#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2fhf s VAL 33 N 0.00 2.52 0.14 2.53 -7.23 -1.26 -4.97 120.40 112.12 2fhf s VAL 33 Ca 0.00 0.50 -0.30 0.00 -1.81 0.00 0.00 61.98 60.37 2fhf s VAL 33 Cb 0.00 -3.31 -0.07 0.00 0.56 0.00 0.00 36.38 33.57 2fhf s VAL 33 CO 0.00 0.10 1.05 -0.69 -0.31 0.00 0.00 175.10 175.26 2fhf s VAL 34 N -1.18 4.15 0.08 1.32 1.01 -1.26 -4.94 120.40 119.58 2fhf s VAL 34 Ca 0.53 1.78 -0.30 0.00 0.00 0.00 0.00 61.98 63.99 2fhf s VAL 34 Cb -0.41 -4.14 -0.05 0.00 0.00 0.00 0.00 36.38 31.78 2fhf s VAL 34 CO 0.54 0.27 1.04 -0.69 0.00 0.00 0.00 175.10 176.26 2fhf s VAL 35 N 0.01 4.40 0.15 2.92 1.01 -1.26 -4.72 120.40 122.91 2fhf s VAL 35 Ca 0.49 1.86 -0.04 0.00 0.00 0.00 0.00 61.98 64.30 2fhf s VAL 35 Cb -0.27 -4.19 -0.03 0.00 0.00 0.00 0.00 36.38 31.89 2fhf s VAL 35 CO 0.32 0.23 0.15 0.00 0.00 0.00 0.00 175.10 175.80 2fhf s ARG 36 N 0.42 1.05 0.56 2.72 1.70 -0.34 -2.25 118.95 122.80 2fhf s ARG 36 Ca 0.51 -1.36 -0.10 0.00 -0.47 0.00 0.00 55.73 54.31 2fhf s ARG 36 Cb -0.25 0.30 -0.05 0.00 -0.57 0.00 0.00 34.95 34.38 2fhf s ARG 36 CO 0.30 -0.34 0.95 -0.51 -1.08 0.00 0.00 175.30 174.62 2fhf s LEU 37 N -3.03 3.43 0.22 -1.89 1.43 -0.54 -0.76 118.68 117.53 2fhf s LEU 37 Ca 0.23 1.30 -0.31 0.00 -1.03 0.00 0.00 54.13 54.32 2fhf s LEU 37 Cb 0.06 -4.30 -0.15 0.00 0.03 0.00 0.00 46.19 41.83 2fhf s LEU 37 CO 0.02 -0.72 1.18 -2.65 0.23 0.00 0.00 176.35 174.41 2fhf n PRO 38 N -2.36 1.40 0.00 1.29 -0.02 -1.26 -4.85 135.00 129.20 2fhf n PRO 38 Ca 0.04 0.50 0.00 0.00 -2.02 0.00 0.00 63.50 62.02 2fhf n PRO 38 Cb 0.54 -2.00 0.00 0.00 -0.02 0.00 0.00 33.50 32.02 2fhf n PRO 38 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 2fhf n ASP 39 N 1.85 0.67 -0.04 2.55 3.85 -1.26 -4.92 116.55 119.25 2fhf n ASP 39 Ca 0.13 -0.08 -0.10 0.00 -0.71 0.00 0.00 54.79 54.04 2fhf n ASP 39 Cb 0.28 0.29 -0.03 0.00 -1.35 0.00 0.00 41.12 40.30 2fhf n ASP 39 CO 0.00 0.00 0.00 0.55 -1.01 0.00 0.00 177.20 176.74 2fhf n VAL 40 N -0.35 0.78 -0.91 2.12 3.14 -1.26 -4.68 118.33 117.17 2fhf n VAL 40 Ca 0.00 -0.04 -0.10 0.00 -2.96 0.00 0.00 64.34 61.24 2fhf n VAL 40 Cb 0.00 -1.71 -0.14 0.00 -1.06 0.00 0.00 33.84 30.93 2fhf n VAL 40 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 2fhf n ALA 41 N -3.58 5.96 -2.46 1.55 0.00 -1.26 -4.84 120.51 115.89 2fhf n ALA 41 Ca -0.17 -1.52 -0.30 0.00 0.00 0.00 0.00 53.44 51.44 2fhf n ALA 41 Cb 0.54 -2.10 -0.12 0.00 0.00 0.00 0.00 19.45 17.76 2fhf n ALA 41 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 2fhf s VAL 42 N 0.84 2.75 0.38 0.00 -7.23 -1.26 -5.09 120.40 110.79 2fhf s VAL 42 Ca 0.56 -1.29 -0.27 0.00 -1.81 0.00 0.00 61.98 59.16 2fhf s VAL 42 Cb 0.27 -2.18 -0.10 0.00 0.56 0.00 0.00 36.38 34.93 2fhf s VAL 42 CO 0.00 0.27 1.37 -2.84 -0.31 0.00 0.00 175.10 173.59 2fhf s PRO 43 N -1.62 4.09 0.21 4.82 0.02 -1.26 -4.98 135.00 136.28 2fhf s PRO 43 Ca 0.15 2.32 -0.01 0.00 0.02 0.00 0.00 61.00 63.48 2fhf s PRO 43 Cb -0.10 -2.89 0.04 0.00 0.02 0.00 0.00 34.50 31.56 2fhf s PRO 43 CO 0.06 -0.45 0.29 0.41 -0.33 0.00 0.00 177.00 176.97 2fhf n GLY 44 N 0.64 0.30 3.78 0.52 0.00 -1.26 -3.49 105.19 105.68 2fhf n GLY 44 Ca 0.02 -1.91 -0.38 0.00 0.00 0.00 0.00 46.02 43.75 2fhf n GLY 44 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2fhf s GLU 45 N -3.25 4.22 0.20 1.61 0.41 -1.26 -4.68 118.70 115.94 2fhf s GLU 45 Ca 0.18 0.63 -0.03 0.00 -0.41 0.00 0.00 54.97 55.34 2fhf s GLU 45 Cb -0.01 -3.31 0.13 0.00 -1.78 0.00 0.00 34.13 29.16 2fhf s GLU 45 CO 0.12 0.45 1.53 0.00 -0.49 0.00 0.00 175.26 176.88 2fhf h ALA 46 N 5.40 0.74 -1.56 5.21 0.00 -1.97 -3.47 119.26 123.61 2fhf h ALA 46 Ca -0.47 -0.48 0.16 0.00 0.00 0.00 0.00 54.91 54.12 2fhf h ALA 46 Cb 1.20 -0.10 -0.22 0.00 0.00 0.00 0.00 17.79 18.68 2fhf h ALA 46 CO 0.68 0.67 0.68 0.54 0.00 0.00 0.00 179.25 181.82 2fhf s VAL 47 N -4.13 0.00 -0.02 0.00 0.11 -1.26 -5.12 120.40 109.99 2fhf s VAL 47 Ca -0.08 0.00 -0.01 0.00 -2.93 0.00 0.00 61.98 58.96 2fhf s VAL 47 Cb 0.12 -1.00 -0.04 0.00 -1.53 0.00 0.00 36.38 33.93 2fhf s VAL 47 CO 0.84 0.00 0.09 -1.10 -3.33 0.00 0.00 175.10 171.60 2fhf s GLN 48 N -1.75 3.12 0.19 1.54 -1.52 -1.26 -5.01 119.66 114.98 2fhf s GLN 48 Ca 0.04 -0.44 -0.30 0.00 -1.95 0.00 0.00 55.36 52.70 2fhf s GLN 48 Cb -0.01 -2.90 -0.09 0.00 -0.22 0.00 0.00 33.01 29.79 2fhf s GLN 48 CO -0.03 0.66 1.40 0.00 -0.25 0.00 0.00 175.29 177.07 2fhf s ALA 49 N -1.18 3.60 0.35 6.09 0.00 -1.26 -5.01 121.76 124.35 2fhf s ALA 49 Ca 0.22 1.21 0.00 0.00 0.00 0.00 0.00 51.96 53.40 2fhf s ALA 49 Cb -0.12 -3.54 0.00 0.00 0.00 0.00 0.00 23.12 19.46 2fhf s ALA 49 CO 0.13 -0.65 0.00 0.43 0.00 0.00 0.00 175.76 175.67 2fhf n SER 50 N 3.00 0.00 -4.74 0.00 7.64 -1.26 -4.96 113.62 113.30 2fhf n SER 50 Ca 0.08 0.00 -0.41 0.00 1.01 0.00 0.00 58.87 59.55 2fhf n SER 50 Cb 0.41 0.00 -0.03 0.00 -1.01 0.00 0.00 64.21 63.58 2fhf n SER 50 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2fhf s ALA 51 N -3.13 3.49 -1.38 -0.43 0.00 -1.26 -3.64 121.76 115.41 2fhf s ALA 51 Ca 0.00 1.04 -0.00 0.00 0.00 0.00 0.00 51.96 53.00 2fhf s ALA 51 Cb 0.00 -3.45 -0.00 0.00 0.00 0.00 0.00 23.12 19.67 2fhf s ALA 51 CO 0.00 -0.47 0.49 0.54 0.00 0.00 0.00 175.76 176.32 2fhf n ARG 52 N 2.61 -3.69 -3.53 0.00 1.74 -1.26 -4.96 116.66 107.56 2fhf n ARG 52 Ca 0.05 0.46 -0.15 0.00 -0.77 0.00 0.00 57.85 57.45 2fhf n ARG 52 Cb 0.44 -4.69 -0.05 0.00 -1.02 0.00 0.00 32.46 27.13 2fhf n ARG 52 CO 0.00 0.00 0.00 1.14 -1.52 0.00 0.00 177.63 177.25 2fhf s GLN 53 N -6.39 0.93 0.24 5.56 -2.07 -1.24 -2.04 119.66 114.65 2fhf s GLN 53 Ca 0.01 0.13 0.11 0.00 -1.82 0.00 0.00 55.36 53.79 2fhf s GLN 53 Cb -0.00 0.44 -0.05 0.00 -1.09 0.00 0.00 33.01 32.31 2fhf s GLN 53 CO 0.87 -0.31 -0.19 0.00 -1.32 0.00 0.00 175.29 174.34 2fhf s ALA 54 N -1.52 2.73 -0.03 2.60 0.00 0.11 -4.32 121.76 121.32 2fhf s ALA 54 Ca -0.06 -1.75 0.02 0.00 0.00 0.00 0.00 51.96 50.17 2fhf s ALA 54 Cb -0.00 -0.37 0.01 0.00 0.00 0.00 0.00 23.12 22.76 2fhf s ALA 54 CO 0.04 0.34 -0.07 0.08 0.00 0.00 0.00 175.76 176.15 2fhf s VAL 55 N -2.15 0.70 -0.11 0.00 1.01 -0.01 0.43 120.40 120.28 2fhf s VAL 55 Ca 0.27 -0.28 0.02 0.00 0.00 0.00 0.00 61.98 61.99 2fhf s VAL 55 Cb -0.06 -0.66 0.01 0.00 0.00 0.00 0.00 36.38 35.67 2fhf s VAL 55 CO 0.14 0.24 -0.18 -0.51 0.00 0.00 0.00 175.10 174.79 2fhf s ILE 56 N 0.48 1.68 -0.11 2.22 2.07 -0.66 -0.72 121.20 126.15 2fhf s ILE 56 Ca -0.07 -0.76 -0.06 0.00 -1.41 0.00 0.00 60.65 58.35 2fhf s ILE 56 Cb -0.11 -1.50 -0.04 0.00 0.13 0.00 0.00 42.46 40.94 2fhf s ILE 56 CO 0.01 0.48 0.11 -1.00 -1.91 0.00 0.00 174.94 172.62 2fhf s HIS 57 N 0.83 3.50 -0.49 3.50 3.76 0.92 -1.02 115.29 126.28 2fhf s HIS 57 Ca -0.09 0.45 -0.01 0.00 -0.15 0.00 0.00 55.06 55.25 2fhf s HIS 57 Cb -0.16 -1.91 0.13 0.00 1.11 0.00 0.00 32.58 31.76 2fhf s HIS 57 CO 0.00 0.67 0.28 -1.17 -0.85 0.00 0.00 174.74 173.67 2fhf s LEU 58 N -0.97 5.09 -0.20 0.89 2.96 -0.76 -0.96 118.68 124.73 2fhf s LEU 58 Ca 0.14 -2.46 -0.28 0.00 -0.22 0.00 0.00 54.13 51.31 2fhf s LEU 58 Cb -0.12 -1.80 -0.05 0.00 0.50 0.00 0.00 46.19 44.72 2fhf s LEU 58 CO 0.04 -0.43 2.18 -0.69 -1.32 0.00 0.00 176.35 176.12 2fhf s VAL 59 N 0.51 3.04 -0.42 1.68 1.01 -0.68 -3.66 120.40 121.88 2fhf s VAL 59 Ca 0.13 0.04 0.04 0.00 0.00 0.00 0.00 61.98 62.19 2fhf s VAL 59 Cb -0.22 -3.05 0.17 0.00 0.00 0.00 0.00 36.38 33.28 2fhf s VAL 59 CO -0.04 -0.03 0.44 -0.62 0.00 0.00 0.00 175.10 174.86 2fhf s ASP 60 N 7.87 0.68 0.07 3.32 2.15 -0.05 -4.67 116.67 126.05 2fhf s ASP 60 Ca 0.98 -2.09 -0.31 0.00 0.43 0.00 0.00 52.55 51.56 2fhf s ASP 60 Cb -0.33 0.53 -0.06 0.00 -0.30 0.00 0.00 42.92 42.76 2fhf s ASP 60 CO 0.35 -0.18 1.20 0.27 -0.17 0.00 0.00 175.17 176.64 2fhf s ILE 61 N 0.87 3.98 0.78 4.11 -4.36 -1.26 -2.85 121.20 122.48 2fhf s ILE 61 Ca 0.25 1.44 -0.11 0.00 -0.26 0.00 0.00 60.65 61.96 2fhf s ILE 61 Cb -0.06 -3.92 0.06 0.00 1.25 0.00 0.00 42.46 39.79 2fhf s ILE 61 CO -0.08 0.12 1.09 0.00 0.24 0.00 0.00 174.94 176.31 2fhf s ALA 62 N 0.98 2.31 0.87 2.27 0.00 -0.99 -5.01 121.76 122.20 2fhf s ALA 62 Ca 0.58 -0.15 -0.11 0.00 0.00 0.00 0.00 51.96 52.28 2fhf s ALA 62 Cb -0.30 -3.12 0.12 0.00 0.00 0.00 0.00 23.12 19.82 2fhf s ALA 62 CO 0.30 -1.65 1.17 0.20 0.00 0.00 0.00 175.76 175.78 2fhf s GLY 63 N -3.87 1.89 0.11 0.00 0.00 -1.26 -4.86 107.32 99.33 2fhf s GLY 63 Ca 0.60 0.69 0.15 0.00 0.00 0.00 0.00 44.72 46.17 2fhf s GLY 63 CO 0.54 1.11 1.48 4.51 0.00 0.00 0.00 173.10 180.74 2fhf n ILE 64 N -3.82 1.13 0.76 0.90 0.00 -1.26 -1.20 119.36 115.86 2fhf n ILE 64 Ca 0.12 0.34 0.08 0.00 0.00 0.00 0.00 62.75 63.30 2fhf n ILE 64 Cb 0.51 -1.22 -0.00 0.00 0.00 0.00 0.00 39.64 38.93 2fhf n ILE 64 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 176.55 176.90 2fhf n THR 65 N -1.81 0.00 -1.50 9.51 -2.24 -1.26 -5.01 114.28 111.98 2fhf n THR 65 Ca 0.02 -0.32 -0.39 0.00 -2.27 0.00 0.00 64.05 61.09 2fhf n THR 65 Cb 0.14 1.20 0.03 0.00 -2.10 0.00 0.00 70.33 69.60 2fhf n THR 65 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 2fhf n SER 66 N -0.11 -0.57 0.00 3.42 2.88 -0.34 -4.92 113.62 113.98 2fhf n SER 66 Ca 0.07 0.81 0.00 0.00 -1.33 0.00 0.00 58.87 58.42 2fhf n SER 66 Cb 0.36 -1.20 0.00 0.00 -0.75 0.00 0.00 64.21 62.61 2fhf n SER 66 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 2fhf n SER 67 N 0.51 0.01 -4.13 -3.46 2.88 -1.26 -4.99 113.62 103.17 2fhf n SER 67 Ca 0.12 -0.16 -0.11 0.00 -1.33 0.00 0.00 58.87 57.38 2fhf n SER 67 Cb 0.45 0.23 -0.10 0.00 -0.75 0.00 0.00 64.21 64.04 2fhf n SER 67 CO 0.00 0.00 0.00 0.42 -1.23 0.00 0.00 175.04 174.23 2fhf s THR 68 N -0.23 0.62 0.25 2.46 -4.23 -1.26 -5.12 115.64 108.12 2fhf s THR 68 Ca 0.00 -1.63 -0.30 0.00 -1.18 0.00 0.00 61.69 58.57 2fhf s THR 68 Cb 0.00 -1.30 -0.11 0.00 1.34 0.00 0.00 72.50 72.43 2fhf s THR 68 CO 0.00 -0.71 1.56 -2.16 -0.54 0.00 0.00 174.62 172.77 2fhf s PRO 69 N -3.05 4.18 0.65 3.99 0.04 -1.26 -4.94 135.00 134.61 2fhf s PRO 69 Ca 0.04 2.46 -0.17 0.00 0.04 0.00 0.00 61.00 63.37 2fhf s PRO 69 Cb 0.00 -3.08 -0.01 0.00 0.04 0.00 0.00 34.50 31.46 2fhf s PRO 69 CO -0.03 -0.58 1.22 0.00 0.04 0.00 0.00 177.00 177.65 2fhf s ALA 70 N 0.34 2.38 -0.26 8.56 0.00 -1.26 -4.97 121.76 126.55 2fhf s ALA 70 Ca 0.65 1.00 -0.22 0.00 0.00 0.00 0.00 51.96 53.38 2fhf s ALA 70 Cb -0.46 -3.47 -0.01 0.00 0.00 0.00 0.00 23.12 19.18 2fhf s ALA 70 CO 0.42 -1.48 0.72 0.34 0.00 0.00 0.00 175.76 175.76 2fhf s ASP 71 N -1.73 6.68 -0.11 0.00 2.15 -1.26 -4.91 116.67 117.50 2fhf s ASP 71 Ca 0.77 0.82 0.15 0.00 0.43 0.00 0.00 52.55 54.72 2fhf s ASP 71 Cb -0.31 -2.38 0.33 0.00 -0.30 0.00 0.00 42.92 40.26 2fhf s ASP 71 CO 0.39 -0.45 1.16 -1.22 -0.17 0.00 0.00 175.17 174.88 2fhf n TYR 72 N 5.87 0.00 -0.01 -5.34 4.01 -1.26 -4.81 117.16 115.62 2fhf n TYR 72 Ca 0.02 -0.93 0.03 0.00 -0.16 0.00 0.00 57.90 56.86 2fhf n TYR 72 Cb 0.48 -0.17 0.39 0.00 -0.31 0.00 0.00 39.34 39.73 2fhf n TYR 72 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2fhf h ALA 73 N 0.62 1.63 0.00 -0.72 0.00 -1.99 -1.83 119.26 116.96 2fhf h ALA 73 Ca -0.05 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.79 2fhf h ALA 73 Cb 1.27 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.89 2fhf h ALA 73 CO 0.02 0.32 -0.25 0.00 0.00 0.00 0.00 179.25 179.34 2fhf h THR 74 N 0.56 0.00 -3.57 0.00 1.03 -1.96 -3.46 112.91 105.51 2fhf h THR 74 Ca 0.15 -0.68 -0.52 0.00 -0.01 0.00 0.00 66.41 65.35 2fhf h THR 74 Cb 0.02 1.53 0.05 0.00 -1.07 0.00 0.00 68.15 68.67 2fhf h THR 74 CO -0.02 0.00 0.65 -0.75 -0.01 0.00 0.00 175.52 175.38 2fhf s LYS 75 N -3.17 4.38 0.36 0.00 2.47 -0.69 -1.37 119.74 121.72 2fhf s LYS 75 Ca 0.07 2.12 -0.14 0.00 -1.56 0.00 0.00 55.97 56.47 2fhf s LYS 75 Cb 0.10 -3.14 0.04 0.00 -1.46 0.00 0.00 37.83 33.37 2fhf s LYS 75 CO 0.66 -0.22 0.72 0.54 0.16 0.00 0.00 175.35 177.22 2fhf s ASN 76 N -0.02 0.12 0.04 1.43 4.22 -0.70 -4.02 114.94 116.02 2fhf s ASN 76 Ca 0.54 -1.14 0.03 0.00 -2.14 0.00 0.00 52.86 50.15 2fhf s ASN 76 Cb -0.38 0.80 -0.02 0.00 1.28 0.00 0.00 41.25 42.93 2fhf s ASN 76 CO 0.44 -1.57 -0.10 -0.76 -2.04 0.00 0.00 177.10 173.06 2fhf s LEU 77 N -3.08 2.22 -0.37 3.54 1.43 -0.76 -1.25 118.68 120.41 2fhf s LEU 77 Ca 0.18 -0.49 -0.06 0.00 -1.03 0.00 0.00 54.13 52.72 2fhf s LEU 77 Cb -0.04 -0.34 0.06 0.00 0.03 0.00 0.00 46.19 45.90 2fhf s LEU 77 CO 0.12 -0.10 0.15 -0.47 0.23 0.00 0.00 176.35 176.29 2fhf s TYR 78 N -1.11 3.33 -0.13 0.29 5.04 -1.10 -4.54 117.35 119.14 2fhf s TYR 78 Ca -0.05 -1.67 -0.05 0.00 -2.44 0.00 0.00 57.07 52.86 2fhf s TYR 78 Cb -0.09 -2.61 -0.04 0.00 0.35 0.00 0.00 41.96 39.58 2fhf s TYR 78 CO 0.01 -0.81 0.06 -0.51 -1.34 0.00 0.00 175.55 172.96 2fhf s LEU 79 N 1.35 3.88 -0.21 6.97 1.43 -1.26 -3.44 118.68 127.40 2fhf s LEU 79 Ca 0.01 0.21 -0.27 0.00 -1.03 0.00 0.00 54.13 53.05 2fhf s LEU 79 Cb -0.21 -1.94 0.08 0.00 0.03 0.00 0.00 46.19 44.15 2fhf s LEU 79 CO 0.01 0.32 0.77 -1.66 0.23 0.00 0.00 176.35 176.02 2fhf s TRP 80 N -0.50 -0.68 -0.07 0.29 -2.14 -1.24 -3.96 118.94 110.65 2fhf s TRP 80 Ca 0.10 1.53 0.05 0.00 2.66 0.00 0.00 56.10 60.43 2fhf s TRP 80 Cb -0.12 0.33 -0.02 0.00 -3.10 0.00 0.00 33.47 30.57 2fhf s TRP 80 CO 0.02 -0.42 -0.21 0.54 -2.66 0.00 0.00 176.95 174.23 2fhf s ASN 81 N -0.16 3.45 0.00 -2.66 2.20 -1.26 -3.77 114.94 112.74 2fhf s ASN 81 Ca -0.03 -0.40 0.00 0.00 -0.94 0.00 0.00 52.86 51.49 2fhf s ASN 81 Cb -0.03 -0.94 0.00 0.00 -2.00 0.00 0.00 41.25 38.27 2fhf s ASN 81 CO 0.02 0.26 0.00 -0.46 -2.94 0.00 0.00 177.10 173.98 2fhf n ASN 82 N 2.86 0.00 0.01 3.54 0.23 0.98 -4.91 115.26 117.98 2fhf n ASN 82 Ca -0.17 0.00 -0.13 0.00 -0.53 0.00 0.00 54.58 53.75 2fhf n ASN 82 Cb 0.52 0.00 -0.09 0.00 -2.08 0.00 0.00 39.78 38.13 2fhf n ASN 82 CO 0.00 0.00 0.00 1.05 -0.93 0.00 0.00 177.26 177.38 2fhf h GLU 83 N 0.00 -0.06 -0.38 -3.83 4.11 -2.03 -3.31 114.58 109.09 2fhf h GLU 83 Ca 0.00 0.00 -0.00 0.00 0.07 0.00 0.00 59.36 59.43 2fhf h GLU 83 Cb 0.00 0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.24 2fhf h GLU 83 CO 0.00 0.37 0.22 1.15 0.07 0.00 0.00 179.01 180.82 2fhf h THR 84 N -0.50 1.13 -3.42 -1.06 2.02 -2.00 -3.43 112.91 105.66 2fhf h THR 84 Ca -0.01 -0.30 -0.44 0.00 0.77 0.00 0.00 66.41 66.43 2fhf h THR 84 Cb 0.45 0.65 -0.34 0.00 -1.74 0.00 0.00 68.15 67.17 2fhf h THR 84 CO 0.01 0.13 -0.78 0.00 0.37 0.00 0.00 175.52 175.25 2fhf n ASP 86 N 4.16 0.44 0.17 0.00 3.85 -1.24 -0.01 116.55 123.93 2fhf n ASP 86 Ca -0.22 -2.19 0.13 0.00 -0.71 0.00 0.00 54.79 51.80 2fhf n ASP 86 Cb 0.51 -0.25 0.44 0.00 -1.35 0.00 0.00 41.12 40.47 2fhf n ASP 86 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 2fhf h ALA 87 N 0.06 1.00 -2.81 2.12 0.00 -1.78 -3.45 119.26 114.39 2fhf h ALA 87 Ca -0.01 0.00 -0.53 0.00 0.00 0.00 0.00 54.91 54.37 2fhf h ALA 87 Cb 1.36 0.00 0.07 0.00 0.00 0.00 0.00 17.79 19.22 2fhf h ALA 87 CO 0.01 0.00 0.77 -0.51 0.00 0.00 0.00 179.25 179.51 2fhf s LEU 88 N -5.23 4.37 -0.30 0.00 1.02 -1.26 -0.33 118.68 116.95 2fhf s LEU 88 Ca 0.06 2.80 -0.10 0.00 0.02 0.00 0.00 54.13 56.91 2fhf s LEU 88 Cb 0.09 -3.64 -0.02 0.00 0.02 0.00 0.00 46.19 42.65 2fhf s LEU 88 CO 0.55 -0.75 0.16 -0.55 0.02 0.00 0.00 176.35 175.78 2fhf s SER 89 N 0.16 5.63 -1.07 2.29 0.15 -0.82 -4.56 113.70 115.47 2fhf s SER 89 Ca 0.57 -0.39 -0.16 0.00 0.70 0.00 0.00 55.95 56.67 2fhf s SER 89 Cb -0.44 -2.03 -0.02 0.00 -1.71 0.00 0.00 66.02 61.83 2fhf s SER 89 CO 0.49 -0.16 0.79 0.00 1.20 0.00 0.00 173.24 175.57 2fhf n ALA 90 N 5.00 -2.56 -2.23 5.45 0.00 -1.26 -4.83 120.51 120.08 2fhf n ALA 90 Ca -0.14 -0.18 -0.42 0.00 0.00 0.00 0.00 53.44 52.70 2fhf n ALA 90 Cb 0.50 -3.92 -0.03 0.00 0.00 0.00 0.00 19.45 16.00 2fhf n ALA 90 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 2fhf s PRO 91 N -5.48 4.28 0.09 0.00 0.04 -1.26 -4.96 135.00 127.70 2fhf s PRO 91 Ca 0.41 1.96 -0.31 0.00 0.04 0.00 0.00 61.00 63.10 2fhf s PRO 91 Cb -0.13 -3.57 -0.08 0.00 0.04 0.00 0.00 34.50 30.75 2fhf s PRO 91 CO 0.84 -0.57 1.60 0.54 0.04 0.00 0.00 177.00 179.44 2fhf s VAL 92 N 2.40 3.02 0.00 -0.36 0.11 -1.25 -4.89 120.40 119.43 2fhf s VAL 92 Ca 0.64 0.56 0.00 0.00 -2.93 0.00 0.00 61.98 60.24 2fhf s VAL 92 Cb -0.31 -3.36 0.00 0.00 -1.53 0.00 0.00 36.38 31.18 2fhf s VAL 92 CO 0.26 0.01 0.00 0.00 -3.33 0.00 0.00 175.10 172.04 2fhf n ALA 93 N 5.12 0.00 -2.27 1.54 0.00 -1.26 -4.38 120.51 119.25 2fhf n ALA 93 Ca 0.15 0.00 -0.04 0.00 0.00 0.00 0.00 53.44 53.55 2fhf n ALA 93 Cb 0.40 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.82 2fhf n ALA 93 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 2fhf n ASP 94 N -2.71 -1.41 -0.12 0.00 4.64 -1.26 -4.61 116.55 111.07 2fhf n ASP 94 Ca 0.00 1.04 0.25 0.00 -1.38 0.00 0.00 54.79 54.69 2fhf n ASP 94 Cb 0.00 -4.16 0.69 0.00 -1.04 0.00 0.00 41.12 36.61 2fhf n ASP 94 CO 0.00 0.00 0.00 -0.25 -0.82 0.00 0.00 177.20 176.13 2fhf h TRP 95 N 3.05 0.06 0.00 -0.67 2.91 -2.01 -0.17 115.95 119.12 2fhf h TRP 95 Ca -0.39 0.00 0.00 0.00 1.13 0.00 0.00 58.89 59.64 2fhf h TRP 95 Cb 0.87 -0.02 0.00 0.00 -0.51 0.00 0.00 29.16 29.50 2fhf h TRP 95 CO 0.00 0.02 0.00 0.09 -1.03 0.00 0.00 178.44 177.52 2fhf n ASN 96 N -4.33 0.11 -4.69 2.65 3.02 -1.26 -4.70 115.26 106.06 2fhf n ASN 96 Ca 0.15 0.53 -0.42 0.00 -0.03 0.00 0.00 54.58 54.81 2fhf n ASN 96 Cb 0.81 -0.55 -0.03 0.00 -0.61 0.00 0.00 39.78 39.40 2fhf n ASN 96 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 2fhf s ASP 97 N -3.20 7.26 -0.22 6.41 2.15 -0.08 -4.92 116.67 124.06 2fhf s ASP 97 Ca 0.05 1.55 0.11 0.00 0.43 0.00 0.00 52.55 54.69 2fhf s ASP 97 Cb 0.08 -2.56 0.44 0.00 -0.30 0.00 0.00 42.92 40.58 2fhf s ASP 97 CO 0.24 -0.43 1.20 0.55 -0.17 0.00 0.00 175.17 176.56 2fhf n VAL 98 N 4.49 2.09 1.04 1.11 3.14 -1.26 -4.74 118.33 124.20 2fhf n VAL 98 Ca 0.09 -3.35 0.13 0.00 -2.96 0.00 0.00 64.34 58.24 2fhf n VAL 98 Cb 0.49 -0.35 0.39 0.00 -1.06 0.00 0.00 33.84 33.30 2fhf n VAL 98 CO 0.00 0.00 0.00 -1.54 -6.46 0.00 0.00 176.83 168.83 2fhf n SER 99 N -0.84 0.37 -3.39 6.55 3.41 -1.26 -4.39 113.62 114.07 2fhf n SER 99 Ca 0.25 -0.08 -0.39 0.00 -0.26 0.00 0.00 58.87 58.39 2fhf n SER 99 Cb 0.82 0.01 -0.02 0.00 -0.26 0.00 0.00 64.21 64.75 2fhf n SER 99 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 175.04 175.29 2fhf n THR 100 N -1.43 4.60 -2.03 6.66 -1.04 -1.26 -4.94 114.28 114.83 2fhf n THR 100 Ca 0.07 -3.19 -0.29 0.00 -2.04 0.00 0.00 64.05 58.60 2fhf n THR 100 Cb 0.33 -2.44 0.05 0.00 -1.82 0.00 0.00 70.33 66.46 2fhf n THR 100 CO 0.00 0.00 0.00 0.42 -0.64 0.00 0.00 175.07 174.85 2fhf s THR 101 N 1.09 3.13 0.32 12.58 -4.23 -1.26 -1.82 115.64 125.45 2fhf s THR 101 Ca 0.64 0.21 -0.27 0.00 -1.18 0.00 0.00 61.69 61.09 2fhf s THR 101 Cb 0.18 -3.34 -0.13 0.00 1.34 0.00 0.00 72.50 70.55 2fhf s THR 101 CO -0.07 -0.42 1.03 -2.65 -0.54 0.00 0.00 174.62 171.98 2fhf n PRO 102 N -2.96 1.43 0.17 3.99 -0.02 -1.26 -4.90 135.00 131.46 2fhf n PRO 102 Ca 0.07 0.50 0.05 0.00 -2.02 0.00 0.00 63.50 62.10 2fhf n PRO 102 Cb 0.58 -1.93 0.17 0.00 -0.02 0.00 0.00 33.50 32.31 2fhf n PRO 102 CO 0.00 0.00 0.00 1.15 1.98 0.00 0.00 175.50 178.63 2fhf h THR 103 N 1.96 0.79 -1.86 3.45 2.02 -1.41 -3.48 112.91 114.38 2fhf h THR 103 Ca -0.41 -1.85 0.35 0.00 0.77 0.00 0.00 66.41 65.27 2fhf h THR 103 Cb 1.33 2.19 -0.07 0.00 -1.74 0.00 0.00 68.15 69.87 2fhf h THR 103 CO 0.60 0.41 0.86 0.61 0.37 0.00 0.00 175.52 178.36 2fhf n GLY 104 N 0.82 0.14 3.49 2.16 0.00 -1.22 -5.04 105.19 105.53 2fhf n GLY 104 Ca 0.01 -0.98 -0.10 0.00 0.00 0.00 0.00 46.02 44.95 2fhf n GLY 104 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2fhf s SER 105 N -3.51 -0.44 0.00 1.61 1.04 -1.26 -1.58 113.70 109.55 2fhf s SER 105 Ca 0.28 0.07 0.00 0.00 0.48 0.00 0.00 55.95 56.78 2fhf s SER 105 Cb -0.00 0.45 0.00 0.00 0.10 0.00 0.00 66.02 66.57 2fhf s SER 105 CO -0.02 -0.70 0.00 -0.90 0.98 0.00 0.00 173.24 172.60 2fhf n ASP 106 N -0.15 0.19 0.29 7.02 3.85 -0.79 -4.97 116.55 121.99 2fhf n ASP 106 Ca -0.12 -0.14 0.17 0.00 -0.71 0.00 0.00 54.79 53.99 2fhf n ASP 106 Cb 0.62 0.00 0.86 0.00 -1.35 0.00 0.00 41.12 41.25 2fhf n ASP 106 CO 0.00 0.00 0.00 0.07 -1.01 0.00 0.00 177.20 176.26 2fhf h LYS 107 N 0.00 0.00 -0.43 0.11 -0.00 -1.99 -2.69 116.57 111.57 2fhf h LYS 107 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 60.65 60.65 2fhf h LYS 107 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 32.23 32.23 2fhf h LYS 107 CO 0.00 0.05 0.00 0.66 -0.00 0.00 0.00 179.45 180.16 2fhf n TYR 108 N -3.36 0.56 0.00 0.07 4.01 -1.26 -2.34 117.16 114.84 2fhf n TYR 108 Ca -0.02 -0.28 0.00 0.00 -0.16 0.00 0.00 57.90 57.44 2fhf n TYR 108 Cb 0.20 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.23 2fhf n TYR 108 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2fhf n GLY 109 N 1.43 1.66 3.93 2.72 0.00 -1.02 -0.87 105.19 113.05 2fhf n GLY 109 Ca 0.19 -2.21 -0.25 0.00 0.00 0.00 0.00 46.02 43.75 2fhf n GLY 109 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2fhf s PRO 110 N -1.45 2.57 0.09 1.61 0.04 -1.24 -1.89 135.00 134.72 2fhf s PRO 110 Ca 0.00 -0.27 -0.10 0.00 0.04 0.00 0.00 61.00 60.67 2fhf s PRO 110 Cb 0.00 -2.28 0.00 0.00 0.04 0.00 0.00 34.50 32.26 2fhf s PRO 110 CO 0.00 -0.90 0.22 1.52 0.04 0.00 0.00 177.00 177.89 2fhf s TYR 111 N -3.03 0.08 -0.05 0.56 -0.85 -0.62 -1.82 117.35 111.62 2fhf s TYR 111 Ca 0.57 -0.47 0.04 0.00 -0.52 0.00 0.00 57.07 56.68 2fhf s TYR 111 Cb -0.11 -0.01 0.00 0.00 0.38 0.00 0.00 41.96 42.23 2fhf s TYR 111 CO 0.43 -0.55 -0.17 -1.58 -1.52 0.00 0.00 175.55 172.16 2fhf s TRP 112 N -3.69 1.77 -0.48 -3.49 0.51 -0.19 -0.93 118.94 112.44 2fhf s TRP 112 Ca 0.03 -0.57 -0.14 0.00 -2.12 0.00 0.00 56.10 53.31 2fhf s TRP 112 Cb 0.04 -1.21 0.10 0.00 -0.81 0.00 0.00 33.47 31.58 2fhf s TRP 112 CO -0.10 -0.22 0.40 0.08 -0.51 0.00 0.00 176.95 176.59 2fhf s VAL 113 N 0.21 4.92 -0.21 4.03 1.01 -1.26 -1.65 120.40 127.45 2fhf s VAL 113 Ca -0.08 -1.35 -0.16 0.00 0.00 0.00 0.00 61.98 60.40 2fhf s VAL 113 Cb -0.13 -4.05 -0.04 0.00 0.00 0.00 0.00 36.38 32.16 2fhf s VAL 113 CO 0.03 -0.68 0.39 -0.63 0.00 0.00 0.00 175.10 174.21 2fhf s ILE 114 N 1.55 5.20 -0.10 2.22 -1.09 0.17 -4.93 121.20 124.23 2fhf s ILE 114 Ca 0.04 0.67 -0.30 0.00 -2.23 0.00 0.00 60.65 58.83 2fhf s ILE 114 Cb -0.26 -3.72 -0.03 0.00 -1.58 0.00 0.00 42.46 36.88 2fhf s ILE 114 CO 0.04 0.25 1.28 -2.16 -1.23 0.00 0.00 174.94 173.12 2fhf s PRO 115 N 1.37 4.28 0.31 2.79 0.04 -1.26 0.05 135.00 142.57 2fhf s PRO 115 Ca 0.18 1.74 0.07 0.00 0.04 0.00 0.00 61.00 63.03 2fhf s PRO 115 Cb -0.15 -3.68 -0.02 0.00 0.04 0.00 0.00 34.50 30.69 2fhf s PRO 115 CO 0.08 -0.61 0.35 -0.51 0.04 0.00 0.00 177.00 176.35 2fhf s LEU 116 N 2.96 3.88 0.03 -3.56 1.43 -0.87 -1.95 118.68 120.59 2fhf s LEU 116 Ca 0.57 -0.26 0.22 0.00 -1.03 0.00 0.00 54.13 53.64 2fhf s LEU 116 Cb -0.25 -2.52 -0.13 0.00 0.03 0.00 0.00 46.19 43.32 2fhf s LEU 116 CO 0.20 -0.28 0.84 1.07 0.23 0.00 0.00 176.35 178.40 2fhf n THR 117 N -1.44 0.11 -3.65 5.49 5.66 0.55 -4.66 114.28 116.35 2fhf n THR 117 Ca -0.03 -0.29 -0.06 0.00 -3.05 0.00 0.00 64.05 60.61 2fhf n THR 117 Cb 0.58 0.27 -0.02 0.00 -1.55 0.00 0.00 70.33 69.61 2fhf n THR 117 CO 0.00 0.00 0.00 -1.59 -3.05 0.00 0.00 175.07 170.43 2fhf s LYS 118 N -3.27 1.10 -0.29 1.09 -2.85 -1.26 -5.04 119.74 109.23 2fhf s LYS 118 Ca 0.01 -0.54 0.11 0.00 -1.00 0.00 0.00 55.97 54.55 2fhf s LYS 118 Cb 0.14 0.42 0.76 0.00 -2.06 0.00 0.00 37.83 37.10 2fhf s LYS 118 CO 0.85 -0.50 1.77 0.39 0.10 0.00 0.00 175.35 177.96 2fhf n GLU 119 N -0.38 4.05 -4.37 1.78 1.02 -1.26 -4.80 120.64 116.67 2fhf n GLU 119 Ca -0.08 -3.11 -0.19 0.00 -0.02 0.00 0.00 57.16 53.76 2fhf n GLU 119 Cb 0.61 -2.22 -0.10 0.00 -0.02 0.00 0.00 31.44 29.71 2fhf n GLU 119 CO 0.00 0.00 0.00 -1.54 1.18 0.00 0.00 177.13 176.77 2fhf s SER 120 N -1.03 2.44 0.38 1.62 1.04 -1.26 -4.94 113.70 111.95 2fhf s SER 120 Ca 0.54 -1.12 0.00 0.00 0.48 0.00 0.00 55.95 55.85 2fhf s SER 120 Cb 0.43 -0.11 0.00 0.00 0.10 0.00 0.00 66.02 66.44 2fhf s SER 120 CO 0.14 -0.32 0.00 0.61 0.98 0.00 0.00 173.24 174.65 2fhf n GLY 121 N -0.45 0.58 2.89 7.32 0.00 -1.26 -4.70 105.19 109.57 2fhf n GLY 121 Ca -0.07 -1.05 -0.08 0.00 0.00 0.00 0.00 46.02 44.82 2fhf n GLY 121 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2fhf s ILE 123 N -2.37 0.06 -0.20 0.00 -4.36 -1.07 -2.65 121.20 110.60 2fhf s ILE 123 Ca 0.14 -0.47 -0.15 0.00 -0.26 0.00 0.00 60.65 59.92 2fhf s ILE 123 Cb -0.03 -0.41 -0.04 0.00 1.25 0.00 0.00 42.46 43.22 2fhf s ILE 123 CO 0.11 -0.26 0.35 0.20 0.24 0.00 0.00 174.94 175.58 2fhf s ASN 124 N -0.95 6.39 0.02 4.36 0.01 -1.25 -1.53 114.94 122.00 2fhf s ASN 124 Ca -0.10 0.46 0.00 0.00 -0.71 0.00 0.00 52.86 52.51 2fhf s ASN 124 Cb -0.06 -2.21 -0.02 0.00 0.41 0.00 0.00 41.25 39.38 2fhf s ASN 124 CO 0.02 -0.04 -0.03 -0.69 -1.51 0.00 0.00 177.10 174.84 2fhf s VAL 125 N 1.18 0.18 -0.20 1.60 1.01 0.13 -3.65 120.40 120.65 2fhf s VAL 125 Ca 0.17 -0.72 -0.05 0.00 0.00 0.00 0.00 61.98 61.39 2fhf s VAL 125 Cb -0.14 -0.27 0.07 0.00 0.00 0.00 0.00 36.38 36.04 2fhf s VAL 125 CO 0.07 -0.35 0.13 -0.63 0.00 0.00 0.00 175.10 174.33 2fhf s ILE 126 N -1.08 -0.15 0.11 2.22 1.01 -1.22 -1.11 121.20 120.97 2fhf s ILE 126 Ca -0.11 -0.24 -0.31 0.00 0.00 0.00 0.00 60.65 60.00 2fhf s ILE 126 Cb -0.08 -0.66 -0.07 0.00 0.01 0.00 0.00 42.46 41.66 2fhf s ILE 126 CO -0.01 -0.33 1.32 -0.69 0.00 0.00 0.00 174.94 175.24 2fhf s VAL 127 N 2.18 3.52 0.23 2.92 1.01 -1.26 -2.70 120.40 126.31 2fhf s VAL 127 Ca 0.04 1.10 0.02 0.00 0.00 0.00 0.00 61.98 63.15 2fhf s VAL 127 Cb -0.16 -3.71 -0.05 0.00 0.00 0.00 0.00 36.38 32.46 2fhf s VAL 127 CO -0.14 0.09 0.05 -0.13 0.00 0.00 0.00 175.10 174.97 2fhf s ARG 128 N 0.99 1.33 -0.53 2.72 0.52 -0.38 -1.76 118.95 121.84 2fhf s ARG 128 Ca 0.62 -1.69 0.07 0.00 -0.52 0.00 0.00 55.73 54.21 2fhf s ARG 128 Cb -0.35 -0.37 0.28 0.00 0.52 0.00 0.00 34.95 35.03 2fhf s ARG 128 CO 0.30 -0.20 0.72 -3.47 0.02 0.00 0.00 175.30 172.67 2fhf n ASP 129 N -0.41 2.54 0.00 0.23 4.64 -0.88 -1.72 116.55 120.96 2fhf n ASP 129 Ca -0.03 -3.23 0.00 0.00 -1.38 0.00 0.00 54.79 50.15 2fhf n ASP 129 Cb 0.65 -0.63 0.00 0.00 -1.04 0.00 0.00 41.12 40.09 2fhf n ASP 129 CO 0.00 0.00 0.00 0.61 -0.82 0.00 0.00 177.20 176.99 2fhf n GLY 130 N 0.73 1.11 0.00 0.27 0.00 -0.47 -4.13 105.19 102.69 2fhf n GLY 130 Ca 0.27 -0.70 0.00 0.00 0.00 0.00 0.00 46.02 45.59 2fhf n GLY 130 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2fhf n THR 131 N 0.00 0.00 -2.01 2.61 -1.04 -1.26 -4.76 114.28 107.82 2fhf n THR 131 Ca 0.00 0.00 -0.30 0.00 -2.04 0.00 0.00 64.05 61.71 2fhf n THR 131 Cb 0.00 0.07 0.02 0.00 -1.82 0.00 0.00 70.33 68.59 2fhf n THR 131 CO 0.00 0.00 0.00 0.20 -0.64 0.00 0.00 175.07 174.63 2fhf s ASN 132 N -1.17 6.02 -0.24 8.00 -0.87 -1.26 -5.05 114.94 120.37 2fhf s ASN 132 Ca 0.00 1.25 -0.12 0.00 -1.57 0.00 0.00 52.86 52.42 2fhf s ASN 132 Cb 0.00 -2.27 -0.05 0.00 -0.02 0.00 0.00 41.25 38.91 2fhf s ASN 132 CO 0.00 -0.95 0.23 -0.54 -2.57 0.00 0.00 177.10 173.27 2fhf s LYS 133 N -5.15 4.06 0.23 -0.60 1.02 -1.26 -2.06 119.74 115.98 2fhf s LYS 133 Ca 0.55 -0.17 0.11 0.00 0.02 0.00 0.00 55.97 56.48 2fhf s LYS 133 Cb -0.11 -3.57 0.15 0.00 -0.52 0.00 0.00 37.83 33.78 2fhf s LYS 133 CO 0.52 -0.03 1.48 -0.07 -0.92 0.00 0.00 175.35 176.33 2fhf h LEU 134 N 7.77 0.00 -7.39 3.17 3.38 -1.66 -3.41 115.31 117.17 2fhf h LEU 134 Ca -0.37 0.00 -0.50 0.00 0.09 0.00 0.00 57.88 57.11 2fhf h LEU 134 Cb 1.17 0.00 -0.39 0.00 0.09 0.00 0.00 40.66 41.53 2fhf h LEU 134 CO 0.65 0.71 -0.77 -0.63 0.09 0.00 0.00 178.44 178.49 2fhf s ILE 135 N -3.18 0.57 0.00 1.22 1.09 -1.21 -1.16 121.20 118.52 2fhf s ILE 135 Ca 0.00 -0.35 0.00 0.00 -1.10 0.00 0.00 60.65 59.21 2fhf s ILE 135 Cb 0.11 -0.91 0.00 0.00 -1.06 0.00 0.00 42.46 40.60 2fhf s ILE 135 CO 0.77 -0.00 0.43 0.47 -0.10 0.00 0.00 174.94 176.51 2fhf n ASP 136 N 5.05 0.00 -3.40 3.58 8.00 -1.26 -4.59 116.55 123.93 2fhf n ASP 136 Ca -0.09 0.43 -0.34 0.00 0.71 0.00 0.00 54.79 55.50 2fhf n ASP 136 Cb 0.48 0.00 -0.01 0.00 -0.02 0.00 0.00 41.12 41.57 2fhf n ASP 136 CO 0.00 0.00 0.00 -0.24 -0.39 0.00 0.00 177.20 176.57 2fhf n SER 137 N -0.44 -1.98 -4.77 -2.24 2.88 -1.26 -4.87 113.62 100.95 2fhf n SER 137 Ca 0.00 0.69 -0.40 0.00 -1.33 0.00 0.00 58.87 57.83 2fhf n SER 137 Cb 0.00 -0.71 -0.03 0.00 -0.75 0.00 0.00 64.21 62.72 2fhf n SER 137 CO 0.00 0.00 0.00 -1.81 -1.23 0.00 0.00 175.04 172.00 2fhf s ASP 138 N -0.79 6.94 -0.16 -3.46 1.01 -1.26 -4.94 116.67 114.01 2fhf s ASP 138 Ca 0.47 2.46 -0.04 0.00 0.71 0.00 0.00 52.55 56.16 2fhf s ASP 138 Cb -0.55 -2.63 -0.03 0.00 1.01 0.00 0.00 42.92 40.72 2fhf s ASP 138 CO 0.48 -0.39 -0.04 -0.76 0.21 0.00 0.00 175.17 174.67 2fhf s LEU 139 N -1.76 3.24 -0.24 1.23 1.43 -0.27 -4.99 118.68 117.32 2fhf s LEU 139 Ca 0.48 -0.14 0.01 0.00 -1.03 0.00 0.00 54.13 53.45 2fhf s LEU 139 Cb -0.35 -1.78 0.04 0.00 0.03 0.00 0.00 46.19 44.13 2fhf s LEU 139 CO 0.46 0.16 -0.10 -0.13 0.23 0.00 0.00 176.35 176.97 2fhf s ARG 140 N 0.40 2.61 -0.55 1.70 0.52 -1.26 0.19 118.95 122.57 2fhf s ARG 140 Ca -0.04 -1.11 -0.20 0.00 -0.52 0.00 0.00 55.73 53.87 2fhf s ARG 140 Cb -0.14 -2.88 0.07 0.00 0.52 0.00 0.00 34.95 32.52 2fhf s ARG 140 CO 0.03 -0.44 0.70 0.08 0.02 0.00 0.00 175.30 175.69 2fhf s VAL 141 N 1.23 4.77 -0.10 3.52 1.01 -0.58 -4.91 120.40 125.34 2fhf s VAL 141 Ca -0.03 -0.61 -0.30 0.00 0.00 0.00 0.00 61.98 61.05 2fhf s VAL 141 Cb -0.17 -4.42 -0.02 0.00 0.00 0.00 0.00 36.38 31.77 2fhf s VAL 141 CO -0.06 -1.00 1.07 -0.55 0.00 0.00 0.00 175.10 174.56 2fhf s SER 142 N 3.12 7.17 0.06 3.32 0.15 -1.26 -2.60 113.70 123.66 2fhf s SER 142 Ca 0.15 1.61 0.21 0.00 0.70 0.00 0.00 55.95 58.63 2fhf s SER 142 Cb -0.20 -2.56 0.88 0.00 -1.71 0.00 0.00 66.02 62.44 2fhf s SER 142 CO 0.10 -0.51 1.68 0.49 1.20 0.00 0.00 173.24 176.20 2fhf n PHE 143 N 5.17 0.22 -0.01 3.44 0.99 0.38 -1.63 117.46 126.01 2fhf n PHE 143 Ca 0.10 0.08 -0.13 0.00 -0.00 0.00 0.00 57.45 57.49 2fhf n PHE 143 Cb 0.48 -0.62 -0.14 0.00 -1.00 0.00 0.00 39.48 38.19 2fhf n PHE 143 CO 0.00 0.00 0.00 -1.13 -0.00 0.00 0.00 176.76 175.63 2fhf n SER 144 N -1.69 1.32 0.01 4.37 3.41 -1.26 -3.31 113.62 116.48 2fhf n SER 144 Ca 0.05 0.34 -0.12 0.00 -0.26 0.00 0.00 58.87 58.87 2fhf n SER 144 Cb 0.26 -0.34 -0.00 0.00 -0.26 0.00 0.00 64.21 63.86 2fhf n SER 144 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 2fhf h ASP 145 N 0.03 0.68 -3.60 4.04 5.19 -1.87 -3.37 116.42 117.51 2fhf h ASP 145 Ca -0.34 -0.43 -0.62 0.00 -0.62 0.00 0.00 57.03 55.03 2fhf h ASP 145 Cb 2.02 -0.20 -0.40 0.00 0.18 0.00 0.00 39.33 40.93 2fhf h ASP 145 CO 0.08 1.18 -0.70 -0.36 -3.12 0.00 0.00 179.24 176.33 2fhf s PHE 146 N -3.75 2.53 0.19 4.55 0.40 -0.65 -5.01 117.98 116.25 2fhf s PHE 146 Ca -0.08 -2.79 -0.16 0.00 -0.60 0.00 0.00 56.93 53.31 2fhf s PHE 146 Cb 0.10 -2.22 0.18 0.00 0.51 0.00 0.00 43.02 41.58 2fhf s PHE 146 CO 0.86 -0.73 1.63 0.00 0.70 0.00 0.00 175.22 177.68 2fhf h THR 147 N 5.13 0.41 0.00 0.64 1.03 -1.73 -0.71 112.91 117.67 2fhf h THR 147 Ca 0.02 0.00 0.00 0.00 -0.01 0.00 0.00 66.41 66.42 2fhf h THR 147 Cb 0.89 0.41 0.00 0.00 -1.07 0.00 0.00 68.15 68.37 2fhf h THR 147 CO 0.57 0.00 0.00 -0.90 -0.01 0.00 0.00 175.52 175.18 2fhf n ASP 148 N -5.40 0.00 -3.20 0.00 5.68 -1.26 -4.84 116.55 107.53 2fhf n ASP 148 Ca 0.05 -0.65 -0.19 0.00 -0.50 0.00 0.00 54.79 53.50 2fhf n ASP 148 Cb 0.30 0.00 -0.01 0.00 -1.14 0.00 0.00 41.12 40.27 2fhf n ASP 148 CO 0.00 0.00 0.00 0.54 -1.33 0.00 0.00 177.20 176.41 2fhf n ARG 149 N -0.82 -2.81 -3.87 0.11 1.74 -0.27 -4.16 116.66 106.58 2fhf n ARG 149 Ca 0.07 0.36 -0.30 0.00 -0.77 0.00 0.00 57.85 57.20 2fhf n ARG 149 Cb 0.03 -4.99 -0.15 0.00 -1.02 0.00 0.00 32.46 26.33 2fhf n ARG 149 CO 0.00 0.00 0.00 0.99 -1.52 0.00 0.00 177.63 177.10 2fhf s THR 150 N -2.74 1.51 0.45 0.55 2.01 -1.26 -0.83 115.64 115.33 2fhf s THR 150 Ca 0.32 -1.77 0.06 0.00 0.31 0.00 0.00 61.69 60.61 2fhf s THR 150 Cb -0.17 -2.09 -0.03 0.00 0.01 0.00 0.00 72.50 70.22 2fhf s THR 150 CO 0.39 -0.59 0.24 0.68 -0.69 0.00 0.00 174.62 174.64 2fhf s VAL 151 N 1.31 2.13 -0.02 3.82 -7.23 0.10 -4.47 120.40 116.04 2fhf s VAL 151 Ca 0.09 -1.63 -0.04 0.00 -1.81 0.00 0.00 61.98 58.59 2fhf s VAL 151 Cb -0.18 -2.76 0.00 0.00 0.56 0.00 0.00 36.38 34.00 2fhf s VAL 151 CO -0.16 0.00 0.08 -0.44 -0.31 0.00 0.00 175.10 174.27 2fhf s SER 152 N -4.01 -0.01 0.15 4.85 0.01 0.58 -0.06 113.70 115.21 2fhf s SER 152 Ca 0.38 -0.03 -0.02 0.00 1.31 0.00 0.00 55.95 57.59 2fhf s SER 152 Cb 0.02 0.18 -0.04 0.00 0.21 0.00 0.00 66.02 66.39 2fhf s SER 152 CO 0.21 -0.16 0.10 0.68 0.41 0.00 0.00 173.24 174.49 2fhf s VAL 153 N -0.57 0.08 0.08 3.43 -7.23 -0.13 -0.79 120.40 115.28 2fhf s VAL 153 Ca -0.06 -1.84 0.05 0.00 -1.81 0.00 0.00 61.98 58.31 2fhf s VAL 153 Cb -0.04 -2.08 -0.03 0.00 0.56 0.00 0.00 36.38 34.79 2fhf s VAL 153 CO 0.00 -0.37 -0.13 -0.63 -0.31 0.00 0.00 175.10 173.66 2fhf s ILE 154 N -4.05 1.06 0.19 -0.62 1.01 -1.26 -1.69 121.20 115.83 2fhf s ILE 154 Ca 0.25 -1.40 -0.33 0.00 0.00 0.00 0.00 60.65 59.18 2fhf s ILE 154 Cb 0.07 -1.14 -0.14 0.00 0.01 0.00 0.00 42.46 41.26 2fhf s ILE 154 CO 0.03 -0.32 1.44 0.00 0.00 0.00 0.00 174.94 176.09 2fhf n ALA 155 N 1.08 0.81 -1.60 9.38 0.00 -1.26 -1.88 120.51 127.04 2fhf n ALA 155 Ca -0.20 0.44 -0.15 0.00 0.00 0.00 0.00 53.44 53.54 2fhf n ALA 155 Cb 0.55 -2.26 -0.05 0.00 0.00 0.00 0.00 19.45 17.69 2fhf n ALA 155 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2fhf n GLY 156 N 2.65 1.13 0.35 0.00 0.00 -0.31 -4.89 105.19 104.12 2fhf n GLY 156 Ca 0.15 -0.33 -0.19 0.00 0.00 0.00 0.00 46.02 45.65 2fhf n GLY 156 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2fhf n ASN 157 N -0.43 1.58 0.00 1.61 5.15 -0.79 -5.01 115.26 117.37 2fhf n ASN 157 Ca -0.15 0.17 0.00 0.00 -0.60 0.00 0.00 54.58 54.00 2fhf n ASN 157 Cb 0.51 -0.51 0.00 0.00 -0.53 0.00 0.00 39.78 39.25 2fhf n ASN 157 CO 0.00 0.00 0.00 -0.24 1.40 0.00 0.00 177.26 178.42 2fhf n SER 158 N -3.70 0.00 -4.90 1.20 2.88 -1.26 -4.99 113.62 102.85 2fhf n SER 158 Ca -0.37 0.00 -0.32 0.00 -1.33 0.00 0.00 58.87 56.85 2fhf n SER 158 Cb 0.78 -0.58 -0.05 0.00 -0.75 0.00 0.00 64.21 63.62 2fhf n SER 158 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2fhf s ALA 159 N -2.81 3.82 -0.15 -1.46 0.00 -1.26 -4.93 121.76 114.97 2fhf s ALA 159 Ca 0.00 -0.58 -0.06 0.00 0.00 0.00 0.00 51.96 51.32 2fhf s ALA 159 Cb 0.00 -2.10 -0.04 0.00 0.00 0.00 0.00 23.12 20.99 2fhf s ALA 159 CO 0.00 0.68 0.05 0.08 0.00 0.00 0.00 175.76 176.57 2fhf s VAL 160 N -1.57 4.72 0.21 0.00 1.01 -1.26 -4.58 120.40 118.93 2fhf s VAL 160 Ca 0.38 -0.07 0.11 0.00 0.00 0.00 0.00 61.98 62.40 2fhf s VAL 160 Cb -0.13 -3.08 -0.05 0.00 0.00 0.00 0.00 36.38 33.13 2fhf s VAL 160 CO 0.23 0.52 -0.22 -0.31 0.00 0.00 0.00 175.10 175.33 2fhf s TYR 161 N -0.15 2.32 -0.66 5.22 2.02 0.03 -4.96 117.35 121.17 2fhf s TYR 161 Ca 0.07 -0.34 0.25 0.00 -0.37 0.00 0.00 57.07 56.68 2fhf s TYR 161 Cb -0.12 -1.11 0.63 0.00 -0.40 0.00 0.00 41.96 40.96 2fhf s TYR 161 CO 0.01 0.55 1.64 0.22 -1.57 0.00 0.00 175.55 176.41 2fhf h ASP 162 N 2.95 0.00 -5.05 2.29 -0.00 -1.84 0.17 116.42 114.94 2fhf h ASP 162 Ca -0.45 -0.04 -0.05 0.00 -0.00 0.00 0.00 57.03 56.49 2fhf h ASP 162 Cb 1.22 0.00 -0.14 0.00 -0.00 0.00 0.00 39.33 40.41 2fhf h ASP 162 CO 0.51 0.02 -0.02 -0.94 -0.00 0.00 0.00 179.24 178.81 2fhf s SER 163 N -4.73 -0.33 0.54 2.28 1.04 -1.26 -4.57 113.70 106.67 2fhf s SER 163 Ca 0.09 -0.11 0.32 0.00 0.48 0.00 0.00 55.95 56.73 2fhf s SER 163 Cb 0.11 0.48 1.51 0.00 0.10 0.00 0.00 66.02 68.23 2fhf s SER 163 CO 0.64 -0.80 2.06 0.03 0.98 0.00 0.00 173.24 176.14 2fhf h ARG 164 N 2.54 0.00 -0.07 4.02 3.08 -1.83 -2.14 114.38 119.97 2fhf h ARG 164 Ca -0.33 0.00 -0.10 0.00 0.07 0.00 0.00 59.98 59.62 2fhf h ARG 164 Cb 1.24 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.30 2fhf h ARG 164 CO 0.44 0.08 -0.35 0.00 -1.07 0.00 0.00 179.97 179.07 2fhf h ALA 165 N 1.92 0.14 -0.31 0.04 0.00 -1.86 -1.56 119.26 117.63 2fhf h ALA 165 Ca -0.00 -0.45 -0.00 0.00 0.00 0.00 0.00 54.91 54.45 2fhf h ALA 165 Cb 0.40 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.17 2fhf h ALA 165 CO 0.01 0.22 0.18 -0.44 0.00 0.00 0.00 179.25 179.21 2fhf h ASP 166 N -0.11 0.39 -0.83 0.00 3.45 -1.83 -1.01 