91 55.02 3n04 h ALA 386 Cb 0.10 -0.03 -0.09 0.00 0.00 0.00 0.00 17.79 17.77 3n04 h ALA 386 CO -0.14 -0.15 0.28 0.78 0.00 0.00 0.00 179.25 180.02 3n04 h GLY 387 N -0.13 1.04 1.48 0.00 0.00 -0.84 -0.66 103.07 103.95 3n04 h GLY 387 Ca 0.03 -0.14 -0.17 0.00 0.00 0.00 0.00 47.33 47.04 3n04 h GLY 387 CO 0.01 -0.06 -0.60 0.83 0.00 0.00 0.00 176.54 176.73 3n04 h GLU 388 N 0.45 0.54 -0.35 4.80 5.08 -1.04 -2.89 114.58 121.17 3n04 h GLU 388 Ca 0.37 -0.36 -0.01 0.00 -1.00 0.00 0.00 59.36 58.37 3n04 h GLU 388 Cb 0.52 0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.80 3n04 h GLU 388 CO -0.36 0.98 0.20 0.00 -1.00 0.00 0.00 179.01 178.82 3n04 h ALA 389 N 0.94 0.44 -0.84 3.43 0.00 -0.76 -2.78 119.26 119.68 3n04 h ALA 389 Ca -0.00 -0.07 0.14 0.00 0.00 0.00 0.00 54.91 54.98 3n04 h ALA 389 Cb 1.15 -0.14 -0.09 0.00 0.00 0.00 0.00 17.79 18.71 3n04 h ALA 389 CO 0.11 -0.04 0.43 0.74 0.00 0.00 0.00 179.25 180.49 3n04 h PHE 390 N 0.44 0.76 -0.61 0.00 0.04 -1.01 0.11 116.94 116.67 3n04 h PHE 390 Ca 0.12 0.03 -0.02 0.00 2.80 0.00 0.00 57.97 60.91 3n04 h PHE 390 Cb 0.04 -0.21 -0.03 0.00 2.20 0.00 0.00 35.95 37.95 3n04 h PHE 390 CO -0.03 0.19 0.30 0.93 -0.60 0.00 0.00 178.31 179.09 3n04 h GLU 391 N 0.63 0.85 -0.06 1.51 5.08 -1.33 0.08 114.58 121.34 3n04 h GLU 391 Ca 0.46 -0.10 -0.21 0.00 -1.00 0.00 0.00 59.36 58.50 3n04 h GLU 391 Cb 0.63 -0.16 0.00 0.00 0.50 0.00 0.00 28.75 29.72 3n04 h GLU 391 CO -0.36 0.66 -0.84 0.00 -1.00 0.00 0.00 179.01 177.47 3n04 h ARG 392 N 0.86 0.51 -0.05 2.33 3.08 -0.99 -3.12 114.38 116.99 3n04 h ARG 392 Ca 0.21 -0.47 -0.14 0.00 0.07 0.00 0.00 59.98 59.65 3n04 h ARG 392 Cb 0.08 0.12 0.01 0.00 0.08 0.00 0.00 29.97 30.25 3n04 h ARG 392 CO -0.03 1.11 -0.53 0.82 -1.07 0.00 0.00 179.97 180.26 3n04 h ILE 393 N 0.32 1.40 -1.14 2.04 2.04 -0.51 -3.43 117.51 118.24 3n04 h ILE 393 Ca -0.06 -1.94 -0.14 0.00 1.00 0.00 0.00 64.86 63.72 3n04 h ILE 393 Cb 1.46 2.41 -0.20 0.00 -0.74 0.00 0.00 36.82 39.75 3n04 h ILE 393 CO 0.15 0.57 -0.50 -0.62 0.00 0.00 0.00 178.15 177.75 3n04 s ASP 394 N -6.68 -1.14 0.58 1.72 -1.08 -0.01 -5.04 116.67 105.01 3n04 s ASP 394 Ca -0.13 -1.25 0.35 0.00 -0.52 0.00 0.00 52.55 51.00 3n04 s ASP 394 Cb 0.04 1.73 1.79 0.00 -1.46 0.00 0.00 42.92 45.02 3n04 s ASP 394 CO 0.82 -0.14 2.17 -0.65 0.52 0.00 0.00 175.17 177.89 3n04 h PRO 395 N 6.31 0.00 0.00 4.34 0.11 -1.68 -2.32 132.00 138.76 3n04 h PRO 395 Ca 0.06 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.17 3n04 h PRO 395 Cb 1.14 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.25 3n04 h PRO 395 CO 0.09 0.04 -0.04 0.93 -0.21 0.00 0.00 178.00 178.81 3n04 h GLU 396 N 0.00 0.00 -5.54 1.05 5.08 -1.91 -3.47 114.58 109.79 3n04 h GLU 396 Ca -0.00 0.00 -0.64 0.00 -1.00 0.00 0.00 59.36 57.72 3n04 h GLU 396 Cb 0.25 0.00 -0.14 0.00 0.50 0.00 0.00 28.75 29.36 3n04 h GLU 396 CO 0.01 0.00 -0.56 0.21 -1.00 0.00 0.00 179.01 177.66 3n04 s LYS 397 N -3.18 3.60 0.27 2.33 2.20 -0.87 -3.02 119.74 121.06 3n04 s LYS 397 Ca 0.08 -0.32 -0.29 0.00 -0.36 0.00 0.00 55.97 55.08 3n04 s LYS 397 Cb 0.08 -3.09 -0.09 0.00 -1.51 0.00 0.00 37.83 33.21 3n04 s LYS 397 CO 0.65 0.49 0.95 1.03 -0.36 0.00 0.00 175.35 178.11 3n04 s ARG 398 N -0.25 4.77 0.07 4.03 0.52 -0.68 -4.95 118.95 122.45 3n04 s ARG 398 Ca 0.08 1.47 0.09 0.00 -0.52 0.00 0.00 55.73 56.85 3n04 s ARG 398 Cb -0.12 -3.14 -0.03 0.00 0.52 0.00 0.00 34.95 32.18 3n04 s ARG 398 CO 0.01 0.43 -0.25 -0.06 0.02 0.00 0.00 175.30 175.46 3n04 s PHE 399 N -1.29 2.14 0.78 -0.53 0.08 -1.26 -4.69 117.98 113.20 3n04 s PHE 399 Ca 0.44 -0.40 -0.11 0.00 0.12 0.00 0.00 56.93 56.98 3n04 s PHE 399 Cb -0.25 -1.24 0.06 0.00 -0.57 0.00 0.00 43.02 41.02 3n04 s PHE 399 CO 0.31 0.17 1.09 -1.17 -0.10 0.00 0.00 175.22 175.51 3n04 s LEU 400 N -1.45 2.70 0.00 -0.37 2.96 -0.84 -4.49 118.68 117.19 3n04 s LEU 400 Ca 0.11 1.36 0.00 0.00 -0.22 0.00 0.00 54.13 55.38 3n04 s LEU 400 Cb -0.10 -4.03 0.00 0.00 0.50 0.00 0.00 46.19 42.57 3n04 s LEU 400 CO 0.03 -1.86 0.00 2.22 -1.32 0.00 0.00 176.35 175.41 3n04 n PHE 402 N -3.37 0.00 -4.07 5.38 -1.74 -1.13 -0.59 117.46 111.94 3n04 n PHE 402 Ca 0.07 0.00 -0.10 0.00 -0.56 0.00 0.00 57.45 56.86 3n04 n PHE 402 Cb 0.56 0.00 -0.11 0.00 1.52 0.00 0.00 39.48 41.45 3n04 n PHE 402 CO 0.00 0.00 0.00 0.45 -0.56 0.00 0.00 176.76 176.65 3n04 s SER 403 N 0.00 0.68 -0.05 5.98 0.15 -0.65 -1.07 113.70 118.73 3n04 s SER 403 Ca 0.00 -0.74 -0.07 0.00 0.70 0.00 0.00 55.95 55.84 3n04 s SER 403 Cb 0.00 0.10 -0.04 0.00 -1.71 0.00 0.00 66.02 64.37 3n04 s SER 403 CO 0.00 -0.37 0.33 -0.09 1.20 0.00 0.00 173.24 174.31 3n04 h ARG 404 N 3.90 -0.25 -6.59 5.44 2.43 -1.71 -1.92 114.38 115.67 3n04 h ARG 404 Ca -0.34 0.02 -0.51 0.00 -0.81 0.00 0.00 59.98 58.33 3n04 h ARG 404 Cb 1.18 0.06 -0.03 0.00 -0.42 0.00 0.00 29.97 30.76 3n04 h ARG 404 CO 0.52 -0.17 0.08 0.45 -1.51 0.00 0.00 179.97 179.33 3n04 s SER 405 N -4.84 6.92 0.24 -3.80 0.15 -1.26 -4.61 113.70 106.50 3n04 s SER 405 Ca -0.04 1.32 -0.20 0.00 0.70 0.00 0.00 55.95 57.73 3n04 s SER 405 Cb 0.00 -2.38 0.03 0.00 -1.71 0.00 0.00 66.02 61.96 3n04 s SER 405 CO 0.11 -0.05 0.63 -0.94 1.20 0.00 0.00 173.24 174.20 3n04 s SER 406 N -1.90 -0.29 0.03 5.45 1.04 -1.20 -4.15 113.70 112.68 3n04 s SER 406 Ca 0.46 -0.52 -0.11 0.00 0.48 0.00 0.00 55.95 56.27 3n04 s SER 406 Cb -0.14 0.66 0.01 0.00 0.10 0.00 0.00 66.02 66.65 3n04 s SER 406 CO 0.20 -1.20 0.22 -0.47 0.98 0.00 0.00 173.24 172.97 3n04 s TYR 407 N -3.89 -0.00 0.24 5.02 5.04 -1.26 -1.59 117.35 120.91 3n04 s TYR 407 Ca 0.10 -0.17 -0.31 0.00 -2.44 0.00 0.00 57.07 54.25 3n04 s TYR 407 Cb -0.03 0.01 -0.12 0.00 0.35 0.00 0.00 41.96 42.16 3n04 s TYR 407 CO 0.02 -0.43 1.58 -0.89 -1.34 0.00 0.00 175.55 174.49 3n04 n ILE 408 N 0.77 0.63 0.00 3.14 5.41 -1.25 -4.37 119.36 123.69 3n04 n ILE 408 Ca -0.19 -0.16 0.00 0.00 1.00 0.00 0.00 62.75 63.40 3n04 n ILE 408 Cb 0.58 -1.81 0.00 0.00 -0.71 0.00 0.00 39.64 37.71 3n04 n ILE 408 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 3n04 n GLY 409 N 2.75 1.77 4.11 7.39 0.00 -1.26 -4.38 105.19 115.57 3n04 n GLY 409 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.14 3n04 n GLY 409 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 3n04 n HIS 411 N -0.17 0.00 0.58 1.61 -0.00 -1.26 -4.43 115.22 111.55 3n04 n HIS 411 Ca 0.00 0.00 0.13 0.00 -0.00 0.00 0.00 57.72 57.85 3n04 n HIS 411 Cb 0.00 -0.55 0.33 0.00 -0.00 0.00 0.00 29.99 29.77 3n04 n HIS 411 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 3n04 h ARG 412 N 0.00 0.00 0.00 -1.40 3.08 -1.89 0.23 114.38 114.40 3n04 h ARG 412 Ca 0.00 0.00 -0.02 0.00 0.07 0.00 0.00 59.98 60.03 3n04 h ARG 412 Cb 0.00 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.05 3n04 h ARG 412 CO 0.00 0.00 -1.16 0.66 -1.07 0.00 0.00 179.97 178.40 3n04 n TYR 413 N -2.30 0.00 -3.73 3.04 4.01 -1.26 -3.97 117.16 112.95 3n04 n TYR 413 Ca 0.05 0.00 -0.03 0.00 -0.16 0.00 0.00 57.90 57.75 3n04 n TYR 413 Cb 0.44 -0.09 -0.01 0.00 -0.31 0.00 0.00 39.34 39.37 3n04 n TYR 413 CO 0.00 0.00 0.00 0.20 -0.46 0.00 0.00 176.86 176.60 3n04 s GLY 414 N -2.69 -0.26 0.15 2.72 0.00 -1.26 -4.74 107.32 101.23 3n04 s GLY 414 Ca -0.01 0.23 -0.01 0.00 0.00 0.00 0.00 44.72 44.93 3n04 s GLY 414 CO 0.12 0.04 0.21 0.61 0.00 0.00 0.00 173.10 174.07 3n04 n GLY 415 N -0.46 0.40 3.09 0.20 0.00 -1.26 -4.46 105.19 102.71 3n04 n GLY 415 Ca -0.06 -1.92 -0.26 0.00 0.00 0.00 0.00 46.02 43.78 3n04 n GLY 415 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3n04 s ILE 416 N -0.62 1.35 0.56 -0.61 -1.09 -0.34 -1.64 121.20 118.81 3n04 s ILE 416 Ca 0.13 -0.63 -0.06 0.00 -2.23 0.00 0.00 60.65 57.86 3n04 s ILE 416 Cb -0.01 -1.19 0.12 0.00 -1.58 0.00 0.00 42.46 39.80 3n04 s ILE 416 CO 0.09 0.40 0.76 1.87 -1.23 0.00 0.00 174.94 176.83 3n04 n TRP 417 N 3.54 -3.61 -3.84 3.97 -0.00 -0.72 -2.95 117.44 113.84 3n04 n TRP 417 Ca -0.21 -0.92 -0.24 0.00 -0.00 0.00 0.00 57.50 56.14 3n04 n TRP 417 Cb 0.52 -0.58 -0.04 0.00 -0.00 0.00 0.00 31.31 31.22 3n04 n TRP 417 CO 0.00 0.00 0.00 0.20 -0.00 0.00 0.00 177.69 177.89 3n04 s GLY 419 N -4.55 2.28 -0.40 5.87 0.00 -1.26 -4.69 107.32 104.57 3n04 s GLY 419 Ca 0.46 -1.76 -0.15 0.00 0.00 0.00 0.00 44.72 43.27 3n04 s GLY 419 CO 0.31 -1.84 0.32 -0.35 0.00 0.00 0.00 173.10 171.54 3n04 s ASP 420 N -4.11 6.12 0.00 1.64 -1.08 -1.26 -1.08 116.67 116.90 3n04 s ASP 420 Ca 0.41 -0.73 0.17 0.00 -0.52 0.00 0.00 52.55 51.88 3n04 s ASP 420 Cb -0.01 -2.17 0.84 0.00 -1.46 0.00 0.00 42.92 40.12 3n04 s ASP 420 CO 0.24 -0.43 1.52 0.59 0.52 0.00 0.00 175.17 177.61 3n04 n ASN 421 N 5.25 0.00 0.00 -0.34 5.03 0.14 -4.93 115.26 120.41 3n04 n ASN 421 Ca -0.10 0.14 0.00 0.00 0.87 0.00 0.00 54.58 55.48 3n04 n ASN 421 Cb 0.48 -0.33 0.00 0.00 -1.02 0.00 0.00 39.78 38.91 3n04 n ASN 421 CO 0.00 0.00 0.00 0.29 -1.83 0.00 0.00 177.26 175.72 3n04 n LYS 422 N -1.33 0.00 -1.59 3.52 5.02 -1.26 -0.62 118.16 