#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3fef s ASP 8 N 0.00 2.45 -1.43 1.96 1.01 -1.26 -0.96 116.67 118.43 3fef s ASP 8 Ca 0.00 -1.23 -0.10 0.00 0.71 0.00 0.00 52.55 51.93 3fef s ASP 8 Cb 0.00 -0.11 0.05 0.00 1.01 0.00 0.00 42.92 43.87 3fef s ASP 8 CO 0.00 -0.44 1.03 0.00 0.21 0.00 0.00 175.17 175.97 3fef n GLN 9 N -0.56 -6.39 -2.76 8.23 6.02 -0.79 -4.92 117.38 116.21 3fef n GLN 9 Ca -0.05 0.69 -0.36 0.00 -0.01 0.00 0.00 57.00 57.28 3fef n GLN 9 Cb 0.64 -5.62 -0.06 0.00 1.02 0.00 0.00 30.24 26.22 3fef n GLN 9 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 3fef s ILE 10 N -3.35 4.20 -0.14 5.09 -1.09 -0.82 -4.90 121.20 120.19 3fef s ILE 10 Ca 0.53 1.68 0.02 0.00 -2.23 0.00 0.00 60.65 60.65 3fef s ILE 10 Cb -0.25 -3.87 0.02 0.00 -1.58 0.00 0.00 42.46 36.77 3fef s ILE 10 CO 0.79 0.01 -0.18 -0.75 -1.23 0.00 0.00 174.94 173.57 3fef s LYS 11 N -2.40 2.64 -0.14 2.79 2.47 -1.26 -0.36 119.74 123.49 3fef s LYS 11 Ca 0.54 -0.71 0.02 0.00 -1.56 0.00 0.00 55.97 54.26 3fef s LYS 11 Cb -0.17 -2.23 0.00 0.00 -1.46 0.00 0.00 37.83 33.98 3fef s LYS 11 CO 0.21 -0.10 -0.19 0.42 0.16 0.00 0.00 175.35 175.85 3fef s ILE 12 N 1.07 2.38 -0.17 5.43 1.01 -0.18 -0.57 121.20 130.18 3fef s ILE 12 Ca -0.03 -0.88 -0.11 0.00 0.00 0.00 0.00 60.65 59.63 3fef s ILE 12 Cb -0.14 -1.97 -0.05 0.00 0.01 0.00 0.00 42.46 40.31 3fef s ILE 12 CO -0.05 0.54 0.21 0.00 0.00 0.00 0.00 174.94 175.63 3fef s ALA 13 N 0.66 3.66 -0.33 9.38 0.00 0.21 -0.68 121.76 134.67 3fef s ALA 13 Ca -0.09 -0.57 -0.00 0.00 0.00 0.00 0.00 51.96 51.29 3fef s ALA 13 Cb -0.16 -2.25 0.07 0.00 0.00 0.00 0.00 23.12 20.78 3fef s ALA 13 CO 0.02 0.18 0.04 -0.47 0.00 0.00 0.00 175.76 175.53 3fef s TYR 14 N 0.25 3.43 -0.29 0.00 5.04 -0.10 -0.63 117.35 125.05 3fef s TYR 14 Ca 0.13 -2.26 -0.20 0.00 -2.44 0.00 0.00 57.07 52.29 3fef s TYR 14 Cb -0.12 -2.49 -0.01 0.00 0.35 0.00 0.00 41.96 39.69 3fef s TYR 14 CO 0.01 -0.88 0.64 0.42 -1.34 0.00 0.00 175.55 174.40 3fef s ILE 15 N 1.14 4.95 0.00 3.14 1.01 0.55 -1.06 121.20 130.93 3fef s ILE 15 Ca 0.00 0.99 0.00 0.00 0.00 0.00 0.00 60.65 61.64 3fef s ILE 15 Cb -0.20 -3.98 0.00 0.00 0.01 0.00 0.00 42.46 38.28 3fef s ILE 15 CO -0.04 -0.08 0.00 0.61 0.00 0.00 0.00 174.94 175.43 3fef n GLY 16 N 4.31 1.53 0.00 6.18 0.00 -0.17 -1.10 105.19 115.93 3fef n GLY 16 Ca -0.01 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.05 3fef n GLY 16 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3fef n GLY 17 N -1.41 -0.64 0.49 -0.02 0.00 0.95 -1.09 105.19 103.46 3fef n GLY 17 Ca 0.00 -0.05 0.11 0.00 0.00 0.00 0.00 46.02 46.08 3fef n GLY 17 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3fef n GLY 18 N 0.20 0.11 3.31 -0.02 0.00 -1.26 -4.43 105.19 103.10 3fef n GLY 18 Ca 0.06 -0.39 -0.33 0.00 0.00 0.00 0.00 46.02 45.36 3fef n GLY 18 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 3fef n SER 19 N 0.18 -2.31 0.00 1.61 2.88 -0.25 -4.76 113.62 110.97 3fef n SER 19 Ca 0.16 -0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.70 3fef n SER 19 Cb 0.30 -1.02 0.00 0.00 -0.75 0.00 0.00 64.21 62.74 3fef n SER 19 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3fef n GLN 20 N -1.95 -0.04 0.00 -1.46 6.02 -1.26 -4.68 117.38 114.01 3fef n GLN 20 Ca 0.02 -0.09 0.00 0.00 -0.01 0.00 0.00 57.00 56.92 3fef n GLN 20 Cb 0.60 -0.55 0.00 0.00 1.02 0.00 0.00 30.24 31.31 3fef n GLN 20 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3fef n GLY 21 N 0.02 0.14 0.36 1.08 0.00 -1.26 -4.62 105.19 100.91 3fef n GLY 21 Ca 0.00 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.16 3fef n GLY 21 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 173.32 174.81 3fef h TRP 22 N 0.00 1.02 0.09 1.61 4.06 -1.95 -1.92 115.95 118.86 3fef h TRP 22 Ca 0.00 0.03 0.00 0.00 2.06 0.00 0.00 58.89 60.99 3fef h TRP 22 Cb 0.00 -0.31 -0.01 0.00 -1.00 0.00 0.00 29.16 27.84 3fef h TRP 22 CO 0.00 0.22 -0.08 0.00 -3.56 0.00 0.00 178.44 175.02 3fef h ALA 23 N 1.64 -0.16 -0.69 1.49 0.00 -1.89 0.44 119.26 120.10 3fef h ALA 23 Ca 0.57 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.46 3fef h ALA 23 Cb 0.95 0.12 -0.03 0.00 0.00 0.00 0.00 17.79 18.83 3fef h ALA 23 CO -0.37 -0.60 0.40 0.00 0.00 0.00 0.00 179.25 178.68 3fef h ARG 24 N -0.19 0.94 -0.70 0.00 2.47 -1.63 -2.11 114.38 113.16 3fef h ARG 24 Ca 0.00 -0.10 -0.06 0.00 -1.26 0.00 0.00 59.98 58.57 3fef h ARG 24 Cb 0.18 -0.19 -0.03 0.00 -1.65 0.00 0.00 29.97 28.28 3fef h ARG 24 CO -0.02 0.68 0.19 1.03 0.56 0.00 0.00 179.97 182.41 3fef h SER 25 N 0.94 1.05 0.00 7.04 0.87 -1.17 -1.32 113.55 120.95 3fef h SER 25 Ca 0.24 -0.22 0.00 0.00 -1.23 0.00 0.00 61.79 60.58 3fef h SER 25 Cb -0.00 -0.28 0.00 0.00 -0.44 0.00 0.00 62.40 61.68 3fef h SER 25 CO -0.04 1.00 0.00 -0.11 -0.53 0.00 0.00 176.83 177.14 3fef n LEU 26 N -4.27 0.68 0.00 2.23 7.94 0.15 -2.17 117.00 121.56 3fef n LEU 26 Ca 0.05 -0.34 0.00 0.00 -1.11 0.00 0.00 56.01 54.61 3fef n LEU 26 Cb 0.24 -0.12 0.00 0.00 0.53 0.00 0.00 43.42 44.07 3fef n LEU 26 CO 0.42 0.11 0.00 -1.20 -1.11 0.00 0.00 177.39 175.61 3fef n SER 28 N 0.84 0.00 -0.29 1.96 7.64 -0.50 -0.38 113.62 122.89 3fef n SER 28 Ca 0.00 0.00 -0.00 0.00 1.01 0.00 0.00 58.87 59.88 3fef n SER 28 Cb 0.11 0.00 0.19 0.00 -1.01 0.00 0.00 64.21 63.50 3fef n SER 28 CO 0.00 0.00 0.00 0.44 -3.01 0.00 0.00 175.04 172.47 3fef h ASP 29 N 0.00 0.99 -0.21 6.43 3.32 -1.66 -1.76 116.42 123.53 3fef h ASP 29 Ca 0.00 -0.02 -0.02 0.00 0.02 0.00 0.00 57.03 57.01 3fef h ASP 29 Cb 0.00 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 39.30 3fef h ASP 29 CO 0.00 0.71 0.06 -0.07 -1.72 0.00 0.00 179.24 178.22 3fef h LEU 30 N 1.17 0.32 -1.57 1.55 3.38 -0.98 -2.76 115.31 116.41 3fef h LEU 30 Ca 0.33 -0.21 0.00 0.00 0.09 0.00 0.00 57.88 58.08 3fef h LEU 30 Cb -0.11 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 40.56 3fef h LEU 30 CO -0.08 0.44 0.00 0.77 0.09 0.00 0.00 178.44 179.67 3fef h SER 31 N 0.17 0.00 0.00 -0.43 4.64 -1.56 -2.73 113.55 113.64 3fef h SER 31 Ca 0.07 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.39 3fef h SER 31 Cb 0.24 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.33 3fef h SER 31 CO -0.00 0.00 -0.50 2.30 -0.87 0.00 0.00 176.83 177.76 3fef n ILE 32 N -2.50 0.00 -2.52 0.95 -5.35 -1.09 -4.60 119.36 104.26 3fef n ILE 32 Ca -0.01 -0.25 -0.43 0.00 -0.27 0.00 0.00 62.75 61.79 3fef n ILE 32 Cb 0.11 1.00 -0.02 0.00 -1.74 0.00 0.00 39.64 38.99 3fef n ILE 32 CO 0.00 0.00 0.00 -0.62 -1.76 0.00 0.00 176.55 174.17 3fef s ASP 33 N -1.99 6.98 0.00 7.28 -1.08 -1.03 -4.89 116.67 121.93 3fef s ASP 33 Ca 0.04 1.52 0.27 0.00 -0.52 0.00 0.00 52.55 53.85 3fef s ASP 33 Cb 0.08 -2.54 0.86 0.00 -1.46 0.00 0.00 42.92 39.86 3fef s ASP 33 CO 0.43 -0.76 1.66 -0.62 0.52 0.00 0.00 175.17 176.40 3fef n GLU 34 N 6.57 0.03 0.00 4.34 1.02 -1.26 -4.87 120.64 126.47 3fef n GLU 34 Ca 0.13 -0.01 0.10 0.00 -0.02 0.00 0.00 57.16 57.36 3fef n GLU 34 Cb 0.45 -1.50 0.57 0.00 -0.02 0.00 0.00 31.44 30.95 3fef n GLU 34 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 3fef n ARG 35 N -1.47 0.47 0.00 3.49 1.74 -1.26 -4.81 116.66 114.82 3fef n ARG 35 Ca 0.07 0.05 0.00 0.00 -0.77 0.00 0.00 57.85 57.19 3fef n ARG 35 Cb 0.33 -1.50 0.00 