116.42 116.48 2fhf h ASP 166 Ca -0.02 -0.08 0.01 0.00 0.43 0.00 0.00 57.03 57.37 2fhf h ASP 166 Cb 1.00 -0.10 -0.04 0.00 -0.56 0.00 0.00 39.33 39.63 2fhf h ASP 166 CO 0.07 0.35 0.54 0.00 -1.57 0.00 0.00 179.24 178.63 2fhf h ALA 167 N 1.05 1.39 -0.43 3.45 0.00 -1.44 -1.42 119.26 121.86 2fhf h ALA 167 Ca 0.11 -0.06 -0.07 0.00 0.00 0.00 0.00 54.91 54.89 2fhf h ALA 167 Cb 0.05 -0.34 -0.02 0.00 0.00 0.00 0.00 17.79 17.48 2fhf h ALA 167 CO -0.02 0.56 -0.02 0.35 0.00 0.00 0.00 179.25 180.12 2fhf h PHE 168 N 1.13 0.76 0.00 0.00 3.04 -0.72 -2.60 116.94 118.54 2fhf h PHE 168 Ca 0.30 -0.10 -0.03 0.00 3.98 0.00 0.00 57.97 62.12 2fhf h PHE 168 Cb -0.12 -0.21 -0.00 0.00 2.56 0.00 0.00 35.95 38.18 2fhf h PHE 168 CO 0.00 0.72 -0.13 0.00 -2.02 0.00 0.00 178.31 176.88 2fhf h ARG 169 N 0.67 0.00 -0.69 1.11 3.08 -0.30 -3.24 114.38 115.00 2fhf h ARG 169 Ca 0.13 0.00 0.19 0.00 0.07 0.00 0.00 59.98 60.37 2fhf h ARG 169 Cb 0.44 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.46 2fhf h ARG 169 CO 0.02 0.13 0.49 0.00 -1.07 0.00 0.00 179.97 179.54 2fhf h ALA 170 N 1.87 2.52 0.00 0.04 0.00 -0.88 0.54 119.26 123.35 2fhf h ALA 170 Ca -0.00 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.89 2fhf h ALA 170 Cb 0.89 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.71 2fhf h ALA 170 CO 0.02 -0.72 0.00 0.00 0.00 0.00 0.00 179.25 178.55 2fhf n ALA 171 N -2.64 2.48 -2.10 0.00 0.00 -1.22 -3.47 120.51 113.56 2fhf n ALA 171 Ca 0.14 -0.16 -0.28 0.00 0.00 0.00 0.00 53.44 53.13 2fhf n ALA 171 Cb 0.70 -1.45 0.02 0.00 0.00 0.00 0.00 19.45 18.73 2fhf n ALA 171 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 2fhf n PHE 172 N -1.08 3.08 -4.35 0.00 3.01 0.19 -4.98 117.46 113.32 2fhf n PHE 172 Ca 0.19 -2.66 -0.15 0.00 1.01 0.00 0.00 57.45 55.83 2fhf n PHE 172 Cb 0.13 -0.46 -0.03 0.00 -0.01 0.00 0.00 39.48 39.10 2fhf n PHE 172 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2fhf n GLY 173 N -0.63 3.88 3.66 1.37 0.00 -1.23 -4.88 105.19 107.36 2fhf n GLY 173 Ca 0.45 -2.26 -0.42 0.00 0.00 0.00 0.00 46.02 43.79 2fhf n GLY 173 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2fhf s VAL 174 N -1.92 3.75 0.00 1.61 1.01 -1.26 -4.05 120.40 119.55 2fhf s VAL 174 Ca 0.01 0.90 -0.06 0.00 0.00 0.00 0.00 61.98 62.82 2fhf s VAL 174 Cb 0.00 -3.60 -0.00 0.00 0.00 0.00 0.00 36.38 32.78 2fhf s VAL 174 CO 0.01 -0.10 0.12 0.00 0.00 0.00 0.00 175.10 175.13 2fhf s ALA 175 N 4.01 -0.28 0.00 5.51 0.00 -0.09 -4.97 121.76 125.95 2fhf s ALA 175 Ca 0.69 -0.17 0.00 0.00 0.00 0.00 0.00 51.96 52.48 2fhf s ALA 175 Cb -0.30 0.10 0.00 0.00 0.00 0.00 0.00 23.12 22.92 2fhf s ALA 175 CO 0.26 -0.20 0.00 1.28 0.00 0.00 0.00 175.76 177.10 2fhf n LEU 176 N 1.52 0.00 -2.71 0.00 4.77 -1.26 -4.21 117.00 115.10 2fhf n LEU 176 Ca -0.23 0.00 -0.08 0.00 -0.03 0.00 0.00 56.01 55.68 2fhf n LEU 176 Cb 0.56 0.00 0.10 0.00 -2.33 0.00 0.00 43.42 41.74 2fhf n LEU 176 CO 0.21 -0.75 0.42 0.00 -1.33 0.00 0.00 177.39 175.94 2fhf n ALA 177 N 1.41 -0.48 -0.35 -1.18 0.00 -0.28 -2.37 120.51 117.27 2fhf n ALA 177 Ca 0.00 -1.30 0.05 0.00 0.00 0.00 0.00 53.44 52.19 2fhf n ALA 177 Cb 0.00 -1.26 0.30 0.00 0.00 0.00 0.00 19.45 18.49 2fhf n ALA 177 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 2fhf n ASP 178 N 0.09 4.39 -4.56 0.00 5.75 -0.96 -4.36 116.55 116.89 2fhf n ASP 178 Ca 0.02 -2.64 -0.34 0.00 -0.01 0.00 0.00 54.79 51.82 2fhf n ASP 178 Cb 0.74 -0.62 -0.11 0.00 -1.03 0.00 0.00 41.12 40.10 2fhf n ASP 178 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2fhf s ALA 179 N -2.23 3.14 -0.19 2.12 0.00 -1.22 -4.39 121.76 118.98 2fhf s ALA 179 Ca 0.40 -0.80 0.01 0.00 0.00 0.00 0.00 51.96 51.57 2fhf s ALA 179 Cb 0.30 -1.61 0.03 0.00 0.00 0.00 0.00 23.12 21.84 2fhf s ALA 179 CO 0.13 0.29 -0.14 -1.01 0.00 0.00 0.00 175.76 175.02 2fhf s HIS 180 N 0.10 2.58 -0.82 0.00 3.76 0.42 -0.97 115.29 120.37 2fhf s HIS 180 Ca 0.01 -1.63 -0.20 0.00 -0.15 0.00 0.00 55.06 53.09 2fhf s HIS 180 Cb -0.13 -1.75 0.12 0.00 1.11 0.00 0.00 32.58 31.92 2fhf s HIS 180 CO 0.02 -0.77 1.03 -0.46 -0.85 0.00 0.00 174.74 173.72 2fhf s TRP 181 N 1.34 3.01 -0.07 1.40 -0.11 -0.47 -0.62 118.94 123.42 2fhf s TRP 181 Ca 0.01 -1.15 0.13 0.00 1.22 0.00 0.00 56.10 56.31 2fhf s TRP 181 Cb -0.15 -4.24 -0.07 0.00 -1.50 0.00 0.00 33.47 27.50 2fhf s TRP 181 CO -0.10 -1.50 1.19 -0.39 -4.62 0.00 0.00 176.95 171.54 2fhf h VAL 182 N 5.85 0.97 -3.56 5.86 -1.51 -1.71 -1.60 116.25 120.55 2fhf h VAL 182 Ca -0.00 -2.48 -0.13 0.00 -1.23 0.00 0.00 66.70 62.85 2fhf h VAL 182 Cb 1.04 2.43 -0.05 0.00 -2.13 0.00 0.00 31.29 32.58 2fhf h VAL 182 CO 1.12 0.55 0.02 1.51 -1.23 0.00 0.00 177.57 179.54 2fhf s ASP 183 N -6.32 0.36 0.24 4.19 3.84 -1.23 -2.03 116.67 115.72 2fhf s ASP 183 Ca 0.01 -1.23 -0.09 0.00 -0.00 0.00 0.00 52.55 51.24 2fhf s ASP 183 Cb 0.08 0.73 0.38 0.00 -1.38 0.00 0.00 42.92 42.73 2fhf s ASP 183 CO 0.79 -1.43 1.40 1.17 -0.00 0.00 0.00 175.17 177.10 2fhf n LYS 184 N -0.52 -0.10 -0.02 2.11 4.81 -1.26 -2.62 118.16 120.55 2fhf n LYS 184 Ca -0.03 1.40 0.01 0.00 -0.87 0.00 0.00 58.31 58.82 2fhf n LYS 184 Cb 0.61 -2.09 0.02 0.00 0.02 0.00 0.00 35.03 33.59 2fhf n LYS 184 CO 0.00 0.00 0.00 0.25 1.17 0.00 0.00 177.40 178.82 2fhf n THR 185 N -5.44 0.90 -4.42 3.15 -2.24 -1.26 -4.89 114.28 100.07 2fhf n THR 185 Ca 0.13 -0.95 -0.34 0.00 -2.27 0.00 0.00 64.05 60.63 2fhf n THR 185 Cb 0.43 0.56 -0.13 0.00 -2.10 0.00 0.00 70.33 69.09 2fhf n THR 185 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 2fhf s THR 186 N -0.91 3.67 -0.12 4.28 2.01 -1.08 -0.73 115.64 122.77 2fhf s THR 186 Ca 0.03 -0.43 0.01 0.00 0.31 0.00 0.00 61.69 61.61 2fhf s THR 186 Cb 0.02 -2.61 0.02 0.00 0.01 0.00 0.00 72.50 69.94 2fhf s THR 186 CO 0.02 0.49 -0.13 -0.22 -0.69 0.00 0.00 174.62 174.09 2fhf s LEU 187 N 0.49 1.57 -0.30 4.42 1.98 -0.29 -2.27 118.68 124.28 2fhf s LEU 187 Ca -0.05 -0.41 -0.09 0.00 -2.89 0.00 0.00 54.13 50.69 2fhf s LEU 187 Cb -0.15 -1.05 -0.01 0.00 0.66 0.00 0.00 46.19 45.64 2fhf s LEU 187 CO 0.03 -0.05 0.13 -0.76 -1.89 0.00 0.00 176.35 173.82 2fhf s LEU 188 N 1.36 3.95 -0.22 -0.68 1.43 0.21 -0.56 118.68 124.17 2fhf s LEU 188 Ca 0.01 -0.45 -0.06 0.00 -1.03 0.00 0.00 54.13 52.59 2fhf s LEU 188 Cb -0.13 -1.98 0.11 0.00 0.03 0.00 0.00 46.19 44.21 2fhf s LEU 188 CO -0.07 -0.16 0.45 0.86 0.23 0.00 0.00 176.35 177.66 2fhf s TRP 189 N 1.61 -0.91 0.25 0.29 -0.00 -0.70 -0.44 118.94 119.05 2fhf s TRP 189 Ca 0.05 1.52 -0.06 0.00 -0.00 0.00 0.00 56.10 57.61 2fhf s TRP 189 Cb -0.17 0.33 0.29 0.00 -0.00 0.00 0.00 33.47 33.92 2fhf s TRP 189 CO 0.06 -0.56 1.91 -1.35 -0.00 0.00 0.00 176.95 177.01 2fhf h PRO 190 N 8.15 1.24 0.00 5.86 0.11 -1.81 -3.02 132.00 142.53 2fhf h PRO 190 Ca -0.17 -0.07 0.00 0.00 0.11 0.00 0.00 66.00 65.87 2fhf h PRO 190 Cb 1.12 -0.28 0.00 0.00 0.11 0.00 0.00 31.00 31.95 2fhf h PRO 190 CO 0.15 0.82 0.00 0.41 -0.21 0.00 0.00 178.00 179.17 2fhf n GLY 191 N -1.37 -0.86 0.21 -0.55 0.00 -1.26 -2.17 105.19 99.20 2fhf n GLY 191 Ca 0.12 0.12 0.12 0.00 0.00 0.00 0.00 46.02 46.38 2fhf n GLY 191 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2fhf n GLY 192 N -1.06 -0.67 3.71 -0.02 0.00 -1.14 -4.84 105.19 101.17 2fhf n GLY 192 Ca -0.00 -0.48 -0.43 0.00 0.00 0.00 0.00 46.02 45.11 2fhf n GLY 192 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2fhf n GLU 193 N -0.84 2.41 -3.98 1.61 2.13 -0.92 -2.50 120.64 118.54 2fhf n GLU 193 Ca 0.09 0.86 -0.26 0.00 0.66 0.00 0.00 57.16 58.50 2fhf n GLU 193 Cb 0.37 -2.58 -0.03 0.00 0.27 0.00 0.00 31.44 29.47 2fhf n GLU 193 CO 0.00 0.00 0.00 0.09 -0.41 0.00 0.00 177.13 176.81 2fhf n ASN 194 N 2.03 -0.25 -3.84 4.31 5.03 -1.26 -4.96 115.26 116.32 2fhf n ASN 194 Ca 0.09 -1.03 -0.28 0.00 0.87 0.00 0.00 54.58 54.23 2fhf n ASN 194 Cb 0.35 -2.92 -0.16 0.00 -1.02 0.00 0.00 39.78 36.02 2fhf n ASN 194 CO 0.00 0.00 0.00 -0.75 -1.83 0.00 0.00 177.26 174.68 2fhf s LYS 195 N -6.62 1.13 0.35 3.52 2.47 -1.04 -5.03 119.74 114.51 2fhf s LYS 195 Ca 0.01 -0.52 0.16 0.00 -1.56 0.00 0.00 55.97 54.06 2fhf s LYS 195 Cb -0.00 -2.06 1.14 0.00 -1.46 0.00 0.00 37.83 35.45 2fhf s LYS 195 CO 0.90 -0.52 1.64 -1.35 0.16 0.00 0.00 175.35 176.18 2fhf h PRO 196 N 8.15 0.23 -4.98 4.03 0.11 -1.89 -3.37 132.00 134.28 2fhf h PRO 196 Ca -0.20 -0.01 -0.67 0.00 0.11 0.00 0.00 66.00 65.23 2fhf h PRO 196 Cb 1.11 -0.05 -0.35 0.00 0.11 0.00 0.00 31.00 31.82 2fhf h PRO 196 CO 0.37 0.15 -0.82 0.42 -0.21 0.00 0.00 178.00 177.91 2fhf s ILE 197 N -5.64 2.28 -0.16 4.15 1.01 -0.74 -4.93 121.20 117.16 2fhf s ILE 197 Ca -0.10 -1.12 -0.00 0.00 0.00 0.00 0.00 60.65 59.43 2fhf s ILE 197 Cb 0.31 -2.10 0.04 0.00 0.01 0.00 0.00 42.46 40.72 2fhf s ILE 197 CO 0.79 0.33 -0.06 -0.69 0.00 0.00 0.00 174.94 175.30 2fhf s VAL 198 N 1.25 1.18 0.11 2.92 1.01 -1.26 -0.93 120.40 124.69 2fhf s VAL 198 Ca 0.01 -0.64 0.02 0.00 0.00 0.00 0.00 61.98 61.36 2fhf s VAL 198 Cb -0.15 -1.32 -0.04 0.00 0.00 0.00 0.00 36.38 34.86 2fhf s VAL 198 CO -0.09 0.17 -0.07 -0.13 0.00 0.00 0.00 175.10 174.98 2fhf s ARG 199 N 1.61 0.88 -0.38 2.72 0.52 -0.08 -1.34 118.95 122.87 2fhf s ARG 199 Ca 0.01 -1.36 0.01 0.00 -0.52 0.00 0.00 55.73 53.87 2fhf s ARG 199 Cb -0.15 -0.27 0.11 0.00 0.52 0.00 0.00 34.95 35.16 2fhf s ARG 199 CO -0.08 -0.01 0.13 -1.17 0.02 0.00 0.00 175.30 174.19 2fhf s LEU 200 N -3.07 4.97 0.38 2.53 2.96 -0.41 -0.86 118.68 125.20 2fhf s LEU 200 Ca 0.13 -2.15 -0.19 0.00 -0.22 0.00 0.00 54.13 51.70 2fhf s LEU 200 Cb 0.05 -1.72 -0.10 0.00 0.50 0.00 0.00 46.19 44.92 2fhf s LEU 200 CO -0.04 -0.44 0.87 -0.31 -1.32 0.00 0.00 176.35 175.11 2fhf s TYR 201 N 0.94 3.35 -0.04 5.38 1.51 0.25 -1.67 117.35 127.06 2fhf s TYR 201 Ca 0.10 1.48 -0.10 0.00 -1.01 0.00 0.00 57.07 57.54 2fhf s TYR 201 Cb -0.21 -2.74 0.02 0.00 -0.11 0.00 0.00 41.96 38.92 2fhf s TYR 201 CO -0.06 -0.02 0.24 1.52 -1.11 0.00 0.00 175.55 176.12 2fhf s TYR 202 N -2.08 -0.16 -0.03 2.71 -0.85 -0.55 -0.54 117.35 115.86 2fhf s TYR 202 Ca 0.58 0.33 -0.01 0.00 -0.52 0.00 0.00 57.07 57.45 2fhf s TYR 202 Cb -0.10 0.06 0.03 0.00 0.38 0.00 0.00 41.96 42.33 2fhf s TYR 202 CO 0.15 -0.26 0.04 0.45 -1.52 0.00 0.00 175.55 174.42 2fhf s SER 203 N -0.76 0.47 0.04 -0.18 0.15 -0.68 -4.02 113.70 108.71 2fhf s SER 203 Ca -0.08 0.06 -0.24 0.00 0.70 0.00 0.00 55.95 56.39 2fhf s SER 203 Cb -0.05 -0.09 -0.17 0.00 -1.71 0.00 0.00 66.02 64.01 2fhf s SER 203 CO 0.02 -0.18 1.50 -0.74 1.20 0.00 0.00 173.24 175.04 2fhf h HIS 204 N 7.73 0.04 0.00 3.44 2.76 -1.93 -1.70 115.15 125.50 2fhf h HIS 204 Ca -0.33 -0.01 0.00 0.00 -2.20 0.00 0.00 60.37 57.83 2fhf h HIS 204 Cb 1.12 -0.01 0.00 0.00 1.55 0.00 0.00 27.41 30.07 2fhf h HIS 204 CO 0.50 0.28 0.00 0.43 -1.30 0.00 0.00 177.93 177.84 2fhf n SER 205 N -4.94 1.22 -4.48 3.26 7.64 -1.26 -4.41 113.62 110.65 2fhf n SER 205 Ca -0.07 -1.29 -0.23 0.00 1.01 0.00 0.00 58.87 58.28 2fhf n SER 205 Cb 0.15 0.00 -0.10 0.00 -1.01 0.00 0.00 64.21 63.25 2fhf n SER 205 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 2fhf s SER 206 N -0.29 3.18 -0.07 6.43 0.01 -1.26 -4.86 113.70 116.84 2fhf s SER 206 Ca 0.00 -1.20 -0.19 0.00 1.31 0.00 0.00 55.95 55.87 2fhf s SER 206 Cb 0.00 -0.25 -0.04 0.00 0.21 0.00 0.00 66.02 65.94 2fhf s SER 206 CO 0.00 -0.29 0.54 -0.75 0.41 0.00 0.00 173.24 173.15 2fhf s LYS 207 N -3.68 4.33 -0.12 12.44 2.20 -1.26 -4.56 119.74 129.09 2fhf s LYS 207 Ca 0.31 0.59 -0.29 0.00 -0.36 0.00 0.00 55.97 56.21 2fhf s LYS 207 Cb 0.03 -3.40 -0.03 0.00 -1.51 0.00 0.00 37.83 32.92 2fhf s LYS 207 CO 0.14 0.22 1.30 0.08 -0.36 0.00 0.00 175.35 176.74 2fhf s VAL 208 N 0.36 4.16 -0.13 4.02 1.01 -1.26 -4.98 120.40 123.57 2fhf s VAL 208 Ca 0.29 1.43 -0.30 0.00 0.00 0.00 0.00 61.98 63.40 2fhf s VAL 208 Cb -0.16 -3.92 0.10 0.00 0.00 0.00 0.00 36.38 32.39 2fhf s VAL 208 CO 0.13 -0.09 0.86 0.00 0.00 0.00 0.00 175.10 176.00 2fhf s ALA 209 N 3.21 -1.86 0.36 5.51 0.00 -1.26 -4.89 121.76 122.83 2fhf s ALA 209 Ca 0.58 1.53 -0.28 0.00 0.00 0.00 0.00 51.96 53.78 2fhf s ALA 209 Cb -0.24 -0.50 -0.11 0.00 0.00 0.00 0.00 23.12 22.26 2fhf s ALA 209 CO 0.18 -0.33 1.52 0.00 0.00 0.00 0.00 175.76 177.13 2fhf s ALA 210 N -0.96 3.62 1.02 0.00 0.00 -1.26 -4.77 121.76 119.41 2fhf s ALA 210 Ca -0.05 1.59 -0.07 0.00 0.00 0.00 0.00 51.96 53.42 2fhf s ALA 210 Cb -0.01 -3.62 0.10 0.00 0.00 0.00 0.00 23.12 19.59 2fhf s ALA 210 CO 0.04 -1.06 0.53 -0.40 0.00 0.00 0.00 175.76 174.88 2fhf n ASP 211 N 0.85 -0.32 0.28 0.00 5.68 0.23 -4.80 116.55 118.47 2fhf n ASP 211 Ca 0.03 -1.10 0.12 0.00 -0.50 0.00 0.00 54.79 53.34 2fhf n ASP 211 Cb 0.39 -0.42 0.81 0.00 -1.14 0.00 0.00 41.12 40.75 2fhf n ASP 211 CO 0.00 0.00 0.00 0.77 -1.33 0.00 0.00 177.20 176.64 2fhf h SER 212 N -0.97 0.00 -0.00 -1.12 4.64 -1.95 0.11 113.55 114.26 2fhf h SER 212 Ca -0.18 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.14 2fhf h SER 212 Cb 0.50 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.59 2fhf h SER 212 CO 0.12 0.00 0.00 0.59 -0.87 0.00 0.00 176.83 176.67 2fhf n ASN 213 N -4.12 0.43 -0.31 4.97 5.03 -1.26 -4.87 115.26 115.12 2fhf n ASN 213 Ca -0.03 -1.15 -0.04 0.00 0.87 0.00 0.00 54.58 54.23 2fhf n ASN 213 Cb 0.09 -0.00 -0.01 0.00 -1.02 0.00 0.00 39.78 38.83 2fhf n ASN 213 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2fhf n GLY 214 N 1.05 0.63 3.61 7.41 0.00 0.38 -4.91 105.19 113.36 2fhf n GLY 214 Ca 0.22 -0.88 -0.25 0.00 0.00 0.00 0.00 46.02 45.12 2fhf n GLY 214 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2fhf s GLU 215 N -2.54 2.18 -0.58 1.61 2.02 -1.26 -1.47 118.70 118.68 2fhf s GLU 215 Ca 0.00 -1.34 -0.09 0.00 0.02 0.00 0.00 54.97 53.56 2fhf s GLU 215 Cb 0.00 -2.16 0.15 0.00 0.10 0.00 0.00 34.13 32.21 2fhf s GLU 215 CO 0.00 0.40 0.46 -0.06 0.02 0.00 0.00 175.26 176.08 2fhf s PHE 216 N -2.02 3.48 -0.79 1.61 0.40 -0.96 0.76 117.98 120.46 2fhf s PHE 216 Ca 0.28 -2.02 0.27 0.00 -0.60 0.00 0.00 56.93 54.85 2fhf s PHE 216 Cb -0.08 -3.53 0.85 0.00 0.51 0.00 0.00 43.02 40.78 2fhf s PHE 216 CO 0.18 -0.97 1.75 0.43 0.70 0.00 0.00 175.22 177.31 2fhf n SER 217 N 4.47 0.61 -4.60 1.36 7.64 -1.26 -4.72 113.62 117.12 2fhf n SER 217 Ca -0.01 0.49 -0.32 0.00 1.01 0.00 0.00 58.87 60.03 2fhf n SER 217 Cb 0.41 -0.60 0.14 0.00 -1.01 0.00 0.00 64.21 63.16 2fhf n SER 217 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 2fhf n ASP 218 N -2.05 -0.22 -4.81 6.43 10.43 -1.26 -4.98 116.55 120.09 2fhf n ASP 218 Ca 0.06 0.44 -0.32 0.00 2.57 0.00 0.00 54.79 57.54 2fhf n ASP 218 Cb 0.41 -1.40 0.03 0.00 1.84 0.00 0.00 41.12 42.00 2fhf n ASP 218 CO 0.00 0.00 0.00 -0.54 -1.07 0.00 0.00 177.20 175.59 2fhf s LYS 219 N -4.16 3.07 0.34 -1.24 1.02 -1.26 -4.91 119.74 112.61 2fhf s LYS 219 Ca 0.66 1.08 -0.13 0.00 0.02 0.00 0.00 55.97 57.59 2fhf s LYS 219 Cb -0.25 -2.00 0.03 0.00 -0.52 0.00 0.00 37.83 35.09 2fhf s LYS 219 CO 0.59 -1.00 0.67 1.52 -0.92 0.00 0.00 175.35 176.21 2fhf s TYR 220 N -2.78 0.31 -0.01 3.18 1.13 -1.26 -1.48 117.35 116.44 2fhf s TYR 220 Ca 0.61 -0.81 0.03 0.00 -1.41 0.00 0.00 57.07 55.48 2fhf s TYR 220 Cb -0.15 0.53 -0.01 0.00 -1.10 0.00 0.00 41.96 41.23 2fhf s TYR 220 CO 0.47 -1.35 -0.10 0.08 -2.51 0.00 0.00 175.55 172.14 2fhf s VAL 221 N -2.96 0.81 0.29 -3.49 1.01 -0.67 -4.97 120.40 110.42 2fhf s VAL 221 Ca 0.19 -0.42 -0.28 0.00 0.00 0.00 0.00 61.98 61.46 2fhf s VAL 221 Cb -0.04 -0.69 -0.09 0.00 0.00 0.00 0.00 36.38 35.56 2fhf s VAL 221 CO 0.12 0.24 1.04 -0.54 0.00 0.00 0.00 175.10 175.96 2fhf s LYS 222 N -0.13 4.61 0.10 2.72 1.02 -1.26 -1.28 119.74 125.52 2fhf s LYS 222 Ca 0.02 1.63 0.08 0.00 0.02 0.00 0.00 55.97 57.72 2fhf s LYS 222 Cb -0.05 -3.07 -0.04 0.00 -0.52 0.00 0.00 37.83 34.15 2fhf s LYS 222 CO -0.00 0.23 -0.14 -0.51 -0.92 0.00 0.00 175.35 174.01 2fhf s LEU 223 N -1.64 2.85 -0.00 3.17 1.43 -0.45 -4.35 118.68 119.69 2fhf s LEU 223 Ca 0.46 -0.47 0.01 0.00 -1.03 0.00 0.00 54.13 53.11 2fhf s LEU 223 Cb -0.28 -1.67 -0.00 0.00 0.03 0.00 0.00 46.19 44.27 2fhf s LEU 223 CO 0.35 0.18 -0.05 0.42 0.23 0.00 0.00 176.35 177.49 2fhf s THR 224 N -1.16 0.36 0.24 5.49 -4.23 -0.90 -4.58 115.64 110.86 2fhf s THR 224 Ca 0.19 -0.25 -0.31 0.00 -1.18 0.00 0.00 61.69 60.14 2fhf s THR 224 Cb -0.11 -0.32 -0.13 0.00 1.34 0.00 0.00 72.50 73.28 2fhf s THR 224 CO 0.11 0.07 1.38 -2.65 -0.54 0.00 0.00 174.62 173.00 2fhf n PRO 225 N 2.88 1.98 -2.96 3.99 -0.02 -1.26 0.54 135.00 140.14 2fhf n PRO 225 Ca -0.13 0.70 -0.09 0.00 -2.02 0.00 0.00 63.50 61.96 2fhf n PRO 225 Cb 0.58 -2.35 -0.02 0.00 -0.02 0.00 0.00 33.50 31.69 2fhf n PRO 225 CO 0.00 0.00 0.00 -2.37 1.98 0.00 0.00 175.50 175.11 2fhf n THR 226 N 1.81 0.00 -4.54 3.45 5.66 -0.83 -4.74 114.28 115.08 2fhf n THR 226 Ca 0.11 -1.05 -0.33 0.00 -3.05 0.00 0.00 64.05 59.73 2fhf n THR 226 Cb 0.31 0.61 -0.16 0.00 -1.55 0.00 0.00 70.33 69.54 2fhf n THR 226 CO 0.00 0.00 0.00 0.42 -3.05 0.00 0.00 175.07 172.44 2fhf s THR 227 N -2.66 2.27 0.12 1.09 -4.23 -1.26 -4.25 115.64 106.72 2fhf s THR 227 Ca 0.17 -0.90 -0.35 0.00 -1.18 0.00 0.00 61.69 59.43 2fhf s THR 227 Cb -0.00 -1.93 -0.16 0.00 1.34 0.00 0.00 72.50 71.74 2fhf s THR 227 CO 0.12 0.53 1.36 0.55 -0.54 0.00 0.00 174.62 176.65 2fhf n VAL 228 N 4.15 0.16 -1.73 2.29 3.14 -1.26 -4.94 118.33 120.14 2fhf n VAL 228 Ca -0.20 -0.04 -0.30 0.00 -2.96 0.00 0.00 64.34 60.84 2fhf n VAL 228 Cb 0.51 -0.97 0.05 0.00 -1.06 0.00 0.00 33.84 32.38 2fhf n VAL 228 CO 0.00 0.00 0.00 0.54 -6.46 0.00 0.00 176.83 170.91 2fhf s ASN 229 N 0.48 5.30 0.44 6.55 6.03 -1.26 -4.89 114.94 127.58 2fhf s ASN 229 Ca 0.81 1.32 0.11 0.00 -1.03 0.00 0.00 52.86 54.07 2fhf s ASN 229 Cb -0.88 -2.16 0.96 0.00 -3.03 0.00 0.00 41.25 36.14 2fhf s ASN 229 CO 0.46 -1.46 2.03 -0.61 -2.03 0.00 0.00 177.10 175.49 2fhf h GLN 230 N -0.73 0.25 0.66 3.55 4.15 -1.98 -1.74 115.11 119.26 2fhf h GLN 230 Ca -0.45 -0.03 -0.03 0.00 0.77 0.00 0.00 58.65 58.91 2fhf h GLN 230 Cb 1.24 -0.05 -0.01 0.00 0.21 0.00 0.00 27.48 28.87 2fhf h GLN 230 CO 0.61 0.25 -0.42 1.96 -1.93 0.00 0.00 178.83 179.30 2fhf h GLN 231 N 0.25 -0.99 -0.35 1.69 7.50 -2.00 -0.28 115.11 120.93 2fhf h GLN 231 Ca 0.06 0.07 -0.05 0.00 0.50 0.00 0.00 58.65 59.23 2fhf h GLN 231 Cb 0.13 0.22 -0.02 0.00 0.05 0.00 0.00 27.48 27.86 2fhf h GLN 231 CO -0.00 -0.66 0.02 0.28 -1.50 0.00 0.00 178.83 176.97 2fhf h VAL 232 N -1.02 1.19 -0.44 -0.54 2.07 -1.91 -1.95 116.25 113.65 2fhf h VAL 232 Ca -0.08 -0.76 -0.01 0.00 0.82 0.00 0.00 66.70 66.67 2fhf h VAL 232 Cb 0.83 0.91 -0.02 0.00 -1.52 0.00 0.00 31.29 31.49 2fhf h VAL 232 CO 0.08 0.26 0.24 -1.28 0.02 0.00 0.00 177.57 176.89 2fhf h SER 233 N 0.52 0.55 -0.05 0.57 0.87 -1.05 0.03 113.55 115.00 2fhf h SER 233 Ca 0.11 -0.09 -0.14 0.00 -1.23 0.00 0.00 61.79 60.44 2fhf h SER 233 Cb 0.31 -0.14 -0.01 0.00 -0.44 0.00 0.00 62.40 62.12 2fhf h SER 233 CO 0.01 0.49 -0.41 0.24 -0.53 0.00 0.00 176.83 176.62 2fhf h MET 234 N 0.58 0.57 -0.32 2.24 2.86 -0.76 -2.38 114.93 117.72 2fhf h MET 234 Ca 0.16 -0.30 -0.12 0.00 -2.06 0.00 0.00 59.70 57.38 2fhf h MET 234 Cb 0.06 0.01 -0.01 0.00 0.06 0.00 0.00 31.60 31.72 2fhf h MET 234 CO -0.02 0.89 -0.27 0.00 1.06 0.00 0.00 176.91 178.56 2fhf h ARG 235 N 0.47 0.75 -2.33 1.72 3.08 -1.11 -3.38 114.38 113.58 2fhf h ARG 235 Ca 0.04 -0.38 -0.59 0.00 0.07 0.00 0.00 59.98 59.12 2fhf h ARG 235 Cb 0.92 0.01 -0.40 0.00 0.08 0.00 0.00 29.97 30.58 2fhf h ARG 235 CO 0.08 1.00 -0.85 1.19 -1.07 0.00 0.00 179.97 180.32 2fhf n PHE 236 N -4.24 1.20 -0.12 3.04 3.01 -0.02 -4.95 117.46 115.37 2fhf n PHE 236 Ca -0.03 -3.79 0.18 0.00 1.01 0.00 0.00 57.45 54.82 2fhf n PHE 236 Cb 0.47 -0.31 0.58 0.00 -0.01 0.00 0.00 39.48 40.21 2fhf n PHE 236 CO 0.00 0.00 0.00 -1.35 1.01 0.00 0.00 176.76 176.42 2fhf h PRO 237 N 4.67 0.24 0.00 -1.08 0.11 -1.62 -1.09 132.00 133.24 2fhf h PRO 237 Ca 0.16 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.26 2fhf h PRO 237 Cb 0.81 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 31.86 2fhf h PRO 237 CO 0.58 0.16 0.00 -2.39 -0.21 0.00 0.00 178.00 176.14 2fhf n HIS 238 N -4.43 0.00 0.20 0.65 1.44 -1.11 -2.80 115.22 109.16 2fhf n HIS 238 Ca 0.14 0.00 0.02 0.00 -2.01 0.00 0.00 57.72 55.87 2fhf n HIS 238 Cb 0.60 -0.47 0.01 0.00 0.12 0.00 0.00 29.99 30.25 2fhf n HIS 238 CO 0.00 0.00 0.00 1.28 -2.81 0.00 0.00 176.34 174.81 2fhf n LEU 239 N -1.47 1.06 0.26 2.39 4.77 -0.43 -4.71 117.00 118.87 2fhf n LEU 239 Ca 0.05 -0.86 0.18 0.00 -0.03 0.00 0.00 56.01 55.35 2fhf n LEU 239 Cb 0.22 0.00 0.87 0.00 -2.33 0.00 0.00 43.42 42.18 2fhf n LEU 239 CO 0.18 0.23 1.15 0.00 -1.33 0.00 0.00 177.39 177.62 2fhf h ALA 240 N 0.84 1.53 -0.14 -1.18 0.00 -1.32 -0.86 119.26 118.13 2fhf h ALA 240 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2fhf h ALA 240 Cb 0.17 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.97 2fhf h ALA 240 CO 0.00 -0.33 0.00 -1.13 0.00 0.00 0.00 179.25 177.79 2fhf n SER 241 N -3.28 2.50 -4.78 0.00 3.41 -1.26 -4.94 113.62 105.25 2fhf n SER 241 Ca 0.00 -1.82 -0.36 0.00 -0.26 0.00 0.00 58.87 56.43 2fhf n SER 241 Cb 0.36 -0.08 -0.05 0.00 -0.26 0.00 0.00 64.21 64.18 2fhf n SER 241 CO 0.00 0.00 0.00 -0.31 -0.16 0.00 0.00 175.04 174.57 2fhf s TYR 242 N -1.84 3.33 0.22 7.33 4.12 -0.33 -4.98 117.35 125.20 2fhf s TYR 242 Ca 0.34 1.66 -0.31 0.00 0.02 0.00 0.00 57.07 58.77 2fhf s TYR 242 Cb 0.20 -3.08 -0.11 0.00 -1.52 0.00 0.00 41.96 37.45 2fhf s TYR 242 CO 0.31 -0.47 1.66 -2.14 0.02 0.00 0.00 175.55 174.92 2fhf s PRO 243 N -2.50 4.15 0.01 -1.71 0.02 -1.26 -4.82 135.00 128.89 2fhf s PRO 243 Ca 0.57 2.54 -0.05 0.00 0.02 0.00 0.00 61.00 64.08 2fhf s PRO 243 Cb -0.20 -3.08 -0.04 0.00 0.02 0.00 0.00 34.50 31.19 2fhf s PRO 243 CO 0.26 -0.69 0.24 0.00 -0.33 0.00 0.00 177.00 176.47 2fhf s ALA 244 N 0.93 3.89 0.00 -1.55 0.00 -1.26 -1.73 121.76 122.04 2fhf s ALA 244 Ca 0.71 -0.65 0.03 0.00 0.00 0.00 0.00 51.96 52.05 2fhf s ALA 244 Cb -0.48 -2.00 -0.01 0.00 0.00 0.00 0.00 23.12 20.63 2fhf s ALA 244 CO 0.35 0.69 -0.10 -0.06 0.00 0.00 0.00 175.76 176.64 2fhf s PHE 245 N -1.32 0.85 -0.16 0.00 0.08 0.27 -1.97 117.98 115.73 2fhf s PHE 245 Ca 0.28 -0.21 -0.05 0.00 0.12 0.00 0.00 56.93 57.07 2fhf s PHE 245 Cb -0.13 -0.53 -0.03 0.00 -0.57 0.00 0.00 43.02 41.75 2fhf s PHE 245 CO 0.17 -0.01 0.00 0.21 -0.10 0.00 0.00 175.22 175.49 2fhf s LYS 246 N -0.44 3.75 0.24 0.44 2.36 0.19 -1.14 119.74 125.14 2fhf s LYS 246 Ca 0.02 -0.44 -0.04 0.00 -2.55 0.00 0.00 55.97 52.95 2fhf s LYS 246 Cb -0.05 -3.02 -0.05 0.00 -1.05 0.00 0.00 37.83 33.66 2fhf s LYS 246 CO -0.00 0.29 0.49 -0.51 1.55 0.00 0.00 175.35 177.16 2fhf s LEU 247 N 0.27 4.14 0.52 5.43 1.43 0.09 -2.12 118.68 128.45 2fhf s LEU 247 Ca -0.00 0.65 -0.23 0.00 -1.03 0.00 0.00 54.13 53.52 2fhf s LEU 247 Cb -0.13 -3.43 -0.06 0.00 0.03 0.00 0.00 46.19 42.60 2fhf s LEU 247 CO 0.02 -0.11 1.35 -2.16 0.23 0.00 0.00 176.35 175.68 2fhf s PRO 248 N -3.26 3.32 0.56 1.29 0.04 -1.26 -4.82 135.00 130.86 2fhf s PRO 248 Ca 0.43 2.22 0.32 0.00 0.04 0.00 0.00 61.00 64.01 2fhf s PRO 248 Cb -0.11 -2.36 1.67 0.00 0.04 0.00 0.00 34.50 33.74 2fhf s PRO 248 CO 0.28 -1.05 2.14 -0.44 0.04 0.00 0.00 177.00 177.97 2fhf h ASP 249 N 1.70 0.00 -0.24 6.66 5.19 -1.97 -1.96 116.42 125.80 2fhf h ASP 249 Ca -0.51 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 55.90 2fhf h ASP 249 Cb 1.29 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.80 2fhf h ASP 249 CO 0.58 0.07 0.00 -0.90 -3.12 0.00 0.00 179.24 175.87 2fhf n ASP 250 N -3.48 1.41 -4.75 6.45 3.85 -1.26 -4.93 116.55 113.83 2fhf n ASP 250 Ca -0.02 -1.93 -0.41 0.00 -0.71 0.00 0.00 54.79 51.72 2fhf n ASP 250 Cb 0.20 -0.16 -0.01 0.00 -1.35 0.00 0.00 41.12 39.79 2fhf n ASP 250 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.20 176.73 2fhf s VAL 251 N -1.68 2.09 -1.23 2.12 0.11 -0.74 -4.90 120.40 116.17 2fhf s VAL 251 Ca 0.20 0.08 -0.12 0.00 -2.93 0.00 0.00 61.98 59.21 2fhf s VAL 251 Cb 0.11 -3.05 0.17 0.00 -1.53 0.00 0.00 36.38 32.08 2fhf s VAL 251 CO 0.15 0.01 1.57 -3.20 -3.33 0.00 0.00 175.10 170.30 2fhf n ASN 252 N 2.05 5.19 -0.23 3.54 4.05 -1.26 -4.84 115.26 123.75 2fhf n ASN 252 Ca 0.08 -3.02 0.03 0.00 0.45 0.00 0.00 54.58 52.12 2fhf n ASN 252 Cb 0.38 -1.54 0.15 0.00 1.23 0.00 0.00 39.78 40.00 2fhf n ASN 252 CO 0.00 0.00 0.00 -0.37 -3.05 0.00 0.00 177.26 173.84 2fhf h VAL 253 N 4.36 0.61 -0.51 3.44 -1.51 -1.93 -2.37 116.25 118.34 2fhf h VAL 253 Ca 0.34 -0.11 0.08 0.00 -1.23 0.00 0.00 66.70 65.78 2fhf h VAL 253 Cb 0.80 0.26 -0.06 0.00 -2.13 0.00 0.00 31.29 30.15 2fhf h VAL 253 CO 1.36 0.06 0.15 -0.78 -1.23 0.00 0.00 177.57 177.13 2fhf h ASP 254 N 0.33 0.11 -0.37 4.19 3.58 -1.98 -1.01 116.42 121.26 2fhf h ASP 254 Ca 0.37 0.07 -0.07 0.00 0.42 0.00 0.00 57.03 57.83 2fhf h ASP 254 Cb 0.58 0.08 -0.01 0.00 1.72 0.00 0.00 39.33 41.70 2fhf h ASP 254 CO -0.43 0.09 -0.03 -0.08 -2.88 0.00 0.00 179.24 175.90 2fhf h GLU 255 N 0.31 0.68 -0.26 0.28 4.57 -1.86 -2.98 114.58 115.32 2fhf h GLU 255 Ca 0.25 -0.23 -0.05 0.00 -1.18 0.00 0.00 59.36 58.15 2fhf h GLU 255 Cb 0.30 -0.05 -0.01 0.00 -0.16 0.00 0.00 28.75 28.83 2fhf h GLU 255 CO -0.28 0.80 -0.04 -0.07 -1.18 0.00 0.00 179.01 178.24 2fhf h LEU 256 N 0.49 0.37 0.00 1.64 4.07 -1.14 -2.07 115.31 118.67 2fhf h LEU 256 Ca 0.10 -0.07 0.00 0.00 0.08 0.00 0.00 57.88 57.99 2fhf h LEU 256 Cb 0.51 -0.10 0.00 0.00 1.08 0.00 0.00 40.66 42.16 2fhf h LEU 256 CO 0.03 0.47 0.00 0.18 -1.08 0.00 0.00 178.44 178.03 2fhf n LEU 257 N -4.29 0.00 0.15 1.67 4.77 -0.41 -2.87 117.00 116.01 2fhf n LEU 257 Ca 0.01 0.45 0.13 0.00 -0.03 0.00 0.00 56.01 56.57 2fhf n LEU 257 Cb 0.24 -0.45 0.39 0.00 -2.33 0.00 0.00 43.42 41.27 2fhf n LEU 257 CO 0.38 -0.13 0.87 1.56 -1.33 0.00 0.00 177.39 178.74 2fhf h GLN 258 N 0.00 0.00 0.00 3.23 1.08 -1.26 -3.43 115.11 114.73 2fhf h GLN 258 Ca 0.00 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 2fhf h GLN 258 Cb 0.32 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.75 2fhf h GLN 258 CO 0.00 0.00 0.00 0.41 -0.95 0.00 0.00 178.83 178.29 2fhf n GLY 259 N 0.91 5.41 3.84 3.46 0.00 -1.14 -4.60 105.19 113.07 2fhf n GLY 259 Ca 0.04 -1.21 -0.35 0.00 0.00 0.00 0.00 46.02 44.50 2fhf n GLY 259 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2fhf s GLU 260 N 1.86 4.07 -0.02 1.61 2.12 -0.64 -4.95 118.70 122.75 2fhf s GLU 260 Ca 0.00 0.62 0.03 0.00 0.36 0.00 0.00 54.97 55.98 2fhf s GLU 260 Cb 0.00 -2.87 0.00 0.00 0.26 0.00 0.00 34.13 31.52 2fhf s GLU 260 CO 0.00 0.42 -0.09 0.95 -0.54 0.00 0.00 175.26 176.00 2fhf s THR 261 N -1.53 0.77 -0.04 -1.70 -4.23 -1.26 -1.69 115.64 105.96 2fhf s THR 261 Ca 0.41 -0.37 0.01 0.00 -1.18 0.00 0.00 61.69 60.56 2fhf s THR 261 Cb -0.15 -0.68 0.02 0.00 1.34 0.00 0.00 72.50 73.03 2fhf s THR 261 CO 0.20 0.24 -0.05 -0.69 -0.54 0.00 0.00 174.62 173.78 2fhf s VAL 262 N 0.08 0.54 -0.17 2.29 1.01 0.30 -3.41 120.40 121.04 2fhf s VAL 262 Ca -0.01 -0.14 -0.22 0.00 0.00 0.00 0.00 61.98 61.61 2fhf s VAL 262 Cb -0.07 -0.56 -0.02 0.00 0.00 0.00 0.00 36.38 35.73 2fhf s VAL 262 CO 0.00 0.22 0.69 0.00 0.00 0.00 0.00 175.10 176.01 2fhf s ALA 263 N 0.82 3.50 0.01 5.51 0.00 -0.28 -0.58 121.76 130.73 2fhf s ALA 263 Ca -0.11 -0.13 0.06 0.00 0.00 0.00 0.00 51.96 51.79 2fhf s ALA 263 Cb -0.14 -3.02 -0.02 0.00 0.00 0.00 0.00 23.12 19.94 2fhf s ALA 263 CO 0.00 -0.49 -0.20 0.42 0.00 0.00 0.00 175.76 175.50 2fhf s ILE 264 N 1.75 1.59 0.03 0.00 1.01 -0.04 -1.01 121.20 124.53 2fhf s ILE 264 Ca 0.32 -0.97 0.04 0.00 0.00 0.00 0.00 60.65 60.04 2fhf s ILE 264 Cb -0.16 -1.34 -0.02 0.00 0.01 0.00 0.00 42.46 40.94 2fhf s ILE 264 CO 0.12 0.35 -0.13 0.00 0.00 0.00 0.00 174.94 175.28 2fhf s ALA 265 N -0.59 1.06 0.22 9.38 0.00 -0.35 -0.91 121.76 130.57 2fhf s ALA 265 Ca 0.07 -0.77 -0.13 0.00 0.00 0.00 0.00 51.96 51.14 2fhf s ALA 265 Cb -0.08 -0.16 0.00 0.00 0.00 0.00 0.00 23.12 22.88 2fhf s ALA 265 CO 0.00 0.19 0.46 0.00 0.00 0.00 0.00 175.76 176.41 2fhf s ALA 266 N -0.82 -0.37 0.70 0.00 0.00 -0.10 -0.03 121.76 121.13 2fhf s ALA 266 Ca 0.01 -0.72 -0.11 0.00 0.00 0.00 0.00 51.96 51.13 2fhf s ALA 266 Cb -0.07 0.98 0.01 0.00 0.00 0.00 0.00 23.12 24.04 2fhf s ALA 266 CO 0.01 -0.81 1.09 -1.21 0.00 0.00 0.00 175.76 174.84 2fhf s GLU 267 N -3.97 2.89 0.56 0.00 0.41 -0.15 -1.79 118.70 116.64 2fhf s GLU 267 Ca 0.18 0.45 0.31 0.00 -0.41 0.00 0.00 54.97 55.50 2fhf s GLU 267 Cb -0.00 -2.04 1.46 0.00 -1.78 0.00 0.00 34.13 31.77 2fhf s GLU 267 CO 0.05 -1.00 1.83 0.66 -0.49 0.00 0.00 175.26 176.30 2fhf h SER 268 N -0.62 0.00 -0.03 -0.19 4.64 -1.92 0.31 113.55 115.75 2fhf h SER 268 Ca -0.45 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.87 2fhf h SER 268 Cb 1.25 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.34 2fhf h SER 268 CO 0.64 0.00 0.00 -0.90 -0.87 0.00 0.00 176.83 175.70 2fhf n ASP 269 N -3.96 0.68 0.00 4.97 5.68 -1.26 -4.91 116.55 117.74 2fhf n ASP 269 Ca 0.17 -1.34 0.00 0.00 -0.50 0.00 0.00 54.79 53.11 2fhf n ASP 269 Cb 0.96 -0.02 0.00 0.00 -1.14 0.00 0.00 41.12 40.93 2fhf n ASP 269 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2fhf n GLY 270 N 1.02 0.80 3.68 6.12 0.00 0.11 -4.97 105.19 111.94 2fhf n GLY 270 Ca 0.19 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.79 2fhf n GLY 270 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2fhf s ILE 271 N -2.71 4.64 0.34 -0.61 1.01 -1.25 -1.19 121.20 121.43 2fhf s ILE 271 Ca 0.00 1.93 -0.29 0.00 0.00 0.00 0.00 60.65 62.30 2fhf s ILE 271 Cb 0.00 -4.24 -0.11 0.00 0.01 0.00 0.00 42.46 38.11 2fhf s ILE 271 CO 0.00 -0.05 1.54 -0.22 0.00 0.00 0.00 174.94 176.21 2fhf s LEU 272 N 2.45 4.33 -0.19 2.97 0.20 0.06 -0.98 118.68 127.51 2fhf s LEU 272 Ca 0.49 3.02 0.04 0.00 0.69 0.00 0.00 54.13 58.37 2fhf s LEU 272 Cb -0.19 -3.65 -0.14 0.00 -0.43 0.00 0.00 46.19 41.78 2fhf s LEU 272 CO 0.15 -0.90 -0.14 -1.54 -0.29 0.00 0.00 176.35 173.63 2fhf n SER 273 N 1.22 2.23 -3.58 3.68 3.41 0.96 -4.78 113.62 116.76 2fhf n SER 273 Ca 0.04 -0.09 -0.05 0.00 -0.26 0.00 0.00 58.87 58.52 2fhf n SER 273 Cb 0.38 -0.11 -0.02 0.00 -0.26 0.00 0.00 64.21 64.21 2fhf n SER 273 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2fhf s SER 274 N -5.75 -0.18 -0.17 4.04 1.04 -1.11 -4.94 113.70 106.62 2fhf s SER 274 Ca -0.23 -0.03 -0.12 0.00 0.48 0.00 0.00 55.95 56.05 2fhf s SER 274 Cb 0.06 0.21 0.05 0.00 0.10 0.00 0.00 66.02 66.45 2fhf s SER 274 CO 0.49 -0.35 0.44 0.00 0.98 0.00 0.00 173.24 174.80 2fhf s ALA 275 N -2.61 -1.11 0.11 5.32 0.00 -1.26 -1.21 121.76 121.00 2fhf s ALA 275 Ca 0.09 1.49 -0.01 0.00 0.00 0.00 0.00 51.96 53.52 2fhf s ALA 275 Cb -0.00 -0.89 -0.04 0.00 0.00 0.00 0.00 23.12 22.19 2fhf s ALA 275 CO -0.05 -0.25 0.04 -0.08 0.00 0.00 0.00 175.76 175.41 2fhf s THR 276 N 1.03 0.14 0.69 0.00 -1.32 -0.18 -0.91 115.64 115.09 2fhf s THR 276 Ca -0.06 -1.85 -0.11 0.00 -1.21 0.00 0.00 61.69 58.45 2fhf s THR 276 Cb -0.06 -1.87 0.01 0.00 -1.51 0.00 0.00 72.50 69.07 2fhf s THR 276 CO -0.09 -0.63 1.07 -1.10 -2.21 0.00 0.00 174.62 171.66 2fhf s GLN 277 N -4.00 2.98 -0.13 7.08 -0.21 -1.00 -1.13 119.66 123.26 2fhf s GLN 277 Ca 0.18 0.71 -0.00 0.00 0.02 0.00 0.00 55.36 56.27 2fhf s GLN 277 Cb 0.07 -2.01 -0.02 0.00 1.00 0.00 0.00 33.01 32.05 2fhf s GLN 277 CO -0.02 -1.01 -0.13 0.08 -2.12 0.00 0.00 175.29 172.09 2fhf s VAL 278 N -3.19 3.07 -0.27 1.09 1.01 -1.22 -3.41 120.40 117.48 2fhf s VAL 278 Ca 0.58 -0.66 -0.19 0.00 0.00 0.00 0.00 61.98 61.71 2fhf s VAL 278 Cb -0.12 -2.29 -0.02 0.00 0.00 0.00 0.00 36.38 33.95 2fhf s VAL 278 CO 0.54 0.53 0.57 -1.10 0.00 0.00 0.00 175.10 175.64 2fhf s GLN 279 N 0.28 4.04 0.00 2.72 -0.21 -0.14 -4.93 119.66 121.42 2fhf s GLN 279 Ca -0.10 0.38 0.17 0.00 0.02 0.00 0.00 55.36 55.84 2fhf s GLN 279 Cb -0.16 -3.67 0.44 0.00 1.00 0.00 0.00 33.01 30.62 2fhf s GLN 279 CO 0.05 -0.42 1.36 0.25 -2.12 0.00 0.00 175.29 174.42 2fhf n THR 280 N 5.22 0.83 -0.27 -0.19 -2.24 -1.26 -1.37 114.28 114.99 2fhf n THR 280 Ca -0.02 -0.91 0.04 0.00 -2.27 0.00 0.00 64.05 60.88 2fhf n THR 280 Cb 0.49 0.65 0.18 0.00 -2.10 0.00 0.00 70.33 69.55 2fhf n THR 280 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2fhf h ALA 281 N 3.34 1.12 -0.02 6.98 0.00 -1.80 -1.54 119.26 127.34 2fhf h ALA 281 Ca 0.00 0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.98 2fhf h ALA 281 Cb 0.86 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.63 2fhf h ALA 281 CO 0.00 -0.08 0.01 0.78 0.00 0.00 0.00 179.25 179.96 2fhf h GLY 282 N 0.60 0.02 2.00 0.00 0.00 -1.77 -2.17 103.07 101.75 2fhf h GLY 282 Ca 0.41 -0.01 -0.05 0.00 0.00 0.00 0.00 47.33 47.68 2fhf h GLY 282 CO -0.32 0.01 -0.23 -0.24 0.00 0.00 0.00 176.54 175.75 2fhf h VAL 283 N -0.00 0.72 -0.42 4.60 3.04 -0.67 -1.48 116.25 122.03 2fhf h VAL 283 Ca 0.01 -0.99 -0.07 0.00 -1.01 0.00 0.00 66.70 64.64 2fhf h VAL 283 Cb 0.02 1.62 -0.01 0.00 -2.01 0.00 0.00 31.29 30.91 2fhf h VAL 283 CO -0.00 0.23 -0.01 -0.07 -1.01 0.00 0.00 177.57 176.71 2fhf h LEU 284 N 0.00 0.73 -0.28 3.16 3.38 -0.86 -0.41 115.31 121.03 2fhf h LEU 284 Ca -0.00 -0.31 -0.09 0.00 0.09 0.00 0.00 57.88 57.57 2fhf h LEU 284 Cb 0.60 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 41.15 2fhf h LEU 284 CO 0.03 0.87 -0.17 0.44 0.09 0.00 0.00 178.44 179.70 2fhf h ASP 285 N 0.58 0.63 -0.16 -0.43 3.45 -1.01 0.10 116.42 119.59 2fhf h ASP 285 Ca 0.12 -0.42 -0.04 0.00 0.43 0.00 0.00 57.03 57.12 2fhf h ASP 285 Cb 0.50 -0.18 -0.01 0.00 -0.56 0.00 0.00 39.33 39.08 2fhf h ASP 285 CO 0.02 0.92 0.00 -0.78 -1.57 0.00 0.00 179.24 177.84 2fhf h ASP 286 N 0.35 0.37 0.15 6.45 3.58 -1.21 -1.97 116.42 124.14 2fhf h ASP 286 Ca 0.06 -0.06 -0.35 0.00 0.42 0.00 0.00 57.03 57.11 2fhf h ASP 286 Cb 0.69 -0.10 -0.00 0.00 1.72 0.00 0.00 39.33 41.65 2fhf h ASP 286 CO 0.05 0.43 -1.80 0.74 -2.88 0.00 0.00 179.24 175.78 2fhf h THR 287 N 0.39 0.82 0.00 2.25 2.02 -0.96 -3.44 112.91 113.98 2fhf h THR 287 Ca 0.09 -2.42 -0.01 0.00 0.77 0.00 0.00 66.41 64.84 2fhf h THR 287 Cb 0.26 2.64 -0.00 0.00 -1.74 0.00 0.00 68.15 69.31 2fhf h THR 287 CO 0.01 0.85 -1.14 -1.22 0.37 0.00 0.00 175.52 174.38 2fhf n TYR 288 N -3.61 0.00 -0.22 3.16 4.01 0.01 -4.87 117.16 115.64 2fhf n TYR 288 Ca -0.28 0.00 -0.04 0.00 -0.16 0.00 0.00 57.90 57.42 2fhf n TYR 288 Cb 1.03 -0.08 0.02 0.00 -0.31 0.00 0.00 39.34 40.01 2fhf n TYR 288 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2fhf h ALA 289 N 0.23 0.08 -0.15 -0.72 0.00 -1.39 -0.64 119.26 116.67 2fhf h ALA 289 Ca -0.02 0.20 0.01 0.00 0.00 0.00 0.00 54.91 55.10 2fhf h ALA 289 Cb 0.38 0.74 -0.01 0.00 0.00 0.00 0.00 17.79 18.90 2fhf h ALA 289 CO 0.00 -0.62 0.06 0.00 0.00 0.00 0.00 179.25 178.69 2fhf h ALA 290 N 1.18 0.16 -0.75 0.00 0.00 -1.90 0.18 119.26 118.13 2fhf h ALA 290 Ca 0.26 0.01 -0.06 0.00 0.00 0.00 0.00 54.91 55.12 2fhf h ALA 290 Cb 0.55 -0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.30 2fhf h ALA 290 CO -0.71 -0.38 0.23 0.00 0.00 0.00 0.00 179.25 178.39 2fhf h ALA 291 N 1.08 0.99 -0.14 0.00 0.00 -1.77 -2.93 119.26 116.49 2fhf h ALA 291 Ca 0.06 -0.23 -0.14 0.00 0.00 0.00 0.00 54.91 54.60 2fhf h ALA 291 Cb 0.03 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.52 2fhf h ALA 291 CO -0.06 0.67 -0.52 0.00 0.00 0.00 0.00 179.25 179.34 2fhf h ALA 292 N 1.13 0.83 0.00 0.00 0.00 -0.83 -3.10 119.26 117.30 2fhf h ALA 292 Ca 0.24 -0.49 -0.04 0.00 0.00 0.00 0.00 54.91 54.62 2fhf h ALA 292 Cb 0.31 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 2fhf h ALA 292 CO -0.01 0.68 -0.18 0.93 0.00 0.00 0.00 179.25 180.67 2fhf h GLU 293 N 0.32 0.00 0.00 0.00 5.08 -0.47 -2.50 114.58 117.00 2fhf h GLU 293 Ca 0.01 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.37 2fhf h GLU 293 Cb 1.02 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.27 2fhf h GLU 293 CO 0.09 0.18 0.00 0.00 -1.00 0.00 0.00 179.01 178.28 2fhf n ALA 294 N -2.47 2.29 -2.49 3.43 0.00 -1.16 -4.84 120.51 115.27 2fhf n ALA 294 Ca -0.02 -0.13 -0.22 0.00 0.00 0.00 0.00 53.44 53.07 2fhf n ALA 294 Cb 0.25 -1.40 -0.05 0.00 0.00 0.00 0.00 19.45 18.25 2fhf n ALA 294 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2fhf s LEU 295 N -2.41 3.43 0.07 0.00 1.43 -0.94 -5.14 118.68 115.13 2fhf s LEU 295 Ca 0.27 -0.64 0.05 0.00 -1.03 0.00 0.00 54.13 52.79 2fhf s LEU 295 Cb 0.16 -1.99 -0.04 0.00 0.03 0.00 0.00 46.19 44.36 2fhf s LEU 295 CO 0.35 -0.35 -0.06 -0.44 0.23 0.00 0.00 176.35 176.08 2fhf s SER 296 N -3.94 4.69 0.37 2.29 0.01 -1.26 -5.06 113.70 110.80 2fhf s SER 296 Ca 0.40 -0.24 0.08 0.00 1.31 0.00 0.00 55.95 57.50 2fhf s SER 296 Cb -0.04 -1.04 -0.07 0.00 0.21 0.00 0.00 66.02 65.08 2fhf s SER 296 CO 0.25 0.21 -0.04 -0.31 0.41 0.00 0.00 173.24 173.75 2fhf s TYR 297 N -1.18 2.41 0.00 2.43 2.02 -1.26 -4.76 117.35 117.00 2fhf s TYR 297 Ca 0.22 -0.60 0.00 0.00 -0.37 0.00 0.00 57.07 56.31 2fhf s TYR 297 Cb -0.11 -1.53 0.00 0.00 -0.40 0.00 0.00 41.96 39.92 2fhf s TYR 297 CO 0.13 0.48 0.00 0.41 -1.57 0.00 0.00 175.55 175.01 2fhf n GLY 298 N -0.85 -1.85 3.42 0.71 0.00 -0.26 -4.74 105.19 101.62 2fhf n GLY 298 Ca -0.05 -1.98 -0.44 0.00 0.00 0.00 0.00 46.02 43.55 2fhf n GLY 298 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2fhf s ALA 299 N -1.83 3.33 -0.75 4.61 0.00 -1.26 -1.93 121.76 123.94 2fhf s ALA 299 Ca 0.00 -2.30 -0.20 0.00 0.00 0.00 0.00 51.96 49.46 2fhf s ALA 299 Cb 0.00 -3.79 0.11 0.00 0.00 0.00 0.00 23.12 19.44 2fhf s ALA 299 CO 0.00 -2.67 0.95 -0.65 0.00 0.00 0.00 175.76 173.39 2fhf s GLN 300 N 3.04 3.29 -0.16 0.00 -0.21 -0.34 -4.53 119.66 120.75 2fhf s GLN 300 Ca 0.21 -1.36 -0.12 0.00 0.02 0.00 0.00 55.36 54.11 2fhf s GLN 300 Cb -0.16 -4.49 -0.05 0.00 1.00 0.00 0.00 33.01 29.32 2fhf s GLN 300 CO 0.02 -1.71 0.24 -1.17 -2.12 0.00 0.00 175.29 170.55 2fhf s LEU 301 N 3.05 4.27 0.27 2.90 2.96 -1.26 -1.85 118.68 129.00 2fhf s LEU 301 Ca 0.23 0.46 0.05 0.00 -0.22 0.00 0.00 54.13 54.64 2fhf s LEU 301 Cb -0.14 -2.27 -0.06 0.00 0.50 0.00 0.00 46.19 44.22 2fhf s LEU 301 CO 0.01 0.17 -0.02 0.42 -1.32 0.00 0.00 176.35 175.62 2fhf s THR 302 N 0.15 1.33 -0.44 3.68 -4.23 0.06 -4.74 115.64 111.45 2fhf s THR 302 Ca 0.14 -2.07 0.20 0.00 -1.18 0.00 0.00 61.69 58.78 2fhf s THR 302 Cb -0.13 -2.45 0.20 0.00 1.34 0.00 0.00 72.50 71.46 2fhf s THR 302 CO 0.03 -0.27 1.60 -0.67 -0.54 0.00 0.00 174.62 174.77 2fhf n ASP 303 N -0.53 0.51 -0.39 3.99 2.03 -1.26 -2.21 116.55 118.70 2fhf n ASP 303 Ca -0.05 0.68 0.10 0.00 0.52 0.00 0.00 54.79 56.05 2fhf n ASP 303 Cb 0.64 -0.77 -0.03 0.00 -0.72 0.00 0.00 41.12 40.25 2fhf n ASP 303 CO 0.00 0.00 0.00 -1.54 -1.92 0.00 0.00 177.20 173.74 2fhf n SER 304 N -2.12 1.78 0.00 1.67 3.41 -1.26 -4.80 113.62 112.29 2fhf n SER 304 Ca 0.00 -1.39 0.00 0.00 -0.26 0.00 0.00 58.87 57.23 2fhf n SER 304 Cb 0.11 0.58 0.00 0.00 -0.26 0.00 0.00 64.21 64.64 2fhf n SER 304 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2fhf n GLY 305 N 1.39 -2.73 2.93 5.00 0.00 -0.94 -4.54 105.19 106.30 2fhf n GLY 305 Ca 0.08 -1.31 -0.13 0.00 0.00 0.00 0.00 46.02 44.65 2fhf n GLY 305 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2fhf s VAL 306 N -2.13 0.22 -0.12 1.61 0.11 -0.71 -0.76 120.40 118.61 2fhf s VAL 306 Ca 0.00 -0.25 -0.00 0.00 -2.93 0.00 0.00 61.98 58.79 2fhf s VAL 306 Cb 0.00 -0.21 0.03 0.00 -1.53 0.00 0.00 36.38 34.66 2fhf s VAL 306 CO 0.00 -0.03 -0.08 -0.89 -3.33 0.00 0.00 175.10 170.77 2fhf s THR 307 N -0.28 1.07 -0.06 5.04 2.01 -0.77 -0.67 115.64 121.98 2fhf s THR 307 Ca -0.01 -0.34 -0.11 0.00 0.31 0.00 0.00 61.69 61.54 2fhf s THR 307 Cb -0.02 -1.09 -0.05 0.00 0.01 0.00 0.00 72.50 71.34 2fhf s THR 307 CO -0.00 0.36 0.28 -0.36 -0.69 0.00 0.00 174.62 174.21 2fhf s PHE 308 N 1.69 3.66 -0.14 4.92 0.40 0.12 -1.20 117.98 127.44 2fhf s PHE 308 Ca 0.05 0.77 -0.09 0.00 -0.60 0.00 0.00 56.93 57.06 2fhf s PHE 308 Cb -0.13 -2.13 0.05 0.00 0.51 0.00 0.00 43.02 41.33 2fhf s PHE 308 CO -0.08 0.68 0.34 0.50 0.70 0.00 0.00 175.22 177.36 2fhf s ARG 309 N -1.03 0.34 -0.01 0.44 3.52 -0.81 -1.79 118.95 119.61 2fhf s ARG 309 Ca 0.19 0.63 0.00 0.00 -0.13 0.00 0.00 55.73 56.43 2fhf s ARG 309 Cb -0.14 0.01 0.01 0.00 -1.56 0.00 0.00 34.95 33.26 2fhf s ARG 309 CO 0.09 -0.13 -0.01 0.54 -0.81 0.00 0.00 175.30 174.98 2fhf s VAL 310 N 1.03 0.13 -0.20 7.11 0.11 -0.61 -1.11 120.40 126.86 2fhf s VAL 310 Ca -0.07 -0.01 -0.25 0.00 -2.93 0.00 0.00 61.98 58.72 2fhf s VAL 310 Cb -0.07 -0.16 -0.01 0.00 -1.53 0.00 0.00 36.38 34.61 2fhf s VAL 310 CO -0.08 0.07 0.85 0.86 -3.33 0.00 0.00 175.10 173.47 2fhf s TRP 311 N 0.31 3.37 -0.46 1.54 -0.00 -1.26 -0.91 118.94 121.53 2fhf s TRP 311 Ca -0.03 1.22 0.07 0.00 -0.00 0.00 0.00 56.10 57.36 2fhf s TRP 311 Cb -0.05 -3.05 0.27 0.00 -0.00 0.00 0.00 33.47 30.64 2fhf s TRP 311 CO -0.01 -0.32 0.87 0.00 -0.00 0.00 0.00 176.95 177.49 2fhf n ALA 312 N 5.62 -0.37 0.32 5.86 0.00 -0.81 -4.74 120.51 126.39 2fhf n ALA 312 Ca 0.05 -1.90 0.19 0.00 0.00 0.00 0.00 53.44 51.78 2fhf n ALA 312 Cb 0.48 -1.18 1.01 0.00 0.00 0.00 0.00 19.45 19.76 2fhf n ALA 312 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 2fhf h PRO 313 N 3.69 0.00 -0.00 0.00 0.13 -1.71 -2.65 132.00 131.46 2fhf h PRO 313 Ca -0.08 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.05 2fhf h PRO 313 Cb 1.02 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.15 2fhf h PRO 313 CO 0.32 0.00 -0.56 0.25 -0.23 0.00 0.00 178.00 177.78 2fhf n THR 314 N -3.11 0.00 -1.93 1.56 -2.24 -1.26 -4.87 114.28 102.43 2fhf n THR 314 Ca -0.02 -0.22 -0.40 0.00 -2.27 0.00 0.00 64.05 61.14 2fhf n THR 314 Cb 0.23 1.05 0.00 0.00 -2.10 0.00 0.00 70.33 69.52 2fhf n THR 314 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2fhf s ALA 315 N -2.18 3.29 -0.00 6.98 0.00 -1.00 -4.46 121.76 124.39 2fhf s ALA 315 Ca 0.08 1.36 0.11 0.00 0.00 0.00 0.00 51.96 53.51 2fhf s ALA 315 Cb 0.11 -3.54 -0.21 0.00 0.00 0.00 0.00 23.12 19.48 2fhf s ALA 315 CO 0.52 -0.98 0.88 1.96 0.00 0.00 0.00 175.76 178.14 2fhf h GLN 316 N 2.60 0.00 -2.48 0.00 4.20 -0.97 -3.48 115.11 114.99 2fhf h GLN 316 Ca -0.50 0.00 -0.09 0.00 0.06 0.00 0.00 58.65 58.12 2fhf h GLN 316 Cb 1.25 0.00 -0.21 0.00 0.30 0.00 0.00 27.48 28.83 2fhf h GLN 316 CO 0.62 0.63 -0.05 -0.65 -0.67 0.00 0.00 178.83 178.71 2fhf s GLN 317 N -2.67 0.79 -0.09 1.46 -0.21 -1.10 -5.02 119.66 112.83 2fhf s GLN 317 Ca -0.03 0.26 -0.04 0.00 0.02 0.00 0.00 55.36 55.58 2fhf s GLN 317 Cb 0.09 0.37 0.05 0.00 1.00 0.00 0.00 33.01 34.52 2fhf s GLN 317 CO 0.82 -0.20 0.18 0.08 -2.12 0.00 0.00 175.29 174.05 2fhf s VAL 318 N -0.77 -0.22 -0.01 1.09 1.01 -1.26 -1.64 120.40 118.61 2fhf s VAL 318 Ca -0.08 0.28 0.08 0.00 0.00 0.00 0.00 61.98 62.26 2fhf s VAL 318 Cb -0.03 -0.32 -0.02 0.00 0.00 0.00 0.00 36.38 36.01 2fhf s VAL 318 CO 0.05 0.12 -0.25 -1.61 0.00 0.00 0.00 175.10 173.41 2fhf s GLU 319 N 1.95 1.94 -0.36 2.72 2.02 -0.55 -1.02 118.70 125.40 2fhf s GLU 319 Ca -0.01 -0.91 -0.21 0.00 0.02 0.00 0.00 54.97 53.85 2fhf s GLU 319 Cb -0.12 -1.91 0.00 0.00 0.10 0.00 0.00 34.13 32.20 2fhf s GLU 319 CO -0.07 0.52 0.68 -1.17 0.02 0.00 0.00 175.26 175.24 2fhf s LEU 320 N -0.69 4.23 -0.28 1.80 2.96 0.16 -0.31 118.68 126.55 2fhf s LEU 320 Ca 0.10 0.20 -0.11 0.00 -0.22 0.00 0.00 54.13 54.10 2fhf s LEU 320 Cb -0.09 -2.85 -0.05 0.00 0.50 0.00 0.00 46.19 43.70 2fhf s LEU 320 CO -0.00 -0.63 0.18 -0.69 -1.32 0.00 0.00 176.35 173.88 2fhf s VAL 321 N 2.82 5.23 -0.21 1.68 1.01 -0.16 -0.01 120.40 130.76 2fhf s VAL 321 Ca 0.26 0.14 -0.10 0.00 0.00 0.00 0.00 61.98 62.28 2fhf s VAL 321 Cb -0.14 -3.49 -0.05 0.00 0.00 0.00 0.00 36.38 32.70 2fhf s VAL 321 CO 0.15 0.26 0.14 -0.63 0.00 0.00 0.00 175.10 175.02 2fhf s ILE 322 N 1.74 5.40 0.06 2.22 -1.09 0.59 -1.97 121.20 128.14 2fhf s ILE 322 Ca 0.07 0.20 0.07 0.00 -2.23 0.00 0.00 60.65 58.76 2fhf s ILE 322 Cb -0.16 -3.48 -0.04 0.00 -1.58 0.00 0.00 42.46 37.21 2fhf s ILE 322 CO 0.10 0.42 -0.16 -0.31 -1.23 0.00 0.00 174.94 173.76 2fhf s TYR 323 N 0.50 2.60 0.98 3.97 1.51 0.19 0.00 117.35 127.10 2fhf s TYR 323 Ca 0.08 -0.23 -0.16 0.00 -1.01 0.00 0.00 57.07 55.76 2fhf s TYR 323 Cb -0.12 -1.44 0.20 0.00 -0.11 0.00 0.00 41.96 40.49 2fhf s TYR 323 CO -0.01 0.32 1.26 -1.54 -1.11 0.00 0.00 175.55 174.47 2fhf s SER 324 N -1.70 2.96 0.40 2.29 1.04 -0.24 -3.04 113.70 115.41 2fhf s SER 324 Ca 0.16 0.43 0.06 0.00 0.48 0.00 0.00 55.95 57.08 2fhf s SER 324 Cb -0.11 -0.58 0.82 0.00 0.10 0.00 0.00 66.02 66.25 2fhf s SER 324 CO 0.08 -2.84 2.04 0.00 0.98 0.00 0.00 173.24 173.50 2fhf h ALA 325 N -1.71 1.69 -0.13 5.32 0.00 -1.95 0.25 119.26 122.73 2fhf h ALA 325 Ca -0.45 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.43 2fhf h ALA 325 Cb 1.26 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.87 2fhf h ALA 325 CO 0.42 0.27 0.00 -0.25 0.00 0.00 0.00 179.25 179.69 2fhf n ASP 326 N -4.47 0.83 -2.84 0.00 8.00 -1.26 -4.90 116.55 111.92 2fhf n ASP 326 Ca 0.05 -2.02 -0.19 0.00 0.71 0.00 0.00 54.79 53.34 2fhf n ASP 326 Cb 0.08 -0.14 0.06 0.00 -0.02 0.00 0.00 41.12 41.10 2fhf n ASP 326 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 2fhf n LYS 327 N -0.09 -5.84 -4.28 -1.24 4.76 0.08 -5.03 118.16 106.51 2fhf n LYS 327 Ca 0.04 0.66 -0.35 0.00 -2.87 0.00 0.00 58.31 55.79 2fhf n LYS 327 Cb 0.15 -5.16 -0.09 0.00 -1.84 0.00 0.00 35.03 28.09 2fhf n LYS 327 CO 0.00 0.00 0.00 0.15 -1.37 0.00 0.00 177.40 176.18 2fhf s LYS 328 N -5.93 3.07 0.01 1.97 -0.14 -1.26 -4.82 119.74 112.64 2fhf s LYS 328 Ca 0.42 -0.35 -0.30 0.00 -1.36 0.00 0.00 55.97 54.38 2fhf s LYS 328 Cb -0.19 -2.87 -0.07 0.00 -1.68 0.00 0.00 37.83 33.02 2fhf s LYS 328 CO 0.52 0.72 1.76 0.08 -0.76 0.00 0.00 175.35 177.67 2fhf s VAL 329 N -0.91 3.26 -0.16 3.17 1.01 -1.26 -1.08 120.40 124.43 2fhf s VAL 329 Ca 0.14 0.42 0.04 0.00 0.00 0.00 0.00 61.98 62.58 2fhf s VAL 329 Cb -0.11 -3.27 -0.23 0.00 0.00 0.00 0.00 36.38 32.77 2fhf s VAL 329 CO 0.03 -0.03 0.20 -0.38 0.00 0.00 0.00 175.10 174.91 2fhf n ILE 330 N 5.33 1.59 -3.54 2.22 2.08 0.10 -4.92 119.36 122.23 2fhf n ILE 330 Ca 0.18 -0.70 -0.12 0.00 0.56 0.00 0.00 62.75 62.67 2fhf n ILE 330 Cb 0.42 -1.27 -0.05 0.00 -0.75 0.00 0.00 39.64 37.99 2fhf n ILE 330 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 2fhf s ALA 331 N -2.54 -1.85 -0.17 -1.39 0.00 -1.15 -5.01 121.76 109.65 2fhf s ALA 331 Ca -0.20 1.33 -0.00 0.00 0.00 0.00 0.00 51.96 53.09 2fhf s ALA 331 Cb 0.07 -0.19 0.04 0.00 0.00 0.00 0.00 23.12 23.04 2fhf s ALA 331 CO 0.74 -0.43 -0.07 0.45 0.00 0.00 0.00 175.76 176.45 2fhf s SER 332 N -1.51 2.94 -0.26 0.00 0.15 -1.26 -0.30 113.70 113.46 2fhf s SER 332 Ca -0.03 -0.69 -0.06 0.00 0.70 0.00 0.00 55.95 55.87 2fhf s SER 332 Cb -0.00 -1.02 -0.01 0.00 -1.71 0.00 0.00 66.02 63.28 2fhf s SER 332 CO 0.01 -0.16 0.04 -1.00 1.20 0.00 0.00 173.24 173.33 2fhf s HIS 333 N 1.56 3.08 0.18 3.44 3.76 0.98 -4.90 115.29 123.39 2fhf s HIS 333 Ca 0.01 -0.80 -0.31 0.00 -0.15 0.00 0.00 55.06 53.81 2fhf s HIS 333 Cb -0.15 -2.21 -0.09 0.00 1.11 0.00 0.00 32.58 31.24 2fhf s HIS 333 CO -0.08 -0.50 1.45 -1.25 -0.85 0.00 0.00 174.74 173.51 2fhf s PRO 334 N 1.53 4.28 0.63 8.40 0.04 -1.26 0.40 135.00 149.02 2fhf s PRO 334 Ca 0.05 2.23 -0.07 0.00 0.04 0.00 0.00 61.00 63.25 2fhf s PRO 334 Cb -0.16 -3.17 0.02 0.00 0.04 0.00 0.00 34.50 31.23 2fhf s PRO 334 CO 0.01 -0.47 0.95 -1.64 0.04 0.00 0.00 177.00 175.89 2fhf s MET 335 N 0.56 2.74 -0.27 4.56 -1.94 -0.19 -4.87 119.30 119.90 2fhf s MET 335 Ca 0.64 -0.02 -0.10 0.00 -1.71 0.00 0.00 55.69 54.50 2fhf s MET 335 Cb -0.41 -2.23 -0.04 0.00 2.01 0.00 0.00 34.83 34.17 2fhf s MET 335 CO 0.35 -0.86 0.15 0.99 -0.01 0.00 0.00 175.02 175.65 2fhf s THR 336 N -3.08 5.01 0.04 2.05 2.01 -0.15 -4.88 115.64 116.64 2fhf s THR 336 Ca 0.56 0.07 -0.26 0.00 0.31 0.00 0.00 61.69 62.37 2fhf s THR 336 Cb -0.11 -3.37 -0.05 0.00 0.01 0.00 0.00 72.50 68.98 2fhf s THR 336 CO 0.46 0.28 0.79 -0.60 -0.69 0.00 0.00 174.62 174.86 2fhf s ARG 337 N 1.67 4.51 -0.33 4.92 3.52 -1.26 -1.33 118.95 130.65 2fhf s ARG 337 Ca 0.07 1.10 -0.15 0.00 -0.13 0.00 0.00 55.73 56.62 2fhf s ARG 337 Cb -0.16 -3.38 -0.02 0.00 -1.56 0.00 0.00 34.95 29.84 2fhf s ARG 337 CO 0.08 0.24 0.35 0.34 -0.81 0.00 0.00 175.30 175.51 2fhf s ASP 338 N 0.06 6.18 0.24 -2.12 2.15 0.28 -4.99 116.67 118.48 2fhf s ASP 338 Ca 0.40 -0.13 -0.06 0.00 0.43 0.00 0.00 52.55 53.19 2fhf s ASP 338 Cb -0.21 -2.19 0.30 0.00 -0.30 0.00 0.00 42.92 40.52 2fhf s ASP 338 CO 0.23 -0.29 1.87 0.77 -0.17 0.00 0.00 175.17 177.58 2fhf h SER 339 N 8.41 0.89 -0.42 -0.34 4.64 -1.96 0.13 113.55 124.90 2fhf h SER 339 Ca -0.30 0.00 -0.11 0.00 -0.47 0.00 0.00 61.79 60.91 2fhf h SER 339 Cb 1.15 -0.19 -0.02 0.00 -0.31 0.00 0.00 62.40 63.04 2fhf h SER 339 CO 0.68 0.59 -0.14 0.00 -0.87 0.00 0.00 176.83 177.09 2fhf h ALA 340 N 1.38 0.86 0.00 5.18 0.00 -1.96 -3.34 119.26 121.38 2fhf h ALA 340 Ca 0.36 -0.35 -0.24 0.00 0.00 0.00 0.00 54.91 54.68 2fhf h ALA 340 Cb 0.08 -0.18 -0.05 0.00 0.00 0.00 0.00 17.79 17.65 2fhf h ALA 340 CO -0.14 0.64 -2.19 -1.13 0.00 0.00 0.00 179.25 176.43 2fhf n SER 341 N -4.14 0.31 0.00 0.00 3.41 -1.18 -4.57 113.62 107.46 2fhf n SER 341 Ca 0.01 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.62 2fhf n SER 341 Cb 0.40 1.27 0.00 0.00 -0.26 0.00 0.00 64.21 65.62 2fhf n SER 341 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2fhf n GLY 342 N 1.68 0.50 3.90 5.00 0.00 0.44 -4.54 105.19 112.16 2fhf n GLY 342 Ca -0.22 -0.51 -0.29 0.00 0.00 0.00 0.00 46.02 45.00 2fhf n GLY 342 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2fhf s ALA 343 N -2.00 3.68 -0.04 4.61 0.00 -1.24 -1.92 121.76 124.85 2fhf s ALA 343 Ca 0.00 -0.58 0.06 0.00 0.00 0.00 0.00 51.96 51.44 2fhf s ALA 343 Cb 0.00 -2.23 -0.02 0.00 0.00 0.00 0.00 23.12 20.87 2fhf s ALA 343 CO 0.00 0.37 -0.23 -1.58 0.00 0.00 0.00 175.76 174.32 2fhf s TRP 344 N -1.95 2.44 0.15 0.00 0.52 -0.09 -0.55 118.94 119.46 2fhf s TRP 344 Ca 0.43 -0.51 0.01 0.00 0.02 0.00 0.00 56.10 56.04 2fhf s TRP 344 Cb -0.11 -1.57 -0.04 0.00 -1.15 0.00 0.00 33.47 30.60 2fhf s TRP 344 CO 0.28 -0.08 0.02 -1.54 0.02 0.00 0.00 176.95 175.65 2fhf s SER 345 N -0.42 0.84 -0.23 2.95 1.04 -0.44 -1.57 113.70 115.86 2fhf s SER 345 Ca 0.04 -1.17 -0.14 0.00 0.48 0.00 0.00 55.95 55.17 2fhf s SER 345 Cb -0.12 0.19 0.07 0.00 0.10 0.00 0.00 66.02 66.26 2fhf s SER 345 CO 0.01 -0.62 0.58 0.86 0.98 0.00 0.00 173.24 175.04 2fhf s TRP 346 N -3.81 -0.86 -0.12 5.02 -0.00 -0.74 -0.97 118.94 117.45 2fhf s TRP 346 Ca 0.22 1.78 -0.00 0.00 -0.00 0.00 0.00 56.10 58.10 2fhf s TRP 346 Cb 0.07 0.47 -0.02 0.00 -0.00 0.00 0.00 33.47 33.98 2fhf s TRP 346 CO 0.02 -0.44 -0.10 -1.14 -0.00 0.00 0.00 176.95 175.28 2fhf s GLN 347 N 1.46 3.25 0.00 5.86 0.74 -1.26 -0.70 119.66 129.01 2fhf s GLN 347 Ca -0.09 -0.63 0.00 0.00 0.05 0.00 0.00 55.36 54.69 2fhf s GLN 347 Cb -0.06 -2.66 0.00 0.00 1.10 0.00 0.00 33.01 31.39 2fhf s GLN 347 CO -0.16 0.34 0.00 0.41 -0.55 0.00 0.00 175.29 175.33 2fhf n GLY 348 N 3.19 4.10 3.94 2.59 0.00 0.15 -5.01 105.19 114.14 2fhf n GLY 348 Ca -0.18 -1.65 -0.25 0.00 0.00 0.00 0.00 46.02 43.94 2fhf n GLY 348 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2fhf s GLY 349 N -0.94 1.69 0.08 -0.02 0.00 -1.26 -1.74 107.32 105.13 2fhf s GLY 349 Ca 0.00 -0.95 0.15 0.00 0.00 0.00 0.00 44.72 43.92 2fhf s GLY 349 CO 0.00 -0.60 1.48 -1.14 0.00 0.00 0.00 173.10 172.84 2fhf n SER 350 N -2.72 0.20 0.07 1.64 3.41 -1.26 -2.38 113.62 112.57 2fhf n SER 350 Ca 0.07 0.56 0.09 0.00 -0.26 0.00 0.00 58.87 59.32 2fhf n SER 350 Cb 0.60 -0.60 0.38 0.00 -0.26 0.00 0.00 64.21 64.33 2fhf n SER 350 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 2fhf n ASP 351 N -1.73 0.32 0.00 4.04 5.75 -1.26 -1.88 116.55 121.79 2fhf n ASP 351 Ca 0.02 0.59 0.15 0.00 -0.01 0.00 0.00 54.79 55.54 2fhf n ASP 351 Cb 0.16 -0.65 0.84 0.00 -1.03 0.00 0.00 41.12 40.43 2fhf n ASP 351 CO 0.00 0.00 0.00 0.18 -0.11 0.00 0.00 177.20 177.27 2fhf n LEU 352 N -1.87 0.00 -4.67 -2.12 4.77 -1.00 -4.84 117.00 107.27 2fhf n LEU 352 Ca 0.02 0.11 -0.46 0.00 -0.03 0.00 0.00 56.01 55.65 2fhf n LEU 352 Cb 0.16 -0.11 -0.04 0.00 -2.33 0.00 0.00 43.42 41.11 2fhf n LEU 352 CO 0.14 -0.00 1.21 1.17 -1.33 0.00 0.00 177.39 178.58 2fhf n LYS 353 N -1.11 2.17 -0.18 3.23 4.81 -0.79 -1.34 118.16 124.96 2fhf n LYS 353 Ca 0.19 0.78 0.00 0.00 -0.87 0.00 0.00 58.31 58.42 2fhf n LYS 353 Cb 0.15 -2.56 0.00 0.00 0.02 0.00 0.00 35.03 32.64 2fhf n LYS 353 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2fhf n GLY 354 N 3.47 2.00 3.78 3.14 0.00 -0.37 -5.00 105.19 112.21 2fhf n GLY 354 Ca 0.17 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.83 2fhf n GLY 354 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2fhf s ALA 355 N -2.96 2.87 0.23 4.61 0.00 -0.45 -4.62 121.76 121.45 2fhf s ALA 355 Ca 0.00 0.83 -0.08 0.00 0.00 0.00 0.00 51.96 52.71 2fhf s ALA 355 Cb 0.00 -3.35 -0.07 0.00 0.00 0.00 0.00 23.12 19.70 2fhf s ALA 355 CO 0.00 -0.61 0.53 -0.06 0.00 0.00 0.00 175.76 175.62 2fhf s PHE 356 N -1.69 3.44 0.18 0.00 0.40 -1.17 -0.96 117.98 118.19 2fhf s PHE 356 Ca 0.67 0.80 -0.23 0.00 -0.60 0.00 0.00 56.93 57.56 2fhf s PHE 356 Cb -0.25 -2.20 0.06 0.00 0.51 0.00 0.00 43.02 41.14 2fhf s PHE 356 CO 0.29 0.27 0.67 1.52 0.70 0.00 0.00 175.22 178.67 2fhf s TYR 357 N -1.85 -0.42 0.14 0.36 -0.85 0.10 -0.64 117.35 114.19 2fhf s TYR 357 Ca 0.46 0.14 -0.13 0.00 -0.52 0.00 0.00 57.07 57.03 2fhf s TYR 357 Cb -0.11 0.60 0.01 0.00 0.38 0.00 0.00 41.96 42.84 2fhf s TYR 357 CO 0.23 -0.93 0.34 1.03 -1.52 0.00 0.00 175.55 174.70 2fhf s ARG 358 N -3.73 1.08 -0.25 -3.49 0.52 -0.83 -1.74 118.95 110.50 2fhf s ARG 358 Ca 0.04 -0.91 -0.08 0.00 -0.52 0.00 0.00 55.73 54.27 2fhf s ARG 358 Cb -0.02 0.42 -0.03 0.00 0.52 0.00 0.00 34.95 35.84 2fhf s ARG 358 CO -0.07 -0.41 0.08 0.71 0.02 0.00 0.00 175.30 175.64 2fhf s TYR 359 N -3.87 3.11 -0.40 -0.53 2.02 0.19 -0.99 117.35 116.89 2fhf s TYR 359 Ca 0.08 -0.34 -0.26 0.00 -0.37 0.00 0.00 57.07 56.18 2fhf s TYR 359 Cb 0.03 -2.25 0.02 0.00 -0.40 0.00 0.00 41.96 39.35 2fhf s TYR 359 CO -0.07 -0.32 0.92 0.00 -1.57 0.00 0.00 175.55 174.51 2fhf s ALA 360 N 1.59 3.35 0.00 3.71 0.00 0.57 -0.85 121.76 130.14 2fhf s ALA 360 Ca 0.06 -0.57 -0.02 0.00 0.00 0.00 0.00 51.96 51.44 2fhf s ALA 360 Cb -0.15 -3.57 -0.04 0.00 0.00 0.00 0.00 23.12 19.36 2fhf s ALA 360 CO 0.04 -1.76 0.17 -1.64 0.00 0.00 0.00 175.76 172.58 2fhf s MET 361 N 3.57 3.37 -0.33 0.00 1.00 0.93 -1.48 119.30 126.36 2fhf s MET 361 Ca 0.38 -0.37 -0.00 0.00 0.00 0.00 0.00 55.69 55.69 2fhf s MET 361 Cb -0.11 -3.04 0.10 0.00 0.00 0.00 0.00 34.83 31.78 2fhf s MET 361 CO 0.21 0.66 0.11 0.99 0.00 0.00 0.00 175.02 176.99 2fhf s THR 362 N -1.34 1.05 -0.10 2.05 2.01 -0.65 -2.11 115.64 116.56 2fhf s THR 362 Ca 0.28 -1.62 -0.13 0.00 0.31 0.00 0.00 61.69 60.52 2fhf s THR 362 Cb -0.13 -1.79 0.03 0.00 0.01 0.00 0.00 72.50 70.63 2fhf s THR 362 CO 0.20 -0.70 0.35 0.54 -0.69 0.00 0.00 174.62 174.31 2fhf s VAL 363 N 1.40 0.02 0.08 3.82 0.11 -0.56 -0.33 120.40 124.93 2fhf s VAL 363 Ca 0.11 -0.13 -0.31 0.00 -2.93 0.00 0.00 61.98 58.72 2fhf s VAL 363 Cb -0.18 -0.54 -0.06 0.00 -1.53 0.00 0.00 36.38 34.06 2fhf s VAL 363 CO -0.20 -0.07 1.26 -0.47 -3.33 0.00 0.00 175.10 172.28 2fhf s TYR 364 N -0.26 3.37 -0.23 1.54 5.04 -1.26 -0.42 117.35 125.14 2fhf s TYR 364 Ca -0.04 1.19 -0.01 0.00 -2.44 0.00 0.00 57.07 55.76 2fhf s TYR 364 Cb -0.03 -3.50 0.02 0.00 0.35 0.00 0.00 41.96 38.79 2fhf s TYR 364 CO 0.02 -1.64 -0.09 -1.58 -1.34 0.00 0.00 175.55 170.92 2fhf s HIS 365 N 1.08 2.98 0.56 4.97 5.65 -0.80 -4.74 115.29 124.98 2fhf s HIS 365 Ca 0.61 -1.47 0.25 0.00 0.25 0.00 0.00 55.06 54.70 2fhf s HIS 365 Cb -0.32 -2.03 1.50 0.00 -1.18 0.00 0.00 32.58 30.55 2fhf s HIS 365 CO 0.29 -0.71 2.09 -1.35 -0.65 0.00 0.00 174.74 174.41 2fhf h PRO 366 N 8.01 0.00 -0.44 2.88 0.11 -1.92 0.24 132.00 140.88 2fhf h PRO 366 Ca -0.37 0.00 -0.14 0.00 0.11 0.00 0.00 66.00 65.60 2fhf h PRO 366 Cb 1.12 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.22 2fhf h PRO 366 CO 0.59 0.00 -0.27 0.37 -0.21 0.00 0.00 178.00 178.49 2fhf h GLN 367 N 0.00 0.94 0.00 1.05 4.15 -1.96 -3.21 115.11 116.08 2fhf h GLN 367 Ca 0.11 -0.43 0.00 0.00 0.77 0.00 0.00 58.65 59.10 2fhf h GLN 367 Cb 0.50 -0.02 0.00 0.00 0.21 0.00 0.00 27.48 28.17 2fhf h GLN 367 CO -0.00 1.09 -1.40 -1.13 -1.93 0.00 0.00 178.83 175.46 2fhf n SER 368 N -4.09 0.50 -1.83 -0.69 3.41 -1.00 -4.99 113.62 104.92 2fhf n SER 368 Ca -0.01 -0.34 -0.17 0.00 -0.26 0.00 0.00 58.87 58.09 2fhf n SER 368 Cb 0.48 1.31 -0.02 0.00 -0.26 0.00 0.00 64.21 65.72 2fhf n SER 368 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 2fhf n ARG 369 N -1.97 -1.32 -4.11 4.33 1.74 0.82 -5.00 116.66 111.15 2fhf n ARG 369 Ca 0.00 0.87 -0.10 0.00 -0.77 0.00 0.00 57.85 57.85 2fhf n ARG 369 Cb 0.46 -5.27 -0.10 0.00 -1.02 0.00 0.00 32.46 26.53 2fhf n ARG 369 CO 0.00 0.00 0.00 -1.59 -1.52 0.00 0.00 177.63 174.52 2fhf s LYS 370 N -4.62 0.67 -0.77 5.56 -2.85 -1.21 -4.72 119.74 111.80 2fhf s LYS 370 Ca 0.00 -1.15 -0.26 0.00 -1.00 0.00 0.00 55.97 53.56 2fhf s LYS 370 Cb 0.00 -0.05 0.02 0.00 -2.06 0.00 0.00 37.83 35.75 2fhf s LYS 370 CO 0.00 -0.04 1.40 0.08 0.10 0.00 0.00 175.35 176.89 2fhf s VAL 371 N -3.22 3.69 0.60 1.79 1.01 -1.26 -1.91 120.40 121.10 2fhf s VAL 371 Ca 0.05 0.18 -0.16 0.00 0.00 0.00 0.00 61.98 62.05 2fhf s VAL 371 Cb 0.03 -4.78 -0.03 0.00 0.00 0.00 0.00 36.38 31.59 2fhf s VAL 371 CO -0.05 -1.72 1.07 -1.61 0.00 0.00 0.00 175.10 172.79 2fhf s GLU 372 N 5.84 3.25 -0.19 2.72 0.41 0.44 -4.78 118.70 126.39 2fhf s GLU 372 Ca 0.42 1.26 -0.03 0.00 -0.41 0.00 0.00 54.97 56.21 2fhf s GLU 372 Cb -0.07 -2.02 0.06 0.00 -1.78 0.00 0.00 34.13 30.32 2fhf s GLU 372 CO 0.12 -0.87 0.04 -0.65 -0.49 0.00 0.00 175.26 173.40 2fhf s GLN 373 N -4.00 0.62 0.10 1.61 -0.21 -1.26 -1.50 119.66 115.02 2fhf s GLN 373 Ca 0.65 -0.39 -0.25 0.00 0.02 0.00 0.00 55.36 55.39 2fhf s GLN 373 Cb -0.17 -2.06 0.07 0.00 1.00 0.00 0.00 33.01 31.85 2fhf s GLN 373 CO 0.36 -0.63 0.62 1.52 -2.12 0.00 0.00 175.29 175.05 2fhf s TYR 374 N 1.88 -0.57 -0.09 0.91 -0.00 -0.89 -4.99 117.35 113.60 2fhf s TYR 374 Ca -0.01 0.54 -0.12 0.00 -0.00 0.00 0.00 57.07 57.49 2fhf s TYR 374 Cb -0.17 0.52 -0.05 0.00 -0.00 0.00 0.00 41.96 42.26 2fhf s TYR 374 CO -0.08 -0.78 0.28 -1.21 -0.00 0.00 0.00 175.55 173.76 2fhf s GLU 375 N -3.06 3.84 0.02 -3.49 2.02 -1.26 -0.05 118.70 116.72 2fhf s GLU 375 Ca -0.02 0.13 0.03 0.00 0.02 0.00 0.00 54.97 55.13 2fhf s GLU 375 Cb -0.01 -3.27 -0.01 0.00 0.10 0.00 0.00 34.13 30.94 2fhf s GLU 375 CO -0.07 0.60 -0.09 0.08 0.02 0.00 0.00 175.26 175.80 2fhf s VAL 376 N -0.63 0.69 0.89 2.63 1.01 -0.03 -4.91 120.40 120.05 2fhf s VAL 376 Ca 0.18 -0.71 -0.12 0.00 0.00 0.00 0.00 61.98 61.34 2fhf s VAL 376 Cb -0.14 -0.65 0.13 0.00 0.00 0.00 0.00 36.38 35.72 2fhf s VAL 376 CO 0.07 -0.04 1.09 0.42 0.00 0.00 0.00 175.10 176.64 2fhf s THR 377 N -0.70 2.64 -0.07 3.92 -4.23 -1.26 -0.63 115.64 115.32 2fhf s THR 377 Ca -0.01 0.21 -0.30 0.00 -1.18 0.00 0.00 61.69 60.41 2fhf s THR 377 Cb -0.06 -2.72 -0.02 0.00 1.34 0.00 0.00 72.50 71.04 2fhf s THR 377 CO 0.00 -0.27 1.11 -0.62 -0.54 0.00 0.00 174.62 174.30 2fhf s ASP 378 N -3.47 7.15 0.54 3.99 -1.08 -1.26 -4.81 116.67 117.74 2fhf s ASP 378 Ca 0.63 1.70 0.35 0.00 -0.52 0.00 0.00 52.55 54.71 2fhf s ASP 378 Cb -0.18 -2.56 1.59 0.00 -1.46 0.00 0.00 42.92 40.32 2fhf s ASP 378 CO 0.57 -0.50 2.04 1.55 0.52 0.00 0.00 175.17 179.35 2fhf h PRO 379 N 7.23 0.00 -0.63 4.34 0.13 -1.94 -0.61 132.00 140.52 2fhf h PRO 379 Ca -0.34 0.00 -0.09 0.00 -0.87 0.00 0.00 66.00 64.70 2fhf h PRO 379 Cb 1.16 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 32.24 2fhf h PRO 379 CO 0.86 0.00 0.11 0.66 -0.23 0.00 0.00 178.00 179.40 2fhf n TYR 380 N -2.95 2.19 -1.69 1.56 4.01 -1.26 -4.65 117.16 114.36 2fhf n TYR 380 Ca -0.00 -0.94 -0.41 0.00 -0.16 0.00 0.00 57.90 56.39 2fhf n TYR 380 Cb 0.22 -0.58 0.02 0.00 -0.31 0.00 0.00 39.34 38.69 2fhf n TYR 380 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2fhf n ALA 381 N 0.23 1.11 -0.20 -0.72 0.00 -0.24 -4.67 120.51 116.02 2fhf n ALA 381 Ca 0.33 0.23 0.00 0.00 0.00 0.00 0.00 53.44 54.00 2fhf n ALA 381 Cb 1.27 -2.24 0.00 0.00 0.00 0.00 0.00 19.45 18.48 2fhf n ALA 381 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 2fhf n HIS 382 N -0.42 0.00 -3.61 0.00 8.25 -1.26 -4.30 115.22 113.88 2fhf n HIS 382 Ca 0.08 -0.01 -0.16 0.00 -0.26 0.00 0.00 57.72 57.37 2fhf n HIS 382 Cb 0.40 -0.00 -0.07 0.00 1.12 0.00 0.00 29.99 31.44 2fhf n HIS 382 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 2fhf s SER 383 N -0.01 -0.49 0.13 0.41 0.15 -1.26 -4.79 113.70 107.84 2fhf s SER 383 Ca 0.00 0.50 -0.04 0.00 0.70 0.00 0.00 55.95 57.11 2fhf s SER 383 Cb 0.00 0.47 -0.03 0.00 -1.71 0.00 0.00 66.02 64.75 2fhf s SER 383 CO 0.00 -0.55 0.11 -0.76 1.20 0.00 0.00 173.24 173.25 2fhf s LEU 384 N -1.22 1.62 0.81 3.45 1.43 -1.26 -0.99 118.68 122.52 2fhf s LEU 384 Ca -0.12 -1.06 -0.04 0.00 -1.03 0.00 0.00 54.13 51.87 2fhf s LEU 384 Cb -0.02 0.56 0.17 0.00 0.03 0.00 0.00 46.19 46.93 2fhf s LEU 384 CO 0.08 -0.76 1.11 -0.94 0.23 0.00 0.00 176.35 176.07 2fhf s SER 385 N -3.00 3.85 0.20 2.29 1.04 -0.51 -1.88 113.70 115.69 2fhf s SER 385 Ca 0.19 -0.33 -0.33 0.00 0.48 0.00 0.00 55.95 55.97 2fhf s SER 385 Cb 0.06 0.13 -0.13 0.00 0.10 0.00 0.00 66.02 66.18 2fhf s SER 385 CO -0.01 -2.21 1.64 0.41 0.98 0.00 0.00 173.24 174.05 2fhf n THR 386 N -3.13 0.11 -1.56 2.02 -1.04 -1.19 -1.87 114.28 107.62 2fhf n THR 386 Ca 0.17 -0.03 -0.15 0.00 -2.04 0.00 0.00 64.05 62.00 2fhf n THR 386 Cb 0.60 -1.78 -0.06 0.00 -1.82 0.00 0.00 70.33 67.28 2fhf n THR 386 CO 0.00 0.00 0.00 -3.20 -0.64 0.00 0.00 175.07 171.23 2fhf n ASN 387 N 3.54 -4.79 -1.73 8.00 4.05 -1.26 -3.46 115.26 119.60 2fhf n ASN 387 Ca 0.16 0.32 -0.18 0.00 0.45 0.00 0.00 54.58 55.33 2fhf n ASN 387 Cb 0.32 -3.67 -0.04 0.00 1.23 0.00 0.00 39.78 37.62 2fhf n ASN 387 CO 0.00 0.00 0.00 -1.20 -3.05 0.00 0.00 177.26 173.01 2fhf n SER 388 N -0.51 -5.25 0.11 1.20 7.64 -0.78 -4.90 113.62 111.12 2fhf n SER 388 Ca -0.16 0.23 -0.02 0.00 1.01 0.00 0.00 58.87 59.93 2fhf n SER 388 Cb 0.52 -4.34 0.21 0.00 -1.01 0.00 0.00 64.21 59.59 2fhf n SER 388 CO 0.00 0.00 0.00 -0.33 -3.01 0.00 0.00 175.04 171.70 2fhf h GLU 389 N 0.00 0.17 -4.58 1.43 5.08 -1.74 -3.45 114.58 111.50 2fhf h GLU 389 Ca -0.40 -0.09 -0.30 0.00 -1.00 0.00 0.00 59.36 57.57 2fhf h GLU 389 Cb 1.25 0.00 -0.23 0.00 0.50 0.00 0.00 28.75 30.28 2fhf h GLU 389 CO 0.53 0.62 -0.74 0.71 -1.00 0.00 0.00 179.01 179.12 2fhf s TYR 390 N -4.00 0.68 0.59 4.33 1.51 -1.26 -4.79 117.35 114.40 2fhf s TYR 390 Ca -0.04 -0.40 -0.05 0.00 -1.01 0.00 0.00 57.07 55.57 2fhf s TYR 390 Cb 0.13 -0.41 0.02 0.00 -0.11 0.00 0.00 41.96 41.59 2fhf s TYR 390 CO 0.77 -0.06 0.88 -1.54 -1.11 0.00 0.00 175.55 174.49 2fhf s SER 391 N -1.25 5.48 -0.00 2.29 1.04 -0.71 -1.43 113.70 119.12 2fhf s SER 391 Ca -0.07 0.57 0.01 0.00 0.48 0.00 0.00 55.95 56.94 2fhf s SER 391 Cb -0.08 -1.53 -0.00 0.00 0.10 0.00 0.00 66.02 64.50 2fhf s SER 391 CO 0.00 -1.10 -0.03 -1.58 0.98 0.00 0.00 173.24 171.51 2fhf s GLN 392 N -4.96 0.27 -0.03 4.02 0.74 -0.16 -0.72 119.66 118.82 2fhf s GLN 392 Ca 0.54 -0.11 -0.30 0.00 0.05 0.00 0.00 55.36 55.54 2fhf s GLN 392 Cb -0.10 -0.27 -0.04 0.00 1.10 0.00 0.00 33.01 33.70 2fhf s GLN 392 CO 0.44 0.06 1.28 0.08 -0.55 0.00 0.00 175.29 176.60 2fhf s VAL 393 N -0.04 4.04 0.01 1.34 1.01 -0.13 -3.99 120.40 122.64 2fhf s VAL 393 Ca 0.01 1.39 -0.09 0.00 0.00 0.00 0.00 61.98 63.28 2fhf s VAL 393 Cb -0.02 -3.89 0.01 0.00 0.00 0.00 0.00 36.38 32.48 2fhf s VAL 393 CO -0.00 -0.00 0.19 0.54 0.00 0.00 0.00 175.10 175.82 2fhf s VAL 394 N 2.29 0.08 -0.38 2.92 0.11 -1.26 -1.23 120.40 122.93 2fhf s VAL 394 Ca 0.59 -0.70 0.01 0.00 -2.93 0.00 0.00 61.98 58.95 2fhf s VAL 394 Cb -0.27 -0.58 0.11 0.00 -1.53 0.00 0.00 36.38 34.10 2fhf s VAL 394 CO 0.24 -0.38 0.13 -0.62 -3.33 0.00 0.00 175.10 171.13 2fhf s ASP 395 N -1.54 4.99 0.42 3.54 -1.08 -1.26 -4.49 116.67 117.25 2fhf s ASP 395 Ca -0.12 -2.13 0.26 0.00 -0.52 0.00 0.00 52.55 50.03 2fhf s ASP 395 Cb -0.06 -1.72 1.43 0.00 -1.46 0.00 0.00 42.92 41.11 2fhf s ASP 395 CO 0.01 -0.45 1.79 -0.07 0.52 0.00 0.00 175.17 176.97 2fhf h LEU 396 N 7.77 0.00 -0.25 -1.34 3.38 -1.96 -1.09 115.31 121.82 2fhf h LEU 396 Ca -0.08 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.89 2fhf h LEU 396 Cb 1.03 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.78 2fhf h LEU 396 CO 0.61 0.00 0.00 0.78 0.09 0.00 0.00 178.44 179.92 2fhf h ASN 397 N 0.00 0.00 -2.02 -0.43 4.21 -1.97 -3.47 115.58 111.90 2fhf h ASN 397 Ca 0.00 0.00 -0.63 0.00 1.21 0.00 0.00 56.30 56.88 2fhf h ASN 397 Cb 0.13 0.00 0.06 0.00 -1.12 0.00 0.00 38.32 37.39 2fhf h ASN 397 CO 0.00 0.00 0.60 -0.67 -1.29 0.00 0.00 177.43 176.07 2fhf n ASP 398 N -2.56 2.32 0.26 5.81 -0.08 -0.42 -4.86 116.55 117.02 2fhf n ASP 398 Ca 0.04 1.11 0.12 0.00 -1.51 0.00 0.00 54.79 54.55 2fhf n ASP 398 Cb 0.41 -1.31 0.73 0.00 2.34 0.00 0.00 41.12 43.29 2fhf n ASP 398 CO 0.00 0.00 0.00 0.77 0.12 0.00 0.00 177.20 178.09 2fhf h SER 399 N 5.02 0.00 0.67 1.67 4.64 -1.90 -2.09 113.55 121.56 2fhf h SER 399 Ca -0.46 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.86 2fhf h SER 399 Cb 1.30 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.39 2fhf h SER 399 CO 0.82 0.11 0.00 0.00 -0.87 0.00 0.00 176.83 176.89 2fhf n ALA 400 N -2.31 1.63 -0.78 5.18 0.00 -1.26 -2.02 120.51 120.94 2fhf n ALA 400 Ca -0.02 0.08 0.08 0.00 0.00 0.00 0.00 53.44 53.58 2fhf n ALA 400 Cb 0.21 -1.37 0.29 0.00 0.00 0.00 0.00 19.45 18.59 2fhf n ALA 400 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2fhf n LEU 401 N -2.19 4.30 -4.13 0.00 4.77 -0.79 -4.94 117.00 114.03 2fhf n LEU 401 Ca 0.02 -2.73 -0.25 0.00 -0.03 0.00 0.00 56.01 53.02 2fhf n LEU 401 Cb 0.21 -0.53 -0.16 0.00 -2.33 0.00 0.00 43.42 40.61 2fhf n LEU 401 CO 0.19 0.70 -0.50 -0.54 -1.33 0.00 0.00 177.39 175.91 2fhf s LYS 402 N -2.34 1.58 0.75 3.23 1.02 -0.86 -3.98 119.74 119.14 2fhf s LYS 402 Ca 0.44 -0.59 -0.11 0.00 0.02 0.00 0.00 55.97 55.73 2fhf s LYS 402 Cb 0.32 -1.43 0.04 0.00 -0.52 0.00 0.00 37.83 36.24 2fhf s LYS 402 CO 0.15 0.28 1.09 -1.25 -0.92 0.00 0.00 175.35 174.69 2fhf s PRO 403 N -0.11 2.43 0.13 -1.68 0.04 -1.26 -4.90 135.00 129.65 2fhf s PRO 403 Ca -0.00 1.14 -0.33 0.00 0.04 0.00 0.00 61.00 61.85 2fhf s PRO 403 Cb -0.10 -1.92 -0.13 0.00 0.04 0.00 0.00 34.50 32.40 2fhf s PRO 403 CO 0.01 -1.50 1.69 -1.91 0.04 0.00 0.00 177.00 175.33 2fhf n GLU 404 N -3.37 2.38 -1.01 4.56 4.07 -1.26 -1.85 120.64 124.17 2fhf n GLU 404 Ca 0.09 0.86 -0.00 0.00 -0.06 0.00 0.00 57.16 58.05 2fhf n GLU 404 Cb 0.53 -2.68 -0.00 0.00 -0.06 0.00 0.00 31.44 29.23 2fhf n GLU 404 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 2fhf n GLY 405 N 3.80 0.47 0.15 8.31 0.00 -1.26 -4.96 105.19 111.70 2fhf n GLY 405 Ca 0.18 -0.24 -0.06 0.00 0.00 0.00 0.00 46.02 45.90 2fhf n GLY 405 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 173.32 173.07 2fhf h TRP 406 N 0.00 0.01 -0.13 1.61 2.91 -1.72 -2.67 115.95 115.96 2fhf h TRP 406 Ca -0.00 0.02 0.04 0.00 1.13 0.00 0.00 58.89 60.08 2fhf h TRP 406 Cb 0.04 0.05 -0.01 0.00 -0.51 0.00 0.00 29.16 28.74 2fhf h TRP 406 CO 0.03 -0.05 0.14 -0.44 -1.03 0.00 0.00 178.44 177.09 2fhf h ASP 407 N 0.11 0.00 -0.61 2.65 3.32 -1.93 -1.26 116.42 118.71 2fhf h ASP 407 Ca 0.16 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.21 2fhf h ASP 407 Cb 0.22 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.77 2fhf h ASP 407 CO -0.26 0.00 0.00 0.61 -1.72 0.00 0.00 179.24 177.87 2fhf n GLY 408 N -1.38 1.96 3.68 2.75 0.00 -1.01 -4.95 105.19 106.23 2fhf n GLY 408 Ca 0.00 -0.68 -0.42 0.00 0.00 0.00 0.00 46.02 44.92 2fhf n GLY 408 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2fhf s LEU 409 N -1.09 4.38 0.23 0.99 2.96 -0.48 -5.00 118.68 120.67 2fhf s LEU 409 Ca 0.42 2.55 0.06 0.00 -0.22 0.00 0.00 54.13 56.94 2fhf s LEU 409 Cb 0.22 -3.56 -0.04 0.00 0.50 0.00 0.00 46.19 43.32 2fhf s LEU 409 CO 0.27 -0.95 0.21 0.42 -1.32 0.00 0.00 176.35 174.98 2fhf s THR 410 N 3.12 4.58 -0.29 3.68 -4.23 -1.26 -5.08 115.64 116.16 2fhf s THR 410 Ca 0.78 -1.26 -0.25 0.00 -1.18 0.00 0.00 61.69 59.78 2fhf s THR 410 Cb -0.41 -3.44 0.00 0.00 1.34 0.00 0.00 72.50 69.99 2fhf s THR 410 CO 0.34 -0.29 0.87 0.00 -0.54 0.00 0.00 174.62 175.01 2fhf s MET 411 N -3.68 4.05 0.55 3.99 0.23 -1.26 -4.80 119.30 118.38 2fhf s MET 411 Ca 0.33 0.80 0.27 0.00 -1.03 0.00 0.00 55.69 56.06 2fhf s MET 411 Cb -0.09 -3.71 1.58 0.00 -1.53 0.00 0.00 34.83 31.09 2fhf s MET 411 CO 0.25 -0.68 2.15 -1.00 -2.03 0.00 0.00 175.02 173.71 2fhf h PRO 412 N 7.98 0.00 -5.36 3.16 0.13 -1.86 -3.42 132.00 132.63 2fhf h PRO 412 Ca -0.23 0.00 -0.62 0.00 -0.87 0.00 0.00 66.00 64.28 2fhf h PRO 412 Cb 1.09 0.00 -0.32 0.00 0.13 0.00 0.00 31.00 31.89 2fhf h PRO 412 CO 0.92 0.07 -0.86 -1.01 -0.23 0.00 0.00 178.00 176.88 2fhf s HIS 413 N -4.45 2.12 0.49 1.56 3.76 -1.26 -5.03 115.29 112.48 2fhf s HIS 413 Ca -0.04 -0.73 -0.21 0.00 -0.15 0.00 0.00 55.06 53.92 2fhf s HIS 413 Cb 0.14 -1.43 -0.07 0.00 1.11 0.00 0.00 32.58 32.34 2fhf s HIS 413 CO 0.58 -0.28 1.12 0.00 -0.85 0.00 0.00 174.74 175.31 2fhf s ALA 414 N 0.19 2.85 -0.01 -1.40 0.00 -1.26 -4.96 121.76 117.16 2fhf s ALA 414 Ca -0.10 0.81 0.13 0.00 0.00 0.00 0.00 51.96 52.80 2fhf s ALA 414 Cb -0.15 -3.34 0.22 0.00 0.00 0.00 0.00 23.12 19.85 2fhf s ALA 414 CO 0.05 -0.61 1.09 1.04 0.00 0.00 0.00 175.76 177.34 2fhf n GLN 415 N -0.86 0.12 -0.02 0.00 6.02 -1.26 -4.38 117.38 116.99 2fhf n GLN 415 Ca 0.09 -1.61 -0.05 0.00 -0.01 0.00 0.00 57.00 55.42 2fhf n GLN 415 Cb 0.50 -0.37 -0.04 0.00 1.02 0.00 0.00 30.24 31.36 2fhf n GLN 415 CO 0.00 0.00 0.00 -0.22 -1.01 0.00 0.00 177.06 175.83 2fhf h LYS 416 N 0.49 -0.08 -6.84 -1.09 3.64 -1.92 -3.44 116.57 107.32 2fhf h LYS 416 Ca -0.10 0.01 -0.45 0.00 -1.27 0.00 0.00 60.65 58.83 2fhf h LYS 416 Cb 1.59 0.02 0.04 0.00 -0.41 0.00 0.00 32.23 33.47 2fhf h LYS 416 CO 0.04 0.19 -0.02 0.95 -2.27 0.00 0.00 179.45 178.34 2fhf s THR 417 N -2.10 3.22 0.30 1.00 -4.23 -1.26 -4.95 115.64 107.62 2fhf s THR 417 Ca -0.06 -0.52 0.01 0.00 -1.18 0.00 0.00 61.69 59.94 2fhf s THR 417 Cb -0.00 -3.22 0.13 0.00 1.34 0.00 0.00 72.50 70.75 2fhf s THR 417 CO 0.22 -0.16 1.81 0.11 -0.54 0.00 0.00 174.62 176.06 2fhf h LYS 418 N 0.13 0.64 -0.42 3.99 1.57 -1.91 -1.06 116.57 119.51 2fhf h LYS 418 Ca -0.44 -0.16 -0.05 0.00 -1.87 0.00 0.00 60.65 58.13 2fhf h LYS 418 Cb 1.28 -0.08 -0.02 0.00 0.08 0.00 0.00 32.23 33.49 2fhf h LYS 418 CO 0.55 0.68 0.04 0.00 -0.57 0.00 0.00 179.45 180.15 2fhf h ALA 419 N 1.38 1.28 -0.15 3.86 0.00 -1.81 -0.09 119.26 123.72 2fhf h ALA 419 Ca 0.12 -0.21 -0.02 0.00 0.00 0.00 0.00 54.91 54.80 2fhf h ALA 419 Cb 0.41 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 2fhf h ALA 419 CO 0.02 0.49 0.00 -0.44 0.00 0.00 0.00 179.25 179.32 2fhf h ASP 420 N 0.63 0.25 -0.91 0.00 3.32 -1.60 -3.18 116.42 114.93 2fhf h ASP 420 Ca 0.13 -0.30 -0.00 0.00 0.02 0.00 0.00 57.03 56.88 2fhf h ASP 420 Cb 0.34 -0.07 -0.04 0.00 0.22 0.00 0.00 39.33 39.78 2fhf h ASP 420 CO 0.01 0.49 0.56 -0.07 -1.72 0.00 0.00 179.24 178.50 2fhf h LEU 421 N 0.00 1.08 -2.49 1.55 3.38 -0.80 -2.69 115.31 115.34 2fhf h LEU 421 Ca 0.04 -0.06 0.01 0.00 0.09 0.00 0.00 57.88 57.96 2fhf h LEU 421 Cb 0.36 -0.27 -0.00 0.00 0.09 0.00 0.00 40.66 40.83 2fhf h LEU 421 CO 0.01 0.83 0.06 0.00 0.09 0.00 0.00 178.44 179.42 2fhf h ALA 422 N 1.30 1.49 0.00 1.53 0.00 -1.00 -0.37 119.26 122.21 2fhf h ALA 422 Ca 0.33 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.24 2fhf h ALA 422 Cb -0.07 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.73 2fhf h ALA 422 CO -0.06 -0.08 0.00 1.63 0.00 0.00 0.00 179.25 180.74 2fhf n LYS 423 N -3.66 0.14 -1.68 0.00 5.02 -1.01 -4.60 118.16 112.37 2fhf n LYS 423 Ca -0.02 0.09 -0.46 0.00 -2.02 0.00 0.00 58.31 55.90 2fhf n LYS 423 Cb 0.15 -1.50 -0.04 0.00 -0.02 0.00 0.00 35.03 33.61 2fhf n LYS 423 CO 0.00 0.00 0.00 -0.12 -0.52 0.00 0.00 177.40 176.76 2fhf n MET 424 N -1.41 2.36 -3.75 1.97 1.56 -0.15 -4.81 117.12 112.89 2fhf n MET 424 Ca 0.08 0.86 -0.29 0.00 -0.27 0.00 0.00 57.70 58.08 2fhf n MET 424 Cb 0.23 -2.72 -0.15 0.00 2.15 0.00 0.00 33.22 32.73 2fhf n MET 424 CO 0.00 0.00 0.00 0.99 -0.73 0.00 0.00 175.97 176.23 2fhf s THR 425 N 3.50 0.87 0.02 1.12 2.01 -1.26 -2.02 115.64 119.88 2fhf s THR 425 Ca 0.89 -1.25 -0.17 0.00 0.31 0.00 0.00 61.69 61.47 2fhf s THR 425 Cb -0.62 -1.57 -0.06 0.00 0.01 0.00 0.00 72.50 70.25 2fhf s THR 425 CO 0.46 -0.56 0.48 -0.63 -0.69 0.00 0.00 174.62 173.69 2fhf s ILE 426 N 1.64 4.93 -0.38 1.82 1.01 0.79 -1.22 121.20 129.78 2fhf s