#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3f06 s VAL 15 N 0.00 5.33 0.34 1.96 0.11 -1.26 -4.85 120.40 122.03 3f06 s VAL 15 Ca 0.00 0.28 -0.27 0.00 -2.93 0.00 0.00 61.98 59.07 3f06 s VAL 15 Cb 0.00 -3.54 -0.13 0.00 -1.53 0.00 0.00 36.38 31.18 3f06 s VAL 15 CO 0.00 0.33 1.01 -2.65 -3.33 0.00 0.00 175.10 170.46 3f06 n PRO 16 N 4.26 1.37 -3.35 1.54 -0.02 -1.26 -4.49 135.00 133.05 3f06 n PRO 16 Ca -0.14 0.48 -0.38 0.00 -2.02 0.00 0.00 63.50 61.44 3f06 n PRO 16 Cb 0.52 -1.92 -0.06 0.00 -0.02 0.00 0.00 33.50 32.02 3f06 n PRO 16 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 3f06 s VAL 17 N -1.15 4.84 -0.17 -1.45 1.01 -0.15 -0.32 120.40 123.00 3f06 s VAL 17 Ca 0.60 1.08 0.00 0.00 0.00 0.00 0.00 61.98 63.67 3f06 s VAL 17 Cb -0.64 -3.83 0.03 0.00 0.00 0.00 0.00 36.38 31.94 3f06 s VAL 17 CO 0.59 0.56 -0.10 -0.47 0.00 0.00 0.00 175.10 175.68 3f06 s TYR 18 N -1.11 2.14 -1.17 5.22 6.14 -0.62 -1.01 117.35 126.95 3f06 s TYR 18 Ca 0.27 -1.32 -0.21 0.00 0.64 0.00 0.00 57.07 56.46 3f06 s TYR 18 Cb -0.18 -1.54 0.04 0.00 0.42 0.00 0.00 41.96 40.70 3f06 s TYR 18 CO 0.17 -0.68 1.67 0.42 0.64 0.00 0.00 175.55 177.77 3f06 s ILE 19 N 1.49 3.96 0.32 3.14 -1.09 -0.50 -0.72 121.20 127.80 3f06 s ILE 19 Ca 0.02 -1.33 0.09 0.00 -2.23 0.00 0.00 60.65 57.20 3f06 s ILE 19 Cb -0.15 -5.02 -0.05 0.00 -1.58 0.00 0.00 42.46 35.66 3f06 s ILE 19 CO -0.09 -1.84 -0.01 -0.47 -1.23 0.00 0.00 174.94 171.30 3f06 s TYR 20 N 5.46 2.55 0.00 3.97 5.04 -1.05 -4.90 117.35 128.42 3f06 s TYR 20 Ca 0.53 -0.38 0.00 0.00 -2.44 0.00 0.00 57.07 54.79 3f06 s TYR 20 Cb 0.02 -1.37 0.00 0.00 0.35 0.00 0.00 41.96 40.95 3f06 s TYR 20 CO 0.02 0.53 0.00 0.45 -1.34 0.00 0.00 175.55 175.21 3f06 n SER 21 N -0.91 0.00 -0.35 4.32 2.88 -1.26 -3.80 113.62 114.50 3f06 n SER 21 Ca -0.05 0.00 0.25 0.00 -1.33 0.00 0.00 58.87 57.74 3f06 n SER 21 Cb 0.61 0.00 0.51 0.00 -0.75 0.00 0.00 64.21 64.58 3f06 n SER 21 CO 0.00 0.00 0.00 -0.65 -1.23 0.00 0.00 175.04 173.16 3f06 h PRO 22 N 0.00 0.34 -0.14 -1.46 0.11 -1.99 0.53 132.00 129.39 3f06 h PRO 22 Ca 0.00 -0.02 -0.12 0.00 0.11 0.00 0.00 66.00 65.96 3f06 h PRO 22 Cb 0.00 -0.08 -0.01 0.00 0.11 0.00 0.00 31.00 31.02 3f06 h PRO 22 CO 0.00 0.23 -0.45 0.93 -0.21 0.00 0.00 178.00 178.49 3f06 h GLU 23 N 0.35 0.35 0.24 1.05 3.07 -1.99 -2.57 114.58 115.08 3f06 h GLU 23 Ca 0.67 -0.19 -0.01 0.00 -0.50 0.00 0.00 59.36 59.33 3f06 h GLU 23 Cb 1.70 0.01 0.00 0.00 -0.84 0.00 0.00 28.75 29.62 3f06 h GLU 23 CO -0.40 0.74 -0.12 -0.92 -1.40 0.00 0.00 179.01 176.91 3f06 h TYR 24 N 0.29 -0.30 -1.00 4.33 -0.00 -0.39 -2.60 116.97 117.30 3f06 h TYR 24 Ca 0.02 -0.01 0.15 0.00 -0.00 0.00 0.00 58.73 58.90 3f06 h TYR 24 Cb 0.91 0.10 -0.10 0.00 -0.00 0.00 0.00 36.73 37.64 3f06 h TYR 24 CO 0.02 0.05 0.61 0.28 -0.00 0.00 0.00 178.16 179.13 3f06 h VAL 25 N -0.94 0.81 -0.06 1.81 2.07 -1.17 0.46 116.25 119.24 3f06 h VAL 25 Ca -0.03 -0.30 -0.12 0.00 0.82 0.00 0.00 66.70 67.06 3f06 h VAL 25 Cb 0.49 -0.14 -0.01 0.00 -1.52 0.00 0.00 31.29 30.11 3f06 h VAL 25 CO 0.05 0.16 -0.53 0.28 0.02 0.00 0.00 177.57 177.56 3f06 h SER 26 N 0.87 0.18 -0.53 0.57 0.02 -1.54 -1.86 113.55 111.26 3f06 h SER 26 Ca 0.54 -0.09 -0.11 0.00 -0.84 0.00 0.00 61.79 61.28 3f06 h SER 26 Cb 0.69 -0.05 -0.02 0.00 0.14 0.00 0.00 62.40 63.16 3f06 h SER 26 CO -0.33 0.68 -0.09 -0.03 -1.14 0.00 0.00 176.83 175.92 3f06 h MET 27 N 0.13 1.00 -0.38 3.45 -1.53 -0.58 -3.11 114.93 113.91 3f06 h MET 27 Ca 0.00 -0.36 -0.15 0.00 -3.44 0.00 0.00 59.70 55.75 3f06 h MET 27 Cb 0.98 -0.07 -0.01 0.00 -0.55 0.00 0.00 31.60 31.95 3f06 h MET 27 CO 0.08 1.04 -0.34 0.00 0.14 0.00 0.00 176.91 177.83 3f06 n ASP 29 N -4.07 0.10 -0.11 0.00 10.43 -0.72 -2.13 116.55 120.05 3f06 n ASP 29 Ca -0.01 0.55 0.15 0.00 2.57 0.00 0.00 54.79 58.04 3f06 n ASP 29 Cb 0.51 -0.56 0.76 0.00 1.84 0.00 0.00 41.12 43.67 3f06 n ASP 29 CO 0.00 0.00 0.00 -1.20 -1.07 0.00 0.00 177.20 174.93 3f06 n SER 30 N -1.64 0.38 -4.58 -2.24 7.64 -1.10 -3.62 113.62 108.47 3f06 n SER 30 Ca 0.00 -0.84 -0.43 0.00 1.01 0.00 0.00 58.87 58.61 3f06 n SER 30 Cb 0.02 -0.06 -0.04 0.00 -1.01 0.00 0.00 64.21 63.13 3f06 n SER 30 CO 0.00 0.00 0.00 -0.22 -3.01 0.00 0.00 175.04 171.81 3f06 s LEU 31 N -2.22 3.97 0.45 -3.43 1.98 -0.91 -4.94 118.68 113.59 3f06 s LEU 31 Ca 0.38 0.27 0.25 0.00 -2.89 0.00 0.00 54.13 52.14 3f06 s LEU 31 Cb 0.21 -3.24 1.27 0.00 0.66 0.00 0.00 46.19 45.09 3f06 s LEU 31 CO 0.41 -1.01 1.79 0.00 -1.89 0.00 0.00 176.35 175.64 3f06 h ALA 32 N 8.93 2.54 0.00 5.97 0.00 -1.91 -1.98 119.26 132.80 3f06 h ALA 32 Ca -0.24 0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.68 3f06 h ALA 32 Cb 1.08 0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.91 3f06 h ALA 32 CO 1.02 -0.92 -0.11 0.87 0.00 0.00 0.00 179.25 180.12 3f06 h LYS 33 N 0.25 0.00 -1.70 0.00 1.79 -1.97 -3.31 116.57 111.62 3f06 h LYS 33 Ca 0.57 0.00 -0.48 0.00 -2.18 0.00 0.00 60.65 58.57 3f06 h LYS 33 Cb 1.75 0.00 -0.36 0.00 -1.58 0.00 0.00 32.23 32.04 3f06 h LYS 33 CO -0.19 0.11 -1.05 0.44 -1.08 0.00 0.00 179.45 177.67 3f06 n ILE 34 N -3.66 -0.36 -1.66 1.86 -5.35 -0.75 -5.05 119.36 104.38 3f06 n ILE 34 Ca -0.02 -3.89 -0.47 0.00 -0.27 0.00 0.00 62.75 58.11 3f06 n ILE 34 Cb 0.23 -0.70 -0.04 0.00 -1.74 0.00 0.00 39.64 37.38 3f06 n ILE 34 CO 0.00 0.00 0.00 -0.81 -1.76 0.00 0.00 176.55 173.98 3f06 n PRO 35 N 0.85 2.27 -0.95 6.28 -0.04 -1.20 -2.41 135.00 139.79 3f06 n PRO 35 Ca 0.21 0.81 0.00 0.00 -0.04 0.00 0.00 63.50 64.48 3f06 n PRO 35 Cb 0.61 -2.77 0.00 0.00 -0.04 0.00 0.00 33.50 31.29 3f06 n PRO 35 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 3f06 n LYS 36 N 7.14 -0.40 -0.15 0.54 4.01 -1.24 -4.91 118.16 123.16 3f06 n LYS 36 Ca 0.24 0.10 -0.01 0.00 -0.51 0.00 0.00 58.31 58.13 3f06 n LYS 36 Cb 0.33 -3.43 0.24 0.00 -0.51 0.00 0.00 35.03 31.66 3f06 n LYS 36 CO 0.00 0.00 0.00 -0.09 -1.11 0.00 0.00 177.40 176.20 3f06 h ARG 37 N 1.17 0.85 -0.18 1.97 2.43 -1.82 -2.26 114.38 116.55 3f06 h ARG 37 Ca 0.00 -0.11 -0.00 0.00 -0.81 0.00 0.00 59.98 59.05 3f06 h ARG 37 Cb 0.20 -0.16 -0.01 0.00 -0.42 0.00 0.00 29.97 29.58 3f06 h ARG 37 CO 0.00 0.67 0.10 0.00 -1.51 0.00 0.00 179.97 179.22 3f06 h ALA 38 N 1.46 0.23 -0.19 2.80 0.00 -1.88 -1.17 119.26 120.50 3f06 h ALA 38 Ca 0.21 -0.06 0.02 0.00 0.00 0.00 0.00 54.91 55.07 3f06 h ALA 38 Cb 0.10 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 17.80 3f06 h ALA 38 CO -0.03 -0.23 0.08 0.77 0.00 0.00 0.00 179.25 179.84 3f06 h SER 39 N 0.18 0.10 -0.73 0.00 0.02 -1.77 -0.09 113.55 111.26 3f06 h SER 39 Ca 0.06 0.02 0.06 0.00 -0.84 0.00 0.00 61.79 61.09 3f06 h SER 39 Cb 0.08 -0.00 -0.06 0.00 0.14 0.00 0.00 62.40 62.56 3f06 h SER 39 CO -0.01 0.08 0.42 0.24 -1.14 0.00 0.00 176.83 176.43 3f06 h MET 40 N 0.17 0.74 0.11 3.45 2.07 -1.27 0.45 114.93 120.66 3f06 h MET 40 Ca 0.08 -0.04 -0.01 0.00 -2.07 0.00 0.00 59.70 57.66 3f06 h MET 40 Cb 0.04 -0.17 0.00 0.00 -1.87 0.00 0.00 31.60 29.60 3f06 h MET 40 CO -0.07 0.49 -0.05 0.28 1.07 0.00 0.00 176.91 178.63 3f06 h VAL 41 N 0.77 1.09 -0.13 -2.22 2.07 -0.89 -1.95 116.25 114.98 3f06 h VAL 41 Ca 0.33 -0.81 0.01 0.00 0.82 0.00 0.00 66.70 67.05 3f06 h VAL 41 Cb 0.20 1.60 -0.01 0.00 -1.52 0.00 0.00 31.29 31.55 3f06 h VAL 41 CO -0.19 0.19 0.04 -0.74 0.02 0.00 0.00 177.57 176.90 3f06 h HIS 42 N -0.53 0.08 -0.47 1.57 6.17 -0.75 -2.04 115.15 119.18 3f06 h HIS 42 Ca -0.01 0.01 0.07 0.00 0.71 0.00 0.00 60.37 61.15 3f06 h HIS 42 Cb 0.43 -0.02 -0.06 0.00 2.52 0.00 0.00 27.41 30.28 3f06 h HIS 42 CO 0.05 0.04 0.11 1.03 0.71 0.00 0.00 177.93 179.87 3f06 h SER 43 N 0.11 0.05 -0.49 3.26 0.87 -0.14 0.99 113.55 118.20 3f06 h SER 43 Ca 0.06 0.08 -0.07 0.00 -1.23 0.00 0.00 61.79 60.62 3f06 h SER 43 Cb 0.03 0.09 -0.02 0.00 -0.44 0.00 0.00 62.40 62.06 3f06 h SER 43 CO -0.06 0.06 0.05 0.25 -0.53 0.00 0.00 176.83 176.60 3f06 h LEU 44 N 0.26 0.85 -0.79 2.23 5.85 -1.19 0.15 115.31 122.66 3f06 h LEU 44 Ca 0.23 -0.19 -0.09 0.00 0.84 0.00 0.00 57.88 58.67 3f06 h LEU 44 Cb 0.28 -0.22 -0.02 0.00 0.37 0.00 0.00 40.66 41.07 3f06 h LEU 44 CO -0.28 0.88 -0.02 0.40 -0.34 0.00 0.00 178.44 179.08 3f06 h ILE 45 N 0.83 1.25 -0.05 4.05 2.04 -0.62 -2.83 117.51 122.18 3f06 h ILE 45 Ca 0.17 -1.09 -0.20 0.00 1.00 0.00 0.00 64.86 64.74 3f06 h ILE 45 Cb 0.42 0.87 -0.00 0.00 -0.74 0.00 0.00 36.82 37.37 3f06 h ILE 45 CO 0.01 0.39 -0.80 -0.08 0.00 0.00 0.00 178.15 177.67 3f06 h GLU 46 N 0.82 0.40 0.00 2.37 4.81 -0.46 -2.09 114.58 120.43 3f06 h GLU 46 Ca 0.15 -0.36 -0.02 0.00 -0.13 0.00 0.00 59.36 59.00 3f06 h GLU 46 Cb 0.52 0.09 -0.00 0.00 0.63 0.00 0.00 28.75 29.98 3f06 h GLU 46 CO 0.03 1.01 -0.11 0.00 -0.73 0.00 0.00 179.01 179.20 3f06 h ALA 47 N 0.88 1.45 -0.04 2.92 0.00 -0.54 0.60 119.26 124.53 3f06 h ALA 47 Ca -0.05 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.76 3f06 h ALA 47 Cb 1.40 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.17 3f06 h ALA 47 CO 0.14 0.14 0.00 0.66 0.00 0.00 0.00 179.25 180.19 3f06 n TYR 48 N -3.88 0.04 -3.88 0.00 4.01 -1.08 -4.89 117.16 107.48 3f06 n TYR 48 Ca -0.02 -0.02 -0.25 0.00 -0.16 0.00 0.00 57.90 57.45 3f06 n TYR 48 Cb 0.21 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.24 3f06 n TYR 48 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 3f06 n ALA 49 N 0.28 -1.87 0.12 -0.72 0.00 0.21 -4.87 120.51 113.65 3f06 n ALA 49 Ca 0.18 -0.16 0.10 0.00 0.00 0.00 0.00 53.44 53.57 3f06 n ALA 49 Cb 0.37 -2.16 0.02 0.00 0.00 0.00 0.00 19.45 17.68 3f06 n ALA 49 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 3f06 h LEU 50 N -1.85 0.00 -1.31 0.00 3.38 -1.59 -3.20 115.31 110.74 3f06 h LEU 50 Ca -0.61 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.36 3f06 h LEU 50 Cb 1.37 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.12 3f06 h LEU 50 CO 0.62 0.08 0.00 1.12 0.09 0.00 0.00 178.44 180.35 3f06 h HIS 51 N 0.00 0.00 0.00 1.13 2.07 -1.89 -1.85 115.15 114.61 3f06 h HIS 51 Ca -0.02 0.00 -0.02 0.00 -2.85 0.00 0.00 60.37 57.48 3f06 h HIS 51 Cb 1.08 0.00 -0.00 0.00 2.57 0.00 0.00 27.41 31.05 3f06 h HIS 51 CO 0.00 0.00 -0.12 0.87 -3.07 0.00 0.00 177.93 175.61 3f06 h LYS 52 N 0.00 0.00 -0.38 5.12 1.79 -1.93 -2.64 116.57 118.54 3f06 h LYS 52 Ca 0.00 0.00 -0.17 0.00 -2.18 0.00 0.00 60.65 58.30 3f06 h LYS 52 Cb 0.35 0.00 -0.10 0.00 -1.58 0.00 0.00 32.23 30.90 3f06 h LYS 52 CO 0.00 0.12 -0.01 1.04 -1.08 0.00 0.00 179.45 179.51 3f06 n GLN 53 N -3.58 2.08 -4.05 3.15 6.02 -0.69 -5.00 117.38 115.31 3f06 n GLN 53 Ca -0.02 -3.10 -0.08 0.00 -0.01 0.00 0.00 57.00 53.79 3f06 n GLN 53 Cb 0.25 -1.85 -0.10 0.00 1.02 0.00 0.00 30.24 29.55 3f06 n GLN 53 CO 0.00 0.00 0.00 -1.64 -1.01 0.00 0.00 177.06 174.41 3f06 s MET 54 N -3.17 0.49 -1.00 -1.09 -1.94 -0.99 -4.59 119.30 107.01 3f06 s MET 54 Ca 0.45 -0.95 -0.20 0.00 -1.71 0.00 0.00 55.69 53.27 3f06 s MET 54 Cb 0.40 0.14 0.10 0.00 2.01 0.00 0.00 34.83 37.47 3f06 s MET 54 CO 0.02 -0.08 1.30 0.50 -0.01 0.00 0.00 175.02 176.75 3f06 s ARG 55 N -2.81 3.64 0.15 2.03 3.52 0.56 -4.89 118.95 121.15 3f06 s ARG 55 Ca -0.03 -1.58 -0.31 0.00 -0.13 0.00 0.00 55.73 53.68 3f06 s ARG 55 Cb -0.00 -5.12 -0.11 0.00 -1.56 0.00 0.00 34.95 28.16 3f06 s ARG 55 CO -0.06 -1.96 1.77 0.42 -0.81 0.00 0.00 175.30 174.66 3f06 s ILE 56 N 3.56 2.38 -0.08 4.11 1.01 -1.26 -1.60 121.20 129.33 3f06 s ILE 56 Ca 0.39 0.09 0.01 0.00 0.00 0.00 0.00 60.65 61.14 3f06 s ILE 56 Cb -0.02 -3.06 0.02 0.00 0.01 0.00 0.00 42.46 39.41 3f06 s ILE 56 CO -0.08 0.00 -0.08 -0.69 0.00 0.00 0.00 174.94 174.09 3f06 s VAL 57 N 2.07 0.90 0.35 2.92 1.01 0.10 -4.89 120.40 122.86 3f06 s VAL 57 Ca 0.78 -0.28 -0.28 0.00 0.00 0.00 0.00 61.98 62.20 3f06 s VAL 57 Cb -0.47 -0.90 -0.09 0.00 0.00 0.00 0.00 36.38 34.92 3f06 s VAL 57 CO 0.34 0.33 1.22 -0.75 0.00 0.00 0.00 175.10 176.23 3f06 s LYS 58 N 1.24 4.29 0.06 2.72 2.20 -1.25 -2.54 