121.90 3n04 n LYS 422 Ca 0.07 0.00 -0.04 0.00 -2.02 0.00 0.00 58.31 56.33 3n04 n LYS 422 Cb 0.15 0.00 0.09 0.00 -0.02 0.00 0.00 35.03 35.25 3n04 n LYS 422 CO 0.00 0.00 0.00 0.43 -0.52 0.00 0.00 177.40 177.31 3n04 n SER 423 N 6.23 2.42 -4.56 4.39 7.64 -1.26 -1.06 113.62 127.42 3n04 n SER 423 Ca 0.00 -3.11 -0.41 0.00 1.01 0.00 0.00 58.87 56.36 3n04 n SER 423 Cb 0.00 -0.42 -0.08 0.00 -1.01 0.00 0.00 64.21 62.70 3n04 n SER 423 CO 0.00 0.00 0.00 0.26 -3.01 0.00 0.00 175.04 172.29 3n04 s TRP 424 N -2.74 3.20 0.35 1.43 0.51 0.20 -4.81 118.94 117.08 3n04 s TRP 424 Ca 0.39 0.16 0.09 0.00 -2.12 0.00 0.00 56.10 54.62 3n04 s TRP 424 Cb 0.38 -2.82 0.82 0.00 -0.81 0.00 0.00 33.47 31.03 3n04 s TRP 424 CO -0.06 -0.48 1.85 -1.49 -0.51 0.00 0.00 176.95 176.26 3n04 h TRP 425 N 8.42 0.86 -0.05 -1.98 4.06 -1.94 -2.30 115.95 123.02 3n04 h TRP 425 Ca -0.29 0.03 0.01 0.00 2.06 0.00 0.00 58.89 60.70 3n04 h TRP 425 Cb 1.13 -0.27 -0.00 0.00 -1.00 0.00 0.00 29.16 29.02 3n04 h TRP 425 CO 0.72 0.28 0.06 0.66 -3.56 0.00 0.00 178.44 176.60 3n04 h SER 426 N 0.69 0.00 1.34 -3.49 4.64 -1.92 -2.53 113.55 112.28 3n04 h SER 426 Ca 0.48 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.80 3n04 h SER 426 Cb 0.80 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.89 3n04 h SER 426 CO -0.24 0.00 0.00 1.41 -0.87 0.00 0.00 176.83 177.13 3n04 n HIS 427 N -3.82 0.71 -0.04 4.77 8.25 -0.86 -2.85 115.22 121.37 3n04 n HIS 427 Ca -0.02 0.21 -0.11 0.00 -0.26 0.00 0.00 57.72 57.54 3n04 n HIS 427 Cb 0.15 -0.84 -0.05 0.00 1.12 0.00 0.00 29.99 30.37 3n04 n HIS 427 CO 0.00 0.00 0.00 0.82 0.64 0.00 0.00 176.34 177.80 3n04 h ILE 428 N 0.00 1.14 -0.42 1.59 2.04 -1.60 -0.74 117.51 119.53 3n04 h ILE 428 Ca 0.00 -0.43 -0.14 0.00 1.00 0.00 0.00 64.86 65.30 3n04 h ILE 428 Cb 0.67 1.10 -0.01 0.00 -0.74 0.00 0.00 36.82 37.84 3n04 h ILE 428 CO 0.00 0.14 -0.29 0.25 0.00 0.00 0.00 178.15 178.25 3n04 h LEU 429 N 0.14 0.95 -0.49 1.44 5.85 -1.74 -2.24 115.31 119.22 3n04 h LEU 429 Ca 0.06 -0.39 0.05 0.00 0.84 0.00 0.00 57.88 58.44 3n04 h LEU 429 Cb 0.15 -0.26 -0.05 0.00 0.37 0.00 0.00 40.66 40.87 3n04 h LEU 429 CO -0.01 1.17 0.24 -0.07 -0.34 0.00 0.00 178.44 179.43 3n04 h LEU 430 N 0.77 0.33 -0.14 2.25 4.07 -1.40 -1.15 115.31 120.04 3n04 h LEU 430 Ca 0.09 0.03 0.03 0.00 0.08 0.00 0.00 57.88 58.11 3n04 h LEU 430 Cb 0.86 -0.02 -0.03 0.00 1.08 0.00 0.00 40.66 42.54 3n04 h LEU 430 CO 0.08 0.23 -0.07 0.78 -1.08 0.00 0.00 178.44 178.38 3n04 h ASN 431 N 0.46 -0.23 -0.69 -0.43 2.35 -0.98 -2.79 115.58 113.29 3n04 h ASN 431 Ca 0.22 0.06 0.09 0.00 -0.55 0.00 0.00 56.30 56.12 3n04 h ASN 431 Cb 0.15 0.13 -0.07 0.00 0.05 0.00 0.00 38.32 38.57 3n04 h ASN 431 CO -0.17 -0.09 0.32 0.25 -1.65 0.00 0.00 177.43 176.09 3n04 h LEU 432 N -0.06 0.40 -2.18 1.61 5.85 -0.97 -2.98 115.31 116.98 3n04 h LEU 432 Ca 0.08 0.07 0.00 0.00 0.84 0.00 0.00 57.88 58.86 3n04 h LEU 432 Cb 0.17 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.20 3n04 h LEU 432 CO -0.17 0.23 0.00 0.29 -0.34 0.00 0.00 178.44 178.44 3n04 n LYS 433 N -4.90 0.42 0.00 1.25 5.02 -0.48 -4.46 118.16 115.02 3n04 n LYS 433 Ca 0.11 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.40 3n04 n LYS 433 Cb 0.28 -1.29 0.00 0.00 -0.02 0.00 0.00 35.03 34.00 3n04 n LYS 433 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 3n04 n LEU 435 N 0.90 0.00 -0.18 -0.35 4.77 -1.13 -4.35 117.00 116.67 3n04 n LEU 435 Ca 0.00 0.00 -0.09 0.00 -0.03 0.00 0.00 56.01 55.89 3n04 n LEU 435 Cb 0.21 0.00 0.04 0.00 -2.33 0.00 0.00 43.42 41.35 3n04 n LEU 435 CO 0.00 0.00 0.79 1.55 -1.33 0.00 0.00 177.39 178.40 3n04 h PRO 436 N 0.00 1.01 -0.79 3.23 0.13 -1.83 -2.20 132.00 131.56 3n04 h PRO 436 Ca 0.00 -0.34 0.02 0.00 -0.87 0.00 0.00 66.00 64.81 3n04 h PRO 436 Cb 0.00 -0.08 -0.04 0.00 0.13 0.00 0.00 31.00 31.00 3n04 h PRO 436 CO 0.00 1.02 0.51 0.77 -0.23 0.00 0.00 178.00 180.07 3n04 h SER 437 N 0.91 0.86 -0.58 1.44 0.02 -1.87 -1.78 113.55 112.55 3n04 h SER 437 Ca 0.15 -0.01 0.01 0.00 -0.84 0.00 0.00 61.79 61.11 3n04 h SER 437 Cb 0.61 -0.20 -0.03 0.00 0.14 0.00 0.00 62.40 62.91 3n04 h SER 437 CO 0.04 0.61 0.37 -0.07 -1.14 0.00 0.00 176.83 176.64 3n04 h LEU 438 N 1.02 0.63 -3.03 5.07 3.38 -1.69 -3.07 115.31 117.62 3n04 h LEU 438 Ca 0.30 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.26 3n04 h LEU 438 Cb -0.04 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 40.56 3n04 h LEU 438 CO -0.09 0.45 0.00 0.59 0.09 0.00 0.00 178.44 179.48 3n04 n ASN 439 N -4.71 0.00 0.00 -0.43 3.02 -0.67 -1.63 115.26 110.84 3n04 n ASN 439 Ca 0.04 -0.49 0.00 0.00 -0.03 0.00 0.00 54.58 54.10 3n04 n ASN 439 Cb 0.04 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.21 3n04 n ASN 439 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3n04 n GLY 442 N 0.00 0.15 3.86 0.00 0.00 -1.05 -4.80 105.19 103.35 3n04 n GLY 442 Ca 0.00 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.65 3n04 n GLY 442 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3n04 s PHE 443 N -2.00 3.65 0.00 1.61 0.08 -0.65 -4.68 117.98 115.99 3n04 s PHE 443 Ca 0.00 0.82 0.00 0.00 0.12 0.00 0.00 56.93 57.87 3n04 s PHE 443 Cb 0.00 -2.17 0.00 0.00 -0.57 0.00 0.00 43.02 40.28 3n04 s PHE 443 CO 0.00 0.62 0.00 0.98 -0.10 0.00 0.00 175.22 176.72 3n04 n TYR 445 N 1.51 0.00 -3.92 0.36 9.36 -1.26 -2.98 117.16 120.23 3n04 n TYR 445 Ca -0.13 0.00 -0.09 0.00 3.32 0.00 0.00 57.90 61.00 3n04 n TYR 445 Cb 0.53 0.00 -0.09 0.00 -0.63 0.00 0.00 39.34 39.15 3n04 n TYR 445 CO 0.00 0.00 0.00 0.95 0.22 0.00 0.00 176.86 178.03 3n04 s THR 446 N 0.00 0.14 -0.05 2.97 -4.23 -1.26 -1.20 115.64 112.01 3n04 s THR 446 Ca 0.00 -1.18 -0.31 0.00 -1.18 0.00 0.00 61.69 59.02 3n04 s THR 446 Cb 0.00 -1.10 0.12 0.00 1.34 0.00 0.00 72.50 72.86 3n04 s THR 446 CO 0.00 -0.65 1.26 -0.83 -0.54 0.00 0.00 174.62 173.86 3n04 s GLY 447 N -2.42 -0.38 0.32 3.99 0.00 -1.15 -1.61 107.32 106.06 3n04 s GLY 447 Ca -0.01 0.89 0.10 0.00 0.00 0.00 0.00 44.72 45.70 3n04 s GLY 447 CO -0.07 0.22 -0.03 0.00 0.00 0.00 0.00 173.10 173.21 3n04 s ALA 448 N -2.45 3.10 0.10 3.20 0.00 -1.26 -4.43 121.76 120.01 3n04 s ALA 448 Ca 0.13 -1.89 0.00 0.00 0.00 0.00 0.00 51.96 50.20 3n04 s ALA 448 Cb 0.03 -0.41 -0.04 0.00 0.00 0.00 0.00 23.12 22.70 3n04 s ALA 448 CO -0.04 0.14 0.25 -0.51 0.00 0.00 0.00 175.76 175.61 3n04 s ASP 449 N -3.67 6.36 -0.76 0.00 1.01 -0.24 -4.68 116.67 114.70 3n04 s ASP 449 Ca 0.33 0.27 0.03 0.00 0.71 0.00 0.00 52.55 53.89 3n04 s ASP 449 Cb -0.02 -1.96 0.20 0.00 1.01 0.00 0.00 42.92 42.15 3n04 s ASP 449 CO 0.19 0.12 0.63 -0.11 0.21 0.00 0.00 175.17 176.20 3n04 n LEU 450 N -0.02 3.53 0.00 1.23 7.94 -1.26 0.27 117.00 128.69 3n04 n LEU 450 Ca -0.05 -5.23 0.11 0.00 -1.11 0.00 0.00 56.01 49.72 3n04 n LEU 450 Cb 0.52 -0.84 0.52 0.00 0.53 0.00 0.00 43.42 44.15 3n04 n LEU 450 CO 0.51 1.76 0.86 0.61 -1.11 0.00 0.00 177.39 180.01 3n04 n GLY 451 N 1.84 -1.16 0.48 -3.96 0.00 -1.22 -4.56 105.19 96.60 3n04 n GLY 451 Ca 0.22 -0.09 0.06 0.00 0.00 0.00 0.00 46.02 46.21 3n04 n GLY 451 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3n04 n GLY 452 N 0.73 -1.56 3.15 -0.02 0.00 -0.22 -0.38 105.19 106.89 3n04 n GLY 452 Ca 0.08 -1.41 0.04 0.00 0.00 0.00 0.00 46.02 44.74 3n04 n GLY 452 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 3n04 s PHE 453 N -1.53 -1.26 0.00 1.61 5.36 -1.26 -2.86 117.98 118.04 3n04 s PHE 453 Ca 0.00 1.23 0.00 0.00 -0.96 0.00 0.00 56.93 57.20 3n04 s PHE 453 Cb 0.00 0.40 0.00 0.00 -0.34 0.00 0.00 43.02 43.08 3n04 s PHE 453 CO 0.00 -0.70 0.00 0.41 -1.46 0.00 0.00 175.22 173.47 3n04 n GLY 454 N 5.43 3.10 1.72 13.12 0.00 -1.25 -1.24 105.19 126.06 3n04 n GLY 454 Ca -0.02 -0.06 0.07 0.00 0.00 0.00 0.00 46.02 46.02 3n04 n GLY 454 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3n04 n ASP 455 N 3.03 5.14 0.21 1.61 8.00 -1.26 0.07 116.55 133.35 3n04 n ASP 455 Ca 0.00 -2.76 0.14 0.00 0.71 0.00 0.00 54.79 52.88 3n04 n ASP 455 Cb 0.00 -0.65 0.46 0.00 -0.02 0.00 0.00 41.12 40.91 3n04 n ASP 455 CO 0.00 0.00 0.00 0.44 -0.39 0.00 0.00 177.20 177.25 3n04 h ASP 456 N 3.66 0.00 -2.33 -2.24 3.32 -1.58 -3.41 116.42 113.84 3n04 h ASP 456 Ca 0.00 0.00 -0.53 0.00 0.02 0.00 0.00 57.03 56.52 3n04 h ASP 456 Cb 1.76 0.00 -0.05 0.00 0.22 0.00 0.00 39.33 41.25 3n04 h ASP 456 CO 0.40 0.00 1.21 -0.89 -1.72 0.00 0.00 179.24 178.24 3n04 s THR 457 N -3.39 3.57 0.47 0.35 2.01 -1.26 -4.94 115.64 112.45 3n04 s THR 457 Ca 0.05 0.39 -0.08 0.00 0.31 0.00 0.00 61.69 62.36 3n04 s THR 457 Cb 0.08 -4.31 -0.05 0.00 0.01 0.00 0.00 72.50 68.24 3n04 s THR 457 CO 0.56 -1.20 0.81 0.42 -0.69 0.00 0.00 174.62 174.52 3n04 s THR 458 N 7.32 4.84 0.23 -0.82 -4.23 -1.26 -4.95 115.64 116.77 3n04 s THR 458 Ca 0.56 0.42 -0.17 0.00 -1.18 0.00 0.00 61.69 61.32 3n04 s THR 458 Cb -0.11 -3.82 0.24 0.00 1.34 0.00 0.00 72.50 70.15 3n04 s THR 458 CO 0.21 -0.77 1.56 -0.09 -0.54 0.00 