ILE 426 Ca 0.07 1.00 0.02 0.00 0.00 0.00 0.00 60.65 61.75 2fhf s ILE 426 Cb -0.17 -3.80 0.11 0.00 0.01 0.00 0.00 42.46 38.61 2fhf s ILE 426 CO -0.21 0.54 0.11 -2.28 0.00 0.00 0.00 174.94 173.11 2fhf s HIS 427 N -0.92 3.67 -0.43 3.97 2.46 -0.03 -1.42 115.29 122.59 2fhf s HIS 427 Ca 0.26 -2.89 -0.28 0.00 0.47 0.00 0.00 55.06 52.61 2fhf s HIS 427 Cb -0.18 -2.99 0.00 0.00 -0.13 0.00 0.00 32.58 29.29 2fhf s HIS 427 CO 0.15 -0.93 1.50 -2.00 -2.47 0.00 0.00 174.74 170.99 2fhf s GLU 428 N 0.81 3.44 0.37 2.88 2.12 0.03 -1.70 118.70 126.65 2fhf s GLU 428 Ca 0.11 0.92 0.08 0.00 0.36 0.00 0.00 54.97 56.44 2fhf s GLU 428 Cb -0.20 -4.09 -0.07 0.00 0.26 0.00 0.00 34.13 30.02 2fhf s GLU 428 CO -0.06 -1.74 -0.03 -1.12 -0.54 0.00 0.00 175.26 171.77 2fhf s SER 429 N 4.59 3.66 -0.01 -1.70 0.01 0.12 -1.27 113.70 119.11 2fhf s SER 429 Ca 0.63 -1.30 0.03 0.00 1.31 0.00 0.00 55.95 56.62 2fhf s SER 429 Cb -0.15 -0.35 -0.01 0.00 0.21 0.00 0.00 66.02 65.73 2fhf s SER 429 CO 0.31 -0.36 -0.09 -2.28 0.41 0.00 0.00 173.24 171.23 2fhf s HIS 430 N -2.73 0.76 0.25 2.43 2.46 -1.26 -0.87 115.29 116.33 2fhf s HIS 430 Ca 0.34 -0.15 -0.04 0.00 0.47 0.00 0.00 55.06 55.68 2fhf s HIS 430 Cb 0.07 -0.49 0.40 0.00 -0.13 0.00 0.00 32.58 32.43 2fhf s HIS 430 CO 0.17 -0.01 1.81 0.82 -2.47 0.00 0.00 174.74 175.06 2fhf h ILE 431 N 4.92 0.91 0.23 0.89 1.08 -1.94 -1.39 117.51 122.20 2fhf h ILE 431 Ca -0.30 -0.27 -0.32 0.00 -0.39 0.00 0.00 64.86 63.57 2fhf h ILE 431 Cb 1.18 0.04 0.03 0.00 -3.07 0.00 0.00 36.82 35.00 2fhf h ILE 431 CO 0.50 0.15 -1.43 0.03 -0.69 0.00 0.00 178.15 176.70 2fhf h ARG 432 N 0.80 0.49 -0.84 2.37 3.08 -1.95 -3.23 114.38 115.10 2fhf h ARG 432 Ca 0.40 -0.83 0.12 0.00 0.07 0.00 0.00 59.98 59.74 2fhf h ARG 432 Cb 0.37 0.31 -0.06 0.00 0.08 0.00 0.00 29.97 30.67 2fhf h ARG 432 CO -0.25 1.40 0.54 -0.44 -1.07 0.00 0.00 179.97 180.15 2fhf h ASP 433 N 0.13 0.64 0.10 7.04 3.32 -1.80 0.14 116.42 126.00 2fhf h ASP 433 Ca -0.23 0.03 -0.01 0.00 0.02 0.00 0.00 57.03 56.84 2fhf h ASP 433 Cb 2.13 -0.10 0.00 0.00 0.22 0.00 0.00 39.33 41.58 2fhf h ASP 433 CO 0.26 0.36 -0.05 -0.07 -1.72 0.00 0.00 179.24 178.02 2fhf h LEU 434 N 0.70 -0.12 -0.68 1.55 3.38 -1.32 -3.39 115.31 115.42 2fhf h LEU 434 Ca 0.40 -0.29 0.00 0.00 0.09 0.00 0.00 57.88 58.08 2fhf h LEU 434 Cb 0.59 0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.37 2fhf h LEU 434 CO -0.17 0.24 -0.03 -1.54 0.09 0.00 0.00 178.44 177.03 2fhf n SER 435 N -4.99 0.76 -0.05 -0.43 3.41 -1.05 -4.71 113.62 106.56 2fhf n SER 435 Ca -0.09 -0.88 0.19 0.00 -0.26 0.00 0.00 58.87 57.83 2fhf n SER 435 Cb 0.21 0.36 0.64 0.00 -0.26 0.00 0.00 64.21 65.17 2fhf n SER 435 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2fhf h ALA 436 N 0.31 2.40 -0.01 7.33 0.00 -0.96 -2.55 119.26 125.79 2fhf h ALA 436 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2fhf h ALA 436 Cb 0.06 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.87 2fhf h ALA 436 CO 0.00 -0.57 -0.27 0.91 0.00 0.00 0.00 179.25 179.32 2fhf n TRP 437 N -4.40 0.00 -2.58 0.00 7.02 -1.26 -4.89 117.44 111.34 2fhf n TRP 437 Ca 0.11 0.00 -0.42 0.00 -1.02 0.00 0.00 57.50 56.17 2fhf n TRP 437 Cb 0.59 0.00 -0.03 0.00 -2.42 0.00 0.00 31.31 29.46 2fhf n TRP 437 CO 0.00 0.00 0.00 0.34 -2.02 0.00 0.00 177.69 176.01 2fhf s ASP 438 N -1.78 6.33 0.40 -0.99 -1.08 -0.96 -4.86 116.67 113.74 2fhf s ASP 438 Ca 0.14 -0.12 0.29 0.00 -0.52 0.00 0.00 52.55 52.33 2fhf s ASP 438 Cb 0.13 -2.55 1.26 0.00 -1.46 0.00 0.00 42.92 40.30 2fhf s ASP 438 CO 0.36 -1.62 1.85 1.56 0.52 0.00 0.00 175.17 177.85 2fhf h GLN 439 N 9.73 0.00 -0.01 4.34 1.08 -1.92 -1.95 115.11 126.39 2fhf h GLN 439 Ca -0.26 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 56.94 2fhf h GLN 439 Cb 1.05 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.48 2fhf h GLN 439 CO 1.22 0.00 -0.11 0.25 -0.95 0.00 0.00 178.83 179.24 2fhf n THR 440 N -2.60 0.00 -3.47 -0.54 -2.24 -1.26 -4.71 114.28 99.47 2fhf n THR 440 Ca 0.01 -0.10 -0.37 0.00 -2.27 0.00 0.00 64.05 61.32 2fhf n THR 440 Cb 0.22 0.06 -0.06 0.00 -2.10 0.00 0.00 70.33 68.44 2fhf n THR 440 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 2fhf s VAL 441 N -2.36 5.22 0.18 2.28 1.01 -0.73 -4.27 120.40 121.72 2fhf s VAL 441 Ca 0.31 0.73 -0.32 0.00 0.00 0.00 0.00 61.98 62.70 2fhf s VAL 441 Cb 0.20 -3.70 -0.15 0.00 0.00 0.00 0.00 36.38 32.72 2fhf s VAL 441 CO 0.45 0.42 1.16 -2.65 0.00 0.00 0.00 175.10 174.48 2fhf n PRO 442 N 3.19 1.20 -0.31 2.72 -0.02 -1.26 -4.78 135.00 135.75 2fhf n PRO 442 Ca -0.11 0.43 0.15 0.00 -2.02 0.00 0.00 63.50 61.95 2fhf n PRO 442 Cb 0.52 -1.93 0.33 0.00 -0.02 0.00 0.00 33.50 32.40 2fhf n PRO 442 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2fhf h ALA 443 N 3.33 1.45 0.00 3.55 0.00 -1.91 0.71 119.26 126.39 2fhf h ALA 443 Ca -0.43 0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.67 2fhf h ALA 443 Cb 1.34 0.22 0.00 0.00 0.00 0.00 0.00 17.79 19.35 2fhf h ALA 443 CO 0.70 -0.43 0.00 -0.85 0.00 0.00 0.00 179.25 178.67 2fhf n GLU 444 N -5.12 0.02 0.00 0.00 0.00 -1.26 -2.67 120.64 111.61 2fhf n GLU 444 Ca 0.23 0.25 0.08 0.00 0.00 0.00 0.00 57.16 57.72 2fhf n GLU 444 Cb 0.72 -1.54 0.04 0.00 0.00 0.00 0.00 31.44 30.66 2fhf n GLU 444 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.13 178.41 2fhf n LEU 445 N -1.58 2.08 -4.71 -1.84 4.77 0.23 -4.90 117.00 111.04 2fhf n LEU 445 Ca 0.04 -0.92 -0.42 0.00 -0.03 0.00 0.00 56.01 54.68 2fhf n LEU 445 Cb 0.19 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.25 2fhf n LEU 445 CO 0.15 0.38 1.15 -0.13 -1.33 0.00 0.00 177.39 177.61 2fhf s ARG 446 N -1.53 4.27 -0.22 3.23 0.52 -1.09 -1.74 118.95 122.39 2fhf s ARG 446 Ca 0.17 2.20 0.00 0.00 -0.52 0.00 0.00 55.73 57.58 2fhf s ARG 446 Cb 0.13 -3.25 0.00 0.00 0.52 0.00 0.00 34.95 32.36 2fhf s ARG 446 CO 0.27 -0.53 0.00 0.41 0.02 0.00 0.00 175.30 175.47 2fhf n GLY 447 N 3.63 0.55 3.46 -3.53 0.00 -1.26 -4.87 105.19 103.17 2fhf n GLY 447 Ca 0.13 -0.54 -0.25 0.00 0.00 0.00 0.00 46.02 45.36 2fhf n GLY 447 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2fhf s LYS 448 N -1.48 1.65 0.25 1.61 -0.14 -0.71 -4.59 119.74 116.33 2fhf s LYS 448 Ca 0.00 -1.71 -0.04 0.00 -1.36 0.00 0.00 55.97 52.86 2fhf s LYS 448 Cb 0.00 -1.79 0.40 0.00 -1.68 0.00 0.00 37.83 34.75 2fhf s LYS 448 CO 0.00 0.35 1.83 1.88 -0.76 0.00 0.00 175.35 178.65 2fhf h TYR 449 N 2.48 0.94 0.00 3.18 0.05 -1.30 -2.24 116.97 120.09 2fhf h TYR 449 Ca -0.42 0.03 0.00 0.00 0.05 0.00 0.00 58.73 58.39 2fhf h TYR 449 Cb 1.25 -0.30 0.00 0.00 1.01 0.00 0.00 36.73 38.69 2fhf h TYR 449 CO 0.78 0.42 0.00 1.28 -1.05 0.00 0.00 178.16 179.59 2fhf n LEU 450 N -4.68 0.23 0.23 3.88 4.77 -1.26 -2.57 117.00 117.60 2fhf n LEU 450 Ca 0.14 0.58 0.13 0.00 -0.03 0.00 0.00 56.01 56.83 2fhf n LEU 450 Cb 0.25 -0.58 0.75 0.00 -2.33 0.00 0.00 43.42 41.51 2fhf n LEU 450 CO 0.28 -0.54 1.11 0.00 -1.33 0.00 0.00 177.39 176.91 2fhf h ALA 451 N 2.17 1.90 0.00 -1.18 0.00 -1.51 -0.00 119.26 120.65 2fhf h ALA 451 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2fhf h ALA 451 Cb 0.12 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.92 2fhf h ALA 451 CO 0.00 -0.13 0.00 1.28 0.00 0.00 0.00 179.25 180.40 2fhf n LEU 452 N -4.21 0.01 -0.37 0.00 7.99 -1.06 -1.68 117.00 117.68 2fhf n LEU 452 Ca -0.01 0.50 0.12 0.00 -0.01 0.00 0.00 56.01 56.61 2fhf n LEU 452 Cb 0.19 -0.50 0.15 0.00 -0.11 0.00 0.00 43.42 43.15 2fhf n LEU 452 CO 0.31 -0.35 0.43 0.35 -1.51 0.00 0.00 177.39 176.63 2fhf n THR 453 N -1.51 0.00 -2.36 -5.08 -2.24 -0.02 -4.69 114.28 98.38 2fhf n THR 453 Ca 0.02 -0.19 -0.43 0.00 -2.27 0.00 0.00 64.05 61.18 2fhf n THR 453 Cb 0.11 0.88 0.00 0.00 -2.10 0.00 0.00 70.33 69.22 2fhf n THR 453 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2fhf n ALA 454 N -0.36 4.10 0.20 6.98 0.00 -0.67 -4.80 120.51 125.95 2fhf n ALA 454 Ca 0.10 -3.87 0.18 0.00 0.00 0.00 0.00 53.44 49.85 2fhf n ALA 454 Cb 0.41 -3.57 0.80 0.00 0.00 0.00 0.00 19.45 17.08 2fhf n ALA 454 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.50 179.46 2fhf h GLN 455 N 7.13 0.00 -0.01 0.00 4.20 -1.86 -1.11 115.11 123.45 2fhf h GLN 455 Ca 0.48 0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.19 2fhf h GLN 455 Cb 0.81 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.59 2fhf h GLN 455 CO 1.57 0.00 -0.22 0.39 -0.67 0.00 0.00 178.83 179.90 2fhf n GLU 456 N -3.44 1.05 -1.95 1.46 -0.58 -1.26 -4.41 120.64 111.50 2fhf n GLU 456 Ca 0.03 -0.64 -0.31 0.00 -0.42 0.00 0.00 57.16 55.81 2fhf n GLU 456 Cb 0.48 -1.49 0.01 0.00 -0.57 0.00 0.00 31.44 29.87 2fhf n GLU 456 CO 0.00 0.00 0.00 -1.54 -0.48 0.00 0.00 177.13 175.11 2fhf s SER 457 N -2.39 6.09 0.21 1.62 1.04 -0.42 -4.93 113.70 114.92 2fhf s SER 457 Ca 0.27 1.55 -0.10 0.00 0.48 0.00 0.00 55.95 58.14 2fhf s SER 457 Cb 0.19 -2.49 0.15 0.00 0.10 0.00 0.00 66.02 63.98 2fhf s SER 457 CO 0.48 -0.96 1.85 0.78 0.98 0.00 0.00 173.24 176.37 2fhf h ASN 458 N -0.02 0.91 0.04 7.02 -0.26 -1.88 -1.87 115.58 119.53 2fhf h ASN 458 Ca -0.45 -0.07 -0.00 0.00 -0.56 0.00 0.00 56.30 55.22 2fhf h ASN 458 Cb 1.20 -0.23 0.00 0.00 -1.06 0.00 0.00 38.32 38.23 2fhf h ASN 458 CO 0.60 0.71 -0.02 -0.03 -1.06 0.00 0.00 177.43 177.63 2fhf h MET 459 N 1.04 -0.06 -0.53 0.81 4.05 -1.91 -1.13 114.93 117.21 2fhf h MET 459 Ca 0.27 0.00 -0.08 0.00 -0.28 0.00 0.00 59.70 59.62 2fhf h MET 459 Cb -0.03 0.01 -0.02 0.00 -0.80 0.00 0.00 31.60 30.76 2fhf h MET 459 CO -0.05 0.13 0.03 0.28 0.23 0.00 0.00 176.91 177.53 2fhf h VAL 460 N -0.24 1.26 -0.49 -5.77 2.07 -1.78 -1.38 116.25 109.92 2fhf h VAL 460 Ca -0.01 -1.05 -0.03 0.00 0.82 0.00 0.00 66.70 66.43 2fhf h VAL 460 Cb 0.22 0.90 -0.02 0.00 -1.52 0.00 0.00 31.29 30.86 2fhf h VAL 460 CO 0.01 0.38 0.19 1.56 0.02 0.00 0.00 177.57 179.73 2fhf h GLN 461 N 0.79 0.70 -0.29 1.57 1.08 -1.33 0.10 115.11 117.73 2fhf h GLN 461 Ca 0.15 -0.10 -0.04 0.00 -1.45 0.00 0.00 58.65 57.21 2fhf h GLN 461 Cb 0.49 -0.13 -0.01 0.00 -0.05 0.00 0.00 27.48 27.78 2fhf h GLN 461 CO 0.02 0.58 0.01 1.25 -0.95 0.00 0.00 178.83 179.74 2fhf h HIS 462 N 0.69 0.56 -0.25 2.96 2.76 -0.82 -2.05 115.15 119.00 2fhf h HIS 462 Ca 0.17 -0.09 -0.08 0.00 -2.20 0.00 0.00 60.37 58.16 2fhf h HIS 462 Cb 0.14 -0.15 -0.01 0.00 1.55 0.00 0.00 27.41 28.94 2fhf h HIS 462 CO 0.01 0.64 -0.21 -0.07 -1.30 0.00 0.00 177.93 177.00 2fhf h LEU 463 N 0.31 0.45 -0.72 0.26 3.38 -0.73 -1.65 115.31 116.61 2fhf h LEU 463 Ca 0.08 -0.14 -0.02 0.00 0.09 0.00 0.00 57.88 57.89 2fhf h LEU 463 Cb 0.41 -0.12 -0.03 0.00 0.09 0.00 0.00 40.66 41.01 2fhf h LEU 463 CO 0.01 0.67 0.36 0.50 0.09 0.00 0.00 178.44 180.08 2fhf h LYS 464 N 0.41 1.03 -0.09 1.13 3.64 -0.56 -1.00 116.57 121.13 2fhf h LYS 464 Ca 0.07 -0.14 -0.15 0.00 -1.27 0.00 0.00 60.65 59.15 2fhf h LYS 464 Cb 0.60 -0.19 -0.01 0.00 -0.41 0.00 0.00 32.23 32.22 2fhf h LYS 464 CO 0.04 0.79 -0.61 0.37 -2.27 0.00 0.00 179.45 177.78 2fhf h GLN 465 N 1.00 0.29 -0.67 1.90 5.75 -1.08 -1.69 115.11 120.61 2fhf h GLN 465 Ca 0.25 -0.20 -0.08 0.00 -0.15 0.00 0.00 58.65 58.47 2fhf h GLN 465 Cb 0.09 0.03 -0.03 0.00 1.07 0.00 0.00 27.48 28.65 2fhf h GLN 465 CO -0.03 0.81 0.11 -0.07 -2.65 0.00 0.00 178.83 177.00 2fhf h LEU 466 N 0.22 1.06 -0.14 -2.39 3.38 -0.91 -1.34 115.31 115.19 2fhf h LEU 466 Ca -0.01 -0.26 -0.01 0.00 0.09 0.00 0.00 57.88 57.70 2fhf h LEU 466 Cb 1.12 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 41.58 2fhf h LEU 466 CO 0.10 1.05 0.05 -1.28 0.09 0.00 0.00 178.44 178.45 2fhf h SER 467 N 1.03 0.19 0.01 -0.43 0.87 -1.01 -1.08 113.55 113.13 2fhf h SER 467 Ca 0.20 -0.17 -0.00 0.00 -1.23 0.00 0.00 61.79 60.60 2fhf h SER 467 Cb 0.44 -0.05 -0.00 0.00 -0.44 0.00 0.00 62.40 62.35 2fhf h SER 467 CO 0.01 0.31 -0.00 0.00 -0.53 0.00 0.00 176.83 176.62 2fhf h ALA 468 N 0.89 1.71 -0.00 6.23 0.00 -1.11 -2.10 119.26 124.88 2fhf h ALA 468 Ca 0.05 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.95 2fhf h ALA 468 Cb 0.18 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.97 2fhf h ALA 468 CO -0.00 0.00 -0.38 0.43 0.00 0.00 0.00 179.25 179.30 2fhf n SER 469 N -4.12 0.73 0.00 0.00 7.64 -0.52 -4.96 113.62 112.40 2fhf n SER 469 Ca -0.03 -0.54 0.00 0.00 1.01 0.00 0.00 58.87 59.31 2fhf n SER 469 Cb 0.09 0.19 0.00 0.00 -1.01 0.00 0.00 64.21 63.48 2fhf n SER 469 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2fhf n GLY 470 N 1.42 0.79 3.71 0.23 0.00 -0.79 -1.23 105.19 109.33 2fhf n GLY 470 Ca 0.09 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.69 2fhf n GLY 470 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2fhf s VAL 471 N -0.85 4.11 -0.06 1.61 1.01 -0.47 -4.75 120.40 121.00 2fhf s VAL 471 Ca 0.00 1.49 0.12 0.00 0.00 0.00 0.00 61.98 63.59 2fhf s VAL 471 Cb 0.00 -3.96 -0.18 0.00 0.00 0.00 0.00 36.38 32.24 2fhf s VAL 471 CO 0.00 0.08 0.18 0.35 0.00 0.00 0.00 175.10 175.71 2fhf n THR 472 N 4.13 0.34 -4.44 3.92 -2.24 -0.36 -4.26 114.28 111.37 2fhf n THR 472 Ca 0.10 -0.38 -0.20 0.00 -2.27 0.00 0.00 64.05 61.29 2fhf n THR 472 Cb 0.46 -0.16 -0.14 0.00 -2.10 0.00 0.00 70.33 68.39 2fhf n THR 472 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 2fhf s HIS 473 N -2.65 1.09 -0.22 4.78 3.76 -0.65 -0.79 115.29 120.62 2fhf s HIS 473 Ca -0.05 -0.26 -0.06 0.00 -0.15 0.00 0.00 55.06 54.54 2fhf s HIS 473 Cb 0.06 -0.68 -0.03 0.00 1.11 0.00 0.00 32.58 33.05 2fhf s HIS 473 CO 0.52 -0.00 0.03 0.42 -0.85 0.00 0.00 174.74 174.85 2fhf s ILE 474 N -0.51 4.08 -0.18 0.60 -1.09 -0.24 -0.85 121.20 123.01 2fhf s ILE 474 Ca 0.03 -0.26 -0.07 0.00 -2.23 0.00 0.00 60.65 58.12 2fhf s ILE 474 Cb -0.06 -2.87 -0.04 0.00 -1.58 0.00 0.00 42.46 37.91 2fhf s ILE 474 CO 0.00 0.39 0.05 -0.70 -1.23 0.00 0.00 174.94 173.45 2fhf s GLU 475 N 1.28 3.93 -0.23 2.79 2.12 -0.69 -1.01 118.70 126.90 2fhf s GLU 475 Ca 0.04 -0.37 -0.08 0.00 0.36 0.00 0.00 54.97 54.92 2fhf s GLU 475 Cb -0.15 -3.17 -0.04 0.00 0.26 0.00 0.00 34.13 31.04 2fhf s GLU 475 CO 0.02 0.28 0.09 -0.51 -0.54 0.00 0.00 175.26 174.60 2fhf s LEU 476 N 0.34 3.72 0.87 2.70 1.43 -0.11 0.14 118.68 127.78 2fhf s LEU 476 Ca 0.02 -0.04 -0.10 0.00 -1.03 0.00 0.00 54.13 52.97 2fhf s LEU 476 Cb -0.13 -1.98 0.12 0.00 0.03 0.00 0.00 46.19 44.23 2fhf s LEU 476 CO 0.00 0.05 1.14 -0.76 0.23 0.00 0.00 176.35 177.01 2fhf s LEU 477 N 1.13 2.92 0.00 1.79 1.02 -0.05 -2.00 118.68 123.48 2fhf s LEU 477 Ca 0.05 2.13 0.00 0.00 0.02 0.00 0.00 54.13 56.33 2fhf s LEU 477 Cb -0.14 -4.56 0.00 0.00 0.02 0.00 0.00 46.19 41.51 2fhf s LEU 477 CO 0.04 -2.85 0.00 -2.65 0.02 0.00 0.00 176.35 170.91 2fhf n PRO 478 N -4.00 0.00 -0.03 1.29 -0.02 -1.25 -4.79 135.00 126.20 2fhf n PRO 478 Ca 0.11 0.00 0.01 0.00 -2.02 0.00 0.00 63.50 61.61 2fhf n PRO 478 Cb 0.52 0.00 0.03 0.00 -0.02 0.00 0.00 33.50 34.03 2fhf n PRO 478 CO 0.00 0.00 0.00 1.33 1.98 0.00 0.00 175.50 178.81 2fhf n VAL 479 N 0.00 0.90 -2.30 -1.45 0.24 -1.26 -4.87 118.33 109.59 2fhf n VAL 479 Ca 0.00 -0.95 -0.26 0.00 -2.04 0.00 0.00 64.34 61.09 2fhf n VAL 479 Cb 0.00 0.56 0.13 0.00 -1.47 0.00 0.00 33.84 33.06 2fhf n VAL 479 CO 0.00 0.00 0.00 0.72 -2.14 0.00 0.00 176.83 175.41 2fhf s PHE 480 N -0.92 1.70 -0.52 6.34 -0.12 -1.26 -1.06 117.98 122.15 2fhf s PHE 480 Ca 0.05 0.01 -0.27 0.00 -0.05 0.00 0.00 56.93 56.67 2fhf s PHE 480 Cb 0.03 -3.44 -0.01 0.00 -0.63 0.00 0.00 43.02 38.96 2fhf s PHE 480 CO 0.03 -2.04 1.74 0.34 -0.05 0.00 0.00 175.22 175.24 2fhf s ASP 481 N -4.78 5.64 0.50 1.98 2.15 0.60 -3.42 116.67 119.34 2fhf s ASP 481 Ca 0.69 0.60 -0.04 0.00 0.43 0.00 0.00 52.55 54.23 2fhf s ASP 481 Cb -0.05 -2.53 -0.01 0.00 -0.30 0.00 0.00 42.92 40.02 2fhf s ASP 481 CO 0.48 -2.04 0.77 -1.48 -0.17 0.00 0.00 175.17 172.73 2fhf s LEU 482 N 7.79 3.54 -0.02 -1.34 0.05 -1.26 -0.89 118.68 126.54 2fhf s LEU 482 Ca 0.67 0.66 0.17 0.00 0.05 0.00 0.00 54.13 55.68 2fhf s LEU 482 Cb -0.15 -3.55 -0.25 0.00 -2.05 0.00 0.00 46.19 40.19 2fhf s LEU 482 CO 0.25 -0.74 0.38 0.00 -0.55 0.00 0.00 176.35 175.69 2fhf n ALA 483 N -2.28 2.68 1.26 1.48 0.00 -0.17 -4.68 120.51 118.80 2fhf n ALA 483 Ca 0.02 -0.40 0.00 0.00 0.00 0.00 0.00 53.44 53.06 2fhf n ALA 483 Cb 0.57 -0.57 0.01 0.00 0.00 0.00 0.00 19.45 19.46 2fhf n ALA 483 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 2fhf n THR 484 N -2.04 0.05 -3.93 0.00 -2.24 -1.26 -4.67 114.28 100.19 2fhf n THR 484 Ca -0.03 -0.03 -0.20 0.00 -2.27 0.00 0.00 64.05 61.52 2fhf n THR 484 Cb 0.42 -0.34 -0.17 0.00 -2.10 0.00 0.00 70.33 68.15 2fhf n THR 484 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 2fhf s VAL 485 N -1.33 0.31 -0.08 2.28 1.01 -1.26 -4.85 120.40 116.47 2fhf s VAL 485 Ca 0.01 0.06 -0.30 0.00 0.00 0.00 0.00 61.98 61.76 2fhf s VAL 485 Cb 0.01 -0.42 -0.03 0.00 0.00 0.00 0.00 36.38 35.94 2fhf s VAL 485 CO 0.01 0.20 1.22 0.21 0.00 0.00 0.00 175.10 176.74 2fhf s ASN 486 N 1.34 7.01 0.00 3.32 3.84 -1.26 -4.89 114.94 124.30 2fhf s ASN 486 Ca -0.05 1.79 0.30 0.00 0.21 0.00 0.00 52.86 55.11 2fhf s ASN 486 Cb -0.13 -2.55 1.42 0.00 -0.55 0.00 0.00 41.25 39.44 2fhf s ASN 486 CO -0.02 -0.64 1.99 -0.62 -2.79 0.00 0.00 177.10 175.02 2fhf n GLU 487 N 5.58 0.50 -2.85 0.43 1.02 -1.26 -4.60 120.64 119.46 2fhf n GLU 487 Ca 0.12 -0.07 -0.43 0.00 -0.02 0.00 0.00 57.16 56.76 2fhf n GLU 487 Cb 0.46 -1.50 -0.04 0.00 -0.02 0.00 0.00 31.44 30.34 2fhf n GLU 487 CO 0.00 0.00 0.00 -0.06 1.18 0.00 0.00 177.13 178.25 2fhf s PHE 488 N -2.54 2.77 0.43 -0.32 0.40 -1.26 -4.71 117.98 112.74 2fhf s PHE 488 Ca 0.29 -0.16 0.21 0.00 -0.60 0.00 0.00 56.93 56.66 2fhf s PHE 488 Cb 0.20 -4.10 1.17 0.00 0.51 0.00 0.00 43.02 40.80 2fhf s PHE 488 CO 0.47 -1.41 1.81 0.77 0.70 0.00 0.00 175.22 177.55 2fhf h SER 489 N 9.37 0.36 0.59 1.36 0.02 -1.95 0.37 113.55 123.67 2fhf h SER 489 Ca -0.27 0.06 0.00 0.00 -0.84 0.00 0.00 61.79 60.74 2fhf h SER 489 Cb 1.07 -0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.61 2fhf h SER 489 CO 1.11 0.09 0.00 -0.90 -1.14 0.00 0.00 176.83 175.99 2fhf n ASP 490 N -4.52 0.17 -1.06 3.07 3.85 -1.26 -2.03 116.55 114.76 2fhf n ASP 490 Ca 0.23 0.54 0.12 0.00 -0.71 0.00 0.00 54.79 54.97 2fhf n ASP 490 Cb 0.87 -0.57 0.21 0.00 -1.35 0.00 0.00 41.12 40.27 2fhf n ASP 490 CO 0.00 0.00 0.00 0.29 -1.01 0.00 0.00 177.20 176.48 2fhf n LYS 491 N -1.68 2.40 -4.68 0.11 4.76 0.12 -4.93 118.16 114.26 2fhf n LYS 491 Ca 0.03 -2.09 -0.30 0.00 -2.87 0.00 0.00 58.31 53.08 2fhf n LYS 491 Cb 0.20 -1.49 -0.14 0.00 -1.84 0.00 0.00 35.03 31.75 2fhf n LYS 491 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 2fhf s VAL 492 N -1.65 2.28 -0.05 -0.18 1.01 -0.86 -4.93 120.40 116.02 2fhf s VAL 492 Ca 0.36 -1.50 0.00 0.00 0.00 0.00 0.00 61.98 60.84 2fhf s VAL 492 Cb 0.22 -1.95 0.03 0.00 0.00 0.00 0.00 36.38 34.68 2fhf s VAL 492 CO 0.31 0.26 -0.01 0.00 0.00 0.00 0.00 175.10 175.65 2fhf s ALA 493 N -0.92 0.55 0.31 5.51 0.00 -0.47 -5.00 121.76 121.74 2fhf s ALA 493 Ca 0.13 0.00 0.08 0.00 0.00 0.00 0.00 51.96 52.18 2fhf s ALA 493 Cb -0.10 -0.48 -0.04 0.00 0.00 0.00 0.00 23.12 22.49 2fhf s ALA 493 CO 0.04 -0.17 0.11 -0.51 0.00 0.00 0.00 175.76 175.23 2fhf s ASP 494 N 1.28 4.78 0.63 0.00 1.01 -1.26 -3.87 116.67 119.23 2fhf s ASP 494 Ca -0.06 -0.65 0.40 0.00 0.71 0.00 0.00 52.55 52.94 2fhf s ASP 494 Cb -0.13 -0.86 2.10 0.00 1.01 0.00 0.00 42.92 45.04 2fhf s ASP 494 CO -0.02 -0.18 2.27 0.16 0.21 0.00 0.00 175.17 177.61 2fhf h ILE 495 N 1.63 0.13 0.00 0.77 3.07 -1.97 -1.29 117.51 119.84 2fhf h ILE 495 Ca -0.44 -0.13 0.00 0.00 1.55 0.00 0.00 64.86 65.83 2fhf h ILE 495 Cb 1.25 1.11 0.00 0.00 -0.27 0.00 0.00 36.82 38.91 2fhf h ILE 495 CO 0.62 0.01 0.00 0.00 -1.05 0.00 0.00 178.15 177.73 2fhf n GLN 496 N -3.24 0.17 -3.48 0.16 3.00 -1.26 -0.45 117.38 112.28 2fhf n GLN 496 Ca -0.02 0.01 -0.20 0.00 -0.01 0.00 0.00 57.00 56.78 2fhf n GLN 496 Cb 0.12 -1.50 -0.00 0.00 0.00 0.00 0.00 30.24 28.86 2fhf n GLN 496 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.06 176.41 2fhf s GLN 497 N -2.83 3.16 0.49 -1.09 -0.21 -0.49 -4.86 119.66 113.83 2fhf s GLN 497 Ca 0.19 -0.92 -0.22 0.00 0.02 0.00 0.00 55.36 54.44 2fhf s GLN 497 Cb 0.19 -2.80 -0.09 0.00 1.00 0.00 0.00 33.01 31.31 2fhf s GLN 497 CO 0.49 0.07 0.98 -2.30 -2.12 0.00 0.00 175.29 172.41 2fhf n PRO 498 N -1.66 1.19 0.22 2.91 -0.02 -1.26 -1.88 135.00 134.50 2fhf n PRO 498 Ca -0.01 0.43 0.06 0.00 -2.02 0.00 0.00 63.50 61.97 2fhf n PRO 498 Cb 0.58 -2.08 0.52 0.00 -0.02 0.00 0.00 33.50 32.50 2fhf n PRO 498 CO 0.00 0.00 0.00 0.35 1.98 0.00 0.00 175.50 177.83 2fhf h PHE 499 N 1.15 0.00 -0.45 6.00 3.57 -1.33 -1.80 116.94 124.09 2fhf h PHE 499 Ca -0.46 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.04 2fhf h PHE 499 Cb 1.35 0.00 -0.02 0.00 2.79 0.00 0.00 35.95 40.07 2fhf h PHE 499 CO 0.41 0.21 0.29 0.66 -2.23 0.00 0.00 178.31 177.65 2fhf h SER 500 N 0.00 0.52 -0.36 0.41 4.64 -1.80 -1.73 113.55 115.23 2fhf h SER 500 Ca -0.00 -0.02 -0.13 0.00 -0.47 0.00 0.00 61.79 61.18 2fhf h SER 500 Cb 0.40 -0.13 -0.01 0.00 -0.31 0.00 0.00 62.40 62.35 2fhf h SER 500 CO 0.03 0.38 -0.27 -0.09 -0.87 0.00 0.00 176.83 176.01 2fhf h ARG 501 N 0.61 0.82 -0.76 4.77 2.43 -1.65 -2.27 114.38 118.32 2fhf h ARG 501 Ca 0.16 -0.40 0.04 0.00 -0.81 0.00 0.00 59.98 58.97 2fhf h ARG 501 Cb -0.06 -0.00 -0.05 0.00 -0.42 0.00 0.00 29.97 29.44 2fhf h ARG 501 CO -0.03 1.03 0.48 1.25 -1.51 0.00 0.00 179.97 181.18 2fhf h LEU 502 N 0.61 0.78 -0.94 3.80 5.85 -1.24 -1.95 115.31 122.21 2fhf h LEU 502 Ca 0.07 0.00 -0.10 0.00 0.84 0.00 0.00 57.88 58.69 2fhf h LEU 502 Cb 0.84 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 41.69 2fhf h LEU 502 CO 0.07 0.53 -0.33 0.00 -0.34 0.00 0.00 178.44 178.37 2fhf h GLU 504 N 0.31 0.00 0.00 0.00 4.11 -0.84 -3.28 114.58 114.87 2fhf h GLU 504 Ca 0.04 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.47 2fhf h GLU 504 Cb 0.74 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.99 2fhf h GLU 504 CO 0.06 0.55 -1.20 1.33 0.07 0.00 0.00 179.01 179.82 2fhf n VAL 505 N -3.75 0.00 -3.88 -1.06 0.24 -0.79 -4.86 118.33 104.23 2fhf n VAL 505 Ca -0.01 -0.19 -0.30 0.00 -2.04 0.00 0.00 64.34 61.79 2fhf n VAL 505 Cb 0.58 0.68 -0.15 0.00 -1.47 0.00 0.00 33.84 33.48 2fhf n VAL 505 CO 0.00 0.00 0.00 0.21 -2.14 0.00 0.00 176.83 174.90 2fhf s ASN 506 N -3.21 4.15 0.45 -1.34 3.84 0.14 -4.98 114.94 113.98 2fhf s ASN 506 Ca 0.02 -1.61 0.23 0.00 0.21 0.00 0.00 52.86 51.72 2fhf s ASN 506 Cb 0.13 -1.18 1.01 0.00 -0.55 0.00 0.00 41.25 40.67 2fhf s ASN 506 CO 0.76 -0.34 1.88 0.77 -2.79 0.00 0.00 177.10 177.37 2fhf h SER 507 N 7.91 0.00 -0.24 -4.21 4.64 -1.85 -2.81 113.55 117.00 2fhf h SER 507 Ca -0.12 0.00 -0.09 0.00 -0.47 0.00 0.00 61.79 61.11 2fhf h SER 507 Cb 1.04 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.11 2fhf h SER 507 CO 0.46 0.23 -0.13 0.00 -0.87 0.00 0.00 176.83 176.52 2fhf h ALA 508 N 1.77 1.09 -0.13 5.18 0.00 -1.94 -2.36 119.26 122.86 2fhf h ALA 508 Ca -0.00 -0.31 -0.05 0.00 0.00 0.00 0.00 54.91 54.55 2fhf h ALA 508 Cb 0.65 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.29 2fhf h ALA 508 CO 0.03 0.56 -0.13 0.28 0.00 0.00 0.00 179.25 179.99 2fhf h VAL 509 N 0.59 1.35 0.00 0.00 2.07 -1.85 -2.72 116.25 115.69 2fhf h VAL 509 Ca 0.10 -1.28 0.00 0.00 0.82 0.00 0.00 66.70 66.34 2fhf h VAL 509 Cb 0.57 1.89 0.00 0.00 -1.52 0.00 0.00 31.29 32.23 2fhf h VAL 509 CO 0.04 0.37 0.00 0.50 0.02 0.00 0.00 177.57 178.50 2fhf h LYS 510 N -0.06 0.00 -0.41 1.57 3.64 -1.34 -0.79 116.57 119.18 2fhf h LYS 510 Ca 0.02 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.40 2fhf h LYS 510 Cb 0.65 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.47 2fhf h LYS 510 CO 0.03 0.00 0.00 -1.13 -2.27 0.00 0.00 179.45 176.08 2fhf n SER 511 N -3.02 3.09 -4.11 4.20 3.41 -0.91 -4.69 113.62 111.60 2fhf n SER 511 Ca -0.02 -1.98 -0.18 0.00 -0.26 0.00 0.00 58.87 56.42 2fhf n SER 511 Cb 0.10 -0.27 0.09 0.00 -0.26 0.00 0.00 64.21 63.87 2fhf n SER 511 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 2fhf n SER 512 N 0.74 1.19 0.01 4.04 3.41 -0.30 -4.97 113.62 117.74 2fhf n SER 512 Ca 0.14 -1.97 0.08 0.00 -0.26 0.00 0.00 58.87 56.86 2fhf n SER 512 Cb 0.46 -0.49 0.36 0.00 -0.26 0.00 0.00 64.21 64.28 2fhf n SER 512 CO 0.00 0.00 0.00 -1.84 -0.16 0.00 0.00 175.04 173.04 2fhf n GLU 513 N -2.41 0.01 -0.04 4.33 0.28 -1.26 -2.25 120.64 119.29 2fhf n GLU 513 Ca 0.13 0.23 0.12 0.00 -0.16 0.00 0.00 57.16 57.48 2fhf n GLU 513 Cb 0.48 -1.53 0.31 0.00 1.43 0.00 0.00 31.44 32.14 2fhf n GLU 513 CO 0.00 0.00 0.00 1.19 -0.16 0.00 0.00 177.13 178.16 2fhf n PHE 514 N -1.55 0.11 -0.20 -1.84 3.01 -1.26 -4.44 117.46 111.28 2fhf n PHE 514 Ca 0.04 -0.05 0.30 0.00 1.01 0.00 0.00 57.45 58.74 2fhf n PHE 514 Cb 0.20 0.00 0.73 0.00 -0.01 0.00 0.00 39.48 40.40 2fhf n PHE 514 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2fhf h ALA 515 N 4.45 2.87 0.00 4.37 0.00 -1.56 -0.05 119.26 129.34 2fhf h ALA 515 Ca 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.88 2fhf h ALA 515 Cb 0.73 0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.59 2fhf h ALA 515 CO 0.00 -1.18 0.00 0.78 0.00 0.00 0.00 179.25 178.85 2fhf h GLY 516 N 0.00 0.00 1.37 0.00 0.00 -1.85 -1.58 103.07 101.00 2fhf h GLY 516 Ca 0.45 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.78 2fhf h GLY 516 CO -0.00 0.00 -0.26 -1.72 0.00 0.00 0.00 176.54 174.56 2fhf n TYR 517 N -2.81 0.00 -0.29 5.60 4.02 -0.03 -4.26 117.16 119.38 2fhf n TYR 517 Ca -0.01 0.00 0.04 0.00 -0.01 0.00 0.00 57.90 57.91 2fhf n TYR 517 Cb 0.13 -0.34 0.18 0.00 -0.02 0.00 0.00 39.34 39.29 2fhf n TYR 517 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2fhf n ASP 519 N -4.76 4.38 -4.10 0.00 4.64 -1.26 -3.56 116.55 111.89 2fhf n ASP 519 Ca 0.14 -3.18 -0.29 0.00 -1.38 0.00 0.00 54.79 50.08 2fhf n ASP 519 Cb 0.30 -0.66 0.19 0.00 -1.04 0.00 0.00 41.12 39.91 2fhf n ASP 519 CO 0.00 0.00 0.00 -0.94 -0.82 0.00 0.00 177.20 175.44 2fhf s SER 520 N -1.49 3.08 -0.15 1.67 1.04 -0.78 -4.99 113.70 112.07 2fhf s SER 520 Ca 0.50 0.06 0.16 0.00 0.48 0.00 0.00 55.95 57.14 2fhf s SER 520 Cb 0.40 -0.07 0.51 0.00 0.10 0.00 0.00 66.02 66.95 2fhf s SER 520 CO 0.11 -2.74 1.41 0.61 0.98 0.00 0.00 173.24 173.61 2fhf n GLY 521 N -3.69 3.83 3.93 7.32 0.00 -1.26 -4.74 105.19 110.57 2fhf n GLY 521 Ca 0.17 -0.94 -0.26 0.00 0.00 0.00 0.00 46.02 44.98 2fhf n GLY 521 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2fhf s SER 522 N -1.77 6.36 0.50 1.61 0.01 -1.26 -4.96 113.70 114.18 2fhf s SER 522 Ca 0.40 0.52 -0.04 0.00 1.31 0.00 0.00 55.95 58.14 2fhf s SER 522 Cb 0.31 -2.06 -0.02 0.00 0.21 0.00 0.00 66.02 64.46 2fhf s SER 522 CO 0.10 -0.22 0.78 0.42 0.41 0.00 0.00 173.24 174.74 2fhf s THR 523 N -2.16 4.38 0.23 1.44 -4.23 -1.26 -0.99 115.64 113.04 2fhf s THR 523 Ca 0.41 -0.03 -0.08 0.00 -1.18 0.00 0.00 61.69 60.81 2fhf s THR 523 Cb -0.10 -3.67 0.19 0.00 1.34 0.00 0.00 72.50 70.25 2fhf s THR 523 CO 0.33 -0.62 1.86 0.58 -0.54 0.00 0.00 174.62 176.23 2fhf h VAL 524 N 0.17 1.10 -0.78 2.29 2.07 -1.27 -2.17 116.25 117.66 2fhf h VAL 524 Ca -0.47 -0.33 0.05 0.00 0.82 0.00 0.00 66.70 66.77 2fhf h VAL 524 Cb 1.23 0.04 -0.05 0.00 -1.52 0.00 0.00 31.29 30.99 2fhf h VAL 524 CO 0.61 0.18 0.48 -0.08 0.02 0.00 0.00 177.57 178.77 2fhf h GLU 525 N 0.97 0.87 -0.37 1.57 4.81 -1.03 -0.50 114.58 120.90 2fhf h GLU 525 Ca 0.33 -0.05 -0.09 0.00 -0.13 0.00 0.00 59.36 59.42 2fhf h GLU 525 Cb 0.05 -0.20 -0.02 0.00 0.63 0.00 0.00 28.75 29.22 2fhf h GLU 525 CO -0.13 0.58 -0.14 0.93 -0.73 0.00 0.00 179.01 179.52 2fhf h GLU 526 N 0.90 0.67 -0.10 1.92 5.08 -1.67 -1.26 114.58 120.12 2fhf h GLU 526 Ca 0.33 -0.22 -0.04 0.00 -1.00 0.00 0.00 59.36 58.44 2fhf h GLU 526 Cb 0.12 -0.06 -0.00 0.00 0.50 0.00 0.00 28.75 29.31 2fhf h GLU 526 CO -0.15 0.78 -0.08 0.28 -1.00 0.00 0.00 179.01 178.83 2fhf h VAL 527 N 0.60 1.35 -0.89 3.13 2.07 -0.88 -2.25 116.25 119.38 2fhf h VAL 527 Ca 0.10 -1.21 0.08 0.00 0.82 0.00 0.00 66.70 66.49 2fhf h VAL 527 Cb 0.58 1.94 -0.07 0.00 -1.52 0.00 0.00 31.29 32.22 2fhf h VAL 527 CO 0.04 0.34 0.55 -0.07 0.02 0.00 0.00 177.57 178.45 2fhf h LEU 528 N -0.17 0.84 -0.41 2.57 3.38 -0.99 -1.29 115.31 119.24 2fhf h LEU 528 Ca 0.02 0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.01 2fhf h LEU 528 Cb 0.58 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 41.17 2fhf h LEU 528 CO 0.02 0.52 0.26 0.74 0.09 0.00 0.00 178.44 180.07 2fhf h THR 529 N 0.97 1.12 0.00 0.22 2.02 -1.13 -2.35 112.91 113.76 2fhf h THR 529 Ca 0.40 -0.25 -0.04 0.00 0.77 0.00 0.00 66.41 67.29 2fhf h THR 529 Cb 0.24 0.54 -0.01 0.00 -1.74 0.00 0.00 68.15 67.19 2fhf h THR 529 CO -0.20 0.12 -0.19 1.56 0.37 0.00 0.00 175.52 177.17 2fhf h GLN 530 N 0.55 0.00 0.00 6.66 1.08 -0.74 -2.57 115.11 120.10 2fhf h GLN 530 Ca 0.15 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.35 2fhf h GLN 530 Cb -0.03 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.40 2fhf h GLN 530 CO -0.03 0.19 0.00 1.28 -0.95 0.00 0.00 178.83 179.32 2fhf n LEU 531 N -3.77 0.40 -0.15 1.46 4.77 -0.56 -4.00 117.00 115.14 2fhf n LEU 531 Ca -0.02 0.56 -0.08 0.00 -0.03 0.00 0.00 56.01 56.44 2fhf n LEU 531 Cb 0.30 -0.46 0.01 0.00 -2.33 0.00 0.00 43.42 40.94 2fhf n LEU 531 CO 0.33 -0.21 1.03 0.11 -1.33 0.00 0.00 177.39 177.31 2fhf h LYS 532 N 0.00 0.62 -0.95 3.23 1.57 -1.33 -2.97 116.57 116.73 2fhf h LYS 532 Ca 0.00 -0.06 0.07 0.00 -1.87 0.00 0.00 60.65 58.79 2fhf h LYS 532 Cb 0.51 -0.13 -0.07 0.00 0.08 0.00 0.00 32.23 32.62 2fhf h LYS 532 CO 0.00 0.46 0.60 0.37 -0.57 0.00 0.00 179.45 180.32 2fhf h GLN 533 N 0.60 1.06 -0.58 3.15 4.15 -1.78 -2.09 115.11 119.62 2fhf h GLN 533 Ca 0.16 -0.06 0.00 0.00 0.77 0.00 0.00 58.65 59.52 2fhf h GLN 533 Cb 0.01 -0.24 0.00 0.00 0.21 0.00 0.00 27.48 27.46 2fhf h GLN 533 CO -0.03 0.70 0.00 -1.71 -1.93 0.00 0.00 178.83 175.86 2fhf n ASN 534 N -4.55 3.31 -4.76 -0.69 4.05 -1.21 -4.92 115.26 106.48 2fhf n ASN 534 Ca 0.14 -2.16 -0.39 0.00 0.45 0.00 0.00 54.58 52.62 2fhf n ASN 534 Cb 0.19 -0.43 -0.05 0.00 1.23 0.00 0.00 39.78 40.71 2fhf n ASN 534 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 177.26 173.59 2fhf s ASP 535 N -0.90 7.04 0.24 1.20 -1.08 -0.79 -4.78 116.67 117.60 2fhf s ASP 535 Ca 0.38 1.24 -0.15 0.00 -0.52 0.00 0.00 52.55 53.50 2fhf s ASP 535 Cb 0.22 -2.39 0.05 0.00 -1.46 0.00 0.00 42.92 39.34 2fhf s ASP 535 CO 0.22 0.09 0.73 -1.54 0.52 0.00 0.00 175.17 175.19 2fhf n SER 536 N 2.68 -1.63 0.26 -0.34 3.41 -0.82 -4.91 113.62 112.27 2fhf n SER 536 Ca -0.06 -2.01 0.10 0.00 -0.26 0.00 0.00 58.87 56.64 2fhf n SER 536 Cb 0.51 2.69 0.69 0.00 -0.26 0.00 0.00 64.21 67.84 2fhf n SER 536 CO 0.00 0.00 0.00 0.07 -0.16 0.00 0.00 175.04 174.95 2fhf h LYS 537 N 0.00 0.00 0.00 4.33 2.10 -1.96 -1.22 116.57 119.82 2fhf h LYS 537 Ca -0.25 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.40 2fhf h LYS 537 Cb 0.98 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.31 2fhf h LYS 537 CO 0.32 0.09 -0.50 -0.25 -2.00 0.00 0.00 179.45 177.11 2fhf n ASP 538 N -4.03 0.50 -2.95 7.07 8.00 -1.26 -4.48 116.55 119.40 2fhf n ASP 538 Ca -0.02 -0.14 -0.14 0.00 0.71 0.00 0.00 54.79 55.20 2fhf n ASP 538 Cb 0.18 0.20 -0.01 0.00 -0.02 0.00 0.00 41.12 41.47 2fhf n ASP 538 CO 0.00 0.00 0.00 -3.20 -0.39 0.00 0.00 177.20 173.61 2fhf n ASN 539 N -1.61 -1.86 -3.51 -2.24 5.15 -0.56 -5.04 115.26 105.59 2fhf n ASN 539 Ca 0.05 -2.97 -0.39 0.00 -0.60 0.00 0.00 54.58 50.67 2fhf n ASN 539 Cb 0.35 0.86 -0.02 0.00 -0.53 0.00 0.00 39.78 40.45 2fhf n ASN 539 CO 0.00 0.00 0.00 -0.81 1.40 0.00 0.00 177.26 177.85 2fhf n PRO 540 N 1.92 3.06 0.15 1.20 -0.04 -0.61 -1.94 135.00 138.75 2fhf n PRO 540 Ca 0.16 -2.30 0.01 0.00 -0.04 0.00 0.00 63.50 61.33 2fhf n PRO 540 Cb 0.57 -3.00 0.21 0.00 -0.04 0.00 0.00 33.50 31.24 2fhf n PRO 540 CO 0.00 0.00 0.00 -0.56 -0.04 0.00 0.00 175.50 174.90 2fhf h GLN 541 N 5.74 0.00 0.02 0.54 3.07 -1.89 -2.44 115.11 120.14 2fhf h GLN 541 Ca 0.68 0.00 -0.00 0.00 0.09 0.00 0.00 58.65 59.42 2fhf h GLN 541 Cb 0.46 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.02 2fhf h GLN 541 CO 1.82 0.55 -0.01 0.28 0.09 0.00 0.00 178.83 181.56 2fhf h VAL 542 N 0.00 1.11 0.00 1.86 2.07 -1.84 -2.18 116.25 117.28 2fhf h VAL 542 Ca -0.01 -0.40 -0.07 0.00 0.82 0.00 0.00 66.70 67.04 2fhf h VAL 542 Cb 1.06 1.38 -0.01 0.00 -1.52 0.00 0.00 31.29 32.20 2fhf h VAL 542 CO 0.07 0.10 -0.35 0.06 0.02 0.00 0.00 177.57 177.47 2fhf h GLN 543 N -0.20 0.00 -0.40 1.57 -0.00 -1.73 -1.41 115.11 112.94 2fhf h GLN 543 Ca -0.00 0.00 -0.01 0.00 -0.00 0.00 0.00 58.65 58.64 2fhf h GLN 543 Cb 0.19 0.00 -0.02 0.00 -0.00 0.00 0.00 27.48 27.65 2fhf h GLN 543 CO 0.00 0.35 0.21 0.00 -0.00 0.00 0.00 178.83 179.40 2fhf h ALA 544 N 1.65 0.52 -0.09 0.06 0.00 -1.12 0.45 119.26 120.73 2fhf h ALA 544 Ca -0.00 -0.09 -0.14 0.00 0.00 0.00 0.00 54.91 54.68 2fhf h ALA 544 Cb 0.81 -0.16 0.01 0.00 0.00 0.00 0.00 17.79 18.45 2fhf h ALA 544 CO 0.05 0.06 -0.49 1.25 0.00 0.00 0.00 179.25 180.12 2fhf h LEU 545 N 0.52 0.58 -1.86 0.00 5.85 -1.27 -3.24 115.31 115.90 2fhf h LEU 545 Ca 0.14 -0.65 -0.02 0.00 0.84 0.00 0.00 57.88 58.20 2fhf h LEU 545 Cb 0.08 -0.17 -0.00 0.00 0.37 0.00 0.00 40.66 40.93 2fhf h LEU 545 CO -0.02 1.14 -0.07 -1.13 -0.34 0.00 0.00 178.44 178.02 2fhf h ASN 546 N 0.07 0.00 -0.12 1.25 -1.24 -1.11 -1.38 115.58 113.05 2fhf h ASN 546 Ca -0.03 0.00 -0.05 0.00 0.71 0.00 0.00 56.30 56.92 2fhf h ASN 546 Cb 1.14 0.00 -0.01 0.00 0.73 0.00 0.00 38.32 40.17 2fhf h ASN 546 CO 0.10 0.07 -0.06 0.74 -1.29 0.00 0.00 177.43 176.99 2fhf h THR 547 N 0.00 1.19 0.03 -3.57 2.02 -0.93 -0.61 112.91 111.04 2fhf h THR 547 Ca -0.00 -0.80 -0.20 0.00 0.77 0.00 0.00 66.41 66.18 2fhf h THR 547 Cb 0.13 1.07 0.02 0.00 -1.74 0.00 0.00 68.15 67.62 2fhf h THR 547 CO 0.01 0.26 -0.80 -0.07 0.37 0.00 0.00 175.52 175.30 2fhf h LEU 548 N 0.39 0.65 -1.00 2.58 3.38 -1.36 -3.27 115.31 116.67 2fhf h LEU 548 Ca 0.08 -0.79 0.09 0.00 0.09 0.00 0.00 57.88 57.35 2fhf h LEU 548 Cb 0.36 -0.20 -0.07 0.00 0.09 0.00 0.00 40.66 40.84 2fhf h LEU 548 CO 0.02 1.36 0.64 0.58 0.09 0.00 0.00 178.44 181.12 2fhf h VAL 549 N 0.01 1.01 -0.33 1.22 2.07 -0.97 -2.32 116.25 116.95 2fhf h VAL 549 Ca -0.11 -0.38 0.10 0.00 0.82 0.00 0.00 66.70 67.13 2fhf h VAL 549 Cb 1.51 -0.18 -0.01 0.00 -1.52 0.00 0.00 31.29 31.09 2fhf h VAL 549 CO 0.16 0.20 0.27 0.00 0.02 0.00 0.00 177.57 178.21 2fhf h ALA 550 N 1.49 2.19 -0.01 1.67 0.00 -1.17 -2.20 119.26 121.23 2fhf h ALA 550 Ca 0.46 -0.01 -0.05 0.00 0.00 0.00 0.00 54.91 55.31 2fhf h ALA 550 Cb 0.31 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.11 2fhf h ALA 550 CO -0.21 -0.44 -0.24 1.96 0.00 0.00 0.00 179.25 180.32 2fhf h GLN 551 N 0.00 0.01 0.00 0.00 4.20 -1.54 -3.30 115.11 114.48 2fhf h GLN 551 Ca 0.16 -0.00 -0.02 0.00 0.06 0.00 0.00 58.65 58.84 2fhf h GLN 551 Cb 0.69 -0.00 -0.04 0.00 0.30 0.00 0.00 27.48 28.42 2fhf h GLN 551 CO -0.00 0.26 -0.36 0.25 -0.67 0.00 0.00 178.83 178.31 2fhf n THR 552 N -4.24 1.03 -2.65 -0.54 -2.24 -0.86 -5.01 114.28 99.76 2fhf n THR 552 Ca -0.02 -1.43 -0.11 0.00 -2.27 0.00 0.00 64.05 60.22 2fhf n THR 552 Cb 0.30 0.17 0.05 0.00 -2.10 0.00 0.00 70.33 68.75 2fhf n THR 552 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 2fhf n ASP 553 N -0.66 0.81 -0.83 3.42 5.68 -0.99 -1.37 116.55 122.60 2fhf n ASP 553 Ca 0.09 -1.63 0.08 0.00 -0.50 0.00 0.00 54.79 52.83 2fhf n ASP 553 Cb 0.73 -0.28 0.23 0.00 -1.14 0.00 0.00 41.12 40.66 2fhf n ASP 553 CO 0.00 0.00 0.00 -1.20 -1.33 0.00 0.00 177.20 174.67 2fhf n SER 554 N -2.85 2.43 -4.63 -1.12 7.64 -1.26 -4.64 113.62 109.19 2fhf n SER 554 Ca 0.08 -1.96 -0.35 0.00 1.01 0.00 0.00 58.87 57.65 2fhf n SER 554 Cb 0.29 -0.28 -0.10 0.00 -1.01 0.00 0.00 64.21 63.11 2fhf n SER 554 CO 0.00 0.00 0.00 -0.47 -3.01 0.00 0.00 175.04 171.56 2fhf s TYR 555 N -1.44 3.21 -0.29 1.43 6.14 -1.26 -4.99 117.35 120.14 2fhf s TYR 555 Ca 0.32 0.04 -0.24 0.00 0.64 0.00 0.00 57.07 57.82 2fhf s TYR 555 Cb 0.17 -1.99 0.17 0.00 0.42 0.00 0.00 41.96 40.72 2fhf s TYR 555 CO 0.22 0.21 1.30 1.21 0.64 0.00 0.00 175.55 179.13 2fhf s ASN 556 N 0.05 -0.19 0.38 4.32 3.84 -1.26 -4.78 114.94 117.31 2fhf s ASN 556 Ca 0.04 0.36 0.09 0.00 0.21 0.00 0.00 52.86 53.55 2fhf s ASN 556 Cb -0.13 0.41 0.83 0.00 -0.55 0.00 0.00 41.25 41.82 2fhf s ASN 556 CO 0.01 -0.06 1.94 -0.50 -2.79 0.00 0.00 177.10 175.70 2fhf h TRP 557 N 3.62 0.69 0.00 0.43 6.55 -1.74 -3.47 115.95 122.04 2fhf h TRP 557 Ca -0.27 0.02 0.00 0.00 0.95 0.00 0.00 58.89 59.58 2fhf h TRP 557 Cb 1.19 -0.23 0.00 0.00 -0.86 0.00 0.00 29.16 29.26 2fhf h TRP 557 CO 0.25 0.33 0.00 0.41 -1.05 0.00 0.00 178.44 178.38 2fhf n GLY 558 N -1.46 1.03 2.19 1.49 0.00 -1.26 -3.93 105.19 103.24 2fhf n GLY 558 Ca 0.12 -0.47 -0.21 0.00 0.00 0.00 0.00 46.02 45.47 2fhf n GLY 558 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2fhf n TYR 559 N -2.46 0.87 -3.36 1.61 4.01 -1.26 -4.50 117.16 112.08 2fhf n TYR 559 Ca 0.00 -1.90 -0.26 0.00 -0.16 0.00 0.00 57.90 55.58 2fhf n TYR 559 Cb 0.15 -1.68 -0.09 0.00 -0.31 0.00 0.00 39.34 37.41 2fhf n TYR 559 CO 0.00 0.00 0.00 -0.25 -0.46 0.00 0.00 176.86 176.15 2fhf n ASP 560 N 2.19 -0.36 -4.67 7.72 9.92 -1.26 -4.97 116.55 125.11 2fhf n ASP 560 Ca 0.50 -2.43 -0.44 0.00 -0.53 0.00 0.00 54.79 51.89 2fhf n ASP 560 Cb 0.70 -0.57 -0.04 0.00 -0.64 0.00 0.00 41.12 40.57 2fhf n ASP 560 CO 0.00 0.00 0.00 -2.65 0.13 0.00 0.00 177.20 174.68 2fhf n PRO 561 N 2.58 2.64 -0.09 -0.24 -0.02 -1.26 -1.00 135.00 137.61 2fhf n PRO 561 Ca 0.28 0.97 -0.18 0.00 -2.02 0.00 0.00 63.50 62.55 2fhf n PRO 561 Cb 0.49 -2.88 -0.06 0.00 -0.02 0.00 0.00 33.50 31.03 2fhf n PRO 561 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 2fhf n PHE 562 N 6.82 0.00 -3.88 6.00 -0.00 -0.07 -2.00 117.46 124.33 2fhf n PHE 562 Ca 0.20 0.00 -0.20 0.00 -0.00 0.00 0.00 57.45 57.45 2fhf n PHE 562 Cb 0.37 -0.64 -0.17 0.00 -0.00 0.00 0.00 39.48 39.04 2fhf n PHE 562 CO 0.00 0.00 0.00 -1.01 -0.00 0.00 0.00 176.76 175.75 2fhf s HIS 563 N -2.46 0.53 -0.06 -5.13 3.76 -1.02 -4.86 115.29 106.05 2fhf s HIS 563 Ca -0.27 -0.09 0.28 0.00 -0.15 0.00 0.00 55.06 54.84 2fhf s HIS 563 Cb 0.09 -0.64 0.95 0.00 1.11 0.00 0.00 32.58 34.09 2fhf s HIS 563 CO 0.35 -0.24 1.83 1.88 -0.85 0.00 0.00 174.74 177.72 2fhf h TYR 564 N 7.84 0.00 -0.57 1.40 -1.99 -1.85 -2.84 116.97 118.95 2fhf h TYR 564 Ca -0.28 0.00 -0.40 0.00 2.00 0.00 0.00 58.73 60.04 2fhf h TYR 564 Cb 1.13 0.00 -0.39 0.00 2.00 0.00 0.00 36.73 39.47 2fhf h TYR 564 CO 0.49 0.05 -0.90 2.41 -0.00 0.00 0.00 178.16 180.21 2fhf n THR 565 N -3.14 2.02 -3.90 -2.88 -1.04 -1.26 -4.82 114.28 99.26 2fhf n THR 565 Ca 0.02 -3.63 -0.13 0.00 -2.04 0.00 0.00 64.05 58.27 2fhf n THR 565 Cb 0.41 -0.23 -0.14 0.00 -1.82 0.00 0.00 70.33 68.54 2fhf n THR 565 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 2fhf s VAL 566 N -4.09 0.04 0.68 12.58 1.01 -1.26 -4.41 120.40 124.96 2fhf s VAL 566 Ca 0.42 -0.01 -0.16 0.00 0.00 0.00 0.00 61.98 62.23 2fhf s VAL 566 Cb 0.38 -0.06 0.01 0.00 0.00 0.00 0.00 36.38 36.71 2fhf s VAL 566 CO -0.00 0.02 1.16 -2.84 0.00 0.00 0.00 175.10 173.44 2fhf s PRO 567 N 0.07 2.53 0.35 2.72 0.02 -1.26 -0.29 135.00 139.14 2fhf s PRO 567 Ca -0.01 1.61 -0.28 0.00 0.02 0.00 0.00 61.00 62.34 2fhf s PRO 567 Cb -0.01 -1.90 -0.11 0.00 0.02 0.00 0.00 34.50 32.50 2fhf s PRO 567 CO -0.00 -1.50 1.38 -2.00 -0.33 0.00 0.00 177.00 174.55 2fhf s GLU 568 N -3.90 4.25 0.05 5.54 2.56 -0.22 -4.27 118.70 122.71 2fhf s GLU 568 Ca 0.71 2.36 -0.06 0.00 0.00 0.00 0.00 54.97 57.98 2fhf s GLU 568 Cb -0.25 -3.03 -0.29 0.00 2.00 0.00 0.00 34.13 32.56 2fhf s GLU 568 CO 0.42 -0.33 1.05 0.78 -0.56 0.00 0.00 175.26 176.62 2fhf h GLY 569 N 3.22 0.36 2.00 -1.50 0.00 -1.92 -3.34 103.07 101.88 2fhf h GLY 569 Ca -0.50 -0.91 0.00 0.00 0.00 0.00 0.00 47.33 45.92 2fhf h GLY 569 CO 0.65 0.80 0.00 1.48 0.00 0.00 0.00 176.54 179.46 2fhf h SER 570 N 0.08 0.00 -0.04 0.19 4.64 -1.92 -1.67 113.55 114.84 2fhf h SER 570 Ca -0.18 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.14 2fhf h SER 570 Cb 2.01 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 64.10 2fhf h SER 570 CO 0.21 0.00 0.00 -1.22 -0.87 0.00 0.00 176.83 174.95 2fhf n TYR 571 N -2.78 0.03 -4.02 4.77 4.01 -1.25 -4.85 117.16 113.07 2fhf n TYR 571 Ca -0.01 -0.02 -0.27 0.00 -0.16 0.00 0.00 57.90 57.45 2fhf n TYR 571 Cb 0.16 0.00 -0.05 0.00 -0.31 0.00 0.00 39.34 39.14 2fhf n TYR 571 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2fhf s ALA 572 N -1.97 3.74 0.19 -0.72 0.00 -0.63 -0.88 121.76 121.50 2fhf s ALA 572 Ca 0.38 -1.11 0.20 0.00 0.00 0.00 0.00 51.96 51.43 2fhf s ALA 572 Cb 0.20 -1.55 0.76 0.00 0.00 0.00 0.00 23.12 22.54 2fhf s ALA 572 CO 0.32 0.56 1.77 1.79 0.00 0.00 0.00 175.76 180.20 2fhf h THR 573 N 1.95 0.85 -3.09 0.00 1.35 -1.88 -3.39 112.91 108.70 2fhf h THR 573 Ca -0.48 -1.40 -0.54 0.00 -0.55 0.00 0.00 66.41 63.45 2fhf h THR 573 Cb 1.19 1.86 -0.40 0.00 -1.73 0.00 0.00 68.15 69.07 2fhf h THR 573 CO 0.66 0.33 -0.76 -0.62 -0.25 0.00 0.00 175.52 174.88 2fhf s ASP 574 N -6.42 3.39 0.00 5.36 -1.08 -1.26 -5.02 116.67 111.64 2fhf s ASP 574 Ca -0.00 -1.19 0.28 0.00 -0.52 0.00 0.00 52.55 51.12 2fhf s ASP 574 Cb 0.11 -0.59 1.70 0.00 -1.46 0.00 0.00 42.92 42.68 2fhf s ASP 574 CO 0.68 -0.38 2.06 -0.81 0.52 0.00 0.00 175.17 177.23 2fhf n PRO 575 N 5.06 0.93 -3.12 4.34 -0.04 -1.26 -3.98 135.00 136.93 2fhf n PRO 575 Ca -0.06 0.00 -0.43 0.00 -0.04 0.00 0.00 63.50 62.97 2fhf n PRO 575 Cb 0.44 -1.48 -0.07 0.00 -0.04 0.00 0.00 33.50 32.36 2fhf n PRO 575 CO 0.00 0.00 0.00 -2.00 -0.04 0.00 0.00 175.50 173.46 2fhf s GLU 576 N -2.00 3.23 1.93 0.54 2.56 -1.26 -3.18 118.70 120.51 2fhf s GLU 576 Ca 0.43 -0.50 0.00 0.00 0.00 0.00 0.00 54.97 54.90 2fhf s GLU 576 Cb 0.20 -3.99 0.00 0.00 2.00 0.00 0.00 34.13 32.34 2fhf s GLU 576 CO 0.33 -1.06 0.00 0.41 -0.56 0.00 0.00 175.26 174.38 2fhf n GLY 577 N 5.07 -0.43 0.12 -1.50 0.00 -0.79 -4.37 105.19 103.29 2fhf n GLY 577 Ca -0.03 -1.37 0.12 0.00 0.00 0.00 0.00 46.02 44.74 2fhf n GLY 577 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2fhf n THR 578 N 0.00 0.74 -0.29 2.61 -2.24 -1.26 -4.15 114.28 109.69 2fhf n THR 578 Ca 0.00 0.05 0.11 0.00 -2.27 0.00 0.00 64.05 61.94 2fhf n THR 578 Cb 0.00 -0.95 0.26 0.00 -2.10 0.00 0.00 70.33 67.53 2fhf n THR 578 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2fhf h ALA 579 N 2.37 1.16 -0.12 6.98 0.00 -1.82 -0.21 119.26 127.62 2fhf h ALA 579 Ca 0.00 0.23 0.04 0.00 0.00 0.00 0.00 54.91 55.17 2fhf h ALA 579 Cb 0.49 0.34 -0.00 0.00 0.00 0.00 0.00 17.79 18.62 2fhf h ALA 579 CO 0.00 -0.45 0.13 0.07 0.00 0.00 0.00 179.25 179.00 2fhf h ARG 580 N 0.19 0.00 -0.19 0.00 0.11 -1.72 -2.70 114.38 110.07 2fhf h ARG 580 Ca 0.52 0.00 -0.02 0.00 0.10 0.00 0.00 59.98 60.57 2fhf h ARG 580 Cb 1.01 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 32.08 2fhf h ARG 580 CO -0.65 0.00 0.03 0.82 0.10 0.00 0.00 179.97 180.27 2fhf h ILE 581 N 0.00 1.22 -0.26 0.08 2.04 -1.33 -1.03 117.51 118.23 2fhf h ILE 581 Ca 0.06 -0.73 -0.14 0.00 1.00 0.00 0.00 64.86 65.05 2fhf h ILE 581 Cb 0.31 1.34 -0.01 0.00 -0.74 0.00 0.00 36.82 37.73 2fhf h ILE 581 CO -0.00 0.22 -0.42 0.50 0.00 0.00 0.00 178.15 178.45 2fhf h LYS 582 N 0.10 0.64 -0.67 2.37 3.64 -1.60 -2.32 116.57 118.73 2fhf h LYS 582 Ca 0.06 -0.34 -0.07 0.00 -1.27 0.00 0.00 60.65 59.02 2fhf h LYS 582 Cb 0.31 0.01 -0.03 0.00 -0.41 0.00 0.00 32.23 32.12 2fhf h LYS 582 CO 0.00 0.94 0.13 0.93 -2.27 0.00 0.00 179.45 179.19 2fhf h GLU 583 N 0.52 1.10 -0.39 1.90 5.08 -1.46 0.70 114.58 122.04 2fhf h GLU 583 Ca 0.04 -0.28 -0.02 0.00 -1.00 0.00 0.00 59.36 58.10 2fhf h GLU 583 Cb 0.95 -0.14 -0.02 0.00 0.50 0.00 0.00 28.75 30.05 2fhf h GLU 583 CO 0.09 0.99 0.17 0.35 -1.00 0.00 0.00 179.01 179.61 2fhf h PHE 584 N 1.02 0.57 -0.56 4.33 3.57 -1.11 -1.83 116.94 122.92 2fhf h PHE 584 Ca 0.21 -0.03 -0.06 0.00 3.53 0.00 0.00 57.97 61.61 2fhf h PHE 584 Cb 0.41 -0.17 -0.02 0.00 2.79 0.00 0.00 35.95 38.95 2fhf h PHE 584 CO 0.03 0.49 0.10 0.00 -2.23 0.00 0.00 178.31 176.71 2fhf h ARG 585 N 0.48 0.89 -0.87 1.11 3.08 -1.13 -1.62 114.38 116.32 2fhf h ARG 585 Ca 0.13 -0.21 -0.01 0.00 0.07 0.00 0.00 59.98 59.96 2fhf h ARG 585 Cb 0.15 -0.12 -0.04 0.00 0.08 0.00 0.00 29.97 30.04 2fhf h ARG 585 CO -0.01 0.82 0.50 1.15 -1.07 0.00 0.00 179.97 181.36 2fhf h THR 586 N 0.85 1.25 -0.18 2.04 2.02 -0.52 0.46 112.91 118.83 2fhf h THR 586 Ca 0.18 -0.58 -0.02 0.00 0.77 0.00 0.00 66.41 66.75 2fhf h THR 586 Cb 0.36 0.04 -0.01 0.00 -1.74 0.00 0.00 68.15 66.81 2fhf h THR 586 CO 0.01 0.27 0.02 -0.03 0.37 0.00 0.00 175.52 176.16 2fhf h MET 587 N 1.21 0.30 -0.55 6.66 1.85 -0.86 -0.67 114.93 122.86 2fhf h MET 587 Ca 0.31 -0.08 0.04 0.00 -0.61 0.00 0.00 59.70 59.36 2fhf h MET 587 Cb -0.01 -0.03 -0.04 0.00 0.43 0.00 0.00 31.60 31.94 2fhf h MET 587 CO -0.05 0.47 0.30 0.82 -0.40 0.00 0.00 176.91 178.05 2fhf h ILE 588 N 0.07 0.99 -0.77 1.77 1.08 -0.81 -1.00 117.51 118.85 2fhf h ILE 588 Ca 0.05 -0.20 -0.01 0.00 -0.39 0.00 0.00 64.86 64.31 2fhf h ILE 588 Cb 0.33 0.36 -0.04 0.00 -3.07 0.00 0.00 36.82 34.40 2fhf h ILE 588 CO 0.00 0.11 0.43 -0.61 -0.69 0.00 0.00 178.15 177.40 2fhf h GLN 589 N 0.58 1.07 -0.54 2.37 4.15 -0.78 -2.13 115.11 119.84 2fhf h GLN 589 Ca 0.23 -0.12 -0.03 0.00 0.77 0.00 0.00 58.65 59.51 2fhf h GLN 589 Cb 0.10 -0.21 -0.02 0.00 0.21 0.00 0.00 27.48 27.56 2fhf h GLN 589 CO -0.14 0.78 0.22 0.00 -1.93 0.00 0.00 178.83 177.77 2fhf h ALA 590 N 1.23 0.69 -0.13 3.38 0.00 -0.39 0.12 119.26 124.16 2fhf h ALA 590 Ca 0.27 -0.15 -0.01 0.00 0.00 0.00 0.00 54.91 55.03 2fhf h ALA 590 Cb 0.01 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 2fhf h ALA 590 CO -0.05 0.29 0.06 0.82 0.00 0.00 0.00 179.25 180.38 2fhf h ILE 591 N 0.72 1.13 -0.05 0.00 2.04 -0.93 0.05 117.51 120.47 2fhf h ILE 591 Ca 0.18 -0.37 -0.06 0.00 1.00 0.00 0.00 64.86 65.61 2fhf h ILE 591 Cb 0.18 1.13 0.00 0.00 -0.74 0.00 0.00 36.82 37.39 2fhf h ILE 591 CO -0.02 0.12 -0.19 0.11 0.00 0.00 0.00 178.15 178.17 2fhf h LYS 592 N 0.08 0.21 0.12 2.37 1.57 -1.32 -0.87 116.57 118.75 2fhf h LYS 592 Ca 0.05 -0.16 -0.19 0.00 -1.87 0.00 0.00 60.65 58.47 2fhf h LYS 592 Cb 0.13 0.03 0.01 0.00 0.08 0.00 0.00 32.23 32.48 2fhf h LYS 592 CO -0.01 0.80 -0.89 0.37 -0.57 0.00 0.00 179.45 179.16 2fhf h GLN 593 N -0.33 0.26 0.00 3.15 4.15 -0.83 -3.03 115.11 118.49 2fhf h GLN 593 Ca -0.01 -0.44 -0.07 0.00 0.77 0.00 0.00 58.65 58.90 2fhf h GLN 593 Cb 0.83 0.17 -0.01 0.00 0.21 0.00 0.00 27.48 28.67 2fhf h GLN 593 CO 0.04 1.21 -1.79 -0.25 -1.93 0.00 0.00 178.83 176.11 2fhf n ASP 594 N -4.13 0.27 -0.00 -0.69 8.00 -0.12 -4.31 116.55 115.56 2fhf n ASP 594 Ca -0.16 0.11 0.07 0.00 0.71 0.00 0.00 54.79 55.52 2fhf n ASP 594 Cb 0.81 1.35 -0.09 0.00 -0.02 0.00 0.00 41.12 43.17 2fhf n ASP 594 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 2fhf n LEU 595 N -2.48 0.59 -1.41 0.64 4.77 -0.47 -5.01 117.00 113.63 2fhf n LEU 595 Ca -0.08 -0.42 -0.13 0.00 -0.03 0.00 0.00 56.01 55.35 2fhf n LEU 595 Cb 0.68 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.75 2fhf n LEU 595 CO 0.44 0.15 -0.16 0.61 -1.33 0.00 0.00 177.39 177.10 2fhf n GLY 596 N 1.40 0.15 3.36 -0.72 0.00 -0.43 -4.75 105.19 104.20 2fhf n GLY 596 Ca 0.02 -0.35 -0.27 0.00 0.00 0.00 0.00 46.02 45.42 2fhf n GLY 596 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2fhf s MET 597 N -4.34 1.31 0.82 1.61 -1.94 -0.60 -4.78 119.30 111.38 2fhf s MET 597 Ca 0.00 -1.29 -0.12 0.00 -1.71 0.00 0.00 55.69 52.57 2fhf s MET 597 Cb 0.00 -1.74 0.08 0.00 2.01 0.00 0.00 34.83 35.19 2fhf s MET 597 CO 0.00 0.41 1.15 -0.80 -0.01 0.00 0.00 175.02 175.77 2fhf s ASN 598 N -2.02 4.39 -0.07 3.03 -0.87 0.03 -3.25 114.94 116.19 2fhf s ASN 598 Ca 0.12 0.93 0.03 0.00 -1.57 0.00 0.00 52.86 52.36 2fhf s ASN 598 Cb -0.10 -1.51 0.01 0.00 -0.02 0.00 0.00 41.25 39.63 2fhf s ASN 598 CO 0.05 -1.99 -0.16 -0.69 -2.57 0.00 0.00 177.10 171.74 2fhf s VAL 599 N -3.43 1.44 -0.06 1.60 1.01 -1.26 -1.08 120.40 118.61 2fhf s VAL 599 Ca 0.62 -0.67 0.04 0.00 0.00 0.00 0.00 61.98 61.97 2fhf s VAL 599 Cb -0.12 -1.28 -0.02 0.00 0.00 0.00 0.00 36.38 34.96 2fhf s VAL 599 CO 0.51 0.42 -0.17 -0.63 0.00 0.00 0.00 175.10 175.23 2fhf s ILE 600 N 0.46 2.77 -0.10 2.22 1.01 -0.18 -0.99 121.20 126.38 2fhf s ILE 600 Ca -0.14 -0.82 -0.01 0.00 0.00 0.00 0.00 60.65 59.68 2fhf s ILE 600 Cb -0.16 -2.07 -0.03 0.00 0.01 0.00 0.00 42.46 40.21 2fhf s ILE 600 CO 0.05 0.57 -0.05 -0.04 0.00 0.00 0.00 174.94 175.48 2fhf s MET 601 N -0.42 3.12 -0.09 2.79 -1.94 -0.48 -0.93 119.30 121.35 2fhf s MET 601 Ca 0.04 -0.51 -0.28 0.00 -1.71 0.00 0.00 55.69 53.23 2fhf s MET 601 Cb -0.12 -2.74 -0.02 0.00 2.01 0.00 0.00 34.83 33.96 2fhf s MET 601 CO 0.02 0.52 0.94 0.34 -0.01 0.00 0.00 175.02 176.83 2fhf s ASP 602 N -0.40 7.20 0.08 3.03 -1.08 -0.85 -1.11 116.67 123.55 2fhf s ASP 602 Ca 0.06 1.47 0.09 0.00 -0.52 0.00 0.00 52.55 53.65 2fhf s ASP 602 Cb -0.12 -2.53 -0.03 0.00 -1.46 0.00 0.00 42.92 38.78 2fhf s ASP 602 CO 0.02 -0.37 -0.24 0.68 0.52 0.00 0.00 175.17 175.78 2fhf s VAL 603 N 1.72 1.99 -0.51 1.11 -7.23 -0.54 -4.46 120.40 112.48 2fhf s VAL 603 Ca 0.46 -1.50 0.07 0.00 -1.81 0.00 0.00 61.98 59.21 2fhf s VAL 603 Cb -0.18 -1.75 0.30 0.00 0.56 0.00 0.00 36.38 35.30 2fhf s VAL 603 CO 0.19 0.16 0.75 0.52 -0.31 0.00 0.00 175.10 176.41 2fhf n VAL 604 N 1.37 1.34 1.54 1.32 0.31 -1.26 -1.11 118.33 121.84 2fhf n VAL 604 Ca -0.18 -4.92 0.15 0.00 -0.01 0.00 0.00 64.34 59.38 2fhf n VAL 604 Cb 0.53 -1.49 0.74 0.00 -0.91 0.00 0.00 33.84 32.71 2fhf n VAL 604 CO 0.00 0.00 0.00 -1.22 -1.32 0.00 0.00 176.83 174.29 2fhf n TYR 605 N 0.55 0.00 0.53 3.52 4.01 -1.26 -3.83 117.16 120.69 2fhf n TYR 605 Ca 0.27 0.00 0.12 0.00 -0.16 0.00 0.00 57.90 58.13 2fhf n TYR 605 Cb 0.48 -0.19 0.45 0.00 -0.31 0.00 0.00 39.34 39.78 2fhf n TYR 605 CO 0.00 0.00 0.00 0.27 -0.46 0.00 0.00 176.86 176.67 2fhf n ASN 606 N -1.08 0.67 -3.56 7.72 6.94 -1.26 -4.73 115.26 119.97 2fhf n ASN 606 Ca 0.16 0.61 -0.10 0.00 -0.02 0.00 0.00 54.58 55.24 2fhf n ASN 606 Cb 0.23 -0.78 -0.02 0.00 -2.36 0.00 0.00 39.78 36.85 2fhf n ASN 606 CO 0.00 0.00 0.00 -1.38 -1.03 0.00 0.00 177.26 174.85 2fhf s HIS 607 N -3.20 -0.40 0.29 -2.53 -3.43 -1.25 -1.38 115.29 103.40 2fhf s HIS 607 Ca 0.08 0.14 0.09 0.00 -0.80 0.00 0.00 55.06 54.56 2fhf s HIS 607 Cb 0.11 0.60 -0.04 0.00 -1.43 0.00 0.00 32.58 31.81 2fhf s HIS 607 CO 0.48 -0.89 0.07 0.95 -2.00 0.00 0.00 174.74 173.35 2fhf s THR 608 N -3.66 3.38 0.35 -5.38 -4.23 -0.06 -4.64 115.64 101.41 2fhf s THR 608 Ca 0.05 -1.79 0.05 0.00 -1.18 0.00 0.00 61.69 58.81 2fhf s THR 608 Cb -0.02 -2.94 0.19 0.00 1.34 0.00 0.00 72.50 71.06 2fhf s THR 608 CO -0.07 -0.30 1.92 -1.13 -0.54 0.00 0.00 174.62 174.50 2fhf h ASN 609 N 1.73 0.49 -5.09 3.99 -0.73 -1.68 -3.00 115.58 111.29 2fhf h ASN 609 Ca -0.44 -0.07 0.10 0.00 1.87 0.00 0.00 56.30 57.76 2fhf h ASN 609 Cb 1.25 -0.13 -0.07 0.00 0.27 0.00 0.00 38.32 39.64 2fhf h ASN 609 CO 0.62 0.51 0.33 0.00 -0.37 0.00 0.00 177.43 178.52 2fhf s ALA 610 N -5.11 -1.45 0.13 1.57 0.00 -1.26 -4.63 121.76 111.00 2fhf s ALA 610 Ca -0.08 0.01 0.03 0.00 0.00 0.00 0.00 51.96 51.92 2fhf s ALA 610 Cb 0.16 0.75 -0.01 0.00 0.00 0.00 0.00 23.12 24.02 2fhf s ALA 610 CO 0.76 -0.99 0.11 0.00 0.00 0.00 0.00 175.76 175.63 2fhf n ALA 611 N -0.44 0.28 0.00 0.00 0.00 -1.26 -4.37 120.51 114.72 2fhf n ALA 611 Ca -0.06 -0.75 0.00 0.00 0.00 0.00 0.00 53.44 52.63 2fhf n ALA 611 Cb 0.60 0.60 0.00 0.00 0.00 0.00 0.00 19.45 20.66 2fhf n ALA 611 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2fhf n GLY 612 N -0.24 -0.29 0.37 0.00 0.00 -1.26 -4.47 105.19 99.30 2fhf n GLY 612 Ca 0.03 -1.77 0.13 0.00 0.00 0.00 0.00 46.02 44.41 2fhf n GLY 612 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2fhf n PRO 613 N -0.24 1.51 -0.01 1.61 -0.04 -1.26 -4.40 135.00 132.18 2fhf n PRO 613 Ca 0.00 -0.75 -0.01 0.00 -0.04 0.00 0.00 63.50 62.70 2fhf n PRO 613 Cb 0.00 -1.45 -0.01 0.00 -0.04 0.00 0.00 33.50 32.00 2fhf n PRO 613 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 2fhf n THR 614 N -0.07 0.10 -1.91 0.52 -2.24 -1.26 -5.05 114.28 104.37 2fhf n THR 614 Ca 0.19 -0.06 -0.41 0.00 -2.27 0.00 0.00 64.05 61.50 2fhf n THR 614 Cb 0.28 -0.88 -0.01 0.00 -2.10 0.00 0.00 70.33 67.62 2fhf n THR 614 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2fhf s ASP 615 N -3.38 6.52 0.36 3.42 -1.08 -1.26 -4.90 116.67 116.34 2fhf s ASP 615 Ca -0.01 2.85 0.09 0.00 -0.52 0.00 0.00 52.55 54.96 2fhf s ASP 615 Cb 0.00 -2.64 0.81 0.00 -1.46 0.00 0.00 42.92 39.64 2fhf s ASP 615 CO 0.06 -0.78 1.88 -0.09 0.52 0.00 0.00 175.17 176.76 2fhf h ARG 616 N 4.17 0.67 -0.07 4.34 2.43 -1.96 -2.28 114.38 121.68 2fhf h ARG 616 Ca -0.48 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 58.65 2fhf h ARG 616 Cb 1.23 -0.15 0.00 0.00 -0.42 0.00 0.00 29.97 30.62 2fhf h ARG 616 CO 0.72 0.45 0.00 0.25 -1.51 0.00 0.00 179.97 179.88 2fhf n THR 617 N -4.55 0.07 -2.60 0.20 -2.24 -1.26 -4.82 114.28 99.07 2fhf n THR 617 Ca 0.16 -0.34 -0.43 0.00 -2.27 0.00 0.00 64.05 61.17 2fhf n THR 617 Cb 0.44 0.70 -0.02 0.00 -2.10 0.00 0.00 70.33 69.35 2fhf n THR 617 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 2fhf s SER 618 N -1.89 6.74 -0.02 3.42 0.15 -0.86 -4.46 113.70 116.78 2fhf s SER 618 Ca 0.35 0.72 -0.04 0.00 0.70 0.00 0.00 55.95 57.68 2fhf s SER 618 Cb 0.20 -2.55 -0.01 0.00 -1.71 0.00 0.00 66.02 61.95 2fhf s SER 618 CO 0.31 -1.11 -0.08 0.52 1.20 0.00 0.00 173.24 174.08 2fhf n VAL 619 N 6.46 0.62 -0.18 4.45 0.31 -1.26 -4.55 118.33 124.18 2fhf n VAL 619 Ca 0.12 0.26 -0.03 0.00 -0.01 0.00 0.00 64.34 64.69 2fhf n VAL 619 Cb 0.48 -1.58 0.07 0.00 -0.91 0.00 0.00 33.84 31.91 2fhf n VAL 619 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 2fhf h LEU 620 N -0.23 0.30 0.00 7.52 3.38 -1.90 -2.21 115.31 122.17 2fhf h LEU 620 Ca 0.00 0.05 0.00 0.00 0.09 0.00 0.00 57.88 58.02 2fhf h LEU 620 Cb 0.23 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.98 2fhf h LEU 620 CO 0.00 0.20 0.00 -0.67 0.09 0.00 0.00 178.44 178.06 2fhf n ASP 621 N -4.93 0.00 -0.03 -0.43 2.03 -1.26 -2.19 116.55 109.74 2fhf n ASP 621 Ca 0.06 -0.06 -0.15 0.00 0.52 0.00 0.00 54.79 55.16 2fhf n ASP 621 Cb 0.19 -0.26 -0.14 0.00 -0.72 0.00 0.00 41.12 40.19 2fhf n ASP 621 CO 0.00 0.00 0.00 0.29 -1.92 0.00 0.00 177.20 175.57 2fhf n LYS 622 N -1.26 0.70 0.02 -0.67 5.02 -0.85 -3.52 118.16 117.59 2fhf n LYS 622 Ca 0.10 0.23 -0.18 0.00 -2.02 0.00 0.00 58.31 56.44 2fhf n LYS 622 Cb 0.16 -1.70 -0.12 0.00 -0.02 0.00 0.00 35.03 33.35 2fhf n LYS 622 CO 0.00 0.00 0.00 0.82 -0.52 0.00 0.00 177.40 177.70 2fhf h ILE 623 N 0.03 1.45 -2.66 -0.18 1.08 -1.29 -3.39 117.51 112.55 2fhf h ILE 623 Ca -0.41 -2.22 -0.60 0.00 -0.39 0.00 0.00 64.86 61.24 2fhf h ILE 623 Cb 2.03 2.77 -0.39 0.00 -3.07 0.00 0.00 36.82 38.16 2fhf h ILE 623 CO 0.06 0.64 -0.82 -0.69 -0.69 0.00 0.00 178.15 176.65 2fhf s VAL 624 N -2.99 1.24 0.23 1.67 1.01 -0.93 -4.77 120.40 115.87 2fhf s VAL 624 Ca -0.13 -3.13 -0.31 0.00 0.00 0.00 0.00 61.98 58.41 2fhf s VAL 624 Cb 0.03 -1.84 -0.15 0.00 0.00 0.00 0.00 36.38 34.42 2fhf s VAL 624 CO 0.83 -1.12 1.16 -2.65 0.00 0.00 0.00 175.10 173.31 2fhf n PRO 625 N 2.67 1.42 -1.13 2.72 -0.02 -1.23 -2.52 135.00 136.91 2fhf n PRO 625 Ca 0.24 0.50 -0.05 0.00 -2.02 0.00 0.00 63.50 62.18 2fhf n PRO 625 Cb 0.42 -1.99 -0.02 0.00 -0.02 0.00 0.00 33.50 31.89 2fhf n PRO 625 CO 0.00 0.00 0.00 0.91 1.98 0.00 0.00 175.50 178.39 2fhf n TRP 626 N 1.11 0.00 -0.13 6.00 7.02 -1.26 -4.85 117.44 125.33 2fhf n TRP 626 Ca 0.12 0.00 -0.26 0.00 -1.02 0.00 0.00 57.50 56.35 2fhf n TRP 626 Cb 0.29 -2.00 -0.10 0.00 -2.42 0.00 0.00 31.31 27.08 2fhf n TRP 626 CO 0.00 0.00 0.00 0.98 -2.02 0.00 0.00 177.69 176.65 2fhf n TYR 627 N -2.26 0.00 0.93 -5.99 9.36 -1.05 -4.57 117.16 113.59 2fhf n TYR 627 Ca -0.05 0.00 0.14 0.00 3.32 0.00 0.00 57.90 61.31 2fhf n TYR 627 Cb 0.45 -0.94 0.58 0.00 -0.63 0.00 0.00 39.34 38.80 2fhf n TYR 627 CO 0.00 0.00 0.00 0.66 0.22 0.00 0.00 176.86 177.74 2fhf n TYR 628 N -3.94 0.13 -4.14 2.98 4.01 -1.26 -4.77 117.16 110.17 2fhf n TYR 628 Ca -0.50 0.04 -0.28 0.00 -0.16 0.00 0.00 57.90 57.00 2fhf n TYR 628 Cb 0.89 -0.56 -0.07 0.00 -0.31 0.00 0.00 39.34 39.29 2fhf n TYR 628 CO 0.00 0.00 0.00 -0.65 -0.46 0.00 0.00 176.86 175.75 2fhf s GLN 629 N -3.01 2.62 -0.08 -0.72 -1.52 -1.26 -1.09 119.66 114.59 2fhf s GLN 629 Ca 0.13 -0.94 -0.20 0.00 -1.95 0.00 0.00 55.36 52.40 2fhf s GLN 629 Cb 0.18 -2.52 -0.04 0.00 -0.22 0.00 0.00 33.01 30.41 2fhf s GLN 629 CO 0.53 0.49 0.57 0.50 -0.25 0.00 0.00 175.29 177.13 2fhf s ARG 630 N -2.78 4.36 0.21 2.91 3.52 -0.53 -4.54 118.95 122.11 2fhf s ARG 630 Ca 0.28 0.63 0.09 0.00 -0.13 0.00 0.00 55.73 56.61 2fhf s ARG 630 Cb -0.10 -3.42 -0.04 0.00 -1.56 0.00 0.00 34.95 29.82 2fhf s ARG 630 CO 0.20 0.16 -0.09 -0.51 -0.81 0.00 0.00 175.30 174.26 2fhf s LEU 631 N 0.55 2.98 0.23 -0.88 1.43 -1.26 -1.42 118.68 120.30 2fhf s LEU 631 Ca 0.31 -0.64 -0.30 0.00 -1.03 0.00 0.00 54.13 52.46 2fhf s LEU 631 Cb -0.16 -1.61 -0.09 0.00 0.03 0.00 0.00 46.19 44.36 2fhf s LEU 631 CO 0.14 0.07 1.32 0.21 0.23 0.00 0.00 176.35 178.33 2fhf s ASN 632 N -3.09 6.85 0.59 2.29 3.84 -0.26 -4.88 114.94 120.28 2fhf s ASN 632 Ca 0.27 2.48 0.30 0.00 0.21 0.00 0.00 52.86 56.12 2fhf s ASN 632 Cb -0.08 -2.62 1.82 0.00 -0.55 0.00 0.00 41.25 39.83 2fhf s ASN 632 CO 0.16 -0.54 2.25 -0.33 -2.79 0.00 0.00 177.10 175.84 2fhf h GLU 633 N 4.97 0.00 0.00 0.43 3.07 -1.92 -1.98 114.58 119.15 2fhf h GLU 633 Ca -0.46 0.00 -0.41 0.00 -0.50 0.00 0.00 59.36 57.99 2fhf h GLU 633 Cb 1.22 0.00 -0.07 0.00 -0.84 0.00 0.00 28.75 29.06 2fhf h GLU 633 CO 0.75 0.00 -2.50 2.41 -1.40 0.00 0.00 179.01 178.28 2fhf n THR 634 N -3.83 1.49 0.02 1.13 -1.04 -1.26 -4.24 114.28 106.55 2fhf n THR 634 Ca -0.03 -0.50 0.05 0.00 -2.04 0.00 0.00 64.05 61.53 2fhf n THR 634 Cb 0.10 -1.58 -0.10 0.00 -1.82 0.00 0.00 70.33 66.94 2fhf n THR 634 CO 0.00 0.00 0.00 0.35 -0.64 0.00 0.00 175.07 174.78 2fhf n THR 635 N -3.60 0.70 -0.86 12.58 -2.24 -1.24 -1.12 114.28 118.50 2fhf n THR 635 Ca -0.49 -0.62 0.00 0.00 -2.27 0.00 0.00 64.05 60.67 2fhf n THR 635 Cb 0.95 -0.37 0.00 0.00 -2.10 0.00 0.00 70.33 68.81 2fhf n THR 635 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2fhf n GLY 636 N 1.35 0.90 3.77 3.38 0.00 -0.74 -4.10 105.19 109.74 2fhf n GLY 636 Ca -0.09 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.54 2fhf n GLY 636 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2fhf s SER 637 N -2.92 6.65 0.01 1.61 0.01 -1.26 -4.60 113.70 113.20 2fhf s SER 637 Ca 0.00 2.49 -0.30 0.00 1.31 0.00 0.00 55.95 59.45 2fhf s SER 637 Cb 0.00 -2.63 -0.06 0.00 0.21 0.00 0.00 66.02 63.54 2fhf s SER 637 CO 0.00 -0.60 1.48 -0.69 0.41 0.00 0.00 173.24 173.85 2fhf s VAL 638 N -1.27 3.52 0.63 3.43 1.01 -1.26 -1.10 120.40 125.36 2fhf s VAL 638 Ca 0.53 0.91 -0.16 0.00 0.00 0.00 0.00 61.98 63.26 2fhf s VAL 638 Cb -0.35 -3.58 -0.02 0.00 0.00 0.00 0.00 36.38 32.43 2fhf s VAL 638 CO 0.45 -0.01 1.11 -1.61 0.00 0.00 0.00 175.10 175.05 2fhf s GLU 639 N 2.57 2.96 -0.12 2.72 2.02 -0.51 -4.86 118.70 123.47 2fhf s GLU 639 Ca 0.67 1.44 0.18 0.00 0.02 0.00 0.00 54.97 57.28 2fhf s GLU 639 Cb -0.34 -1.97 0.43 0.00 0.10 0.00 0.00 34.13 32.36 2fhf s GLU 639 CO 0.28 -1.14 1.19 -1.13 0.02 0.00 0.00 175.26 174.49 2fhf n SER 640 N -2.12 1.53 0.26 -0.19 3.41 -1.25 -1.08 113.62 114.18 2fhf n SER 640 Ca 0.11 -2.99 0.10 0.00 -0.26 0.00 0.00 58.87 55.83 2fhf n SER 640 Cb 0.52 -0.42 0.67 0.00 -0.26 0.00 0.00 64.21 64.72 2fhf n SER 640 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2fhf h ALA 641 N 1.12 1.66 0.00 7.33 0.00 -1.94 -1.38 119.26 126.04 2fhf h ALA 641 Ca -0.09 -0.08 -0.02 0.00 0.00 0.00 0.00 54.91 54.73 2fhf h ALA 641 Cb 1.43 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 19.20 2fhf h ALA 641 CO 0.08 0.10 -0.08 1.79 0.00 0.00 0.00 179.25 181.15 2fhf h THR 642 N 0.00 0.14 0.00 0.00 1.35 -1.92 -3.46 112.91 109.01 2fhf h THR 642 Ca -0.00 -1.12 0.00 0.00 -0.55 0.00 0.00 66.41 64.74 2fhf h THR 642 Cb 0.17 2.00 0.00 0.00 -1.73 0.00 0.00 68.15 68.59 2fhf h THR 642 CO 0.01 0.08 0.00 0.00 -0.25 0.00 0.00 175.52 175.36 2fhf s SER 645 N 1.00 6.15 0.19 0.00 0.01 -1.14 -3.93 113.70 115.98 2fhf s SER 645 Ca 0.00 -2.81 -0.32 0.00 1.31 0.00 0.00 55.95 54.12 2fhf s SER 645 Cb 0.00 -2.06 -0.15 0.00 0.21 0.00 0.00 66.02 64.02 2fhf s SER 645 CO 0.00 -0.47 1.25 0.47 0.41 0.00 0.00 173.24 174.90 2fhf n ASP 646 N 3.70 1.81 -4.90 2.44 10.43 -0.24 -0.88 116.55 128.91 2fhf n ASP 646 Ca 0.12 1.14 -0.21 0.00 2.57 0.00 0.00 54.79 58.41 2fhf n ASP 646 Cb 0.43 -1.28 0.06 0.00 1.84 0.00 0.00 41.12 42.16 2fhf n ASP 646 CO 0.00 0.00 0.00 -0.94 -1.07 0.00 0.00 177.20 175.19 2fhf s SER 647 N 0.12 5.04 -0.65 -2.24 1.04 -0.48 -1.45 113.70 115.09 2fhf s SER 647 Ca 0.72 -0.26 0.05 0.00 0.48 0.00 0.00 55.95 56.95 2fhf s SER 647 Cb -0.79 -0.47 0.19 0.00 0.10 0.00 0.00 66.02 65.05 2fhf s SER 647 CO 0.51 -1.32 0.55 0.00 0.98 0.00 0.00 173.24 173.96 2fhf n ALA 648 N -2.41 3.51 0.19 5.32 0.00 -0.25 -3.77 120.51 123.10 2fhf n ALA 648 Ca 0.11 -4.42 0.10 0.00 0.00 0.00 0.00 53.44 49.22 2fhf n ALA 648 Cb 0.60 -0.96 0.50 0.00 0.00 0.00 0.00 19.45 19.59 2fhf n ALA 648 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 2fhf n PRO 649 N 1.70 0.13 0.06 0.00 -0.02 -1.26 -1.17 135.00 134.44 2fhf n PRO 649 Ca 0.24 0.58 0.12 0.00 -2.02 0.00 0.00 63.50 62.42 2fhf n PRO 649 Cb 0.39 -1.88 0.48 0.00 -0.02 0.00 0.00 33.50 32.46 2fhf n PRO 649 CO 0.00 0.00 0.00 -0.85 1.98 0.00 0.00 175.50 176.63 2fhf n GLU 650 N -2.15 0.12 -3.10 -0.52 0.00 -1.26 -4.17 120.64 109.56 2fhf n GLU 650 Ca -0.01 0.17 -0.39 0.00 0.00 0.00 0.00 57.16 56.93 2fhf n GLU 650 Cb 0.07 -1.66 -0.05 0.00 0.00 0.00 0.00 31.44 29.79 2fhf n GLU 650 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.13 176.12 2fhf s HIS 651 N -3.08 3.55 0.25 -1.84 3.76 -0.32 -4.99 115.29 112.62 2fhf s HIS 651 Ca 0.10 1.16 -0.07 0.00 -0.15 0.00 0.00 55.06 56.10 2fhf s HIS 651 Cb 0.14 -2.76 0.43 0.00 1.11 0.00 0.00 32.58 31.50 2fhf s HIS 651 CO 0.50 0.08 1.62 0.00 -0.85 0.00 0.00 174.74 176.08 2fhf h ARG 652 N 6.82 0.05 0.00 1.40 3.08 -1.87 -1.20 114.38 122.67 2fhf h ARG 652 Ca -0.40 -0.00 -0.02 0.00 0.07 0.00 0.00 59.98 59.63 2fhf h ARG 652 Cb 1.19 -0.01 -0.00 0.00 0.08 0.00 0.00 29.97 31.22 2fhf h ARG 652 CO 0.76 0.04 -0.10 0.52 -1.07 0.00 0.00 179.97 180.11 2fhf h MET 653 N 0.06 0.00 0.13 0.04 2.86 -1.94 -1.74 114.93 114.34 2fhf h MET 653 Ca 0.42 0.00 -0.28 0.00 -2.06 0.00 0.00 59.70 57.78 2fhf h MET 653 Cb 0.73 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.39 2fhf h MET 653 CO -0.74 0.10 -1.29 0.35 1.06 0.00 0.00 176.91 176.39 2fhf h PHE 654 N 0.00 0.52 -0.81 -0.22 -0.00 -1.54 -1.85 116.94 113.04 2fhf h PHE 654 Ca -0.00 -0.38 -0.01 0.00 -0.00 0.00 0.00 57.97 57.58 2fhf h PHE 654 Cb 0.80 -0.02 -0.04 0.00 -0.00 0.00 0.00 35.95 36.69 2fhf h PHE 654 CO 0.00 1.31 0.45 0.00 -0.00 0.00 0.00 178.31 180.07 2fhf h ALA 655 N 0.55 1.28 -0.33 2.41 0.00 -1.14 -0.88 119.26 121.15 2fhf h ALA 655 Ca -0.15 -0.11 -0.05 0.00 0.00 0.00 0.00 54.91 54.59 2fhf h ALA 655 Cb 1.99 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 19.44 2fhf h ALA 655 CO 0.20 0.60 0.01 -0.22 0.00 0.00 0.00 179.25 179.83 2fhf h LYS 656 N 1.13 0.58 -0.62 0.00 3.64 -1.28 -1.57 116.57 118.44 2fhf h LYS 656 Ca 0.29 -0.18 0.06 0.00 -1.27 0.00 0.00 60.65 59.54 2fhf h LYS 656 Cb 0.01 -0.05 -0.05 0.00 -0.41 0.00 0.00 32.23 31.72 2fhf h LYS 656 CO -0.05 0.70 0.34 1.25 -2.27 0.00 0.00 179.45 179.42 2fhf h LEU 657 N 0.39 0.50 0.08 5.20 6.46 -0.70 0.12 115.31 127.35 2fhf h LEU 657 Ca 0.09 0.03 -0.00 0.00 -0.12 0.00 0.00 57.88 57.88 2fhf h LEU 657 Cb 0.44 -0.07 0.00 0.00 -0.73 0.00 0.00 40.66 40.30 2fhf h LEU 657 CO 0.02 0.33 -0.04 0.40 -0.62 0.00 0.00 178.44 178.52 2fhf h ILE 658 N 0.63 0.92 -0.66 4.05 2.04 -1.00 -0.13 117.51 123.35 2fhf h ILE 658 Ca 0.28 -0.00 -0.02 0.00 1.00 0.00 0.00 64.86 66.11 2fhf h ILE 658 Cb 0.17 0.92 -0.03 0.00 -0.74 0.00 0.00 36.82 37.15 2fhf h ILE 658 CO -0.18 0.00 0.33 0.00 0.00 0.00 0.00 178.15 178.30 2fhf h ALA 659 N 0.81 0.85 -0.58 1.87 0.00 -0.84 -1.12 119.26 120.25 2fhf h ALA 659 Ca -0.01 -0.13 -0.06 0.00 0.00 0.00 0.00 54.91 54.71 2fhf h ALA 659 Cb 0.08 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.59 2fhf h ALA 659 CO 0.02 0.40 0.14 -0.44 0.00 0.00 0.00 179.25 179.37 2fhf h ASP 660 N 0.91 0.84 -0.07 0.00 3.45 -0.62 -1.62 116.42 119.31 2fhf h ASP 660 Ca 0.23 -0.16 -0.01 0.00 0.43 0.00 0.00 57.03 57.52 2fhf h ASP 660 Cb 0.10 -0.22 -0.00 0.00 -0.56 0.00 0.00 39.33 38.65 2fhf h ASP 660 CO -0.03 0.82 0.01 -1.28 -1.57 0.00 0.00 179.24 177.19 2fhf h SER 661 N 0.86 0.12 -0.64 6.45 0.87 -0.62 -2.83 113.55 117.76 2fhf h SER 661 Ca 0.19 -0.27 0.04 0.00 -1.23 0.00 0.00 61.79 60.52 2fhf h SER 661 Cb 0.31 -0.03 -0.04 0.00 -0.44 0.00 0.00 62.40 62.21 2fhf h SER 661 CO -0.00 0.35 0.42 -0.07 -0.53 0.00 0.00 176.83 177.00 2fhf h LEU 662 N -0.13 0.63 -0.81 2.23 3.38 -1.05 -1.69 115.31 117.87 2fhf h LEU 662 Ca 0.02 -0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.99 2fhf h LEU 662 Cb 0.29 -0.14 -0.04 0.00 0.09 0.00 0.00 40.66 40.85 2fhf h LEU 662 CO 0.00 0.43 0.50 0.00 0.09 0.00 0.00 178.44 179.46 2fhf h ALA 663 N 1.64 1.03 -0.12 1.53 0.00 -1.09 -0.34 119.26 121.91 2fhf h ALA 663 Ca 0.26 -0.08 -0.03 0.00 0.00 0.00 0.00 54.91 55.06 2fhf h ALA 663 Cb 0.13 -0.33 -0.00 0.00 0.00 0.00 0.00 17.79 17.59 2fhf h ALA 663 CO -0.07 0.48 -0.03 0.28 0.00 0.00 0.00 179.25 179.90 2fhf h VAL 664 N 1.11 1.30 -0.72 0.00 2.07 -1.10 -0.16 116.25 118.75 2fhf h VAL 664 Ca 0.29 -0.99 0.01 0.00 0.82 0.00 0.00 66.70 66.83 2fhf h VAL 664 Cb -0.07 1.72 -0.04 0.00 -1.52 0.00 0.00 31.29 31.39 2fhf h VAL 664 CO -0.06 0.28 0.47 -0.50 0.02 0.00 0.00 177.57 177.79 2fhf h TRP 665 N -0.10 0.90 0.32 1.57 4.06 -1.17 0.13 115.95 121.67 2fhf h TRP 665 Ca 0.03 0.02 -0.02 0.00 2.06 0.00 0.00 58.89 60.98 2fhf h TRP 665 Cb 0.46 -0.31 0.00 0.00 -1.00 0.00 0.00 29.16 28.32 2fhf h TRP 665 CO 0.06 0.57 -0.15 1.15 -3.56 0.00 0.00 178.44 176.50 2fhf h THR 666 N 0.97 0.52 0.03 1.49 2.02 -0.96 -2.55 112.91 114.44 2fhf h THR 666 Ca 0.26 -0.76 -0.00 0.00 0.77 0.00 0.00 66.41 66.69 2fhf h THR 666 Cb -0.11 0.82 0.00 0.00 -1.74 0.00 0.00 68.15 67.12 2fhf h THR 666 CO -0.06 0.11 -0.02 0.74 0.37 0.00 0.00 175.52 176.67 2fhf h THR 667 N -0.93 1.39 0.00 3.16 2.02 -0.98 -2.37 112.91 115.21 2fhf h THR 667 Ca -0.04 -1.68 -0.11 0.00 0.77 0.00 0.00 66.41 65.34 2fhf h THR 667 Cb 0.51 2.46 -0.02 0.00 -1.74 0.00 0.00 68.15 69.37 2fhf h THR 667 CO 0.07 0.41 -0.59 0.44 0.37 0.00 0.00 175.52 176.22 2fhf h ASP 668 N -0.82 0.00 -0.03 4.18 3.45 -0.91 -3.34 116.42 118.96 2fhf h ASP 668 Ca -0.00 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.46 2fhf h ASP 668 Cb 0.70 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.47 2fhf h ASP 668 CO 0.01 0.51 0.00 -1.22 -1.57 0.00 0.00 179.24 176.97 2fhf n TYR 669 N -3.20 0.02 -3.95 4.55 4.01 -1.04 -5.02 117.16 112.53 2fhf n TYR 669 Ca 0.01 -0.04 -0.29 0.00 -0.16 0.00 0.00 57.90 57.42 2fhf n TYR 669 Cb 0.75 -0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.78 2fhf n TYR 669 CO 0.00 0.00 0.00 1.63 -0.46 0.00 0.00 176.86 178.03 2fhf n LYS 670 N 0.38 -4.39 -2.59 -0.72 5.02 -0.89 -4.95 118.16 110.03 2fhf n LYS 670 Ca 0.04 0.51 -0.40 0.00 -2.02 0.00 0.00 58.31 56.44 2fhf n LYS 670 Cb 0.19 -5.13 -0.05 0.00 -0.02 0.00 0.00 35.03 30.03 2fhf n LYS 670 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 2fhf s ILE 671 N -3.52 3.77 -0.21 -0.18 -1.09 -1.03 -4.89 121.20 114.06 2fhf s ILE 671 Ca 0.41 1.75 0.21 0.00 -2.23 0.00 0.00 60.65 60.79 2fhf s ILE 671 Cb -0.21 -4.12 -0.03 0.00 -1.58 0.00 0.00 42.46 36.52 2fhf s ILE 671 CO 0.86 0.41 0.99 0.47 -1.23 0.00 0.00 174.94 176.44 2fhf n ASP 672 N 1.45 0.86 -3.55 3.58 8.00 -0.16 -4.69 116.55 122.04 2fhf n ASP 672 Ca -0.01 0.34 -0.09 0.00 0.71 0.00 0.00 54.79 55.74 2fhf n ASP 672 Cb 0.46 0.37 -0.02 0.00 -0.02 0.00 0.00 41.12 41.91 2fhf n ASP 672 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 2fhf s GLY 673 N -4.47 -0.45 -0.03 0.44 0.00 -1.11 -3.11 107.32 98.59 2fhf s GLY 673 Ca -0.01 0.46 0.03 0.00 0.00 0.00 0.00 44.72 45.20 2fhf s GLY 673 CO 0.80 0.15 -0.12 -1.36 0.00 0.00 0.00 173.10 172.57 2fhf s PHE 674 N -3.56 1.15 -0.37 1.90 0.40 -0.49 -1.39 117.98 115.62 2fhf s PHE 674 Ca 0.05 -0.28 -0.10 0.00 -0.60 0.00 0.00 56.93 55.99 2fhf s PHE 674 Cb -0.02 -0.79 0.03 0.00 0.51 0.00 0.00 43.02 42.76 2fhf s PHE 674 CO -0.07 -0.09 0.19 0.50 0.70 0.00 0.00 175.22 176.45 2fhf s ARG 675 N 0.04 2.77 -0.47 0.44 3.00 -0.27 -2.05 118.95 122.41 2fhf s ARG 675 Ca -0.01 -1.13 -0.28 0.00 -1.00 0.00 0.00 55.73 53.31 2fhf s ARG 675 Cb -0.08 -3.69 0.03 0.00 0.00 0.00 0.00 34.95 31.20 2fhf s ARG 675 CO 0.01 -0.72 1.06 -0.06 0.00 0.00 0.00 175.30 175.59 2fhf s PHE 676 N 1.52 2.85 0.25 5.12 0.40 0.16 -1.47 117.98 126.81 2fhf s PHE 676 Ca 0.01 0.58 -0.30 0.00 -0.60 0.00 0.00 56.93 56.62 2fhf s PHE 676 Cb -0.20 -4.27 -0.10 0.00 0.51 0.00 0.00 43.02 38.97 2fhf s PHE 676 CO 0.06 -1.22 1.44 0.34 0.70 0.00 0.00 175.22 176.54 2fhf s ASP 677 N 2.40 6.65 -1.48 1.36 2.15 -0.27 -2.54 116.67 124.95 2fhf s ASP 677 Ca 0.44 2.67 -0.03 0.00 0.43 0.00 0.00 52.55 56.06 2fhf s ASP 677 Cb -0.08 -2.62 0.00 0.00 -0.30 0.00 0.00 42.92 39.92 2fhf s ASP 677 CO 0.30 -0.70 0.17 0.18 -0.17 0.00 0.00 175.17 174.95 2fhf n LEU 678 N 2.31 -1.30 0.24 -1.34 4.77 -1.26 -4.55 117.00 115.87 2fhf n LEU 678 Ca 0.07 -1.20 0.16 0.00 -0.03 0.00 0.00 56.01 55.01 2fhf n LEU 678 Cb 0.40 -1.78 0.85 0.00 -2.33 0.00 0.00 43.42 40.56 2fhf n LEU 678 CO 0.61 0.48 1.14 -0.03 -1.33 0.00 0.00 177.39 178.25 2fhf h MET 679 N -1.86 0.00 0.00 3.23 4.05 -1.29 -1.57 114.93 117.49 2fhf h MET 679 Ca -0.66 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 58.76 2fhf h MET 679 Cb 1.39 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 32.19 2fhf h MET 679 CO 0.67 0.00 0.00 1.37 0.23 0.00 0.00 176.91 179.18 2fhf h LEU 680 N 0.00 0.00 -0.58 3.39 -0.00 -1.38 -0.11 115.31 116.63 2fhf h LEU 680 Ca 0.06 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.94 2fhf h LEU 680 Cb 0.31 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 40.97 2fhf h LEU 680 CO -0.00 0.00 0.00 -1.22 -0.00 0.00 0.00 178.44 177.22 2fhf n TYR 681 N -3.08 0.07 -4.11 0.17 4.02 -0.59 -4.21 117.16 109.44 2fhf n TYR 681 Ca -0.02 -0.04 -0.32 0.00 -0.01 0.00 0.00 57.90 57.51 2fhf n TYR 681 Cb 0.11 0.00 -0.07 0.00 -0.02 0.00 0.00 39.34 39.36 2fhf n TYR 681 CO 0.00 0.00 0.00 -1.01 -1.01 0.00 0.00 176.86 174.84 2fhf s HIS 682 N -1.93 3.21 0.37 -0.72 3.76 -0.06 -4.77 115.29 115.17 2fhf s HIS 682 Ca 0.34 0.13 -0.26 0.00 -0.15 0.00 0.00 55.06 55.13 2fhf s HIS 682 Cb 0.17 -1.68 -0.09 0.00 1.11 0.00 0.00 32.58 32.10 2fhf s HIS 682 CO 0.28 0.53 1.17 -2.14 -0.85 0.00 0.00 174.74 173.72 2fhf s PRO 683 N -1.99 4.19 0.23 8.40 0.02 -1.26 -1.54 135.00 143.05 2fhf s PRO 683 Ca 0.25 1.85 -0.06 0.00 0.02 0.00 0.00 61.00 63.06 2fhf s PRO 683 Cb -0.12 -2.79 0.35 0.00 0.02 0.00 0.00 34.50 31.96 2fhf s PRO 683 CO 0.17 -0.21 1.80 -0.22 -0.33 0.00 0.00 177.00 178.21 2fhf h LYS 684 N 2.89 0.71 -0.24 5.54 3.64 -1.04 -1.54 116.57 126.53 2fhf h LYS 684 Ca -0.48 -0.04 -0.03 0.00 -1.27 0.00 0.00 60.65 58.82 2fhf h LYS 684 Cb 1.23 -0.16 -0.01 0.00 -0.41 0.00 0.00 32.23 32.88 2fhf h LYS 684 CO 0.63 0.47 0.00 0.00 -2.27 0.00 0.00 179.45 178.28 2fhf h ALA 685 N 1.43 1.56 -0.18 5.00 0.00 -1.91 -2.04 119.26 123.12 2fhf h ALA 685 Ca 0.37 -0.15 -0.13 0.00 0.00 0.00 0.00 54.91 55.00 2fhf h ALA 685 Cb 0.33 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.01 2fhf h ALA 685 CO -0.24 0.33 -0.41 0.37 0.00 0.00 0.00 179.25 179.30 2fhf h GLN 686 N 0.35 0.59 -0.55 0.00 -0.00 -1.67 -1.44 115.11 112.39 2fhf h GLN 686 Ca 0.08 -0.40 -0.02 0.00 -0.00 0.00 0.00 58.65 58.31 2fhf h GLN 686 Cb 0.24 0.06 -0.02 0.00 0.00 0.00 0.00 27.48 27.75 2fhf h GLN 686 CO 0.01 1.02 0.25 0.82 0.00 0.00 0.00 178.83 180.92 2fhf h ILE 687 N 0.25 1.21 -0.54 2.39 1.08 -1.24 -1.24 117.51 119.43 2fhf h ILE 687 Ca -0.00 -0.62 -0.09 0.00 -0.39 0.00 0.00 64.86 63.76 2fhf h ILE 687 Cb 1.02 0.60 -0.02 0.00 -3.07 0.00 0.00 36.82 35.34 2fhf h ILE 687 CO 0.09 0.24 -0.03 -0.07 -0.69 0.00 0.00 178.15 177.69 2fhf h LEU 688 N 0.74 0.92 -0.54 1.44 3.38 -1.37 -0.93 115.31 118.95 2fhf h LEU 688 Ca 0.19 -0.26 -0.05 0.00 0.09 0.00 0.00 57.88 57.85 2fhf h LEU 688 Cb 0.15 