119.74 126.46 3f06 s LYS 58 Ca -0.05 2.00 -0.13 0.00 -0.36 0.00 0.00 55.97 57.44 3f06 s LYS 58 Cb -0.14 -2.94 -0.06 0.00 -1.51 0.00 0.00 37.83 33.18 3f06 s LYS 58 CO -0.02 -0.17 0.44 -1.25 -0.36 0.00 0.00 175.35 173.99 3f06 s PRO 59 N -1.92 3.88 -0.02 4.03 0.04 -1.26 -4.97 135.00 134.79 3f06 s PRO 59 Ca 0.51 0.35 -0.15 0.00 0.04 0.00 0.00 61.00 61.75 3f06 s PRO 59 Cb -0.35 -3.08 -0.06 0.00 0.04 0.00 0.00 34.50 31.06 3f06 s PRO 59 CO 0.45 0.60 0.41 0.15 0.04 0.00 0.00 177.00 178.65 3f06 s LYS 60 N -1.58 3.97 0.32 4.56 -0.14 -1.26 -4.94 119.74 120.67 3f06 s LYS 60 Ca 0.30 0.41 -0.29 0.00 -1.36 0.00 0.00 55.97 55.03 3f06 s LYS 60 Cb -0.15 -3.25 -0.10 0.00 -1.68 0.00 0.00 37.83 32.64 3f06 s LYS 60 CO 0.17 0.62 1.34 0.08 -0.76 0.00 0.00 175.35 176.80 3f06 s VAL 61 N -0.86 2.66 0.38 3.17 1.01 -1.26 -3.95 120.40 121.54 3f06 s VAL 61 Ca 0.24 0.64 -0.26 0.00 0.00 0.00 0.00 61.98 62.60 3f06 s VAL 61 Cb -0.16 -3.41 -0.09 0.00 0.00 0.00 0.00 36.38 32.72 3f06 s VAL 61 CO 0.13 0.15 1.17 0.00 0.00 0.00 0.00 175.10 176.55 3f06 s ALA 62 N -0.97 3.23 0.35 5.51 0.00 -0.93 -4.86 121.76 124.09 3f06 s ALA 62 Ca 0.51 0.99 -0.06 0.00 0.00 0.00 0.00 51.96 53.40 3f06 s ALA 62 Cb -0.41 -3.38 -0.05 0.00 0.00 0.00 0.00 23.12 19.28 3f06 s ALA 62 CO 0.52 -0.49 0.64 -1.54 0.00 0.00 0.00 175.76 174.90 3f06 s SER 63 N -1.03 6.42 0.64 0.00 1.04 -1.26 -4.90 113.70 114.61 3f06 s SER 63 Ca 0.54 0.82 0.39 0.00 0.48 0.00 0.00 55.95 58.19 3f06 s SER 63 Cb -0.32 -2.19 2.21 0.00 0.10 0.00 0.00 66.02 65.82 3f06 s SER 63 CO 0.40 -0.31 2.33 -0.03 0.98 0.00 0.00 173.24 176.62 3f06 h MET 64 N 1.28 0.00 0.00 4.02 4.05 -1.99 -0.29 114.93 121.99 3f06 h MET 64 Ca -0.48 0.00 -0.19 0.00 -0.28 0.00 0.00 59.70 58.75 3f06 h MET 64 Cb 1.19 0.00 -0.03 0.00 -0.80 0.00 0.00 31.60 31.96 3f06 h MET 64 CO 0.64 0.00 -1.05 1.05 0.23 0.00 0.00 176.91 177.79 3f06 h GLU 65 N 0.00 0.00 0.09 0.39 9.09 -1.98 -2.75 114.58 119.42 3f06 h GLU 65 Ca 0.00 0.00 -0.27 0.00 0.05 0.00 0.00 59.36 59.14 3f06 h GLU 65 Cb 0.00 0.00 0.01 0.00 -1.65 0.00 0.00 28.75 27.11 3f06 h GLU 65 CO -0.00 0.72 -1.14 0.93 0.05 0.00 0.00 179.01 179.56 3f06 h GLU 66 N 0.00 0.42 -0.12 1.06 5.08 -1.46 -3.22 114.58 116.33 3f06 h GLU 66 Ca -0.07 -0.57 -0.15 0.00 -1.00 0.00 0.00 59.36 57.57 3f06 h GLU 66 Cb 1.70 0.19 -0.01 0.00 0.50 0.00 0.00 28.75 31.13 3f06 h GLU 66 CO 0.10 1.23 -0.58 0.52 -1.00 0.00 0.00 179.01 179.27 3f06 h MET 67 N 0.18 0.40 0.00 2.33 2.86 -1.44 -2.79 114.93 116.47 3f06 h MET 67 Ca -0.13 -0.26 0.00 0.00 -2.06 0.00 0.00 59.70 57.25 3f06 h MET 67 Cb 1.82 0.03 0.00 0.00 0.06 0.00 0.00 31.60 33.52 3f06 h MET 67 CO 0.20 0.87 0.00 0.00 1.06 0.00 0.00 176.91 179.04 3f06 n ALA 68 N -2.50 1.26 0.34 6.32 0.00 -1.04 -1.87 120.51 123.03 3f06 n ALA 68 Ca -0.03 0.05 0.10 0.00 0.00 0.00 0.00 53.44 53.56 3f06 n ALA 68 Cb 0.61 -1.20 0.43 0.00 0.00 0.00 0.00 19.45 19.30 3f06 n ALA 68 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 3f06 n THR 69 N -1.82 1.00 0.00 0.00 -2.24 -1.05 -4.16 114.28 106.02 3f06 n THR 69 Ca 0.01 0.36 0.00 0.00 -2.27 0.00 0.00 64.05 62.14 3f06 n THR 69 Cb 0.08 -1.27 0.00 0.00 -2.10 0.00 0.00 70.33 67.04 3f06 n THR 69 CO 0.00 0.00 0.00 0.33 -0.57 0.00 0.00 175.07 174.83 3f06 n PHE 70 N -2.03 -0.05 -2.71 4.78 7.35 -0.83 -5.09 117.46 118.88 3f06 n PHE 70 Ca 0.02 0.01 -0.32 0.00 -0.76 0.00 0.00 57.45 56.39 3f06 n PHE 70 Cb 0.16 0.31 -0.05 0.00 0.35 0.00 0.00 39.48 40.25 3f06 n PHE 70 CO 0.00 0.00 0.00 -1.01 -0.76 0.00 0.00 176.76 174.99 3f06 s HIS 71 N -2.00 3.40 0.49 -5.13 3.76 -0.78 -4.72 115.29 110.31 3f06 s HIS 71 Ca 0.00 1.39 -0.16 0.00 -0.15 0.00 0.00 55.06 56.14 3f06 s HIS 71 Cb 0.00 -2.71 -0.08 0.00 1.11 0.00 0.00 32.58 30.91 3f06 s HIS 71 CO 0.00 -0.18 0.94 0.95 -0.85 0.00 0.00 174.74 175.60 3f06 s THR 72 N -2.36 4.57 0.20 1.30 -4.23 -0.63 -4.35 115.64 110.15 3f06 s THR 72 Ca 0.58 1.13 -0.08 0.00 -1.18 0.00 0.00 61.69 62.13 3f06 s THR 72 Cb -0.10 -3.71 0.13 0.00 1.34 0.00 0.00 72.50 70.17 3f06 s THR 72 CO 0.24 -0.62 1.75 0.44 -0.54 0.00 0.00 174.62 175.89 3f06 h ASP 73 N 1.07 1.07 -0.71 3.99 3.32 -1.93 0.20 116.42 123.44 3f06 h ASP 73 Ca -0.47 -0.20 0.08 0.00 0.02 0.00 0.00 57.03 56.46 3f06 h ASP 73 Cb 1.18 -0.28 -0.07 0.00 0.22 0.00 0.00 39.33 40.39 3f06 h ASP 73 CO 0.62 0.98 0.38 0.00 -1.72 0.00 0.00 179.24 179.50 3f06 h ALA 74 N 1.13 0.98 0.21 3.45 0.00 -1.98 0.96 119.26 124.01 3f06 h ALA 74 Ca 0.24 0.04 -0.01 0.00 0.00 0.00 0.00 54.91 55.18 3f06 h ALA 74 Cb 0.28 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.99 3f06 h ALA 74 CO -0.01 0.01 -0.10 -0.92 0.00 0.00 0.00 179.25 178.23 3f06 h TYR 75 N 0.66 -0.26 -0.89 0.00 3.20 -1.74 -1.99 116.97 115.95 3f06 h TYR 75 Ca 0.34 -0.01 0.08 0.00 3.14 0.00 0.00 58.73 62.28 3f06 h TYR 75 Cb 0.30 0.09 -0.06 0.00 1.54 0.00 0.00 36.73 38.60 3f06 h TYR 75 CO -0.09 0.11 0.58 -0.07 -1.64 0.00 0.00 178.16 177.05 3f06 h LEU 76 N -0.69 0.84 -0.47 2.82 3.38 -0.19 0.26 115.31 121.26 3f06 h LEU 76 Ca -0.03 0.02 -0.03 0.00 0.09 0.00 0.00 57.88 57.92 3f06 h LEU 76 Cb 0.48 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 41.05 3f06 h LEU 76 CO 0.05 0.52 0.16 1.56 0.09 0.00 0.00 178.44 180.81 3f06 h GLN 77 N 0.94 0.71 -0.37 1.13 1.08 0.97 -1.92 115.11 117.66 3f06 h GLN 77 Ca 0.40 -0.15 -0.09 0.00 -1.45 0.00 0.00 58.65 57.37 3f06 h GLN 77 Cb 0.32 -0.11 -0.01 0.00 -0.05 0.00 0.00 27.48 27.63 3f06 h GLN 77 CO -0.16 0.67 -0.10 1.25 -0.95 0.00 0.00 178.83 179.54 3f06 h HIS 78 N 0.62 0.82 -0.91 2.96 2.76 -0.44 0.19 115.15 121.15 3f06 h HIS 78 Ca 0.15 -0.18 0.04 0.00 -2.20 0.00 0.00 60.37 58.18 3f06 h HIS 78 Cb 0.24 -0.20 -0.05 0.00 1.55 0.00 0.00 27.41 28.95 3f06 h HIS 78 CO 0.01 0.88 0.60 1.25 -1.30 0.00 0.00 177.93 179.36 3f06 h LEU 79 N 0.53 0.97 0.32 0.26 6.46 -0.44 -0.01 115.31 123.40 3f06 h LEU 79 Ca 0.09 -0.01 -0.02 0.00 -0.12 0.00 0.00 57.88 57.83 3f06 h LEU 79 Cb 0.62 -0.22 0.00 0.00 -0.73 0.00 0.00 40.66 40.33 3f06 h LEU 79 CO 0.04 0.66 -0.15 -0.61 -0.62 0.00 0.00 178.44 177.76 3f06 h GLN 80 N 1.12 -0.41 -0.49 1.25 4.15 -1.05 -1.83 115.11 117.84 3f06 h GLN 80 Ca 0.37 0.03 0.09 0.00 0.77 0.00 0.00 58.65 59.90 3f06 h GLN 80 Cb 0.05 0.09 -0.10 0.00 0.21 0.00 0.00 27.48 27.73 3f06 h GLN 80 CO -0.12 -0.09 -0.35 -0.22 -1.93 0.00 0.00 178.83 176.13 3f06 h LYS 81 N -0.82 -0.21 -0.03 1.69 1.63 -0.30 0.13 116.57 118.66 3f06 h LYS 81 Ca -0.04 0.01 0.01 0.00 -0.85 0.00 0.00 60.65 59.78 3f06 h LYS 81 Cb 0.52 0.05 -0.00 0.00 -0.60 0.00 0.00 32.23 32.20 3f06 h LYS 81 CO 0.07 -0.14 0.03 0.28 -3.45 0.00 0.00 179.45 176.24 3f06 h VAL 82 N -0.22 0.59 -0.64 2.00 2.07 -1.00 -3.51 116.25 115.53 3f06 h VAL 82 Ca 0.19 0.00 -0.13 0.00 0.82 0.00 0.00 66.70 67.58 3f06 h VAL 82 Cb 0.55 0.98 -0.08 0.00 -1.52 0.00 0.00 31.29 31.22 3f06 h VAL 82 CO -0.61 0.00 0.16 -0.24 0.02 0.00 0.00 177.57 176.89 3f06 n SER 83 N -3.94 4.95 -0.50 0.57 2.88 0.45 -4.61 113.62 113.42 3f06 n SER 83 Ca -0.02 -3.15 0.00 0.00 -1.33 0.00 0.00 58.87 54.37 3f06 n SER 83 Cb 0.11 -0.71 0.00 0.00 -0.75 0.00 0.00 64.21 62.87 3f06 n SER 83 CO 0.00 0.00 0.00 -0.90 -1.23 0.00 0.00 175.04 172.91 3f06 n ASP 92 N 0.00 0.00 0.16 -3.46 5.68 -1.26 -4.23 116.55 113.44 3f06 n ASP 92 Ca 0.35 0.00 0.02 0.00 -0.50 0.00 0.00 54.79 54.67 3f06 n ASP 92 Cb 1.28 0.00 0.38 0.00 -1.14 0.00 0.00 41.12 41.64 3f06 n ASP 92 CO 0.00 0.00 0.00 0.28 -1.33 0.00 0.00 177.20 176.15 3f06 h SER 93 N 0.16 0.10 0.00 -1.12 0.02 -2.01 -2.57 113.55 108.12 3f06 h SER 93 Ca 0.00 -0.03 0.00 0.00 -0.84 0.00 0.00 61.79 60.92 3f06 h SER 93 Cb 0.00 -0.03 0.00 0.00 0.14 0.00 0.00 62.40 62.51 3f06 h SER 93 CO 0.00 0.37 0.00 -0.38 -1.14 0.00 0.00 176.83 175.68 3f06 n ILE 94 N -4.19 0.05 0.00 3.27 2.08 -1.26 -0.31 119.36 119.00 3f06 n ILE 94 Ca -0.02 0.00 0.00 0.00 0.56 0.00 0.00 62.75 63.29 3f06 n ILE 94 Cb 0.34 -0.23 0.00 0.00 -0.75 0.00 0.00 39.64 39.00 3f06 n ILE 94 CO 0.00 0.00 0.00 1.21 0.56 0.00 0.00 176.55 178.32 3f06 n GLU 95 N 0.53 3.91 -0.07 0.38 2.13 -0.97 -4.63 120.64 121.92 3f06 n GLU 95 Ca 0.00 0.00 0.02 0.00 0.66 0.00 0.00 57.16 57.84 3f06 n GLU 95 Cb 0.06 -0.71 0.06 0.00 0.27 0.00 0.00 31.44 31.12 3f06 n GLU 95 CO 0.00 0.00 0.00 0.66 -0.41 0.00 0.00 177.13 177.38 3f06 n TYR 96 N -1.19 0.17 -0.84 4.31 4.01 0.57 -4.96 117.16 119.24 3f06 n TYR 96 Ca 0.00 -0.43 0.00 0.00 -0.16 0.00 0.00 57.90 57.31 3f06 n TYR 96 Cb 0.00 -0.03 0.00 0.00 -0.31 0.00 0.00 39.34 39.00 3f06 n TYR 96 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3f06 n GLY 97 N -0.02 0.49 3.42 2.72 0.00 -1.19 -0.16 105.19 110.44 3f06 n GLY 97 Ca 0.05 -0.84 -0.44 0.00 0.00 0.00 0.00 46.02 44.79 3f06 n GLY 97 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3f06 s LEU 98 N 0.00 5.51 0.00 0.99 1.43 -1.10 -4.19 118.68 121.32 3f06 s LEU 98 Ca 0.00 -3.20 0.00 0.00 -1.03 0.00 0.00 54.13 49.90 3f06 s LEU 98 Cb 0.00 -2.33 0.00 0.00 0.03 0.00 0.00 46.19 43.89 3f06 s LEU 98 CO 0.00 -0.59 0.00 0.61 0.23 0.00 0.00 176.35 176.60 3f06 n GLY 99 N 3.62 3.75 0.35 -3.19 0.00 -0.65 -4.21 105.19 104.87 3f06 n GLY 99 Ca 0.32 -0.45 -0.14 0.00 0.00 0.00 0.00 46.02 45.76 3f06 n GLY 99 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 3f06 h TYR 100 N 0.00 -0.84 -0.12 1.61 3.20 -1.98 -2.15 116.97 116.68 3f06 h TYR 100 Ca 0.00 -0.02 -0.02 0.00 3.14 0.00 0.00 58.73 61.83 3f06 h TYR 100 Cb 0.00 0.29 -0.00 0.00 1.54 0.00 0.00 36.73 38.55 3f06 h TYR 100 CO 0.00 -0.51 -0.00 0.00 -1.64 0.00 0.00 178.16 176.01 3f06 h ALA 101 N -1.54 0.17 -2.84 1.82 0.00 -1.97 -3.36 119.26 111.54 3f06 h ALA 101 Ca -0.09 -0.19 -0.67 0.00 0.00 0.00 0.00 54.91 53.97 3f06 h ALA 101 Cb 0.67 -0.05 -0.38 0.00 0.00 0.00 0.00 17.79 18.04 3f06 h ALA 101 CO 0.13 -0.14 -0.27 0.00 0.00 0.00 0.00 179.25 178.97 3f06 n PRO 103 N 2.00 0.01 -1.05 0.00 -0.02 -0.81 -1.63 135.00 133.50 3f06 n PRO 103 Ca 0.22 0.06 -0.19 0.00 -2.02 0.00 0.00 63.50 61.57 3f06 n PRO 103 Cb 0.36 -2.01 -0.00 0.00 -0.02 0.00 0.00 33.50 31.84 3f06 n PRO 103 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3f06 n ALA 104 N -3.16 5.52 -1.65 3.55 0.00 -1.26 -4.80 120.51 118.71 3f06 n ALA 104 Ca 0.10 -2.00 -0.38 0.00 0.00 0.00 0.00 53.44 51.16 3f06 n ALA 104 Cb 0.52 -1.62 0.05 0.00 0.00 0.00 0.00 19.45 18.39 3f06 n ALA 104 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 3f06 n THR 105 N 0.65 3.80 -2.39 0.00 -1.04 -1.26 -4.82 114.28 109.21 3f06 n THR 105 Ca 0.35 -0.50 -0.42 0.00 -2.04 0.00 0.00 64.05 61.43 3f06 n THR 105 Cb 0.58 -1.29 -0.03 0.00 -1.82 0.00 0.00 70.33 67.78 3f06 n THR 105 CO 0.00 0.00 0.00 -1.83 -0.64 0.00 0.00 175.07 172.60 3f06 s GLU 106 N -2.80 4.29 0.00 -2.82 -1.05 -1.26 -3.20 118.70 111.85 3f06 s GLU 106 Ca 0.75 1.74 0.00 0.00 -0.15 0.00 0.00 54.97 57.31 3f06 s GLU 106 Cb -0.42 -3.65 0.00 0.00 -0.44 0.00 0.00 34.13 29.62 3f06 s GLU 106 CO 0.47 -0.57 0.00 0.41 0.95 0.00 0.00 175.26 176.52 3f06 n GLY 107 N 3.53 0.12 0.37 -3.83 0.00 -1.26 -4.95 105.19 99.15 3f06 n GLY 107 Ca 0.13 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.24 3f06 n GLY 107 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 173.32 173.48 3f06 h ILE 108 N 0.00 0.92 -0.11 -0.61 3.07 -1.91 -0.47 117.51 118.40 3f06 h ILE 108 Ca 0.00 -0.27 0.03 0.00 1.55 0.00 0.00 64.86 66.17 3f06 h ILE 108 Cb 0.00 0.06 -0.03 0.00 -0.27 0.00 0.00 36.82 36.58 3f06 h ILE 108 CO 0.00 0.14 -0.09 0.15 -1.05 0.00 0.00 178.15 177.30 3f06 h PHE 109 N 0.78 -0.22 -0.67 0.16 3.57 -1.86 0.68 116.94 119.39 3f06 h PHE 109 Ca 0.42 0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.90 3f06 h PHE 109 Cb 0.53 0.11 -0.03 0.00 2.79 0.00 0.00 35.95 39.35 3f06 h PHE 109 CO -0.00 -0.14 0.29 -0.44 -2.23 0.00 0.00 178.31 175.80 3f06 h ASP 110 N -0.10 0.87 0.06 0.41 3.45 -1.73 -0.96 116.42 118.42 3f06 h ASP 110 Ca 0.07 -0.11 -0.00 0.00 0.43 0.00 0.00 57.03 