0.00 -1.02 0.00 0.00 32.46 30.27 3fef n ARG 35 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 3fef n SER 37 N -1.15 0.00 0.00 0.55 2.88 -0.14 -0.21 113.62 115.56 3fef n SER 37 Ca 0.13 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.67 3fef n SER 37 Cb 0.12 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.58 3fef n SER 37 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3fef n GLY 38 N -0.36 -0.61 3.22 0.46 0.00 -1.06 -1.88 105.19 104.96 3fef n GLY 38 Ca 0.00 -0.39 -0.17 0.00 0.00 0.00 0.00 46.02 45.46 3fef n GLY 38 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3fef s THR 39 N -4.00 1.18 -0.21 2.61 -4.23 0.52 -1.69 115.64 109.82 3fef s THR 39 Ca 0.00 -1.69 0.01 0.00 -1.18 0.00 0.00 61.69 58.83 3fef s THR 39 Cb 0.00 -1.47 0.03 0.00 1.34 0.00 0.00 72.50 72.41 3fef s THR 39 CO 0.00 -0.47 -0.17 -0.69 -0.54 0.00 0.00 174.62 172.75 3fef s VAL 40 N -2.27 2.14 -0.39 2.29 1.01 -0.14 -1.01 120.40 122.04 3fef s VAL 40 Ca 0.08 -1.14 -0.20 0.00 0.00 0.00 0.00 61.98 60.72 3fef s VAL 40 Cb -0.04 -2.01 0.01 0.00 0.00 0.00 0.00 36.38 34.34 3fef s VAL 40 CO 0.02 0.37 0.60 0.00 0.00 0.00 0.00 175.10 176.08 3fef s ALA 41 N 1.24 3.41 -0.24 5.51 0.00 0.15 -1.50 121.76 130.33 3fef s ALA 41 Ca 0.01 -1.07 -0.18 0.00 0.00 0.00 0.00 51.96 50.71 3fef s ALA 41 Cb -0.15 -3.18 -0.03 0.00 0.00 0.00 0.00 23.12 19.76 3fef s ALA 41 CO -0.10 -1.51 0.53 -0.51 0.00 0.00 0.00 175.76 174.17 3fef s LEU 42 N 2.65 4.08 0.06 0.00 1.43 0.88 -0.93 118.68 126.84 3fef s LEU 42 Ca 0.22 0.60 0.08 0.00 -1.03 0.00 0.00 54.13 53.99 3fef s LEU 42 Cb -0.15 -2.71 -0.03 0.00 0.03 0.00 0.00 46.19 43.34 3fef s LEU 42 CO 0.16 -0.27 -0.23 -0.47 0.23 0.00 0.00 176.35 175.77 3fef s TYR 43 N 2.14 1.98 -0.29 0.29 5.04 -0.23 -0.26 117.35 126.03 3fef s TYR 43 Ca 0.23 -0.39 -0.16 0.00 -2.44 0.00 0.00 57.07 54.30 3fef s TYR 43 Cb -0.16 -1.16 0.13 0.00 0.35 0.00 0.00 41.96 41.12 3fef s TYR 43 CO 0.09 0.13 0.89 0.34 -1.34 0.00 0.00 175.55 175.67 3fef s ASP 44 N -1.35 -0.63 0.33 4.32 -1.08 -1.26 -0.04 116.67 116.96 3fef s ASP 44 Ca 0.09 1.02 0.10 0.00 -0.52 0.00 0.00 52.55 53.24 3fef s ASP 44 Cb -0.09 1.25 0.98 0.00 -1.46 0.00 0.00 42.92 43.60 3fef s ASP 44 CO 0.02 -0.16 1.60 -0.07 0.52 0.00 0.00 175.17 177.09 3fef h LEU 45 N 6.26 0.02 -8.15 -1.34 3.38 -1.96 -3.05 115.31 110.46 3fef h LEU 45 Ca -0.29 0.24 -0.63 0.00 0.09 0.00 0.00 57.88 57.30 3fef h LEU 45 Cb 1.20 0.32 -0.13 0.00 0.09 0.00 0.00 40.66 42.14 3fef h LEU 45 CO 0.18 -0.31 0.93 -0.62 0.09 0.00 0.00 178.44 178.71 3fef s ASP 46 N -4.85 6.38 0.23 -0.43 -1.08 -1.26 -4.88 116.67 110.78 3fef s ASP 46 Ca -0.11 -1.33 -0.07 0.00 -0.52 0.00 0.00 52.55 50.52 3fef s ASP 46 Cb 0.30 -2.47 0.22 0.00 -1.46 0.00 0.00 42.92 39.51 3fef s ASP 46 CO 0.78 -1.41 1.87 0.15 0.52 0.00 0.00 175.17 177.09 3fef h PHE 47 N 9.47 1.23 -0.81 -5.34 3.04 -1.94 -2.50 116.94 120.09 3fef h PHE 47 Ca -0.04 -0.01 0.09 0.00 3.98 0.00 0.00 57.97 61.98 3fef h PHE 47 Cb 1.04 -0.40 -0.07 0.00 2.56 0.00 0.00 35.95 39.08 3fef h PHE 47 CO 1.12 0.83 0.47 1.49 -2.02 0.00 0.00 178.31 180.20 3fef h GLU 48 N 1.27 0.77 -0.15 1.11 4.81 -1.89 -0.41 114.58 120.10 3fef h GLU 48 Ca 0.33 -0.05 -0.17 0.00 -0.13 0.00 0.00 59.36 59.34 3fef h GLU 48 Cb -0.03 -0.17 -0.01 0.00 0.63 0.00 0.00 28.75 29.17 3fef h GLU 48 CO -0.06 0.51 -0.61 0.00 -0.73 0.00 0.00 179.01 178.12 3fef h ALA 49 N 1.44 0.66 -0.72 2.92 0.00 -1.82 -2.21 119.26 119.53 3fef h ALA 49 Ca 0.39 -0.54 -0.00 0.00 0.00 0.00 0.00 54.91 54.75 3fef h ALA 49 Cb 0.33 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.01 3fef h ALA 49 CO -0.23 0.71 0.44 0.00 0.00 0.00 0.00 179.25 180.17 3fef h ALA 50 N 0.95 0.92 -0.53 0.00 0.00 -1.15 -2.43 119.26 117.02 3fef h ALA 50 Ca -0.01 -0.08 0.06 0.00 0.00 0.00 0.00 54.91 54.88 3fef h ALA 50 Cb 1.17 -0.29 -0.05 0.00 0.00 0.00 0.00 17.79 18.62 3fef h ALA 50 CO 0.11 0.38 0.25 1.96 0.00 0.00 0.00 179.25 181.95 3fef h GLN 51 N 0.98 0.46 -0.13 0.00 4.20 -0.68 0.18 115.11 120.11 3fef h GLN 51 Ca 0.26 -0.03 -0.07 0.00 0.06 0.00 0.00 58.65 58.88 3fef h GLN 51 Cb -0.04 -0.10 -0.01 0.00 0.30 0.00 0.00 27.48 27.62 3fef h GLN 51 CO -0.05 0.30 -0.22 0.87 -0.67 0.00 0.00 178.83 179.07 3fef h LYS 52 N 0.47 0.23 -0.31 1.46 1.57 -1.17 0.38 116.57 119.20 3fef h LYS 52 Ca 0.24 -0.07 -0.12 0.00 -1.87 0.00 0.00 60.65 58.84 3fef h LYS 52 Cb 0.20 -0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.47 3fef h LYS 52 CO -0.20 0.44 -0.29 -0.91 -0.57 0.00 0.00 179.45 177.93 3fef h ASN 53 N 0.21 0.67 0.38 0.86 2.35 -0.94 -0.24 115.58 118.88 3fef h ASN 53 Ca 0.04 -0.26 -0.01 0.00 -0.55 0.00 0.00 56.30 55.52 3fef h ASN 53 Cb 0.51 -0.19 -0.02 0.00 0.05 0.00 0.00 38.32 38.67 3fef h ASN 53 CO 0.03 0.93 -0.35 -0.08 -1.65 0.00 0.00 177.43 176.31 3fef h GLU 54 N 0.56 -0.73 0.01 0.81 4.81 0.68 1.43 114.58 122.15 3fef h GLU 54 Ca 0.07 0.05 0.03 0.00 -0.13 0.00 0.00 59.36 59.38 3fef h GLU 54 Cb 0.78 0.17 -0.04 0.00 0.63 0.00 0.00 28.75 30.28 3fef h GLU 54 CO 0.06 -0.48 -0.26 0.28 -0.73 0.00 0.00 179.01 177.88 3fef h VAL 55 N -0.75 0.42 -0.32 0.32 2.07 -0.22 -0.28 116.25 117.49 3fef h VAL 55 Ca -0.03 0.00 -0.09 0.00 0.82 0.00 0.00 66.70 67.40 3fef h VAL 55 Cb 0.67 0.42 -0.02 0.00 -1.52 0.00 0.00 31.29 30.84 3fef h VAL 55 CO -0.04 0.00 -0.18 0.40 0.02 0.00 0.00 177.57 177.76 3fef h ILE 56 N -0.40 1.26 -0.65 4.57 2.04 -0.85 -2.37 117.51 121.11 3fef h ILE 56 Ca 0.06 -1.19 -0.05 0.00 1.00 0.00 0.00 64.86 64.68 3fef h ILE 56 Cb 0.48 1.21 -0.03 0.00 -0.74 0.00 0.00 36.82 37.75 3fef h ILE 56 CO -0.22 0.39 0.21 1.23 0.00 0.00 0.00 178.15 179.75 3fef h GLY 57 N 0.98 1.05 0.86 5.37 0.00 0.24 -2.70 103.07 108.87 3fef h GLY 57 Ca 0.08 -0.59 0.00 0.00 0.00 0.00 0.00 47.33 46.82 3fef h GLY 57 CO 0.04 0.56 0.00 0.70 0.00 0.00 0.00 176.54 177.84 3fef n ASN 58 N -4.28 0.01 -1.14 0.19 3.02 -0.15 -1.40 115.26 111.50 3fef n ASN 58 Ca 0.05 -1.14 0.08 0.00 -0.03 0.00 0.00 54.58 53.54 3fef n ASN 58 Cb 0.21 -0.00 0.28 0.00 -0.61 0.00 0.00 39.78 39.66 3fef n ASN 58 CO 0.00 0.00 0.00 1.41 -2.62 0.00 0.00 177.26 176.05 3fef n HIS 59 N -0.93 1.12 -4.18 3.10 8.25 -1.02 -4.94 115.22 116.62 3fef n HIS 59 Ca 0.21 -0.71 -0.23 0.00 -0.26 0.00 0.00 57.72 56.73 3fef n HIS 59 Cb 0.10 -0.26 -0.07 0.00 1.12 0.00 0.00 29.99 30.88 3fef n HIS 59 CO 0.00 0.00 0.00 -1.12 0.64 0.00 0.00 176.34 175.86 3fef s SER 60 N -1.32 4.55 0.43 0.41 0.01 -0.50 -3.48 113.70 113.80 3fef s SER 60 Ca 0.42 -0.81 0.00 0.00 1.31 0.00 0.00 55.95 56.87 3fef s SER 60 Cb 0.30 -0.70 0.00 0.00 0.21 0.00 0.00 66.02 65.83 3fef s SER 60 CO 0.15 -0.24 0.00 0.61 0.41 0.00 0.00 173.24 174.17 3fef n GLY 61 N -1.07 0.77 0.46 3.44 0.00 -1.26 -3.50 105.19 104.03 3fef n GLY 61 Ca -0.04 -0.78 0.14 0.00 0.00 0.00 0.00 46.02 45.34 3fef n GLY 61 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3fef n ASN 62 N -3.57 1.47 0.00 1.61 4.13 -1.26 -4.78 115.26 112.86 3fef n ASN 62 Ca 0.00 -1.45 0.00 0.00 1.68 0.00 0.00 54.58 54.81 3fef n ASN 62 Cb 0.00 0.01 0.00 0.00 -1.54 0.00 0.00 39.78 38.25 3fef n ASN 62 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 3fef n GLY 63 N 1.19 0.59 0.35 7.41 0.00 -1.23 -4.93 105.19 108.57 3fef n GLY 63 Ca 0.18 -0.42 0.07 0.00 0.00 0.00 