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.63 2fhf h LEU 688 CO -0.02 1.00 0.16 -1.28 0.09 0.00 0.00 178.44 178.39 2fhf h SER 689 N 0.86 0.80 -0.81 -0.43 0.87 -1.04 -0.71 113.55 113.08 2fhf h SER 689 Ca 0.15 -0.21 -0.03 0.00 -1.23 0.00 0.00 61.79 60.47 2fhf h SER 689 Cb 0.55 -0.21 -0.04 0.00 -0.44 0.00 0.00 62.40 62.26 2fhf h SER 689 CO 0.03 0.80 0.38 0.00 -0.53 0.00 0.00 176.83 177.51 2fhf h ALA 690 N 1.03 1.12 -0.62 6.23 0.00 -0.98 -1.65 119.26 124.38 2fhf h ALA 690 Ca 0.17 -0.17 -0.08 0.00 0.00 0.00 0.00 54.91 54.84 2fhf h ALA 690 Cb 0.29 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 2fhf h ALA 690 CO -0.00 0.65 0.10 2.35 0.00 0.00 0.00 179.25 182.34 2fhf h TRP 691 N 1.17 1.10 -0.92 0.00 7.01 -0.75 -0.78 115.95 122.78 2fhf h TRP 691 Ca 0.28 -0.16 -0.01 0.00 2.11 0.00 0.00 58.89 61.12 2fhf h TRP 691 Cb 0.14 -0.30 -0.04 0.00 -2.10 0.00 0.00 29.16 26.85 2fhf h TRP 691 CO 0.02 0.94 0.55 0.93 -2.79 0.00 0.00 178.44 178.08 2fhf h GLU 692 N 0.94 1.25 -0.29 2.65 5.08 -0.71 0.21 114.58 123.71 2fhf h GLU 692 Ca 0.19 -0.12 -0.13 0.00 -1.00 0.00 0.00 59.36 58.30 2fhf h GLU 692 Cb 0.44 -0.26 -0.00 0.00 0.50 0.00 0.00 28.75 29.42 2fhf h GLU 692 CO 0.01 0.88 -0.33 0.00 -1.00 0.00 0.00 179.01 178.57 2fhf h ARG 693 N 1.27 0.74 0.00 2.33 2.47 -0.97 -3.23 114.38 116.99 2fhf h ARG 693 Ca 0.33 -0.40 -0.14 0.00 -1.26 0.00 0.00 59.98 58.50 2fhf h ARG 693 Cb -0.04 0.02 -0.02 0.00 -1.65 0.00 0.00 29.97 28.28 2fhf h ARG 693 CO -0.06 1.03 -0.67 0.82 0.56 0.00 0.00 179.97 181.65 2fhf h ILE 694 N 0.49 1.45 0.00 2.04 1.08 -0.88 -2.95 117.51 118.73 2fhf h ILE 694 Ca 0.04 -2.31 -0.01 0.00 -0.39 0.00 0.00 64.86 62.19 2fhf h ILE 694 Cb 0.91 2.26 -0.00 0.00 -3.07 0.00 0.00 36.82 36.92 2fhf h ILE 694 CO 0.08 0.65 -0.03 0.11 -0.69 0.00 0.00 178.15 178.27 2fhf h LYS 695 N 0.00 0.00 0.00 2.37 1.57 -0.98 0.08 116.57 119.62 2fhf h LYS 695 Ca -0.01 0.00 -0.06 0.00 -1.87 0.00 0.00 60.65 58.71 2fhf h LYS 695 Cb 1.20 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.51 2fhf h LYS 695 CO 0.09 0.03 -0.30 0.00 -0.57 0.00 0.00 179.45 178.69 2fhf h ALA 696 N 1.97 0.96 0.08 3.86 0.00 -1.54 -2.36 119.26 122.24 2fhf h ALA 696 Ca -0.00 -0.28 -0.34 0.00 0.00 0.00 0.00 54.91 54.29 2fhf h ALA 696 Cb 0.28 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 18.00 2fhf h ALA 696 CO 0.00 0.38 -1.91 1.28 0.00 0.00 0.00 179.25 179.00 2fhf n LEU 697 N -3.40 2.46 -3.55 0.00 4.77 -0.18 -4.80 117.00 112.32 2fhf n LEU 697 Ca 0.00 0.23 -0.29 0.00 -0.03 0.00 0.00 56.01 55.92 2fhf n LEU 697 Cb 0.50 -1.05 -0.15 0.00 -2.33 0.00 0.00 43.42 40.39 2fhf n LEU 697 CO 0.35 0.72 -0.33 0.21 -1.33 0.00 0.00 177.39 177.01 2fhf s ASN 698 N -6.97 3.46 0.66 -1.43 3.84 -0.16 -5.01 114.94 109.34 2fhf s ASN 698 Ca -0.26 -1.25 0.40 0.00 0.21 0.00 0.00 52.86 51.96 2fhf s ASN 698 Cb 0.07 -0.35 2.20 0.00 -0.55 0.00 0.00 41.25 42.63 2fhf s ASN 698 CO 0.70 -0.43 2.26 1.55 -2.79 0.00 0.00 177.10 178.38 2fhf h PRO 699 N 8.41 0.00 -0.54 0.43 0.13 -1.66 -2.49 132.00 136.29 2fhf h PRO 699 Ca -0.20 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.93 2fhf h PRO 699 Cb 1.02 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.15 2fhf h PRO 699 CO 0.43 0.00 0.00 -0.25 -0.23 0.00 0.00 178.00 177.95 2fhf n ASP 700 N -3.10 3.82 -4.76 1.44 10.43 -1.26 -4.93 116.55 118.19 2fhf n ASP 700 Ca -0.03 -2.21 -0.39 0.00 2.57 0.00 0.00 54.79 54.73 2fhf n ASP 700 Cb 0.15 -0.43 0.03 0.00 1.84 0.00 0.00 41.12 42.71 2fhf n ASP 700 CO 0.00 0.00 0.00 -0.51 -1.07 0.00 0.00 177.20 175.62 2fhf s ILE 701 N -1.39 2.04 -0.09 0.53 1.10 -0.94 -4.75 121.20 117.71 2fhf s ILE 701 Ca 0.40 0.04 0.03 0.00 -0.51 0.00 0.00 60.65 60.61 2fhf s ILE 701 Cb 0.24 -3.02 -0.01 0.00 0.15 0.00 0.00 42.46 39.82 2fhf s ILE 701 CO 0.23 0.00 -0.19 -0.47 -2.11 0.00 0.00 174.94 172.40 2fhf s TYR 702 N -1.23 2.63 -0.08 3.50 5.04 -1.18 -5.01 117.35 121.03 2fhf s TYR 702 Ca 0.65 -0.68 0.03 0.00 -2.44 0.00 0.00 57.07 54.63 2fhf s TYR 702 Cb -0.43 -1.71 -0.02 0.00 0.35 0.00 0.00 41.96 40.15 2fhf s TYR 702 CO 0.54 -0.20 -0.16 -0.06 -1.34 0.00 0.00 175.55 174.33 2fhf s PHE 703 N 0.03 2.68 0.20 4.97 0.40 -1.26 -1.39 117.98 123.61 2fhf s PHE 703 Ca -0.07 -0.42 -0.22 0.00 -0.60 0.00 0.00 56.93 55.62 2fhf s PHE 703 Cb -0.15 -1.69 0.05 0.00 0.51 0.00 0.00 43.02 41.74 2fhf s PHE 703 CO 0.05 -0.02 0.63 -0.59 0.70 0.00 0.00 175.22 175.99 2fhf s PHE 704 N -0.29 -0.38 -0.00 0.36 -0.71 -0.87 -1.51 117.98 114.58 2fhf s PHE 704 Ca 0.02 0.07 -0.01 0.00 -1.04 0.00 0.00 56.93 55.96 2fhf s PHE 704 Cb -0.13 0.59 0.00 0.00 -1.21 0.00 0.00 43.02 42.28 2fhf s PHE 704 CO 0.03 -0.99 0.05 0.41 -1.34 0.00 0.00 175.22 173.38 2fhf n GLY 705 N -0.40 0.59 3.60 1.99 0.00 -0.72 0.35 105.19 110.59 2fhf n GLY 705 Ca -0.12 -0.84 -0.43 0.00 0.00 0.00 0.00 46.02 44.64 2fhf n GLY 705 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2fhf s GLU 706 N -2.00 3.75 -0.73 1.61 2.02 -1.05 -2.37 118.70 119.92 2fhf s GLU 706 Ca 0.01 0.54 0.00 0.00 0.02 0.00 0.00 54.97 55.54 2fhf s GLU 706 Cb -0.00 -3.87 0.37 0.00 0.10 0.00 0.00 34.13 30.73 2fhf s GLU 706 CO -0.00 -1.20 1.71 0.41 0.02 0.00 0.00 175.26 176.20 2fhf n GLY 707 N 4.65 5.71 0.00 -1.39 0.00 -1.26 -1.76 105.19 111.13 2fhf n GLY 707 Ca 0.10 -2.58 0.00 0.00 0.00 0.00 0.00 46.02 43.53 2fhf n GLY 707 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 2fhf n TRP 708 N -0.48 -1.10 -3.56 1.61 5.03 -1.26 -1.29 117.44 116.39 2fhf n TRP 708 Ca 0.48 0.00 -0.40 0.00 3.03 0.00 0.00 57.50 60.61 2fhf n TRP 708 Cb 0.37 0.00 -0.11 0.00 -1.03 0.00 0.00 31.31 30.54 2fhf n TRP 708 CO 0.00 0.00 0.00 0.34 -0.03 0.00 0.00 177.69 178.00 2fhf s ASP 709 N -1.08 5.91 0.00 -0.99 -1.08 -1.26 -4.66 116.67 113.51 2fhf s ASP 709 Ca 0.00 -0.55 0.26 0.00 -0.52 0.00 0.00 52.55 51.75 2fhf s ASP 709 Cb 0.00 -2.10 0.78 0.00 -1.46 0.00 0.00 42.92 40.14 2fhf s ASP 709 CO 0.00 -0.26 1.59 -1.54 0.52 0.00 0.00 175.17 175.48 2fhf n SER 710 N 5.07 0.52 -1.16 -0.34 3.41 -1.26 -4.93 113.62 114.92 2fhf n SER 710 Ca -0.13 -0.31 -0.13 0.00 -0.26 0.00 0.00 58.87 58.04 2fhf n SER 710 Cb 0.49 0.06 -0.04 0.00 -0.26 0.00 0.00 64.21 64.46 2fhf n SER 710 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 2fhf n ASN 711 N -1.25 -4.44 -1.19 4.04 4.05 -1.26 -4.88 115.26 110.33 2fhf n ASN 711 Ca 0.08 0.22 0.10 0.00 0.45 0.00 0.00 54.58 55.44 2fhf n ASN 711 Cb 0.33 -3.26 0.28 0.00 1.23 0.00 0.00 39.78 38.36 2fhf n ASN 711 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 2fhf n GLN 712 N -2.51 2.84 0.33 1.20 1.13 -1.26 -4.56 117.38 114.56 2fhf n GLN 712 Ca -0.14 -2.54 0.22 0.00 -1.94 0.00 0.00 57.00 52.60 2fhf n GLN 712 Cb 0.49 -1.52 1.18 0.00 0.11 0.00 0.00 30.24 30.50 2fhf n GLN 712 CO 0.00 0.00 0.00 0.77 -1.44 0.00 0.00 177.06 176.39 2fhf h SER 713 N 3.71 0.00 1.46 1.08 0.02 -1.90 -0.84 113.55 117.08 2fhf h SER 713 Ca 0.00 0.00 -0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2fhf h SER 713 Cb 0.96 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.50 2fhf h SER 713 CO 0.02 0.00 -0.01 -2.24 -1.14 0.00 0.00 176.83 173.46 2fhf h ASP 714 N 0.00 0.00 0.08 3.07 2.03 -2.01 -3.28 116.42 116.31 2fhf h ASP 714 Ca -0.00 0.00 -0.36 0.00 -0.73 0.00 0.00 57.03 55.94 2fhf h ASP 714 Cb 0.01 0.00 -0.06 0.00 -0.83 0.00 0.00 39.33 38.45 2fhf h ASP 714 CO 0.00 0.01 -2.29 0.54 -1.03 0.00 0.00 179.24 176.48 2fhf n ARG 715 N -3.10 0.68 -3.62 4.15 1.74 -0.36 -2.77 116.66 113.37 2fhf n ARG 715 Ca 0.02 0.11 -0.04 0.00 -0.77 0.00 0.00 57.85 57.17 2fhf n ARG 715 Cb 0.41 -1.58 -0.01 0.00 -1.02 0.00 0.00 32.46 30.26 2fhf n ARG 715 CO 0.00 0.00 0.00 -0.59 -1.52 0.00 0.00 177.63 175.52 2fhf s PHE 716 N -2.52 -0.18 -0.15 -1.55 -0.12 -0.98 -4.49 117.98 107.99 2fhf s PHE 716 Ca -0.18 0.01 -0.29 0.00 -0.05 0.00 0.00 56.93 56.42 2fhf s PHE 716 Cb 0.07 0.57 -0.02 0.00 -0.63 0.00 0.00 43.02 43.01 2fhf s PHE 716 CO 0.75 -0.52 1.30 -2.00 -0.05 0.00 0.00 175.22 174.71 2fhf s GLU 717 N -2.91 4.23 0.54 1.99 2.12 -1.26 -3.88 118.70 119.54 2fhf s GLU 717 Ca 0.10 1.72 -0.11 0.00 0.36 0.00 0.00 54.97 57.04 2fhf s GLU 717 Cb 0.00 -3.78 -0.05 0.00 0.26 0.00 0.00 34.13 30.56 2fhf s GLU 717 CO -0.04 -0.72 0.94 0.96 -0.54 0.00 0.00 175.26 175.87 2fhf s ILE 718 N 3.52 4.72 -1.26 -3.70 -4.36 -1.26 -0.62 121.20 118.25 2fhf s ILE 718 Ca 0.57 0.78 -0.13 0.00 -0.26 0.00 0.00 60.65 61.60 2fhf s ILE 718 Cb -0.23 -3.82 0.14 0.00 1.25 0.00 0.00 42.46 39.80 2fhf s ILE 718 CO 0.16 -0.91 1.65 0.00 0.24 0.00 0.00 174.94 176.08 2fhf n ALA 719 N -2.23 4.32 -2.31 2.27 0.00 -0.59 -4.23 120.51 117.73 2fhf n ALA 719 Ca 0.05 -4.17 -0.22 0.00 0.00 0.00 0.00 53.44 49.09 2fhf n ALA 719 Cb 0.54 -3.16 -0.05 0.00 0.00 0.00 0.00 19.45 16.78 2fhf n ALA 719 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 2fhf s SER 720 N 2.58 4.79 0.19 0.00 1.04 -1.26 -3.51 113.70 117.53 2fhf s SER 720 Ca 0.44 -0.90 -0.14 0.00 0.48 0.00 0.00 55.95 55.83 2fhf s SER 720 Cb 0.03 -0.50 0.19 0.00 0.10 0.00 0.00 66.02 65.84 2fhf s SER 720 CO 0.01 -0.63 1.66 1.56 0.98 0.00 0.00 173.24 176.82 2fhf h GLN 721 N 1.17 0.04 0.47 4.02 4.20 -1.47 -1.20 115.11 122.35 2fhf h GLN 721 Ca -0.42 -0.00 -0.02 0.00 0.06 0.00 0.00 58.65 58.27 2fhf h GLN 721 Cb 1.26 -0.01 0.00 0.00 0.30 0.00 0.00 27.48 29.04 2fhf h GLN 721 CO 0.62 0.03 -0.23 0.82 -0.67 0.00 0.00 178.83 179.41 2fhf h ILE 722 N 0.05 0.53 0.00 2.54 1.08 -1.89 -3.21 117.51 116.60 2fhf h ILE 722 Ca 0.26 -0.18 -0.01 0.00 -0.39 0.00 0.00 64.86 64.54 2fhf h ILE 722 Cb 0.40 0.61 -0.00 0.00 -3.07 0.00 0.00 36.82 34.76 2fhf h ILE 722 CO -0.50 0.03 -0.06 0.78 -0.69 0.00 0.00 178.15 177.71 2fhf h ASN 723 N -0.74 0.00 -0.12 1.72 2.35 -1.79 -2.86 115.58 114.13 2fhf h ASN 723 Ca -0.06 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.69 2fhf h ASN 723 Cb 0.54 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.91 2fhf h ASN 723 CO 0.11 0.06 0.00 0.18 -1.65 0.00 0.00 177.43 176.12 2fhf n LEU 724 N -3.25 1.54 -4.66 1.61 4.77 -0.47 -4.92 117.00 111.61 2fhf n LEU 724 Ca -0.01 -0.61 -0.47 0.00 -0.03 0.00 0.00 56.01 54.89 2fhf n LEU 724 Cb 0.26 -0.08 -0.04 0.00 -2.33 0.00 0.00 43.42 41.23 2fhf n LEU 724 CO 0.27 0.31 1.16 1.17 -1.33 0.00 0.00 177.39 178.96 2fhf n LYS 725 N 0.22 2.03 -0.89 3.23 4.81 -1.08 -1.67 118.16 124.81 2fhf n LYS 725 Ca 0.17 0.73 0.00 0.00 -0.87 0.00 0.00 58.31 58.34 2fhf n LYS 725 Cb 0.32 -2.49 0.00 0.00 0.02 0.00 0.00 35.03 32.89 2fhf n LYS 725 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2fhf n GLY 726 N 3.28 0.76 0.15 3.14 0.00 -1.26 -4.88 105.19 106.38 2fhf n GLY 726 Ca 0.17 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.27 2fhf n GLY 726 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 2fhf h THR 727 N 0.00 0.24 0.00 2.61 1.35 -1.68 -3.48 112.91 111.95 2fhf h THR 727 Ca 0.00 -1.38 0.00 0.00 -0.55 0.00 0.00 66.41 64.48 2fhf h THR 727 Cb 0.01 1.91 0.00 0.00 -1.73 0.00 0.00 68.15 68.34 2fhf h THR 727 CO 0.00 0.14 0.00 0.61 -0.25 0.00 0.00 175.52 176.02 2fhf n GLY 728 N 1.20 0.64 3.64 5.82 0.00 -1.26 -5.04 105.19 110.19 2fhf n GLY 728 Ca 0.00 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.63 2fhf n GLY 728 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2fhf s ILE 729 N -2.44 5.13 0.59 -0.61 -1.09 -1.26 -4.77 121.20 116.74 2fhf s ILE 729 Ca 0.00 0.81 -0.11 0.00 -2.23 0.00 0.00 60.65 59.12 2fhf s ILE 729 Cb 0.00 -3.79 -0.05 0.00 -1.58 0.00 0.00 42.46 37.05 2fhf s ILE 729 CO 0.00 0.17 1.00 -0.83 -1.23 0.00 0.00 174.94 174.04 2fhf s GLY 730 N 1.30 1.71 -0.00 6.18 0.00 -0.57 -4.82 107.32 111.13 2fhf s GLY 730 Ca 0.21 -0.09 -0.02 0.00 0.00 0.00 0.00 44.72 44.82 2fhf s GLY 730 CO 0.09 0.17 0.03 -0.51 0.00 0.00 0.00 173.10 172.89 2fhf s THR 731 N -3.04 0.05 0.32 0.90 -4.23 -0.68 -1.76 115.64 107.20 2fhf s THR 731 Ca 0.55 -0.44 -0.29 0.00 -1.18 0.00 0.00 61.69 60.33 2fhf s THR 731 Cb -0.11 -0.20 -0.10 0.00 1.34 0.00 0.00 72.50 73.43 2fhf s THR 731 CO 0.49 -0.24 1.40 -0.36 -0.54 0.00 0.00 174.62 175.37 2fhf s PHE 732 N -0.74 2.91 -0.21 3.99 0.08 -1.00 -1.64 117.98 121.37 2fhf s PHE 732 Ca -0.08 1.23 -0.08 0.00 0.12 0.00 0.00 56.93 58.12 2fhf s PHE 732 Cb -0.05 -3.82 -0.04 0.00 -0.57 0.00 0.00 43.02 38.54 2fhf s PHE 732 CO -0.00 -2.42 0.08 0.45 -0.10 0.00 0.00 175.22 173.23 2fhf s SER 733 N -0.15 5.55 0.00 1.36 0.15 -0.34 -4.72 113.70 115.56 2fhf s SER 733 Ca 0.53 -0.00 0.27 0.00 0.70 0.00 0.00 55.95 57.45 2fhf s SER 733 Cb -0.42 -1.97 0.89 0.00 -1.71 0.00 0.00 66.02 62.81 2fhf s SER 733 CO 0.53 0.09 1.65 -0.90 1.20 0.00 0.00 173.24 175.82 2fhf n ASP 734 N 4.07 1.66 0.04 5.45 5.75 -1.26 -4.22 116.55 128.04 2fhf n ASP 734 Ca -0.16 -1.51 -0.02 0.00 -0.01 0.00 0.00 54.79 53.09 2fhf n ASP 734 Cb 0.52 0.02 -0.01 0.00 -1.03 0.00 0.00 41.12 40.62 2fhf n ASP 734 CO 0.00 0.00 0.00 0.03 -0.11 0.00 0.00 177.20 177.12 2fhf h ARG 735 N 2.56 -0.10 -0.65 0.11 -0.00 -1.93 -2.39 114.38 111.98 2fhf h ARG 735 Ca 0.00 0.01 -0.04 0.00 -0.50 0.00 0.00 59.98 59.45 2fhf h ARG 735 Cb 0.57 0.02 -0.03 0.00 0.00 0.00 0.00 29.97 30.53 2fhf h ARG 735 CO 0.00 -0.07 0.24 1.25 0.00 0.00 0.00 179.97 181.40 2fhf h LEU 736 N -0.15 0.89 -0.33 3.04 6.46 -1.79 -1.86 115.31 121.55 2fhf h LEU 736 Ca -0.01 -0.13 0.06 0.00 -0.12 0.00 0.00 57.88 57.68 2fhf h LEU 736 Cb 0.08 -0.23 -0.08 0.00 -0.73 0.00 0.00 40.66 39.69 2fhf h LEU 736 CO 0.02 0.81 -0.47 -0.09 -0.62 0.00 0.00 178.44 178.09 2fhf h ARG 737 N 0.95 -0.38 -0.11 1.25 2.43 -1.67 -0.19 114.38 116.66 2fhf h ARG 737 Ca 0.22 0.03 -0.15 0.00 -0.81 0.00 0.00 59.98 59.27 2fhf h ARG 737 Cb 0.21 0.09 -0.01 0.00 -0.42 0.00 0.00 29.97 29.83 2fhf h ARG 737 CO -0.02 -0.26 -0.56 -0.44 -1.51 0.00 0.00 179.97 177.18 2fhf h ASP 738 N -0.40 0.37 -0.63 -3.80 3.45 -1.27 -1.47 116.42 112.68 2fhf h ASP 738 Ca 0.10 -0.20 -0.05 0.00 0.43 0.00 0.00 57.03 57.31 2fhf h ASP 738 Cb 0.61 -0.11 -0.03 0.00 -0.56 0.00 0.00 39.33 39.24 2fhf h ASP 738 CO -0.54 0.86 0.20 0.00 -1.57 0.00 0.00 179.24 178.19 2fhf h ALA 739 N 1.15 1.12 0.15 3.45 0.00 -0.77 0.21 119.26 124.57 2fhf h ALA 739 Ca 0.00 -0.21 -0.30 0.00 0.00 0.00 0.00 54.91 54.40 2fhf h ALA 739 Cb 1.07 -0.26 0.01 0.00 0.00 0.00 0.00 17.79 18.60 2fhf h ALA 739 CO 0.09 0.61 -1.51 0.28 0.00 0.00 0.00 179.25 178.71 2fhf h VAL 740 N 0.97 1.03 -0.22 0.00 2.07 -1.04 -1.43 116.25 117.64 2fhf h VAL 740 Ca 0.21 -2.46 -0.18 0.00 0.82 0.00 0.00 66.70 65.09 2fhf h VAL 740 Cb 0.28 2.78 -0.00 0.00 -1.52 0.00 0.00 31.29 32.83 2fhf h VAL 740 CO -0.01 0.77 -0.59 0.03 0.02 0.00 0.00 177.57 177.79 2fhf h ARG 741 N -0.13 0.71 0.00 1.57 3.08 -1.31 -1.93 114.38 116.37 2fhf h ARG 741 Ca -0.31 -0.47 0.00 0.00 0.07 0.00 0.00 59.98 59.27 2fhf h ARG 741 Cb 1.91 0.07 0.00 0.00 0.08 0.00 0.00 29.97 32.02 2fhf h ARG 741 CO 0.12 1.09 0.00 0.41 -1.07 0.00 0.00 179.97 180.53 2fhf n GLY 742 N 0.38 2.12 7.00 0.04 0.00 0.75 -3.74 105.19 111.74 2fhf n GLY 742 Ca -0.04 -1.73 0.00 0.00 0.00 0.00 0.00 46.02 44.24 2fhf n GLY 742 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2fhf n GLY 743 N 1.95 2.13 3.67 -0.02 0.00 -1.08 -4.85 105.19 106.99 2fhf n GLY 743 Ca 0.00 -0.47 -0.10 0.00 0.00 0.00 0.00 46.02 45.45 2fhf n GLY 743 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2fhf s GLY 744 N -1.40 0.60 0.00 -0.02 0.00 -1.26 -4.78 107.32 100.45 2fhf s GLY 744 Ca 0.00 -0.89 0.13 0.00 0.00 0.00 0.00 44.72 43.97 2fhf s GLY 744 CO 0.00 -0.54 1.34 -1.55 0.00 0.00 0.00 173.10 172.35 2fhf n PRO 745 N -0.47 0.22 -0.16 2.90 -0.04 -1.26 -2.75 135.00 133.43 2fhf n PRO 745 Ca -0.03 0.14 0.09 0.00 -0.04 0.00 0.00 63.50 63.66 2fhf n PRO 745 Cb 0.61 -1.50 0.17 0.00 -0.04 0.00 0.00 33.50 32.74 2fhf n PRO 745 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 2fhf n PHE 746 N -1.26 0.41 -2.41 0.54 3.01 -1.26 -5.00 117.46 111.50 2fhf n PHE 746 Ca 0.07 -0.27 -0.38 0.00 1.01 0.00 0.00 57.45 57.88 2fhf n PHE 746 Cb 0.10 -0.01 -0.03 0.00 -0.01 0.00 0.00 39.48 39.53 2fhf n PHE 746 CO 0.00 0.00 0.00 -0.51 1.01 0.00 0.00 176.76 177.26 2fhf s ASP 747 N -1.24 6.79 0.13 4.37 1.01 -1.11 -5.05 116.67 121.57 2fhf s ASP 747 Ca 0.30 2.24 -0.11 0.00 0.71 0.00 0.00 52.55 55.70 2fhf s ASP 747 Cb 0.18 -2.61 0.01 0.00 1.01 0.00 0.00 42.92 41.50 2fhf s ASP 747 CO 0.25 -0.48 0.30 -0.94 0.21 0.00 0.00 175.17 174.51 2fhf s SER 748 N -1.18 -0.02 0.92 0.27 1.04 -1.26 -4.83 113.70 108.65 2fhf s SER 748 Ca 0.54 -0.64 0.00 0.00 0.48 0.00 0.00 55.95 56.33 2fhf s SER 748 Cb -0.29 0.42 0.00 0.00 0.10 0.00 0.00 66.02 66.26 2fhf s SER 748 CO 0.36 -0.84 0.00 0.61 0.98 0.00 0.00 173.24 174.35 2fhf n GLY 749 N -0.17 1.98 0.32 7.32 0.00 -1.26 -2.72 105.19 110.66 2fhf n GLY 749 Ca -0.12 -0.51 0.20 0.00 0.00 0.00 0.00 46.02 45.59 2fhf n GLY 749 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2fhf h ASP 750 N 9.48 0.00 -0.03 1.61 5.19 -1.98 -1.82 116.42 128.88 2fhf h ASP 750 Ca 0.00 0.00 -0.00 0.00 -0.62 0.00 0.00 57.03 56.41 2fhf h ASP 750 Cb 0.00 0.00 -0.00 0.00 0.18 0.00 0.00 39.33 39.51 2fhf h ASP 750 CO 0.00 0.00 0.02 0.00 -3.12 0.00 0.00 179.24 176.14 2fhf h ALA 751 N 2.00 1.97 0.00 3.45 0.00 -1.92 -0.03 119.26 124.73 2fhf h ALA 751 Ca -0.00 -0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.89 2fhf h ALA 751 Cb 0.03 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 17.81 2fhf h ALA 751 CO 0.00 0.02 -0.09 -0.07 0.00 0.00 0.00 179.25 179.11 2fhf h LEU 752 N 0.04 0.00 0.09 0.00 3.38 -1.47 -2.03 115.31 115.32 2fhf h LEU 752 Ca 0.01 0.00 -0.37 0.00 0.09 0.00 0.00 57.88 57.61 2fhf h LEU 752 Cb 0.00 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.72 2fhf h LEU 752 CO -0.00 0.09 -2.13 -1.14 0.09 0.00 0.00 178.44 175.35 2fhf n ARG 753 N -4.42 0.72 -0.34 1.13 0.63 -0.27 -4.32 116.66 109.80 2fhf n ARG 753 Ca -0.03 0.23 -0.02 0.00 -0.92 0.00 0.00 57.85 57.12 2fhf n ARG 753 Cb 0.17 -1.65 0.11 0.00 0.45 0.00 0.00 32.46 31.54 2fhf n ARG 753 CO 0.00 0.00 0.00 1.96 -2.51 0.00 0.00 177.63 177.08 2fhf h GLN 754 N 0.02 1.15 -4.58 -0.14 4.20 -0.96 -3.36 115.11 111.45 2fhf h GLN 754 Ca -0.47 -0.07 -0.71 0.00 0.06 0.00 0.00 58.65 57.46 2fhf h GLN 754 Cb 1.98 -0.26 -0.07 0.00 0.30 0.00 0.00 27.48 29.43 2fhf h GLN 754 CO 0.03 0.76 2.64 0.09 -0.67 0.00 0.00 178.83 181.68 2fhf n ASN 755 N -4.48 4.40 -4.78 1.46 3.02 -0.78 -4.49 115.26 109.62 2fhf n ASN 755 Ca 0.11 -2.90 -0.33 0.00 -0.03 0.00 0.00 54.58 51.43 2fhf n ASN 755 Cb 0.06 -1.67 0.03 0.00 -0.61 0.00 0.00 39.78 37.60 2fhf n ASN 755 CO 0.00 0.00 0.00 -1.10 -2.62 0.00 0.00 177.26 173.54 2fhf s GLN 756 N 3.17 2.98 0.52 3.52 -0.21 -1.26 -2.63 119.66 125.76 2fhf s GLN 756 Ca 0.48 1.38 0.03 0.00 0.02 0.00 0.00 55.36 57.27 2fhf s GLN 756 Cb 0.10 -1.98 0.01 0.00 1.00 0.00 0.00 33.01 32.14 2fhf s GLN 756 CO -0.02 -1.10 0.18 0.20 -2.12 0.00 0.00 175.29 172.43 2fhf s GLY 757 N -2.53 2.73 0.42 3.09 0.00 -1.25 -4.40 107.32 105.39 2fhf s GLY 757 Ca 0.67 -0.79 0.08 0.00 0.00 0.00 0.00 44.72 44.67 2fhf s GLY 757 CO 0.39 -2.08 2.07 -0.24 0.00 0.00 0.00 173.10 173.23 2fhf h VAL 758 N 1.09 1.10 0.00 1.40 3.04 -1.21 -0.94 116.25 120.73 2fhf h VAL 758 Ca -0.41 -0.18 0.00 0.00 -1.01 0.00 0.00 66.70 65.10 2fhf h VAL 758 Cb 1.31 0.53 0.00 0.00 -2.01 0.00 0.00 31.29 31.12 2fhf h VAL 758 CO 0.67 0.09 0.00 1.23 -1.01 0.00 0.00 177.57 178.55 2fhf h GLY 759 N 0.52 0.00 -0.72 3.17 0.00 -1.60 -3.21 103.07 101.24 2fhf h GLY 759 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.47 2fhf h GLY 759 CO -0.03 0.00 0.00 -1.14 0.00 0.00 0.00 176.54 175.37 2fhf n SER 760 N -2.80 3.04 0.00 0.19 3.41 -0.52 -4.68 113.62 112.25 2fhf n SER 760 Ca 0.02 -3.05 0.00 0.00 -0.26 0.00 0.00 58.87 55.58 2fhf n SER 760 Cb 0.35 -0.48 0.00 0.00 -0.26 0.00 0.00 64.21 63.82 2fhf n SER 760 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2fhf n GLY 761 N -1.01 0.88 3.65 5.00 0.00 -0.90 -4.64 105.19 108.16 2fhf n GLY 761 Ca 0.18 -0.60 -0.49 0.00 0.00 0.00 0.00 46.02 45.11 2fhf n GLY 761 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2fhf n ALA 762 N -0.82 0.61 0.00 4.61 0.00 -0.47 -0.69 120.51 123.75 2fhf n ALA 762 Ca 0.00 0.43 0.00 0.00 0.00 0.00 0.00 53.44 53.87 2fhf n ALA 762 Cb 0.26 -2.30 0.00 0.00 0.00 0.00 0.00 19.45 17.41 2fhf n ALA 762 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2fhf n GLY 763 N 3.41 1.61 0.15 0.00 0.00 -1.26 -4.61 105.19 104.49 2fhf n GLY 763 Ca 0.19 -0.07 0.02 0.00 0.00 0.00 0.00 46.02 46.17 2fhf n GLY 763 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 2fhf h VAL 764 N 0.00 0.95 -1.59 1.61 -1.51 -1.84 -3.38 116.25 110.48 2fhf h VAL 764 Ca 0.00 -2.14 -0.47 0.00 -1.23 0.00 0.00 66.70 62.86 2fhf h VAL 764 Cb 0.00 2.32 -0.34 0.00 -2.13 0.00 0.00 31.29 31.14 2fhf h VAL 764 CO 0.00 0.50 -1.00 -0.11 -1.23 0.00 0.00 177.57 175.73 2fhf n LEU 765 N -3.32 -0.26 -4.77 4.19 7.94 0.14 -4.74 117.00 116.17 2fhf n LEU 765 Ca 0.01 -4.51 -0.40 0.00 -1.11 0.00 0.00 56.01 50.00 2fhf n LEU 765 Cb 0.69 0.71 0.01 0.00 0.53 0.00 0.00 43.42 45.35 2fhf n LEU 765 CO 0.40 2.11 1.01 -2.16 -1.11 0.00 0.00 177.39 177.64 2fhf s PRO 766 N -1.13 3.82 0.31 1.96 0.04 -1.25 -4.42 135.00 134.34 2fhf s PRO 766 Ca 0.35 2.27 -0.02 0.00 0.04 0.00 0.00 61.00 63.64 2fhf s PRO 766 Cb 0.23 -2.70 0.07 0.00 0.04 0.00 0.00 34.50 32.14 2fhf s PRO 766 CO -0.12 -0.66 0.43 0.27 0.04 0.00 0.00 177.00 176.97 2fhf n ASN 767 N -0.05 0.34 0.00 6.66 0.23 -1.26 -4.78 115.26 116.40 2fhf n ASN 767 Ca 0.04 -1.34 0.13 0.00 -0.53 0.00 0.00 54.58 52.88 2fhf n ASN 767 Cb 0.43 -0.30 0.65 0.00 -2.08 0.00 0.00 39.78 38.47 2fhf n ASN 767 CO 0.00 0.00 0.00 -1.84 -0.93 0.00 0.00 177.26 174.49 2fhf n GLU 768 N -1.85 0.25 -0.03 -3.83 0.00 -1.26 -3.93 120.64 109.99 2fhf n GLU 768 Ca 0.06 0.03 -0.01 0.00 0.00 0.00 0.00 57.16 57.25 2fhf n GLU 768 Cb 0.22 -1.50 -0.07 0.00 0.00 0.00 0.00 31.44 30.09 2fhf n GLU 768 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.13 178.41 2fhf n LEU 769 N -1.36 0.00 -4.74 -1.84 4.77 -1.26 -5.05 117.00 107.52 2fhf n LEU 769 Ca 0.11 0.00 -0.36 0.00 -0.03 0.00 0.00 56.01 55.73 2fhf n LEU 769 Cb 0.25 0.14 0.05 0.00 -2.33 0.00 0.00 43.42 41.53 2fhf n LEU 769 CO 0.22 0.14 0.85 0.28 -1.33 0.00 0.00 177.39 177.56 2fhf s THR 770 N -2.39 2.41 -0.06 -5.08 -1.32 -1.25 -4.84 115.64 103.11 2fhf s THR 770 Ca -0.04 0.25 0.08 0.00 -1.21 0.00 0.00 61.69 60.77 2fhf s THR 770 Cb 0.04 -3.06 0.13 0.00 -1.51 0.00 0.00 72.50 68.10 2fhf s THR 770 CO 0.38 -0.06 1.06 0.35 -2.21 0.00 0.00 174.62 174.14 2fhf n THR 771 N -1.84 0.83 -1.81 5.08 -2.24 -1.26 -4.91 114.28 108.12 2fhf n THR 771 Ca 0.14 -0.99 -0.42 0.00 -2.27 0.00 0.00 64.05 60.51 2fhf n THR 771 Cb 0.49 0.19 -0.02 0.00 -2.10 0.00 0.00 70.33 68.89 2fhf n THR 771 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 2fhf s LEU 772 N -1.26 4.36 0.60 3.22 1.43 -1.26 -5.00 118.68 120.78 2fhf s LEU 772 Ca 0.14 2.86 -0.03 0.00 -1.03 0.00 0.00 54.13 56.07 2fhf s LEU 772 Cb 0.12 -3.62 0.03 0.00 0.03 0.00 0.00 46.19 42.75 2fhf s LEU 772 CO 0.01 -0.89 0.87 -0.94 0.23 0.00 0.00 176.35 175.63 2fhf s SER 773 N 0.72 5.24 0.23 2.29 1.04 -1.26 -4.71 113.70 117.25 2fhf s SER 773 Ca 0.66 0.34 -0.07 0.00 0.48 0.00 0.00 55.95 57.36 2fhf s SER 773 Cb -0.47 -1.21 0.19 0.00 0.10 0.00 0.00 66.02 64.63 2fhf s SER 773 CO 0.42 -1.24 1.83 0.44 0.98 0.00 0.00 173.24 175.67 2fhf h ASP 774 N -0.18 1.12 -0.55 7.02 3.32 -1.94 -1.24 116.42 123.97 2fhf h ASP 774 Ca -0.44 -0.13 0.01 0.00 0.02 0.00 0.00 57.03 56.49 2fhf h ASP 774 Cb 1.29 -0.29 -0.03 0.00 0.22 0.00 0.00 39.33 40.52 2fhf h ASP 774 CO 0.57 0.93 0.36 -0.78 -1.72 0.00 0.00 179.24 178.60 2fhf h ASP 775 N 1.23 0.61 -0.60 6.45 1.82 -1.98 0.83 116.42 124.77 2fhf h ASP 775 Ca 0.30 -0.01 -0.07 0.00 -0.39 0.00 0.00 57.03 56.85 2fhf h ASP 775 Cb 0.09 -0.15 -0.03 0.00 0.68 0.00 0.00 39.33 39.93 2fhf h ASP 775 CO -0.04 0.44 0.10 1.56 -1.61 0.00 0.00 179.24 179.69 2fhf h GLN 776 N 0.73 1.02 -0.57 0.28 4.20 -1.82 -1.20 115.11 117.76 2fhf h GLN 776 Ca 0.20 -0.26 -0.10 0.00 0.06 0.00 0.00 58.65 58.55 2fhf h GLN 776 Cb -0.07 -0.13 -0.02 0.00 0.30 0.00 0.00 27.48 27.57 2fhf h GLN 776 CO -0.05 0.94 -0.05 0.00 -0.67 0.00 0.00 178.83 179.00 2fhf h ALA 777 N 1.14 0.84 0.00 3.87 0.00 -0.72 -2.57 119.26 121.81 2fhf h ALA 777 Ca 0.19 -0.33 -0.09 0.00 0.00 0.00 0.00 54.91 54.69 2fhf h ALA 777 Cb 0.42 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.99 2fhf h ALA 777 CO 0.01 0.66 -0.41 0.00 0.00 0.00 0.00 179.25 179.51 2fhf h ARG 778 N 0.92 0.00 -0.54 0.00 3.08 -0.56 -2.42 114.38 114.87 2fhf h ARG 778 Ca 0.16 0.00 -0.11 0.00 0.07 0.00 0.00 59.98 60.10 2fhf h ARG 778 Cb 0.60 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.63 2fhf h ARG 778 CO 0.04 0.41 -0.09 1.25 -1.07 0.00 0.00 179.97 180.50 2fhf h HIS 779 N 0.00 1.11 -0.29 3.04 2.76 -0.89 -1.35 115.15 119.52 2fhf h HIS 779 Ca -0.00 -0.22 -0.06 0.00 -2.20 0.00 0.00 60.37 57.88 2fhf h HIS 779 Cb 0.84 -0.28 -0.02 0.00 1.55 0.00 0.00 27.41 29.51 2fhf h HIS 779 CO 0.00 1.02 -0.10 -0.07 -1.30 0.00 0.00 177.93 177.49 2fhf h LEU 780 N 0.89 0.46 -0.84 0.26 3.38 -1.09 -2.00 115.31 116.37 2fhf h LEU 780 Ca 0.14 -0.11 -0.09 0.00 0.09 0.00 0.00 57.88 57.91 2fhf h LEU 780 Cb 0.65 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 41.26 2fhf h LEU 780 CO 0.04 0.60 -0.11 0.00 0.09 0.00 0.00 178.44 179.07 2fhf h ALA 781 N 1.45 1.02 -0.56 1.53 0.00 -0.95 -0.74 119.26 121.01 2fhf h ALA 781 Ca 0.09 -0.31 -0.01 0.00 0.00 0.00 0.00 54.91 54.67 2fhf h ALA 781 Cb 0.45 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 18.04 2fhf h ALA 781 CO 0.02 0.59 0.30 -0.44 0.00 0.00 0.00 179.25 179.72 2fhf h ASP 782 N 0.67 0.71 0.03 0.00 3.45 -0.60 0.21 116.42 120.90 2fhf h ASP 782 Ca 0.12 -0.10 -0.08 0.00 0.43 0.00 0.00 57.03 57.40 2fhf h ASP 782 Cb 0.58 -0.18 -0.01 0.00 -0.56 0.00 0.00 39.33 39.15 2fhf h ASP 782 CO 0.04 0.61 -0.22 -0.07 -1.57 0.00 0.00 179.24 178.02 2fhf h LEU 783 N 0.76 0.33 -0.06 1.55 3.38 -0.98 -1.53 115.31 118.76 2fhf h LEU 783 Ca 0.20 -0.10 -0.04 0.00 0.09 0.00 0.00 57.88 58.03 2fhf h LEU 783 Cb 0.06 -0.09 -0.00 0.00 0.09 0.00 0.00 40.66 40.72 2fhf h LEU 783 CO -0.03 0.57 -0.11 0.74 0.09 0.00 0.00 178.44 179.70 2fhf h THR 784 N 0.31 1.41 -0.49 0.22 2.02 -0.59 -1.68 112.91 114.11 2fhf h THR 784 Ca 0.05 -1.38 0.01 0.00 0.77 0.00 0.00 66.41 65.85 2fhf h THR 784 Cb 0.57 2.18 -0.03 0.00 -1.74 0.00 0.00 68.15 69.13 2fhf h THR 784 CO 0.04 0.38 0.32 0.03 0.37 0.00 0.00 175.52 176.66 2fhf h ARG 785 N -0.30 0.63 -0.90 6.66 3.08 -0.91 0.29 114.38 122.94 2fhf h ARG 785 Ca 0.00 -0.04 0.06 0.00 0.07 0.00 0.00 59.98 60.08 2fhf h ARG 785 Cb 0.67 -0.14 -0.06 0.00 0.08 0.00 0.00 29.97 30.52 2fhf h ARG 785 CO 0.02 0.42 0.56 1.25 -1.07 0.00 0.00 179.97 181.16 2fhf h LEU 786 N 0.65 0.89 -0.71 3.04 5.85 -1.28 -1.78 115.31 121.98 2fhf h LEU 786 Ca 0.18 0.01 -0.10 0.00 0.84 0.00 0.00 57.88 58.81 2fhf h LEU 786 Cb -0.06 -0.17 -0.02 0.00 0.37 0.00 0.00 40.66 40.78 2fhf h LEU 786 CO -0.05 0.57 -0.13 1.23 -0.34 0.00 0.00 178.44 179.72 2fhf h GLY 787 N 1.03 0.93 2.00 3.75 0.00 -0.36 0.70 103.07 111.12 2fhf h GLY 787 Ca 0.39 -0.74 0.00 0.00 0.00 0.00 0.00 47.33 46.98 2fhf h GLY 787 CO -0.17 0.67 0.00 -0.33 0.00 0.00 0.00 176.54 176.71 2fhf h MET 788 N 0.77 0.00 -0.66 4.80 2.86 -0.16 -0.40 114.93 122.14 2fhf h MET 788 Ca 0.12 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.76 2fhf h MET 788 Cb 0.65 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.31 2fhf h MET 788 CO 0.05 0.00 0.00 0.00 1.06 0.00 0.00 176.91 178.02 2fhf n ALA 789 N -2.06 2.87 -0.36 6.32 0.00 -0.78 -0.46 120.51 126.04 2fhf n ALA 789 Ca -0.00 -1.38 0.00 0.00 0.00 0.00 0.00 53.44 52.06 2fhf n ALA 789 Cb 0.23 -1.01 0.00 0.00 0.00 0.00 0.00 19.45 18.67 2fhf n ALA 789 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2fhf n GLY 790 N 1.23 0.82 3.98 0.00 0.00 -0.16 -4.42 105.19 106.64 2fhf n GLY 790 Ca 0.24 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.99 2fhf n GLY 790 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2fhf n ASN 791 N 0.00 -0.71 -4.77 1.61 5.15 0.19 -4.49 115.26 112.24 2fhf n ASN 791 Ca 0.00 -1.00 -0.39 0.00 -0.60 0.00 0.00 54.58 52.59 2fhf n ASN 791 Cb 0.00 -3.04 -0.06 0.00 -0.53 0.00 0.00 39.78 36.15 2fhf n ASN 791 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 2fhf s LEU 792 N -7.01 4.58 0.29 1.20 1.43 -1.26 -2.44 118.68 115.46 2fhf s LEU 792 Ca 0.09 1.75 -0.01 0.00 -1.03 0.00 0.00 54.13 54.93 2fhf s LEU 792 Cb -0.05 -3.48 0.42 0.00 0.03 0.00 0.00 46.19 43.11 2fhf s LEU 792 CO 0.89 0.16 1.87 0.00 0.23 0.00 0.00 176.35 179.50 2fhf h ALA 793 N 4.10 1.28 -0.13 4.21 0.00 -1.33 -3.18 119.26 124.22 2fhf h ALA 793 Ca -0.46 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.29 2fhf h ALA 793 Cb 1.20 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 18.74 2fhf h ALA 793 CO 0.67 0.53 0.00 -0.25 0.00 0.00 0.00 179.25 180.20 2fhf n ASP 794 N -4.32 2.79 -4.74 0.00 10.43 -1.26 -1.06 116.55 118.38 2fhf n ASP 794 Ca 0.05 -1.90 -0.41 0.00 2.57 0.00 0.00 54.79 55.10 2fhf n ASP 794 Cb 0.17 -0.07 -0.02 0.00 1.84 0.00 0.00 41.12 43.04 2fhf n ASP 794 CO 0.00 0.00 0.00 0.12 -1.07 0.00 0.00 177.20 176.25 2fhf s PHE 795 N -1.86 3.04 -0.22 1.24 2.19 -1.20 -4.66 117.98 116.51 2fhf s PHE 795 Ca 0.32 1.02 -0.09 0.00 0.33 0.00 0.00 56.93 58.52 2fhf s PHE 795 Cb 0.21 -3.81 -0.04 0.00 -1.31 0.00 0.00 43.02 38.07 2fhf s PHE 795 CO 0.31 -2.64 0.10 0.08 1.83 0.00 0.00 175.22 174.90 2fhf s VAL 796 N 0.07 4.93 0.20 3.12 1.01 -1.26 -0.36 120.40 128.11 2fhf s VAL 796 Ca 0.60 0.03 -0.01 0.00 0.00 0.00 0.00 61.98 62.59 2fhf s VAL 796 Cb -0.41 -3.27 -0.04 0.00 0.00 0.00 0.00 36.38 32.66 2fhf s VAL 796 CO 0.42 0.39 0.13 -1.48 0.00 0.00 0.00 175.10 174.56 2fhf s LEU 797 N 0.87 1.16 -0.24 3.92 0.05 -0.26 -4.98 118.68 119.20 2fhf s LEU 797 Ca 0.05 -1.39 -0.12 0.00 0.05 0.00 0.00 54.13 52.72 2fhf s LEU 797 Cb -0.13 0.38 -0.05 0.00 -2.05 0.00 0.00 46.19 44.34 2fhf s LEU 797 CO 0.03 -0.84 0.22 -0.63 -0.55 0.00 0.00 176.35 174.58 2fhf s ILE 798 N -4.15 5.31 0.74 1.48 1.09 -1.26 -0.98 121.20 123.43 2fhf s ILE 798 Ca 0.39 0.30 -0.09 0.00 -1.10 0.00 0.00 60.65 60.15 2fhf s ILE 798 Cb 0.07 -3.56 0.16 0.00 -1.06 0.00 0.00 42.46 38.07 2fhf s ILE 798 CO 0.12 0.29 1.01 -0.90 -0.10 0.00 0.00 174.94 175.37 2fhf n ASP 799 N 4.56 0.49 -0.16 3.58 3.85 -0.15 -4.41 116.55 124.30 2fhf n ASP 799 Ca -0.13 -1.62 0.28 0.00 -0.71 0.00 0.00 54.79 52.61 2fhf n ASP 799 Cb 0.52 -0.74 0.72 0.00 -1.35 0.00 0.00 41.12 40.27 2fhf n ASP 799 CO 0.00 0.00 0.00 0.07 -1.01 0.00 0.00 177.20 176.26 2fhf h LYS 800 N 0.00 0.00 -0.18 0.11 2.10 -1.86 0.62 116.57 117.37 2fhf h LYS 800 Ca -0.33 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.32 2fhf h LYS 800 Cb 1.01 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.34 2fhf h LYS 800 CO 0.27 0.00 0.00 -0.25 -2.00 0.00 0.00 179.45 177.47 2fhf n ASP 801 N -4.24 2.49 0.00 7.07 8.00 -1.26 -2.41 116.55 126.20 2fhf n ASP 801 Ca 0.18 -1.83 0.00 0.00 0.71 0.00 0.00 54.79 53.85 2fhf n ASP 801 Cb 0.93 -0.11 0.00 0.00 -0.02 0.00 0.00 41.12 41.93 2fhf n ASP 801 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2fhf n GLY 802 N 1.30 0.76 3.82 0.44 0.00 0.20 -4.53 105.19 107.19 2fhf n GLY 802 Ca 0.17 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.85 2fhf n GLY 802 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2fhf s ALA 803 N -2.75 3.22 -0.14 4.61 0.00 -1.26 -4.73 121.76 120.72 2fhf s ALA 803 Ca 0.00 0.27 -0.28 0.00 0.00 0.00 0.00 51.96 51.95 2fhf s ALA 803 Cb 0.00 -2.98 -0.01 0.00 0.00 0.00 0.00 23.12 20.13 2fhf s ALA 803 CO 0.00 0.24 0.95 0.08 0.00 0.00 0.00 175.76 177.02 2fhf s VAL 804 N -1.91 4.81 0.01 0.00 1.01 -1.26 -0.98 120.40 122.09 2fhf s VAL 804 Ca 0.54 1.89 0.01 0.00 0.00 0.00 0.00 61.98 64.42 2fhf s VAL 804 Cb -0.12 -4.25 -0.01 0.00 0.00 0.00 0.00 36.38 32.00 2fhf s VAL 804 CO 0.18 -0.01 -0.04 -0.54 0.00 0.00 0.00 175.10 174.69 2fhf s LYS 805 N 2.20 0.29 0.43 2.72 -0.14 -0.15 -4.97 119.74 120.11 2fhf s LYS 805 Ca 0.44 -0.39 -0.08 0.00 -1.36 0.00 0.00 55.97 54.58 2fhf s LYS 805 Cb -0.17 -0.09 -0.05 0.00 -1.68 0.00 0.00 37.83 35.83 2fhf s LYS 805 CO 0.14 0.01 0.76 1.03 -0.76 0.00 0.00 175.35 176.54 2fhf s ARG 806 N -0.84 3.66 0.31 1.68 0.52 -1.26 -1.10 118.95 121.92 2fhf s ARG 806 Ca -0.07 0.32 0.06 0.00 -0.52 0.00 0.00 55.73 55.52 2fhf s ARG 806 Cb -0.06 -2.40 0.73 0.00 0.52 0.00 0.00 34.95 33.74 2fhf s ARG 806 CO -0.00 -0.10 1.81 0.78 0.02 0.00 0.00 175.30 177.81 2fhf h GLY 807 N 0.82 1.61 2.00 -3.53 0.00 -0.08 0.17 103.07 104.06 2fhf h GLY 807 Ca -0.47 -0.36 0.00 0.00 0.00 0.00 0.00 47.33 46.50 2fhf h GLY 807 CO 0.63 0.02 0.00 -1.14 0.00 0.00 0.00 176.54 176.05 2fhf n SER 808 N -4.68 0.57 0.02 0.19 3.41 -0.23 -0.94 113.62 111.97 2fhf n SER 808 Ca 0.21 0.69 0.12 0.00 -0.26 0.00 0.00 58.87 59.63 2fhf n SER 808 Cb 0.51 -0.80 0.12 0.00 -0.26 0.00 0.00 64.21 63.79 2fhf n SER 808 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2fhf n GLU 809 N -2.19 0.17 -2.74 4.33 1.02 0.58 -4.00 120.64 117.81 2fhf n GLU 809 Ca 0.01 0.02 -0.43 0.00 -0.02 0.00 0.00 57.16 56.74 2fhf n GLU 809 Cb 0.14 -1.58 -0.03 0.00 -0.02 0.00 0.00 31.44 29.95 2fhf n GLU 809 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 2fhf s ILE 810 N -3.11 4.64 0.26 -3.67 -1.09 -0.85 -4.89 121.20 112.50 2fhf s ILE 810 Ca 0.07 1.66 -0.29 0.00 -2.23 0.00 0.00 60.65 59.86 2fhf s ILE 810 Cb 0.15 -4.30 -0.09 0.00 -1.58 0.00 0.00 42.46 36.64 2fhf s ILE 810 CO 0.75 -0.32 1.17 -0.62 -1.23 0.00 0.00 174.94 174.70 2fhf s ASP 811 N 1.51 7.11 -0.39 3.58 2.15 -1.26 0.76 116.67 130.13 2fhf s ASP 811 Ca 0.41 2.35 0.02 0.00 0.43 0.00 0.00 52.55 55.76 2fhf s ASP 811 Cb -0.14 -2.63 0.12 0.00 -0.30 0.00 0.00 42.92 39.98 2fhf s ASP 811 CO 0.12 -0.29 0.16 -0.47 -0.17 0.00 0.00 175.17 174.52 2fhf s TYR 812 N -0.84 2.27 -1.61 -5.34 5.04 0.34 -4.76 117.35 112.44 2fhf s TYR 812 Ca 0.48 -2.35 -0.12 0.00 -2.44 0.00 0.00 57.07 52.64 2fhf s TYR 812 Cb -0.34 -2.07 0.10 0.00 0.35 0.00 0.00 41.96 40.00 2fhf s TYR 812 CO 0.42 -0.84 0.64 0.09 -1.34 0.00 0.00 175.55 174.53 2fhf n ASN 813 N 4.06 -2.25 0.00 4.32 3.02 -1.26 -1.39 115.26 121.76 2fhf n ASN 813 Ca 0.04 -1.02 0.00 0.00 -0.03 0.00 0.00 54.58 53.57 2fhf n ASN 813 Cb 0.38 -2.81 0.00 0.00 -0.61 0.00 0.00 39.78 36.73 2fhf n ASN 813 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2fhf n GLY 814 N -1.64 0.58 3.51 7.41 0.00 -1.26 -5.06 105.19 108.72 2fhf n GLY 814 Ca -0.06 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.69 2fhf n GLY 814 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2fhf s ALA 815 N -2.20 2.77 0.16 4.61 0.00 -0.49 -5.08 121.76 121.52 2fhf s ALA 815 Ca 0.00 -1.55 -0.31 0.00 0.00 0.00 0.00 51.96 50.09 2fhf s ALA 815 Cb 0.00 -0.56 -0.11 0.00 0.00 0.00 0.00 23.12 22.46 2fhf s ALA 815 CO 0.00 0.45 1.75 -1.25 0.00 0.00 0.00 175.76 176.71 2fhf s PRO 816 N -2.77 4.14 0.03 0.00 0.04 -1.26 -0.51 135.00 134.67 2fhf s PRO 816 Ca 0.23 2.56 -0.18 0.00 0.04 0.00 0.00 61.00 63.65 2fhf s PRO 816 Cb -0.08 -3.34 -0.10 0.00 0.04 0.00 0.00 34.50 31.01 2fhf s PRO 816 CO 0.13 -0.78 1.26 0.78 0.04 0.00 0.00 177.00 178.43 2fhf h GLY 817 N 7.70 -0.69 -4.49 0.56 0.00 0.24 -3.43 103.07 102.96 2fhf h GLY 817 Ca -0.44 0.26 -0.54 0.00 0.00 0.00 0.00 47.33 46.60 2fhf h GLY 817 CO 0.95 -0.25 0.47 -0.32 0.00 0.00 0.00 176.54 177.39 2fhf s GLY 818 N -1.50 2.64 0.00 4.60 0.00 -0.12 -4.92 107.32 108.02 2fhf s GLY 818 Ca -0.10 0.63 0.00 0.00 0.00 0.00 0.00 44.72 45.26 2fhf s GLY 818 CO 0.29 1.86 0.00 1.58 0.00 0.00 0.00 173.10 176.83 2fhf n TYR 819 N 4.10 0.00 -2.94 1.90 0.18 -1.03 -3.67 117.16 115.69 2fhf n TYR 819 Ca 0.08 0.00 -0.24 0.00 1.88 0.00 0.00 57.90 59.61 2fhf n TYR 819 Cb 0.49 0.00 0.01 0.00 -0.38 0.00 0.00 39.34 39.46 2fhf n TYR 819 CO 0.00 0.00 0.00 0.00 -2.08 0.00 0.00 176.86 174.78 2fhf s ALA 820 N -0.73 3.63 -0.19 -3.48 0.00 -1.02 -4.60 121.76 115.37 2fhf s ALA 820 Ca 0.00 -0.89 0.06 0.00 0.00 0.00 0.00 51.96 51.14 2fhf s ALA 820 Cb 0.00 -2.26 -0.22 0.00 0.00 0.00 0.00 23.12 20.64 2fhf s ALA 820 CO 0.00 -0.35 0.09 0.00 0.00 0.00 0.00 175.76 175.51 2fhf n ALA 821 N -2.11 1.36 -2.80 0.00 0.00 -1.26 -1.29 120.51 114.41 2fhf n ALA 821 Ca 0.00 -1.03 -0.15 0.00 0.00 0.00 0.00 53.44 52.27 2fhf n ALA 821 Cb 0.57 -0.34 -0.12 0.00 0.00 0.00 0.00 19.45 19.57 2fhf n ALA 821 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2fhf s ASP 822 N -6.26 1.14 0.61 0.00 1.01 -1.26 -4.04 116.67 107.87 2fhf s ASP 822 Ca -0.21 -0.58 0.37 0.00 0.71 0.00 0.00 52.55 52.84 2fhf s ASP 822 Cb 0.08 0.01 2.01 0.00 1.01 0.00 0.00 42.92 46.02 2fhf s ASP 822 CO 0.73 -0.17 2.25 1.55 0.21 0.00 0.00 175.17 179.74 2fhf h PRO 823 N 4.40 0.00 0.00 8.23 0.13 -1.79 -1.45 132.00 141.52 2fhf h PRO 823 Ca -0.37 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.76 2fhf h PRO 823 Cb 1.20 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.33 2fhf h PRO 823 CO 0.41 0.02 0.00 0.25 -0.23 0.00 0.00 178.00 178.45 2fhf n THR 824 N -3.33 0.16 0.69 1.56 -2.24 -1.26 -1.63 114.28 108.23 2fhf n THR 824 Ca -0.02 0.04 0.12 0.00 -2.27 0.00 0.00 64.05 61.92 2fhf n THR 824 Cb 0.13 -0.70 0.15 0.00 -2.10 0.00 0.00 70.33 67.81 2fhf n THR 824 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2fhf n GLU 825 N -1.13 2.41 -5.04 -0.78 1.02 -0.54 -4.48 120.64 112.10 2fhf n GLU 825 Ca 0.13 -2.09 -0.30 0.00 -0.02 0.00 0.00 57.16 54.88 2fhf n GLU 825 Cb 0.11 -1.48 -0.17 0.00 -0.02 0.00 0.00 31.44 29.88 2fhf n GLU 825 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 2fhf s VAL 826 N -1.77 1.83 -0.32 2.62 1.01 -0.65 -1.69 120.40 121.43 2fhf s VAL 826 Ca 0.33 -0.88 -0.02 0.00 0.00 0.00 0.00 61.98 61.40 2fhf s VAL 826 Cb 0.21 -1.60 0.06 0.00 0.00 0.00 0.00 36.38 35.05 2fhf s VAL 826 CO 0.31 0.51 0.05 -0.69 0.00 0.00 0.00 175.10 175.28 2fhf s VAL 827 N 0.45 3.12 0.25 2.92 1.01 -0.65 -1.00 120.40 126.49 2fhf s VAL 827 Ca -0.17 -1.50 -0.14 0.00 0.00 0.00 0.00 61.98 60.17 2fhf s VAL 827 Cb -0.17 -2.86 -0.08 0.00 0.00 0.00 0.00 36.38 33.26 2fhf s VAL 827 CO 0.07 -0.23 0.65 0.20 0.00 0.00 0.00 175.10 175.80 2fhf s ASN 828 N 1.37 6.79 -0.03 3.32 0.01 -0.09 -1.20 114.94 125.12 2fhf s ASN 828 Ca -0.02 1.18 -0.29 0.00 -0.71 0.00 0.00 52.86 53.02 2fhf s ASN 828 Cb -0.20 -2.33 0.10 0.00 0.41 0.00 0.00 41.25 39.23 2fhf s ASN 828 CO -0.01 -0.08 0.87 -0.72 -1.51 0.00 0.00 177.10 175.65 2fhf s TYR 829 N -1.78 -0.39 0.00 2.20 1.13 -1.26 -1.59 117.35 115.66 2fhf s TYR 829 Ca 0.48 0.37 0.00 0.00 -1.41 0.00 0.00 57.07 56.50 2fhf s TYR 829 Cb -0.12 0.51 0.00 0.00 -1.10 0.00 0.00 41.96 41.25 2fhf s TYR 829 CO 0.19 -0.53 0.68 1.33 -2.51 0.00 0.00 175.55 174.71 2fhf n VAL 830 N 0.01 0.46 -3.56 -3.49 0.24 -1.26 -3.75 118.33 106.98 2fhf n VAL 830 Ca -0.10 -0.54 -0.14 0.00 -2.04 0.00 0.00 64.34 61.52 2fhf n VAL 830 Cb 0.61 0.87 -0.06 0.00 -1.47 0.00 0.00 33.84 33.79 2fhf n VAL 830 CO 0.00 0.00 0.00 -0.55 -2.14 0.00 0.00 176.83 174.14 2fhf s SER 831 N -0.46 -0.56 0.27 -1.34 0.15 -1.26 -4.43 113.70 106.07 2fhf s SER 831 Ca 0.00 0.74 -0.21 0.00 0.70 0.00 0.00 55.95 57.18 2fhf s SER 831 Cb 0.00 0.63 0.02 0.00 -1.71 0.00 0.00 66.02 64.96 2fhf s SER 831 CO 0.00 -0.44 0.74 -0.75 1.20 0.00 0.00 173.24 173.99 2fhf s LYS 832 N -0.82 1.76 0.36 5.44 2.20 -1.26 -3.28 119.74 124.15 2fhf s LYS 832 Ca -0.05 -0.97 0.06 0.00 -0.36 0.00 0.00 55.97 54.65 2fhf s LYS 832 Cb -0.01 0.60 0.76 0.00 -1.51 0.00 0.00 37.83 37.66 2fhf s LYS 832 CO 0.05 -0.81 1.95 1.12 -0.36 0.00 0.00 175.35 177.30 2fhf h HIS 833 N 2.00 0.76 -3.93 4.03 2.07 -1.96 -3.42 115.15 114.70 2fhf h HIS 833 Ca -0.19 0.02 -0.48 0.00 -2.85 0.00 0.00 60.37 56.87 2fhf h HIS 833 Cb 1.25 -0.25 0.01 0.00 2.57 0.00 0.00 27.41 30.99 2fhf h HIS 833 CO 0.44 0.39 0.40 -0.51 -3.07 0.00 0.00 177.93 175.57 2fhf s ASP 834 N -6.15 6.94 0.28 3.10 -0.00 -1.26 -4.71 116.67 114.87 2fhf s ASP 834 Ca -0.10 2.00 0.00 0.00 -0.00 0.00 0.00 52.55 54.46 2fhf s ASP 834 Cb 0.20 -2.59 0.00 0.00 -0.00 0.00 0.00 42.92 40.53 2fhf s ASP 834 CO 0.77 -0.36 0.00 0.59 -0.00 0.00 0.00 175.17 176.17 2fhf n ASN 835 N 0.17 -6.16 -4.75 0.27 3.02 -0.74 -4.87 115.26 102.20 2fhf n ASN 835 Ca 0.04 0.54 -0.38 0.00 -0.03 0.00 0.00 54.58 54.75 2fhf n ASN 835 Cb 0.49 -3.21 0.04 0.00 -0.61 0.00 0.00 39.78 36.49 2fhf n ASN 835 CO 0.00 0.00 0.00 -1.10 -2.62 0.00 0.00 177.26 173.54 2fhf s GLN 836 N -2.29 3.18 0.82 3.52 1.11 -1.23 -4.77 119.66 120.00 2fhf s GLN 836 Ca 0.00 2.14 -0.11 0.00 0.01 0.00 0.00 55.36 57.41 2fhf s GLN 836 Cb 0.00 -2.24 0.08 0.00 -1.01 0.00 0.00 33.01 29.85 2fhf s GLN 836 CO 0.00 -1.13 1.10 0.95 0.01 0.00 0.00 175.29 176.22 2fhf s THR 837 N -1.36 3.02 0.21 -0.19 -4.23 -1.26 -4.78 115.64 107.06 2fhf s THR 837 Ca 0.71 0.33 -0.09 0.00 -1.18 0.00 0.00 61.69 61.47 2fhf s THR 837 Cb -0.38 -2.73 0.15 0.00 1.34 0.00 0.00 72.50 70.88 2fhf s THR 837 CO 0.45 -0.43 1.81 0.25 -0.54 0.00 0.00 174.62 176.15 2fhf h LEU 838 N -1.32 0.56 -0.75 4.79 5.85 -1.82 -1.14 115.31 121.48 2fhf h LEU 838 Ca -0.44 0.03 -0.03 0.00 0.84 0.00 0.00 57.88 58.28 2fhf h LEU 838 Cb 1.24 -0.08 -0.03 0.00 0.37 0.00 0.00 40.66 42.16 2fhf h LEU 838 CO 0.50 0.36 0.36 -0.25 -0.34 0.00 0.00 178.44 179.07 2fhf h TRP 839 N 0.70 1.08 -0.25 1.25 2.91 -1.86 -0.51 115.95 119.26 2fhf h TRP 839 Ca 0.31 -0.05 -0.08 0.00 1.13 0.00 0.00 58.89 60.19 2fhf h TRP 839 Cb 0.20 -0.33 -0.01 0.00 -0.51 0.00 0.00 29.16 28.50 2fhf h TRP 839 CO -0.08 0.79 -0.21 -0.44 -1.03 0.00 0.00 178.44 177.48 2fhf h ASP 840 N 1.05 0.45 -0.32 2.65 3.45 -1.65 0.27 116.42 122.33 2fhf h ASP 840 Ca 0.26 -0.14 -0.09 0.00 0.43 0.00 0.00 57.03 57.49 2fhf h ASP 840 Cb 0.11 -0.12 -0.01 0.00 -0.56 0.00 0.00 39.33 38.75 2fhf h ASP 840 CO -0.03 0.67 -0.15 0.24 -1.57 0.00 0.00 179.24 178.40 2fhf h MET 841 N 0.41 0.67 -0.37 3.56 2.86 -0.68 -0.84 114.93 120.55 2fhf h MET 841 Ca 0.07 -0.29 -0.04 0.00 -2.06 0.00 0.00 59.70 57.38 2fhf h MET 841 Cb 0.59 -0.02 -0.02 0.00 0.06 0.00 0.00 31.60 32.22 2fhf h MET 841 CO 0.04 0.88 0.06 0.82 1.06 0.00 0.00 176.91 179.77 2fhf h ILE 842 N 0.43 1.18 -0.11 -1.22 2.04 -0.80 -0.43 117.51 118.61 2fhf h ILE 842 Ca 0.07 -0.68 -0.11 0.00 1.00 0.00 0.00 64.86 65.14 2fhf h ILE 842 Cb 0.68 0.84 -0.01 0.00 -0.74 0.00 0.00 36.82 37.58 2fhf h ILE 842 CO 0.05 0.24 -0.44 0.28 0.00 0.00 0.00 178.15 178.28 2fhf h SER 843 N 0.54 0.26 0.24 1.72 0.02 -0.61 0.21 113.55 115.93 2fhf h SER 843 Ca 0.12 -0.12 -0.18 0.00 -0.84 0.00 0.00 61.79 60.78 2fhf h SER 843 Cb 0.25 -0.07 -0.01 0.00 0.14 0.00 0.00 62.40 62.71 2fhf h SER 843 CO 0.00 0.67 -0.70 1.88 -1.14 0.00 0.00 176.83 177.55 2fhf h TYR 844 N 0.21 0.55 0.00 3.45 0.05 -0.23 -3.39 116.97 117.60 2fhf h TYR 844 Ca 0.02 -0.23 -0.16 0.00 0.05 0.00 0.00 58.73 58.41 2fhf h TYR 844 Cb 0.86 -0.09 -0.03 0.00 1.01 0.00 0.00 36.73 38.49 2fhf h TYR 844 CO 0.02 0.98 -2.08 1.63 -1.05 0.00 0.00 178.16 177.65 2fhf n LYS 845 N -3.86 0.77 -1.79 4.88 5.02 -0.26 -4.13 118.16 118.79 2fhf n LYS 845 Ca -0.04 -0.10 -0.41 0.00 -2.02 0.00 0.00 58.31 55.73 2fhf n LYS 845 Cb 0.69 -1.48 -0.01 0.00 -0.02 0.00 0.00 35.03 34.21 2fhf n LYS 845 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2fhf s ALA 846 N -2.97 3.62 0.61 7.82 0.00 0.72 -4.68 121.76 126.89 2fhf s ALA 846 Ca -0.08 1.58 -0.19 0.00 0.00 0.00 0.00 51.96 53.27 2fhf s ALA 846 Cb 0.10 -3.62 -0.03 0.00 0.00 0.00 0.00 23.12 19.57 2fhf s ALA 846 CO 0.80 -1.04 1.30 0.00 0.00 0.00 0.00 175.76 176.82 2fhf s ALA 847 N -0.81 2.53 0.37 0.00 0.00 -1.26 -4.89 121.76 117.70 2fhf s ALA 847 Ca 0.56 1.22 0.09 0.00 0.00 0.00 0.00 51.96 53.83 2fhf s ALA 847 Cb -0.47 -3.54 0.84 0.00 0.00 0.00 0.00 23.12 19.95 2fhf s ALA 847 CO 0.59 -1.46 1.90 1.96 0.00 0.00 0.00 175.76 178.75 2fhf h GLN 848 N 0.87 0.64 0.00 0.00 4.20 -1.92 -1.48 115.11 117.41 2fhf h GLN 848 Ca -0.51 -0.04 0.00 0.00 0.06 0.00 0.00 58.65 58.16 2fhf h GLN 848 Cb 1.32 -0.14 0.00 0.00 0.30 0.00 0.00 27.48 28.96 2fhf h GLN 848 CO 0.55 0.42 0.00 -0.85 -0.67 0.00 0.00 178.83 178.28 2fhf n GLU 849 N -4.52 0.14 -2.43 1.46 0.00 -1.26 -4.67 120.64 109.36 2fhf n GLU 849 Ca 0.15 0.07 -0.43 0.00 0.00 0.00 0.00 57.16 56.95 2fhf n GLU 849 Cb 0.41 -1.50 -0.02 0.00 0.00 0.00 0.00 31.44 30.33 2fhf n GLU 849 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 2fhf s ALA 850 N -2.83 3.06 1.09 -1.84 0.00 -0.56 -5.00 121.76 115.69 2fhf s ALA 850 Ca 0.16 -0.30 -0.17 0.00 0.00 0.00 0.00 51.96 51.65 2fhf s ALA 850 Cb 0.16 -3.94 0.24 0.00 0.00 0.00 0.00 23.12 19.58 2fhf s ALA 850 CO 0.42 -2.40 1.18 0.16 0.00 0.00 0.00 175.76 175.11 2fhf s ASP 851 N 3.52 1.91 0.16 0.00 1.47 -1.26 -4.76 116.67 117.70 2fhf s ASP 851 Ca 0.56 0.58 -0.16 0.00 1.18 0.00 0.00 52.55 54.71 2fhf s ASP 851 Cb -0.11 -0.81 0.09 0.00 -0.34 0.00 0.00 42.92 41.74 2fhf s ASP 851 CO 0.32 -3.51 1.72 0.25 0.68 0.00 0.00 175.17 174.63 2fhf h LEU 852 N -2.16 -0.04 -0.97 2.11 5.85 -1.94 -1.65 115.31 116.50 2fhf h LEU 852 Ca -0.46 0.07 0.04 0.00 0.84 0.00 0.00 57.88 58.37 2fhf h LEU 852 Cb 1.28 0.11 -0.06 0.00 0.37 0.00 0.00 40.66 42.36 2fhf h LEU 852 CO 0.39 0.01 0.64 -0.78 -0.34 0.00 0.00 178.44 178.36 2fhf h ASP 853 N 0.16 1.06 -0.44 1.25 3.58 -2.00 -1.67 116.42 118.37 2fhf h ASP 853 Ca 0.18 -0.01 -0.07 0.00 0.42 0.00 0.00 57.03 57.55 2fhf h ASP 853 Cb 0.22 -0.24 -0.02 0.00 1.72 0.00 0.00 39.33 41.01 2fhf h ASP 853 CO -0.26 0.72 0.03 0.74 -2.88 0.00 0.00 179.24 177.59 2fhf h THR 854 N 1.23 1.24 -0.11 2.25 2.02 -1.76 -2.44 112.91 115.34 2fhf h THR 854 Ca 0.39 -0.98 -0.10 0.00 0.77 0.00 0.00 66.41 66.49 2fhf h THR 854 Cb 0.00 0.83 -0.01 0.00 -1.74 0.00 0.00 68.15 67.23 2fhf h THR 854 CO -0.12 0.35 -0.36 0.03 0.37 0.00 0.00 175.52 175.78 2fhf h ARG 855 N 0.78 0.23 -0.47 6.66 3.08 -0.43 0.17 114.38 124.40 2fhf h ARG 855 Ca 0.15 -0.10 -0.11 0.00 0.07 0.00 0.00 59.98 59.99 2fhf h ARG 855 Cb 0.43 -0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.46 2fhf h ARG 855 CO 0.02 0.57 -0.14 0.28 -1.07 0.00 0.00 179.97 179.62 2fhf h VAL 856 N 0.20 1.27 -0.14 2.04 2.07 -1.12 -1.70 116.25 118.87 2fhf h VAL 856 Ca 0.02 -1.29 -0.09 0.00 0.82 0.00 0.00 66.70 66.17 2fhf h VAL 856 Cb 0.74 1.12 -0.01 0.00 -1.52 0.00 0.00 31.29 31.61 2fhf h VAL 856 CO 0.06 0.44 -0.31 0.03 0.02 0.00 0.00 177.57 177.81 2fhf h ARG 857 N 0.78 0.28 -0.58 1.57 3.08 -0.96 -1.87 114.38 116.67 2fhf h ARG 857 Ca 0.12 -0.11 -0.06 0.00 0.07 0.00 0.00 59.98 59.99 2fhf h ARG 857 Cb 0.71 -0.01 -0.03 0.00 0.08 0.00 0.00 29.97 30.71 2fhf h ARG 857 CO 0.05 0.57 0.10 0.52 -1.07 0.00 0.00 179.97 180.15 2fhf h MET 858 N 0.25 0.92 -0.44 0.04 2.86 -0.60 0.37 114.93 118.33 2fhf h MET 858 Ca 0.03 -0.22 -0.03 0.00 -2.06 0.00 0.00 59.70 57.43 2fhf h MET 858 Cb 0.68 -0.12 -0.02 0.00 0.06 0.00 0.00 31.60 32.20 2fhf h MET 858 CO 0.05 0.85 0.16 0.37 1.06 0.00 0.00 176.91 179.40 2fhf h GLN 859 N 0.87 0.66 -0.46 1.72 5.75 -0.76 -0.50 115.11 122.40 2fhf h GLN 859 Ca 0.18 -0.13 -0.11 0.00 -0.15 0.00 0.00 58.65 58.44 2fhf h GLN 859 Cb 0.37 -0.10 -0.01 0.00 1.07 0.00 0.00 27.48 28.80 2fhf h GLN 859 CO 0.01 0.62 -0.14 0.00 -2.65 0.00 0.00 178.83 176.66 2fhf h ALA 860 N 1.01 0.64 -0.76 3.38 0.00 -0.86 -1.91 119.26 120.77 2fhf h ALA 860 Ca 0.15 -0.35 -0.04 0.00 0.00 0.00 0.00 54.91 54.66 2fhf h ALA 860 Cb 0.21 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 17.81 2fhf h ALA 860 CO -0.01 0.57 0.31 0.28 0.00 0.00 0.00 179.25 180.40 2fhf h VAL 861 N 0.76 1.25 -0.26 0.00 2.07 -0.14 0.82 116.25 120.75 2fhf h VAL 861 Ca 0.11 -0.78 -0.01 0.00 0.82 0.00 0.00 66.70 66.85 2fhf h VAL 861 Cb 0.70 0.35 -0.01 0.00 -1.52 0.00 0.00 31.29 30.81 2fhf h VAL 861 CO 0.05 0.32 0.13 0.28 0.02 0.00 0.00 177.57 178.37 2fhf h SER 862 N 1.09 0.33 0.48 0.57 0.02 -0.95 -2.52 113.55 112.57 2fhf h SER 862 Ca 0.25 -0.11 -0.05 0.00 -0.84 0.00 0.00 61.79 61.04 2fhf h SER 862 Cb 0.19 -0.09 -0.01 0.00 0.14 0.00 0.00 62.40 62.64 2fhf h SER 862 CO -0.02 0.35 -0.26 -0.07 -1.14 0.00 0.00 176.83 175.69 2fhf h LEU 863 N 0.30 0.00 -1.36 5.07 3.38 -1.06 -2.93 115.31 118.70 2fhf h LEU 863 Ca 0.09 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.03 2fhf h LEU 863 Cb 0.09 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.83 2fhf h LEU 863 CO -0.01 0.26 0.12 0.00 0.09 0.00 0.00 178.44 178.89 2fhf h ALA 864 N 1.74 1.50 0.00 1.53 0.00 -0.38 -0.74 119.26 122.91 2fhf h ALA 864 Ca -0.00 -0.13 -0.03 0.00 0.00 0.00 0.00 54.91 54.74 2fhf h ALA 864 Cb 0.57 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 18.19 2fhf h ALA 864 CO 0.03 0.38 -0.16 1.79 0.00 0.00 0.00 179.25 181.29 2fhf h THR 865 N 0.55 0.87 0.00 0.00 1.35 -1.47 -1.04 112.91 113.16 2fhf h THR 865 Ca 0.13 -0.62 -0.06 0.00 -0.55 0.00 0.00 66.41 65.31 2fhf h THR 865 Cb 0.17 1.36 -0.01 0.00 -1.73 0.00 0.00 68.15 67.94 2fhf h THR 865 CO -0.01 0.16 -0.51 0.58 -0.25 0.00 0.00 175.52 175.49 2fhf h VAL 866 N 0.00 0.58 -0.22 6.82 2.07 -1.47 -3.29 116.25 120.74 2fhf h VAL 866 Ca -0.00 -1.57 -0.01 0.00 0.82 0.00 0.00 66.70 65.94 2fhf h VAL 866 Cb 0.34 1.23 -0.01 0.00 -1.52 0.00 0.00 31.29 31.33 2fhf h VAL 866 CO 0.02 0.20 0.09 0.24 0.02 0.00 0.00 177.57 178.13 2fhf h MET 867 N -1.00 0.30 -0.64 1.57 2.86 -1.14 -2.35 114.93 114.53 2fhf h MET 867 Ca -0.10 -0.03 0.00 0.00 -2.06 0.00 0.00 59.70 57.52 2fhf h MET 867 Cb 0.70 -0.06 0.00 0.00 0.06 0.00 0.00 31.60 32.30 2fhf h MET 867 CO -0.06 0.25 0.00 1.28 1.06 0.00 0.00 176.91 179.44 2fhf n LEU 868 N -4.45 3.65 -4.96 1.22 4.77 -0.40 -4.56 117.00 112.27 2fhf n LEU 868 Ca 0.00 -1.78 -0.22 0.00 -0.03 0.00 0.00 56.01 53.98 2fhf n LEU 868 Cb 0.12 -0.42 0.02 0.00 -2.33 0.00 0.00 43.42 40.81 2fhf n LEU 868 CO 0.35 0.89 0.31 -0.83 -1.33 0.00 0.00 177.39 176.78 2fhf s GLY 869 N -1.10 1.67 0.33 -0.72 0.00 -0.89 -5.01 107.32 101.61 2fhf s GLY 869 Ca 0.45 -1.18 0.17 0.00 0.00 0.00 0.00 44.72 44.16 2fhf s GLY 869 CO 0.32 -0.97 1.54 1.46 0.00 0.00 0.00 173.10 175.44 2fhf h GLN 870 N 0.29 0.00 -7.34 2.90 1.08 -0.92 -3.46 115.11 107.67 2fhf h GLN 870 Ca -0.44 0.00 -0.50 0.00 -1.45 0.00 0.00 58.65 56.26 2fhf h GLN 870 Cb 1.27 0.00 0.13 0.00 -0.05 0.00 0.00 27.48 28.83 2fhf h GLN 870 CO 0.55 0.40 0.30 0.20 -0.95 0.00 0.00 178.83 179.33 2fhf s GLY 871 N -4.40 1.65 0.38 3.46 0.00 -1.26 -4.72 107.32 102.43 2fhf s GLY 871 Ca 0.04 0.07 -0.28 0.00 0.00 0.00 0.00 44.72 44.55 2fhf s GLY 871 CO 0.72 0.47 1.46 -0.42 0.00 0.00 0.00 173.10 175.33 2fhf s ILE 872 N -2.96 2.12 -0.18 0.90 1.01 -0.17 -4.77 121.20 117.14 2fhf s ILE 872 Ca 0.61 0.12 -0.14 0.00 0.00 0.00 0.00 60.65 61.25 2fhf s ILE 872 Cb -0.17 -3.07 -0.05 0.00 0.01 0.00 0.00 42.46 39.18 2fhf s ILE 872 CO 0.56 0.03 0.29 0.00 0.00 0.00 0.00 174.94 175.82 2fhf s ALA 873 N -1.13 3.59 -0.01 9.38 0.00 -0.86 -0.91 121.76 131.82 2fhf s ALA 873 Ca 0.53 -0.55 0.04 0.00 0.00 0.00 0.00 51.96 51.98 2fhf s ALA 873 Cb -0.46 -2.43 -0.01 0.00 0.00 0.00 0.00 23.12 20.23 2fhf s ALA 873 CO 0.61 -0.04 -0.11 0.12 0.00 0.00 0.00 175.76 176.34 2fhf s PHE 874 N 0.75 1.02 0.06 0.00 2.19 -0.62 -0.15 117.98 121.22 2fhf s PHE 874 Ca 0.15 -0.20 -0.16 0.00 0.33 0.00 0.00 56.93 57.04 2fhf s PHE 874 Cb -0.13 -0.65 0.03 0.00 -1.31 0.00 0.00 43.02 40.96 2fhf s PHE 874 CO 0.04 -0.01 0.38 0.34 1.83 0.00 0.00 175.22 177.80 2fhf s ASP 875 N -0.33 -0.23 0.25 6.13 3.68 -0.51 -4.31 116.67 121.35 2fhf s ASP 875 Ca 0.04 -0.11 -0.30 0.00 2.13 0.00 0.00 52.55 54.32 2fhf s ASP 875 Cb -0.05 0.41 -0.09 0.00 -1.45 0.00 0.00 42.92 41.74 2fhf s ASP 875 CO -0.00 -0.68 0.97 -1.58 0.13 0.00 0.00 175.17 174.01 2fhf s GLN 876 N -2.70 4.82 0.09 4.34 0.74 -1.20 -0.79 119.66 124.95 2fhf s GLN 876 Ca -0.04 1.54 -0.34 0.00 0.05 0.00 0.00 55.36 56.57 2fhf s GLN 876 Cb -0.00 -3.25 -0.13 0.00 1.10 0.00 0.00 33.01 30.72 2fhf s GLN 876 CO -0.04 0.46 1.66 0.94 -0.55 0.00 0.00 175.29 177.76 2fhf n GLN 877 N 1.41 2.16 -0.00 1.67 7.27 -0.40 -2.06 117.38 127.43 2fhf n GLN 877 Ca -0.02 0.78 0.00 0.00 0.07 0.00 0.00 57.00 57.83 2fhf n GLN 877 Cb 0.47 -2.57 0.00 0.00 2.41 0.00 0.00 30.24 30.55 2fhf n GLN 877 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 2fhf n GLY 878 N 3.68 0.07 0.26 1.69 0.00 -1.26 -4.94 105.19 104.70 2fhf n GLY 878 Ca 0.18 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.29 2fhf n GLY 878 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2fhf h SER 879 N 0.00 0.00 0.58 1.61 0.02 -1.78 0.19 113.55 114.17 2fhf h SER 879 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2fhf h SER 879 Cb 0.00 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.54 2fhf h SER 879 CO 0.00 0.04 0.00 -1.84 -1.14 0.00 0.00 176.83 173.89 2fhf n GLU 880 N -4.39 0.11 -0.23 3.45 0.00 -1.26 -2.12 120.64 116.20 2fhf n GLU 880 Ca -0.03 0.13 0.09 0.00 0.00 0.00 0.00 57.16 57.35 2fhf n GLU 880 Cb 0.12 -1.50 0.18 0.00 0.00 0.00 0.00 31.44 30.24 2fhf n GLU 880 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.13 178.41 2fhf n LEU 881 N -1.42 2.87 -3.28 -1.84 4.77 0.56 -2.49 117.00 116.17 2fhf n LEU 881 Ca 0.07 -3.14 -0.24 0.00 -0.03 0.00 0.00 56.01 52.67 2fhf n LEU 881 Cb 0.21 -0.48 0.02 0.00 -2.33 0.00 0.00 43.42 40.84 2fhf n LEU 881 CO 0.18 0.75 0.01 0.18 -1.33 0.00 0.00 177.39 177.18 2fhf n LEU 882 N -1.15 -2.25 -4.59 2.23 4.77 -0.90 -4.64 117.00 110.49 2fhf n LEU 882 Ca 0.18 -0.39 -0.56 0.00 -0.03 0.00 0.00 56.01 55.22 2fhf n LEU 882 Cb 0.73 -2.59 -0.07 0.00 -2.33 0.00 0.00 43.42 39.16 2fhf n LEU 882 CO 0.05 0.25 0.87 -1.14 -1.33 0.00 0.00 177.39 176.09 2fhf n ARG 883 N -4.03 0.75 -4.37 3.23 0.63 -0.61 -4.77 116.66 107.50 2fhf n ARG 883 Ca -0.05 0.27 -0.25 0.00 -0.92 0.00 0.00 57.85 56.91 2fhf n ARG 883 Cb 0.58 -1.87 -0.12 0.00 0.45 0.00 0.00 32.46 31.50 2fhf n ARG 883 CO 0.00 0.00 0.00 0.45 -2.51 0.00 0.00 177.63 175.57 2fhf s SER 884 N 0.82 3.01 -0.15 6.15 0.15 -0.29 -4.20 113.70 119.19 2fhf s SER 884 Ca 0.89 -0.83 0.15 0.00 0.70 0.00 0.00 55.95 56.86 2fhf s SER 884 Cb -1.09 -0.20 0.33 0.00 -1.71 0.00 0.00 66.02 63.36 2fhf s SER 884 CO 0.54 0.05 1.17 0.29 1.20 0.00 0.00 173.24 176.49 2fhf n LYS 885 N 0.43 1.28 -3.25 5.44 5.02 -1.26 -4.62 118.16 121.20 2fhf n LYS 885 Ca -0.14 -2.76 -0.23 0.00 -2.02 0.00 0.00 58.31 53.15 2fhf n LYS 885 Cb 0.56 -1.43 0.04 0.00 -0.02 0.00 0.00 35.03 34.18 2fhf n LYS 885 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 2fhf n SER 886 N -1.16 -5.99 0.00 4.39 2.88 -1.25 -1.88 113.62 110.61 2fhf n SER 886 Ca 0.16 -0.39 0.00 0.00 -1.33 0.00 0.00 58.87 57.31 2fhf n SER 886 Cb 0.68 -4.81 0.00 0.00 -0.75 0.00 0.00 64.21 59.34 2fhf n SER 886 CO 0.00 0.00 0.00 0.49 -1.23 0.00 0.00 175.04 174.30 2fhf n PHE 887 N -4.63 0.00 -1.88 0.66 3.72 -1.26 -3.99 117.46 110.07 2fhf n PHE 887 Ca -0.06 0.00 -0.42 0.00 -0.05 0.00 0.00 57.45 56.92 2fhf n PHE 887 Cb 0.59 -0.31 -0.03 0.00 -0.94 0.00 0.00 39.48 38.79 2fhf n PHE 887 CO 0.00 0.00 0.00 0.99 -0.05 0.00 0.00 176.76 177.70 2fhf s THR 888 N -2.50 2.53 -0.12 4.37 2.01 -0.78 -4.92 115.64 116.23 2fhf s THR 888 Ca 0.00 0.35 -0.25 0.00 0.31 0.00 0.00 61.69 62.10 2fhf s THR 888 Cb 0.00 -3.22 -0.27 0.00 0.01 0.00 0.00 72.50 69.02 2fhf s THR 888 CO 0.00 0.02 0.73 -0.09 -0.69 0.00 0.00 174.62 174.59 2fhf h ARG 889 N 6.96 0.10 -3.33 4.92 2.43 -1.91 -3.39 114.38 120.16 2fhf h ARG 889 Ca -0.43 -0.17 -0.63 0.00 -0.81 0.00 0.00 59.98 57.94 2fhf h ARG 889 Cb 1.20 0.06 -0.41 0.00 -0.42 0.00 0.00 29.97 30.41 2fhf h ARG 889 CO 0.93 1.08 -0.67 0.34 -1.51 0.00 0.00 179.97 180.13 2fhf s ASP 890 N -6.55 4.11 -0.10 -3.80 3.68 -1.26 -1.79 116.67 110.96 2fhf s ASP 890 Ca -0.19 -2.80 0.08 0.00 2.13 0.00 0.00 52.55 51.78 2fhf s ASP 890 Cb -0.00 -1.42 0.42 0.00 -1.45 0.00 0.00 42.92 40.47 2fhf s ASP 890 CO 0.72 -0.26 1.19 -1.54 0.13 0.00 0.00 175.17 175.42 2fhf n SER 891 N 3.37 3.24 -0.30 -0.34 3.41 -1.26 -4.62 113.62 117.11 2fhf n SER 891 Ca 0.06 -2.40 0.31 0.00 -0.26 0.00 0.00 58.87 56.58 2fhf n SER 891 Cb 0.34 -0.53 0.68 0.00 -0.26 0.00 0.00 64.21 64.43 2fhf n SER 891 CO 0.00 0.00 0.00 0.10 -0.16 0.00 0.00 175.04 174.98 2fhf h TYR 892 N 2.17 0.20 0.00 7.33 -0.00 -1.94 -1.23 116.97 123.50 2fhf h TYR 892 Ca 0.00 0.01 -0.03 0.00 -0.00 0.00 0.00 58.73 58.70 2fhf h TYR 892 Cb 1.14 -0.06 -0.07 0.00 -0.00 0.00 0.00 36.73 37.74 2fhf h TYR 892 CO 0.52 0.02 -0.45 -3.47 -0.00 0.00 0.00 178.16 174.78 2fhf n ASP 893 N -4.33 1.40 -0.56 0.10 4.64 -1.26 -1.99 116.55 114.54 2fhf n ASP 893 Ca 0.25 -2.87 0.05 0.00 -1.38 0.00 0.00 54.79 50.84 2fhf n ASP 893 Cb 1.10 -0.38 0.13 0.00 -1.04 0.00 0.00 41.12 40.93 2fhf n ASP 893 CO 0.00 0.00 0.00 -1.20 -0.82 0.00 0.00 177.20 175.18 2fhf n SER 894 N -0.66 1.63 -0.93 1.67 7.64 -0.46 -4.74 113.62 117.76 2fhf n SER 894 Ca 0.11 -2.01 0.05 0.00 1.01 0.00 0.00 58.87 58.04 2fhf n SER 894 Cb 0.76 -0.21 -0.01 0.00 -1.01 0.00 0.00 64.21 63.74 2fhf n SER 894 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2fhf n GLY 895 N 0.97 -1.40 0.23 0.23 0.00 -1.26 -3.34 105.19 100.61 2fhf n GLY 895 Ca 0.10 -1.12 0.04 0.00 0.00 0.00 0.00 46.02 45.04 2fhf n GLY 895 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2fhf h ASP 896 N -0.34 0.12 0.54 1.61 3.32 -1.96 -2.89 116.42 116.81 2fhf h ASP 896 Ca 0.01 -0.02 -0.03 0.00 0.02 0.00 0.00 57.03 57.01 2fhf h ASP 896 Cb 0.34 -0.03 0.01 0.00 0.22 0.00 0.00 39.33 39.86 2fhf h ASP 896 CO 0.00 0.29 -0.26 -0.25 -1.72 0.00 0.00 179.24 177.31 2fhf h TRP 897 N 0.12 -0.67 0.00 4.55 2.91 -2.00 -1.87 115.95 118.99 2fhf h TRP 897 Ca 0.02 -0.02 0.00 0.00 1.13 0.00 0.00 58.89 60.03 2fhf h TRP 897 Cb 0.36 0.22 0.00 0.00 -0.51 0.00 0.00 29.16 29.23 2fhf h TRP 897 CO 0.00 -0.40 -0.29 0.74 -1.03 0.00 0.00 178.44 177.46 2fhf h PHE 898 N -0.76 0.00 -0.37 2.65 0.04 -1.62 -3.29 116.94 113.59 2fhf h PHE 898 Ca -0.07 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.70 2fhf h PHE 898 Cb 0.57 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.72 2fhf h PHE 898 CO -0.03 0.00 0.00 0.09 -0.60 0.00 0.00 178.31 177.77 2fhf n ASN 899 N -2.49 3.42 -4.65 2.17 4.13 -1.09 -4.33 115.26 112.42 2fhf n ASN 899 Ca 0.04 -1.99 -0.46 0.00 1.68 0.00 0.00 54.58 53.85 2fhf n ASN 899 Cb 0.47 -0.24 -0.03 0.00 -1.54 0.00 0.00 39.78 38.45 2fhf n ASN 899 CO 0.00 0.00 0.00 -1.14 0.28 0.00 0.00 177.26 176.40 2fhf n ARG 900 N 1.48 1.89 -3.90 3.52 0.63 -0.71 -4.83 116.66 114.73 2fhf n ARG 900 Ca 0.19 0.67 -0.29 0.00 -0.92 0.00 0.00 57.85 57.51 2fhf n ARG 900 Cb 0.61 -2.31 -0.16 0.00 0.45 0.00 0.00 32.46 31.04 2fhf n ARG 900 CO 0.00 0.00 0.00 0.08 -2.51 0.00 0.00 177.63 175.20 2fhf s VAL 901 N -0.01 1.19 -0.62 5.15 1.01 -1.26 -4.75 120.40 121.10 2fhf s VAL 901 Ca 0.70 -0.75 -0.20 0.00 0.00 0.00 0.00 61.98 61.73 2fhf s VAL 901 Cb -0.69 -1.39 0.09 0.00 0.00 0.00 0.00 36.38 34.39 2fhf s VAL 901 CO 0.49 0.08 0.81 -0.62 0.00 0.00 0.00 175.10 175.86 2fhf s ASP 902 N 1.59 6.19 0.00 3.32 3.68 -1.26 -4.77 116.67 125.41 2fhf s ASP 902 Ca -0.01 -1.28 0.21 0.00 2.13 0.00 0.00 52.55 53.60 2fhf s ASP 902 Cb -0.16 -2.35 1.24 0.00 -1.45 0.00 0.00 42.92 40.20 2fhf s ASP 902 CO -0.08 -1.24 1.73 -1.22 0.13 0.00 0.00 175.17 174.49 2fhf n TYR 903 N 6.86 0.00 1.24 -5.34 4.02 -1.26 -1.81 117.16 120.86 2fhf n TYR 903 Ca -0.07 0.00 0.13 0.00 -0.01 0.00 0.00 57.90 57.95 2fhf n TYR 903 Cb 0.44 0.00 0.35 0.00 -0.02 0.00 0.00 39.34 40.11 2fhf n TYR 903 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 176.86 174.72 2fhf n SER 904 N -0.86 1.15 -1.96 7.72 3.41 -1.26 -4.76 113.62 117.07 2fhf n SER 904 Ca 0.16 -0.99 -0.16 0.00 -0.26 0.00 0.00 58.87 57.61 2fhf n SER 904 Cb 0.07 0.15 -0.00 0.00 -0.26 0.00 0.00 64.21 64.17 2fhf n SER 904 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2fhf n LEU 905 N -0.53 -1.88 0.12 1.04 4.77 -0.75 -4.95 117.00 114.82 2fhf n LEU 905 Ca 0.12 -0.06 -0.22 0.00 -0.03 0.00 0.00 56.01 55.82 2fhf n LEU 905 Cb 0.36 -2.40 -0.14 0.00 -2.33 0.00 0.00 43.42 38.91 2fhf n LEU 905 CO 0.25 -0.10 -0.14 1.56 -1.33 0.00 0.00 177.39 177.63 2fhf h GLN 906 N -0.22 0.51 -2.95 3.23 1.08 -1.92 -2.99 115.11 111.86 2fhf h GLN 906 Ca -0.39 -0.80 0.06 0.00 -1.45 0.00 0.00 58.65 56.07 2fhf h GLN 906 Cb 1.28 0.29 -0.04 0.00 -0.05 0.00 0.00 27.48 28.96 2fhf h GLN 906 CO 0.45 1.38 0.26 0.16 -0.95 0.00 0.00 178.83 180.13 2fhf s ASP 907 N -7.45 -0.21 -0.06 1.46 1.47 -1.26 -3.64 116.67 106.98 2fhf s ASP 907 Ca -0.08 -0.69 0.20 0.00 1.18 0.00 0.00 52.55 53.16 2fhf s ASP 907 Cb 0.05 0.73 0.67 0.00 -0.34 0.00 0.00 42.92 44.04 2fhf s ASP 907 CO 0.93 -1.37 1.57 -0.46 0.68 0.00 0.00 175.17 176.52 2fhf n ASN 908 N -0.63 4.28 -0.50 2.11 6.94 -1.25 -4.55 115.26 121.66 2fhf n ASN 908 Ca -0.05 -2.24 -0.07 0.00 -0.02 0.00 0.00 54.58 52.20 2fhf n ASN 908 Cb 0.59 -0.53 -0.03 0.00 -2.36 0.00 0.00 39.78 37.45 2fhf n ASN 908 CO 0.00 0.00 0.00 -3.20 -1.03 0.00 0.00 177.26 173.03 2fhf n ASN 909 N 1.32 -3.86 -4.84 0.53 5.15 -1.26 -1.13 115.26 111.17 2fhf n ASN 909 Ca 0.25 0.16 -0.32 0.00 -0.60 0.00 0.00 54.58 54.07 2fhf n ASN 909 Cb 0.75 -1.93 -0.05 0.00 -0.53 0.00 0.00 39.78 38.01 2fhf n ASN 909 CO 0.00 0.00 0.00 -0.47 1.40 0.00 0.00 177.26 178.19 2fhf s TYR 910 N -2.22 3.38 -1.20 1.20 6.14 -1.26 -3.81 117.35 119.59 2fhf s TYR 910 Ca 0.00 1.38 -0.04 0.00 0.64 0.00 0.00 57.07 59.05 2fhf s TYR 910 Cb 0.00 -2.69 -0.02 0.00 0.42 0.00 0.00 41.96 39.68 2fhf s TYR 910 CO 0.00 -0.11 0.83 -1.71 0.64 0.00 0.00 175.55 175.21 2fhf n ASN 911 N -0.87 -3.20 -0.51 4.32 4.05 -1.26 -4.92 115.26 112.87 2fhf n ASN 911 Ca 0.05 -0.77 0.07 0.00 0.45 0.00 0.00 54.58 54.37 2fhf n ASN 911 Cb 0.54 -4.49 0.19 0.00 1.23 0.00 0.00 39.78 37.25 2fhf n ASN 911 CO 0.00 0.00 0.00 1.33 -3.05 0.00 0.00 177.26 175.54 2fhf n VAL 912 N -3.99 2.14 0.00 3.44 0.24 -1.26 -5.06 118.33 113.84 2fhf n VAL 912 Ca -0.22 -2.51 0.00 0.00 -2.04 0.00 0.00 64.34 59.57 2fhf n VAL 912 Cb 0.65 -0.26 0.00 0.00 -1.47 0.00 0.00 33.84 32.77 2fhf n VAL 912 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2fhf n GLY 913 N -1.15 3.64 3.76 7.63 0.00 -1.26 -4.97 105.19 112.84 2fhf n GLY 913 Ca 0.20 -1.67 -0.39 0.00 0.00 0.00 0.00 46.02 44.16 2fhf n GLY 913 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2fhf s MET 914 N -3.88 3.68 0.92 1.61 -1.94 -1.26 -4.86 119.30 113.58 2fhf s MET 914 Ca 0.00 2.20 -0.12 0.00 -1.71 0.00 0.00 55.69 56.06 2fhf s MET 914 Cb 0.00 -2.58 0.14 0.00 2.01 0.00 0.00 34.83 34.41 2fhf s MET 914 CO 0.00 -0.74 1.11 -1.25 -0.01 0.00 0.00 175.02 174.13 2fhf s PRO 915 N -2.50 1.05 -0.42 2.03 0.04 -1.26 -4.21 135.00 129.73 2fhf s PRO 915 Ca 0.62 0.47 -0.45 0.00 0.04 0.00 0.00 61.00 61.68 2fhf s PRO 915 Cb -0.39 -1.81 -0.19 0.00 0.04 0.00 0.00 34.50 32.15 2fhf s PRO 915 CO 0.49 -2.30 1.62 2.89 0.04 0.00 0.00 177.00 179.74 2fhf n ARG 916 N -3.87 0.30 0.14 4.56 1.85 -1.26 -4.79 116.66 113.59 2fhf n ARG 916 Ca 0.06 0.11 0.01 0.00 -1.00 0.00 0.00 57.85 57.03 2fhf n ARG 916 Cb 0.58 -1.66 0.33 0.00 -1.05 0.00 0.00 32.46 30.66 2fhf n ARG 916 CO 0.00 0.00 0.00 0.66 -0.01 0.00 0.00 177.63 178.28 2fhf h SER 917 N 5.50 0.15 -0.65 2.89 4.64 -1.91 -0.42 113.55 123.75 2fhf h SER 917 Ca -0.45 -0.05 0.07 0.00 -0.47 0.00 0.00 61.79 60.89 2fhf h SER 917 Cb 1.36 -0.04 -0.04 0.00 -0.31 0.00 0.00 62.40 63.37 2fhf h SER 917 CO 0.96 0.46 0.43 0.77 -0.87 0.00 0.00 176.83 178.58 2fhf h SER 918 N 0.13 0.56 0.00 4.97 4.64 -1.99 -0.90 113.55 120.96 2fhf h SER 918 Ca 0.02 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.31 2fhf h SER 918 Cb 0.62 -0.12 -0.01 0.00 -0.31 0.00 0.00 62.40 62.58 2fhf h SER 918 CO 0.04 0.36 -1.33 -0.67 -0.87 0.00 0.00 176.83 174.37 2fhf n ASP 919 N -4.48 3.52 -0.29 4.97 4.64 -1.18 -4.71 116.55 119.03 2fhf n ASP 919 Ca 0.09 0.00 0.03 0.00 -1.38 0.00 0.00 54.79 53.54 2fhf n ASP 919 Cb 0.24 1.12 0.05 0.00 -1.04 0.00 0.00 41.12 41.49 2fhf n ASP 919 CO 0.00 0.00 0.00 0.47 -0.82 0.00 0.00 177.20 176.85 2fhf n ASP 920 N -1.86 1.88 -0.21 1.67 10.43 -0.17 -4.69 116.55 123.59 2fhf n ASP 920 Ca -0.04 -1.53 0.16 0.00 2.57 0.00 0.00 54.79 55.96 2fhf n ASP 920 Cb 0.31 -0.05 0.49 0.00 1.84 0.00 0.00 41.12 43.71 2fhf n ASP 920 CO 0.00 0.00 0.00 1.23 -1.07 0.00 0.00 177.20 177.36 2fhf h GLY 921 N 1.19 0.85 1.99 0.44 0.00 -1.24 0.20 103.07 106.49 2fhf h GLY 921 Ca 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 47.33 47.13 2fhf h GLY 921 CO 0.00 0.04 0.00 -1.14 0.00 0.00 0.00 176.54 175.44 2fhf n SER 922 N -4.50 0.00 -0.73 0.19 3.41 -1.26 -2.48 113.62 108.25 2fhf n SER 922 Ca 0.17 0.49 0.09 0.00 -0.26 0.00 0.00 58.87 59.35 2fhf n SER 922 Cb 0.58 -0.49 0.09 0.00 -0.26 0.00 0.00 64.21 64.14 2fhf n SER 922 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 2fhf n ASN 923 N -1.49 2.56 -0.30 4.04 3.02 0.69 -4.26 115.26 119.52 2fhf n ASN 923 Ca 0.04 -1.75 0.01 0.00 -0.03 0.00 0.00 54.58 52.85 2fhf n ASN 923 Cb 0.19 -0.05 0.14 0.00 -0.61 0.00 0.00 39.78 39.45 2fhf n ASN 923 CO 0.00 0.00 0.00 1.88 -2.62 0.00 0.00 177.26 176.52 2fhf h TYR 924 N 3.32 0.95 0.10 3.10 0.99 -1.38 -0.63 116.97 123.42 2fhf h TYR 924 Ca 0.00 0.03 -0.00 0.00 2.00 0.00 0.00 58.73 60.75 2fhf h TYR 924 Cb 0.73 -0.31 0.00 0.00 1.00 0.00 0.00 36.73 38.16 2fhf h TYR 924 CO 0.05 0.48 -0.05 0.22 -0.00 0.00 0.00 178.16 178.86 2fhf h ASP 925 N 0.94 -0.11 0.01 3.88 1.82 -1.81 -0.31 116.42 120.84 2fhf h ASP 925 Ca 0.37 0.00 -0.11 0.00 -0.39 0.00 0.00 57.03 56.90 2fhf h ASP 925 Cb 0.18 0.03 -0.01 0.00 0.68 0.00 0.00 39.33 40.21 2fhf h ASP 925 CO -0.18 -0.08 -0.35 -0.29 -1.61 0.00 0.00 179.24 176.73 2fhf h ILE 926 N -0.13 1.29 -0.12 2.25 6.09 -1.83 -2.70 117.51 122.37 2fhf h ILE 926 Ca -0.01 -1.46 -0.00 0.00 -1.37 0.00 0.00 64.86 62.02 2fhf h ILE 926 Cb 0.10 1.51 -0.01 0.00 0.47 0.00 0.00 36.82 38.89 2fhf h ILE 926 CO 0.02 0.46 0.07 0.40 -3.07 0.00 0.00 178.15 176.03 2fhf h ILE 927 N 0.40 1.07 -0.42 2.19 2.04 -0.88 -1.93 117.51 119.97 2fhf h ILE 927 Ca 0.04 -0.17 0.06 0.00 1.00 0.00 0.00 64.86 65.79 2fhf h ILE 927 Cb 0.80 0.97 -0.02 0.00 -0.74 0.00 0.00 36.82 37.83 2fhf h ILE 927 CO 0.07 0.06 0.29 0.00 0.00 0.00 0.00 178.15 178.56 2fhf h ALA 928 N 1.00 1.97 0.02 1.87 0.00 -0.90 0.73 119.26 123.94 2fhf h ALA 928 Ca 0.04 -0.01 -0.21 0.00 0.00 0.00 0.00 54.91 54.73 2fhf h ALA 928 Cb 0.04 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 2fhf h ALA 928 CO -0.01 -0.05 -0.94 0.00 0.00 0.00 0.00 179.25 178.25 2fhf h ARG 929 N 0.33 0.18 0.00 0.00 3.08 -1.09 -3.38 114.38 113.51 2fhf h ARG 929 Ca 0.19 -0.23 -0.07 0.00 0.07 0.00 0.00 59.98 59.94 2fhf h ARG 929 Cb 0.31 0.07 -0.01 0.00 0.08 0.00 0.00 29.97 30.42 2fhf h ARG 929 CO -0.04 1.00 -1.91 1.33 -1.07 0.00 0.00 179.97 179.28 2fhf n VAL 930 N -3.60 0.25 -0.24 2.04 0.24 -0.78 -4.73 118.33 111.51 2fhf n VAL 930 Ca -0.04 -0.48 0.02 0.00 -2.04 0.00 0.00 64.34 61.79 2fhf n VAL 930 Cb 0.85 -0.05 0.10 0.00 -1.47 0.00 0.00 33.84 33.27 2fhf n VAL 930 CO 0.00 0.00 0.00 0.50 -2.14 0.00 0.00 176.83 175.19 2fhf h LYS 931 N 0.00 0.03 -0.74 7.34 3.64 -1.04 -2.74 116.57 123.06 2fhf h LYS 931 Ca -0.10 -0.00 -0.13 0.00 -1.27 0.00 0.00 60.65 59.15 2fhf h LYS 931 Cb 1.10 -0.01 -0.08 0.00 -0.41 0.00 0.00 32.23 32.84 2fhf h LYS 931 CO 0.01 0.02 0.16 -0.25 -2.27 0.00 0.00 179.45 177.11 2fhf n ASP 932 N -5.43 4.74 -0.20 4.20 8.00 -1.26 -4.58 116.55 122.01 2fhf n ASP 932 Ca 0.10 -2.98 0.01 0.00 0.71 0.00 0.00 54.79 52.63 2fhf n ASP 932 Cb 0.39 -0.70 0.11 0.00 -0.02 0.00 0.00 41.12 40.90 2fhf n ASP 932 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2fhf h ALA 933 N 3.03 0.77 -2.05 2.24 0.00 -1.80 -3.44 119.26 118.01 2fhf h ALA 933 Ca 0.15 0.11 -0.53 0.00 0.00 0.00 0.00 54.91 54.65 2fhf h ALA 933 Cb 2.04 0.12 -0.13 0.00 0.00 0.00 0.00 17.79 19.82 2fhf h ALA 933 CO 0.58 -0.26 -0.50 0.14 0.00 0.00 0.00 179.25 179.21 2fhf s VAL 934 N -6.09 0.37 0.72 0.00 -7.23 -1.26 -5.07 120.40 101.83 2fhf s VAL 934 Ca -0.13 -2.00 -0.12 0.00 -1.81 0.00 0.00 61.98 57.93 2fhf s VAL 934 Cb 0.18 -2.38 0.03 0.00 0.56 0.00 0.00 36.38 34.76 2fhf s VAL 934 CO 0.74 0.00 1.08 0.00 -0.31 0.00 0.00 175.10 176.61 2fhf s ALA 935 N -3.29 2.46 0.09 1.32 0.00 -1.26 -5.01 121.76 116.06 2fhf s ALA 935 Ca 0.29 0.26 -0.29 0.00 0.00 0.00 0.00 51.96 52.22 2fhf s ALA 935 Cb 0.02 -3.25 -0.06 0.00 0.00 0.00 0.00 23.12 19.84 2fhf s ALA 935 CO 0.19 -1.45 0.91 0.99 0.00 0.00 0.00 175.76 176.39 2fhf s THR 936 N -2.84 4.56 0.36 0.00 2.01 -1.26 -4.97 115.64 113.51 2fhf s THR 936 Ca 0.61 1.95 -0.26 0.00 0.31 0.00 0.00 61.69 64.31 2fhf s THR 936 Cb -0.16 -4.27 -0.12 0.00 0.01 0.00 0.00 72.50 67.95 2fhf s THR 936 CO 0.52 0.33 0.98 -2.65 -0.69 0.00 0.00 174.62 173.11 2fhf n PRO 937 N 2.77 1.31 -1.90 4.92 -0.02 -1.26 -5.00 135.00 135.82 2fhf n PRO 937 Ca 0.01 0.46 0.00 0.00 -2.02 0.00 0.00 63.50 61.95 2fhf n PRO 937 Cb 0.49 -1.92 0.00 0.00 -0.02 0.00 0.00 33.50 32.06 2fhf n PRO 937 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2fhf n GLY 938 N 1.24 4.30 0.37 -1.23 0.00 -1.26 -3.96 105.19 104.65 2fhf n GLY 938 Ca 0.09 -2.05 0.12 0.00 0.00 0.00 0.00 46.02 44.18 2fhf n GLY 938 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2fhf h GLU 939 N 0.00 0.76 -0.23 1.61 4.81 -1.59 -0.95 114.58 118.99 2fhf h GLU 939 Ca 0.00 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.18 2fhf h GLU 939 Cb 0.00 -0.17 -0.01 0.00 0.63 0.00 0.00 28.75 29.20 2fhf h GLU 939 CO 0.00 0.50 0.15 1.15 -0.73 0.00 0.00 179.01 180.08 2fhf h THR 940 N 0.78 1.08 -0.28 0.32 2.02 -1.94 -0.57 112.91 114.32 2fhf h THR 940 Ca 0.52 -0.17 -0.15 0.00 0.77 0.00 0.00 66.41 67.38 2fhf h THR 940 Cb 0.77 0.77 -0.01 0.00 -1.74 0.00 0.00 68.15 67.95 2fhf h THR 940 CO -0.29 0.07 -0.44 -0.33 0.37 0.00 0.00 175.52 174.91 2fhf h GLU 941 N 0.30 0.70 -0.50 6.66 3.07 -1.76 -1.99 114.58 121.06 2fhf h GLU 941 Ca 0.08 -0.38 -0.09 0.00 -0.50 0.00 0.00 59.36 58.47 2fhf h GLU 941 Cb -0.01 0.02 -0.02 0.00 -0.84 0.00 0.00 28.75 27.91 2fhf h GLU 941 CO -0.02 1.00 -0.03 -0.07 -1.40 0.00 0.00 179.01 178.50 2fhf h LEU 942 N 0.56 0.88 -0.67 1.33 3.38 -1.03 0.44 115.31 120.20 2fhf h LEU 942 Ca 0.04 -0.32 -0.10 0.00 0.09 0.00 0.00 57.88 57.58 2fhf h LEU 942 Cb 0.99 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 41.48 2fhf h LEU 942 CO 0.09 0.99 -0.09 0.11 0.09 0.00 0.00 178.44 179.63 2fhf h LYS 943 N 0.76 0.94 -0.28 1.13 1.57 -1.08 -0.87 116.57 118.73 2fhf h LYS 943 Ca 0.14 -0.33 -0.00 0.00 -1.87 0.00 0.00 60.65 58.59 2fhf h LYS 943 Cb 0.55 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.78 2fhf h LYS 943 CO 0.03 0.98 0.16 0.37 -0.57 0.00 0.00 179.45 180.42 2fhf h GLN 944 N 0.84 0.38 -0.57 3.15 4.15 -1.08 -1.81 115.11 120.17 2fhf h GLN 944 Ca 0.14 -0.04 -0.09 0.00 0.77 0.00 0.00 58.65 59.43 2fhf h GLN 944 Cb 0.63 -0.08 -0.02 0.00 0.21 0.00 0.00 27.48 28.22 2fhf h GLN 944 CO 0.04 0.32 0.01 1.98 -1.93 0.00 0.00 178.83 179.25 2fhf h MET 945 N 0.34 1.00 -0.69 1.69 4.05 -0.72 -1.65 114.93 118.95 2fhf h MET 945 Ca 0.10 -0.31 -0.01 0.00 -0.28 0.00 0.00 59.70 59.19 2fhf h MET 945 Cb 0.04 -0.09 -0.03 0.00 -0.80 0.00 0.00 31.60 30.71 2fhf h MET 945 CO -0.02 0.99 0.38 1.15 0.23 0.00 0.00 176.91 179.64 2fhf h THR 946 N 0.89 1.20 -0.20 -0.77 2.02 -0.84 0.57 112.91 115.77 2fhf h THR 946 Ca 0.16 -0.50 -0.02 0.00 0.77 0.00 0.00 66.41 66.82 2fhf h THR 946 Cb 0.53 0.27 -0.01 0.00 -1.74 0.00 0.00 68.15 67.20 2fhf h THR 946 CO 0.03 0.23 0.04 0.00 0.37 0.00 0.00 175.52 176.18 2fhf h ALA 947 N 1.46 0.27 -0.65 6.16 0.00 -1.02 -1.24 119.26 124.25 2fhf h ALA 947 Ca 0.24 -0.16 0.03 0.00 0.00 0.00 0.00 54.91 55.02 2fhf h ALA 947 Cb 0.01 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 17.69 2fhf h ALA 947 CO -0.04 -0.07 0.41 0.74 0.00 0.00 0.00 179.25 180.29 2fhf h PHE 948 N 0.14 0.76 -0.13 0.00 0.04 -0.74 -1.55 116.94 115.45 2fhf h PHE 948 Ca 0.06 0.02 -0.00 0.00 2.80 0.00 0.00 57.97 60.85 2fhf h PHE 948 Cb 0.30 -0.25 -0.01 0.00 2.20 0.00 0.00 35.95 38.19 2fhf h PHE 948 CO 0.02 0.44 0.07 -0.92 -0.60 0.00 0.00 178.31 177.31 2fhf h TYR 949 N 0.80 0.18 0.00 -0.55 5.03 -0.71 -1.76 116.97 119.96 2fhf h TYR 949 Ca 0.26 -0.01 -0.04 0.00 2.58 0.00 0.00 58.73 61.53 2fhf h TYR 949 Cb 0.00 -0.06 -0.01 0.00 1.55 0.00 0.00 36.73 38.22 2fhf h TYR 949 CO -0.05 0.21 -0.17 1.96 -1.32 0.00 0.00 178.16 178.79 2fhf h GLN 950 N 0.10 0.00 -0.21 1.82 4.20 -1.10 -1.46 115.11 118.46 2fhf h GLN 950 Ca 0.05 0.00 -0.12 0.00 0.06 0.00 0.00 58.65 58.63 2fhf h GLN 950 Cb 0.09 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 27.87 2fhf h GLN 950 CO -0.01 0.17 -0.34 1.49 -0.67 0.00 0.00 178.83 179.47 2fhf h GLU 951 N 0.00 0.61 -0.38 1.46 4.81 -0.90 -1.53 114.58 118.65 2fhf h GLU 951 Ca -0.00 -0.37 -0.03 0.00 -0.13 0.00 0.00 59.36 58.83 2fhf h GLU 951 Cb 0.56 0.04 -0.02 0.00 0.63 