57.42 3f06 h ASP 110 Cb 0.21 -0.22 0.00 0.00 -0.56 0.00 0.00 39.33 38.75 3f06 h ASP 110 CO -0.17 0.76 -0.03 0.22 -1.57 0.00 0.00 179.24 178.45 3f06 h TYR 111 N 0.95 -0.08 -0.54 4.55 -0.00 -0.09 -2.23 116.97 119.53 3f06 h TYR 111 Ca 0.23 -0.00 -0.02 0.00 -0.00 0.00 0.00 58.73 58.93 3f06 h TYR 111 Cb 0.14 0.03 -0.02 0.00 -0.00 0.00 0.00 36.73 36.87 3f06 h TYR 111 CO 0.01 0.06 0.25 0.00 -0.00 0.00 0.00 178.16 178.49 3f06 h ALA 112 N 0.72 0.70 -0.91 1.82 0.00 0.57 -2.59 119.26 119.56 3f06 h ALA 112 Ca -0.01 -0.13 0.07 0.00 0.00 0.00 0.00 54.91 54.84 3f06 h ALA 112 Cb 0.18 -0.21 -0.07 0.00 0.00 0.00 0.00 17.79 17.69 3f06 h ALA 112 CO 0.01 0.27 0.57 0.00 0.00 0.00 0.00 179.25 180.11 3f06 h ALA 113 N 1.09 1.27 -0.63 0.00 0.00 -1.10 0.22 119.26 120.12 3f06 h ALA 113 Ca 0.18 -0.01 -0.06 0.00 0.00 0.00 0.00 54.91 55.03 3f06 h ALA 113 Cb 0.14 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 17.65 3f06 h ALA 113 CO -0.02 0.32 0.17 0.00 0.00 0.00 0.00 179.25 179.72 3f06 h ALA 114 N 1.43 0.82 -0.04 0.00 0.00 -1.16 -0.42 119.26 119.90 3f06 h ALA 114 Ca 0.40 -0.22 -0.22 0.00 0.00 0.00 0.00 54.91 54.87 3f06 h ALA 114 Cb 0.20 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 17.75 3f06 h ALA 114 CO -0.18 0.52 -0.87 0.82 0.00 0.00 0.00 179.25 179.53 3f06 h ILE 115 N 0.91 1.37 0.07 0.00 2.04 -0.95 -1.54 117.51 119.41 3f06 h ILE 115 Ca 0.20 -2.29 -0.00 0.00 1.00 0.00 0.00 64.86 63.77 3f06 h ILE 115 Cb 0.32 2.28 0.00 0.00 -0.74 0.00 0.00 36.82 38.68 3f06 h ILE 115 CO -0.00 0.69 -0.03 1.23 0.00 0.00 0.00 178.15 180.03 3f06 h GLY 116 N 1.10 -0.10 1.50 5.37 0.00 -0.51 -2.50 103.07 107.92 3f06 h GLY 116 Ca -0.07 0.04 0.00 0.00 0.00 0.00 0.00 47.33 47.30 3f06 h GLY 116 CO 0.16 -0.04 0.32 -1.33 0.00 0.00 0.00 176.54 175.65 3f06 h GLY 117 N -0.31 0.72 1.52 4.60 0.00 -1.13 -0.51 103.07 107.95 3f06 h GLY 117 Ca -0.01 -0.28 -0.04 0.00 0.00 0.00 0.00 47.33 47.01 3f06 h GLY 117 CO 0.02 0.27 0.10 0.00 0.00 0.00 0.00 176.54 176.92 3f06 h ALA 118 N 1.67 1.40 0.13 3.60 0.00 -1.09 0.44 119.26 125.40 3f06 h ALA 118 Ca 0.19 -0.16 -0.28 0.00 0.00 0.00 0.00 54.91 54.65 3f06 h ALA 118 Cb -0.06 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 17.56 3f06 h ALA 118 CO -0.04 0.43 -1.30 1.15 0.00 0.00 0.00 179.25 179.50 3f06 h THR 119 N 0.60 1.43 -0.42 0.00 2.02 -0.85 -2.69 112.91 113.00 3f06 h THR 119 Ca 0.14 -3.01 -0.06 0.00 0.77 0.00 0.00 66.41 64.24 3f06 h THR 119 Cb 0.23 2.91 -0.02 0.00 -1.74 0.00 0.00 68.15 69.54 3f06 h THR 119 CO -0.00 0.88 0.01 0.40 0.37 0.00 0.00 175.52 177.17 3f06 h ILE 120 N 0.07 1.26 -0.63 3.11 2.04 -0.79 -1.35 117.51 121.22 3f06 h ILE 120 Ca -0.15 -1.01 0.04 0.00 1.00 0.00 0.00 64.86 64.74 3f06 h ILE 120 Cb 1.98 1.08 -0.04 0.00 -0.74 0.00 0.00 36.82 39.11 3f06 h ILE 120 CO 0.20 0.34 0.42 0.74 0.00 0.00 0.00 178.15 179.85 3f06 h THR 121 N 0.58 1.06 -0.09 -0.27 2.02 -0.18 -1.41 112.91 114.61 3f06 h THR 121 Ca 0.12 -0.24 -0.20 0.00 0.77 0.00 0.00 66.41 66.87 3f06 h THR 121 Cb 0.47 0.29 -0.00 0.00 -1.74 0.00 0.00 68.15 67.17 3f06 h THR 121 CO 0.02 0.13 -0.76 0.00 0.37 0.00 0.00 175.52 175.28 3f06 h ALA 122 N 1.64 0.52 -0.43 6.16 0.00 -1.11 -3.23 119.26 122.81 3f06 h ALA 122 Ca 0.26 -0.61 -0.07 0.00 0.00 0.00 0.00 54.91 54.48 3f06 h ALA 122 Cb 0.15 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 3f06 h ALA 122 CO -0.07 0.75 -0.02 0.00 0.00 0.00 0.00 179.25 179.91 3f06 h ALA 123 N 0.85 0.58 -0.96 0.00 0.00 -0.42 -3.02 119.26 116.29 3f06 h ALA 123 Ca -0.04 -0.28 0.11 0.00 0.00 0.00 0.00 54.91 54.70 3f06 h ALA 123 Cb 1.35 -0.16 -0.08 0.00 0.00 0.00 0.00 17.79 18.90 3f06 h ALA 123 CO 0.14 0.39 0.61 0.37 0.00 0.00 0.00 179.25 180.76 3f06 h GLN 124 N 0.61 0.91 -0.61 0.00 5.75 -1.32 -0.89 115.11 119.56 3f06 h GLN 124 Ca 0.12 -0.05 -0.01 0.00 -0.15 0.00 0.00 58.65 58.55 3f06 h GLN 124 Cb 0.52 -0.20 -0.03 0.00 1.07 0.00 0.00 27.48 28.84 3f06 h GLN 124 CO 0.03 0.60 0.34 0.00 -2.65 0.00 0.00 178.83 177.14 3f06 h LEU 126 N 0.84 0.61 -2.59 0.00 -0.00 -1.18 -2.76 115.31 110.23 3f06 h LEU 126 Ca 0.22 -0.24 -0.14 0.00 -0.00 0.00 0.00 57.88 57.72 3f06 h LEU 126 Cb 0.02 -0.17 -0.08 0.00 -0.00 0.00 0.00 40.66 40.42 3f06 h LEU 126 CO -0.04 0.89 0.18 2.30 -0.00 0.00 0.00 178.44 181.77 3f06 n ILE 127 N -4.08 1.68 -1.89 1.22 -5.35 -0.80 -3.23 119.36 106.92 3f06 n ILE 127 Ca -0.01 -0.76 0.00 0.00 -0.27 0.00 0.00 62.75 61.71 3f06 n ILE 127 Cb 0.46 -0.62 0.00 0.00 -1.74 0.00 0.00 39.64 37.75 3f06 n ILE 127 CO 0.00 0.00 0.00 0.47 -1.76 0.00 0.00 176.55 175.26 3f06 n ASP 128 N -0.03 0.08 0.00 7.28 8.00 -1.05 -4.99 116.55 125.84 3f06 n ASP 128 Ca 0.21 -1.96 0.00 0.00 0.71 0.00 0.00 54.79 53.75 3f06 n ASP 128 Cb 0.88 -0.19 0.00 0.00 -0.02 0.00 0.00 41.12 41.79 3f06 n ASP 128 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3f06 n GLY 129 N -0.05 0.00 0.01 0.44 0.00 -1.20 -4.69 105.19 99.71 3f06 n GLY 129 Ca 0.00 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.03 3f06 n GLY 129 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 3f06 n MET 130 N -0.68 0.01 0.00 1.61 0.00 -1.14 -4.72 117.12 112.20 3f06 n MET 130 Ca 0.00 0.41 0.00 0.00 0.00 0.00 0.00 57.70 58.11 3f06 n MET 130 Cb 0.00 -1.63 0.00 0.00 0.00 0.00 0.00 33.22 31.59 3f06 n MET 130 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 3f06 n LYS 132 N -0.09 1.32 -3.66 0.00 3.00 -1.26 -4.62 118.16 112.84 3f06 n LYS 132 Ca 0.00 -1.45 -0.08 0.00 -0.00 0.00 0.00 58.31 56.79 3f06 n LYS 132 Cb 0.00 -1.22 -0.08 0.00 0.00 0.00 0.00 35.03 33.73 3f06 n LYS 132 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.40 177.48 3f06 s VAL 133 N -0.93 -0.08 0.05 3.15 1.01 -1.26 -1.96 120.40 120.39 3f06 s VAL 133 Ca 0.16 0.04 0.08 0.00 0.00 0.00 0.00 61.98 62.25 3f06 s VAL 133 Cb 0.10 -0.86 -0.03 0.00 0.00 0.00 0.00 36.38 35.59 3f06 s VAL 133 CO 0.14 0.02 -0.22 0.00 0.00 0.00 0.00 175.10 175.04 3f06 s ALA 134 N 1.66 1.84 -0.04 5.51 0.00 -0.41 -0.98 121.76 129.34 3f06 s ALA 134 Ca -0.09 -1.11 0.04 0.00 0.00 0.00 0.00 51.96 50.79 3f06 s ALA 134 Cb -0.07 -0.35 -0.00 0.00 0.00 0.00 0.00 23.12 22.70 3f06 s ALA 134 CO -0.17 0.41 -0.14 0.42 0.00 0.00 0.00 175.76 176.28 3f06 s ILE 135 N -0.84 1.18 -0.41 0.00 1.01 -0.18 -0.45 121.20 121.51 3f06 s ILE 135 Ca 0.08 -0.57 0.04 0.00 0.00 0.00 0.00 60.65 60.20 3f06 s ILE 135 Cb -0.09 -1.02 0.17 0.00 0.01 0.00 0.00 42.46 41.52 3f06 s ILE 135 CO 0.02 0.35 0.43 0.21 0.00 0.00 0.00 174.94 175.95 3f06 s ASN 136 N 0.12 0.78 0.52 3.58 2.47 -0.62 -1.41 114.94 120.38 3f06 s ASN 136 Ca -0.04 -2.10 0.17 0.00 0.42 0.00 0.00 52.86 51.32 3f06 s ASN 136 Cb -0.11 0.49 1.31 0.00 -1.45 0.00 0.00 41.25 41.49 3f06 s ASN 136 CO 0.02 -0.19 2.15 -0.50 -3.72 0.00 0.00 177.10 174.86 3f06 h TRP 137 N 6.21 0.00 0.00 0.43 -0.00 -1.91 -2.13 115.95 118.56 3f06 h TRP 137 Ca 0.12 0.00 0.00 0.00 -0.00 0.00 0.00 58.89 59.01 3f06 h TRP 137 Cb 1.02 0.00 0.00 0.00 -0.00 0.00 0.00 29.16 30.18 3f06 h TRP 137 CO 0.26 0.01 0.00 0.43 -0.00 0.00 0.00 178.44 179.14 3f06 n SER 138 N -4.46 0.00 -1.93 -3.49 7.64 -1.26 -3.11 113.62 107.00 3f06 n SER 138 Ca -0.03 -1.04 0.00 0.00 1.01 0.00 0.00 58.87 58.81 3f06 n SER 138 Cb 0.10 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.30 3f06 n SER 138 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3f06 n GLY 139 N 0.82 2.12 0.00 0.23 0.00 -0.80 -4.88 105.19 102.68 3f06 n GLY 139 Ca 0.20 -2.13 0.00 0.00 0.00 0.00 0.00 46.02 44.09 3f06 n GLY 139 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3f06 n GLY 140 N 5.00 1.51 3.57 -0.02 0.00 -1.26 -2.13 105.19 111.87 3f06 n GLY 140 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 3f06 n GLY 140 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 3f06 s TRP 141 N -2.00 2.64 -1.68 1.61 0.52 -1.26 -4.48 118.94 114.28 3f06 s TRP 141 Ca 0.00 -1.22 0.31 0.00 0.02 0.00 0.00 56.10 55.20 3f06 s TRP 141 Cb 0.00 -4.68 1.62 0.00 -1.15 0.00 0.00 33.47 29.25 3f06 s TRP 141 CO 0.00 -1.81 2.09 -2.39 0.02 0.00 0.00 176.95 174.86 3f06 n HIS 142 N 9.02 0.00 0.30 -1.98 1.44 -1.26 -4.13 115.22 118.60 3f06 n HIS 142 Ca 0.44 0.00 0.12 0.00 -2.01 0.00 0.00 57.72 56.26 3f06 n HIS 142 Cb 0.48 -0.17 0.06 0.00 0.12 0.00 0.00 29.99 30.48 3f06 n HIS 142 CO 0.00 0.00 0.00 0.45 -2.81 0.00 0.00 176.34 173.98 3f06 h HIS 143 N 0.12 0.00 -3.21 -1.40 3.86 -1.88 -1.59 115.15 111.04 3f06 h HIS 143 Ca 0.00 0.00 -0.53 0.00 -1.16 0.00 0.00 60.37 58.68 3f06 h HIS 143 Cb 0.20 0.00 0.07 0.00 1.06 0.00 0.00 27.41 28.74 3f06 h HIS 143 CO 0.00 0.00 0.86 0.00 0.86 0.00 0.00 177.93 179.65 3f06 s ALA 144 N -3.28 3.74 0.55 2.45 0.00 -1.26 -4.11 121.76 119.85 3f06 s ALA 144 Ca 0.02 1.48 0.02 0.00 0.00 0.00 0.00 51.96 53.48 3f06 s ALA 144 Cb 0.11 -3.62 0.04 0.00 0.00 0.00 0.00 23.12 19.65 3f06 s ALA 144 CO 0.77 -0.88 0.78 0.15 0.00 0.00 0.00 175.76 176.57 3f06 s LYS 145 N -0.08 2.49 0.54 0.00 -0.14 -0.20 -4.64 119.74 117.71 3f06 s LYS 145 Ca 0.64 -0.86 0.20 0.00 -1.36 0.00 0.00 55.97 54.59 3f06 s LYS 145 Cb -0.46 -2.50 1.42 0.00 -1.68 0.00 0.00 37.83 34.61 3f06 s LYS 145 CO 0.43 -0.74 2.18 1.57 -0.76 0.00 0.00 175.35 178.03 3f06 h LYS 146 N 0.07 0.00 -0.06 1.68 2.10 -1.93 -3.15 116.57 115.28 3f06 h LYS 146 Ca -0.41 0.00 -0.18 0.00 -2.00 0.00 0.00 60.65 58.06 3f06 h LYS 146 Cb 1.29 0.00 -0.36 0.00 -0.90 0.00 0.00 32.23 32.26 3f06 h LYS 146 CO 0.50 0.00 -1.01 -0.40 -2.00 0.00 0.00 179.45 176.55 3f06 n ASP 147 N -4.35 1.16 -3.63 7.07 3.85 -1.26 -1.60 116.55 117.78 3f06 n ASP 147 Ca -0.03 -2.17 -0.11 0.00 -0.71 0.00 0.00 54.79 51.77 3f06 n ASP 147 Cb 0.09 -0.34 -0.07 0.00 -1.35 0.00 0.00 41.12 39.45 3f06 n ASP 147 CO 0.00 0.00 0.00 -0.70 -1.01 0.00 0.00 177.20 175.49 3f06 s GLU 148 N -0.71 0.78 0.30 0.11 2.12 -1.19 -4.81 118.70 115.29 3f06 s GLU 148 Ca 0.34 1.07 -0.17 0.00 0.36 0.00 0.00 54.97 56.57 3f06 s GLU 148 Cb 0.38 0.30 -0.09 0.00 0.26 0.00 0.00 34.13 34.98 3f06 s GLU 148 CO -0.15 -0.12 0.75 0.00 -0.54 0.00 0.00 175.26 175.21 3f06 s ALA 149 N 0.86 3.32 -0.10 6.30 0.00 0.77 -1.03 121.76 131.89 3f06 s ALA 149 Ca -0.04 0.12 -0.21 0.00 0.00 0.00 0.00 51.96 51.83 3f06 s ALA 149 Cb -0.05 -2.82 0.05 0.00 0.00 0.00 0.00 23.12 20.30 3f06 s ALA 149 CO -0.07 0.31 0.51 0.45 0.00 0.00 0.00 175.76 176.95 3f06 s SER 150 N -2.08 -0.47 -1.46 0.00 0.15 -0.83 -4.47 113.70 104.54 3f06 s SER 150 Ca 0.52 0.67 -0.07 0.00 0.70 0.00 0.00 55.95 57.76 3f06 s SER 150 Cb -0.12 0.69 0.01 0.00 -1.71 0.00 0.00 66.02 64.89 3f06 s SER 150 CO 0.18 -0.39 0.19 0.61 1.20 0.00 0.00 173.24 175.04 3f06 n GLY 151 N 1.80 -0.29 2.26 9.45 0.00 -1.26 -0.91 105.19 116.24 3f06 n GLY 151 Ca -0.17 0.21 -0.02 0.00 0.00 0.00 0.00 46.02 46.03 3f06 n GLY 151 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3f06 n PHE 152 N -4.67 0.00 -4.25 1.61 3.72 -1.26 -4.87 117.46 107.75 3f06 n PHE 152 Ca -0.28 0.00 -0.34 0.00 -0.05 0.00 0.00 57.45 56.78 3f06 n PHE 152 Cb 0.67 -0.89 -0.15 0.00 -0.94 0.00 0.00 39.48 38.17 3f06 n PHE 152 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3f06 n TYR 154 N 4.36 0.00 -3.71 0.00 4.02 -1.26 -1.97 117.16 118.60 3f06 n TYR 154 Ca -0.19 0.00 -0.14 0.00 -0.01 0.00 0.00 57.90 57.56 3f06 n TYR 154 Cb 0.51 -0.13 -0.09 0.00 -0.02 0.00 0.00 39.34 39.61 3f06 n TYR 154 CO 0.00 0.00 0.00 -1.17 -1.01 0.00 0.00 176.86 174.68 3f06 s LEU 155 N -3.37 0.32 -0.81 7.72 0.20 -1.26 -4.80 118.68 116.67 3f06 s LEU 155 Ca 0.04 0.76 -0.15 0.00 0.69 0.00 0.00 54.13 55.46 3f06 s LEU 155 Cb 0.15 1.56 0.19 0.00 -0.43 0.00 0.00 46.19 47.66 3f06 s LEU 155 CO 0.86 -0.23 0.82 0.21 -0.29 0.00 0.00 176.35 177.71 3f06 s ASN 156 N -0.12 6.66 0.38 3.68 3.84 -1.26 -4.78 114.94 123.34 3f06 s ASN 156 Ca -0.03 -2.42 0.15 0.00 0.21 0.00 0.00 52.86 50.77 3f06 s ASN 156 Cb -0.03 -2.25 0.75 0.00 -0.55 0.00 0.00 41.25 39.16 3f06 s ASN 156 CO 0.02 -0.73 1.81 -2.24 -2.79 0.00 