0.00 46.02 45.86 3fef n GLY 63 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 3fef h ARG 64 N 0.87 0.86 -5.07 1.61 2.43 -1.86 -3.40 114.38 109.83 3fef h ARG 64 Ca 0.00 -0.05 -0.65 0.00 -0.81 0.00 0.00 59.98 58.47 3fef h ARG 64 Cb 0.00 -0.19 -0.34 0.00 -0.42 0.00 0.00 29.97 29.01 3fef h ARG 64 CO 0.00 0.57 -0.86 -1.58 -1.51 0.00 0.00 179.97 176.59 3fef s TRP 65 N -5.95 2.47 -0.15 2.20 0.52 -1.26 -2.55 118.94 114.21 3fef s TRP 65 Ca -0.12 -1.23 -0.15 0.00 0.02 0.00 0.00 56.10 54.62 3fef s TRP 65 Cb 0.22 -1.70 -0.05 0.00 -1.15 0.00 0.00 33.47 30.79 3fef s TRP 65 CO 0.80 -0.58 0.34 0.50 0.02 0.00 0.00 176.95 178.03 3fef s ARG 66 N 0.87 4.28 0.09 4.98 3.52 -0.68 -4.83 118.95 127.17 3fef s ARG 66 Ca -0.07 0.18 0.05 0.00 -0.13 0.00 0.00 55.73 55.76 3fef s ARG 66 Cb -0.15 -3.43 -0.04 0.00 -1.56 0.00 0.00 34.95 29.77 3fef s ARG 66 CO -0.02 0.22 0.00 0.71 -0.81 0.00 0.00 175.30 175.40 3fef s TYR 67 N 0.51 3.00 -0.22 5.12 1.51 -1.26 -0.96 117.35 125.04 3fef s TYR 67 Ca 0.19 -0.02 -0.09 0.00 -1.01 0.00 0.00 57.07 56.13 3fef s TYR 67 Cb -0.13 -1.54 0.09 0.00 -0.11 0.00 0.00 41.96 40.27 3fef s TYR 67 CO 0.05 0.48 0.50 -2.00 -1.11 0.00 0.00 175.55 173.48 3fef s GLU 68 N -2.31 0.45 0.10 -0.62 2.12 -0.56 -4.91 118.70 112.96 3fef s GLU 68 Ca 0.26 1.09 -0.30 0.00 0.36 0.00 0.00 54.97 56.38 3fef s GLU 68 Cb -0.12 0.33 -0.06 0.00 0.26 0.00 0.00 34.13 34.54 3fef s GLU 68 CO 0.18 -0.20 1.15 0.00 -0.54 0.00 0.00 175.26 175.85 3fef s ALA 69 N 2.24 3.37 0.07 6.30 0.00 -1.26 -0.09 121.76 132.40 3fef s ALA 69 Ca -0.06 0.83 0.06 0.00 0.00 0.00 0.00 51.96 52.79 3fef s ALA 69 Cb -0.10 -3.41 -0.03 0.00 0.00 0.00 0.00 23.12 19.58 3fef s ALA 69 CO -0.15 -0.35 -0.17 0.14 0.00 0.00 0.00 175.76 175.23 3fef s VAL 70 N 0.56 1.34 -0.97 0.00 -7.23 0.64 -4.87 120.40 109.87 3fef s VAL 70 Ca 0.55 -1.30 0.25 0.00 -1.81 0.00 0.00 61.98 59.67 3fef s VAL 70 Cb -0.29 -1.24 0.01 0.00 0.56 0.00 0.00 36.38 35.42 3fef s VAL 70 CO 0.32 -0.09 1.41 -1.54 -0.31 0.00 0.00 175.10 174.89 3fef n SER 71 N 1.40 0.50 -4.00 4.85 3.41 -1.26 -4.42 113.62 114.11 3fef n SER 71 Ca -0.20 -0.22 -0.14 0.00 -0.26 0.00 0.00 58.87 58.06 3fef n SER 71 Cb 0.54 0.24 -0.13 0.00 -0.26 0.00 0.00 64.21 64.60 3fef n SER 71 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 3fef s THR 72 N -3.01 0.41 0.19 6.66 -4.23 -1.26 -4.95 115.64 109.44 3fef s THR 72 Ca 0.11 -0.61 -0.20 0.00 -1.18 0.00 0.00 61.69 59.80 3fef s THR 72 Cb 0.17 -0.42 0.14 0.00 1.34 0.00 0.00 72.50 73.73 3fef s THR 72 CO 0.70 -0.15 1.59 -0.07 -0.54 0.00 0.00 174.62 176.15 3fef h LEU 73 N 5.29 -1.10 -0.74 4.79 3.38 -1.99 -0.27 115.31 124.67 3fef h LEU 73 Ca -0.31 0.22 0.09 0.00 0.09 0.00 0.00 57.88 57.97 3fef h LEU 73 Cb 1.20 0.56 -0.07 0.00 0.09 0.00 0.00 40.66 42.44 3fef h LEU 73 CO 0.46 -0.30 0.40 0.50 0.09 0.00 0.00 178.44 179.59 3fef h LYS 74 N -0.15 0.67 -0.11 1.13 3.64 -1.95 0.60 116.57 120.41 3fef h LYS 74 Ca 0.24 -0.04 -0.01 0.00 -1.27 0.00 0.00 60.65 59.57 3fef h LYS 74 Cb 0.55 -0.15 -0.00 0.00 -0.41 0.00 0.00 32.23 32.21 3fef h LYS 74 CO -0.68 0.44 0.02 -0.22 -2.27 0.00 0.00 179.45 176.74 3fef h LYS 75 N 0.69 0.18 -0.75 1.90 3.64 -1.81 -1.60 116.57 118.81 3fef h LYS 75 Ca 0.36 -0.05 0.06 0.00 -1.27 0.00 0.00 60.65 59.75 3fef h LYS 75 Cb 0.33 -0.02 -0.06 0.00 -0.41 0.00 0.00 32.23 32.07 3fef h LYS 75 CO -0.24 0.37 0.45 0.00 -2.27 0.00 0.00 179.45 177.76 3fef h ALA 76 N 0.80 1.02 0.00 5.00 0.00 0.71 -3.08 119.26 123.70 3fef h ALA 76 Ca 0.03 -0.00 -0.15 0.00 0.00 0.00 0.00 54.91 54.79 3fef h ALA 76 Cb 0.28 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.86 3fef h ALA 76 CO 0.00 0.17 -0.74 -0.07 0.00 0.00 0.00 179.25 178.62 3fef h LEU 77 N 0.83 0.00 -9.23 0.00 3.38 0.31 -3.41 115.31 107.19 3fef h LEU 77 Ca 0.33 0.00 -0.69 0.00 0.09 0.00 0.00 57.88 57.61 3fef h LEU 77 Cb 0.15 0.00 0.03 0.00 0.09 0.00 0.00 40.66 40.93 3fef h LEU 77 CO -0.17 0.74 0.83 -0.24 0.09 0.00 0.00 178.44 179.69 3fef n SER 78 N -3.35 2.49 -1.82 -0.43 2.88 -0.62 -0.88 113.62 111.89 3fef n SER 78 Ca 0.01 1.06 -0.18 0.00 -1.33 0.00 0.00 58.87 58.43 3fef n SER 78 Cb 0.81 -1.22 -0.06 0.00 -0.75 0.00 0.00 64.21 62.99 3fef n SER 78 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3fef n ALA 79 N 4.81 -0.41 -2.42 -1.46 0.00 -1.26 -4.95 120.51 114.82 3fef n ALA 79 Ca 0.23 0.25 -0.42 0.00 0.00 0.00 0.00 53.44 53.50 3fef n ALA 79 Cb 0.19 -1.88 -0.03 0.00 0.00 0.00 0.00 19.45 17.72 3fef n ALA 79 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3fef s ALA 80 N -2.67 3.29 0.07 0.00 0.00 -0.06 -4.70 121.76 117.68 3fef s ALA 80 Ca 0.00 0.70 -0.06 0.00 0.00 0.00 0.00 51.96 52.60 3fef s ALA 80 Cb 0.00 -3.37 -0.29 0.00 0.00 0.00 0.00 23.12 19.46 3fef s ALA 80 CO 0.00 -0.26 1.12 -0.44 0.00 0.00 0.00 175.76 176.18 3fef h ASP 81 N 6.26 0.50 -3.90 0.00 3.32 -1.17 -3.39 116.42 118.04 3fef h ASP 81 Ca -0.42 -0.53 -0.42 0.00 0.02 0.00 0.00 57.03 55.68 3fef h ASP 81 Cb 1.22 -0.16 -0.30 0.00 0.22 0.00 0.00 39.33 40.30 3fef h ASP 81 CO 0.76 1.41 -0.79 -0.63 -1.72 0.00 0.00 179.24 178.28 3fef s ILE 82 N -2.66 0.79 -0.15 0.35 -1.09 -1.05 -1.70 121.20 115.70 3fef s ILE 82 Ca -0.05 -0.38 0.02 0.00 -2.23 0.00 0.00 60.65 58.01 3fef s ILE 82 Cb 0.07 -0.69 0.01 0.00 -1.58 0.00 0.00 42.46 40.27 3fef s ILE 82 CO 0.89 0.24 -0.21 -0.69 -1.23 0.00 0.00 174.94 173.94 3fef s VAL 83 N 0.05 2.01 -0.11 2.92 1.01 0.36 -0.62 120.40 126.01 3fef s VAL 83 Ca -0.01 -0.94 -0.01 0.00 0.00 0.00 0.00 61.98 61.02 3fef s VAL 83 Cb -0.07 -1.79 -0.03 0.00 0.00 0.00 0.00 36.38 34.49 3fef s VAL 83 CO 0.00 0.54 -0.06 -0.63 0.00 0.00 0.00 175.10 174.95 3fef s ILE 84 N 0.94 3.75 -0.16 2.22 1.01 0.20 0.77 121.20 129.93 3fef s ILE 84 Ca -0.04 -0.43 0.01 0.00 0.00 0.00 0.00 60.65 60.18 3fef s ILE 84 Cb -0.15 -2.59 0.02 0.00 0.01 0.00 0.00 42.46 39.76 3fef s ILE 84 CO -0.04 0.54 -0.15 -0.63 0.00 0.00 0.00 174.94 174.66 3fef s ILE 85 N -0.17 1.72 -0.41 2.92 1.01 0.19 -0.33 121.20 126.14 3fef s ILE 85 Ca 0.03 -0.77 0.03 0.00 0.00 0.00 0.00 60.65 59.94 3fef s ILE 85 Cb -0.13 -1.62 0.16 0.00 0.01 0.00 0.00 42.46 40.89 3fef s ILE 85 CO 0.03 0.45 0.37 -0.55 0.00 0.00 0.00 174.94 175.23 3fef s SER 86 N 1.42 1.31 0.45 3.58 0.15 -0.26 -0.49 113.70 119.86 3fef s SER 86 Ca 0.04 -2.51 0.05 0.00 0.70 0.00 0.00 55.95 54.24 3fef s SER 86 Cb -0.13 0.02 -0.04 0.00 -1.71 0.00 0.00 66.02 64.15 3fef s SER 86 CO -0.11 -0.20 0.10 0.27 1.20 0.00 0.00 173.24 174.50 3fef s ILE 87 N 0.57 1.83 -0.26 6.45 -4.36 -1.26 -4.41 121.20 119.75 3fef s ILE 87 Ca 0.27 -1.86 -0.03 0.00 -0.26 0.00 0.00 60.65 58.77 3fef s ILE 87 Cb -0.05 -2.69 0.02 0.00 1.25 0.00 0.00 42.46 40.99 3fef s ILE 87 CO -0.11 0.00 -0.02 -0.22 0.24 0.00 0.00 174.94 174.83 3fef s LEU 88 N -3.87 3.41 -0.89 0.37 2.96 -1.26 -4.68 118.68 114.72 3fef s LEU 88 Ca 0.29 -0.83 -0.25 0.00 -0.22 0.00 0.00 54.13 53.12 3fef s LEU 88 Cb 0.05 -1.73 -0.00 0.00 0.50 0.00 0.00 46.19 45.01 3fef s LEU 88 CO 0.16 -0.15 1.69 -2.84 -1.32 0.00 0.00 176.35 173.89 3fef s PRO 89 N 1.37 2.99 0.20 0.98 0.02 -1.26 -4.74 135.00 134.56 3fef s PRO 89 Ca 0.01 -0.45 0.00 0.00 0.02 0.00 0.00 61.00 60.58 3fef s PRO 89 Cb -0.17 -4.98 0.00 0.00 0.02 0.00 0.00 34.50 29.37 3fef s PRO 89 CO -0.02 -2.76 0.00 0.41 -0.33 0.00 0.00 177.00 174.30 3fef n GLY 90 N 6.55 -1.89 3.99 0.52 0.00 -1.26 -4.85 105.19 108.25 3fef n GLY 90 Ca 0.31 -1.93 -0.21 0.00 0.00 0.00 0.00 46.02 44.19 3fef n GLY 90 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3fef s SER 91 N -3.79 5.05 0.41 1.61 1.04 -1.26 -4.99 113.70 111.76 3fef s SER 91 Ca 0.00 -0.88 0.20 0.00 0.48 0.00 0.00 55.95 55.75 3fef s SER 91 Cb 0.00 0.15 0.86 0.00 0.10 0.00 0.00 66.02 67.13 3fef s SER 91 CO 0.00 -1.17 1.82 -0.07 0.98 0.00 0.00 173.24 174.81 3fef h LEU 92 N 0.43 0.00 -0.37 2.42 3.38 -1.99 -2.58 115.31 116.61 3fef h LEU 92 Ca -0.33 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 57.53 3fef h LEU 92 Cb 1.29 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.03 3fef h LEU 92 CO 0.46 0.31 -0.18 0.44 0.09 0.00 0.00 178.44 179.56 3fef h ASP 93 N 0.00 0.79 0.00 -0.43 3.32 -1.99 0.53 116.42 118.64 3fef h ASP 93 Ca -0.00 -0.40 0.00 0.00 0.02 0.00 0.00 57.03 56.64 3fef h ASP 93 Cb 0.74 -0.22 0.00 0.00 0.22 0.00 0.00 39.33 40.07 3fef h ASP 93 CO 0.04 1.02 0.00 0.47 -1.72 0.00 0.00 179.24 179.05 3fef n ASP 94 N -4.29 0.00 0.00 6.45 8.00 -0.97 -2.62 116.55 123.11 3fef n ASP 94 Ca -0.02 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.48 3fef n ASP 94 Cb 0.41 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.51 3fef n ASP 94 CO 0.00 0.00 0.00 1.21 -0.39 0.00 0.00 177.20 178.02 3fef n GLU 96 N 0.66 0.00 0.19 -1.24 2.13 0.18 -1.38 120.64 121.18 3fef n GLU 96 Ca 0.00 0.00 -0.13 0.00 0.66 0.00 0.00 57.16 57.69 3fef n GLU 96 Cb 0.00 0.00 -0.08 0.00 0.27 0.00 0.00 31.44 31.63 3fef n GLU 96 CO 0.00 0.00 0.00 0.28 -0.41 0.00 0.00 177.13 177.00 3fef h VAL 97 N 0.00 0.57 -0.83 6.31 2.07 -1.79 -2.15 116.25 120.43 3fef h VAL 97 Ca 0.00 -0.53 0.16 0.00 0.82 0.00 0.00 66.70 67.14 3fef h VAL 97 Cb 0.00 0.81 -0.15 0.00 -1.52 0.00 0.00 31.29 30.42 3fef h VAL 97 CO 0.00 0.09 -0.25 0.44 0.02 0.00 0.00 177.57 177.87 3fef h ASP 98 N -0.84 -0.91 0.47 0.57 3.32 -1.53 -2.01 116.42 115.49 3fef h ASP 98 Ca -0.05 0.26 -0.30 0.00 0.02 0.00 0.00 57.03 56.96 3fef h ASP 98 Cb 0.54 0.56 -0.05 0.00 0.22 0.00 0.00 39.33 40.60 3fef h ASP 98 CO 0.08 -0.28 -1.72 0.58 -1.72 0.00 0.00 179.24 176.19 3fef h VAL 99 N -0.02 0.85 0.00 -1.35 2.07 -1.84 -3.29 116.25 112.67 3fef h VAL 99 Ca 0.37 -2.69 -0.11 0.00 0.82 0.00 0.00 66.70 65.09 3fef h VAL 99 Cb 0.60 2.43 -0.02 0.00 -1.52 0.00 0.00 31.29 32.79 3fef h VAL 99 CO -0.86 0.52 -1.43 1.41 0.02 0.00 0.00 177.57 177.24 3fef n HIS 100 N -3.09 0.00 -0.33 1.57 8.25 -0.81 -4.46 115.22 116.35 3fef n HIS 100 Ca -0.18 0.00 0.13 0.00 -0.26 0.00 0.00 57.72 57.41 3fef n HIS 100 Cb 1.05 -0.31 0.31 0.00 1.12 0.00 0.00 29.99 32.17 3fef n HIS 100 CO 0.00 0.00 0.00 1.25 0.64 0.00 0.00 176.34 178.23 3fef h LEU 101 N 0.00 0.64 -0.17 2.41 5.85 -1.41 -0.74 115.31 121.90 3fef h LEU 101 Ca -0.17 0.11 0.00 0.00 0.84 0.00 0.00 57.88 58.66 3fef h LEU 101 Cb 1.36 0.01 0.00 0.00 0.37 0.00 0.00 40.66 42.40 3fef h LEU 101 CO 0.00 0.19 0.00 -2.65 -0.34 0.00 0.00 178.44 175.64 3fef n PRO 102 N -4.86 0.03 0.13 5.25 -0.02 -1.26 -2.58 135.00 131.68 3fef n PRO 102 Ca 0.23 0.40 0.05 0.00 -2.02 0.00 0.00 63.50 62.16 3fef n PRO 102 Cb 0.60 -1.57 0.49 0.00 -0.02 0.00 0.00 33.50 33.00 3fef n PRO 102 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 3fef h GLU 103 N 0.00 0.26 0.00 -0.52 5.08 -0.87 -1.10 114.58 117.43 3fef h GLU 103 Ca 0.00 -0.03 -0.00 0.00 -1.00 0.00 0.00 59.36 58.33 3fef h GLU 103 Cb 0.13 -0.05 -0.00 0.00 0.50 0.00 0.00 28.75 29.33 3fef h GLU 103 CO 0.00 0.24 -0.00 0.07 -1.00 0.00 0.00 179.01 178.32 3fef h ARG 104 N 0.26 0.00 -0.59 2.33 0.11 -1.69 0.24 114.38 115.04 3fef h ARG 104 Ca 0.07 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.15 3fef h ARG 104 Cb 0.10 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.18 3fef h ARG 104 CO -0.00 0.00 0.00 0.00 0.10 0.00 0.00 179.97 180.07 3fef n GLY 106 N 1.13 0.55 3.58 0.00 0.00 0.85 -4.98 105.19 106.33 3fef n GLY 106 Ca 0.21 -0.18 -0.40 0.00 0.00 0.00 0.00 46.02 45.65 3fef n GLY 106 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3fef s ILE 107 N -2.00 5.08 -0.02 -0.61 1.01 -0.73 -4.97 121.20 118.96 3fef s ILE 107 Ca 0.00 0.46 -0.00 0.00 0.00 0.00 0.00 60.65 61.10 3fef s ILE 107 Cb 0.00 -3.86 -0.04 0.00 0.01 0.00 0.00 42.46 38.58 3fef s ILE 107 CO 0.00 -0.05 0.05 -0.31 0.00 0.00 0.00 174.94 174.62 3fef s TYR 108 N 2.25 3.21 -0.03 3.97 2.02 -1.26 -2.62 117.35 124.89 3fef s TYR 108 Ca 0.17 0.18 0.02 0.00 -0.37 0.00 0.00 57.07 57.07 3fef s TYR 108 Cb -0.16 -1.73 0.01 0.00 -0.40 0.00 0.00 41.96 39.68 3fef s TYR 108 CO 0.11 0.52 -0.09 -0.65 -1.57 0.00 0.00 175.55 173.88 3fef s GLN 109 N -1.51 1.01 0.05 -0.62 -0.21 -1.26 -5.00 119.66 112.12 3fef s GLN 109 Ca 0.20 -0.28 -0.09 0.00 0.02 0.00 0.00 55.36 55.21 3fef s GLN 109 Cb -0.12 -0.94 -0.31 0.00 1.00 0.00 0.00 33.01 32.64 3fef s GLN 109 CO 0.10 0.08 1.06 0.66 -2.12 0.00 0.00 175.29 175.07 3fef h SER 110 N 6.56 0.59 0.00 5.90 4.64 -1.91 -3.42 113.55 125.91 3fef h SER 110 Ca -0.34 -0.65 0.00 0.00 -0.47 0.00 0.00 61.79 60.33 3fef h SER 110 Cb 1.17 -0.19 0.00 0.00 -0.31 0.00 0.00 62.40 63.07 3fef h SER 110 CO 0.48 1.51 -0.55 0.52 -0.87 0.00 0.00 176.83 177.93 3fef n VAL 111 N -3.60 0.15 -1.88 0.95 0.31 -1.26 -0.07 118.33 112.92 3fef n VAL 111 Ca -0.13 0.05 -0.10 0.00 -0.01 0.00 0.00 64.34 64.16 3fef n VAL 111 Cb 1.06 -1.18 -0.02 0.00 -0.91 0.00 0.00 33.84 32.79 3fef n VAL 111 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3fef n GLY 112 N 2.56 0.35 0.26 2.92 0.00 -1.26 -4.90 105.19 105.12 3fef n GLY 112 Ca 0.00 -0.52 0.03 0.00 0.00 0.00 0.00 46.02 45.53 3fef n GLY 112 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3fef n ASP 113 N 0.25 1.98 0.02 1.61 5.75 -1.26 -3.32 116.55 121.58 3fef n ASP 113 Ca -0.11 -1.64 0.00 0.00 -0.01 0.00 0.00 54.79 53.03 3fef n ASP 113 Cb 0.50 -0.06 0.00 0.00 -1.03 0.00 0.00 41.12 40.53 3fef n ASP 113 CO 0.00 0.00 0.00 0.41 -0.11 0.00 0.00 177.20 177.50 3fef n THR 114 N 0.12 0.09 -2.98 2.12 -1.04 -1.26 -2.73 114.28 108.60 3fef n THR 114 Ca 0.04 0.03 0.00 0.00 -2.04 0.00 0.00 64.05 62.08 3fef n THR 114 Cb 0.24 -0.53 0.00 0.00 -1.82 0.00 0.00 70.33 68.22 3fef n THR 114 CO 0.00 0.00 0.00 1.33 -0.64 0.00 0.00 175.07 175.76 3fef n VAL 115 N -2.67 0.00 -1.92 12.58 0.24 -1.26 -4.58 118.33 120.72 3fef n VAL 115 Ca 0.00 0.00 0.06 0.00 -2.04 0.00 0.00 64.34 62.36 3fef n VAL 115 Cb 0.00 0.00 -0.01 0.00 -1.47 0.00 0.00 33.84 32.36 3fef n VAL 115 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3fef n GLY 116 N 3.12 -1.93 0.36 7.63 0.00 -1.26 -1.43 105.19 111.68 3fef n GLY 116 Ca 0.00 -1.32 -0.03 0.00 0.00 0.00 0.00 46.02 44.67 3fef n GLY 116 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3fef h PRO 117 N 0.00 1.24 -0.51 1.61 0.11 -1.92 -1.54 132.00 130.98 3fef h PRO 117 Ca 0.01 -0.09 -0.08 0.00 0.11 0.00 0.00 66.00 65.95 3fef h PRO 117 Cb 0.39 -0.27 -0.02 0.00 0.11 0.00 0.00 31.00 31.21 3fef h PRO 117 CO 0.00 0.84 0.02 0.78 -0.21 0.00 0.00 178.00 179.43 3fef h GLY 118 N 1.27 0.96 1.00 -0.55 0.00 -1.74 -1.96 103.07 102.06 3fef h GLY 118 Ca 0.34 -0.70 0.00 0.00 0.00 0.00 0.00 47.33 46.97 3fef h GLY 118 CO -0.07 0.64 