0.00 0.00 28.75 29.96 2fhf h GLU 951 CO 0.02 0.98 0.13 -0.07 -0.73 0.00 0.00 179.01 179.34 2fhf h LEU 952 N 0.29 0.54 -0.96 1.64 3.38 -0.70 -0.86 115.31 118.64 2fhf h LEU 952 Ca 0.02 -0.19 -0.11 0.00 0.09 0.00 0.00 57.88 57.68 2fhf h LEU 952 Cb 0.93 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 41.52 2fhf h LEU 952 CO 0.08 0.59 -0.51 0.71 0.09 0.00 0.00 178.44 179.40 2fhf h THR 953 N 0.46 1.37 -0.29 0.22 1.35 -1.32 -1.56 112.91 113.14 2fhf h THR 953 Ca 0.12 -1.76 -0.15 0.00 -0.55 0.00 0.00 66.41 64.07 2fhf h THR 953 Cb 0.24 1.94 -0.01 0.00 -1.73 0.00 0.00 68.15 68.59 2fhf h THR 953 CO -0.01 0.50 -0.43 0.00 -0.25 0.00 0.00 175.52 175.34 2fhf h ALA 954 N 1.47 0.69 -0.55 6.62 0.00 -0.08 -2.93 119.26 124.48 2fhf h ALA 954 Ca -0.00 -0.46 -0.11 0.00 0.00 0.00 0.00 54.91 54.33 2fhf h ALA 954 Cb 0.91 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.58 2fhf h ALA 954 CO 0.07 0.67 -0.10 -0.07 0.00 0.00 0.00 179.25 179.82 2fhf h LEU 955 N 0.60 1.04 -0.90 0.00 3.38 -0.88 -2.27 115.31 116.27 2fhf h LEU 955 Ca 0.04 -0.34 0.11 0.00 0.09 0.00 0.00 57.88 57.78 2fhf h LEU 955 Cb 0.99 -0.28 -0.08 0.00 0.09 0.00 0.00 40.66 41.37 2fhf h LEU 955 CO 0.09 1.14 0.53 -0.09 0.09 0.00 0.00 178.44 180.20 2fhf h ARG 956 N 0.93 0.82 -0.49 1.13 2.43 -1.11 -1.35 114.38 116.73 2fhf h ARG 956 Ca 0.14 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 59.27 2fhf h ARG 956 Cb 0.67 -0.18 0.00 0.00 -0.42 0.00 0.00 29.97 30.03 2fhf h ARG 956 CO 0.05 0.54 0.00 0.36 -1.51 0.00 0.00 179.97 179.41 2fhf n LYS 957 N -4.71 2.33 0.00 0.20 2.85 -1.13 -4.30 118.16 113.39 2fhf n LYS 957 Ca 0.16 -2.04 0.13 0.00 -1.05 0.00 0.00 58.31 55.50 2fhf n LYS 957 Cb 0.33 -1.47 0.57 0.00 -0.65 0.00 0.00 35.03 33.81 2fhf n LYS 957 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 177.40 176.22 2fhf n SER 958 N 1.19 0.00 -3.58 -5.58 3.41 -0.51 -4.82 113.62 103.72 2fhf n SER 958 Ca 0.19 0.40 -0.15 0.00 -0.26 0.00 0.00 58.87 59.05 2fhf n SER 958 Cb 0.51 -0.46 -0.07 0.00 -0.26 0.00 0.00 64.21 63.93 2fhf n SER 958 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 2fhf s SER 959 N -2.93 -0.69 0.16 4.04 0.15 -1.26 -5.02 113.70 108.16 2fhf s SER 959 Ca 0.15 1.09 0.20 0.00 0.70 0.00 0.00 55.95 58.08 2fhf s SER 959 Cb 0.17 1.02 0.83 0.00 -1.71 0.00 0.00 66.02 66.34 2fhf s SER 959 CO 0.46 -0.40 1.60 -0.81 1.20 0.00 0.00 173.24 175.29 2fhf n PRO 960 N 1.87 0.12 0.23 5.44 -0.04 -1.26 -2.89 135.00 138.47 2fhf n PRO 960 Ca -0.16 0.37 0.08 0.00 -0.04 0.00 0.00 63.50 63.75 2fhf n PRO 960 Cb 0.56 -1.73 0.58 0.00 -0.04 0.00 0.00 33.50 32.86 2fhf n PRO 960 CO 0.00 0.00 0.00 -0.07 -0.04 0.00 0.00 175.50 175.39 2fhf h LEU 961 N 0.00 0.00 -0.65 1.53 3.38 -1.93 -2.66 115.31 114.98 2fhf h LEU 961 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2fhf h LEU 961 Cb 0.30 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.05 2fhf h LEU 961 CO 0.00 0.20 0.00 -0.26 0.09 0.00 0.00 178.44 178.47 2fhf h PHE 962 N 0.00 0.00 -2.01 1.13 0.04 -1.80 -3.36 116.94 110.93 2fhf h PHE 962 Ca -0.00 0.00 -0.52 0.00 2.80 0.00 0.00 57.97 60.25 2fhf h PHE 962 Cb 0.43 0.00 -0.41 0.00 2.20 0.00 0.00 35.95 38.17 2fhf h PHE 962 CO 0.00 0.00 -0.98 0.25 -0.60 0.00 0.00 178.31 176.98 2fhf n THR 963 N -3.05 1.16 0.03 -1.55 -2.24 -1.00 -4.11 114.28 103.51 2fhf n THR 963 Ca 0.03 -4.85 0.13 0.00 -2.27 0.00 0.00 64.05 57.09 2fhf n THR 963 Cb 0.42 -0.64 0.59 0.00 -2.10 0.00 0.00 70.33 68.60 2fhf n THR 963 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 2fhf h LEU 964 N 2.97 0.16 0.00 3.22 3.38 -1.71 -3.42 115.31 119.92 2fhf h LEU 964 Ca 0.11 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.08 2fhf h LEU 964 Cb 0.82 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.54 2fhf h LEU 964 CO 0.63 0.10 0.00 0.61 0.09 0.00 0.00 178.44 179.87 2fhf n GLY 965 N -1.56 1.29 3.72 0.83 0.00 -1.26 -4.26 105.19 103.95 2fhf n GLY 965 Ca 0.06 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.70 2fhf n GLY 965 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2fhf s ASP 966 N 0.00 6.72 0.19 1.61 1.01 -1.26 -3.91 116.67 121.03 2fhf s ASP 966 Ca 0.00 0.86 -0.12 0.00 0.71 0.00 0.00 52.55 53.99 2fhf s ASP 966 Cb 0.00 -2.30 0.17 0.00 1.01 0.00 0.00 42.92 41.80 2fhf s ASP 966 CO 0.00 -0.03 1.77 1.23 0.21 0.00 0.00 175.17 178.35 2fhf h GLY 967 N 6.83 0.74 1.34 0.21 0.00 -1.92 -1.29 103.07 108.97 2fhf h GLY 967 Ca -0.40 -0.15 0.00 0.00 0.00 0.00 0.00 47.33 46.77 2fhf h GLY 967 CO 0.75 0.07 0.42 0.00 0.00 0.00 0.00 176.54 177.79 2fhf h ALA 968 N 1.31 1.50 -0.32 3.60 0.00 -1.94 -1.18 119.26 122.24 2fhf h ALA 968 Ca 0.24 -0.06 -0.16 0.00 0.00 0.00 0.00 54.91 54.94 2fhf h ALA 968 Cb 0.20 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 2fhf h ALA 968 CO -0.20 0.45 -0.44 1.15 0.00 0.00 0.00 179.25 180.22 2fhf h THR 969 N 0.90 1.28 -0.51 0.00 2.02 -1.78 -2.03 112.91 112.80 2fhf h THR 969 Ca 0.24 -1.62 -0.00 0.00 0.77 0.00 0.00 66.41 65.80 2fhf h THR 969 Cb -0.08 1.50 -0.02 0.00 -1.74 0.00 0.00 68.15 67.81 2fhf h THR 969 CO -0.05 0.53 0.31 0.58 0.37 0.00 0.00 175.52 177.26 2fhf h VAL 970 N 0.65 1.15 0.00 3.16 2.07 -0.54 -1.54 116.25 121.20 2fhf h VAL 970 Ca 0.04 -0.34 -0.04 0.00 0.82 0.00 0.00 66.70 67.18 2fhf h VAL 970 Cb 1.01 0.46 -0.01 0.00 -1.52 0.00 0.00 31.29 31.23 2fhf h VAL 970 CO 0.10 0.16 -0.21 0.24 0.02 0.00 0.00 177.57 177.87 2fhf h MET 971 N 0.69 0.00 0.00 1.57 2.86 -1.10 0.12 114.93 119.07 2fhf h MET 971 Ca 0.18 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.82 2fhf h MET 971 Cb -0.02 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.64 2fhf h MET 971 CO -0.04 0.21 -0.31 0.87 1.06 0.00 0.00 176.91 178.71 2fhf h LYS 972 N 0.00 0.00 0.00 1.72 1.57 -0.72 -3.40 116.57 115.74 2fhf h LYS 972 Ca -0.00 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2fhf h LYS 972 Cb 0.38 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.69 2fhf h LYS 972 CO 0.03 0.00 -1.00 0.54 -0.57 0.00 0.00 179.45 178.45 2fhf n ARG 973 N -2.79 2.87 -3.48 3.15 1.74 -0.64 -4.58 116.66 112.93 2fhf n ARG 973 Ca 0.03 -0.00 -0.38 0.00 -0.77 0.00 0.00 57.85 56.74 2fhf n ARG 973 Cb 0.51 -1.00 -0.06 0.00 -1.02 0.00 0.00 32.46 30.89 2fhf n ARG 973 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 2fhf s VAL 974 N -2.00 5.16 0.31 1.55 1.01 0.39 -0.69 120.40 126.13 2fhf s VAL 974 Ca -0.00 0.77 -0.05 0.00 0.00 0.00 0.00 61.98 62.70 2fhf s VAL 974 Cb 0.00 -3.70 -0.00 0.00 0.00 0.00 0.00 36.38 32.68 2fhf s VAL 974 CO 0.00 0.47 0.46 -0.62 0.00 0.00 0.00 175.10 175.42 2fhf s ASP 975 N -0.30 0.58 0.06 3.32 -1.08 -0.55 -4.82 116.67 113.89 2fhf s ASP 975 Ca 0.22 -1.33 0.02 0.00 -0.52 0.00 0.00 52.55 50.94 2fhf s ASP 975 Cb -0.15 0.63 -0.03 0.00 -1.46 0.00 0.00 42.92 41.91 2fhf s ASP 975 CO 0.10 -1.24 -0.07 -0.36 0.52 0.00 0.00 175.17 174.11 2fhf s PHE 976 N -3.34 0.74 0.47 -5.34 0.40 -1.26 -0.71 117.98 108.94 2fhf s PHE 976 Ca 0.29 -0.63 0.04 0.00 -0.60 0.00 0.00 56.93 56.03 2fhf s PHE 976 Cb -0.00 -0.44 -0.03 0.00 0.51 0.00 0.00 43.02 43.06 2fhf s PHE 976 CO 0.17 -0.10 0.08 1.03 0.70 0.00 0.00 175.22 177.09 2fhf s ARG 977 N -2.30 2.14 -1.21 0.44 1.81 -0.13 -4.81 118.95 114.90 2fhf s ARG 977 Ca -0.03 -2.19 -0.05 0.00 -1.72 0.00 0.00 55.73 51.73 2fhf s ARG 977 Cb -0.05 -1.70 -0.02 0.00 -0.45 0.00 0.00 34.95 32.74 2fhf s ARG 977 CO -0.01 -0.27 0.80 -1.71 -0.68 0.00 0.00 175.30 173.43 2fhf n ASN 978 N -1.24 -3.25 -4.64 0.23 4.05 -1.26 -4.20 115.26 104.95 2fhf n ASN 978 Ca -0.11 -0.81 -0.29 0.00 0.45 0.00 0.00 54.58 53.83 2fhf n ASN 978 Cb 0.66 -4.30 -0.10 0.00 1.23 0.00 0.00 39.78 37.27 2fhf n ASN 978 CO 0.00 0.00 0.00 0.42 -3.05 0.00 0.00 177.26 174.63 2fhf s THR 979 N -3.53 1.82 0.00 -0.44 -4.23 -1.26 -4.66 115.64 103.34 2fhf s THR 979 Ca 0.19 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.70 2fhf s THR 979 Cb -0.05 -2.84 0.00 0.00 1.34 0.00 0.00 72.50 70.95 2fhf s THR 979 CO 0.80 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 175.49 2fhf n GLY 980 N -1.02 -2.51 0.25 3.99 0.00 -1.19 -4.19 105.19 100.53 2fhf n GLY 980 Ca -0.08 -1.74 0.10 0.00 0.00 0.00 0.00 46.02 44.31 2fhf n GLY 980 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2fhf h ALA 981 N 0.00 1.42 -0.60 4.61 0.00 -1.71 -2.88 119.26 120.10 2fhf h ALA 981 Ca 0.00 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.78 2fhf h ALA 981 Cb 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.77 2fhf h ALA 981 CO 0.00 0.17 0.00 -0.25 0.00 0.00 0.00 179.25 179.17 2fhf n ASP 982 N -3.86 4.93 -4.76 0.00 10.43 -1.26 -5.00 116.55 117.03 2fhf n ASP 982 Ca -0.02 -2.58 -0.32 0.00 2.57 0.00 0.00 54.79 54.43 2fhf n ASP 982 Cb 0.24 -0.61 0.08 0.00 1.84 0.00 0.00 41.12 42.66 2fhf n ASP 982 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 2fhf s GLN 983 N -2.12 2.39 -0.42 -1.24 -2.07 -1.09 -4.98 119.66 110.13 2fhf s GLN 983 Ca 0.50 1.34 -0.21 0.00 -1.82 0.00 0.00 55.36 55.18 2fhf s GLN 983 Cb 0.35 -1.90 0.02 0.00 -1.09 0.00 0.00 33.01 30.38 2fhf s GLN 983 CO 0.21 -1.56 0.64 -0.65 -1.32 0.00 0.00 175.29 172.61 2fhf s GLN 984 N -4.45 3.34 0.21 9.60 -0.21 -1.26 -5.01 119.66 121.88 2fhf s GLN 984 Ca 0.65 -0.32 -0.32 0.00 0.02 0.00 0.00 55.36 55.40 2fhf s GLN 984 Cb -0.20 -3.93 -0.14 0.00 1.00 0.00 0.00 33.01 29.74 2fhf s GLN 984 CO 0.49 -0.96 1.34 2.41 -2.12 0.00 0.00 175.29 176.45 2fhf n THR 985 N 5.80 0.83 0.00 -0.19 -1.04 -1.26 -2.33 114.28 116.09 2fhf n THR 985 Ca -0.02 -0.21 0.00 0.00 -2.04 0.00 0.00 64.05 61.79 2fhf n THR 985 Cb 0.48 -1.27 0.00 0.00 -1.82 0.00 0.00 70.33 67.72 2fhf n THR 985 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2fhf n GLY 986 N 2.22 2.50 3.58 3.41 0.00 -1.26 -4.83 105.19 110.81 2fhf n GLY 986 Ca 0.13 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.74 2fhf n GLY 986 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2fhf s LEU 987 N 0.00 4.22 -0.24 0.99 2.96 -0.98 -1.37 118.68 124.25 2fhf s LEU 987 Ca 0.00 0.22 -0.08 0.00 -0.22 0.00 0.00 54.13 54.05 2fhf s LEU 987 Cb 0.00 -2.81 -0.03 0.00 0.50 0.00 0.00 46.19 43.84 2fhf s LEU 987 CO 0.00 -0.58 0.09 -0.76 -1.32 0.00 0.00 176.35 173.78 2fhf s LEU 988 N 2.72 3.60 -0.21 -0.68 1.43 0.47 -4.88 118.68 121.13 2fhf s LEU 988 Ca 0.25 -0.13 0.00 0.00 -1.03 0.00 0.00 54.13 53.23 2fhf s LEU 988 Cb -0.14 -1.96 0.05 0.00 0.03 0.00 0.00 46.19 44.16 2fhf s LEU 988 CO 0.14 -0.00 -0.07 -0.69 0.23 0.00 0.00 176.35 175.96 2fhf s VAL 989 N 1.44 1.47 -0.05 -1.59 1.01 -1.26 -0.30 120.40 121.13 2fhf s VAL 989 Ca 0.06 -1.04 0.05 0.00 0.00 0.00 0.00 61.98 61.05 2fhf s VAL 989 Cb -0.15 -1.67 -0.02 0.00 0.00 0.00 0.00 36.38 34.54 2fhf s VAL 989 CO 0.05 0.02 -0.18 -0.32 0.00 0.00 0.00 175.10 174.67 2fhf s MET 990 N 1.45 2.48 0.04 2.72 0.00 0.36 -0.96 119.30 125.37 2fhf s MET 990 Ca -0.03 -0.76 0.08 0.00 0.00 0.00 0.00 55.69 54.98 2fhf s MET 990 Cb -0.17 -2.30 -0.03 0.00 0.00 0.00 0.00 34.83 32.32 2fhf s MET 990 CO -0.07 0.57 -0.23 0.95 0.00 0.00 0.00 175.02 176.23 2fhf s THR 991 N -0.59 2.36 -0.21 10.11 -4.23 0.11 0.13 115.64 123.33 2fhf s THR 991 Ca 0.09 -1.29 -0.00 0.00 -1.18 0.00 0.00 61.69 59.30 2fhf s THR 991 Cb -0.11 -1.94 0.06 0.00 1.34 0.00 0.00 72.50 71.85 2fhf s THR 991 CO 0.01 0.38 -0.03 -0.63 -0.54 0.00 0.00 174.62 173.81 2fhf s ILE 992 N -0.83 1.17 0.30 2.99 1.01 0.05 -1.48 121.20 124.41 2fhf s ILE 992 Ca 0.12 -0.94 -0.28 0.00 0.00 0.00 0.00 60.65 59.56 2fhf s ILE 992 Cb -0.10 -1.50 -0.09 0.00 0.01 0.00 0.00 42.46 40.78 2fhf s ILE 992 CO 0.03 -0.10 1.01 -0.62 0.00 0.00 0.00 174.94 175.26 2fhf s ASP 993 N 1.57 7.32 -0.00 3.58 3.68 0.13 -1.35 116.67 131.59 2fhf s ASP 993 Ca -0.03 2.03 0.00 0.00 2.13 0.00 0.00 52.55 56.68 2fhf s ASP 993 Cb -0.18 -2.60 0.00 0.00 -1.45 0.00 0.00 42.92 38.69 2fhf s ASP 993 CO -0.07 -0.09 0.91 -0.67 0.13 0.00 0.00 175.17 175.38 2fhf n ASP 994 N 0.92 0.02 -4.19 -0.34 2.03 -0.46 -4.84 116.55 109.70 2fhf n ASP 994 Ca 0.00 -1.83 -0.28 0.00 0.52 0.00 0.00 54.79 53.20 2fhf n ASP 994 Cb 0.47 -0.17 0.18 0.00 -0.72 0.00 0.00 41.12 40.89 2fhf n ASP 994 CO 0.00 0.00 0.00 -0.83 -1.92 0.00 0.00 177.20 174.45 2fhf s GLY 995 N -0.84 1.80 0.43 0.27 0.00 -0.98 -4.51 107.32 103.49 2fhf s GLY 995 Ca 0.00 -1.54 0.19 0.00 0.00 0.00 0.00 44.72 43.38 2fhf s GLY 995 CO 0.00 -0.77 1.86 -0.33 0.00 0.00 0.00 173.10 173.86 2fhf h MET 996 N -1.36 0.35 0.00 2.90 2.86 -1.54 -1.55 114.93 116.58 2fhf h MET 996 Ca -0.40 -0.02 0.00 0.00 -2.06 0.00 0.00 59.70 57.21 2fhf h MET 996 Cb 1.23 -0.08 0.00 0.00 0.06 0.00 0.00 31.60 32.81 2fhf h MET 996 CO 0.33 0.23 0.00 1.04 1.06 0.00 0.00 176.91 179.57 2fhf n GLN 997 N -4.49 0.22 0.07 1.72 6.02 -1.26 -3.16 117.38 116.49 2fhf n GLN 997 Ca 0.19 0.23 0.00 0.00 -0.01 0.00 0.00 57.00 57.41 2fhf n GLN 997 Cb 0.72 -1.78 -0.05 0.00 1.02 0.00 0.00 30.24 30.16 2fhf n GLN 997 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2fhf h ALA 998 N 2.53 0.64 0.00 -1.58 0.00 -1.58 -3.50 119.26 115.78 2fhf h ALA 998 Ca 0.00 -0.73 0.00 0.00 0.00 0.00 0.00 54.91 54.18 2fhf h ALA 998 Cb 0.64 0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.56 2fhf h ALA 998 CO 0.00 0.85 0.00 0.41 0.00 0.00 0.00 179.25 180.51 2fhf n GLY 999 N 1.34 0.28 3.82 0.00 0.00 -1.19 -4.96 105.19 104.48 2fhf n GLY 999 Ca -0.05 -1.45 -0.33 0.00 0.00 0.00 0.00 46.02 44.19 2fhf n GLY 999 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2fhf s ALA 1000N -1.50 2.92 -0.25 4.61 0.00 -1.26 -4.50 121.76 121.79 2fhf s ALA 1000Ca 0.00 0.31 -0.29 0.00 0.00 0.00 0.00 51.96 51.98 2fhf s ALA 1000Cb 0.00 -3.18 -0.00 0.00 0.00 0.00 0.00 23.12 19.94 2fhf s ALA 1000CO 0.00 -0.44 1.29 0.45 0.00 0.00 0.00 175.76 177.05 2fhf s SER 1001N -2.82 6.77 0.24 0.00 0.15 -1.26 -4.87 113.70 111.92 2fhf s SER 1001Ca 0.62 1.39 0.23 0.00 0.70 0.00 0.00 55.95 58.89 2fhf s SER 1001Cb -0.13 -2.54 0.21 0.00 -1.71 0.00 0.00 66.02 61.85 2fhf s SER 1001CO 0.31 -0.96 1.29 -0.07 1.20 0.00 0.00 173.24 175.01 2fhf h LEU 1002N 10.45 0.00 -7.46 3.45 3.38 -1.91 -3.43 115.31 119.79 2fhf h LEU 1002Ca -0.26 -0.05 -0.55 0.00 0.09 0.00 0.00 57.88 57.12 2fhf h LEU 1002Cb 1.10 0.00 -0.39 0.00 0.09 0.00 0.00 40.66 41.46 2fhf h LEU 1002CO 1.01 0.02 -0.78 -0.62 0.09 0.00 0.00 178.44 178.17 2fhf s ASP 1003N -5.28 3.09 0.49 -0.43 3.68 -1.26 -4.79 116.67 112.17 2fhf s ASP 1003Ca 0.03 -0.85 0.33 0.00 2.13 0.00 0.00 52.55 54.19 2fhf s ASP 1003Cb 0.09 -0.82 1.66 0.00 -1.45 0.00 0.00 42.92 42.41 2fhf s ASP 1003CO 0.73 -0.26 2.00 0.77 0.13 0.00 0.00 175.17 178.55 2fhf h SER 1004N 8.14 0.00 0.84 -0.34 4.64 -2.01 -2.93 113.55 121.90 2fhf h SER 1004Ca -0.18 0.00 -0.10 0.00 -0.47 0.00 0.00 61.79 61.04 2fhf h SER 1004Cb 1.11 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.18 2fhf h SER 1004CO 0.37 0.00 -1.22 0.03 -0.87 0.00 0.00 176.83 175.13 2fhf h ARG 1005N 0.00 0.00 -4.42 4.77 3.08 -1.95 -3.43 114.38 112.42 2fhf h ARG 1005Ca 0.00 0.00 -0.19 0.00 0.07 0.00 0.00 59.98 59.86 2fhf h ARG 1005Cb 0.15 0.00 -0.16 0.00 0.08 0.00 0.00 29.97 30.04 2fhf h ARG 1005CO 0.00 0.17 -0.70 0.14 -1.07 0.00 0.00 179.97 178.51 2fhf s VAL 1006N -3.11 0.44 -2.06 2.04 -7.23 -1.11 -1.67 120.40 107.71 2fhf s VAL 1006Ca -0.02 -1.69 0.20 0.00 -1.81 0.00 0.00 61.98 58.67 2fhf s VAL 1006Cb 0.09 -1.35 0.05 0.00 0.56 0.00 0.00 36.38 35.72 2fhf s VAL 1006CO 0.80 -0.82 1.04 0.47 -0.31 0.00 0.00 175.10 176.28 2fhf n ASP 1007N 0.36 2.14 0.00 4.85 8.00 0.61 -4.61 116.55 127.90 2fhf n ASP 1007Ca -0.15 -1.57 0.00 0.00 0.71 0.00 0.00 54.79 53.78 2fhf n ASP 1007Cb 0.60 0.33 0.00 0.00 -0.02 0.00 0.00 41.12 42.02 2fhf n ASP 1007CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2fhf n GLY 1008N 1.27 1.26 3.09 0.44 0.00 -1.26 -1.35 105.19 108.64 2fhf n GLY 1008Ca 0.09 -0.73 -0.18 0.00 0.00 0.00 0.00 46.02 45.20 2fhf n GLY 1008CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2fhf s ILE 1009N -2.00 0.88 -0.12 -0.61 -1.09 -0.45 -1.66 121.20 116.15 2fhf s ILE 1009Ca 0.00 -0.81 0.02 0.00 -2.23 0.00 0.00 60.65 57.64 2fhf s ILE 1009Cb 0.00 -0.80 0.01 0.00 -1.58 0.00 0.00 42.46 40.09 2fhf s ILE 1009CO 0.00 0.01 -0.18 -0.69 -1.23 0.00 0.00 174.94 172.85 2fhf s VAL 1010N -0.72 1.73 -0.26 2.92 1.01 -0.26 -0.77 120.40 124.05 2fhf s VAL 1010Ca 0.00 -0.79 -0.05 0.00 0.00 0.00 0.00 61.98 61.14 2fhf s VAL 1010Cb -0.07 -1.55 0.00 0.00 0.00 0.00 0.00 36.38 34.76 2fhf s VAL 1010CO 0.01 0.49 0.02 -0.69 0.00 0.00 0.00 175.10 174.93 2fhf s VAL 1011N 0.88 3.67 -0.20 2.92 1.01 0.12 -0.79 120.40 128.01 2fhf s VAL 1011Ca -0.08 -0.63 0.01 0.00 0.00 0.00 0.00 61.98 61.29 2fhf s VAL 1011Cb -0.15 -2.81 0.03 0.00 0.00 0.00 0.00 36.38 33.45 2fhf s VAL 1011CO -0.01 0.22 -0.17 0.00 0.00 0.00 0.00 175.10 175.14 2fhf s ALA 1012N 1.48 2.36 -0.29 5.51 0.00 -0.05 -0.49 121.76 130.29 2fhf s ALA 1012Ca 0.04 -1.34 -0.00 0.00 0.00 0.00 0.00 51.96 50.65 2fhf s ALA 1012Cb -0.16 -1.28 0.06 0.00 0.00 0.00 0.00 23.12 21.74 2fhf s ALA 1012CO -0.00 -0.57 -0.03 0.42 0.00 0.00 0.00 175.76 175.57 2fhf s ILE 1013N 1.25 2.70 -1.03 0.00 1.01 0.59 -0.66 121.20 125.06 2fhf s ILE 1013Ca 0.01 -1.51 -0.13 0.00 0.00 0.00 0.00 60.65 59.03 2fhf s ILE 1013Cb -0.15 -2.58 0.22 0.00 0.01 0.00 0.00 42.46 39.96 2fhf s ILE 1013CO -0.11 -0.10 1.09 0.21 0.00 0.00 0.00 174.94 176.03 2fhf s ASN 1014N 1.21 7.02 -1.34 3.58 3.04 -0.09 -0.39 114.94 127.96 2fhf s ASN 1014Ca -0.06 -3.00 -0.12 0.00 0.04 0.00 0.00 52.86 49.73 2fhf s ASN 1014Cb -0.20 -2.28 0.12 0.00 -1.54 0.00 0.00 41.25 37.35 2fhf s ASN 1014CO -0.03 -0.57 1.96 0.00 -3.04 0.00 0.00 177.10 175.42 2fhf n ALA 1015N 4.22 5.22 -3.45 1.71 0.00 -0.47 -2.15 120.51 125.59 2fhf n ALA 1015Ca 0.24 -4.13 -0.13 0.00 0.00 0.00 0.00 53.44 49.42 2fhf n ALA 1015Cb 0.44 -3.22 -0.03 0.00 0.00 0.00 0.00 19.45 16.63 2fhf n ALA 1015CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2fhf s ALA 1016N 1.71 -1.66 -2.04 0.00 0.00 -1.26 -4.57 121.76 113.94 2fhf s ALA 1016Ca 0.43 0.73 0.15 0.00 0.00 0.00 0.00 51.96 53.28 2fhf s ALA 1016Cb 0.10 0.63 0.83 0.00 0.00 0.00 0.00 23.12 24.68 2fhf s ALA 1016CO -0.03 -0.67 1.55 -0.35 0.00 0.00 0.00 175.76 176.26 2fhf n PRO 1017N -0.09 1.14 -4.24 0.00 -0.04 -1.26 -1.61 135.00 128.89 2fhf n PRO 1017Ca -0.16 -0.21 -0.25 0.00 -0.04 0.00 0.00 63.50 62.84 2fhf n PRO 1017Cb 0.63 -1.25 -0.07 0.00 -0.04 0.00 0.00 33.50 32.76 2fhf n PRO 1017CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 2fhf s GLU 1018N -1.95 2.36 0.26 0.54 2.02 -1.26 -4.75 118.70 115.92 2fhf s GLU 1018Ca 0.23 -1.24 -0.24 0.00 0.02 0.00 0.00 54.97 53.75 2fhf s GLU 1018Cb 0.11 -2.28 -0.09 0.00 0.10 0.00 0.00 34.13 31.98 2fhf s GLU 1018CO 0.18 0.41 0.84 -1.12 0.02 0.00 0.00 175.26 175.60 2fhf s SER 1019N -3.27 7.26 -0.00 -0.19 0.01 -1.26 -3.78 113.70 112.47 2fhf s SER 1019Ca 0.29 1.66 0.05 0.00 1.31 0.00 0.00 55.95 59.27 2fhf s SER 1019Cb -0.08 -2.51 -0.02 0.00 0.21 0.00 0.00 66.02 63.62 2fhf s SER 1019CO 0.19 0.01 -0.17 -0.13 0.41 0.00 0.00 173.24 173.55 2fhf s ARG 1020N -1.87 1.35 -0.15 12.44 3.00 -0.01 -4.96 118.95 128.75 2fhf s ARG 1020Ca 0.45 -0.66 -0.00 0.00 0.00 0.00 0.00 55.73 55.52 2fhf s ARG 1020Cb -0.19 -1.33 -0.01 0.00 0.00 0.00 0.00 34.95 33.42 2fhf s ARG 1020CO 0.23 0.36 -0.13 0.99 0.00 0.00 0.00 175.30 176.75 2fhf s THR 1021N -0.48 2.94 -0.18 0.02 2.01 -1.26 0.15 115.64 118.84 2fhf s THR 1021Ca 0.06 -0.69 -0.14 0.00 0.31 0.00 0.00 61.69 61.24 2fhf s THR 1021Cb -0.07 -2.25 -0.04 0.00 0.01 0.00 0.00 72.50 70.15 2fhf s THR 1021CO -0.00 0.51 0.30 -0.76 -0.69 0.00 0.00 174.62 173.98 2fhf s LEU 1022N 0.63 4.21 0.00 4.42 1.43 0.20 -4.93 118.68 124.64 2fhf s LEU 1022Ca -0.07 0.46 0.09 0.00 -1.03 0.00 0.00 54.13 53.58 2fhf s LEU 1022Cb -0.16 -2.38 -0.04 0.00 0.03 0.00 0.00 46.19 43.64 2fhf s LEU 1022CO 0.03 0.05 0.48 0.00 0.23 0.00 0.00 176.35 177.13 2fhf n GLN 1023N 3.88 3.15 0.24 1.70 1.13 -1.26 -1.59 117.38 124.63 2fhf n GLN 1023Ca -0.11 -0.30 0.15 0.00 -1.94 0.00 0.00 57.00 54.79 2fhf n GLN 1023Cb 0.52 -0.97 0.78 0.00 0.11 0.00 0.00 30.24 30.68 2fhf n GLN 1023CO 0.00 0.00 0.00 -0.44 -1.44 0.00 0.00 177.06 175.18 2fhf h ASP 1024N 0.52 0.00 0.00 1.08 5.19 -1.93 -2.77 116.42 118.51 2fhf h ASP 1024Ca 0.00 0.00 -0.02 0.00 -0.62 0.00 0.00 57.03 56.39 2fhf h ASP 1024Cb 0.25 0.00 -0.03 0.00 0.18 0.00 0.00 39.33 39.73 2fhf h ASP 1024CO 0.00 0.00 -0.51 0.49 -3.12 0.00 0.00 179.24 176.10 2fhf n PHE 1025N -2.57 0.00 -1.74 4.55 3.01 -1.26 -5.06 117.46 114.39 2fhf n PHE 1025Ca -0.02 -1.37 -0.42 0.00 1.01 0.00 0.00 57.45 56.65 2fhf n PHE 1025Cb 0.14 -0.23 -0.01 0.00 -0.01 0.00 0.00 39.48 39.36 2fhf n PHE 1025CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2fhf n ALA 1026N -1.00 2.30 -3.32 4.37 0.00 -1.05 -2.89 120.51 118.92 2fhf n ALA 1026Ca 0.18 0.37 -0.18 0.00 0.00 0.00 0.00 53.44 53.80 2fhf n ALA 1026Cb 0.73 -2.42 0.06 0.00 0.00 0.00 0.00 19.45 17.82 2fhf n ALA 1026CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2fhf n GLY 1027N 1.58 -1.14 0.00 0.00 0.00 -1.19 -4.92 105.19 99.51 2fhf n GLY 1027Ca 0.06 0.57 0.00 0.00 0.00 0.00 0.00 46.02 46.65 2fhf n GLY 1027CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2fhf n THR 1028N -3.38 0.00 -3.29 2.61 -1.04 -1.14 -5.07 114.28 102.96 2fhf n THR 1028Ca -0.07 0.00 -0.10 0.00 -2.04 0.00 0.00 64.05 61.83 2fhf n THR 1028Cb 0.61 1.09 0.02 0.00 -1.82 0.00 0.00 70.33 70.23 2fhf n THR 1028CO 0.00 0.00 0.00 -1.54 -0.64 0.00 0.00 175.07 172.89 2fhf n SER 1029N 0.00 -6.83 -4.84 8.00 3.41 -1.26 -4.95 113.62 107.15 2fhf n SER 1029Ca 0.00 -0.44 -0.37 0.00 -0.26 0.00 0.00 58.87 57.80 2fhf n SER 1029Cb 0.06 -4.44 -0.06 0.00 -0.26 0.00 0.00 64.21 59.51 2fhf n SER 1029CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 2fhf s LEU 1030N -4.68 4.44 0.04 1.04 2.96 -1.26 -4.44 118.68 116.78 2fhf s LEU 1030Ca 0.13 0.97 0.06 0.00 -0.22 0.00 0.00 54.13 55.07 2fhf s LEU 1030Cb -0.03 -2.76 -0.02 0.00 0.50 0.00 0.00 46.19 43.88 2fhf s LEU 1030CO 0.79 0.27 -0.17 -1.10 -1.32 0.00 0.00 176.35 174.82 2fhf s GLN 1031N -1.33 1.12 0.35 1.98 -0.21 -0.31 -4.93 119.66 116.33 2fhf s GLN 1031Ca 0.27 -0.81 -0.27 0.00 0.02 0.00 0.00 55.36 54.58 2fhf s GLN 1031Cb -0.16 -1.16 -0.09 0.00 1.00 0.00 0.00 33.01 32.59 2fhf s GLN 1031CO 0.15 0.29 1.13 -1.17 -2.12 0.00 0.00 175.29 173.58 2fhf s LEU 1032N -1.10 4.32 0.29 2.90 2.96 -1.26 0.04 118.68 126.83 2fhf s LEU 1032Ca 0.04 2.28 -0.29 0.00 -0.22 0.00 0.00 54.13 55.94 2fhf s LEU 1032Cb -0.08 -3.89 -0.13 0.00 0.50 0.00 0.00 46.19 42.59 2fhf s LEU 1032CO 0.01 -0.44 1.30 -0.24 -1.32 0.00 0.00 176.35 175.65 2fhf n SER 1033N 0.48 2.53 -0.10 3.68 2.88 -0.13 -4.83 113.62 118.14 2fhf n SER 1033Ca 0.02 1.18 0.05 0.00 -1.33 0.00 0.00 58.87 58.79 2fhf n SER 1033Cb 0.46 -1.43 0.39 0.00 -0.75 0.00 0.00 64.21 62.88 2fhf n SER 1033CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2fhf h ALA 1034N 3.15 1.71 -0.60 -1.46 0.00 -1.92 -1.27 119.26 118.87 2fhf h ALA 1034Ca -0.45 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 54.41 2fhf h ALA 1034Cb 1.29 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 18.87 2fhf h ALA 1034CO 0.68 0.22 0.27 0.82 0.00 0.00 0.00 179.25 181.24 2fhf h ILE 1035N 0.67 1.22 -0.12 0.00 2.04 -1.98 -0.85 117.51 118.49 2fhf h ILE 1035Ca 0.24 -0.65 -0.19 0.00 1.00 0.00 0.00 64.86 65.26 2fhf h ILE 1035Cb 0.11 0.54 -0.00 0.00 -0.74 0.00 0.00 36.82 36.72 2fhf h ILE 1035CO -0.06 0.26 -0.70 1.56 0.00 0.00 0.00 178.15 179.21 2fhf h GLN 1036N 0.82 0.51 -0.61 2.37 4.20 -1.74 -3.10 115.11 117.56 2fhf h GLN 1036Ca 0.20 -0.39 0.02 0.00 0.06 0.00 0.00 58.65 58.54 2fhf h GLN 1036Cb 0.15 0.07 -0.04 0.00 0.30 0.00 0.00 27.48 27.97 2fhf h GLN 1036CO -0.02 1.02 0.39 1.96 -0.67 0.00 0.00 178.83 181.51 2fhf h GLN 1037N 0.36 0.76 -0.28 1.46 4.20 -1.02 -2.27 115.11 118.32 2fhf h GLN 1037Ca -0.03 -0.05 0.05 0.00 0.06 0.00 0.00 58.65 58.69 2fhf h GLN 1037Cb 1.27 -0.17 -0.01 0.00 0.30 0.00 0.00 27.48 28.87 2fhf h GLN 1037CO 0.13 0.50 0.19 0.00 -0.67 0.00 0.00 178.83 178.98 2fhf h ALA 1038N 1.25 2.05 0.00 3.87 0.00 -1.09 -1.50 119.26 123.84 2fhf h ALA 1038Ca 0.24 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.14 2fhf h ALA 1038Cb -0.03 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.72 2fhf h ALA 1038CO -0.08 -0.11 0.00 0.00 0.00 0.00 0.00 179.25 179.07 2fhf n ALA 1039N -2.54 2.16 -0.70 0.00 0.00 -0.86 -4.98 120.51 113.59 2fhf n ALA 1039Ca 0.03 -0.08 0.00 0.00 0.00 0.00 0.00 53.44 53.39 2fhf n ALA 1039Cb 0.24 -1.42 0.00 0.00 0.00 0.00 0.00 19.45 18.27 2fhf n ALA 1039CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2fhf n GLY 1040N 1.12 2.99 0.00 0.00 0.00 -0.57 -1.35 105.19 107.38 2fhf n GLY 1040Ca 0.06 -0.17 0.05 0.00 0.00 0.00 0.00 46.02 45.96 2fhf n GLY 1040CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2fhf n ASP 1041N 2.38 0.00 -0.78 1.61 5.68 -1.26 -2.06 116.55 122.12 2fhf n ASP 1041Ca 0.00 -1.18 0.11 0.00 -0.50 0.00 0.00 54.79 53.22 2fhf n ASP 1041Cb 0.00 0.00 0.07 0.00 -1.14 0.00 0.00 41.12 40.05 2fhf n ASP 1041CO 0.00 0.00 0.00 0.54 -1.33 0.00 0.00 177.20 176.41 2fhf n ARG 1042N -0.71 1.88 -2.49 0.11 1.74 -0.45 -4.87 116.66 111.86 2fhf n ARG 1042Ca 0.07 -1.62 -0.32 0.00 -0.77 0.00 0.00 57.85 55.22 2fhf n ARG 1042Cb 0.03 -1.41 -0.03 0.00 -1.02 0.00 0.00 32.46 30.03 2fhf n ARG 1042CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 2fhf s SER 1043N -1.90 6.59 0.30 0.55 0.15 -0.87 -4.68 113.70 113.83 2fhf s SER 1043Ca 0.24 1.46 0.25 0.00 0.70 0.00 0.00 55.95 58.59 2fhf s SER 1043Cb 0.18 -2.46 1.03 0.00 -1.71 0.00 0.00 66.02 63.06 2fhf s SER 1043CO 0.32 -0.55 1.75 -0.07 1.20 0.00 0.00 173.24 175.89 2fhf h LEU 1044N 0.96 0.00 -2.76 3.45 3.38 -1.89 -2.28 115.31 116.17 2fhf h LEU 1044Ca -0.47 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.50 2fhf h LEU 1044Cb 1.19 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.94 2fhf h LEU 1044CO 0.62 0.00 0.00 0.00 0.09 0.00 0.00 178.44 179.15 2fhf n ALA 1045N -1.81 2.64 -1.71 1.53 0.00 -1.15 -2.13 120.51 117.87 2fhf n ALA 1045Ca 0.02 -1.35 -0.43 0.00 0.00 0.00 0.00 53.44 51.68 2fhf n ALA 1045Cb 0.24 -0.97 -0.03 0.00 0.00 0.00 0.00 19.45 18.68 2fhf n ALA 1045CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2fhf n SER 1046N 1.41 3.80 0.00 0.00 2.88 -0.86 -1.60 113.62 119.26 2fhf n SER 1046Ca 0.24 1.06 0.00 0.00 -1.33 0.00 0.00 58.87 58.84 2fhf n SER 1046Cb 0.70 -1.54 0.00 0.00 -0.75 0.00 0.00 64.21 62.62 2fhf n SER 1046CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2fhf n GLY 1047N 3.88 0.96 3.77 0.46 0.00 -1.26 -4.79 105.19 108.20 2fhf n GLY 1047Ca 0.16 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.78 2fhf n GLY 1047CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2fhf s VAL 1048N -2.32 2.75 -0.05 1.61 1.01 -0.62 -4.63 120.40 118.15 2fhf s VAL 1048Ca 0.00 0.76 0.03 0.00 0.00 0.00 0.00 61.98 62.77 2fhf s VAL 1048Cb 0.00 -3.48 0.01 0.00 0.00 0.00 0.00 36.38 32.90 2fhf s VAL 1048CO 0.00 0.18 -0.12 0.00 0.00 0.00 0.00 175.10 175.16 2fhf s GLN 1049N -1.75 1.49 -0.40 2.72 -2.07 -0.72 -5.00 119.66 113.94 2fhf s GLN 1049Ca 0.49 -0.43 -0.05 0.00 -1.82 0.00 0.00 55.36 53.55 2fhf s GLN 1049Cb -0.39 -1.28 0.09 0.00 -1.09 0.00 0.00 33.01 30.33 2fhf s GLN 1049CO 0.52 0.11 0.20 0.08 -1.32 0.00 0.00 175.29 174.88 2fhf s VAL 1050N 0.36 3.64 0.97 3.63 1.01 -1.26 -1.09 120.40 127.66 2fhf s VAL 1050Ca -0.08 -1.67 -0.13 0.00 0.00 0.00 0.00 61.98 60.10 2fhf s VAL 1050Cb -0.12 -3.32 0.17 0.00 0.00 0.00 0.00 36.38 33.11 2fhf s VAL 1050CO 0.02 -0.52 1.12 0.00 0.00 0.00 0.00 175.10 175.72 2fhf s ALA 1051N 1.28 1.35 0.22 5.51 0.00 -0.45 -4.95 121.76 124.72 2fhf s ALA 1051Ca 0.04 -0.51 0.20 0.00 0.00 0.00 0.00 51.96 51.68 2fhf s ALA 1051Cb -0.22 -3.05 0.81 0.00 0.00 0.00 0.00 23.12 20.66 2fhf s ALA 1051CO -0.01 -2.62 1.80 0.00 0.00 0.00 0.00 175.76 174.93 2fhf h ALA 1052N -1.75 1.08 -0.02 0.00 0.00 -1.99 -2.43 119.26 114.15 2fhf h ALA 1052Ca -0.52 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.09 2fhf h ALA 1052Cb 1.33 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.07 2fhf h ALA 1052CO 0.58 0.41 0.00 -0.40 0.00 0.00 0.00 179.25 179.84 2fhf n ASP 1053N -3.60 0.45 0.00 0.00 5.75 -1.26 -4.89 116.55 113.01 2fhf n ASP 1053Ca -0.01 -1.24 0.00 0.00 -0.01 0.00 0.00 54.79 53.53 2fhf n ASP 1053Cb 0.45 -0.01 0.00 0.00 -1.03 0.00 0.00 41.12 40.53 2fhf n ASP 1053CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2fhf n GLY 1054N 1.01 1.18 3.79 6.12 0.00 -0.92 -3.17 105.19 113.20 2fhf n GLY 1054Ca 0.20 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.88 2fhf n GLY 1054CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2fhf s SER 1055N -2.99 5.85 -0.11 1.61 1.04 -1.26 -4.18 113.70 113.65 2fhf s SER 1055Ca 0.00 2.02 0.02 0.00 0.48 0.00 0.00 55.95 58.47 2fhf s SER 1055Cb 0.00 -2.56 0.01 0.00 0.10 0.00 0.00 66.02 63.57 2fhf s SER 1055CO 0.00 -1.12 -0.15 -0.69 0.98 0.00 0.00 173.24 172.25 2fhf s VAL 1056N -2.01 1.49 -0.14 5.02 1.01 -0.62 -1.35 120.40 123.81 2fhf s VAL 1056Ca 0.69 -0.64 -0.03 0.00 0.00 0.00 0.00 61.98 62.00 2fhf s VAL 1056Cb -0.20 -1.36 -0.03 0.00 0.00 0.00 0.00 36.38 34.79 2fhf s VAL 1056CO 0.28 0.44 -0.06 -0.89 0.00 0.00 0.00 175.10 174.87 2fhf s THR 1057N 0.96 3.74 -0.11 3.92 2.01 -0.25 0.63 115.64 126.54 2fhf s THR 1057Ca -0.07 -0.42 0.01 0.00 0.31 0.00 0.00 61.69 61.52 2fhf s THR 1057Cb -0.15 -2.62 -0.02 0.00 0.01 0.00 0.00 72.50 69.73 2fhf s THR 1057CO -0.01 0.51 -0.14 -0.76 -0.69 0.00 0.00 174.62 173.53 2fhf s LEU 1058N 0.19 2.70 1.02 4.42 1.02 0.12 -1.76 118.68 126.39 2fhf s LEU 1058Ca -0.03 -0.30 -0.15 0.00 0.02 0.00 0.00 54.13 53.67 2fhf s LEU 1058Cb -0.14 -1.59 0.20 0.00 0.02 0.00 0.00 46.19 44.68 2fhf s LEU 1058CO 0.03 0.22 1.15 -2.84 0.02 0.00 0.00 176.35 174.93 2fhf s PRO 1059N 0.05 0.27 0.59 1.29 0.02 -1.26 -0.83 135.00 135.12 2fhf s PRO 1059Ca -0.05 0.13 -0.20 0.00 0.02 0.00 0.00 61.00 60.90 2fhf s PRO 1059Cb -0.14 -1.75 -0.03 0.00 0.02 0.00 0.00 34.50 32.59 2fhf s PRO 1059CO 0.04 -2.75 1.32 0.00 -0.33 0.00 0.00 177.00 175.28 2fhf s ALA 1060N -3.23 2.62 -1.28 -1.55 0.00 -1.25 -3.52 121.76 113.54 2fhf s ALA 1060Ca 0.67 1.26 -0.25 0.00 0.00 0.00 0.00 51.96 53.64 2fhf s ALA 1060Cb -0.13 -3.55 0.03 0.00 0.00 0.00 0.00 23.12 19.47 2fhf s ALA 1060CO 0.55 -1.45 0.55 0.91 0.00 0.00 0.00 175.76 176.31 2fhf n TRP 1061N -1.43 -1.42 -4.41 0.00 7.02 -0.64 -4.96 117.44 111.60 2fhf n TRP 1061Ca 0.13 0.23 -0.21 0.00 -1.02 0.00 0.00 57.50 56.63 2fhf n TRP 1061Cb 0.47 -2.89 -0.10 0.00 -2.42 0.00 0.00 31.31 26.37 2fhf n TRP 1061CO 0.00 0.00 0.00 -1.54 -2.02 0.00 0.00 177.69 174.13 2fhf s SER 1062N -3.73 2.85 -0.06 -0.99 1.04 -1.15 -4.91 113.70 106.76 2fhf s SER 1062Ca 0.37 -1.11 -0.00 0.00 0.48 0.00 0.00 55.95 55.69 2fhf s SER 1062Cb -0.20 -0.18 0.02 0.00 0.10 0.00 0.00 66.02 65.76 2fhf s SER 1062CO 0.97 -0.23 -0.02 -0.69 0.98 0.00 0.00 173.24 174.24 2fhf s VAL 1063N -2.91 0.46 -0.04 5.02 1.01 -0.91 -0.91 120.40 122.12 2fhf s VAL 1063Ca 0.27 -0.01 0.03 0.00 0.00 0.00 0.00 61.98 62.28 2fhf s VAL 1063Cb 0.01 -0.55 0.00 0.00 0.00 0.00 0.00 36.38 35.84 2fhf s VAL 1063CO 0.11 0.24 -0.12 0.00 0.00 0.00 0.00 175.10 175.33 2fhf s ALA 1064N 1.44 1.16 -0.27 5.51 0.00 0.16 -2.95 121.76 126.81 2fhf s ALA 1064Ca -0.03 -0.45 -0.03 0.00 0.00 0.00 0.00 51.96 51.45 2fhf s ALA 1064Cb -0.13 -0.44 0.03 0.00 0.00 0.00 0.00 23.12 22.57 2fhf s ALA 1064CO -0.03 0.17 -0.02 0.08 0.00 0.00 0.00 175.76 175.97 2fhf s VAL 1065N 0.28 3.15 0.23 0.00 1.01 -1.26 -0.87 120.40 122.95 2fhf s VAL 1065Ca -0.06 -1.01 0.07 0.00 0.00 0.00 0.00 61.98 60.98 2fhf s VAL 1065Cb -0.11 -2.64 -0.04 0.00 0.00 0.00 0.00 36.38 33.58 2fhf s VAL 1065CO 0.02 0.12 0.11 -0.76 0.00 0.00 0.00 175.10 174.59 2fhf s LEU 1066N 1.35 3.59 0.01 3.92 2.01 0.03 -0.95 118.68 128.65 2fhf s LEU 1066Ca -0.00 -0.35 -0.03 0.00 0.01 0.00 0.00 54.13 53.75 2fhf s LEU 1066Cb -0.17 -2.15 -0.01 0.00 0.01 0.00 0.00 46.19 43.87 2fhf s LEU 1066CO -0.02 0.00 0.05 -1.83 1.01 0.00 0.00 176.35 175.56 2fhf s GLU 1067N -3.58 0.41 -0.43 1.70 -1.05 0.11 -1.10 118.70 114.75 2fhf s GLU 1067Ca 0.31 -0.54 -0.16 0.00 -0.15 0.00 0.00 54.97 54.44 2fhf s GLU 1067Cb -0.08 0.16 0.04 0.00 -0.44 0.00 0.00 34.13 33.80 2fhf s GLU 1067CO 0.23 -0.08 0.35 -0.51 0.95 0.00 0.00 175.26 176.19 2fhf s LEU 1068N -1.49 5.23 0.30 1.83 1.43 -0.67 -1.16 118.68 124.15 2fhf s LEU 1068Ca -0.15 -1.00 -0.30 0.00 -1.03 0.00 0.00 54.13 51.66 2fhf s LEU 1068Cb -0.08 -2.20 -0.11 0.00 0.03 0.00 0.00 46.19 43.82 2fhf s LEU 1068CO -0.00 -0.54 1.60 -2.16 0.23 0.00 0.00 176.35 175.48 2fhf s PRO 1069N 1.75 4.11 -0.14 1.29 0.04 -1.26 -0.28 135.00 140.50 2fhf s PRO 1069Ca 0.06 2.60 -0.21 0.00 0.04 0.00 0.00 61.00 63.49 2fhf s PRO 1069Cb -0.20 -3.01 -0.03 0.00 0.04 0.00 0.00 34.50 31.29 2fhf s PRO 1069CO 0.09 -0.64 0.60 -1.14 0.04 0.00 0.00 177.00 175.95 2fhf s GLN 1070N -0.62 4.31 0.00 4.56 0.74 -0.67 -4.62 119.66 123.35 2fhf s GLN 1070Ca 0.63 0.63 0.00 0.00 0.05 0.00 0.00 55.36 56.67 2fhf s GLN 1070Cb -0.48 -3.50 0.00 0.00 1.10 0.00 0.00 33.01 30.12 2fhf s GLN 1070CO 0.49 -0.05 0.00 0.41 -0.55 0.00 0.00 175.29 175.59 2fhf n GLY 1071N 3.47 1.17 0.32 2.59 0.00 -1.26 -4.90 105.19 106.58 2fhf n GLY 1071Ca -0.03 -1.54 0.00 0.00 0.00 0.00 0.00 46.02 44.45 2fhf n GLY 1071CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2fhf h GLU 1072N 0.00 0.95 -5.32 1.61 4.81 -2.00 -3.44 114.58 111.19 2fhf h GLU 1072Ca 0.00 -0.06 -0.45 0.00 -0.13 0.00 0.00 59.36 58.73 2fhf h GLU 1072Cb 0.00 -0.21 -0.14 0.00 0.63 0.00 0.00 28.75 29.03 2fhf h GLU 1072CO 0.00 0.63 -0.66 -1.12 -0.73 0.00 0.00 179.01 177.12 2fhf s SER 1073N -5.78 2.37 0.26 1.04 0.01 -1.26 -5.11 113.70 105.23 2fhf s SER 1073Ca -0.13 -1.21 -0.30 0.00 1.31 0.00 0.00 55.95 55.62 2fhf s SER 1073Cb 0.18 -0.09 -0.14 0.00 0.21 0.00 0.00 66.02 66.18 2fhf s SER 1073CO 0.79 -0.43 1.28 1.67 0.41 0.00 0.00 173.24 176.96 2fhf n GLN 1074N -0.52 1.79 -1.46 12.44 7.27 -1.26 -4.98 117.38 130.65 2fhf n GLN 1074Ca -0.05 0.63 -0.09 0.00 0.07 0.00 0.00 57.00 57.56 2fhf n GLN 1074Cb 0.64 -2.20 0.05 0.00 2.41 0.00 0.00 30.24 31.14 2fhf n GLN 1074CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 2fhf n GLY 1075N 1.71 0.83 0.18 1.69 0.00 -1.26 -4.81 105.19 103.53 2fhf n GLY 1075Ca 0.11 -2.00 0.03 0.00 0.00 0.00 0.00 46.02 44.15 2fhf n GLY 1075CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2fhf h ALA 1076N -0.44 1.15 -0.73 4.61 0.00 -1.93 -2.02 119.26 119.89 2fhf h ALA 1076Ca -0.13 -0.39 0.00 0.00 0.00 0.00 0.00 54.91 54.39 2fhf h ALA 1076Cb 0.51 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.23 2fhf h ALA 1076CO 0.15 0.53 0.00 0.41 0.00 0.00 0.00 179.25 180.34 2fhf n GLY 1077N -0.08 0.94 2.40 0.00 0.00 -1.26 -4.26 105.19 102.94 2fhf n GLY 1077Ca -0.01 -0.70 -0.26 0.00 0.00 0.00 0.00 46.02 45.05 2fhf n GLY 1077CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2fhf n LEU 1078N 0.00 1.95 -4.70 0.99 4.77 -1.26 -4.95 117.00 113.80 2fhf n LEU 1078Ca 0.00 -5.03 -0.43 0.00 -0.03 0.00 0.00 56.01 50.52 2fhf n LEU 1078Cb 0.00 -0.09 -0.01 0.00 -2.33 0.00 0.00 43.42 40.99 2fhf n LEU 1078CO 0.00 2.00 0.91 -0.81 -1.33 0.00 0.00 177.39 178.16 2fhf n PRO 1079N 1.42 2.13 -2.01 3.23 -0.04 -1.26 -4.13 135.00 134.33 2fhf n PRO 1079Ca 0.26 0.75 -0.42 0.00 -0.04 0.00 0.00 63.50 64.04 2fhf n PRO 1079Cb 0.45 -2.33 -0.03 0.00 -0.04 0.00 0.00 33.50 31.55 2fhf n PRO 1079CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 2fhf s VAL 1080N -1.02 2.85 0.31 0.52 1.01 -1.26 -4.95 120.40 117.86 2fhf s VAL 1080Ca 0.56 0.61 -0.29 0.00 0.00 0.00 0.00 61.98 62.86 2fhf s VAL 1080Cb -0.57 -3.39 -0.10 0.00 0.00 0.00 0.00 36.38 32.32 2fhf s VAL 1080CO 0.61 0.05 1.25 -0.94 0.00 0.00 0.00 175.10 176.07 2fhf s SER 1081N 1.12 6.92 0.24 3.32 1.04 -1.26 -4.98 113.70 120.11 2fhf s SER 1081Ca 0.68 2.56 -0.30 0.00 0.48 0.00 0.00 55.95 59.37 2fhf s SER 1081Cb -0.41 -2.64 -0.09 0.00 0.10 0.00 0.00 66.02 62.97 2fhf s SER 1081CO 0.31 -0.42 1.29 -0.44 0.98 0.00 0.00 173.24 174.96 2fhf s SER 1082N -0.58 6.90 0.00 7.02 0.01 -1.26 -5.14 113.70 120.65 2fhf s SER 1082Ca 0.48 2.46 0.00 0.00 1.31 0.00 0.00 55.95 60.20 2fhf s SER 1082Cb -0.37 -2.62 0.00 0.00 0.21 0.00 0.00 66.02 63.24 2fhf s SER 1082CO 0.49 -0.49 0.21 0.29 0.41 0.00 0.00 173.24 174.15