0.00 177.10 173.17 3f06 h ASP 157 N 8.16 0.00 -0.65 -4.21 2.03 -1.91 -2.65 116.42 117.19 3f06 h ASP 157 Ca 0.06 0.00 -0.06 0.00 -0.73 0.00 0.00 57.03 56.31 3f06 h ASP 157 Cb 1.04 0.00 -0.03 0.00 -0.83 0.00 0.00 39.33 39.51 3f06 h ASP 157 CO 0.87 0.38 0.19 0.00 -1.03 0.00 0.00 179.24 179.64 3f06 h ALA 158 N 1.62 1.07 -0.07 4.15 0.00 -1.90 -0.09 119.26 124.04 3f06 h ALA 158 Ca -0.00 -0.22 -0.04 0.00 0.00 0.00 0.00 54.91 54.65 3f06 h ALA 158 Cb 0.73 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 18.25 3f06 h ALA 158 CO 0.05 0.62 -0.10 0.28 0.00 0.00 0.00 179.25 180.10 3f06 h VAL 159 N 1.00 1.39 -0.97 0.00 2.07 -1.88 -1.72 116.25 116.13 3f06 h VAL 159 Ca 0.22 -1.32 0.14 0.00 0.82 0.00 0.00 66.70 66.55 3f06 h VAL 159 Cb 0.31 2.09 -0.08 0.00 -1.52 0.00 0.00 31.29 32.09 3f06 h VAL 159 CO -0.00 0.37 0.61 -0.07 0.02 0.00 0.00 177.57 178.50 3f06 h LEU 160 N -0.25 0.82 -0.60 2.57 3.38 -1.31 0.42 115.31 120.34 3f06 h LEU 160 Ca 0.01 0.05 -0.11 0.00 0.09 0.00 0.00 57.88 57.92 3f06 h LEU 160 Cb 0.64 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 41.27 3f06 h LEU 160 CO 0.02 0.41 -0.12 1.23 0.09 0.00 0.00 178.44 180.07 3f06 h GLY 161 N 0.86 1.06 0.96 0.83 0.00 -0.89 -1.96 103.07 103.94 3f06 h GLY 161 Ca 0.50 -0.86 -0.14 0.00 0.00 0.00 0.00 47.33 46.83 3f06 h GLY 161 CO -0.27 0.78 -0.44 -2.22 0.00 0.00 0.00 176.54 174.40 3f06 h ILE 162 N 0.87 1.33 0.00 2.60 2.04 -0.04 -2.12 117.51 122.19 3f06 h ILE 162 Ca 0.13 -1.68 -0.01 0.00 1.00 0.00 0.00 64.86 64.31 3f06 h ILE 162 Cb 0.68 1.90 -0.00 0.00 -0.74 0.00 0.00 36.82 38.65 3f06 h ILE 162 CO 0.05 0.52 -0.04 -0.07 0.00 0.00 0.00 178.15 178.61 3f06 h LEU 163 N 0.32 0.00 0.10 1.44 3.38 -0.20 -1.39 115.31 118.96 3f06 h LEU 163 Ca -0.00 0.00 -0.28 0.00 0.09 0.00 0.00 57.88 57.69 3f06 h LEU 163 Cb 1.05 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.79 3f06 h LEU 163 CO 0.10 0.04 -1.37 -0.09 0.09 0.00 0.00 178.44 177.21 3f06 h ARG 164 N 0.00 0.21 0.00 1.13 9.65 -1.12 -3.26 114.38 120.99 3f06 h ARG 164 Ca -0.00 -0.36 -0.00 0.00 -1.10 0.00 0.00 59.98 58.52 3f06 h ARG 164 Cb 0.17 0.13 -0.00 0.00 -1.39 0.00 0.00 29.97 28.88 3f06 h ARG 164 CO 0.01 1.10 -0.02 -0.07 2.80 0.00 0.00 179.97 183.78 3f06 h LEU 165 N 0.06 0.00 -1.92 3.80 3.38 -0.60 -2.94 115.31 117.08 3f06 h LEU 165 Ca -0.18 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.78 3f06 h LEU 165 Cb 1.97 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.72 3f06 h LEU 165 CO 0.17 0.02 -0.07 0.03 0.09 0.00 0.00 178.44 178.68 3f06 h ARG 166 N 0.00 0.00 -1.00 1.13 2.47 -1.36 0.20 114.38 115.81 3f06 h ARG 166 Ca -0.00 0.00 0.23 0.00 -1.26 0.00 0.00 59.98 58.95 3f06 h ARG 166 Cb 0.62 0.00 -0.10 0.00 -1.65 0.00 0.00 29.97 28.84 3f06 h ARG 166 CO 0.00 0.07 0.63 0.00 0.56 0.00 0.00 179.97 181.23 3f06 h ARG 167 N 0.00 0.53 0.00 0.04 3.08 -1.68 -3.29 114.38 113.05 3f06 h ARG 167 Ca -0.00 -0.03 -0.12 0.00 0.07 0.00 0.00 59.98 59.89 3f06 h ARG 167 Cb 0.12 -0.12 -0.02 0.00 0.08 0.00 0.00 29.97 30.03 3f06 h ARG 167 CO 0.01 0.35 -1.45 1.17 -1.07 0.00 0.00 179.97 178.98 3f06 n LYS 168 N -4.69 0.19 -3.19 0.04 4.81 -0.98 -5.04 118.16 109.30 3f06 n LYS 168 Ca 0.24 0.05 -0.38 0.00 -0.87 0.00 0.00 58.31 57.35 3f06 n LYS 168 Cb 0.73 -1.06 -0.06 0.00 0.02 0.00 0.00 35.03 34.66 3f06 n LYS 168 CO 0.00 0.00 0.00 -0.06 1.17 0.00 0.00 177.40 178.51 3f06 s PHE 169 N -2.15 3.81 -0.13 5.64 0.40 0.02 -5.00 117.98 120.57 3f06 s PHE 169 Ca -0.11 1.37 0.20 0.00 -0.60 0.00 0.00 56.93 57.79 3f06 s PHE 169 Cb 0.03 -2.57 -0.18 0.00 0.51 0.00 0.00 43.02 40.81 3f06 s PHE 169 CO 0.17 0.54 0.66 0.39 0.70 0.00 0.00 175.22 177.68 3f06 n GLU 170 N 1.55 0.64 -3.67 0.44 -0.58 -1.26 -4.33 120.64 113.43 3f06 n GLU 170 Ca -0.08 0.05 -0.28 0.00 -0.42 0.00 0.00 57.16 56.43 3f06 n GLU 170 Cb 0.50 -1.69 -0.16 0.00 -0.57 0.00 0.00 31.44 29.52 3f06 n GLU 170 CO 0.00 0.00 0.00 1.03 -0.48 0.00 0.00 177.13 177.68 3f06 s ARG 171 N -3.11 0.47 -0.12 3.49 0.52 -1.26 -4.78 118.95 114.16 3f06 s ARG 171 Ca -0.05 -0.53 -0.07 0.00 -0.52 0.00 0.00 55.73 54.56 3f06 s ARG 171 Cb 0.10 -1.83 -0.04 0.00 0.52 0.00 0.00 34.95 33.70 3f06 s ARG 171 CO 0.84 -0.81 0.12 0.42 0.02 0.00 0.00 175.30 175.89 3f06 s ILE 172 N 1.91 5.33 -0.16 1.52 -1.09 -0.95 0.13 121.20 127.88 3f06 s ILE 172 Ca 0.04 0.14 -0.01 0.00 -2.23 0.00 0.00 60.65 58.60 3f06 s ILE 172 Cb -0.17 -3.32 -0.00 0.00 -1.58 0.00 0.00 42.46 37.38 3f06 s ILE 172 CO -0.18 0.60 -0.13 -0.22 -1.23 0.00 0.00 174.94 173.77 3f06 s LEU 173 N -0.84 2.59 -0.28 2.97 2.96 -0.46 -1.46 118.68 124.17 3f06 s LEU 173 Ca 0.14 -0.43 -0.06 0.00 -0.22 0.00 0.00 54.13 53.55 3f06 s LEU 173 Cb -0.12 -1.60 0.00 0.00 0.50 0.00 0.00 46.19 44.97 3f06 s LEU 173 CO 0.03 0.08 0.06 -0.47 -1.32 0.00 0.00 176.35 174.73 3f06 s TYR 174 N 0.85 3.11 -0.20 5.38 5.04 0.58 -0.63 117.35 131.49 3f06 s TYR 174 Ca -0.04 -0.92 -0.04 0.00 -2.44 0.00 0.00 57.07 53.63 3f06 s TYR 174 Cb -0.15 -2.22 -0.02 0.00 0.35 0.00 0.00 41.96 39.92 3f06 s TYR 174 CO -0.00 -0.55 -0.03 0.08 -1.34 0.00 0.00 175.55 173.71 3f06 s VAL 175 N 1.50 3.68 -0.40 3.14 1.01 -0.02 -0.13 120.40 129.19 3f06 s VAL 175 Ca 0.03 -0.40 -0.02 0.00 0.00 0.00 0.00 61.98 61.59 3f06 s VAL 175 Cb -0.16 -2.66 0.11 0.00 0.00 0.00 0.00 36.38 33.67 3f06 s VAL 175 CO 0.02 0.44 0.19 -0.62 0.00 0.00 0.00 175.10 175.13 3f06 s ASP 176 N 1.03 5.20 -0.07 3.32 -1.08 0.42 -0.99 116.67 124.50 3f06 s ASP 176 Ca 0.01 -2.06 0.13 0.00 -0.52 0.00 0.00 52.55 50.11 3f06 s ASP 176 Cb -0.15 -1.81 0.50 0.00 -1.46 0.00 0.00 42.92 40.01 3f06 s ASP 176 CO 0.01 -0.52 1.37 0.18 0.52 0.00 0.00 175.17 176.72 3f06 n LEU 177 N 4.53 3.39 -4.76 -1.34 4.77 -0.30 -2.43 117.00 120.86 3f06 n LEU 177 Ca -0.01 -1.71 -0.31 0.00 -0.03 0.00 0.00 56.01 53.95 3f06 n LEU 177 Cb 0.41 -0.47 0.10 0.00 -2.33 0.00 0.00 43.42 41.13 3f06 n LEU 177 CO 0.32 0.60 0.69 -0.62 -1.33 0.00 0.00 177.39 177.06 3f06 s ASP 178 N -0.79 4.35 0.51 -1.43 2.15 -1.26 -4.55 116.67 115.65 3f06 s ASP 178 Ca 0.35 1.76 0.24 0.00 0.43 0.00 0.00 52.55 55.33 3f06 s ASP 178 Cb 0.22 -2.46 1.38 0.00 -0.30 0.00 0.00 42.92 41.77 3f06 s ASP 178 CO 0.18 -2.12 2.08 0.25 -0.17 0.00 0.00 175.17 175.39 3f06 h LEU 179 N -1.19 0.00 -9.72 -1.34 5.85 -1.84 -3.40 115.31 103.67 3f06 h LEU 179 Ca -0.44 0.00 -0.62 0.00 0.84 0.00 0.00 57.88 57.65 3f06 h LEU 179 Cb 1.24 0.00 -0.08 0.00 0.37 0.00 0.00 40.66 42.19 3f06 h LEU 179 CO 0.52 0.11 -0.57 -1.00 -0.34 0.00 0.00 178.44 177.16 3f06 s HIS 180 N -4.42 3.25 0.24 1.25 3.76 -1.26 -2.03 115.29 116.08 3f06 s HIS 180 Ca -0.04 0.09 -0.31 0.00 -0.15 0.00 0.00 55.06 54.66 3f06 s HIS 180 Cb 0.14 -1.63 -0.11 0.00 1.11 0.00 0.00 32.58 32.09 3f06 s HIS 180 CO 0.61 0.53 1.64 -1.58 -0.85 0.00 0.00 174.74 175.09 3f06 s HIS 181 N -1.48 2.86 -0.92 1.40 2.46 -1.26 -4.84 115.29 113.51 3f06 s HIS 181 Ca 0.31 0.59 -0.08 0.00 0.47 0.00 0.00 55.06 56.35 3f06 s HIS 181 Cb -0.12 -4.07 -0.15 0.00 -0.13 0.00 0.00 32.58 28.10 3f06 s HIS 181 CO 0.23 -3.84 3.09 0.41 -2.47 0.00 0.00 174.74 172.16 3f06 n GLY 182 N 3.09 3.61 0.29 1.59 0.00 -1.26 -4.71 105.19 107.79 3f06 n GLY 182 Ca 0.12 -1.30 0.09 0.00 0.00 0.00 0.00 46.02 44.93 3f06 n GLY 182 CO 0.00 0.00 0.00 1.29 0.00 0.00 0.00 173.32 174.61 3f06 h ASP 183 N 4.38 0.22 -0.31 1.61 -0.00 -1.89 -2.49 116.42 117.93 3f06 h ASP 183 Ca 0.57 0.14 0.05 0.00 -0.00 0.00 0.00 57.03 57.79 3f06 h ASP 183 Cb 0.73 0.14 -0.05 0.00 -0.00 0.00 0.00 39.33 40.16 3f06 h ASP 183 CO 1.14 0.02 0.03 1.23 -0.00 0.00 0.00 179.24 181.66 3f06 h GLY 184 N 0.38 0.34 1.25 7.15 0.00 -1.45 -0.95 103.07 109.79 3f06 h GLY 184 Ca 0.48 0.01 -0.14 0.00 0.00 0.00 0.00 47.33 47.68 3f06 h GLY 184 CO -0.50 -0.04 -0.34 -2.08 0.00 0.00 0.00 176.54 173.58 3f06 h VAL 185 N 0.13 1.28 0.03 4.60 2.07 -1.28 -2.73 116.25 120.34 3f06 h VAL 185 Ca 0.15 -1.50 -0.00 0.00 0.82 0.00 0.00 66.70 66.17 3f06 h VAL 185 Cb 0.18 1.36 0.00 0.00 -1.52 0.00 0.00 31.29 31.31 3f06 h VAL 185 CO -0.22 0.50 -0.01 -0.08 0.02 0.00 0.00 177.57 177.77 3f06 h GLU 186 N 0.69 -0.03 -0.88 1.57 4.81 -1.13 -2.88 114.58 116.72 3f06 h GLU 186 Ca 0.07 0.00 0.07 0.00 -0.13 0.00 0.00 59.36 59.37 3f06 h GLU 186 Cb 0.90 0.01 -0.06 0.00 0.63 0.00 0.00 28.75 30.22 3f06 h GLU 186 CO 0.08 0.08 0.55 -0.44 -0.73 0.00 0.00 179.01 178.55 3f06 h ASP 187 N -0.14 0.86 -0.89 1.04 3.45 -1.19 0.27 116.42 119.81 3f06 h ASP 187 Ca -0.00 0.02 0.11 0.00 0.43 0.00 0.00 57.03 57.59 3f06 h ASP 187 Cb 0.13 -0.16 -0.07 0.00 -0.56 0.00 0.00 39.33 38.67 3f06 h ASP 187 CO 0.01 0.54 0.58 0.00 -1.57 0.00 0.00 179.24 178.79 3f06 h ALA 188 N 1.42 1.70 -0.10 3.45 0.00 -1.28 -2.97 119.26 121.47 3f06 h ALA 188 Ca 0.39 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.30 3f06 h ALA 188 Cb 0.19 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 17.80 3f06 h ALA 188 CO -0.18 0.10 0.00 1.19 0.00 0.00 0.00 179.25 180.36 3f06 n PHE 189 N -4.55 0.32 0.33 0.00 3.01 -0.55 -4.73 117.46 111.28 3f06 n PHE 189 Ca 0.16 -0.87 0.12 0.00 1.01 0.00 0.00 57.45 57.87 3f06 n PHE 189 Cb 0.36 -0.18 0.54 0.00 -0.01 0.00 0.00 39.48 40.19 3f06 n PHE 189 CO 0.00 0.00 0.00 0.66 1.01 0.00 0.00 176.76 178.43 3f06 h SER 190 N 0.69 0.00 -0.64 4.37 4.64 -0.34 -2.72 113.55 119.55 3f06 h SER 190 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3f06 h SER 190 Cb 1.06 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.15 3f06 h SER 190 CO 0.07 0.00 0.00 0.49 -0.87 0.00 0.00 176.83 176.52 3f06 n PHE 191 N -2.30 1.09 -4.13 4.77 3.72 -1.26 -1.50 117.46 117.85 3f06 n PHE 191 Ca 0.01 -0.55 -0.13 0.00 -0.05 0.00 0.00 57.45 56.73 3f06 n PHE 191 Cb 0.18 -0.10 -0.11 0.00 -0.94 0.00 0.00 39.48 38.51 3f06 n PHE 191 CO 0.00 0.00 0.00 -0.08 -0.05 0.00 0.00 176.76 176.63 3f06 s THR 192 N -1.36 0.72 -1.24 4.37 -1.32 -1.03 -3.84 115.64 111.95 3f06 s THR 192 Ca 0.46 -1.54 0.12 0.00 -1.21 0.00 0.00 61.69 59.52 3f06 s THR 192 Cb 0.27 -1.20 0.22 0.00 -1.51 0.00 0.00 72.50 70.27 3f06 s THR 192 CO 0.27 -0.60 1.08 -1.54 -2.21 0.00 0.00 174.62 171.63 3f06 n SER 193 N 0.68 2.52 0.08 8.08 3.41 -1.26 -4.42 113.62 122.70 3f06 n SER 193 Ca -0.17 -1.76 -0.08 0.00 -0.26 0.00 0.00 58.87 56.60 3f06 n SER 193 Cb 0.58 -0.13 0.03 0.00 -0.26 0.00 0.00 64.21 64.43 3f06 n SER 193 CO 0.00 0.00 0.00 0.11 -0.16 0.00 0.00 175.04 174.99 3f06 h LYS 194 N 2.27 0.25 -5.01 4.33 1.79 -1.93 -3.43 116.57 114.84 3f06 h LYS 194 Ca 0.00 -0.23 -0.64 0.00 -2.18 0.00 0.00 60.65 57.60 3f06 h LYS 194 Cb 0.63 0.06 -0.34 0.00 -1.58 0.00 0.00 32.23 30.99 3f06 h LYS 194 CO 0.00 0.91 -0.86 0.08 -1.08 0.00 0.00 179.45 178.50 3f06 s VAL 195 N -3.44 1.83 -0.13 0.50 1.01 -1.26 -2.23 120.40 116.68 3f06 s VAL 195 Ca -0.04 -0.84 -0.02 0.00 0.00 0.00 0.00 61.98 61.08 3f06 s VAL 195 Cb 0.11 -1.64 -0.03 0.00 0.00 0.00 0.00 36.38 34.82 3f06 s VAL 195 CO 0.82 0.51 -0.06 -0.32 0.00 0.00 0.00 175.10 176.04 3f06 s MET 196 N 0.90 3.35 -0.07 2.72 1.75 -0.53 -4.90 119.30 122.52 3f06 s MET 196 Ca -0.07 -0.56 0.00 0.00 -1.25 0.00 0.00 55.69 53.82 3f06 s MET 196 Cb -0.15 -2.77 -0.03 0.00 2.84 0.00 0.00 34.83 34.72 3f06 s MET 196 CO -0.02 0.36 -0.05 0.95 -0.65 0.00 0.00 175.02 175.61 3f06 s THR 197 N 0.02 3.86 -0.09 10.11 -4.23 -1.23 -0.31 115.64 123.77 3f06 s THR 197 Ca -0.01 -0.44 0.01 0.00 -1.18 0.00 0.00 61.69 60.07 3f06 s THR 197 Cb -0.14 -2.59 0.02 0.00 1.34 0.00 0.00 72.50 71.13 3f06 s THR 197 CO 0.03 0.59 -0.10 -0.69 -0.54 0.00 0.00 174.62 173.92 3f06 s VAL 198 N -0.84 1.05 -0.09 2.29 1.01 0.81 -0.28 120.40 124.35 3f06 s VAL 198 Ca 0.13 -0.37 -0.01 0.00 0.00 0.00 0.00 61.98 61.73 3f06 s VAL 198 Cb -0.11 -1.02 0.03 0.00 0.00 0.00 0.00 36.38 35.27 3f06 s VAL 198 CO 0.02 0.36 -0.04 -0.55 0.00 0.00 0.00 175.10 174.89 3f06 s SER 199 N 1.20 1.81 -0.34 3.32 0.15 -0.50 -0.44 113.70 118.90 3f06 s SER 199 Ca -0.05 -0.19 -0.11 0.00 0.70 0.00 