0.33 -1.33 0.00 0.00 0.00 176.54 176.11 3fef h GLY 119 N 0.76 0.75 0.95 4.60 0.00 -0.84 -0.38 103.07 108.91 3fef h GLY 119 Ca 0.15 -0.30 -0.01 0.00 0.00 0.00 0.00 47.33 47.17 3fef h GLY 119 CO 0.02 0.29 0.14 -2.22 0.00 0.00 0.00 176.54 174.78 3fef h ILE 120 N 0.70 1.13 -0.31 2.60 1.08 -1.15 0.65 117.51 122.21 3fef h ILE 120 Ca 0.19 -0.35 -0.09 0.00 -0.39 0.00 0.00 64.86 64.22 3fef h ILE 120 Cb -0.04 0.87 -0.01 0.00 -3.07 0.00 0.00 36.82 34.57 3fef h ILE 120 CO -0.04 0.13 -0.16 0.40 -0.69 0.00 0.00 178.15 177.79 3fef h ILE 121 N 0.32 1.29 -0.74 -0.67 1.08 -1.28 -1.74 117.51 115.77 3fef h ILE 121 Ca 0.09 -1.27 -0.04 0.00 -0.39 0.00 0.00 64.86 63.26 3fef h ILE 121 Cb 0.08 1.45 -0.03 0.00 -3.07 0.00 0.00 36.82 35.24 3fef h ILE 121 CO -0.01 0.41 0.32 -0.09 -0.69 0.00 0.00 178.15 178.09 3fef h ARG 122 N 0.43 1.08 -0.12 2.37 2.43 -0.94 -1.45 114.38 118.18 3fef h ARG 122 Ca 0.07 -0.18 0.05 0.00 -0.81 0.00 0.00 59.98 59.10 3fef h ARG 122 Cb 0.69 -0.18 -0.06 0.00 -0.42 0.00 0.00 29.97 30.00 3fef h ARG 122 CO 0.05 0.87 -0.23 0.78 -1.51 0.00 0.00 179.97 179.92 3fef h GLY 123 N 1.04 -0.24 0.16 2.80 0.00 -0.73 0.11 103.07 106.21 3fef h GLY 123 Ca 0.25 0.28 0.09 0.00 0.00 0.00 0.00 47.33 47.95 3fef h GLY 123 CO -0.03 -0.20 -0.07 1.41 0.00 0.00 0.00 176.54 177.66 3fef h LEU 124 N -0.30 -0.33 -0.94 3.11 -0.00 -0.80 0.20 115.31 116.25 3fef h LEU 124 Ca 0.10 0.12 0.13 0.00 -0.00 0.00 0.00 57.88 58.23 3fef h LEU 124 Cb 0.45 0.24 -0.09 0.00 -0.00 0.00 0.00 40.66 41.26 3fef h LEU 124 CO -0.29 -0.12 0.56 -0.09 -0.00 0.00 0.00 178.44 178.50 3fef h ARG 125 N 0.04 0.83 0.00 1.13 2.43 -0.93 -3.04 114.38 114.85 3fef h ARG 125 Ca 0.22 -0.05 -0.00 0.00 -0.81 0.00 0.00 59.98 59.34 3fef h ARG 125 Cb 0.33 -0.19 -0.00 0.00 -0.42 0.00 0.00 29.97 29.69 3fef h ARG 125 CO -0.43 0.55 -0.08 0.00 -1.51 0.00 0.00 179.97 178.51 3fef h ALA 126 N 1.53 0.96 0.21 2.80 0.00 0.14 -3.38 119.26 121.52 3fef h ALA 126 Ca 0.48 -0.01 0.01 0.00 0.00 0.00 0.00 54.91 55.39 3fef h ALA 126 Cb 0.53 -0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.28 3fef h ALA 126 CO -0.29 0.02 -0.44 0.28 0.00 0.00 0.00 179.25 178.81 3fef h VAL 127 N 0.00 0.12 -0.22 0.00 2.07 -1.07 -1.04 116.25 116.11 3fef h VAL 127 Ca -0.00 0.00 -0.03 0.00 0.82 0.00 0.00 66.70 67.49 3fef h VAL 127 Cb 1.01 0.12 -0.01 0.00 -1.52 0.00 0.00 31.29 30.89 3fef h VAL 127 CO 0.00 0.00 -0.01 1.55 0.02 0.00 0.00 177.57 179.13 3fef h PRO 128 N -0.74 0.33 -0.59 1.57 0.13 -1.76 -0.03 132.00 130.91 3fef h PRO 128 Ca -0.00 -0.06 -0.05 0.00 -0.87 0.00 0.00 66.00 65.03 3fef h PRO 128 Cb 0.73 -0.06 -0.02 0.00 0.13 0.00 0.00 31.00 31.78 3fef h PRO 128 CO -0.20 0.37 0.19 0.82 -0.23 0.00 0.00 178.00 178.94 3fef h ILE 129 N 0.32 1.24 0.01 -3.56 2.04 -1.69 -2.09 117.51 113.78 3fef h ILE 129 Ca 0.07 -0.81 -0.19 0.00 1.00 0.00 0.00 64.86 64.93 3fef h ILE 129 Cb 0.24 0.66 -0.02 0.00 -0.74 0.00 0.00 36.82 36.96 3fef h ILE 129 CO 0.01 0.31 -0.88 -0.26 0.00 0.00 0.00 178.15 177.32 3fef h PHE 130 N 0.83 0.13 -0.68 1.37 0.04 -0.56 -2.41 116.94 115.66 3fef h PHE 130 Ca 0.19 -0.07 0.01 0.00 2.80 0.00 0.00 57.97 60.90 3fef h PHE 130 Cb 0.28 -0.01 -0.04 0.00 2.20 0.00 0.00 35.95 38.38 3fef h PHE 130 CO 0.02 0.92 0.45 0.00 -0.60 0.00 0.00 178.31 179.09 3fef h ALA 131 N 1.06 0.87 -0.29 2.45 0.00 -0.94 0.22 119.26 122.63 3fef h ALA 131 Ca -0.03 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.82 3fef h ALA 131 Cb 1.53 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 19.04 3fef h ALA 131 CO 0.12 0.27 0.09 1.49 0.00 0.00 0.00 179.25 181.23 3fef h GLU 132 N 0.90 0.45 -0.85 0.00 4.81 -1.35 -1.32 114.58 117.22 3fef h GLU 132 Ca 0.25 -0.10 -0.02 0.00 -0.13 0.00 0.00 59.36 59.37 3fef h GLU 132 Cb -0.08 -0.07 -0.04 0.00 0.63 0.00 0.00 28.75 29.19 3fef h GLU 132 CO -0.06 0.50 0.47 0.82 -0.73 0.00 0.00 179.01 180.01 3fef h ILE 133 N 0.32 1.25 -0.91 2.32 2.04 -1.08 -2.18 117.51 119.27 3fef h ILE 133 Ca 0.09 -0.60 -0.02 0.00 1.00 0.00 0.00 64.86 65.33 3fef h ILE 133 Cb 0.24 0.09 -0.04 0.00 -0.74 0.00 0.00 36.82 36.36 3fef h ILE 133 CO -0.00 0.27 0.51 0.00 0.00 0.00 0.00 178.15 178.93 3fef h ALA 134 N 1.33 1.17 -0.51 1.87 0.00 -0.28 -1.26 119.26 121.58 3fef h ALA 134 Ca 0.30 -0.13 -0.08 0.00 0.00 0.00 0.00 54.91 55.00 3fef h ALA 134 Cb 0.02 -0.37 -0.02 0.00 0.00 0.00 0.00 17.79 17.42 3fef h ALA 134 CO -0.05 0.67 -0.00 0.00 0.00 0.00 0.00 179.25 179.87 3fef h ARG 135 N 1.28 0.89 -0.41 0.00 3.08 -0.95 -1.81 114.38 116.46 3fef h ARG 135 Ca 0.32 -0.29 -0.02 0.00 0.07 0.00 0.00 59.98 60.07 3fef h ARG 135 Cb 0.01 -0.08 -0.02 0.00 0.08 0.00 0.00 29.97 29.97 3fef h ARG 135 CO -0.05 0.92 0.18 0.00 -1.07 0.00 0.00 179.97 179.95 3fef h ALA 136 N 0.94 0.53 -0.81 0.04 0.00 -1.07 0.65 119.26 119.54 3fef h ALA 136 Ca 0.14 -0.13 -0.03 0.00 0.00 0.00 0.00 54.91 54.89 3fef h ALA 136 Cb 0.52 -0.16 -0.04 0.00 0.00 0.00 0.00 17.79 18.11 3fef h ALA 136 CO 0.03 0.12 0.39 0.82 0.00 0.00 0.00 179.25 180.60 3fef h ILE 137 N 0.52 1.25 -0.47 0.00 2.04 -1.20 0.47 117.51 120.11 3fef h ILE 137 Ca 0.14 -0.72 -0.02 0.00 1.00 0.00 0.00 64.86 65.27 3fef h ILE 137 Cb 0.17 0.23 -0.02 0.00 -0.74 0.00 0.00 36.82 36.45 3fef h ILE 137 CO -0.01 0.30 0.23 -0.09 0.00 0.00 0.00 178.15 178.58 3fef h ARG 138 N 1.15 0.67 0.03 2.37 2.43 -0.90 0.14 114.38 120.27 3fef h ARG 138 Ca 0.28 -0.10 -0.22 0.00 -0.81 0.00 0.00 59.98 59.13 3fef h ARG 138 Cb 0.12 -0.12 -0.01 0.00 -0.42 0.00 0.00 29.97 29.54 3fef h ARG 138 CO -0.03 0.57 -0.97 -0.44 -1.51 0.00 0.00 179.97 177.58 3fef h ASP 139 N 0.61 0.34 0.00 -3.80 3.32 -0.26 -3.36 116.42 113.28 3fef h ASP 139 Ca 0.16 -0.30 0.00 0.00 0.02 0.00 0.00 57.03 56.91 3fef h ASP 139 Cb 0.12 -0.11 0.00 0.00 0.22 0.00 0.00 39.33 39.56 3fef h ASP 139 CO -0.02 1.13 -0.88 -1.22 -1.72 0.00 0.00 179.24 176.53 3fef n TYR 140 N -3.64 0.00 -2.69 4.55 4.01 0.16 -4.84 117.16 114.71 3fef n TYR 140 Ca -0.05 0.00 -0.06 0.00 -0.16 0.00 0.00 57.90 57.63 3fef n TYR 140 Cb 0.86 -0.09 0.11 0.00 -0.31 0.00 0.00 39.34 39.91 3fef n TYR 140 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 3fef n ALA 141 N -1.49 1.84 0.24 -0.72 0.00 0.32 -4.17 120.51 116.53 3fef n ALA 141 Ca -0.00 -1.55 0.16 0.00 0.00 0.00 0.00 53.44 52.05 3fef n ALA 141 Cb 0.13 -0.96 0.86 0.00 0.00 0.00 0.00 19.45 19.48 3fef n ALA 141 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 3fef h PRO 142 N 2.01 0.00 -0.05 0.00 0.13 -1.26 -1.41 132.00 131.42 3fef h PRO 142 Ca -0.28 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.85 3fef h PRO 142 Cb 1.28 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.41 3fef h PRO 142 CO 0.00 0.00 0.00 0.39 -0.23 0.00 0.00 178.00 178.16 3fef n GLU 143 N -3.81 2.04 -2.09 0.86 -0.58 -1.26 -4.66 120.64 111.14 3fef n GLU 143 Ca -0.00 -1.52 -0.33 0.00 -0.42 0.00 0.00 57.16 54.89 3fef n GLU 143 Cb 0.24 -1.47 0.01 0.00 -0.57 0.00 0.00 31.44 29.65 3fef n GLU 143 CO 0.00 0.00 0.00 -1.54 -0.48 0.00 0.00 177.13 175.11 3fef s SER 144 N -1.95 5.82 0.08 1.62 1.04 -0.53 -5.02 113.70 114.76 3fef s SER 144 Ca 0.33 1.84 -0.22 0.00 0.48 0.00 0.00 55.95 58.38 3fef s SER 144 Cb 0.20 -2.54 -0.07 0.00 0.10 0.00 0.00 66.02 63.72 3fef s SER 144 CO 0.31 -1.14 0.65 0.26 0.98 0.00 0.00 