0.00 174.62 174.98 3n04 h ARG 459 N 0.51 -0.02 -0.66 3.99 2.43 -1.98 -2.12 114.38 116.52 3n04 h ARG 459 Ca -0.47 0.00 -0.05 0.00 -0.81 0.00 0.00 59.98 58.65 3n04 h ARG 459 Cb 1.20 0.01 -0.03 0.00 -0.42 0.00 0.00 29.97 30.72 3n04 h ARG 459 CO 0.62 -0.02 0.21 0.38 -1.51 0.00 0.00 179.97 179.66 3n04 h ASP 460 N -0.02 0.94 -0.07 -3.80 2.03 -1.99 -1.18 116.42 112.33 3n04 h ASP 460 Ca 0.34 -0.16 0.00 0.00 -0.73 0.00 0.00 57.03 56.48 3n04 h ASP 460 Cb 0.60 -0.24 -0.00 0.00 -0.83 0.00 0.00 39.33 38.85 3n04 h ASP 460 CO -0.95 0.88 0.04 0.25 -1.03 0.00 0.00 179.24 178.43 3n04 h LEU 461 N 0.98 0.07 -0.26 0.15 5.85 -1.80 -1.21 115.31 119.08 3n04 h LEU 461 Ca 0.22 0.00 -0.00 0.00 0.84 0.00 0.00 57.88 58.94 3n04 h LEU 461 Cb 0.27 -0.01 -0.01 0.00 0.37 0.00 0.00 40.66 41.27 3n04 h LEU 461 CO -0.01 0.05 0.16 0.25 -0.34 0.00 0.00 178.44 178.55 3n04 h LEU 462 N 0.09 0.31 -0.52 2.25 5.85 -1.24 -0.78 115.31 121.27 3n04 h LEU 462 Ca 0.03 -0.04 0.10 0.00 0.84 0.00 0.00 57.88 58.80 3n04 h LEU 462 Cb -0.00 -0.08 -0.08 0.00 0.37 0.00 0.00 40.66 40.87 3n04 h LEU 462 CO -0.01 0.26 0.06 -0.07 -0.34 0.00 0.00 178.44 178.34 3n04 h LEU 463 N 0.34 -0.09 -0.82 2.25 3.38 -1.06 -0.58 115.31 118.72 3n04 h LEU 463 Ca 0.10 0.11 -0.10 0.00 0.09 0.00 0.00 57.88 58.07 3n04 h LEU 463 Cb 0.00 0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.90 3n04 h LEU 463 CO -0.02 -0.02 -0.17 0.03 0.09 0.00 0.00 178.44 178.35 3n04 h ARG 464 N 0.19 0.70 -0.03 1.13 2.47 -0.99 -1.84 114.38 116.01 3n04 h ARG 464 Ca 0.26 -0.25 -0.00 0.00 -1.26 0.00 0.00 59.98 58.74 3n04 h ARG 464 Cb 0.38 -0.05 -0.00 0.00 -1.65 0.00 0.00 29.97 28.65 3n04 h ARG 464 CO -0.38 0.83 0.01 0.35 0.56 0.00 0.00 179.97 181.34 3n04 h PHE 465 N 0.62 0.04 -0.03 3.04 3.57 -0.73 -2.59 116.94 120.86 3n04 h PHE 465 Ca 0.10 -0.00 -0.02 0.00 3.53 0.00 0.00 57.97 61.58 3n04 h PHE 465 Cb 0.64 -0.01 -0.00 0.00 2.79 0.00 0.00 35.95 39.36 3n04 h PHE 465 CO 0.03 0.14 -0.08 -0.07 -2.23 0.00 0.00 178.31 176.10 3n04 h LEU 466 N -0.08 0.04 -0.46 0.59 3.38 -1.06 -0.68 115.31 117.05 3n04 h LEU 466 Ca 0.01 -0.00 -0.14 0.00 0.09 0.00 0.00 57.88 57.84 3n04 h LEU 466 Cb 0.12 -0.01 -0.02 0.00 0.09 0.00 0.00 40.66 40.84 3n04 h LEU 466 CO -0.00 0.13 -0.65 0.00 0.09 0.00 0.00 178.44 178.01 3n04 h ALA 467 N 1.87 0.75 -0.22 1.53 0.00 -0.96 -0.46 119.26 121.77 3n04 h ALA 467 Ca 0.01 -0.59 -0.13 0.00 0.00 0.00 0.00 54.91 54.19 3n04 h ALA 467 Cb 0.18 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.86 3n04 h ALA 467 CO 0.01 0.81 -0.38 1.25 0.00 0.00 0.00 179.25 180.94 3n04 h LEU 468 N 0.00 0.72 -2.12 0.00 5.85 -1.24 -3.31 115.31 115.20 3n04 h LEU 468 Ca -0.01 -0.53 0.08 0.00 0.84 0.00 0.00 57.88 58.26 3n04 h LEU 468 Cb 1.29 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 42.10 3n04 h LEU 468 CO 0.08 1.12 0.27 1.23 -0.34 0.00 0.00 178.44 180.80 3n04 h GLY 469 N 0.35 0.00 -0.12 3.75 0.00 -0.45 -0.66 103.07 105.94 3n04 h GLY 469 Ca 0.01 0.00 0.23 0.00 0.00 0.00 0.00 47.33 47.58 3n04 h GLY 469 CO 0.09 0.00 0.54 -2.08 0.00 0.00 0.00 176.54 175.08 3n04 h VAL 470 N 0.00 0.54 0.00 4.60 2.07 -1.20 -2.10 116.25 120.16 3n04 h VAL 470 Ca 0.13 -0.19 0.00 0.00 0.82 0.00 0.00 66.70 67.47 3n04 h VAL 470 Cb 0.68 -0.06 0.00 0.00 -1.52 0.00 0.00 31.29 30.39 3n04 h VAL 470 CO -0.00 0.10 -0.79 0.49 0.02 0.00 0.00 177.57 177.39 3n04 n PHE 471 N -4.92 0.06 -3.20 1.57 3.72 -0.26 -4.83 117.46 109.61 3n04 n PHE 471 Ca 0.25 0.02 -0.39 0.00 -0.05 0.00 0.00 57.45 57.28 3n04 n PHE 471 Cb 0.70 -0.21 -0.06 0.00 -0.94 0.00 0.00 39.48 38.97 3n04 n PHE 471 CO 0.00 0.00 0.00 0.95 -0.05 0.00 0.00 176.76 177.66 3n04 s THR 472 N -3.05 5.10 0.29 4.37 -4.23 -0.79 -4.97 115.64 112.36 3n04 s THR 472 Ca 0.08 1.10 0.03 0.00 -1.18 0.00 0.00 61.69 61.73 3n04 s THR 472 Cb 0.16 -3.90 0.28 0.00 1.34 0.00 0.00 72.50 70.39 3n04 s THR 472 CO 0.78 0.22 1.79 -0.65 -0.54 0.00 0.00 174.62 176.22 3n04 h PRO 473 N 7.10 0.76 -6.93 3.99 0.11 -1.84 -3.48 132.00 131.70 3n04 h PRO 473 Ca -0.37 -0.05 -0.47 0.00 0.11 0.00 0.00 66.00 65.23 3n04 h PRO 473 Cb 1.17 -0.17 0.04 0.00 0.11 0.00 0.00 31.00 32.15 3n04 h PRO 473 CO 0.76 0.50 0.06 -1.17 -0.21 0.00 0.00 178.00 177.94 3n04 s LEU 474 N -10.30 3.45 0.00 2.35 2.96 -0.63 -4.58 118.68 111.92 3n04 s LEU 474 Ca -0.12 0.58 0.00 0.00 -0.22 0.00 0.00 54.13 54.37 3n04 s LEU 474 Cb 0.24 -3.44 0.00 0.00 0.50 0.00 0.00 46.19 43.49 3n04 s LEU 474 CO 0.80 -0.86 0.00 -2.11 -1.32 0.00 0.00 176.35 172.86 3n04 n ARG 476 N -2.34 0.00 -3.74 1.98 1.85 -1.26 -4.11 116.66 109.03 3n04 n ARG 476 Ca 0.03 0.00 -0.37 0.00 -1.00 0.00 0.00 57.85 56.51 3n04 n ARG 476 Cb 0.57 0.00 -0.11 0.00 -1.05 0.00 0.00 32.46 31.87 3n04 n ARG 476 CO 0.00 0.00 0.00 0.34 -0.01 0.00 0.00 177.63 177.96 3n04 s ASP 477 N 0.00 5.32 -0.31 2.89 -1.08 -0.19 -4.67 116.67 118.63 3n04 s ASP 477 Ca 0.00 -1.95 -0.00 0.00 -0.52 0.00 0.00 52.55 50.08 3n04 s ASP 477 Cb 0.00 -1.86 0.10 0.00 -1.46 0.00 0.00 42.92 39.70 3n04 s ASP 477 CO 0.00 -0.55 0.08 -2.28 0.52 0.00 0.00 175.17 172.94 3n04 s HIS 478 N 1.19 1.97 0.24 -5.34 2.46 -1.26 -0.85 115.29 113.69 3n04 s HIS 478 Ca 0.07 -1.86 -0.30 0.00 0.47 0.00 0.00 55.06 53.44 3n04 s HIS 478 Cb -0.23 -1.83 -0.09 0.00 -0.13 0.00 0.00 32.58 30.29 3n04 s HIS 478 CO -0.03 -0.87 1.24 0.00 -2.47 0.00 0.00 174.74 172.61 3n04 s ALA 479 N 1.53 3.48 0.00 1.58 0.00 -1.09 -3.89 121.76 123.37 3n04 s ALA 479 Ca 0.09 1.07 0.00 0.00 0.00 0.00 0.00 51.96 53.11 3n04 s ALA 479 Cb -0.17 -3.44 0.00 0.00 0.00 0.00 0.00 23.12 19.51 3n04 s ALA 479 CO -0.22 -0.45 0.00 0.00 0.00 0.00 0.00 175.76 175.09 3n04 n ALA 480 N 1.95 0.98 0.21 0.00 0.00 0.49 -0.98 120.51 123.16 3n04 n ALA 480 Ca 0.03 0.00 0.10 0.00 0.00 0.00 0.00 53.44 53.57 3n04 n ALA 480 Cb 0.43 0.00 0.33 0.00 0.00 0.00 0.00 19.45 20.22 3n04 n ALA 480 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 3n04 h GLU 481 N 0.00 0.00 -6.56 0.00 5.08 -1.64 -3.44 114.58 108.03 3n04 h GLU 481 Ca 0.00 0.00 -0.59 0.00 -1.00 0.00 0.00 59.36 57.77 3n04 h GLU 481 Cb 0.00 0.00 0.09 0.00 0.50 0.00 0.00 28.75 29.34 3n04 h GLU 481 CO 0.00 0.19 0.46 0.41 -1.00 0.00 0.00 179.01 179.06 3n04 n GLY 482 N 0.60 0.45 0.00 -3.84 0.00 0.12 -3.76 105.19 98.76 3n04 n GLY 482 Ca 0.02 0.44 0.05 0.00 0.00 0.00 0.00 46.02 46.53 3n04 n GLY 482 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3n04 n THR 483 N 1.24 0.00 -2.52 2.61 -2.24 0.11 -4.84 114.28 108.64 3n04 n THR 483 Ca 0.10 -0.25 -0.41 0.00 -2.27 0.00 0.00 64.05 61.23 3n04 n THR 483 Cb 0.31 0.71 -0.04 0.00 -2.10 0.00 0.00 70.33 69.21 3n04 n THR 483 CO 0.00 0.00 0.00 -0.60 -0.57 0.00 0.00 175.07 173.90 3n04 s ARG 484 N -2.34 4.58 -0.01 -0.78 3.52 -1.16 -4.94 118.95 117.82 3n04 s ARG 484 Ca 0.01 1.70 -0.33 0.00 -0.13 0.00 0.00 55.73 56.98 3n04 s ARG 484 Cb 0.08 -3.30 -0.11 0.00 -1.56 0.00 0.00 34.95 30.06 3n04 s ARG 484 CO 0.47 0.04 1.89 0.39 -0.81 0.00 0.00 175.30 177.27 3n04 n GLU 485 N 2.63 2.47 -0.07 5.12 -0.58 -1.26 -4.89 120.64 124.05 3n04 n GLU 485 Ca 0.04 0.90 0.03 0.00 -0.42 0.00 0.00 57.16 57.71 3n04 n GLU 485 Cb 0.46 -2.78 0.05 0.00 -0.57 0.00 0.00 31.44 28.60 3n04 n GLU 485 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 3n04 n GLN 486 N 6.57 1.77 -1.79 3.49 10.64 -1.26 -4.87 117.38 131.94 3n04 n GLN 486 Ca 0.21 -1.70 -0.37 0.00 -1.83 0.00 0.00 57.00 53.31 3n04 n GLN 486 Cb 0.34 -1.06 0.06 0.00 -0.86 0.00 0.00 30.24 28.72 3n04 n GLN 486 CO 0.00 0.00 0.00 -1.21 -1.83 0.00 0.00 177.06 174.02 3n04 s GLU 487 N -1.42 2.69 0.47 2.61 8.01 -1.26 -4.90 118.70 124.90 3n04 s GLU 487 Ca 0.11 2.06 0.21 0.00 0.01 0.00 0.00 54.97 57.36 3n04 s GLU 487 Cb 0.10 -1.91 1.21 0.00 -4.31 0.00 0.00 34.13 29.21 3n04 s GLU 487 CO 0.01 -1.49 1.92 0.00 0.01 0.00 0.00 175.26 175.71 3n04 n TYR 489 N -4.43 0.03 0.40 0.00 4.11 -1.26 -3.84 117.16 112.17 3n04 n TYR 489 Ca 0.15 -0.01 0.10 0.00 -0.00 0.00 0.00 57.90 58.14 3n04 n TYR 489 Cb 0.66 0.00 0.16 0.00 -0.00 0.00 0.00 39.34 40.15 3n04 n TYR 489 CO 0.00 0.00 0.00 1.04 -0.00 0.00 0.00 176.86 177.90 3n04 n GLN 490 N -0.54 2.17 -4.35 -3.48 1.13 -0.37 -4.98 117.38 106.97 3n04 n GLN 490 Ca 0.06 -2.01 -0.24 0.00 -1.94 0.00 0.00 57.00 52.88 3n04 n GLN 490 Cb 0.05 -1.43 -0.08 0.00 0.11 0.00 0.00 30.24 28.89 3n04 n GLN 490 CO 0.00 0.00 0.00 -0.06 -1.44 0.00 0.00 177.06 175.56 3n04 s PHE 491 N -1.43 2.55 0.38 1.08 0.08 -1.25 -4.98 117.98 114.41 3n04 s PHE 491 Ca 0.31 -0.32 -0.26 0.00 0.12 0.00 0.00 56.93 56.78 3n04 s PHE 491 Cb 0.19 -1.25 -0.11 0.00 -0.57 0.00 0.00 43.02 41.28 3n04 s PHE 491 CO 0.27 0.59 1.14 0.39 -0.10 0.00 0.00 175.22 177.52 3n04 n GLU 492 N -0.85 1.69 -3.25 0.44 4.71 -1.26 -4.01 120.64 118.11 3n04 n GLU 492 Ca -0.05 0.60 -0.08 0.00 -0.01 0.00 0.00 57.16 57.62 3n04 n GLU 492 Cb 0.60 -2.16 0.01 0.00 -1.01 0.00 0.00 31.44 28.88 3n04 n GLU 492 CO 0.00 0.00 0.00 0.09 0.09 0.00 0.00 177.13 177.31 3n04 n ASN 493 N 0.64 -7.01 -0.16 1.62 4.13 -1.26 -4.87 115.26 108.34 3n04 n ASN 493 Ca 0.07 -0.35 0.22 0.00 1.68 0.00 0.00 54.58 56.21 3n04 n ASN 493 Cb 0.37 -4.49 0.62 0.00 -1.54 0.00 0.00 39.78 34.75 3n04 n ASN 493 CO 0.00 0.00 0.00 0.40 0.28 0.00 0.00 177.26 177.94 3n04 h ILE 494 N 0.07 0.66 -0.98 2.41 1.08 -1.88 -2.42 117.51 116.45 3n04 h ILE 494 Ca -0.21 -0.06 0.26 0.00 -0.39 0.00 0.00 64.86 64.46 3n04 h ILE 494 Cb 1.12 0.46 -0.06 0.00 -3.07 0.00 0.00 36.82 35.27 3n04 h ILE 494 CO 0.33 0.03 0.67 1.05 -0.69 0.00 0.00 178.15 179.55 3n04 h GLU 495 N 0.18 0.21 -0.55 2.37 9.09 -1.95 -0.84 114.58 123.10 3n04 h GLU 495 Ca 0.40 -0.01 -0.12 0.00 0.05 0.00 0.00 59.36 59.68 3n04 h GLU 495 Cb 1.29 -0.05 -0.02 0.00 -1.65 0.00 0.00 28.75 28.32 3n04 h GLU 495 CO -0.08 0.14 -0.11 -0.44 0.05 0.00 0.00 179.01 178.58 3n04 h ASP 496 N 0.22 1.05 -0.29 3.06 3.32 -1.79 -0.22 116.42 121.78 3n04 h ASP 496 Ca 0.50 -0.35 -0.08 0.00 0.02 0.00 0.00 57.03 57.12 3n04 h ASP 496 Cb 1.58 -0.29 -0.01 0.00 0.22 0.00 0.00 39.33 40.84 3n04 h ASP 496 CO -0.13 1.15 -0.14 -0.26 -1.72 0.00 0.00 179.24 178.15 3n04 h PHE 497 N 0.93 0.69 -0.78 4.55 0.04 -1.37 -2.47 116.94 118.53 3n04 h PHE 497 Ca 0.14 -0.17 0.08 0.00 2.80 0.00 0.00 57.97 60.82 3n04 h PHE 497 Cb 0.68 -0.16 -0.07 0.00 2.20 0.00 0.00 35.95 38.60 3n04 h PHE 497 CO 0.05 0.84 0.44 -0.09 -0.60 0.00 0.00 178.31 178.95 3n04 h ARG 498 N 0.35 0.75 -0.46 1.51 2.43 -1.24 -1.37 114.38 116.34 3n04 h ARG 498 Ca 0.06 -0.04 -0.00 0.00 -0.81 0.00 0.00 59.98 59.19 3n04 h ARG 498 Cb 0.65 -0.17 -0.02 0.00 -0.42 0.00 0.00 29.97 30.01 3n04 h ARG 498 CO 0.04 0.49 0.27 0.77 -1.51 0.00 0.00 179.97 180.04 3n04 h SER 499 N 0.77 0.55 -0.34 -3.80 0.02 -0.87 0.29 113.55 110.18 3n04 h SER 499 Ca 0.37 -0.06 -0.10 0.00 -0.84 0.00 0.00 61.79 61.16 3n04 h SER 499 Cb 0.30 -0.14 -0.01 0.00 0.14 0.00 0.00 62.40 62.70 3n04 h SER 499 CO -0.23 0.45 -0.16 0.58 -1.14 0.00 0.00 176.83 176.33 3n04 h VAL 500 N 0.61 1.29 -0.12 2.27 2.07 -1.06 -2.11 116.25 119.20 3n04 h VAL 500 Ca 0.16 -1.27 -0.16 0.00 0.82 0.00 0.00 66.70 66.25 3n04 h VAL 500 Cb 0.01 1.40 -0.01 0.00 -1.52 0.00 0.00 31.29 31.16 3n04 h VAL 500 CO -0.03 0.42 -0.61 0.40 0.02 0.00 0.00 177.57 177.77 3n04 h ILE 501 N 0.48 1.36 -0.94 4.57 2.04 -1.14 -2.14 117.51 121.73 3n04 h ILE 501 Ca 0.08 -1.94 0.11 0.00 1.00 0.00 0.00 64.86 64.11 3n04 h ILE 501 Cb 0.70 1.93 -0.08 0.00 -0.74 0.00 0.00 36.82 38.63 3n04 h ILE 501 CO 0.05 0.59 0.58 0.78 0.00 0.00 0.00 178.15 180.14 3n04 h ASN 502 N 0.30 0.84 -0.80 1.72 2.35 -0.30 -2.15 115.58 117.53 3n04 h ASN 502 Ca -0.01 0.05 -0.03 0.00 -0.55 0.00 0.00 56.30 55.76 3n04 h ASN 502 Cb 1.14 -0.12 -0.04 0.00 0.05 0.00 0.00 38.32 39.36 3n04 h ASN 502 CO 0.10 0.45 0.38 0.00 -1.65 0.00 0.00 177.43 176.71 3n04 h ALA 503 N 1.51 1.03 -0.09 -0.83 0.00 -0.71 -0.39 119.26 119.77 3n04 h ALA 503 Ca 0.46 -0.16 0.03 0.00 0.00 0.00 0.00 54.91 55.24 3n04 h ALA 503 Cb 0.45 -0.31 -0.03 0.00 0.00 0.00 0.00 17.79 17.90 3n04 h ALA 503 CO -0.26 0.60 -0.07 -0.09 0.00 0.00 0.00 179.25 179.42 3n04 h ARG 504 N 1.13 -0.08 -0.02 0.00 9.65 -1.20 -2.02 114.38 121.84 3n04 h ARG 504 Ca 0.27 0.01 -0.08 0.00 -1.10 0.00 0.00 59.98 59.08 3n04 h ARG 504 Cb 0.13 0.02 -0.01 0.00 -1.39 0.00 0.00 29.97 28.71 3n04 h ARG 504 CO -0.03 -0.06 -0.36 1.88 2.80 0.00 0.00 179.97 184.20 3n04 h TYR 505 N -0.09 0.04 -0.02 2.20 -1.99 -0.77 -0.15 116.97 116.20 3n04 h TYR 505 Ca 0.06 -0.01 -0.09 0.00 2.00 0.00 0.00 58.73 60.70 3n04 h TYR 505 Cb 0.18 -0.01 -0.01 0.00 2.00 0.00 0.00 36.73 38.89 3n04 h TYR 505 CO -0.19 0.39 -0.40 0.00 -0.00 0.00 0.00 178.16 177.96 3n04 h ARG 506 N 0.03 0.03 -0.00 4.88 3.08 -0.90 -3.02 114.38 118.48 3n04 h ARG 506 Ca 0.00 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.04 3n04 h ARG 506 Cb 0.65 -0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.70 3n04 h ARG 506 CO 0.05 0.43 -0.48 1.28 -1.07 0.00 0.00 179.97 180.18 3n04 n LEU 507 N -4.06 0.62 -0.21 3.04 4.77 -0.39 -1.85 117.00 118.92 3n04 n LEU 507 Ca -0.02 -0.07 0.02 0.00 -0.03 0.00 0.00 56.01 55.92 3n04 n LEU 507 Cb 0.44 -0.22 0.13 0.00 -2.33 0.00 0.00 43.42 41.44 3n04 n LEU 507 CO 0.40 0.14 0.91 0.58 -1.33 0.00 0.00 177.39 178.09 3n04 h VAL 508 N 0.22 0.59 -0.52 4.08 2.07 -0.95 0.14 116.25 121.88 3n04 h VAL 508 Ca 0.00 -0.09 -0.04 0.00 0.82 0.00 0.00 66.70 67.39 3n04 h VAL 508 Cb 0.50 0.32 -0.02 0.00 -1.52 0.00 0.00 31.29 30.57 3n04 h VAL 508 CO 0.00 0.05 0.15 -0.65 0.02 0.00 0.00 177.57 177.14 3n04 h PRO 509 N 0.25 0.78 -0.13 1.57 0.11 -1.80 0.14 132.00 132.92 3n04 h PRO 509 Ca 0.34 -0.14 -0.07 0.00 0.11 0.00 0.00 66.00 66.24 3n04 h PRO 509 Cb 0.54 -0.13 -0.00 0.00 0.11 0.00 0.00 31.00 31.52 3n04 h PRO 509 CO -0.45 0.69 -0.18 -0.92 -0.21 0.00 0.00 178.00 176.94 3n04 h TYR 510 N 0.76 0.44 -0.44 0.65 3.20 -1.58 -2.04 116.97 117.96 3n04 h TYR 510 Ca 0.17 -0.14 -0.03 0.00 3.14 0.00 0.00 58.73 61.87 3n04 h TYR 510 Cb 0.24 -0.09 -0.02 0.00 1.54 0.00 0.00 36.73 38.41 3n04 h TYR 510 CO 0.01 0.78 0.15 -0.07 -1.64 0.00 0.00 178.16 177.40 3n04 h LEU 511 N -0.04 0.63 -0.30 2.82 3.38 -0.49 -1.07 115.31 120.24 3n04 h LEU 511 Ca 0.02 -0.19 0.01 0.00 0.09 0.00 0.00 57.88 57.80 3n04 h LEU 511 Cb 0.73 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 41.30 3n04 h LEU 511 CO 0.04 0.65 0.19 0.22 0.09 0.00 0.00 178.44 179.63 3n04 h TYR 512 N 0.57 0.36 -0.16 1.13 3.20 -1.07 -1.27 116.97 119.74 3n04 h TYR 512 Ca 0.14 0.01 0.04 0.00 3.14 0.00 0.00 58.73 62.07 3n04 h TYR 512 Cb 0.24 -0.12 -0.04 0.00 1.54 0.00 0.00 36.73 38.34 3n04 h TYR 512 CO 0.01 0.22 -0.11 1.03 -1.64 0.00 0.00 178.16 177.67 3n04 h SER 513 N 0.39 -0.36 -0.43 -2.11 0.87 -1.10 -2.67 113.55 108.14 3n04 h SER 513 Ca 0.11 0.08 -0.05 0.00 -1.23 0.00 0.00 61.79 60.70 3n04 h SER 513 Cb -0.03 0.19 -0.02 0.00 -0.44 0.00 0.00 62.40 62.09 3n04 h SER 513 CO -0.04 -0.15 0.09 -0.33 -0.53 0.00 0.00 176.83 175.87 3n04 h GLU 514 N -0.12 0.77 -0.02 2.24 4.39 -1.14 -0.64 114.58 120.06 3n04 h GLU 514 Ca 0.10 -0.17 0.00 0.00 0.34 0.00 0.00 59.36 59.63 3n04 h GLU 514 Cb 0.26 -0.11 0.00 0.00 -0.10 0.00 0.00 28.75 28.80 3n04 h GLU 514 CO -0.23 0.72 0.00 0.98 -1.16 0.00 0.00 179.01 179.32 3n04 n TYR 515 N -4.27 0.00 0.00 4.33 9.36 -0.49 -1.17 117.16 124.92 3n04 n TYR 515 Ca 0.03 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.25 3n04 n TYR 515 Cb 0.24 -0.00 0.00 0.00 -0.63 0.00 0.00 39.34 38.95 3n04 n TYR 515 CO 0.00 0.00 0.00 1.63 0.22 0.00 0.00 176.86 178.71 3n04 n LYS 517 N 0.03 0.00 -0.02 2.98 5.02 -0.25 -0.17 118.16 125.74 3n04 n LYS 517 Ca 0.00 0.00 -0.10 0.00 -2.02 0.00 0.00 58.31 56.19 3n04 n LYS 517 Cb 0.00 0.00 -0.04 0.00 -0.02 0.00 0.00 35.03 34.98 3n04 n LYS 517 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3n04 h ALA 518 N 0.00 0.16 -0.45 7.82 0.00 -1.40 -1.84 119.26 123.55 3n04 h ALA 518 Ca 0.00 0.03 -0.06 0.00 0.00 0.00 0.00 54.91 54.87 3n04 h ALA 518 Cb 0.00 0.03 -0.02 0.00 0.00 0.00 0.00 17.79 17.80 3n04 h ALA 518 CO 0.00 -0.41 0.03 0.00 0.00 0.00 0.00 179.25 178.87 3n04 h ALA 519 N 1.11 0.60 0.00 0.00 0.00 -0.80 0.23 119.26 120.40 3n04 h ALA 519 Ca 0.07 -0.25 -0.01 0.00 0.00 0.00 0.00 54.91 54.72 3n04 h ALA 519 Cb 0.06 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 17.68 3n04 h ALA 519 CO -0.09 0.36 -0.05 -0.07 0.00 0.00 0.00 179.25 179.41 3n04 h LEU 520 N 0.62 0.00 -2.98 0.00 3.38 -1.78 -3.03 115.31 111.52 3n04 h LEU 520 Ca 0.13 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.10 3n04 h LEU 520 Cb 0.44 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.19 3n04 h LEU 520 CO 0.02 0.05 0.00 0.59 0.09 0.00 0.00 178.44 179.18 3n04 n ASN 521 N -3.14 3.25 -3.74 -0.43 3.02 -0.70 -4.98 115.26 108.54 3n04 n ASN 521 Ca 0.01 -2.27 -0.26 0.00 -0.03 0.00 0.00 54.58 52.04 3n04 n ASN 521 Cb 0.39 -0.33 0.05 0.00 -0.61 0.00 0.00 39.78 39.28 3n04 n ASN 521 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 3n04 n ASP 522 N 0.31 -4.32 0.00 6.41 8.00 -0.49 -5.02 116.55 121.44 3n04 n ASP 522 Ca 0.15 -0.71 0.00 0.00 0.71 0.00 0.00 54.79 54.94 3n04 n ASP 522 Cb 0.56 -4.35 0.00 0.00 -0.02 0.00 0.00 41.12 37.31 3n04 n ASP 522 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 3n04 n ASP 523 N -2.95 0.00 0.08 -2.24 -0.08 0.68 -4.68 116.55 107.36 3n04 n ASP 523 Ca -0.06 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.22 3n04 n ASP 523 Cb 0.58 0.00 0.00 0.00 2.34 0.00 0.00 41.12 44.04 3n04 n ASP 523 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 3n04 n TYR 525 N 0.00 -1.13 -3.76 -0.67 9.36 -1.26 -4.52 117.16 115.18 3n04 n TYR 525 Ca 0.00 0.20 -0.35 0.00 3.32 0.00 0.00 57.90 61.07 3n04 n TYR 525 Cb 0.00 0.37 -0.05 0.00 -0.63 0.00 0.00 39.34 39.02 3n04 n TYR 525 CO 0.00 0.00 0.00 -0.06 0.22 0.00 0.00 176.86 177.02 3n04 s PHE 526 N -2.00 3.60 -0.01 2.98 0.08 -1.26 -0.75 117.98 120.62 3n04 s PHE 526 Ca 0.00 0.60 0.02 0.00 0.12 0.00 