0.00 55.95 56.31 3f06 s SER 199 Cb -0.14 -0.63 0.00 0.00 -1.71 0.00 0.00 66.02 63.55 3f06 s SER 199 CO -0.03 -0.15 0.20 -0.76 1.20 0.00 0.00 173.24 173.70 3f06 s LEU 200 N 1.76 4.44 0.15 3.45 1.02 -1.02 -1.05 118.68 127.43 3f06 s LEU 200 Ca 0.04 -0.67 -0.11 0.00 0.02 0.00 0.00 54.13 53.40 3f06 s LEU 200 Cb -0.13 -2.05 0.00 0.00 0.02 0.00 0.00 46.19 44.04 3f06 s LEU 200 CO -0.06 -0.28 0.32 -1.38 0.02 0.00 0.00 176.35 174.97 3f06 s HIS 201 N 1.62 0.19 0.18 0.29 -3.43 -1.17 -4.38 115.29 108.60 3f06 s HIS 201 Ca 0.04 -0.56 -0.30 0.00 -0.80 0.00 0.00 55.06 53.44 3f06 s HIS 201 Cb -0.18 0.06 -0.08 0.00 -1.43 0.00 0.00 32.58 30.95 3f06 s HIS 201 CO 0.07 -0.72 1.18 0.21 -2.00 0.00 0.00 174.74 173.48 3f06 s LYS 202 N -3.91 4.51 -0.09 -0.38 2.20 -0.86 -1.62 119.74 119.59 3f06 s LYS 202 Ca 0.12 1.84 0.00 0.00 -0.36 0.00 0.00 55.97 57.57 3f06 s LYS 202 Cb 0.03 -3.25 0.02 0.00 -1.51 0.00 0.00 37.83 33.12 3f06 s LYS 202 CO -0.04 -0.06 -0.07 0.12 -0.36 0.00 0.00 175.35 174.94 3f06 s PHE 203 N -0.07 1.32 -0.29 4.03 2.19 -0.47 -4.70 117.98 119.99 3f06 s PHE 203 Ca 0.52 -0.59 -0.22 0.00 0.33 0.00 0.00 56.93 56.97 3f06 s PHE 203 Cb -0.32 -1.10 0.15 0.00 -1.31 0.00 0.00 43.02 40.44 3f06 s PHE 203 CO 0.36 -0.42 1.13 0.45 1.83 0.00 0.00 175.22 178.57 3f06 s SER 204 N 1.48 -0.35 -0.09 6.13 0.15 -1.26 -4.66 113.70 115.10 3f06 s SER 204 Ca 0.00 0.64 -0.36 0.00 0.70 0.00 0.00 55.95 56.93 3f06 s SER 204 Cb -0.13 0.79 -0.14 0.00 -1.71 0.00 0.00 66.02 64.83 3f06 s SER 204 CO -0.05 -0.11 1.74 -2.65 1.20 0.00 0.00 173.24 173.38 3f06 n PRO 205 N 2.46 1.77 -0.01 5.44 -0.02 -1.26 -1.34 135.00 142.04 3f06 n PRO 205 Ca -0.14 0.65 0.00 0.00 -2.02 0.00 0.00 63.50 61.99 3f06 n PRO 205 Cb 0.56 -2.41 0.00 0.00 -0.02 0.00 0.00 33.50 31.63 3f06 n PRO 205 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3f06 n GLY 206 N 4.01 0.21 3.63 -1.23 0.00 -1.26 -5.06 105.19 105.49 3f06 n GLY 206 Ca 0.23 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.86 3f06 n GLY 206 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 3f06 s PHE 207 N -2.05 3.29 0.26 1.61 5.36 -0.45 -4.99 117.98 121.01 3f06 s PHE 207 Ca 0.00 0.43 -0.30 0.00 -0.96 0.00 0.00 56.93 56.10 3f06 s PHE 207 Cb 0.00 -2.52 -0.14 0.00 -0.34 0.00 0.00 43.02 40.02 3f06 s PHE 207 CO 0.00 -0.14 1.21 0.34 -1.46 0.00 0.00 175.22 175.17 3f06 n PHE 208 N 4.98 1.74 0.71 10.12 -0.00 -1.26 -0.97 117.46 132.77 3f06 n PHE 208 Ca -0.09 0.59 0.11 0.00 -0.00 0.00 0.00 57.45 58.06 3f06 n PHE 208 Cb 0.51 -2.35 0.28 0.00 -0.00 0.00 0.00 39.48 37.92 3f06 n PHE 208 CO 0.00 0.00 0.00 -0.35 -0.00 0.00 0.00 176.76 176.41 3f06 n PRO 209 N 1.26 2.16 -0.89 -7.13 -0.04 -1.26 -4.62 135.00 124.49 3f06 n PRO 209 Ca 0.10 -1.75 0.00 0.00 -0.04 0.00 0.00 63.50 61.81 3f06 n PRO 209 Cb 0.31 -1.45 0.00 0.00 -0.04 0.00 0.00 33.50 32.32 3f06 n PRO 209 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3f06 n GLY 210 N 1.33 0.48 3.64 0.55 0.00 -0.15 -5.05 105.19 106.00 3f06 n GLY 210 Ca 0.18 -0.66 -0.30 0.00 0.00 0.00 0.00 46.02 45.23 3f06 n GLY 210 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3f06 n THR 211 N -2.89 0.00 -1.79 2.61 -2.24 -1.26 -4.96 114.28 103.75 3f06 n THR 211 Ca 0.00 -2.48 0.00 0.00 -2.27 0.00 0.00 64.05 59.30 3f06 n THR 211 Cb 0.00 0.67 0.00 0.00 -2.10 0.00 0.00 70.33 68.90 3f06 n THR 211 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3f06 n GLY 212 N -1.12 0.61 3.90 3.38 0.00 -1.26 -4.84 105.19 105.87 3f06 n GLY 212 Ca -0.15 -0.45 -0.28 0.00 0.00 0.00 0.00 46.02 45.14 3f06 n GLY 212 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3f06 s ASP 213 N -2.71 5.57 0.56 1.61 3.68 -1.26 -4.43 116.67 119.68 3f06 s ASP 213 Ca 0.00 0.90 0.25 0.00 2.13 0.00 0.00 52.55 55.83 3f06 s ASP 213 Cb 0.00 -1.82 1.50 0.00 -1.45 0.00 0.00 42.92 41.15 3f06 s ASP 213 CO 0.00 -1.15 2.07 1.62 0.13 0.00 0.00 175.17 177.84 3f06 h VAL 214 N -0.35 0.65 0.00 1.11 3.04 -1.96 -0.45 116.25 118.28 3f06 h VAL 214 Ca -0.45 0.00 -0.01 0.00 -1.01 0.00 0.00 66.70 65.23 3f06 h VAL 214 Cb 1.25 0.83 -0.00 0.00 -2.01 0.00 0.00 31.29 31.36 3f06 h VAL 214 CO 0.62 0.00 -0.05 0.77 -1.01 0.00 0.00 177.57 177.89 3f06 h SER 215 N 0.00 0.00 -3.02 3.17 4.64 -1.92 -3.43 113.55 112.99 3f06 h SER 215 Ca 0.13 0.00 -0.57 0.00 -0.47 0.00 0.00 61.79 60.88 3f06 h SER 215 Cb 0.58 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.63 3f06 h SER 215 CO -0.00 0.05 1.09 -0.62 -0.87 0.00 0.00 176.83 176.48 3f06 s ASP 216 N -5.80 6.38 0.00 4.97 3.68 -0.18 -4.85 116.67 120.87 3f06 s ASP 216 Ca 0.00 1.21 0.00 0.00 2.13 0.00 0.00 52.55 55.89 3f06 s ASP 216 Cb 0.10 -2.54 0.00 0.00 -1.45 0.00 0.00 42.92 39.03 3f06 s ASP 216 CO 0.56 -1.33 0.47 1.33 0.13 0.00 0.00 175.17 176.33 3f06 n VAL 217 N 6.71 0.21 0.00 1.11 0.24 -1.26 -4.29 118.33 121.05 3f06 n VAL 217 Ca 0.17 -0.30 0.00 0.00 -2.04 0.00 0.00 64.34 62.18 3f06 n VAL 217 Cb 0.47 1.17 0.00 0.00 -1.47 0.00 0.00 33.84 34.01 3f06 n VAL 217 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3f06 n GLY 218 N -0.11 1.15 3.08 7.63 0.00 -1.26 -0.69 105.19 114.98 3f06 n GLY 218 Ca 0.00 -2.23 -0.13 0.00 0.00 0.00 0.00 46.02 43.66 3f06 n GLY 218 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3f06 s LEU 219 N 0.00 2.27 0.00 0.99 2.01 -0.56 -4.60 118.68 118.79 3f06 s LEU 219 Ca 0.00 -0.57 0.00 0.00 0.01 0.00 0.00 54.13 53.57 3f06 s LEU 219 Cb 0.00 -0.20 0.00 0.00 0.01 0.00 0.00 46.19 46.00 3f06 s LEU 219 CO 0.00 -0.20 0.00 0.61 1.01 0.00 0.00 176.35 177.77 3f06 n GLY 220 N 1.39 3.35 0.00 -3.19 0.00 -1.26 -1.00 105.19 104.47 3f06 n GLY 220 Ca -0.22 -0.02 0.04 0.00 0.00 0.00 0.00 46.02 45.82 3f06 n GLY 220 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3f06 n LYS 221 N 14.00 0.16 -0.21 1.61 5.02 -1.26 -1.56 118.16 135.92 3f06 n LYS 221 Ca 0.00 0.13 0.06 0.00 -2.02 0.00 0.00 58.31 56.48 3f06 n LYS 221 Cb 0.00 -1.50 0.16 0.00 -0.02 0.00 0.00 35.03 33.67 3f06 n LYS 221 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3f06 n GLY 222 N -0.60 2.95 3.72 0.72 0.00 -0.17 -4.04 105.19 107.77 3f06 n GLY 222 Ca 0.04 -0.46 -0.42 0.00 0.00 0.00 0.00 46.02 45.18 3f06 n GLY 222 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 3f06 n ARG 223 N 0.34 2.71 0.00 1.61 0.63 -0.60 -1.40 116.66 119.94 3f06 n ARG 223 Ca 0.13 0.97 0.00 0.00 -0.92 0.00 0.00 57.85 58.03 3f06 n ARG 223 Cb 0.49 -2.80 0.00 0.00 0.45 0.00 0.00 32.46 30.59 3f06 n ARG 223 CO 0.00 0.00 0.00 0.66 -2.51 0.00 0.00 177.63 175.78 3f06 n TYR 224 N 3.64 0.00 -0.94 -0.14 4.01 0.13 -4.88 117.16 118.98 3f06 n TYR 224 Ca 0.15 0.00 -0.22 0.00 -0.16 0.00 0.00 57.90 57.67 3f06 n TYR 224 Cb 0.35 0.00 0.07 0.00 -0.31 0.00 0.00 39.34 39.45 3f06 n TYR 224 CO 0.00 0.00 0.00 0.66 -0.46 0.00 0.00 176.86 177.06 3f06 n TYR 225 N -2.00 2.19 -3.66 -0.72 4.02 -0.50 -4.68 117.16 111.81 3f06 n TYR 225 Ca 0.00 -2.17 -0.10 0.00 -0.01 0.00 0.00 57.90 55.62 3f06 n TYR 225 Cb 0.00 -1.06 -0.11 0.00 -0.02 0.00 0.00 39.34 38.16 3f06 n TYR 225 CO 0.00 0.00 0.00 -1.12 -1.01 0.00 0.00 176.86 174.73 3f06 s SER 226 N -0.61 -0.10 -0.12 7.72 0.01 -1.13 -3.47 113.70 116.01 3f06 s SER 226 Ca 0.43 0.86 0.03 0.00 1.31 0.00 0.00 55.95 58.59 3f06 s SER 226 Cb 0.34 1.10 0.01 0.00 0.21 0.00 0.00 66.02 67.68 3f06 s SER 226 CO 0.01 -0.23 -0.22 -0.69 0.41 0.00 0.00 173.24 172.52 3f06 s VAL 227 N 2.44 1.99 -0.12 3.43 1.01 0.61 -4.30 120.40 125.46 3f06 s VAL 227 Ca -0.02 -0.96 0.01 0.00 0.00 0.00 0.00 61.98 61.01 3f06 s VAL 227 Cb -0.12 -1.74 0.02 0.00 0.00 0.00 0.00 36.38 34.54 3f06 s VAL 227 CO -0.11 0.54 -0.12 0.20 0.00 0.00 0.00 175.10 175.61 3f06 s ASN 228 N 0.59 2.35 -0.77 3.32 0.01 -1.26 -1.41 114.94 117.76 3f06 s ASN 228 Ca -0.13 -0.39 -0.07 0.00 -0.71 0.00 0.00 52.86 51.57 3f06 s ASN 228 Cb -0.17 -1.00 0.20 0.00 0.41 0.00 0.00 41.25 40.69 3f06 s ASN 228 CO 0.04 -0.05 0.65 -0.69 -1.51 0.00 0.00 177.10 175.53 3f06 s VAL 229 N 1.36 4.58 0.13 1.60 1.01 -0.22 -4.02 120.40 124.85 3f06 s VAL 229 Ca 0.00 -2.99 -0.31 0.00 0.00 0.00 0.00 61.98 58.68 3f06 s VAL 229 Cb -0.13 -3.88 -0.09 0.00 0.00 0.00 0.00 36.38 32.27 3f06 s VAL 229 CO -0.06 -0.98 1.47 -2.16 0.00 0.00 0.00 175.10 173.37 3f06 s PRO 230 N -0.29 4.27 0.17 2.72 0.04 -1.26 -3.05 135.00 137.61 3f06 s PRO 230 Ca 0.20 2.20 0.04 0.00 0.04 0.00 0.00 61.00 63.48 3f06 s PRO 230 Cb -0.14 -3.22 -0.05 0.00 0.04 0.00 0.00 34.50 31.13 3f06 s PRO 230 CO -0.07 -0.52 -0.07 0.42 0.04 0.00 0.00 177.00 176.81 3f06 s ILE 231 N 1.17 1.10 0.44 0.56 1.01 -0.64 -4.86 121.20 119.99 3f06 s ILE 231 Ca 0.67 -2.05 0.07 0.00 0.00 0.00 0.00 60.65 59.34 3f06 s ILE 231 Cb -0.40 -2.01 -0.04 0.00 0.01 0.00 0.00 42.46 40.02 3f06 s ILE 231 CO 0.31 -0.60 0.19 -1.10 0.00 0.00 0.00 174.94 173.73 3f06 s GLN 232 N -3.79 2.22 0.99 2.79 -1.52 -1.26 -1.37 119.66 117.72 3f06 s GLN 232 Ca 0.21 -1.92 -0.12 0.00 -1.95 0.00 0.00 55.36 51.58 3f06 s GLN 232 Cb 0.04 -1.95 0.14 0.00 -0.22 0.00 0.00 33.01 31.02 3f06 s GLN 232 CO 0.03 -0.19 0.84 -0.25 -0.25 0.00 0.00 175.29 175.47 3f06 n ASP 233 N -1.29 -0.88 0.00 5.90 8.00 -1.26 -3.89 116.55 123.13 3f06 n ASP 233 Ca -0.03 0.25 0.00 0.00 0.71 0.00 0.00 54.79 55.72 3f06 n ASP 233 Cb 0.65 -1.33 0.00 0.00 -0.02 0.00 0.00 41.12 40.42 3f06 n ASP 233 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3f06 n GLY 234 N 0.86 3.03 3.59 0.44 0.00 -0.91 -1.06 105.19 111.14 3f06 n GLY 234 Ca 0.08 0.00 -0.51 0.00 0.00 0.00 0.00 46.02 45.59 3f06 n GLY 234 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 3f06 n ILE 235 N -1.95 0.32 -3.82 -0.61 3.06 -1.25 -4.33 119.36 110.77 3f06 n ILE 235 Ca 0.00 -0.08 -0.25 0.00 -2.50 0.00 0.00 62.75 59.92 3f06 n ILE 235 Cb 0.00 -0.83 -0.01 0.00 0.54 0.00 0.00 39.64 39.34 3f06 n ILE 235 CO 0.00 0.00 0.00 -1.10 -2.50 0.00 0.00 176.55 172.95 3f06 s GLN 236 N 0.18 2.29 0.19 9.51 -0.21 -1.26 -1.53 119.66 128.82 3f06 s GLN 236 Ca 0.80 -1.92 -0.23 0.00 0.02 0.00 0.00 55.36 54.03 3f06 s GLN 236 Cb -0.92 -2.15 0.09 0.00 1.00 0.00 0.00 33.01 31.03 3f06 s GLN 236 CO 0.49 -0.53 1.56 -0.44 -2.12 0.00 0.00 175.29 174.25 3f06 h ASP 237 N 0.82 -1.49 0.43 5.90 3.32 -1.94 -1.96 116.42 121.50 3f06 h ASP 237 Ca -0.38 0.27 -0.02 0.00 0.02 0.00 0.00 57.03 56.92 3f06 h ASP 237 Cb 1.29 0.71 0.00 0.00 0.22 0.00 0.00 39.33 41.56 3f06 h ASP 237 CO 0.58 -0.31 -0.21 -0.08 -1.72 0.00 0.00 179.24 177.50 3f06 h GLU 238 N -0.14 -0.56 -0.98 3.56 4.81 -1.97 -0.22 114.58 119.08 3f06 h GLU 238 Ca 0.23 0.04 0.14 0.00 -0.13 0.00 0.00 59.36 59.63 3f06 h GLU 238 Cb 0.55 0.13 -0.09 0.00 0.63 0.00 0.00 28.75 29.98 3f06 h GLU 238 CO -0.79 -0.32 0.62 -0.22 -0.73 0.00 0.00 179.01 177.57 3f06 h LYS 239 N -0.67 0.87 -0.18 1.92 1.63 -1.96 -1.69 116.57 116.49 3f06 h LYS 239 Ca -0.06 -0.05 -0.04 0.00 -0.85 0.00 0.00 60.65 59.65 3f06 h LYS 239 Cb 0.49 -0.20 -0.01 0.00 -0.60 0.00 0.00 32.23 31.92 3f06 h LYS 239 CO 0.10 0.57 -0.04 -0.92 -3.45 0.00 0.00 179.45 175.71 3f06 h TYR 240 N 0.89 0.38 -0.76 1.91 5.03 -1.06 -2.67 116.97 120.69 3f06 h TYR 240 Ca 0.50 -0.08 -0.06 0.00 2.58 0.00 0.00 58.73 61.67 3f06 h TYR 240 Cb 0.61 -0.09 -0.03 0.00 1.55 0.00 0.00 36.73 38.76 3f06 h TYR 240 CO -0.00 0.60 0.25 -0.92 -1.32 0.00 0.00 178.16 176.77 3f06 h TYR 241 N 0.06 1.21 0.02 -3.82 5.03 -0.52 -0.33 116.97 118.62 3f06 h TYR 241 Ca 0.05 -0.12 0.03 0.00 2.58 0.00 0.00 58.73 61.27 3f06 h TYR 241 Cb 0.47 -0.35 -0.04 0.00 1.55 0.00 0.00 36.73 38.37 3f06 h TYR 241 CO 0.05 0.94 -0.20 1.96 -1.32 0.00 0.00 178.16 179.60 3f06 h GLN 242 N 1.13 -0.31 -0.37 1.82 4.20 -1.31 0.59 115.11 120.85 3f06 h GLN 242 Ca 0.25 0.02 0.03 0.00 0.06 0.00 0.00 58.65 59.01 3f06 h GLN 242 Cb 0.29 0.07 -0.03 0.00 0.30 0.00 0.00 27.48 28.11 3f06 h GLN 242 CO -0.01 -0.21 0.17 0.82 -0.67 0.00 0.00 178.83 178.93 3f06 h ILE 243 N -0.33 0.95 -0.15 2.54 2.04 -1.18 -0.85 117.51 120.54 3f06 h ILE 243 