173.24 174.30 3fef s TRP 145 N -2.38 3.80 -0.17 5.02 0.52 -0.69 -4.33 118.94 120.71 3fef s TRP 145 Ca 0.64 1.38 0.00 0.00 0.02 0.00 0.00 56.10 58.15 3fef s TRP 145 Cb -0.16 -2.63 0.01 0.00 -1.15 0.00 0.00 33.47 29.53 3fef s TRP 145 CO 0.35 0.49 -0.17 0.08 0.02 0.00 0.00 176.95 177.71 3fef s VAL 146 N -0.81 2.39 -0.27 4.03 1.01 0.42 -0.49 120.40 126.68 3fef s VAL 146 Ca 0.32 -0.85 -0.03 0.00 0.00 0.00 0.00 61.98 61.43 3fef s VAL 146 Cb -0.20 -2.01 0.03 0.00 0.00 0.00 0.00 36.38 34.20 3fef s VAL 146 CO 0.21 0.52 -0.02 -0.63 0.00 0.00 0.00 175.10 175.18 3fef s ILE 147 N 1.10 3.15 -0.11 2.22 1.01 0.23 -0.68 121.20 128.11 3fef s ILE 147 Ca 0.00 -1.02 -0.15 0.00 0.00 0.00 0.00 60.65 59.48 3fef s ILE 147 Cb -0.14 -2.64 -0.05 0.00 0.01 0.00 0.00 42.46 39.64 3fef s ILE 147 CO -0.06 0.11 0.37 0.21 0.00 0.00 0.00 174.94 175.57 3fef s ASN 148 N 1.35 6.59 0.00 3.58 2.47 0.23 -0.63 114.94 128.53 3fef s ASN 148 Ca -0.00 0.69 0.04 0.00 0.42 0.00 0.00 52.86 54.01 3fef s ASN 148 Cb -0.17 -2.23 -0.03 0.00 -1.45 0.00 0.00 41.25 37.37 3fef s ASN 148 CO -0.02 0.12 0.22 -1.22 -3.72 0.00 0.00 177.10 172.48 3fef n TYR 149 N 3.22 0.00 -2.63 0.43 4.01 0.36 -0.56 117.16 121.99 3fef n TYR 149 Ca -0.11 0.00 -0.38 0.00 -0.16 0.00 0.00 57.90 57.25 3fef n TYR 149 Cb 0.52 0.00 -0.05 0.00 -0.31 0.00 0.00 39.34 39.50 3fef n TYR 149 CO 0.00 0.00 0.00 0.99 -0.46 0.00 0.00 176.86 177.39 3fef s THR 150 N -1.22 3.86 0.09 -0.72 2.01 -1.22 -4.95 115.64 113.50 3fef s THR 150 Ca 0.02 1.63 0.03 0.00 0.31 0.00 0.00 61.69 63.68 3fef s THR 150 Cb 0.03 -3.94 -0.04 0.00 0.01 0.00 0.00 72.50 68.56 3fef s THR 150 CO 0.14 0.20 0.10 0.20 -0.69 0.00 0.00 174.62 174.57 3fef s ASN 151 N -1.36 5.58 1.07 3.53 0.01 -1.26 -4.85 114.94 117.66 3fef s ASN 151 Ca 0.50 -0.01 -0.10 0.00 -0.71 0.00 0.00 52.86 52.54 3fef s ASN 151 Cb -0.24 -1.51 0.14 0.00 0.41 0.00 0.00 41.25 40.05 3fef s ASN 151 CO 0.30 0.15 0.63 -0.81 -1.51 0.00 0.00 177.10 175.87 3fef n PRO 152 N 0.31 -1.47 0.00 -0.60 -0.04 -1.10 -4.75 135.00 127.35 3fef n PRO 152 Ca -0.08 -0.99 0.00 0.00 -0.04 0.00 0.00 63.50 62.39 3fef n PRO 152 Cb 0.52 -0.79 0.00 0.00 -0.04 0.00 0.00 33.50 33.19 3fef n PRO 152 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 3fef n SER 154 N -3.74 0.00 0.14 3.54 7.64 -1.26 -1.82 113.62 118.12 3fef n SER 154 Ca 0.08 0.00 -0.13 0.00 1.01 0.00 0.00 58.87 59.83 3fef n SER 154 Cb 0.31 0.00 -0.08 0.00 -1.01 0.00 0.00 64.21 63.42 3fef n SER 154 CO 0.00 0.00 0.00 0.58 -3.01 0.00 0.00 175.04 172.61 3fef h VAL 155 N 0.00 0.77 -0.33 0.44 2.07 -1.96 -1.79 116.25 115.44 3fef h VAL 155 Ca 0.00 -0.58 0.07 0.00 0.82 0.00 0.00 66.70 67.01 3fef h VAL 155 Cb 0.00 1.08 -0.08 0.00 -1.52 0.00 0.00 31.29 30.77 3fef h VAL 155 CO 0.00 0.12 -0.24 0.00 0.02 0.00 0.00 177.57 177.47 3fef h THR 157 N -0.20 1.26 -0.61 0.00 2.02 -1.81 -2.26 112.91 111.31 3fef h THR 157 Ca 0.17 -0.90 -0.05 0.00 0.77 0.00 0.00 66.41 66.39 3fef h THR 157 Cb 0.46 0.44 -0.03 0.00 -1.74 0.00 0.00 68.15 67.28 3fef h THR 157 CO -0.45 0.36 0.17 -0.09 0.37 0.00 0.00 175.52 175.88 3fef h ARG 158 N 1.10 0.94 -0.88 6.66 9.65 -0.64 -1.99 114.38 129.22 3fef h ARG 158 Ca 0.24 -0.19 0.01 0.00 -1.10 0.00 0.00 59.98 58.94 3fef h ARG 158 Cb 0.30 -0.14 -0.04 0.00 -1.39 0.00 0.00 29.97 28.69 3fef h ARG 158 CO -0.01 0.82 0.58 0.28 2.80 0.00 0.00 179.97 184.45 3fef h VAL 159 N 0.91 1.22 -0.26 0.20 2.07 -0.16 -0.61 116.25 119.62 3fef h VAL 159 Ca 0.20 -0.41 0.05 0.00 0.82 0.00 0.00 66.70 67.36 3fef h VAL 159 Cb 0.29 -0.07 -0.04 0.00 -1.52 0.00 0.00 31.29 29.94 3fef h VAL 159 CO -0.00 0.22 -0.02 -0.07 0.02 0.00 0.00 177.57 177.71 3fef h LEU 160 N 1.19 -0.15 -0.65 2.57 3.38 -0.84 -1.81 115.31 118.99 3fef h LEU 160 Ca 0.32 0.06 -0.14 0.00 0.09 0.00 0.00 57.88 58.22 3fef h LEU 160 Cb -0.13 0.12 -0.01 0.00 0.09 0.00 0.00 40.66 40.73 3fef h LEU 160 CO -0.07 -0.04 -0.42 1.88 0.09 0.00 0.00 178.44 179.87 3fef h TYR 161 N 0.05 0.68 -0.37 1.13 -1.99 -1.30 -0.42 116.97 114.75 3fef h TYR 161 Ca 0.12 -0.20 -0.06 0.00 2.00 0.00 0.00 58.73 60.59 3fef h TYR 161 Cb 0.17 -0.14 -0.02 0.00 2.00 0.00 0.00 36.73 38.74 3fef h TYR 161 CO -0.22 0.90 -0.04 0.87 -0.00 0.00 0.00 178.16 179.66 3fef h LYS 162 N 0.46 0.60 0.08 4.88 1.57 -0.81 -2.45 116.57 120.90 3fef h LYS 162 Ca 0.04 -0.15 -0.34 0.00 -1.87 0.00 0.00 60.65 58.33 3fef h LYS 162 Cb 0.93 -0.07 -0.03 0.00 0.08 0.00 0.00 32.23 33.14 3fef h LYS 162 CO 0.08 0.65 -1.86 0.28 -0.57 0.00 0.00 179.45 178.03 3fef h VAL 163 N 0.56 0.74 -2.79 0.50 2.07 -1.30 -3.41 116.25 112.61 3fef h VAL 163 Ca 0.11 -2.50 -0.61 0.00 0.82 0.00 0.00 66.70 64.53 3fef h VAL 163 Cb 0.43 2.49 -0.40 0.00 -1.52 0.00 0.00 31.29 32.29 3fef h VAL 163 CO 0.02 0.75 -0.75 0.12 0.02 0.00 0.00 177.57 177.72 3fef s PHE 164 N -2.58 2.37 0.48 1.57 5.36 -0.17 -4.90 117.98 120.10 3fef s PHE 164 Ca -0.15 -2.81 0.29 0.00 -0.96 0.00 0.00 56.93 53.30 3fef s PHE 164 Cb 0.07 -1.89 1.36 0.00 -0.34 0.00 0.00 43.02 42.22 3fef s PHE 164 CO 0.80 -0.69 1.79 -1.35 -1.46 0.00 0.00 175.22 174.30 3fef h PRO 165 N 5.71 0.16 -0.19 10.12 0.11 -1.66 0.17 132.00 146.42 3fef h PRO 165 Ca 0.17 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.27 3fef h PRO 165 Cb 0.84 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 31.92 3fef h PRO 165 CO 0.55 0.10 0.00 0.41 -0.21 0.00 0.00 178.00 178.85 3fef n GLY 166 N -1.64 0.42 3.75 -0.55 0.00 -1.26 -4.95 105.19 100.97 3fef n GLY 166 Ca 0.26 -0.44 -0.38 0.00 0.00 0.00 0.00 46.02 45.45 3fef n GLY 166 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 3fef s ILE 167 N -1.75 2.22 -0.71 -0.61 2.07 0.05 -4.96 121.20 117.50 3fef s ILE 167 Ca 0.32 0.16 -0.08 0.00 -1.41 0.00 0.00 60.65 59.64 3fef s ILE 167 Cb 0.18 -3.08 0.19 0.00 0.13 0.00 0.00 42.46 39.87 3fef s ILE 167 CO 0.26 -0.00 0.59 -0.54 -1.91 0.00 0.00 174.94 173.34 3fef s LYS 168 N -2.86 3.05 -0.01 3.50 1.02 -1.26 -5.01 119.74 118.17 3fef s LYS 168 Ca 0.70 -2.46 0.03 0.00 0.02 0.00 0.00 55.97 54.26 3fef s LYS 168 Cb -0.39 -4.07 -0.00 0.00 -0.52 0.00 0.00 37.83 32.84 3fef s LYS 168 CO 0.46 -1.23 -0.08 0.00 -0.92 0.00 0.00 175.35 173.58 3fef s ALA 169 N 0.12 0.72 0.14 5.17 0.00 -1.26 -0.44 121.76 126.21 3fef s ALA 169 Ca 0.17 -0.34 0.06 0.00 0.00 0.00 0.00 51.96 51.85 3fef s ALA 169 Cb -0.16 -0.21 -0.04 0.00 0.00 0.00 0.00 23.12 22.71 3fef s ALA 169 CO -0.06 0.16 -0.14 0.96 0.00 0.00 0.00 175.76 176.68 3fef s ILE 170 N -0.09 1.44 -0.18 0.00 -4.36 0.14 -4.87 121.20 113.28 3fef s ILE 170 Ca 0.02 -1.83 -0.06 0.00 -0.26 0.00 0.00 60.65 58.52 3fef s ILE 170 Cb -0.04 -1.66 -0.04 0.00 1.25 0.00 0.00 42.46 41.97 3fef s ILE 170 CO -0.00 -0.44 0.03 -0.83 0.24 0.00 0.00 174.94 173.93 3fef s GLY 171 N -2.63 1.83 -0.07 6.27 0.00 0.05 -0.60 107.32 112.17 3fef s GLY 171 Ca 0.12 -0.79 0.03 0.00 0.00 0.00 0.00 44.72 44.08 3fef s GLY 171 CO 0.04 0.04 -0.18 0.00 0.00 0.00 0.00 173.10 173.00 3fef n HIS 174 N 1.29 0.40 -0.22 0.00 1.44 -1.26 -4.62 115.22 112.25 3fef n HIS 174 Ca -0.22 -0.31 -0.08 0.00 -2.01 0.00 0.00 57.72 55.10 3fef n HIS 174 Cb 0.56 -0.01 0.03 0.00 0.12 0.00 0.00 29.99 30.69 3fef n HIS 174 CO 0.00 0.00 0.00 0.93 -2.81 0.00 0.00 176.34 174.46 3fef h GLU 175 N 2.86 1.00 -0.42 -1.40 4.39 -1.97 -2.51 