0.00 56.93 57.67 3n04 s PHE 526 Cb 0.00 -2.01 -0.00 0.00 -0.57 0.00 0.00 43.02 40.44 3n04 s PHE 526 CO 0.00 0.64 -0.05 0.15 -0.10 0.00 0.00 175.22 175.86 3n04 s LYS 527 N -1.57 0.42 0.62 0.44 1.02 -1.26 -4.65 119.74 114.76 3n04 s LYS 527 Ca 0.25 -0.17 -0.19 0.00 0.02 0.00 0.00 55.97 55.88 3n04 s LYS 527 Cb -0.13 -0.42 -0.02 0.00 -0.52 0.00 0.00 37.83 36.74 3n04 s LYS 527 CO 0.14 0.10 1.28 -2.14 -0.92 0.00 0.00 175.35 173.80 3n04 s PRO 528 N -0.06 2.72 0.40 -1.68 0.02 -1.26 -4.64 135.00 130.50 3n04 s PRO 528 Ca 0.01 2.02 0.16 0.00 0.02 0.00 0.00 61.00 63.21 3n04 s PRO 528 Cb -0.03 -1.90 1.03 0.00 0.02 0.00 0.00 34.50 33.62 3n04 s PRO 528 CO -0.00 -1.46 1.85 -0.07 -0.33 0.00 0.00 177.00 176.99 3n04 h LEU 529 N 0.72 0.47 -1.61 -5.54 4.07 -1.80 -1.74 115.31 109.88 3n04 h LEU 529 Ca -0.51 0.05 -0.04 0.00 0.08 0.00 0.00 57.88 57.46 3n04 h LEU 529 Cb 1.32 -0.04 -0.01 0.00 1.08 0.00 0.00 40.66 43.02 3n04 h LEU 529 CO 0.54 0.19 -0.20 1.23 -1.08 0.00 0.00 178.44 179.11 3n04 h GLY 530 N 0.47 0.00 1.77 0.83 0.00 -1.83 0.18 103.07 104.48 3n04 h GLY 530 Ca 0.48 0.00 -0.08 0.00 0.00 0.00 0.00 47.33 47.73 3n04 h GLY 530 CO -0.20 0.00 -0.26 0.74 0.00 0.00 0.00 176.54 176.81 3n04 h PHE 531 N 0.00 0.30 0.02 5.60 -1.00 -1.68 -2.77 116.94 117.41 3n04 h PHE 531 Ca -0.00 -0.06 -0.33 0.00 2.81 0.00 0.00 57.97 60.39 3n04 h PHE 531 Cb 0.36 -0.08 -0.05 0.00 3.61 0.00 0.00 35.95 39.79 3n04 h PHE 531 CO 0.00 0.52 -1.95 0.28 -1.61 0.00 0.00 178.31 175.55 3n04 n VAL 532 N -4.15 1.58 -3.22 -0.55 0.31 -0.72 -4.58 118.33 106.99 3n04 n VAL 532 Ca -0.01 -0.78 -0.26 0.00 -0.01 0.00 0.00 64.34 63.29 3n04 n VAL 532 Cb 0.38 -1.03 -0.06 0.00 -0.91 0.00 0.00 33.84 32.22 3n04 n VAL 532 CO 0.00 0.00 0.00 -1.22 -1.32 0.00 0.00 176.83 174.29 3n04 n TYR 533 N -3.05 2.78 0.33 3.52 4.01 0.54 -4.96 117.16 120.33 3n04 n TYR 533 Ca -0.24 -3.98 0.15 0.00 -0.16 0.00 0.00 57.90 53.66 3n04 n TYR 533 Cb 1.07 -0.49 0.61 0.00 -0.31 0.00 0.00 39.34 40.22 3n04 n TYR 533 CO 0.00 0.00 0.00 -1.00 -0.46 0.00 0.00 176.86 175.40 3n04 h PRO 534 N 3.69 0.00 -0.14 -0.72 0.13 -1.74 -2.49 132.00 130.73 3n04 h PRO 534 Ca 0.15 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.28 3n04 h PRO 534 Cb 0.68 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.81 3n04 h PRO 534 CO 0.74 0.00 0.00 -0.25 -0.23 0.00 0.00 178.00 178.26 3n04 n ASP 535 N -2.78 2.45 -4.48 1.44 8.00 -1.26 -4.80 116.55 115.12 3n04 n ASP 535 Ca 0.01 -1.81 -0.43 0.00 0.71 0.00 0.00 54.79 53.27 3n04 n ASP 535 Cb 0.28 -0.08 -0.08 0.00 -0.02 0.00 0.00 41.12 41.22 3n04 n ASP 535 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 3n04 s ASP 536 N -1.78 6.20 0.00 -2.24 -1.08 -0.94 -5.08 116.67 111.76 3n04 s ASP 536 Ca 0.34 -0.68 0.00 0.00 -0.52 0.00 0.00 52.55 51.69 3n04 s ASP 536 Cb 0.20 -2.23 0.00 0.00 -1.46 0.00 0.00 42.92 39.43 3n04 s ASP 536 CO 0.30 -0.61 0.08 0.29 0.52 0.00 0.00 175.17 175.75 3n04 n LYS 537 N 5.66 0.10 0.00 4.34 4.76 -1.26 -2.20 118.16 129.56 3n04 n LYS 537 Ca -0.07 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.37 3n04 n LYS 537 Cb 0.47 -1.25 0.00 0.00 -1.84 0.00 0.00 35.03 32.42 3n04 n LYS 537 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 3n04 n ALA 539 N 0.70 0.00 0.30 7.82 0.00 -1.26 -4.10 120.51 123.96 3n04 n ALA 539 Ca 0.00 0.00 0.17 0.00 0.00 0.00 0.00 53.44 53.61 3n04 n ALA 539 Cb 0.04 0.00 0.81 0.00 0.00 0.00 0.00 19.45 20.29 3n04 n ALA 539 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 177.50 176.66 3n04 h ILE 540 N 0.00 0.00 -0.03 0.00 3.07 -1.68 -2.33 117.51 116.55 3n04 h ILE 540 Ca 0.00 -0.20 0.00 0.00 1.55 0.00 0.00 64.86 66.21 3n04 h ILE 540 Cb 0.00 1.04 0.00 0.00 -0.27 0.00 0.00 36.82 37.59 3n04 h ILE 540 CO 0.00 0.00 -0.05 0.54 -1.05 0.00 0.00 178.15 177.59 3n04 n ARG 541 N -2.77 1.92 -2.38 0.16 5.12 -1.26 -4.69 116.66 112.77 3n04 n ARG 541 Ca -0.01 -1.68 -0.42 0.00 -1.93 0.00 0.00 57.85 53.81 3n04 n ARG 541 Cb 0.16 -1.41 -0.03 0.00 -1.16 0.00 0.00 32.46 30.02 3n04 n ARG 541 CO 0.00 0.00 0.00 0.08 -1.93 0.00 0.00 177.63 175.78 3n04 s VAL 542 N -1.85 3.85 0.00 1.55 1.01 -0.88 -4.93 120.40 119.16 3n04 s VAL 542 Ca 0.24 1.36 0.00 0.00 0.00 0.00 0.00 61.98 63.58 3n04 s VAL 542 Cb 0.18 -3.87 0.00 0.00 0.00 0.00 0.00 36.38 32.69 3n04 s VAL 542 CO 0.30 0.12 0.13 -0.62 0.00 0.00 0.00 175.10 175.03 3n04 n GLU 543 N 3.74 3.12 -0.48 2.72 1.02 -1.26 -4.66 120.64 124.84 3n04 n GLU 543 Ca 0.09 -0.13 0.05 0.00 -0.02 0.00 0.00 57.16 57.14 3n04 n GLU 543 Cb 0.45 -0.55 0.22 0.00 -0.02 0.00 0.00 31.44 31.54 3n04 n GLU 543 CO 0.00 0.00 0.00 -0.40 1.18 0.00 0.00 177.13 177.91 3n04 n ASP 544 N -0.48 3.09 -3.93 1.62 5.68 -1.26 -4.64 116.55 116.62 3n04 n ASP 544 Ca 0.00 -3.29 -0.10 0.00 -0.50 0.00 0.00 54.79 50.90 3n04 n ASP 544 Cb 0.02 -0.55 -0.12 0.00 -1.14 0.00 0.00 41.12 39.33 3n04 n ASP 544 CO 0.00 0.00 0.00 -1.10 -1.33 0.00 0.00 177.20 174.77 3n04 s GLN 545 N -2.98 0.21 0.00 0.11 -0.21 -1.26 -4.54 119.66 110.98 3n04 s GLN 545 Ca 0.41 -0.37 0.00 0.00 0.02 0.00 0.00 55.36 55.42 3n04 s GLN 545 Cb 0.35 0.07 0.00 0.00 1.00 0.00 0.00 33.01 34.43 3n04 s GLN 545 CO 0.04 -0.03 0.00 1.28 -2.12 0.00 0.00 175.29 174.46 3n04 n LEU 546 N 2.14 0.00 -3.48 2.90 4.77 -0.92 -4.48 117.00 117.94 3n04 n LEU 546 Ca -0.19 0.00 0.01 0.00 -0.03 0.00 0.00 56.01 55.79 3n04 n LEU 546 Cb 0.57 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.61 3n04 n LEU 546 CO 0.22 0.00 0.69 -0.22 -1.33 0.00 0.00 177.39 176.75 3n04 s LEU 548 N 0.00 -0.46 0.00 2.23 0.20 -0.46 -0.19 118.68 120.00 3n04 s LEU 548 Ca 0.00 0.67 0.00 0.00 0.69 0.00 0.00 54.13 55.49 3n04 s LEU 548 Cb 0.00 1.58 0.00 0.00 -0.43 0.00 0.00 46.19 47.34 3n04 s LEU 548 CO 0.00 -0.10 0.00 0.61 -0.29 0.00 0.00 176.35 176.57 3n04 n GLY 549 N 4.37 2.93 0.04 7.98 0.00 0.07 -2.75 105.19 117.83 3n04 n GLY 549 Ca -0.13 -0.22 0.00 0.00 0.00 0.00 0.00 46.02 45.68 3n04 n GLY 549 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3n04 n ASN 550 N 1.96 1.60 -0.04 1.61 3.02 -1.26 -4.78 115.26 117.37 3n04 n ASN 550 Ca 0.00 -1.55 -0.05 0.00 -0.03 0.00 0.00 54.58 52.96 3n04 n ASN 550 Cb 0.00 -0.01 -0.05 0.00 -0.61 0.00 0.00 39.78 39.12 3n04 n ASN 550 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 3n04 n GLU 551 N -0.21 1.54 0.00 3.52 4.71 -1.21 -4.92 120.64 124.08 3n04 n GLU 551 Ca 0.01 0.02 0.00 0.00 -0.01 0.00 0.00 57.16 57.18 3n04 n GLU 551 Cb 0.15 -1.17 0.00 0.00 -1.01 0.00 0.00 31.44 29.41 3n04 n GLU 551 CO 0.00 0.00 0.00 0.44 0.09 0.00 0.00 177.13 177.66 3n04 n ILE 552 N -2.50 0.00 -3.56 -3.67 -5.35 -1.11 -1.04 119.36 102.13 3n04 n ILE 552 Ca -0.13 0.00 -0.17 0.00 -0.27 0.00 0.00 62.75 62.18 3n04 n ILE 552 Cb 0.69 0.00 -0.06 0.00 -1.74 0.00 0.00 39.64 38.52 3n04 n ILE 552 CO 0.00 0.00 0.00 0.27 -1.76 0.00 0.00 176.55 175.06 3n04 s ILE 554 N 1.57 0.01 -0.48 7.28 -4.36 0.73 -1.36 121.20 124.59 3n04 s ILE 554 Ca 0.00 -0.08 0.06 0.00 -0.26 0.00 0.00 60.65 60.38 3n04 s ILE 554 Cb 0.00 -0.94 0.20 0.00 1.25 0.00 0.00 42.46 42.98 3n04 s ILE 554 CO 0.00 -0.04 0.69 0.00 0.24 0.00 0.00 174.94 175.82 3n04 n ALA 555 N 0.97 -0.65 -1.72 2.27 0.00 -1.26 -2.17 120.51 117.94 3n04 n ALA 555 Ca -0.19 -1.64 -0.35 0.00 0.00 0.00 0.00 53.44 51.25 3n04 n ALA 555 Cb 0.57 -1.28 0.03 0.00 0.00 0.00 0.00 19.45 18.76 3n04 n ALA 555 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 3n04 s PRO 556 N 0.54 3.03 0.06 0.00 0.04 -1.26 -4.96 135.00 132.45 3n04 s PRO 556 Ca 0.31 1.74 -0.29 0.00 0.04 0.00 0.00 61.00 62.80 3n04 s PRO 556 Cb 0.07 -1.95 -0.05 0.00 0.04 0.00 0.00 34.50 32.62 3n04 s PRO 556 CO -0.13 -1.14 0.94 0.08 0.04 0.00 0.00 177.00 176.80 3n04 s VAL 557 N -1.70 4.68 -0.03 -0.36 1.01 -1.26 -4.94 120.40 117.79 3n04 s VAL 557 Ca 0.75 2.01 0.04 0.00 0.00 0.00 0.00 61.98 64.79 3n04 s VAL 557 Cb -0.28 -4.30 0.06 0.00 0.00 0.00 0.00 36.38 31.87 3n04 s VAL 557 CO 0.32 0.26 0.89 0.00 0.00 0.00 0.00 175.10 176.58 3n04 n TYR 558 N 3.24 0.00 -5.00 5.22 0.18 -1.26 -4.91 117.16 114.63 3n04 n TYR 558 Ca 0.03 -0.33 -0.32 0.00 1.88 0.00 0.00 57.90 59.15 3n04 n TYR 558 Cb 0.50 -0.06 -0.15 0.00 -0.38 0.00 0.00 39.34 39.26 3n04 n TYR 558 CO 0.00 0.00 0.00 -1.21 -2.08 0.00 0.00 176.86 173.57 3n04 s GLU 559 N -0.86 2.72 0.41 -3.48 2.02 -1.26 -4.80 118.70 113.45 3n04 s GLU 559 Ca 0.07 -0.77 -0.25 0.00 0.02 0.00 0.00 54.97 54.04 3n04 s GLU 559 Cb 0.06 -2.36 -0.08 0.00 0.10 0.00 0.00 34.13 31.85 3n04 s GLU 559 CO 0.01 0.44 1.20 -1.14 0.02 0.00 0.00 175.26 175.79 3n04 s GLN 560 N -0.27 4.00 0.00 1.61 0.74 -1.26 -2.88 119.66 121.60 3n04 s GLN 560 Ca 0.01 1.91 0.00 0.00 0.05 0.00 0.00 55.36 57.33 3n04 s GLN 560 Cb -0.13 -2.67 0.00 0.00 1.10 0.00 0.00 33.01 31.31 3n04 s GLN 560 CO 0.03 -0.39 0.00 0.09 -0.55 0.00 0.00 175.29 174.47 3n04 n ASN 561 N 0.04 -4.37 -4.78 6.67 3.02 -1.26 -4.99 115.26 109.59 3n04 n ASN 561 Ca 0.04 0.00 -0.38 0.00 -0.03 0.00 0.00 54.58 54.22 