Ca 0.05 -0.12 -0.04 0.00 1.00 0.00 0.00 64.86 65.75 3f06 h ILE 243 Cb 0.39 0.57 -0.00 0.00 -0.74 0.00 0.00 36.82 37.04 3f06 h ILE 243 CO -0.17 0.06 -0.07 0.00 0.00 0.00 0.00 178.15 177.97 3f06 h GLU 245 N -0.03 0.77 0.62 0.00 4.22 0.25 0.76 114.58 121.17 3f06 h GLU 245 Ca 0.03 -0.05 -0.02 0.00 0.08 0.00 0.00 59.36 59.40 3f06 h GLU 245 Cb 0.55 -0.17 -0.02 0.00 0.50 0.00 0.00 28.75 29.61 3f06 h GLU 245 CO 0.02 0.51 -0.50 1.03 -2.18 0.00 0.00 179.01 177.89 3f06 h SER 246 N 0.80 -1.33 -0.32 1.04 0.87 -1.15 -1.73 113.55 111.73 3f06 h SER 246 Ca 0.24 0.09 0.00 0.00 -1.23 0.00 0.00 61.79 60.90 3f06 h SER 246 Cb -0.03 0.42 -0.02 0.00 -0.44 0.00 0.00 62.40 62.34 3f06 h SER 246 CO -0.08 -0.70 0.20 0.58 -0.53 0.00 0.00 176.83 176.30 3f06 h VAL 247 N -1.09 1.09 0.00 2.23 2.07 -1.29 -1.70 116.25 117.57 3f06 h VAL 247 Ca -0.08 -0.19 -0.00 0.00 0.82 0.00 0.00 66.70 67.25 3f06 h VAL 247 Cb 0.91 0.65 -0.00 0.00 -1.52 0.00 0.00 31.29 31.33 3f06 h VAL 247 CO 0.00 0.09 -0.00 -0.07 0.02 0.00 0.00 177.57 177.61 3f06 h LEU 248 N 0.42 0.00 0.30 2.57 3.38 -0.82 -1.45 115.31 119.71 3f06 h LEU 248 Ca 0.12 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.07 3f06 h LEU 248 Cb -0.03 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.73 3f06 h LEU 248 CO -0.02 0.00 -0.14 0.50 0.09 0.00 0.00 178.44 178.87 3f06 h LYS 249 N 0.00 -0.38 -0.98 1.13 1.63 -0.38 -2.47 116.57 115.11 3f06 h LYS 249 Ca -0.00 0.03 0.16 0.00 -0.85 0.00 0.00 60.65 59.99 3f06 h LYS 249 Cb 0.04 0.09 -0.09 0.00 -0.60 0.00 0.00 32.23 31.67 3f06 h LYS 249 CO 0.00 -0.26 0.62 0.93 -3.45 0.00 0.00 179.45 177.29 3f06 h GLU 250 N -0.90 0.78 -0.50 1.90 4.39 -1.14 -1.96 114.58 117.16 3f06 h GLU 250 Ca -0.04 -0.05 -0.13 0.00 0.34 0.00 0.00 59.36 59.49 3f06 h GLU 250 Cb 0.31 -0.18 -0.01 0.00 -0.10 0.00 0.00 28.75 28.76 3f06 h GLU 250 CO 0.07 0.52 -0.18 0.28 -1.16 0.00 0.00 179.01 178.53 3f06 h VAL 251 N 0.81 1.27 0.00 3.13 2.07 -1.36 -1.51 116.25 120.65 3f06 h VAL 251 Ca 0.53 -1.35 -0.06 0.00 0.82 0.00 0.00 66.70 66.64 3f06 h VAL 251 Cb 0.76 1.07 -0.01 0.00 -1.52 0.00 0.00 31.29 31.60 3f06 h VAL 251 CO -0.30 0.47 -0.30 0.22 0.02 0.00 0.00 177.57 177.68 3f06 h TYR 252 N 0.87 0.00 0.06 1.57 3.20 -0.88 -0.46 116.97 121.33 3f06 h TYR 252 Ca 0.12 0.00 -0.00 0.00 3.14 0.00 0.00 58.73 61.99 3f06 h TYR 252 Cb 0.76 0.00 0.00 0.00 1.54 0.00 0.00 36.73 39.03 3f06 h TYR 252 CO 0.05 0.30 -0.03 0.37 -1.64 0.00 0.00 178.16 177.21 3f06 h GLN 253 N 0.00 -0.07 0.00 1.82 5.75 -1.10 -2.22 115.11 119.29 3f06 h GLN 253 Ca -0.00 0.01 -0.05 0.00 -0.15 0.00 0.00 58.65 58.45 3f06 h GLN 253 Cb 0.69 0.02 -0.01 0.00 1.07 0.00 0.00 27.48 29.25 3f06 h GLN 253 CO 0.04 -0.05 -0.24 0.00 -2.65 0.00 0.00 178.83 175.93 3f06 h ALA 254 N -1.93 1.20 0.00 3.38 0.00 -1.32 -3.32 119.26 117.28 3f06 h ALA 254 Ca -0.01 -0.22 -0.38 0.00 0.00 0.00 0.00 54.91 54.30 3f06 h ALA 254 Cb 0.06 -0.04 -0.07 0.00 0.00 0.00 0.00 17.79 17.74 3f06 h ALA 254 CO 0.01 0.30 -2.46 0.34 0.00 0.00 0.00 179.25 177.45 3f06 n PHE 255 N -3.67 0.00 -3.43 0.00 7.35 -0.18 -4.69 117.46 112.84 3f06 n PHE 255 Ca -0.01 0.00 -0.15 0.00 -0.76 0.00 0.00 57.45 56.53 3f06 n PHE 255 Cb 0.36 -0.99 0.01 0.00 0.35 0.00 0.00 39.48 39.21 3f06 n PHE 255 CO 0.00 0.00 0.00 -1.71 -0.76 0.00 0.00 176.76 174.29 3f06 n ASN 256 N -3.19 -6.32 -4.74 -2.13 4.05 -0.83 -4.92 115.26 97.18 3f06 n ASN 256 Ca -0.44 -0.57 -0.33 0.00 0.45 0.00 0.00 54.58 53.69 3f06 n ASN 256 Cb 1.01 -3.75 0.09 0.00 1.23 0.00 0.00 39.78 38.35 3f06 n ASN 256 CO 0.00 0.00 0.00 -2.16 -3.05 0.00 0.00 177.26 172.05 3f06 s PRO 257 N -4.27 2.25 -0.24 1.20 0.04 -1.26 -4.97 135.00 127.75 3f06 s PRO 257 Ca 0.11 1.48 -0.05 0.00 0.04 0.00 0.00 61.00 62.58 3f06 s PRO 257 Cb -0.04 -1.87 -0.17 0.00 0.04 0.00 0.00 34.50 32.46 3f06 s PRO 257 CO 0.82 -1.69 -0.14 1.63 0.04 0.00 0.00 177.00 177.65 3f06 n LYS 258 N -2.98 0.65 -4.23 4.56 4.01 0.12 -5.02 118.16 115.26 3f06 n LYS 258 Ca 0.11 0.22 -0.13 0.00 -0.51 0.00 0.00 58.31 58.00 3f06 n LYS 258 Cb 0.52 -1.56 -0.10 0.00 -0.51 0.00 0.00 35.03 33.38 3f06 n LYS 258 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 3f06 s ALA 259 N -2.51 1.32 -0.03 7.82 0.00 -1.08 -4.06 121.76 123.21 3f06 s ALA 259 Ca -0.34 -1.55 0.02 0.00 0.00 0.00 0.00 51.96 50.09 3f06 s ALA 259 Cb 0.10 0.41 0.01 0.00 0.00 0.00 0.00 23.12 23.64 3f06 s ALA 259 CO 0.60 -0.27 -0.06 0.08 0.00 0.00 0.00 175.76 176.11 3f06 s VAL 260 N -3.60 0.56 -0.19 0.00 1.01 0.26 -1.35 120.40 117.10 3f06 s VAL 260 Ca 0.21 -0.20 -0.01 0.00 0.00 0.00 0.00 61.98 61.98 3f06 s VAL 260 Cb 0.05 -0.54 0.01 0.00 0.00 0.00 0.00 36.38 35.90 3f06 s VAL 260 CO 0.02 0.20 -0.14 -0.69 0.00 0.00 0.00 175.10 174.50 3f06 s VAL 261 N 0.50 2.62 -0.18 2.92 1.01 0.20 -1.20 120.40 126.27 3f06 s VAL 261 Ca -0.07 -0.75 0.00 0.00 0.00 0.00 0.00 61.98 61.16 3f06 s VAL 261 Cb -0.10 -2.14 0.02 0.00 0.00 0.00 0.00 36.38 34.15 3f06 s VAL 261 CO 0.00 0.49 -0.18 -0.22 0.00 0.00 0.00 175.10 175.20 3f06 s LEU 262 N 1.30 2.25 -0.20 3.92 2.96 -0.38 -0.84 118.68 127.68 3f06 s LEU 262 Ca 0.04 -0.61 -0.12 0.00 -0.22 0.00 0.00 54.13 53.22 3f06 s LEU 262 Cb -0.14 -1.52 -0.05 0.00 0.50 0.00 0.00 46.19 44.99 3f06 s LEU 262 CO -0.08 0.00 0.22 -1.58 -1.32 0.00 0.00 176.35 173.60 3f06 s GLN 263 N 1.29 4.16 -0.38 1.98 -0.44 -0.16 -0.58 119.66 125.54 3f06 s GLN 263 Ca 0.05 -0.09 0.07 0.00 -2.50 0.00 0.00 55.36 52.88 3f06 s GLN 263 Cb -0.13 -3.48 0.44 0.00 -1.64 0.00 0.00 33.01 28.19 3f06 s GLN 263 CO -0.11 0.15 1.13 1.28 0.50 0.00 0.00 175.29 178.24 3f06 n LEU 264 N 3.95 4.55 -4.57 3.68 4.77 0.28 -1.15 117.00 128.51 3f06 n LEU 264 Ca -0.13 -4.93 -0.53 0.00 -0.03 0.00 0.00 56.01 50.39 3f06 n LEU 264 Cb 0.52 -0.35 -0.06 0.00 -2.33 0.00 0.00 43.42 41.20 3f06 n LEU 264 CO 0.38 2.13 0.80 0.61 -1.33 0.00 0.00 177.39 179.98 3f06 n GLY 265 N -0.54 0.24 0.81 -0.72 0.00 -1.20 -4.71 105.19 99.07 3f06 n GLY 265 Ca 0.38 0.68 0.05 0.00 0.00 0.00 0.00 46.02 47.13 3f06 n GLY 265 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3f06 n ALA 266 N 2.15 2.70 1.69 4.61 0.00 -0.54 -4.18 120.51 126.96 3f06 n ALA 266 Ca 0.18 -0.69 0.02 0.00 0.00 0.00 0.00 53.44 52.95 3f06 n ALA 266 Cb 0.18 -1.00 0.11 0.00 0.00 0.00 0.00 19.45 18.74 3f06 n ALA 266 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 3f06 n ASP 267 N 0.41 0.00 -0.05 0.00 5.68 -1.24 -2.28 116.55 119.07 3f06 n ASP 267 Ca 0.12 -1.58 -0.10 0.00 -0.50 0.00 0.00 54.79 52.74 3f06 n ASP 267 Cb 0.43 0.00 -0.15 0.00 -1.14 0.00 0.00 41.12 40.26 3f06 n ASP 267 CO 0.00 0.00 0.00 0.35 -1.33 0.00 0.00 177.20 176.22 3f06 n THR 268 N -0.57 1.52 -1.75 2.12 -2.24 -1.26 -4.76 114.28 107.35 3f06 n THR 268 Ca 0.03 -0.82 -0.41 0.00 -2.27 0.00 0.00 64.05 60.58 3f06 n THR 268 Cb 0.01 -0.82 0.01 0.00 -2.10 0.00 0.00 70.33 67.43 3f06 n THR 268 CO 0.00 0.00 0.00 -0.38 -0.57 0.00 0.00 175.07 174.12 3f06 n ILE 269 N -2.94 2.28 -1.70 2.28 -0.00 -0.96 -2.93 119.36 115.39 3f06 n ILE 269 Ca -0.24 -0.50 -0.39 0.00 -0.00 0.00 0.00 62.75 61.61 3f06 n ILE 269 Cb 1.10 -1.81 0.03 0.00 -0.00 0.00 0.00 39.64 38.95 3f06 n ILE 269 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.55 176.55 3f06 n ALA 270 N 0.16 1.18 0.00 -1.39 0.00 0.11 -2.75 120.51 117.82 3f06 n ALA 270 Ca 0.04 0.16 0.00 0.00 0.00 0.00 0.00 53.44 53.64 3f06 n ALA 270 Cb 0.39 -2.27 0.00 0.00 0.00 0.00 0.00 19.45 17.57 3f06 n ALA 270 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3f06 n GLY 271 N 0.88 2.71 3.75 0.00 0.00 -1.26 -4.98 105.19 106.30 3f06 n GLY 271 Ca 0.09 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.70 3f06 n GLY 271 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3f06 s ASP 272 N -1.28 6.81 0.26 1.61 2.15 -1.11 -4.79 116.67 120.32 3f06 s ASP 272 Ca 0.00 2.58 0.15 0.00 0.43 0.00 0.00 52.55 55.72 3f06 s ASP 272 Cb 0.00 -2.63 0.83 0.00 -0.30 0.00 0.00 42.92 40.82 3f06 s ASP 272 CO 0.00 -0.55 1.44 -0.81 -0.17 0.00 0.00 175.17 175.08 3f06 n PRO 273 N 1.68 0.10 0.22 4.34 -0.04 -1.26 -0.78 135.00 139.25 3f06 n PRO 273 Ca 0.03 0.58 0.07 0.00 -0.04 0.00 0.00 63.50 64.15 3f06 n PRO 273 Cb 0.42 -1.90 0.51 0.00 -0.04 0.00 0.00 33.50 32.48 3f06 n PRO 273 CO 0.00 0.00 0.00 1.98 -0.04 0.00 0.00 175.50 177.44 3f06 h MET 274 N 0.00 0.00 -6.83 0.54 4.05 -1.89 -3.47 114.93 107.34 3f06 h MET 274 Ca 0.00 0.00 -0.56 0.00 -0.28 0.00 0.00 59.70 58.86 3f06 h MET 274 Cb 0.15 0.00 -0.19 0.00 -0.80 0.00 0.00 31.60 30.76 3f06 h MET 274 CO 0.00 0.25 -0.90 0.00 0.23 0.00 0.00 176.91 176.50 3f06 n SER 276 N -2.79 0.00 -3.36 0.00 7.64 -1.26 -4.95 113.62 108.89 3f06 n SER 276 Ca -0.14 0.00 -0.31 0.00 1.01 0.00 0.00 58.87 59.43 3f06 n SER 276 Cb 0.60 0.00 0.30 0.00 -1.01 0.00 0.00 64.21 64.09 3f06 n SER 276 CO 0.00 0.00 0.00 -0.36 -3.01 0.00 0.00 175.04 171.67 3f06 s PHE 277 N 0.00 -0.84 -0.36 1.43 2.99 -1.26 -2.13 117.98 117.81 3f06 s PHE 277 Ca 0.00 0.58 0.14 0.00 0.00 0.00 0.00 56.93 57.64 3f06 s PHE 277 Cb 0.00 -2.81 0.41 0.00 0.00 0.00 0.00 43.02 40.62 3f06 s PHE 277 CO 0.00 -5.18 1.00 -1.71 -0.00 0.00 0.00 175.22 169.33 3f06 n ASN 278 N -5.78 0.34 -4.80 1.36 5.15 -0.59 -4.58 115.26 106.37 3f06 n ASN 278 Ca 0.13 -2.81 -0.24 0.00 -0.60 0.00 0.00 54.58 51.06 3f06 n ASN 278 Cb 0.60 -0.04 0.08 0.00 -0.53 0.00 0.00 39.78 39.89 3f06 n ASN 278 CO 0.00 0.00 0.00 -0.04 1.40 0.00 0.00 177.26 178.62 3f06 s MET 279 N -2.04 2.00 0.15 1.20 -1.94 -1.15 -4.38 119.30 113.15 3f06 s MET 279 Ca 0.28 -0.70 0.02 0.00 -1.71 0.00 0.00 55.69 53.58 3f06 s MET 279 Cb 0.41 -2.29 -0.04 0.00 2.01 0.00 0.00 34.83 34.92 3f06 s MET 279 CO -0.02 -1.25 -0.02 0.95 -0.01 0.00 0.00 175.02 174.67 3f06 s THR 280 N -3.12 0.71 0.67 2.05 -4.23 -1.26 0.05 115.64 110.51 3f06 s THR 280 Ca 0.62 -1.97 0.44 0.00 -1.18 0.00 0.00 61.69 59.60 3f06 s THR 280 Cb -0.08 -1.99 0.44 0.00 1.34 0.00 0.00 72.50 72.20 3f06 s THR 280 CO 0.43 -0.59 2.34 -0.65 -0.54 0.00 0.00 174.62 175.61 3f06 h PRO 281 N 2.77 0.00 -0.04 3.99 0.11 -1.93 -2.43 132.00 134.47 3f06 h PRO 281 Ca -0.36 0.00 -0.11 0.00 0.11 0.00 0.00 66.00 65.64 3f06 h PRO 281 Cb 1.19 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.29 3f06 h PRO 281 CO 0.63 0.00 -0.47 0.28 -0.21 0.00 0.00 178.00 178.24 3f06 h VAL 282 N 0.00 1.34 0.56 3.15 2.07 -1.97 -0.15 116.25 121.26 3f06 h VAL 282 Ca 0.00 -1.63 -0.03 0.00 0.82 0.00 0.00 66.70 65.87 3f06 h VAL 282 Cb 0.05 1.83 0.01 0.00 -1.52 0.00 0.00 31.29 31.66 3f06 h VAL 282 CO 0.00 0.47 -0.27 1.23 0.02 0.00 0.00 177.57 179.02 3f06 h GLY 283 N 1.37 -0.79 0.48 2.17 0.00 -1.78 -2.62 103.07 101.90 3f06 h GLY 283 Ca 0.00 0.29 0.16 0.00 0.00 0.00 0.00 47.33 47.79 3f06 h GLY 283 CO 0.06 -0.29 0.57 -2.22 0.00 0.00 0.00 176.54 174.67 3f06 h ILE 284 N -1.18 0.78 -0.57 2.60 5.03 -1.63 -0.75 117.51 121.79 3f06 h ILE 284 Ca -0.08 -0.20 0.07 0.00 -0.12 0.00 0.00 64.86 64.53 3f06 h ILE 284 Cb 0.59 0.15 -0.06 0.00 -3.03 0.00 0.00 36.82 34.48 3f06 h ILE 284 CO 0.13 0.11 0.26 1.23 -0.68 0.00 0.00 178.15 179.19 3f06 h GLY 285 N 0.58 0.80 1.01 5.37 0.00 -0.92 0.13 103.07 110.04 3f06 h GLY 285 Ca 0.45 -0.16 -0.01 0.00 0.00 0.00 0.00 47.33 47.61 3f06 h GLY 285 CO -0.19 0.06 0.41 0.50 0.00 0.00 0.00 176.54 177.32 3f06 h LYS 286 N 0.48 1.01 -0.85 4.80 1.57 -0.75 0.20 116.57 123.03 3f06 h LYS 286 Ca 0.27 -0.11 -0.01 0.00 -1.87 0.00 0.00 60.65 58.93 3f06 h LYS 286 Cb 0.25 -0.20 -0.04 0.00 0.08 0.00 0.00 32.23 32.31 3f06 h LYS 286 CO -0.23 0.74 0.48 0.00 -0.57 0.00 0.00 179.45 179.88 3f06 h LEU 288 N 1.18 0.58 0.03 0.00 5.85 0.18 -2.32 115.31 120.82 3f06 h LEU 288 Ca 0.30 -0.31 0.03 0.00 0.84 0.00 0.00 57.88 58.74 3f06 h LEU 288 Cb -0.00 -0.16 -0.04 0.00 0.37 0.00 0.00 40.66 40.83 3f06 h LEU 288 CO -0.05 0.76 -0.27 0.11 -0.34 0.00 0.00 178.44 178.64 3f06 h LYS 289 N 0.40 -0.42 -0.67 1.25 1.57 0.04 -0.04 116.57 118.69 3f06 h LYS 289 Ca 0.09 