114.58 116.52 3fef h GLU 175 Ca 0.00 -0.25 -0.02 0.00 0.34 0.00 0.00 59.36 59.43 3fef h GLU 175 Cb 0.75 -0.13 -0.02 0.00 -0.10 0.00 0.00 28.75 29.25 3fef h GLU 175 CO 0.00 0.92 0.16 0.28 -1.16 0.00 0.00 179.01 179.20 3fef h VAL 176 N 0.91 1.16 -0.95 3.13 2.07 -1.82 -2.26 116.25 118.50 3fef h VAL 176 Ca 0.19 -0.52 0.13 0.00 0.82 0.00 0.00 66.70 67.32 3fef h VAL 176 Cb 0.37 0.68 -0.09 0.00 -1.52 0.00 0.00 31.29 30.73 3fef h VAL 176 CO 0.00 0.20 0.57 -0.26 0.02 0.00 0.00 177.57 178.11 3fef h PHE 177 N 0.59 1.03 -0.92 1.57 0.04 -1.78 -1.06 116.94 116.42 3fef h PHE 177 Ca 0.14 0.03 0.11 0.00 2.80 0.00 0.00 57.97 61.06 3fef h PHE 177 Cb 0.14 -0.32 -0.07 0.00 2.20 0.00 0.00 35.95 37.90 3fef h PHE 177 CO 0.01 0.36 0.59 0.78 -0.60 0.00 0.00 178.31 179.45 3fef h GLY 178 N 0.87 1.37 1.82 -1.45 0.00 -1.49 0.75 103.07 104.95 3fef h GLY 178 Ca 0.49 -0.37 -0.21 0.00 0.00 0.00 0.00 47.33 47.24 3fef h GLY 178 CO -0.30 0.17 -0.97 -0.84 0.00 0.00 0.00 176.54 174.61 3fef h THR 179 N 0.88 1.56 -0.85 4.70 2.02 -1.29 -1.52 112.91 118.41 3fef h THR 179 Ca 0.44 -2.91 -0.03 0.00 0.77 0.00 0.00 66.41 64.68 3fef h THR 179 Cb 0.49 2.65 -0.04 0.00 -1.74 0.00 0.00 68.15 69.51 3fef h THR 179 CO -0.21 0.84 0.39 1.56 0.37 0.00 0.00 175.52 178.48 3fef h GLN 180 N 0.07 1.23 -0.66 6.66 4.20 -0.59 0.50 115.11 126.52 3fef h GLN 180 Ca -0.05 -0.19 -0.07 0.00 0.06 0.00 0.00 58.65 58.40 3fef h GLN 180 Cb 1.65 -0.22 -0.03 0.00 0.30 0.00 0.00 27.48 29.19 3fef h GLN 180 CO 0.14 0.95 0.13 0.87 -0.67 0.00 0.00 178.83 180.26 3fef h LYS 181 N 1.21 1.07 -0.32 1.46 1.57 -0.76 -0.38 116.57 120.42 3fef h LYS 181 Ca 0.29 -0.27 0.01 0.00 -1.87 0.00 0.00 60.65 58.81 3fef h LYS 181 Cb 0.14 -0.13 -0.02 0.00 0.08 0.00 0.00 32.23 32.30 3fef h LYS 181 CO -0.03 0.97 0.18 1.25 -0.57 0.00 0.00 179.45 181.25 3fef h LEU 182 N 0.99 0.29 -1.03 2.94 5.85 -0.88 -1.19 115.31 122.28 3fef h LEU 182 Ca 0.20 0.00 -0.08 0.00 0.84 0.00 0.00 57.88 58.84 3fef h LEU 182 Cb 0.40 -0.06 -0.01 0.00 0.37 0.00 0.00 40.66 41.36 3fef h LEU 182 CO 0.01 0.22 -0.19 -0.07 -0.34 0.00 0.00 178.44 178.06 3fef h LEU 183 N 0.38 0.46 -0.62 2.25 3.38 -0.55 -2.28 115.31 118.32 3fef h LEU 183 Ca 0.13 -0.14 -0.01 0.00 0.09 0.00 0.00 57.88 57.95 3fef h LEU 183 Cb 0.01 -0.12 -0.03 0.00 0.09 0.00 0.00 40.66 40.60 3fef h LEU 183 CO -0.06 0.67 0.34 0.00 0.09 0.00 0.00 178.44 179.48 3fef h ALA 184 N 1.37 0.80 0.00 1.53 0.00 -0.70 -0.97 119.26 121.29 3fef h ALA 184 Ca 0.07 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.88 3fef h ALA 184 Cb 0.58 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 18.12 3fef h ALA 184 CO 0.04 0.32 0.00 0.39 0.00 0.00 0.00 179.25 180.00 3fef n GLU 185 N -4.55 0.43 0.00 0.00 1.02 -0.48 -2.64 120.64 114.42 3fef n GLU 185 Ca 0.04 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.18 3fef n GLU 185 Cb 0.09 -1.28 0.00 0.00 -0.02 0.00 0.00 31.44 30.23 3fef n GLU 185 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 3fef n VAL 187 N 0.84 0.00 -0.14 2.62 0.31 -0.37 -0.31 118.33 121.28 3fef n VAL 187 Ca 0.00 0.00 -0.08 0.00 -0.01 0.00 0.00 64.34 64.25 3fef n VAL 187 Cb 0.22 0.00 -0.00 0.00 -0.91 0.00 0.00 33.84 33.14 3fef n VAL 187 CO 0.00 0.00 0.00 0.74 -1.32 0.00 0.00 176.83 176.25 3fef h THR 188 N 0.00 1.16 -0.10 2.52 2.02 -1.49 0.37 112.91 117.39 3fef h THR 188 Ca 0.00 -0.43 -0.20 0.00 0.77 0.00 0.00 66.41 66.56 3fef h THR 188 Cb 0.00 0.69 0.00 0.00 -1.74 0.00 0.00 68.15 67.10 3fef h THR 188 CO 0.00 0.17 -0.76 -0.08 0.37 0.00 0.00 175.52 175.22 3fef h GLU 189 N 0.53 0.52 0.01 6.66 4.81 -0.96 0.26 114.58 126.41 3fef h GLU 189 Ca 0.14 -0.43 -0.27 0.00 -0.13 0.00 0.00 59.36 58.67 3fef h GLU 189 Cb 0.07 0.09 -0.04 0.00 0.63 0.00 0.00 28.75 29.50 3fef h GLU 189 CO -0.02 1.06 -1.51 0.00 -0.73 0.00 0.00 179.01 177.81 3fef h ARG 190 N 0.35 0.01 0.00 1.92 2.47 -1.78 -3.40 114.38 113.96 3fef h ARG 190 Ca -0.04 -0.02 0.00 0.00 -1.26 0.00 0.00 59.98 58.66 3fef h ARG 190 Cb 1.35 0.01 0.00 0.00 -1.65 0.00 0.00 29.97 29.68 3fef h ARG 190 CO 0.14 0.67 -0.25 1.28 0.56 0.00 0.00 179.97 182.37 3fef n LEU 191 N -3.15 0.09 0.00 3.04 4.77 0.13 -5.00 117.00 116.87 3fef n LEU 191 Ca -0.12 -0.43 0.00 0.00 -0.03 0.00 0.00 56.01 55.43 3fef n LEU 191 Cb 1.02 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 42.11 3fef n LEU 191 CO 0.46 0.02 0.00 0.61 -1.33 0.00 0.00 177.39 177.15 3fef n GLY 192 N 1.25 2.97 3.77 -0.72 0.00 0.92 -4.98 105.19 108.40 3fef n GLY 192 Ca 0.00 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.63 3fef n GLY 192 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3fef s ILE 193 N -1.62 4.42 0.63 -0.61 -4.36 -1.26 -4.89 121.20 113.51 3fef s ILE 193 Ca 0.00 1.70 -0.14 0.00 -0.26 0.00 0.00 60.65 61.96 3fef s ILE 193 Cb 0.00 -4.14 -0.02 0.00 1.25 0.00 0.00 42.46 39.55 3fef s ILE 193 CO 0.00 0.50 1.05 -1.61 0.24 0.00 0.00 174.94 175.12 3fef s GLU 194 N -0.96 3.22 -0.15 0.37 0.41 -1.26 -3.27 118.70 117.05 3fef s GLU 194 Ca 0.36 1.08 -0.00 0.00 -0.41 0.00 0.00 54.97 56.00 3fef s GLU 194 Cb -0.23 -2.02 0.04 0.00 -1.78 0.00 0.00 34.13 30.13 3fef s GLU 194 CO 0.26 -0.88 -0.06 0.08 -0.49 0.00 0.00 175.26 174.16 3fef s VAL 195 N -2.71 1.10 0.19 2.63 1.01 -1.26 -4.98 120.40 116.38 3fef s VAL 195 Ca 0.61 -0.53 -0.11 0.00 0.00 0.00 0.00 61.98 61.94 3fef s VAL 195 Cb -0.15 -1.22 0.11 0.00 0.00 0.00 0.00 36.38 35.12 3fef s VAL 195 CO 0.44 0.21 1.81 -0.65 0.00 0.00 0.00 175.10 176.91 3fef h PRO 196 N 8.13 0.63 -2.96 2.72 0.11 -2.00 -3.45 132.00 135.19 3fef h PRO 196 Ca -0.26 -0.04 -0.12 0.00 0.11 0.00 0.00 66.00 65.69 3fef h PRO 196 Cb 1.12 -0.14 -0.21 0.00 0.11 0.00 0.00 31.00 31.87 3fef h PRO 196 CO 0.41 0.42 -0.27 1.03 -0.21 0.00 0.00 178.00 179.38 3fef s ARG 197 N -6.12 0.61 0.56 1.05 0.52 -1.26 -5.02 118.95 109.28 3fef s ARG 197 Ca -0.13 0.01 0.25 0.00 -0.52 0.00 0.00 55.73 55.34 3fef s ARG 197 Cb 0.15 0.28 1.50 0.00 0.52 0.00 0.00 34.95 37.39 3fef s ARG 197 CO 0.75 -0.15 2.07 0.07 0.02 0.00 0.00 175.30 178.06 3fef h ARG 198 N 4.31 0.00 -0.97 3.54 -0.00 -1.90 0.41 114.38 119.78 3fef h ARG 198 Ca -0.29 0.00 0.19 0.00 -0.00 0.00 0.00 59.98 59.89 3fef h ARG 198 Cb 1.18 0.00 -0.09 0.00 -0.00 0.00 0.00 29.97 31.06 3fef h ARG 198 CO 0.37 0.00 0.61 0.93 -0.00 0.00 0.00 179.97 181.88 3fef h GLU 199 N 0.00 0.61 0.00 0.08 3.07 -1.95 -0.66 114.58 115.73 3fef h GLU 199 Ca 0.12 -0.04 0.00 0.00 -0.50 0.00 0.00 59.36 58.95 3fef h GLU 199 Cb 0.57 -0.14 0.00 0.00 -0.84 0.00 0.00 28.75 28.34 3fef h GLU 199 CO -0.00 0.40 0.00 -0.25 -1.40 0.00 0.00 179.01 177.76 3fef n ASP 200 N -4.65 0.00 -4.51 1.42 8.00 0.14 -4.35 116.55 112.60 3fef n ASP 200 Ca 0.22 0.17 -0.43 0.00 0.71 0.00 0.00 54.79 55.46 3fef n ASP 200 Cb 0.62 -0.33 -0.05 0.00 -0.02 0.00 0.00 41.12 41.35 3fef n ASP 200 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 3fef s ILE 201 N -2.66 4.52 -0.41 0.53 -1.09 -0.26 -4.43 121.20 117.41 3fef s ILE 201 Ca 0.12 0.17 -0.15 0.00 -2.23 0.00 0.00 60.65 58.55 3fef s ILE 201 Cb 0.09 -4.46 0.02 0.00 -1.58 0.00 0.00 42.46 36.54 3fef s ILE 201 CO 0.22 -0.99 0.33 -0.13 -1.23 0.00 0.00 174.94 173.14 3fef s ARG 202 N 3.59 2.99 0.04 2.79 1.81 0.07 -4.93 118.95 125.31 3fef s ARG 202 Ca 0.28 -0.98 0.09 