3n04 n ASN 561 Cb 0.46 -2.31 -0.06 0.00 -0.61 0.00 0.00 39.78 37.25 3n04 n ASN 561 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3n04 s ALA 562 N -1.45 3.29 -1.04 5.41 0.00 -1.14 -4.95 121.76 121.90 3n04 s ALA 562 Ca 0.00 0.47 0.13 0.00 0.00 0.00 0.00 51.96 52.55 3n04 s ALA 562 Cb 0.00 -3.11 0.36 0.00 0.00 0.00 0.00 23.12 20.38 3n04 s ALA 562 CO 0.00 0.22 1.30 0.54 0.00 0.00 0.00 175.76 177.82 3n04 n ARG 563 N 0.89 2.87 -3.46 0.00 1.74 -1.26 -4.81 116.66 112.63 3n04 n ARG 563 Ca -0.00 -2.17 0.00 0.00 -0.77 0.00 0.00 57.85 54.90 3n04 n ARG 563 Cb 0.49 -1.34 0.00 0.00 -1.02 0.00 0.00 32.46 30.60 3n04 n ARG 563 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3n04 n GLY 564 N 0.63 -1.10 3.67 -0.13 0.00 -1.25 -0.78 105.19 106.24 3n04 n GLY 564 Ca 0.14 -0.95 -0.08 0.00 0.00 0.00 0.00 46.02 45.13 3n04 n GLY 564 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 3n04 s ARG 565 N -0.91 1.43 0.31 1.61 1.70 -0.61 -4.86 118.95 117.62 3n04 s ARG 565 Ca 0.00 -0.71 -0.24 0.00 -0.47 0.00 0.00 55.73 54.31 3n04 s ARG 565 Cb 0.00 0.55 -0.10 0.00 -0.57 0.00 0.00 34.95 34.83 3n04 s ARG 565 CO 0.00 -0.65 0.89 0.71 -1.08 0.00 0.00 175.30 175.18 3n04 s TYR 566 N -3.68 3.65 0.06 5.89 2.02 -1.26 -1.16 117.35 122.87 3n04 s TYR 566 Ca 0.08 1.67 0.00 0.00 -0.37 0.00 0.00 57.07 58.45 3n04 s TYR 566 Cb -0.03 -2.84 -0.04 0.00 -0.40 0.00 0.00 41.96 38.65 3n04 s TYR 566 CO -0.01 0.21 -0.05 0.14 -1.57 0.00 0.00 175.55 174.27 3n04 s VAL 567 N -1.65 0.38 -0.12 0.71 -7.23 0.53 -4.95 120.40 108.06 3n04 s VAL 567 Ca 0.50 -1.66 0.02 0.00 -1.81 0.00 0.00 61.98 59.03 3n04 s VAL 567 Cb -0.17 -1.31 -0.00 0.00 0.56 0.00 0.00 36.38 35.45 3n04 s VAL 567 CO 0.22 -0.83 -0.18 -0.47 -0.31 0.00 0.00 175.10 173.53 3n04 s TYR 568 N -3.25 2.70 -0.28 2.82 5.04 -1.26 -1.28 117.35 121.84 3n04 s TYR 568 Ca 0.04 -0.92 -0.07 0.00 -2.44 0.00 0.00 57.07 53.68 3n04 s TYR 568 Cb 0.03 -1.80 0.00 0.00 0.35 0.00 0.00 41.96 40.54 3n04 s TYR 568 CO -0.06 -0.37 0.06 -0.51 -1.34 0.00 0.00 175.55 173.33 3n04 s LEU 569 N 0.48 3.67 0.00 6.97 1.43 -0.03 -4.95 118.68 126.24 3n04 s LEU 569 Ca -0.12 -0.59 0.26 0.00 -1.03 0.00 0.00 54.13 52.65 3n04 s LEU 569 Cb -0.17 -1.87 1.30 0.00 0.03 0.00 0.00 46.19 45.48 3n04 s LEU 569 CO 0.05 -0.14 1.87 -2.65 0.23 0.00 0.00 176.35 175.71 3n04 n PRO 570 N 4.87 0.36 -3.93 1.29 -0.02 -1.26 0.01 135.00 136.31 3n04 n PRO 570 Ca -0.15 0.04 -0.09 0.00 -2.02 0.00 0.00 63.50 61.28 3n04 n PRO 570 Cb 0.49 -1.50 -0.03 0.00 -0.02 0.00 0.00 33.50 32.44 3n04 n PRO 570 CO 0.00 0.00 0.00 -1.83 1.98 0.00 0.00 175.50 175.65 3n04 s GLU 571 N -2.58 1.74 0.97 -0.52 -1.05 -1.26 -4.91 118.70 111.09 3n04 s GLU 571 Ca 0.24 -1.21 -0.11 0.00 -0.15 0.00 0.00 54.97 53.74 3n04 s GLU 571 Cb 0.17 0.54 0.18 0.00 -0.44 0.00 0.00 34.13 34.58 3n04 s GLU 571 CO 0.39 -0.76 1.11 -2.00 0.95 0.00 0.00 175.26 174.95 3n04 s GLU 572 N -3.72 0.58 -0.20 -4.83 2.12 -1.26 -4.00 118.70 107.39 3n04 s GLU 572 Ca 0.18 1.32 0.01 0.00 0.36 0.00 0.00 54.97 56.84 3n04 s GLU 572 Cb -0.03 -1.69 0.03 0.00 0.26 0.00 0.00 34.13 32.70 3n04 s GLU 572 CO 0.09 -2.86 -0.16 0.15 -0.54 0.00 0.00 175.26 171.94 3n04 s LYS 574 N -4.62 2.66 -0.19 4.30 1.02 -0.07 -1.87 119.74 120.97 3n04 s LYS 574 Ca 0.67 -0.92 -0.28 0.00 0.02 0.00 0.00 55.97 55.46 3n04 s LYS 574 Cb -0.23 -2.58 -0.00 0.00 -0.52 0.00 0.00 37.83 34.50 3n04 s LYS 574 CO 0.60 -0.31 0.96 0.12 -0.92 0.00 0.00 175.35 175.80 3n04 s PHE 575 N 1.28 3.40 -0.05 3.18 5.36 0.13 -0.80 117.98 130.49 3n04 s PHE 575 Ca 0.01 1.42 0.06 0.00 -0.96 0.00 0.00 56.93 57.46 3n04 s PHE 575 Cb -0.15 -3.17 -0.01 0.00 -0.34 0.00 0.00 43.02 39.35 3n04 s PHE 575 CO -0.11 -0.35 -0.23 0.42 -1.46 0.00 0.00 175.22 173.49 3n04 s ILE 576 N 2.62 1.90 -0.04 3.12 -1.09 0.05 -1.23 121.20 126.52 3n04 s ILE 576 Ca 0.43 -0.99 0.02 0.00 -2.23 0.00 0.00 60.65 57.88 3n04 s ILE 576 Cb -0.16 -1.60 0.01 0.00 -1.58 0.00 0.00 42.46 39.13 3n04 s ILE 576 CO 0.11 0.53 -0.07 -0.54 -1.23 0.00 0.00 174.94 173.74 3n04 s LYS 577 N -0.21 0.92 0.78 2.79 1.02 -0.76 -1.47 119.74 122.82 3n04 s LYS 577 Ca -0.01 -0.20 -0.11 0.00 0.02 0.00 0.00 55.97 55.66 3n04 s LYS 577 Cb -0.12 -0.87 0.06 0.00 -0.52 0.00 0.00 37.83 36.38 3n04 s LYS 577 CO 0.02 0.01 1.09 -0.06 -0.92 0.00 0.00 175.35 175.49 3n04 s PHE 578 N 0.57 2.87 -0.04 3.18 0.40 -0.55 -1.16 117.98 123.26 3n04 s PHE 578 Ca -0.08 1.17 0.18 0.00 -0.60 0.00 0.00 56.93 57.60 3n04 s PHE 578 Cb -0.12 -3.10 -0.27 0.00 0.51 0.00 0.00 43.02 40.04 3n04 s PHE 578 CO 0.01 -1.70 0.39 -2.30 0.70 0.00 0.00 175.22 172.32 3n04 n PRO 580 N -3.39 0.55 -0.13 0.24 -0.02 -1.26 -2.31 135.00 128.68 3n04 n PRO 580 Ca 0.07 -0.16 0.03 0.00 -2.02 0.00 0.00 63.50 61.43 3n04 n PRO 580 Cb 0.56 -1.42 0.10 0.00 -0.02 0.00 0.00 33.50 32.73 3n04 n PRO 580 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 3n04 n ASP 581 N -2.10 1.35 0.00 2.55 3.85 -1.26 -4.89 116.55 116.06 3n04 n ASP 581 Ca -0.03 -2.04 0.00 0.00 -0.71 0.00 0.00 54.79 52.01 3n04 n ASP 581 Cb 0.45 -0.20 0.00 0.00 -1.35 0.00 0.00 41.12 40.02 3n04 n ASP 581 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 3n04 n GLY 582 N 0.77 1.68 3.92 6.12 0.00 -1.26 -5.05 105.19 111.36 3n04 n GLY 582 Ca 0.08 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.82 3n04 n GLY 582 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3n04 s SER 583 N -3.19 4.81 -0.16 1.61 1.04 -1.26 -5.08 113.70 111.46 3n04 s SER 583 Ca 0.00 0.63 0.01 0.00 0.48 0.00 0.00 55.95 57.07 3n04 s SER 583 Cb 0.00 -1.26 0.02 0.00 0.10 0.00 0.00 66.02 64.87 3n04 s SER 583 CO 0.00 -1.65 -0.18 -0.63 0.98 0.00 0.00 173.24 171.76 3n04 s ILE 584 N -3.35 1.86 0.16 -1.02 1.01 -1.26 -4.50 121.20 114.10 3n04 s ILE 584 Ca 0.60 -0.82 -0.10 0.00 0.00 0.00 0.00 60.65 60.33 3n04 s ILE 584 Cb -0.11 -1.70 -0.07 0.00 0.01 0.00 0.00 42.46 40.60 3n04 s ILE 584 CO 0.47 0.51 0.49 -0.94 0.00 0.00 0.00 174.94 175.46 3n04 s SER 585 N 1.28 6.66 -0.02 3.58 1.04 -0.31 -4.92 113.70 121.01 3n04 s SER 585 Ca 0.03 0.88 0.03 0.00 0.48 0.00 0.00 55.95 57.36 3n04 s SER 585 Cb -0.13 -2.21 -0.00 0.00 0.10 0.00 0.00 66.02 63.77 3n04 s SER 585 CO -0.10 0.04 -0.10 -1.61 0.98 0.00 0.00 173.24 172.46 3n04 s GLU 586 N -2.38 0.88 -0.15 4.02 2.02 -1.26 -1.82 118.70 120.01 3n04 s GLU 586 Ca 0.41 -0.34 -0.07 0.00 0.02 0.00 0.00 54.97 54.99 3n04 s GLU 586 Cb -0.13 -0.84 0.06 0.00 0.10 0.00 0.00 34.13 33.33 3n04 s GLU 586 CO 0.20 0.17 0.35 -2.00 0.02 0.00 0.00 175.26 174.01 3n04 s GLU 587 N -0.05 0.30 -0.05 1.61 2.12 -0.37 -4.97 118.70 117.30 3n04 s GLU 587 Ca 0.01 0.76 -0.30 0.00 0.36 0.00 0.00 54.97 55.80 3n04 s GLU 587 Cb -0.06 0.00 -0.03 0.00 0.26 0.00 0.00 34.13 34.31 3n04 s GLU 587 CO -0.00 -0.19 1.05 0.08 -0.54 0.00 0.00 175.26 175.67 3n04 s VAL 588 N 1.67 4.63 -0.07 3.70 1.01 -1.26 0.21 120.40 130.29 3n04 s VAL 588 Ca -0.07 1.90 0.04 0.00 0.00 0.00 0.00 61.98 63.86 3n04 s VAL 588 Cb -0.10 -4.22 -0.00 0.00 0.00 0.00 0.00 36.38 32.06 3n04 s VAL 588 CO -0.11 0.06 -0.21 -0.76 0.00 0.00 0.00 175.10 174.08 3n04 s LEU 589 N 1.66 1.97 0.78 3.92 1.43 -1.26 -4.94 118.68 122.24 3n04 s LEU 589 Ca 0.52 -0.46 -0.11 0.00 -1.03 0.00 0.00 54.13 53.04 3n04 s LEU 589 Cb -0.21 -1.21 0.06 0.00 0.03 0.00 0.00 46.19 44.85 3n04 s LEU 589 CO 0.23 0.16 1.08 -1.61 0.23 0.00 0.00 176.35 176.44 3n04 s GLU 590 N 0.22 2.24 0.30 1.70 2.02 -1.26 -4.42 118.70 119.51 3n04 s GLU 590 Ca -0.12 0.87 -0.27 0.00 0.02 0.00 0.00 54.97 55.47 3n04 s GLU 590 Cb -0.15 -1.92 -0.14 0.00 0.10 0.00 0.00 34.13 32.02 3n04 s GLU 590 CO 0.06 -1.57 0.95 1.17 0.02 0.00 0.00 175.26 175.89 3n04 n LYS 591 N -3.43 1.23 0.00 1.61 4.81 -1.26 -4.76 118.16 116.36 3n04 n LYS 591 Ca 0.08 0.43 0.00 0.00 -0.87 0.00 0.00 58.31 57.95 3n04 n LYS 591 Cb 0.55 -1.79 0.00 0.00 0.02 0.00 0.00 35.03 33.81 3n04 n LYS 591 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3n04 n GLY 592 N 1.29 0.45 3.74 3.14 0.00 0.10 -4.94 105.19 108.98 3n04 n GLY 592 Ca 0.10 -2.20 -0.40 0.00 0.00 0.00 0.00 46.02 43.52 3n04 n GLY 592 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3n04 s VAL 593 N -0.56 4.65 0.01 1.61 1.01 -1.26 -0.85 120.40 125.01 3n04 s VAL 593 Ca 0.00 1.75 -0.03 0.00 0.00 0.00 0.00 61.98 63.70 3n04 s VAL 593 Cb 0.00 -4.17 -0.01 0.00 0.00 0.00 0.00 36.38 32.20 3n04 s VAL 593 CO 0.00 0.36 0.04 -1.00 0.00 0.00 0.00 175.10 174.50 3n04 s HIS 594 N -0.09 0.16 -0.21 5.22 3.76 -0.41 -5.00 115.29 118.72 3n04 s HIS 594 Ca 0.41 -0.35 -0.11 0.00 -0.15 0.00 0.00 55.06 54.86 3n04 s HIS 594 Cb -0.21 -0.13 -0.05 0.00 1.11 0.00 0.00 32.58 33.30 3n04 s HIS 594 CO 0.25 -0.23 0.17 -0.47 -0.85 0.00 0.00 174.74 173.62 3n04 s TYR 595 N -1.38 3.37 -0.06 1.40 5.04 -1.26 -0.35 117.35 124.11 3n04 s TYR 595 Ca -0.15 0.33 0.05 0.00 -2.44 0.00 0.00 57.07 54.85 3n04 s TYR 595 Cb -0.09 -2.25 -0.02 0.00 0.35 0.00 0.00 41.96 39.96 3n04 s TYR 595 CO 0.00 0.17 -0.20 0.14 -1.34 0.00 0.00 175.55 174.33 3n04 s VAL 596 N 0.73 2.56 -0.08 3.14 -7.23 -0.31 -4.97 120.40 114.24 3n04 s VAL 596 Ca 0.09 -0.90 -0.30 0.00 -1.81 0.00 0.00 61.98 59.07 3n04 s VAL 596 Cb -0.12 -1.97 -0.02 0.00 0.56 0.00 0.00 36.38 34.83 3n04 s VAL 596 CO 0.02 0.57 1.04 -1.81 -0.31 0.00 0.00 175.10 174.61 3n04 s ASP 597 N -0.39 7.23 -0.22 4.85 1.01 -1.26 -1.58 116.67 126.30 3n04 s ASP 597 Ca 0.04 1.61 -0.03 0.00 0.71 0.00 0.00 52.55 54.88 3n04 s ASP 597 Cb -0.12 -2.56 0.07 0.00 1.01 0.00 0.00 42.92 41.32 3n04 s ASP 597 CO 0.02 -0.44 0.07 -0.69 0.21 0.00 0.00 175.17 174.34 3n04 s VAL 598 N 1.88 0.34 0.89 -1.27 1.01 0.04 -4.91 120.40 118.37 3n04 s VAL 598 Ca 0.50 -0.63 -0.12 0.00 0.00 0.00 0.00 61.98 61.74 3n04 s VAL 598 Cb -0.20 -1.01 0.12 0.00 0.00 0.00 0.00 36.38 35.29 3n04 s VAL 598 CO 0.20 -0.39 1.10 0.00 0.00 0.00 0.00 175.10 176.02 3n04 s ALA 599 N 1.93 1.67 0.38 5.51 0.00 -1.26 -3.74 121.76 126.24 3n04 s ALA 599 Ca 0.03 -0.18 0.09 0.00 0.00 0.00 0.00 51.96 51.90 3n04 s ALA 599 Cb -0.17 -3.15 0.85 0.00 0.00 0.00 0.00 23.12 20.66 3n04 s ALA 599 CO -0.16 -2.25 1.93 -0.07 0.00 0.00 0.00 175.76 175.21 3n04 h LEU 600 N -1.47 0.58 -3.68 0.00 3.38 -1.94 -2.79 115.31 109.39 3n04 h LEU 600 Ca -0.50 0.02 -0.13 0.00 0.09 0.00 0.00 57.88 57.36 3n04 h LEU 600 Cb 1.29 -0.10 -0.08 0.00 0.09 0.00 0.00 40.66 41.86 3n04 h LEU 600 CO 0.57 0.34 0.17 -0.46 0.09 0.00 0.00 178.44 179.14 3n04 n ASN 601 N -4.50 5.21 -4.22 -0.43 0.23 -1.26 -4.74 115.26 105.55 3n04 n ASN 601 Ca 0.13 -3.12 -0.29 0.00 -0.53 0.00 0.00 54.58 50.78 3n04 n ASN 601 Cb 0.37 -0.73 -0.16 0.00 -2.08 0.00 0.00 39.78 37.18 3n04 n ASN 601 CO 0.00 0.00 0.00 -1.61 -0.93 0.00 0.00 177.26 174.72 3n04 s GLU 602 N -2.92 2.02 -0.28 -3.83 2.02 -1.05 -4.04 118.70 110.62 3n04 s GLU 602 Ca 0.55 -0.77 -0.06 0.00 0.02 0.00 0.00 54.97 54.71 3n04 s GLU 602 Cb 0.43 -1.81 0.00 0.00 0.10 0.00 0.00 34.13 32.86 3n04 s GLU 602 CO 0.14 0.38 0.05 0.08 0.02 0.00 0.00 175.26 175.94 3n04 s VAL 603 N -0.25 3.84 0.19 2.63 1.01 -0.98 -4.71 120.40 122.14 3n04 s VAL 603 Ca 0.01 -0.65 -0.04 0.00 0.00 0.00 0.00 61.98 61.30 3n04 s VAL 603 Cb -0.11 -2.94 -0.05 0.00 0.00 0.00 0.00 36.38 33.28 3n04 s VAL 603 CO 0.01 0.15 0.42 -2.16 0.00 0.00 0.00 175.10 173.52 3n04 s PRO 604 N 1.49 3.61 0.29 2.72 0.04 -1.26 -1.49 135.00 140.40 3n04 s PRO 604 Ca 0.03 -0.11 -0.19 0.00 0.04 0.00 0.00 61.00 60.77 3n04 s PRO 604 Cb -0.17 -2.80 0.02 0.00 0.04 0.00 0.00 34.50 31.59 3n04 s PRO 604 CO 0.01 0.40 0.69 -0.48 0.04 0.00 0.00 177.00 177.66 3n04 s LEU 605 N -2.98 -0.12 -0.04 -3.56 0.05 -0.54 -4.64 118.68 106.84 3n04 s LEU 605 Ca 0.41 -0.73 0.03 0.00 0.05 0.00 0.00 54.13 53.89 3n04 s LEU 605 Cb -0.12 2.58 0.00 0.00 -2.05 0.00 0.00 46.19 46.61 3n04 s LEU 605 CO 0.26 -1.36 -0.13 -0.36 -0.55 0.00 0.00 176.35 174.22 3n04 s PHE 606 N -3.73 1.34 -0.23 3.48 0.08 -1.26 -0.77 117.98 116.89 3n04 s PHE 606 Ca 0.14 -0.38 -0.11 0.00 0.12 0.00 0.00 56.93 56.70 3n04 s PHE 606 Cb -0.05 -0.93 -0.05 0.00 -0.57 0.00 0.00 43.02 41.42 3n04 s PHE 606 CO 0.08 -0.15 0.18 0.42 -0.10 0.00 0.00 175.22 175.65 3n04 s ILE 607 N 0.17 5.35 0.50 0.64 -1.09 0.02 -4.29 121.20 122.51 3n04 s ILE 607 Ca -0.05 0.23 -0.23 0.00 -2.23 0.00 0.00 60.65 58.38 3n04 s ILE 607 Cb -0.11 -3.52 -0.06 0.00 -1.58 0.00 0.00 42.46 37.19 3n04 s ILE 607 CO 0.01 0.35 1.28 -0.13 -1.23 0.00 0.00 174.94 175.22 3n04 s ARG 608 N 1.01 3.44 0.09 2.79 0.52 -0.21 -0.89 118.95 125.71 3n04 s ARG 608 Ca 0.09 2.06 -0.35 0.00 -0.52 0.00 0.00 55.73 57.01 3n04 s ARG 608 Cb -0.13 -2.36 -0.18 0.00 0.52 0.00 0.00 34.95 32.80 3n04 s ARG 608 CO 0.04 -0.89 0.91 0.45 0.02 0.00 0.00 175.30 175.83 3n04 n SER 609 N -0.72 -0.20 -0.08 0.23 2.88 -0.78 -1.94 113.62 113.01 3n04 n SER 609 Ca 0.09 1.15 -0.01 0.00 -1.33 0.00 0.00 58.87 58.76 3n04 n SER 609 Cb 0.46 -0.98 -0.00 0.00 -0.75 0.00 0.00 64.21 62.94 3n04 n SER 609 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3n04 n GLY 610 N 1.76 0.46 3.43 0.46 0.00 -1.26 -5.01 105.19 105.02 3n04 n GLY 610 Ca 0.19 -0.18 -0.22 0.00 0.00 0.00 0.00 46.02 45.81 3n04 n GLY 610 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3n04 s LYS 611 N -0.89 1.55 0.11 1.61 -0.14 -0.82 -4.69 119.74 116.47 3n04 s LYS 611 Ca 0.00 -1.75 -0.09 0.00 -1.36 0.00 0.00 55.97 52.77 3n04 s LYS 611 Cb 0.00 -1.35 -0.00 0.00 -1.68 0.00 0.00 37.83 34.80 3n04 s LYS 611 CO 0.00 0.16 0.24 0.00 -0.76 0.00 0.00 175.35 174.98 3n04 s ILE 613 N -3.88 0.93 0.14 0.00 -4.36 -0.25 -4.70 121.20 109.06 3n04 s ILE 613 Ca 0.08 -1.26 -0.20 0.00 -0.26 0.00 0.00 60.65 59.00 3n04 s ILE 613 Cb 0.04 -0.95 -0.07 0.00 1.25 0.00 0.00 42.46 42.72 3n04 s ILE 613 CO -0.08 -0.30 0.65 -2.16 0.24 0.00 0.00 174.94 173.29 3n04 s PRO 614 N -1.78 4.27 -0.13 0.37 0.04 -1.26 -1.35 135.00 135.17 3n04 s PRO 614 Ca -0.04 0.84 0.01 0.00 0.04 0.00 0.00 61.00 61.85 3n04 s PRO 614 Cb -0.09 -3.13 0.02 0.00 0.04 0.00 0.00 34.50 31.33 3n04 s PRO 614 CO 0.02 0.55 -0.13 0.08 0.04 0.00 0.00 177.00 177.56 3n04 s VAL 615 N -1.25 1.43 0.62 -0.36 1.01 -0.17 -4.48 120.40 117.20 3n04 s VAL 615 Ca 0.35 -0.56 -0.09 0.00 0.00 0.00 0.00 61.98 61.67 3n04 s VAL 615 Cb -0.19 -1.34 -0.01 0.00 0.00 0.00 0.00 36.38 34.83 3n04 s VAL 615 CO 0.21 0.43 0.98 0.00 0.00 0.00 0.00 175.10 176.73 3n04 s ALA 616 N 1.34 3.13 0.61 5.51 0.00 -0.77 -2.49 121.76 129.10 3n04 s ALA 616 Ca 0.01 -0.39 -0.16 0.00 0.00 0.00 0.00 51.96 51.41 3n04 s ALA 616 Cb -0.13 -2.87 -0.02 0.00 0.00 0.00 0.00 23.12 20.09 3n04 s ALA 616 CO -0.07 -0.81 1.11 -1.21 0.00 0.00 0.00 175.76 174.78 3n04 s GLU 617 N -5.13 3.05 0.21 0.00 0.41 -1.26 -4.55 118.70 111.44 3n04 s GLU 617 Ca 0.55 1.43 -0.31 0.00 -0.41 0.00 0.00 54.97 56.22 3n04 s GLU 617 Cb -0.11 -1.98 -0.11 0.00 -1.78 0.00 0.00 34.13 30.15 3n04 s GLU 617 CO 0.50 -1.06 1.61 0.00 -0.49 0.00 0.00 175.26 175.82 3n04 s ALA 618 N -2.19 3.81 0.23 5.21 0.00 -1.26 -4.67 121.76 122.89 3n04 s ALA 618 Ca 0.68 1.47 0.05 0.00 0.00 0.00 0.00 51.96 54.17 3n04 s ALA 618 Cb -0.21 -3.64 -0.05 0.00 0.00 0.00 0.00 23.12 19.22 3n04 s ALA 618 CO 0.36 -0.86 -0.06 0.00 0.00 0.00 0.00 175.76 175.20 3n04 s ALA 619 N 0.82 1.93 -1.37 0.00 0.00 -1.26 -5.04 121.76 116.85 3n04 s ALA 619 Ca 0.69 -1.74 0.24 0.00 0.00 0.00 0.00 51.96 51.15 3n04 s ALA 619 Cb -0.46 0.23 0.26 0.00 0.00 0.00 0.00 23.12 23.14 3n04 s ALA 619 CO 0.36 -0.12 1.24 0.39 0.00 0.00 0.00 175.76 177.63 3n04 n GLU 620 N -0.42 0.42 -3.69 0.00 1.02 -1.26 -4.72 120.64 111.99 3n04 n GLU 620 Ca -0.07 -0.30 -0.10 0.00 -0.02 0.00 0.00 57.16 56.67 3n04 n GLU 620 Cb 0.63 -1.49 -0.06 0.00 -0.02 0.00 0.00 31.44 30.50 3n04 n GLU 620 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3n04 h VAL 622 N 2.59 1.02 -0.91 0.00 2.07 -1.91 -2.16 116.25 116.94 3n04 h VAL 622 Ca -0.33 -0.31 0.18 0.00 0.82 0.00 0.00 66.70 67.06 3n04 h VAL 622 Cb 1.23 0.04 -0.11 0.00 -1.52 0.00 0.00 31.29 30.94 3n04 h VAL 622 CO 0.48 0.16 0.49 0.50 0.02 0.00 0.00 177.57 179.23 3n04 h LYS 623 N 0.90 0.60 -0.21 1.57 3.64 -1.98 -2.47 116.57 118.62 3n04 h LYS 623 Ca 0.36 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.70 3n04 h LYS 623 Cb 0.18 -0.14 0.00 0.00 -0.41 0.00 0.00 32.23 31.87 3n04 h LYS 623 CO -0.18 0.40 0.00 -0.25 -2.27 0.00 0.00 179.45 177.15 3n04 n ASP 624 N -4.88 1.62 -4.70 4.20 8.00 -0.82 -4.88 116.55 115.10 3n04 n ASP 624 Ca 0.21 -1.79 -0.42 0.00 0.71 0.00 0.00 54.79 53.49 3n04 n ASP 624 Cb 0.54 -0.14 -0.03 0.00 -0.02 0.00 0.00 41.12 41.47 3n04 n ASP 624 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 3n04 s ILE 625 N -1.72 3.42 -0.54 0.53 1.01 -0.93 -4.87 121.20 118.09 3n04 s ILE 625 Ca 0.29 0.91 -0.22 0.00 0.00 0.00 0.00 60.65 61.63 3n04 s ILE 625 Cb 0.15 -3.58 0.05 0.00 0.01 0.00 0.00 42.46 39.09 3n04 s ILE 625 CO 0.22 0.02 0.80 -0.62 0.00 0.00 0.00 174.94 175.37 3n04 s ASP 626 N 1.72 6.27 0.00 3.58 2.15 -1.26 -4.90 116.67 124.23 3n04 s ASP 626 Ca 0.66 -0.66 0.23 0.00 0.43 0.00 0.00 52.55 53.21 3n04 s ASP 626 Cb -0.35 -2.37 0.51 0.00 -0.30 0.00 0.00 42.92 40.41 3n04 s ASP 626 CO 0.29 -1.10 1.44 0.35 -0.17 0.00 0.00 175.17 175.98 3n04 n THR 627 N 5.91 0.33 -0.01 1.71 -2.24 -1.26 -4.52 114.28 114.20 3n04 n THR 627 Ca -0.02 -0.58 -0.13 0.00 -2.27 0.00 0.00 64.05 61.05 3n04 n THR 627 Cb 0.46 0.87 -0.10 0.00 -2.10 0.00 0.00 70.33 69.46 3n04 n THR 627 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 3n04 h GLU 628 N 3.80 -0.05 -5.86 -0.78 4.39 -2.03 -3.52 114.58 110.53 3n04 h GLU 628 Ca 0.00 0.00 -0.53 0.00 0.34 0.00 0.00 59.36 59.17 3n04 h GLU 628 Cb 0.83 0.01 -0.25 0.00 -0.10 0.00 0.00 28.75 29.24 3n04 h GLU 628 CO 0.00 0.56 -0.82 -0.80 -1.16 0.00 0.00 179.01 176.78 3n04 s ASN 629 N -5.78 2.23 0.10 1.42 0.02 -1.26 -5.24 114.94 106.44 3n04 s ASN 629 Ca -0.16 -0.53 0.10 0.00 -1.02 0.00 0.00 52.86 51.25 3n04 s ASN 629 Cb 0.00 -0.16 -0.04 0.00 0.02 0.00 0.00 41.25 41.07 3n04 s ASN 629 CO 