0.03 0.14 0.00 -1.87 0.00 0.00 60.65 59.05 3f06 h LYS 289 Cb 0.46 0.10 -0.12 0.00 0.08 0.00 0.00 32.23 32.75 3f06 h LYS 289 CO 0.02 -0.28 -0.01 -0.92 -0.57 0.00 0.00 179.45 177.68 3f06 h TYR 290 N -0.44 -0.07 -0.41 -1.35 3.20 -0.97 0.78 116.97 117.72 3f06 h TYR 290 Ca 0.05 0.05 -0.11 0.00 3.14 0.00 0.00 58.73 61.86 3f06 h TYR 290 Cb 0.51 0.14 -0.01 0.00 1.54 0.00 0.00 36.73 38.90 3f06 h TYR 290 CO -0.29 -0.20 -0.20 0.82 -1.64 0.00 0.00 178.16 176.64 3f06 h ILE 291 N 0.10 1.27 0.00 1.81 2.04 -0.84 -2.92 117.51 118.97 3f06 h ILE 291 Ca 0.36 -1.31 -0.07 0.00 1.00 0.00 0.00 64.86 64.83 3f06 h ILE 291 Cb 0.59 1.17 -0.01 0.00 -0.74 0.00 0.00 36.82 37.83 3f06 h ILE 291 CO -0.59 0.44 -0.32 -0.07 0.00 0.00 0.00 178.15 177.60 3f06 h LEU 292 N 0.70 0.00 -2.21 1.44 3.38 0.52 -2.98 115.31 116.16 3f06 h LEU 292 Ca 0.10 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.07 3f06 h LEU 292 Cb 0.72 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.47 3f06 h LEU 292 CO 0.05 0.32 0.00 -0.61 0.09 0.00 0.00 178.44 178.30 3f06 h GLN 293 N 0.00 0.00 -0.00 1.13 -0.00 -0.71 -0.57 115.11 114.96 3f06 h GLN 293 Ca -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.65 3f06 h GLN 293 Cb 0.70 0.00 0.00 0.00 0.00 0.00 0.00 27.48 28.18 3f06 h GLN 293 CO 0.04 0.00 -0.05 0.91 0.00 0.00 0.00 178.83 179.74 3f06 n TRP 294 N -2.71 0.00 -1.90 3.99 8.01 -1.13 -4.92 117.44 118.79 3f06 n TRP 294 Ca -0.02 0.00 -0.06 0.00 -1.31 0.00 0.00 57.50 56.11 3f06 n TRP 294 Cb 0.07 -0.18 -0.01 0.00 -2.01 0.00 0.00 31.31 29.17 3f06 n TRP 294 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 177.69 177.72 3f06 n GLN 295 N -1.05 -1.95 -2.21 -0.99 6.02 -0.22 -4.93 117.38 112.04 3f06 n GLN 295 Ca 0.16 0.33 -0.28 0.00 -0.01 0.00 0.00 57.00 57.20 3f06 n GLN 295 Cb 0.24 -4.69 0.03 0.00 1.02 0.00 0.00 30.24 26.83 3f06 n GLN 295 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 3f06 s LEU 296 N -4.21 3.21 0.38 1.08 1.43 -1.26 -5.00 118.68 114.32 3f06 s LEU 296 Ca 0.00 0.98 -0.28 0.00 -1.03 0.00 0.00 54.13 53.81 3f06 s LEU 296 Cb 0.00 -3.86 -0.11 0.00 0.03 0.00 0.00 46.19 42.25 3f06 s LEU 296 CO 0.00 -1.02 1.48 0.00 0.23 0.00 0.00 176.35 177.04 3f06 n ALA 297 N -2.67 2.34 -3.69 4.21 0.00 -1.26 -4.82 120.51 114.62 3f06 n ALA 297 Ca 0.05 0.34 -0.20 0.00 0.00 0.00 0.00 53.44 53.62 3f06 n ALA 297 Cb 0.56 -2.42 -0.18 0.00 0.00 0.00 0.00 19.45 17.42 3f06 n ALA 297 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 3f06 s THR 298 N -1.12 -0.04 -0.40 0.00 2.01 -0.83 -0.57 115.64 114.69 3f06 s THR 298 Ca 0.54 0.37 -0.14 0.00 0.31 0.00 0.00 61.69 62.77 3f06 s THR 298 Cb -0.48 -0.20 0.03 0.00 0.01 0.00 0.00 72.50 71.86 3f06 s THR 298 CO 0.63 0.18 0.28 -0.22 -0.69 0.00 0.00 174.62 174.80 3f06 s LEU 299 N 2.05 5.03 -0.09 4.42 2.96 -0.34 -1.29 118.68 131.42 3f06 s LEU 299 Ca 0.04 -0.99 -0.19 0.00 -0.22 0.00 0.00 54.13 52.77 3f06 s LEU 299 Cb -0.12 -2.11 -0.04 0.00 0.50 0.00 0.00 46.19 44.41 3f06 s LEU 299 CO -0.03 -0.45 0.53 -0.63 -1.32 0.00 0.00 176.35 174.45 3f06 s ILE 300 N 1.63 5.12 0.17 6.68 1.09 0.41 -1.25 121.20 135.04 3f06 s ILE 300 Ca 0.04 1.07 0.05 0.00 -1.10 0.00 0.00 60.65 60.71 3f06 s ILE 300 Cb -0.20 -3.86 -0.05 0.00 -1.06 0.00 0.00 42.46 37.29 3f06 s ILE 300 CO 0.08 0.34 -0.11 -0.76 -0.10 0.00 0.00 174.94 174.39 3f06 s LEU 301 N 0.48 2.52 0.00 2.97 1.43 0.26 -1.59 118.68 124.74 3f06 s LEU 301 Ca 0.28 -1.03 0.00 0.00 -1.03 0.00 0.00 54.13 52.36 3f06 s LEU 301 Cb -0.16 -0.42 0.00 0.00 0.03 0.00 0.00 46.19 45.64 3f06 s LEU 301 CO 0.13 -0.30 0.00 0.61 0.23 0.00 0.00 176.35 177.01 3f06 n GLY 302 N -0.26 0.92 0.00 -3.19 0.00 -0.90 -0.56 105.19 101.20 3f06 n GLY 302 Ca -0.09 -0.49 0.00 0.00 0.00 0.00 0.00 46.02 45.44 3f06 n GLY 302 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3f06 n GLY 303 N 5.00 0.13 3.42 -0.02 0.00 -1.08 -3.27 105.19 109.37 3f06 n GLY 303 Ca 0.00 -0.88 -0.28 0.00 0.00 0.00 0.00 46.02 44.85 3f06 n GLY 303 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3f06 n GLY 304 N 0.00 -2.32 0.00 -0.02 0.00 -1.26 -4.77 105.19 96.82 3f06 n GLY 304 Ca 0.00 -1.22 0.00 0.00 0.00 0.00 0.00 46.02 44.80 3f06 n GLY 304 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3f06 n GLY 305 N 1.23 1.23 0.55 -0.02 0.00 -1.26 -1.46 105.19 105.45 3f06 n GLY 305 Ca 0.03 0.19 0.06 0.00 0.00 0.00 0.00 46.02 46.29 3f06 n GLY 305 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 3f06 n TYR 306 N 0.00 0.23 -3.58 1.61 4.02 -1.26 -4.66 117.16 113.53 3f06 n TYR 306 Ca 0.00 -0.25 -0.40 0.00 -0.01 0.00 0.00 57.90 57.24 3f06 n TYR 306 Cb 0.00 -0.01 -0.07 0.00 -0.02 0.00 0.00 39.34 39.24 3f06 n TYR 306 CO 0.00 0.00 0.00 1.21 -1.01 0.00 0.00 176.86 177.06 3f06 s ASN 307 N -0.97 5.77 0.19 7.72 3.84 -1.26 -4.65 114.94 125.57 3f06 s ASN 307 Ca 0.18 -2.63 -0.22 0.00 0.21 0.00 0.00 52.86 50.41 3f06 s ASN 307 Cb 0.11 -1.99 0.11 0.00 -0.55 0.00 0.00 41.25 38.93 3f06 s ASN 307 CO 0.15 -0.49 1.58 -0.07 -2.79 0.00 0.00 177.10 175.48 3f06 h LEU 308 N 7.52 -1.29 -0.30 3.21 3.38 -1.98 0.34 115.31 126.19 3f06 h LEU 308 Ca -0.02 0.24 0.05 0.00 0.09 0.00 0.00 57.88 58.24 3f06 h LEU 308 Cb 1.00 0.63 -0.04 0.00 0.09 0.00 0.00 40.66 42.33 3f06 h LEU 308 CO 0.75 -0.31 0.02 0.00 0.09 0.00 0.00 178.44 178.99 3f06 h ALA 309 N 0.92 0.28 -0.48 1.53 0.00 -1.94 -2.15 119.26 117.43 3f06 h ALA 309 Ca 0.23 0.07 -0.03 0.00 0.00 0.00 0.00 54.91 55.18 3f06 h ALA 309 Cb 0.56 0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.44 3f06 h ALA 309 CO -0.71 -0.39 0.19 -0.91 0.00 0.00 0.00 179.25 177.43 3f06 h ASN 310 N 0.12 0.63 -0.66 0.00 2.35 -1.63 -0.45 115.58 115.94 3f06 h ASN 310 Ca 0.14 -0.07 -0.03 0.00 -0.55 0.00 0.00 56.30 55.79 3f06 h ASN 310 Cb 0.17 -0.16 -0.03 0.00 0.05 0.00 0.00 38.32 38.35 3f06 h ASN 310 CO -0.22 0.57 0.29 0.74 -1.65 0.00 0.00 177.43 177.17 3f06 h THR 311 N 0.69 1.23 -0.45 2.81 2.02 -0.43 -0.00 112.91 118.78 3f06 h THR 311 Ca 0.17 -0.69 -0.03 0.00 0.77 0.00 0.00 66.41 66.63 3f06 h THR 311 Cb 0.15 0.46 -0.02 0.00 -1.74 0.00 0.00 68.15 67.00 3f06 h THR 311 CO -0.02 0.28 0.16 0.00 0.37 0.00 0.00 175.52 176.32 3f06 h ALA 312 N 1.13 0.59 -0.82 6.16 0.00 -0.80 -0.82 119.26 124.70 3f06 h ALA 312 Ca 0.22 -0.16 0.10 0.00 0.00 0.00 0.00 54.91 55.07 3f06 h ALA 312 Cb 0.16 -0.18 -0.07 0.00 0.00 0.00 0.00 17.79 17.71 3f06 h ALA 312 CO -0.02 0.21 0.46 0.00 0.00 0.00 0.00 179.25 179.90 3f06 h ARG 313 N 0.59 0.75 0.43 0.00 3.08 -0.58 -0.84 114.38 117.81 3f06 h ARG 313 Ca 0.15 -0.04 -0.02 0.00 0.07 0.00 0.00 59.98 60.13 3f06 h ARG 313 Cb 0.22 -0.17 0.00 0.00 0.08 0.00 0.00 29.97 30.11 3f06 h ARG 313 CO -0.01 0.49 -0.21 0.00 -1.07 0.00 0.00 179.97 179.18 3f06 h TRP 315 N -0.99 0.00 0.24 0.00 6.55 -1.10 -0.50 115.95 120.16 3f06 h TRP 315 Ca -0.06 0.00 -0.01 0.00 0.95 0.00 0.00 58.89 59.77 3f06 h TRP 315 Cb 0.56 0.00 0.00 0.00 -0.86 0.00 0.00 29.16 28.86 3f06 h TRP 315 CO 0.02 0.16 -0.11 1.15 -1.05 0.00 0.00 178.44 178.61 3f06 h THR 316 N 0.00 0.70 -0.87 1.49 2.02 -1.21 0.24 112.91 115.29 3f06 h THR 316 Ca -0.00 -0.90 0.17 0.00 0.77 0.00 0.00 66.41 66.44 3f06 h THR 316 Cb 0.40 1.13 -0.10 0.00 -1.74 0.00 0.00 68.15 67.84 3f06 h THR 316 CO 0.02 0.16 0.43 0.22 0.37 0.00 0.00 175.52 176.73 3f06 h TYR 317 N -0.86 0.75 -0.44 3.16 3.20 -1.21 0.74 116.97 122.31 3f06 h TYR 317 Ca -0.03 0.04 -0.10 0.00 3.14 0.00 0.00 58.73 61.77 3f06 h TYR 317 Cb 0.51 -0.20 -0.01 0.00 1.54 0.00 0.00 36.73 38.57 3f06 h TYR 317 CO 0.06 0.12 -0.11 -0.07 -1.64 0.00 0.00 178.16 176.52 3f06 h LEU 318 N 0.57 0.87 -2.06 2.82 3.38 -1.06 -0.49 115.31 119.35 3f06 h LEU 318 Ca 0.49 -0.36 0.07 0.00 0.09 0.00 0.00 57.88 58.16 3f06 h LEU 318 Cb 0.77 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 41.28 3f06 h LEU 318 CO -0.41 1.03 0.17 0.74 0.09 0.00 0.00 178.44 180.07 3f06 h THR 319 N 0.69 0.80 -0.02 0.22 2.02 0.74 -0.04 112.91 117.32 3f06 h THR 319 Ca 0.11 0.00 -0.16 0.00 0.77 0.00 0.00 66.41 67.13 3f06 h THR 319 Cb 0.66 0.88 -0.02 0.00 -1.74 0.00 0.00 68.15 67.93 3f06 h THR 319 CO 0.05 0.00 -0.70 1.23 0.37 0.00 0.00 175.52 176.46 3f06 h GLY 320 N 0.00 0.12 1.70 2.16 0.00 0.62 -2.81 103.07 104.86 3f06 h GLY 320 Ca 0.11 -0.18 -0.04 0.00 0.00 0.00 0.00 47.33 47.22 3f06 h GLY 320 CO -0.00 0.16 -0.46 -0.39 0.00 0.00 0.00 176.54 175.84 3f06 h VAL 321 N 0.07 0.27 -0.06 4.60 -1.51 0.05 -2.60 116.25 117.07 3f06 h VAL 321 Ca -0.01 -1.41 -0.09 0.00 -1.23 0.00 0.00 66.70 63.96 3f06 h VAL 321 Cb 1.25 2.01 -0.01 0.00 -2.13 0.00 0.00 31.29 32.41 3f06 h VAL 321 CO 0.10 0.15 -0.38 0.40 -1.23 0.00 0.00 177.57 176.61 3f06 h ILE 322 N 0.00 1.29 -0.20 7.19 1.08 -1.09 -2.91 117.51 122.86 3f06 h ILE 322 Ca -0.02 -1.38 0.00 0.00 -0.39 0.00 0.00 64.86 63.07 3f06 h ILE 322 Cb 1.15 1.67 0.00 0.00 -3.07 0.00 0.00 36.82 36.58 3f06 h ILE 322 CO 0.02 0.41 0.00 0.18 -0.69 0.00 0.00 178.15 178.07 3f06 n LEU 323 N -4.07 2.76 0.00 1.44 4.77 -1.07 -4.95 117.00 115.88 3f06 n LEU 323 Ca -0.02 -1.08 0.00 0.00 -0.03 0.00 0.00 56.01 54.88 3f06 n LEU 323 Cb 0.44 -0.12 0.00 0.00 -2.33 0.00 0.00 43.42 41.40 3f06 n LEU 323 CO 0.40 0.54 0.00 0.61 -1.33 0.00 0.00 177.39 177.61 3f06 n GLY 324 N 1.35 2.23 3.65 -0.72 0.00 -1.00 -4.98 105.19 105.72 3f06 n GLY 324 Ca 0.17 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.89 3f06 n GLY 324 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3f06 s LYS 325 N 0.00 0.72 -0.27 1.61 -0.14 -1.07 -4.96 119.74 115.63 3f06 s LYS 325 Ca 0.00 1.11 -0.01 0.00 -1.36 0.00 0.00 55.97 55.71 3f06 s LYS 325 Cb 0.00 -1.72 0.09 0.00 -1.68 0.00 0.00 37.83 34.51 3f06 s LYS 325 CO 0.00 -2.69 0.06 0.95 -0.76 0.00 0.00 175.35 172.91 3f06 s THR 326 N -2.71 0.88 0.81 2.17 -4.23 -1.26 -4.46 115.64 106.84 3f06 s THR 326 Ca 0.66 -1.18 -0.11 0.00 -1.18 0.00 0.00 61.69 59.87 3f06 s THR 326 Cb -0.21 -1.54 0.08 0.00 1.34 0.00 0.00 72.50 72.18 3f06 s THR 326 CO 0.59 -0.49 1.13 -0.76 -0.54 0.00 0.00 174.62 174.55 3f06 s LEU 327 N 1.64 3.04 0.39 4.79 1.43 -1.26 -5.02 118.68 123.69 3f06 s LEU 327 Ca 0.05 2.08 -0.25 0.00 -1.03 0.00 0.00 54.13 54.98 3f06 s LEU 327 Cb -0.17 -4.55 -0.09 0.00 0.03 0.00 0.00 46.19 41.41 3f06 s LEU 327 CO -0.19 -2.46 1.11 -0.55 0.23 0.00 0.00 176.35 174.50 3f06 s SER 328 N -2.80 6.69 0.49 2.29 0.15 -1.26 -4.96 113.70 114.30 3f06 s SER 328 Ca 0.66 2.20 0.28 0.00 0.70 0.00 0.00 55.95 59.79 3f06 s SER 328 Cb -0.22 -2.60 1.13 0.00 -1.71 0.00 0.00 66.02 62.62 3f06 s SER 328 CO 0.54 -0.55 1.91 0.28 1.20 0.00 0.00 173.24 176.62 3f06 h SER 329 N 2.69 0.00 -3.34 5.45 0.02 -1.98 -3.43 113.55 112.97 3f06 h SER 329 Ca -0.48 0.00 -0.57 0.00 -0.84 0.00 0.00 61.79 59.90 3f06 h SER 329 Cb 1.22 0.00 -0.06 0.00 0.14 0.00 0.00 62.40 63.70 3f06 h SER 329 CO 0.63 0.14 0.00 -1.61 -1.14 0.00 0.00 176.83 174.85 3f06 s GLU 330 N -3.72 4.38 -0.16 3.45 8.01 -1.26 -1.24 118.70 128.15 3f06 s GLU 330 Ca 0.00 0.73 -0.29 0.00 0.01 0.00 0.00 54.97 55.42 3f06 s GLU 330 Cb 0.10 -3.41 -0.01 0.00 -4.31 0.00 0.00 34.13 26.50 3f06 s GLU 330 CO 0.60 0.18 1.26 0.42 0.01 0.00 0.00 175.26 177.73 3f06 s ILE 331 N 0.44 4.28 0.59 -1.63 -1.09 -1.02 -4.85 121.20 117.92 3f06 s ILE 331 Ca 0.33 1.55 -0.20 0.00 -2.23 0.00 0.00 60.65 60.10 3f06 s ILE 331 Cb -0.17 -4.00 -0.03 0.00 -1.58 0.00 0.00 42.46 36.68 3f06 s ILE 331 CO 0.16 -0.13 1.32 -2.84 -1.23 0.00 0.00 174.94 172.22 3f06 s PRO 332 N 3.44 2.87 0.30 2.79 0.02 -1.26 -4.94 135.00 138.23 3f06 s PRO 332 Ca 0.55 2.14 -0.29 0.00 0.02 0.00 0.00 61.00 63.42 3f06 s PRO 332 Cb -0.22 -2.06 -0.10 0.00 0.02 0.00 0.00 34.50 32.14 3f06 s PRO 332 CO 0.15 -1.37 1.24 0.34 -0.33 0.00 0.00 177.00 177.03 3f06 s ASP 333 N -1.17 6.93 0.12 2.53 3.68 -1.26 -4.81 116.67 122.69 3f06 s ASP 333 Ca 0.77 2.54 -0.09 0.00 2.13 0.00 0.00 52.55 57.90 3f06 s ASP 333 Cb -0.39 -2.64 0.03 0.00 -1.45 0.00 0.00 42.92 38.48 3f06 