0.62 0.10 -0.24 0.00 0.02 0.00 0.00 177.10 177.60 3n04 s GLN 631 N -1.28 1.61 -0.19 -0.60 -2.07 -1.04 -4.87 119.66 111.22 3n04 s GLN 631 Ca 0.05 -1.24 -0.09 0.00 -1.82 0.00 0.00 55.36 52.27 3n04 s GLN 631 Cb -0.09 -1.98 -0.05 0.00 -1.09 0.00 0.00 33.01 29.80 3n04 s GLN 631 CO 0.02 0.48 0.10 -0.51 -1.32 0.00 0.00 175.29 174.05 3n04 s LEU 632 N -1.87 4.01 -0.08 2.60 1.43 -1.26 -0.99 118.68 122.51 3n04 s LEU 632 Ca 0.14 0.15 0.05 0.00 -1.03 0.00 0.00 54.13 53.45 3n04 s LEU 632 Cb -0.10 -2.03 -0.01 0.00 0.03 0.00 0.00 46.19 44.09 3n04 s LEU 632 CO 0.06 0.17 -0.24 -0.63 0.23 0.00 0.00 176.35 175.94 3n04 s ILE 633 N 0.39 2.06 -1.71 -0.59 -1.09 -0.46 -4.96 121.20 114.84 3n04 s ILE 633 Ca 0.06 -1.04 0.00 0.00 -2.23 0.00 0.00 60.65 57.43 3n04 s ILE 633 Cb -0.12 -1.76 0.00 0.00 -1.58 0.00 0.00 42.46 39.00 3n04 s ILE 633 CO -0.01 0.57 0.00 0.61 -1.23 0.00 0.00 174.94 174.88 3n04 n GLY 634 N 3.25 0.48 3.82 6.18 0.00 -1.26 -1.09 105.19 116.56 3n04 n GLY 634 Ca -0.18 -1.55 -0.38 0.00 0.00 0.00 0.00 46.02 43.91 3n04 n GLY 634 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3n04 s TYR 635 N -3.05 3.70 0.36 1.61 2.02 0.00 -4.98 117.35 117.01 3n04 s TYR 635 Ca 0.00 0.99 0.08 0.00 -0.37 0.00 0.00 57.07 57.77 3n04 s TYR 635 Cb 0.00 -2.34 0.80 0.00 -0.40 0.00 0.00 41.96 40.02 3n04 s TYR 635 CO 0.00 0.57 1.89 1.49 -1.57 0.00 0.00 175.55 177.94 3n04 h GLU 636 N 4.98 0.69 -0.00 -0.62 4.57 -1.90 -2.53 114.58 119.77 3n04 h GLU 636 Ca -0.50 -0.04 0.00 0.00 -1.18 0.00 0.00 59.36 57.64 3n04 h GLU 636 Cb 1.21 -0.16 0.00 0.00 -0.16 0.00 0.00 28.75 29.65 3n04 h GLU 636 CO 0.64 0.46 -0.04 0.41 -1.18 0.00 0.00 179.01 179.29 3n04 n GLY 637 N -1.44 -0.91 3.97 1.92 0.00 -1.26 -4.65 105.19 102.82 3n04 n GLY 637 Ca 0.16 -0.25 -0.21 0.00 0.00 0.00 0.00 46.02 45.72 3n04 n GLY 637 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3n04 s SER 638 N -2.29 5.60 0.11 1.61 1.04 -0.95 -4.87 113.70 113.95 3n04 s SER 638 Ca 0.36 0.05 0.01 0.00 0.48 0.00 0.00 55.95 56.85 3n04 s SER 638 Cb 0.21 -1.16 -0.04 0.00 0.10 0.00 0.00 66.02 65.13 3n04 s SER 638 CO 0.42 -0.86 -0.02 -0.94 0.98 0.00 0.00 173.24 172.82 3n04 s SER 639 N -4.31 0.88 -0.01 7.02 1.04 -1.26 -0.48 113.70 116.57 3n04 s SER 639 Ca 0.52 -1.09 -0.00 0.00 0.48 0.00 0.00 55.95 55.87 3n04 s SER 639 Cb -0.10 0.16 0.02 0.00 0.10 0.00 0.00 66.02 66.20 3n04 s SER 639 CO 0.37 -0.57 0.02 -0.47 0.98 0.00 0.00 173.24 173.58 3n04 s TYR 640 N -3.77 0.02 -0.49 5.02 5.04 0.13 -4.50 117.35 118.81 3n04 s TYR 640 Ca 0.16 0.10 -0.20 0.00 -2.44 0.00 0.00 57.07 54.69 3n04 s TYR 640 Cb 0.06 -0.17 0.04 0.00 0.35 0.00 0.00 41.96 42.25 3n04 s TYR 640 CO -0.02 -0.06 0.67 0.99 -1.34 0.00 0.00 175.55 175.79 3n04 s THR 641 N 0.76 4.79 -0.12 4.34 2.01 -1.26 0.05 115.64 126.21 3n04 s THR 641 Ca -0.06 -0.17 -0.24 0.00 0.31 0.00 0.00 61.69 61.53 3n04 s THR 641 Cb -0.09 -4.30 -0.03 0.00 0.01 0.00 0.00 72.50 68.10 3n04 s THR 641 CO -0.02 -0.77 0.73 -0.22 -0.69 0.00 0.00 174.62 173.65 3n04 s LEU 642 N 2.88 4.24 -0.17 4.42 2.96 0.80 -4.91 118.68 128.89 3n04 s LEU 642 Ca 0.20 1.12 -0.16 0.00 -0.22 0.00 0.00 54.13 55.06 3n04 s LEU 642 Cb -0.16 -3.10 -0.04 0.00 0.50 0.00 0.00 46.19 43.39 3n04 s LEU 642 CO 0.15 -0.24 0.41 -0.47 -1.32 0.00 0.00 176.35 174.89 3n04 s TYR 643 N 1.45 3.44 -0.11 5.38 5.04 -1.26 -1.27 117.35 130.03 3n04 s TYR 643 Ca 0.36 0.71 -0.07 0.00 -2.44 0.00 0.00 57.07 55.64 3n04 s TYR 643 Cb -0.17 -2.51 0.04 0.00 0.35 0.00 0.00 41.96 39.67 3n04 s TYR 643 CO 0.15 0.09 0.27 -1.83 -1.34 0.00 0.00 175.55 172.89 3n04 s GLU 644 N 0.95 0.26 0.00 4.97 -1.05 0.16 -4.22 118.70 119.78 3n04 s GLU 644 Ca 0.21 0.51 0.00 0.00 -0.15 0.00 0.00 54.97 55.54 3n04 s GLU 644 Cb -0.15 -0.03 0.00 0.00 -0.44 0.00 0.00 34.13 33.51 3n04 s GLU 644 CO 0.08 -0.13 0.00 -0.40 0.95 0.00 0.00 175.26 175.76 3n04 n ASP 645 N 3.85 0.56 0.00 0.83 5.68 -1.26 -4.33 116.55 121.89 3n04 n ASP 645 Ca -0.21 -0.46 0.13 0.00 -0.50 0.00 0.00 54.79 53.76 3n04 n ASP 645 Cb 0.55 0.00 0.60 0.00 -1.14 0.00 0.00 41.12 41.12 3n04 n ASP 645 CO 0.00 0.00 0.00 -0.90 -1.33 0.00 0.00 177.20 174.97 3n04 n ASP 646 N -1.11 0.01 0.00 -1.12 5.68 -1.26 -4.90 116.55 113.84 3n04 n ASP 646 Ca 0.00 0.50 0.00 0.00 -0.50 0.00 0.00 54.79 54.79 3n04 n ASP 646 Cb 0.00 -0.50 0.00 0.00 -1.14 0.00 0.00 41.12 39.48 3n04 n ASP 646 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3n04 n GLY 647 N 1.39 0.34 0.48 6.12 0.00 -1.26 -4.80 105.19 107.46 3n04 n GLY 647 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.09 3n04 n GLY 647 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 3n04 n ILE 648 N -2.52 0.00 -2.92 -0.61 5.41 -1.26 -0.96 119.36 116.50 3n04 n ILE 648 Ca 0.00 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.75 3n04 n ILE 648 Cb 0.18 -0.87 0.00 0.00 -0.71 0.00 0.00 39.64 38.23 3n04 n ILE 648 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 176.55 177.96 3n04 n HIS 649 N -2.65 -2.56 -1.61 1.39 8.25 -1.26 -1.69 115.22 115.09 3n04 n HIS 649 Ca 0.00 0.00 0.02 0.00 -0.26 0.00 0.00 57.72 57.48 3n04 n HIS 649 Cb 0.45 0.00 0.19 0.00 1.12 0.00 0.00 29.99 31.76 3n04 n HIS 649 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 3n04 n LYS 650 N -0.85 1.80 -3.05 -0.41 5.02 -1.17 -4.72 118.16 114.78 3n04 n LYS 650 Ca 0.00 -3.37 -0.44 0.00 -2.02 0.00 0.00 58.31 52.48 3n04 n LYS 650 Cb 0.00 -1.71 -0.00 0.00 -0.02 0.00 0.00 35.03 33.30 3n04 n LYS 650 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 3n04 s ASP 651 N -3.16 7.12 0.04 4.39 2.15 -1.26 -4.82 116.67 121.12 3n04 s ASP 651 Ca 0.40 -3.11 0.14 0.00 0.43 0.00 0.00 52.55 50.41 3n04 s ASP 651 Cb 0.38 -2.35 -0.17 0.00 -0.30 0.00 0.00 42.92 40.48 3n04 s ASP 651 CO -0.05 -0.64 0.83 1.88 -0.17 0.00 0.00 175.17 177.02 3n04 h TYR 652 N 7.10 0.00 -0.44 -5.34 0.05 -2.04 -3.41 116.97 112.90 3n04 h TYR 652 Ca 0.27 0.00 -0.09 0.00 0.05 0.00 0.00 58.73 58.96 3n04 h TYR 652 Cb 0.88 0.00 -0.02 0.00 1.01 0.00 0.00 36.73 38.60 3n04 h TYR 652 CO 1.02 0.77 -0.09 0.22 -1.05 0.00 0.00 178.16 179.02 3n04 h ASP 653 N 0.00 0.77 -3.98 3.88 1.82 -2.04 -3.48 116.42 113.39 3n04 h ASP 653 Ca -0.19 -0.22 -0.56 0.00 -0.39 0.00 0.00 57.03 55.67 3n04 h ASP 653 Cb 1.76 -0.21 0.14 0.00 0.68 0.00 0.00 39.33 41.70 3n04 h ASP 653 CO 0.07 0.89 0.57 0.29 -1.61 0.00 0.00 179.24 179.45 3n04 n LYS 654 N -4.17 1.63 0.24 0.28 4.76 -1.26 -4.93 118.16 114.71 3n04 n LYS 654 Ca 0.02 0.60 0.09 0.00 -2.87 0.00 0.00 58.31 56.15 3n04 n LYS 654 Cb 0.36 -2.55 0.62 0.00 -1.84 0.00 0.00 35.03 31.62 3n04 n LYS 654 CO 0.00 0.00 0.00 1.57 -1.37 0.00 0.00 177.40 177.60 3n04 h LYS 655 N 1.36 0.00 0.00 1.97 2.10 -1.96 -2.46 116.57 117.58 3n04 h LYS 655 Ca -0.51 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.14 3n04 h LYS 655 Cb 1.31 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.64 3n04 h LYS 655 CO 0.57 0.16 0.00 0.93 -2.00 0.00 0.00 179.45 179.11 3n04 h GLU 656 N 0.00 0.00 0.00 0.07 3.07 -1.97 -2.63 114.58 113.13 3n04 h GLU 656 Ca -0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 3n04 h GLU 656 Cb 0.35 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.26 3n04 h GLU 656 CO 0.02 0.00 0.00 0.09 -1.40 0.00 0.00 179.01 177.72 3n04 n ASN 657 N -2.32 0.01 -4.31 1.42 3.02 -0.93 -4.78 115.26 107.37 3n04 n ASN 657 Ca 0.00 0.50 -0.32 0.00 -0.03 0.00 0.00 54.58 54.73 3n04 n ASN 657 Cb 0.13 -0.50 -0.16 0.00 -0.61 0.00 0.00 39.78 38.64 3n04 n ASN 657 CO 0.00 0.00 0.00 -0.31 -2.62 0.00 0.00 177.26 174.33 3n04 s TYR 658 N -3.00 2.59 -0.03 3.10 2.02 -0.99 -0.66 117.35 120.38 3n04 s TYR 658 Ca 0.12 -0.72 -0.02 0.00 -0.37 0.00 0.00 57.07 56.07 3n04 s TYR 658 Cb 0.16 -1.69 0.01 0.00 -0.40 0.00 0.00 41.96 40.04 3n04 s TYR 658 CO 0.44 -0.22 0.07 -0.98 -1.57 0.00 0.00 175.55 173.29 3n04 s ARG 659 N 0.03 0.06 -0.20 -0.62 1.70 -0.39 -4.99 118.95 114.54 3n04 s ARG 659 Ca -0.08 0.13 -0.25 0.00 -0.47 0.00 0.00 55.73 55.06 3n04 s ARG 659 Cb -0.15 -0.02 -0.01 0.00 -0.57 0.00 0.00 34.95 34.20 3n04 s ARG 659 CO 0.05 -0.05 0.85 0.08 -1.08 0.00 0.00 175.30 175.15 3n04 s VAL 660 N 0.29 4.85 -0.14 4.99 1.01 -1.26 -0.14 120.40 129.99 3n04 s VAL 660 Ca -0.02 1.64 -0.05 0.00 0.00 0.00 0.00 61.98 63.56 3n04 s VAL 660 Cb -0.03 -4.14 -0.03 0.00 0.00 0.00 0.00 36.38 32.17 3n04 s VAL 660 CO -0.01 -0.02 0.01 -0.76 0.00 0.00 0.00 175.10 174.32 3n04 s LEU 661 N 2.46 3.58 -0.13 3.92 1.43 0.11 -4.95 118.68 125.10 3n04 s LEU 661 Ca 0.38 0.04 0.03 0.00 -1.03 0.00 0.00 54.13 53.55 3n04 s LEU 661 Cb -0.16 -1.87 0.01 0.00 0.03 0.00 0.00 46.19 44.20 3n04 s LEU 661 CO 0.10 0.24 -0.22 -0.89 0.23 0.00 0.00 176.35 175.81 3n04 s THR 662 N -0.03 2.02 -2.11 5.49 2.01 -1.26 0.22 115.64 121.99 3n04 s THR 662 Ca 0.04 -0.97 0.31 0.00 0.31 0.00 0.00 61.69 61.38 3n04 s THR 662 Cb -0.13 -1.78 0.83 0.00 0.01 0.00 0.00 72.50 71.44 3n04 s THR 662 CO 0.02 0.55 2.13 1.17 -0.69 0.00 0.00 174.62 177.79