s ASP 333 CO 0.44 -0.41 0.44 0.00 0.13 0.00 0.00 175.17 175.76 3f06 n HIS 334 N 1.08 -1.19 -0.02 -5.34 1.44 -1.26 -4.99 115.22 104.94 3f06 n HIS 334 Ca 0.00 -0.68 0.23 0.00 -2.01 0.00 0.00 57.72 55.26 3f06 n HIS 334 Cb 0.43 0.34 0.72 0.00 0.12 0.00 0.00 29.99 31.60 3f06 n HIS 334 CO 0.00 0.00 0.00 1.49 -2.81 0.00 0.00 176.34 175.02 3f06 h GLU 335 N 0.00 0.00 -0.23 -1.40 4.81 -1.94 -2.20 114.58 113.62 3f06 h GLU 335 Ca -0.14 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.09 3f06 h GLU 335 Cb 0.56 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.94 3f06 h GLU 335 CO 0.18 0.00 0.00 1.19 -0.73 0.00 0.00 179.01 179.65 3f06 n PHE 336 N -4.09 0.55 -0.36 0.92 3.72 -1.26 -4.77 117.46 112.17 3f06 n PHE 336 Ca 0.11 -0.72 0.27 0.00 -0.05 0.00 0.00 57.45 57.07 3f06 n PHE 336 Cb 0.72 -0.17 0.55 0.00 -0.94 0.00 0.00 39.48 39.64 3f06 n PHE 336 CO 0.00 0.00 0.00 0.35 -0.05 0.00 0.00 176.76 177.06 3f06 h PHE 337 N 1.44 0.64 0.00 1.38 3.04 -1.71 -0.24 116.94 121.49 3f06 h PHE 337 Ca 0.00 0.02 -0.01 0.00 3.98 0.00 0.00 57.97 61.96 3f06 h PHE 337 Cb 1.04 -0.18 -0.00 0.00 2.56 0.00 0.00 35.95 39.37 3f06 h PHE 337 CO 0.29 -0.04 -0.05 1.79 -2.02 0.00 0.00 178.31 178.28 3f06 h THR 338 N 0.29 0.20 -0.00 4.41 1.35 -1.86 -2.75 112.91 114.56 3f06 h THR 338 Ca 0.68 -0.40 0.00 0.00 -0.55 0.00 0.00 66.41 66.13 3f06 h THR 338 Cb 1.85 1.33 0.00 0.00 -1.73 0.00 0.00 68.15 69.60 3f06 h THR 338 CO -0.36 0.05 0.00 0.00 -0.25 0.00 0.00 175.52 174.96 3f06 n ALA 339 N -2.15 2.68 -1.00 6.62 0.00 -0.10 -3.73 120.51 122.83 3f06 n ALA 339 Ca -0.01 -0.20 0.01 0.00 0.00 0.00 0.00 53.44 53.24 3f06 n ALA 339 Cb 0.22 -1.49 0.34 0.00 0.00 0.00 0.00 19.45 18.53 3f06 n ALA 339 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 3f06 n TYR 340 N -0.95 2.09 -1.55 0.00 4.02 -1.04 -4.76 117.16 114.98 3f06 n TYR 340 Ca 0.23 -0.98 -0.29 0.00 -0.01 0.00 0.00 57.90 56.84 3f06 n TYR 340 Cb 0.11 -0.57 0.14 0.00 -0.02 0.00 0.00 39.34 39.00 3f06 n TYR 340 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 176.86 176.05 3f06 s GLY 341 N -1.09 1.59 0.05 2.72 0.00 -1.24 -0.96 107.32 108.38 3f06 s GLY 341 Ca 0.53 -0.58 0.25 0.00 0.00 0.00 0.00 44.72 44.92 3f06 s GLY 341 CO 0.14 -0.00 1.45 -1.55 0.00 0.00 0.00 173.10 173.13 3f06 n PRO 342 N -3.79 0.12 0.00 2.90 -0.04 -1.26 -4.68 135.00 128.25 3f06 n PRO 342 Ca 0.07 0.04 0.06 0.00 -0.04 0.00 0.00 63.50 63.63 3f06 n PRO 342 Cb 0.59 -1.58 -0.12 0.00 -0.04 0.00 0.00 33.50 32.35 3f06 n PRO 342 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 3f06 n ASP 343 N -1.75 0.29 -3.54 3.54 8.00 -1.26 -5.02 116.55 116.82 3f06 n ASP 343 Ca 0.05 0.12 -0.23 0.00 0.71 0.00 0.00 54.79 55.44 3f06 n ASP 343 Cb 0.38 1.25 0.08 0.00 -0.02 0.00 0.00 41.12 42.81 3f06 n ASP 343 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 3f06 n TYR 344 N -2.52 -2.77 -4.51 1.24 4.01 -0.13 -5.00 117.16 107.47 3f06 n TYR 344 Ca -0.09 1.00 -0.24 0.00 -0.16 0.00 0.00 57.90 58.41 3f06 n TYR 344 Cb 0.71 -5.00 -0.11 0.00 -0.31 0.00 0.00 39.34 34.64 3f06 n TYR 344 CO 0.00 0.00 0.00 0.14 -0.46 0.00 0.00 176.86 176.54 3f06 s VAL 345 N -3.32 1.65 -0.57 -0.72 -7.23 -1.26 -2.43 120.40 106.51 3f06 s VAL 345 Ca 0.51 -2.05 0.24 0.00 -1.81 0.00 0.00 61.98 58.87 3f06 s VAL 345 Cb -0.23 -2.76 0.08 0.00 0.56 0.00 0.00 36.38 34.04 3f06 s VAL 345 CO 0.72 -0.09 1.34 0.25 -0.31 0.00 0.00 175.10 177.01 3f06 h LEU 346 N 2.04 0.00-10.04 1.32 5.85 -1.44 -3.45 115.31 109.59 3f06 h LEU 346 Ca -0.42 -0.14 -0.49 0.00 0.84 0.00 0.00 57.88 57.67 3f06 h LEU 346 Cb 1.24 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 42.25 3f06 h LEU 346 CO 0.73 0.07 0.09 -1.61 -0.34 0.00 0.00 178.44 177.38 3f06 s GLU 347 N -3.19 3.95 -0.12 1.25 8.01 -1.26 -4.87 118.70 122.47 3f06 s GLU 347 Ca 0.06 0.61 0.03 0.00 0.01 0.00 0.00 54.97 55.68 3f06 s GLU 347 Cb 0.12 -2.43 0.00 0.00 -4.31 0.00 0.00 34.13 27.51 3f06 s GLU 347 CO 0.72 0.13 -0.23 0.42 0.01 0.00 0.00 175.26 176.30 3f06 s ILE 348 N -2.05 2.04 -0.07 -1.63 1.01 -1.26 -5.09 121.20 114.15 3f06 s ILE 348 Ca 0.53 -0.99 -0.16 0.00 0.00 0.00 0.00 60.65 60.03 3f06 s ILE 348 Cb -0.10 -1.78 -0.05 0.00 0.01 0.00 0.00 42.46 40.54 3f06 s ILE 348 CO 0.20 0.55 0.43 -0.89 0.00 0.00 0.00 174.94 175.23 3f06 s THR 349 N 0.55 5.12 0.70 2.92 2.01 -1.26 -4.86 115.64 120.81 3f06 s THR 349 Ca -0.14 0.86 -0.16 0.00 0.31 0.00 0.00 61.69 62.56 3f06 s THR 349 Cb -0.17 -3.75 0.02 0.00 0.01 0.00 0.00 72.50 68.62 3f06 s THR 349 CO 0.04 0.45 1.20 -2.84 -0.69 0.00 0.00 174.62 172.78 3f06 s PRO 350 N -0.20 2.34 0.49 4.92 0.02 -1.26 -4.86 135.00 136.45 3f06 s PRO 350 Ca 0.24 1.72 -0.10 0.00 0.02 0.00 0.00 61.00 62.89 3f06 s PRO 350 Cb -0.16 -1.86 -0.05 0.00 0.02 0.00 0.00 34.50 32.45 3f06 s PRO 350 CO 0.11 -1.67 0.86 -1.12 -0.33 0.00 0.00 177.00 174.84 3f06 s SER 351 N -2.04 6.38 -1.12 2.53 0.01 -1.26 -4.99 113.70 113.21 3f06 s SER 351 Ca 0.74 1.18 -0.15 0.00 1.31 0.00 0.00 55.95 59.03 3f06 s SER 351 Cb -0.28 -2.35 0.16 0.00 0.21 0.00 0.00 66.02 63.76 3f06 s SER 351 CO 0.43 -0.58 1.33 0.00 0.41 0.00 0.00 173.24 174.83 3f06 s ARG 353 N 1.77 0.62 0.34 0.00 1.70 -1.26 -5.16 118.95 116.96 3f06 s ARG 353 Ca 0.39 0.03 -0.29 0.00 -0.47 0.00 0.00 55.73 55.40 3f06 s ARG 353 Cb -0.04 0.28 -0.12 0.00 -0.57 0.00 0.00 34.95 34.51 3f06 s ARG 353 CO -0.03 -0.15 1.48 -0.35 -1.08 0.00 0.00 175.30 175.17 3f06 n PRO 354 N 1.72 2.56 -2.63 3.89 -0.04 -1.26 -4.91 135.00 134.33 3f06 n PRO 354 Ca -0.19 0.90 -0.42 0.00 -0.04 0.00 0.00 63.50 63.75 3f06 n PRO 354 Cb 0.56 -2.62 -0.03 0.00 -0.04 0.00 0.00 33.50 31.37 3f06 n PRO 354 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 3f06 s ASP 355 N 0.04 7.30 -0.26 3.54 -1.08 -1.26 -4.21 116.67 120.74 3f06 s ASP 355 Ca 0.57 1.77 0.13 0.00 -0.52 0.00 0.00 52.55 54.50 3f06 s ASP 355 Cb -0.51 -2.57 0.72 0.00 -1.46 0.00 0.00 42.92 39.11 3f06 s ASP 355 CO 0.59 -0.31 1.70 0.54 0.52 0.00 0.00 175.17 178.21 3f06 n ARG 356 N 3.82 3.94 -3.28 4.34 5.12 -0.23 -4.87 116.66 125.50 3f06 n ARG 356 Ca 0.07 -3.08 -0.46 0.00 -1.93 0.00 0.00 57.85 52.44 3f06 n ARG 356 Cb 0.50 -2.15 -0.03 0.00 -1.16 0.00 0.00 32.46 29.61 3f06 n ARG 356 CO 0.00 0.00 0.00 -0.80 -1.93 0.00 0.00 177.63 174.90 3f06 s ASN 357 N -1.20 6.49 -0.14 0.55 0.01 -1.26 -4.84 114.94 114.55 3f06 s ASN 357 Ca 0.52 -2.20 -0.30 0.00 -0.71 0.00 0.00 52.86 50.17 3f06 s ASN 357 Cb 0.41 -2.23 -0.07 0.00 0.41 0.00 0.00 41.25 39.77 3f06 s ASN 357 CO 0.13 -0.76 2.12 -1.84 -1.51 0.00 0.00 177.10 175.24 3f06 n GLU 358 N 4.81 2.19 -0.08 -0.60 0.00 -1.26 -4.83 120.64 120.87 3f06 n GLU 358 Ca 0.02 0.69 0.25 0.00 0.00 0.00 0.00 57.16 58.12 3f06 n GLU 358 Cb 0.44 -3.07 0.58 0.00 0.00 0.00 0.00 31.44 29.39 3f06 n GLU 358 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.13 176.13 3f06 h PRO 359 N 13.11 0.00 -0.03 3.44 0.13 -2.00 -0.04 132.00 146.61 3f06 h PRO 359 Ca -0.43 0.00 -0.20 0.00 -0.87 0.00 0.00 66.00 64.49 3f06 h PRO 359 Cb 1.25 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.38 3f06 h PRO 359 CO 0.96 0.00 -0.84 1.25 -0.23 0.00 0.00 178.00 179.14 3f06 h HIS 360 N 0.00 0.51 -0.10 1.56 2.76 -2.01 -3.10 115.15 114.78 3f06 h HIS 360 Ca 0.36 -0.26 -0.13 0.00 -2.20 0.00 0.00 60.37 58.15 3f06 h HIS 360 Cb 2.12 -0.07 -0.01 0.00 1.55 0.00 0.00 27.41 31.00 3f06 h HIS 360 CO 0.00 1.05 -0.49 -0.09 -1.30 0.00 0.00 177.93 177.10 3f06 h ARG 361 N 0.22 0.27 -0.21 5.26 1.12 -1.37 -2.04 114.38 117.63 3f06 h ARG 361 Ca -0.05 -0.15 -0.07 0.00 -1.11 0.00 0.00 59.98 58.59 3f06 h ARG 361 Cb 1.45 0.01 -0.01 0.00 -0.01 0.00 0.00 29.97 31.41 3f06 h ARG 361 CO 0.14 0.70 -0.19 0.82 -3.11 0.00 0.00 179.97 178.34 3f06 h ILE 362 N 0.22 1.23 -0.03 1.20 1.08 -1.55 -1.95 117.51 117.71 3f06 h ILE 362 Ca 0.01 -1.05 -0.04 0.00 -0.39 0.00 0.00 64.86 63.39 3f06 h ILE 362 Cb 0.95 1.28 0.00 0.00 -3.07 0.00 0.00 36.82 35.98 3f06 h ILE 362 CO 0.08 0.33 -0.13 -0.61 -0.69 0.00 0.00 178.15 177.13 3f06 h GLN 363 N 0.33 0.14 -0.60 2.37 5.75 -1.41 -1.57 115.11 120.10 3f06 h GLN 363 Ca 0.06 -0.11 0.12 0.00 -0.15 0.00 0.00 58.65 58.57 3f06 h GLN 363 Cb 0.53 0.02 -0.10 0.00 1.07 0.00 0.00 27.48 29.00 3f06 h GLN 363 CO 0.03 0.77 0.03 1.96 -2.65 0.00 0.00 178.83 178.97 3f06 h GLN 364 N -0.46 0.14 -0.03 1.69 4.20 -1.20 -0.30 115.11 119.14 3f06 h GLN 364 Ca -0.01 -0.01 -0.00 0.00 0.06 0.00 0.00 58.65 58.69 3f06 h GLN 364 Cb 0.79 -0.03 -0.00 0.00 0.30 0.00 0.00 27.48 28.54 3f06 h GLN 364 CO 0.03 0.09 0.01 0.82 -0.67 0.00 0.00 178.83 179.11 3f06 h ILE 365 N 0.14 1.06 -0.33 2.54 2.04 -1.34 -0.53 117.51 121.10 3f06 h ILE 365 Ca 0.32 -0.18 0.00 0.00 1.00 0.00 0.00 64.86 65.99 3f06 h ILE 365 Cb 0.50 1.14 -0.02 0.00 -0.74 0.00 0.00 36.82 37.71 3f06 h ILE 365 CO -0.49 0.05 0.20 -0.07 0.00 0.00 0.00 178.15 177.84 3f06 h LEU 366 N -0.03 0.38 0.04 1.44 3.38 -0.50 -0.30 115.31 119.71 3f06 h LEU 366 Ca 0.01 -0.01 -0.00 0.00 0.09 0.00 0.00 57.88 57.96 3f06 h LEU 366 Cb 0.07 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 40.73 3f06 h LEU 366 CO -0.00 0.29 -0.02 0.78 0.09 0.00 0.00 178.44 179.58 3f06 h ASN 367 N 0.44 -0.04 -0.99 -0.43 2.35 -0.81 -0.09 115.58 116.01 3f06 h ASN 367 Ca 0.12 -0.54 0.25 0.00 -0.55 0.00 0.00 56.30 55.57 3f06 h ASN 367 Cb -0.03 0.01 -0.08 0.00 0.05 0.00 0.00 38.32 38.28 3f06 h ASN 367 CO -0.02 0.54 0.65 0.22 -1.65 0.00 0.00 177.43 177.17 3f06 h TYR 368 N -0.65 0.53 0.47 1.19 5.03 -0.72 0.20 116.97 123.02 3f06 h TYR 368 Ca -0.01 0.02 -0.02 0.00 2.58 0.00 0.00 58.73 61.30 3f06 h TYR 368 Cb 0.58 -0.16 0.00 0.00 1.55 0.00 0.00 36.73 38.71 3f06 h TYR 368 CO 0.12 0.09 -0.23 0.82 -1.32 0.00 0.00 178.16 177.64 3f06 h ILE 369 N 0.35 0.00 -0.93 1.81 1.08 -0.89 -2.85 117.51 116.08 3f06 h ILE 369 Ca 0.53 -0.50 0.15 0.00 -0.39 0.00 0.00 64.86 64.65 3f06 h ILE 369 Cb 1.43 0.00 -0.15 0.00 -3.07 0.00 0.00 36.82 35.03 3f06 h ILE 369 CO -0.21 0.00 -0.35 1.17 -0.69 0.00 0.00 178.15 178.06 3f06 n LYS 370 N -5.10 -0.21 -0.10 2.37 3.00 -0.06 0.11 118.16 118.18 3f06 n LYS 370 Ca -0.08 1.43 -0.06 0.00 -0.00 0.00 0.00 58.31 59.60 3f06 n LYS 370 Cb 0.25 -2.12 0.02 0.00 0.00 0.00 0.00 35.03 33.17 3f06 n LYS 370 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.40 178.18 3f06 h GLY 371 N 0.00 0.41 1.71 3.14 0.00 -0.78 -2.40 103.07 105.16 3f06 h GLY 371 Ca 0.33 -0.03 0.01 0.00 0.00 0.00 0.00 47.33 47.64 3f06 h GLY 371 CO -0.92 -0.02 0.18 3.43 0.00 0.00 0.00 176.54 179.21 3f06 h ASN 372 N 0.20 0.27 0.98 0.19 -0.26 -0.07 -2.42 115.58 114.47 3f06 h ASN 372 Ca 0.16 -0.01 -0.06 0.00 -0.56 0.00 0.00 56.30 55.84 3f06 h ASN 372 Cb 0.18 -0.07 -0.01 0.00 -1.06 0.00 0.00 38.32 37.36 3f06 h ASN 372 CO -0.21 0.20 -0.29 -0.07 -1.06 0.00 0.00 177.43 176.00 3f06 h LEU 373 N 0.32 0.00 -0.52 1.61 -0.00 -0.73 -3.17 115.31 112.82 3f06 h LEU 373 Ca 0.10 0.00 0.07 0.00 -0.00 0.00 0.00 57.88 58.05 3f06 h LEU 373 Cb 0.01 0.00 -0.06 0.00 -0.00 0.00 0.00 40.66 40.61 3f06 h LEU 373 CO -0.02 0.29 0.19 0.11 -0.00 0.00 0.00 178.44 179.01 3f06 h LYS 374 N 0.00 0.36 0.00 1.13 6.56 -1.32 -1.64 116.57 121.67 3f06 h LYS 374 Ca -0.00 -0.02 0.00 0.00 -1.06 0.00 0.00 60.65 59.57 3f06 h LYS 374 Cb 0.86 -0.08 0.00 0.00 -0.57 0.00 0.00 32.23 32.44 3f06 h LYS 374 CO 0.04 0.24 0.10 0.72 -2.06 0.00 0.00 179.45 178.49 3f06 n HIS 375 N -5.00 0.00 -2.90 -1.35 8.25 -1.20 -4.54 115.22 108.48 3f06 n HIS 375 Ca 0.06 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 57.09 3f06 n HIS 375 Cb 0.21 -0.33 -0.05 0.00 1.12 0.00 0.00 29.99 30.94 3f06 n HIS 375 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 3f06 s VAL 376 N -2.63 4.70 0.00 1.59 1.01 -0.62 -5.10 120.40 119.36 3f06 s VAL 376 Ca 0.00 1.06 0.00 0.00 0.00 0.00 0.00 61.98 63.04 3f06 s VAL 376 Cb 0.00 -4.24 0.00 0.00 0.00 0.00 0.00 36.38 32.14 3f06 s VAL 376 CO 0.00 -0.42 0.00 0.52 0.00 0.00 0.00 175.10 175.20