0.00 -1.72 0.00 0.00 55.73 53.39 3fef s ARG 202 Cb -0.14 -3.98 -0.03 0.00 -0.45 0.00 0.00 34.95 30.35 3fef s ARG 202 CO 0.19 -0.78 -0.25 0.14 -0.68 0.00 0.00 175.30 173.92 3fef s VAL 203 N 1.76 2.24 -0.59 3.52 -7.23 -1.26 -0.83 120.40 118.02 3fef s VAL 203 Ca 0.06 -1.35 -0.19 0.00 -1.81 0.00 0.00 61.98 58.70 3fef s VAL 203 Cb -0.19 -1.88 0.11 0.00 0.56 0.00 0.00 36.38 34.98 3fef s VAL 203 CO 0.11 0.37 0.68 0.21 -0.31 0.00 0.00 175.10 176.15 3fef s ASN 204 N -1.25 6.18 -0.05 4.85 2.47 0.80 -4.95 114.94 122.99 3fef s ASN 204 Ca 0.12 -1.48 0.00 0.00 0.42 0.00 0.00 52.86 51.92 3fef s ASN 204 Cb -0.10 -2.29 -0.03 0.00 -1.45 0.00 0.00 41.25 37.38 3fef s ASN 204 CO 0.02 -1.08 -0.02 0.54 -3.72 0.00 0.00 177.10 172.84 3fef s VAL 205 N 2.54 4.03 0.16 -5.21 0.11 -1.26 -2.25 120.40 118.53 3fef s VAL 205 Ca 0.10 -0.47 -0.22 0.00 -2.93 0.00 0.00 61.98 58.46 3fef s VAL 205 Cb -0.25 -2.72 0.06 0.00 -1.53 0.00 0.00 36.38 31.94 3fef s VAL 205 CO 0.06 0.51 0.57 -1.48 -3.33 0.00 0.00 175.10 171.43 3fef s LEU 206 N -1.12 -0.41 0.00 2.54 2.34 0.45 -3.88 118.68 118.59 3fef s LEU 206 Ca 0.15 -0.06 0.00 0.00 0.06 0.00 0.00 54.13 54.28 3fef s LEU 206 Cb -0.11 2.48 0.00 0.00 -0.56 0.00 0.00 46.19 48.00 3fef s LEU 206 CO 0.05 -0.96 0.00 0.61 -1.06 0.00 0.00 176.35 174.99 3fef n GLY 207 N -0.36 0.61 3.47 -3.48 0.00 -1.03 -0.21 105.19 104.19 3fef n GLY 207 Ca -0.17 -1.64 -0.23 0.00 0.00 0.00 0.00 46.02 43.98 3fef n GLY 207 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3fef s ILE 208 N -3.25 2.04 0.22 -0.61 -4.36 -1.07 0.03 121.20 114.19 3fef s ILE 208 Ca 0.00 -2.22 -0.32 0.00 -0.26 0.00 0.00 60.65 57.85 3fef s ILE 208 Cb 0.00 -2.46 -0.13 0.00 1.25 0.00 0.00 42.46 41.12 3fef s ILE 208 CO 0.00 -0.31 1.48 -3.20 0.24 0.00 0.00 174.94 173.15 3fef n ASN 209 N -0.65 2.96 0.00 4.36 5.15 -1.26 0.25 115.26 126.06 3fef n ASN 209 Ca -0.05 1.12 0.00 0.00 -0.60 0.00 0.00 54.58 55.05 3fef n ASN 209 Cb 0.62 -1.44 0.00 0.00 -0.53 0.00 0.00 39.78 38.43 3fef n ASN 209 CO 0.00 0.00 0.00 1.41 1.40 0.00 0.00 177.26 180.07 3fef n HIS 210 N 2.47 0.00 -2.88 1.20 8.25 -1.26 -4.80 115.22 118.20 3fef n HIS 210 Ca 0.13 0.00 -0.15 0.00 -0.26 0.00 0.00 57.72 57.44 3fef n HIS 210 Cb 0.31 -0.81 -0.00 0.00 1.12 0.00 0.00 29.99 30.60 3fef n HIS 210 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 3fef n PHE 211 N -2.01 1.12 -3.59 4.41 7.35 0.14 -4.24 117.46 120.64 3fef n PHE 211 Ca 0.00 -3.32 -0.31 0.00 -0.76 0.00 0.00 57.45 53.07 3fef n PHE 211 Cb 0.00 -0.38 -0.04 0.00 0.35 0.00 0.00 39.48 39.41 3fef n PHE 211 CO 0.00 0.00 0.00 0.95 -0.76 0.00 0.00 176.76 176.95 3fef s THR 212 N -3.11 5.12 0.05 -2.13 -4.23 -1.12 -2.61 115.64 107.61 3fef s THR 212 Ca 0.35 0.06 0.03 0.00 -1.18 0.00 0.00 61.69 60.95 3fef s THR 212 Cb 0.40 -3.65 -0.03 0.00 1.34 0.00 0.00 72.50 70.56 3fef s THR 212 CO -0.04 -0.05 -0.09 0.26 -0.54 0.00 0.00 174.62 174.16 3fef s TRP 213 N -1.76 0.81 -0.24 3.99 0.52 0.71 -0.29 118.94 122.67 3fef s TRP 213 Ca 0.42 -0.52 -0.01 0.00 0.02 0.00 0.00 56.10 56.01 3fef s TRP 213 Cb -0.12 -0.47 0.03 0.00 -1.15 0.00 0.00 33.47 31.76 3fef s TRP 213 CO 0.25 -0.05 -0.08 0.42 0.02 0.00 0.00 176.95 177.51 3fef s ILE 214 N -1.51 2.71 -0.37 2.03 1.01 0.00 -0.41 121.20 124.66 3fef s ILE 214 Ca -0.07 -1.07 0.22 0.00 0.00 0.00 0.00 60.65 59.73 3fef s ILE 214 Cb -0.09 -2.37 -0.30 0.00 0.01 0.00 0.00 42.46 39.71 3fef s ILE 214 CO 0.01 0.22 0.63 0.35 0.00 0.00 0.00 174.94 176.14 3fef n THR 215 N 4.64 0.00 -3.83 2.92 -2.24 -0.95 -1.39 114.28 113.43 3fef n THR 215 Ca -0.17 -0.33 -0.12 0.00 -2.27 0.00 0.00 64.05 61.17 3fef n THR 215 Cb 0.47 0.35 -0.12 0.00 -2.10 0.00 0.00 70.33 68.93 3fef n THR 215 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 3fef s LYS 216 N -3.34 0.29 -0.08 -0.78 1.02 -1.25 -5.00 119.74 110.60 3fef s LYS 216 Ca -0.02 0.05 -0.21 0.00 0.02 0.00 0.00 55.97 55.81 3fef s LYS 216 Cb 0.15 0.13 0.05 0.00 -0.52 0.00 0.00 37.83 37.64 3fef s LYS 216 CO 0.90 -0.05 0.48 0.00 -0.92 0.00 0.00 175.35 175.76 3fef s ALA 217 N -0.36 -1.23 0.10 5.17 0.00 -1.26 -0.14 121.76 124.04 3fef s ALA 217 Ca -0.04 0.97 -0.13 0.00 0.00 0.00 0.00 51.96 52.76 3fef s ALA 217 Cb -0.03 -0.23 0.02 0.00 0.00 0.00 0.00 23.12 22.88 3fef s ALA 217 CO 0.01 -0.29 0.31 -1.54 0.00 0.00 0.00 175.76 174.25 3fef s SER 218 N -0.79 -0.09 -0.24 0.00 1.04 -0.01 -1.40 113.70 112.22 3fef s SER 218 Ca -0.09 -0.42 0.01 0.00 0.48 0.00 0.00 55.95 55.94 3fef s SER 218 Cb -0.03 0.41 0.06 0.00 0.10 0.00 0.00 66.02 66.55 3fef s SER 218 CO 0.05 -0.77 -0.08 -0.47 0.98 0.00 0.00 173.24 172.95 3fef s TYR 219 N -3.63 2.68 0.00 5.02 5.04 -0.61 -0.75 117.35 125.09 3fef s TYR 219 Ca 0.02 -1.93 0.00 0.00 -2.44 0.00 0.00 57.07 52.73 3fef s TYR 219 Cb 0.03 -1.70 0.00 0.00 0.35 0.00 0.00 41.96 40.64 3fef s TYR 219 CO -0.10 -0.81 0.00 0.54 -1.34 0.00 0.00 175.55 173.84 3fef n ARG 220 N 4.60 0.00 0.00 4.97 5.12 -1.26 -1.18 116.66 128.90 3fef n ARG 220 Ca -0.13 0.00 0.15 0.00 -1.93 0.00 0.00 57.85 55.94 3fef n ARG 220 Cb 0.44 0.00 0.81 0.00 -1.16 0.00 0.00 32.46 32.55 3fef n ARG 220 CO 0.00 0.00 0.00 -2.39 -1.93 0.00 0.00 177.63 173.31 3fef n HIS 221 N 14.00 0.00 -3.56 -1.55 1.44 -1.26 -4.85 115.22 119.44 3fef n HIS 221 Ca 0.00 0.00 -0.37 0.00 -2.01 0.00 0.00 57.72 55.34 3fef n HIS 221 Cb 0.00 -0.04 -0.09 0.00 0.12 0.00 0.00 29.99 29.98 3fef n HIS 221 CO 0.00 0.00 0.00 0.42 -2.81 0.00 0.00 176.34 173.95 3fef s ILE 222 N -2.10 5.30 -0.16 0.61 1.01 -0.33 -5.05 121.20 120.48 3fef s ILE 222 Ca 0.42 0.37 -0.29 0.00 0.00 0.00 0.00 60.65 61.15 3fef s ILE 222 Cb 0.21 -3.58 -0.01 0.00 0.01 0.00 0.00 42.46 39.09 3fef s ILE 222 CO 0.38 0.31 1.18 -0.62 0.00 0.00 0.00 174.94 176.19 3fef s ASP 223 N 1.07 7.02 0.09 3.58 -1.08 -1.26 -1.58 116.67 124.50 3fef s ASP 223 Ca 0.12 1.62 0.25 0.00 -0.52 0.00 0.00 52.55 54.02 3fef s ASP 223 Cb -0.14 -2.54 0.60 0.00 -1.46 0.00 0.00 42.92 39.38 3fef s ASP 223 CO 0.06 -0.69 1.52 0.18 0.52 0.00 0.00 175.17 176.75 3fef n LEU 224 N 6.22 0.57 0.05 -1.34 4.77 -0.49 -4.25 117.00 122.53 3fef n LEU 224 Ca 0.13 0.28 -0.13 0.00 -0.03 0.00 0.00 56.01 56.26 3fef n LEU 224 Cb 0.46 -0.27 -0.08 0.00 -2.33 0.00 0.00 43.42 41.19 3fef n LEU 224 CO 0.55 -0.03 0.74 -0.07 -1.33 0.00 0.00 177.39 177.24 3fef h LEU 225 N 0.00 -0.08 -1.48 2.23 -0.00 -1.93 0.18 115.31 114.24 3fef h LEU 225 Ca 0.00 -0.19 -0.03 0.00 -0.00 0.00 0.00 57.88 57.66 3fef h LEU 225 Cb 0.65 0.02 -0.01 0.00 -0.00 0.00 0.00 40.66 41.32 3fef h LEU 225 CO 0.00 0.14 0.03 -0.65 -0.00 0.00 0.00 178.44 177.96 3fef h PRO 226 N -0.31 0.37 -0.14 1.13 0.11 -1.97 -1.19 132.00 130.00 3fef h PRO 226 Ca -0.01 -0.06 -0.06 0.00 0.11 0.00 0.00 66.00 65.99 3fef h PRO 226 Cb 0.27 -0.06 -0.00 0.00 0.11 0.00 0.00 31.00 31.31 3fef h PRO 226 CO 0.02 0.37 -0.14 0.82 -0.21 0.00 0.00 178.00 178.87 3fef h ILE 227 N 0.36 1.35 -0.81 4.15 2.04 -1.66 -2.77 117.51 120.16 3fef h ILE 227 Ca 0.09 -1.29 0.08 0.00 1.00 0.00 0.00 64.86 64.73 3fef h ILE 227 Cb 0.20 1.88 -0.05 0.00 -0.74 0.00 0.00 36.82 38.11 3fef h ILE 227 CO 0.00 0.38 0.53 0.15 0.00 0.00 0.00 178.15 179.21 3fef h PHE 228 N -0.04 0.86 -0.61 1.37 3.04 -0.36 -0.12 116.94 121.08 3fef h PHE 228 Ca 0.02 0.02 0.07 0.00 3.98 0.00 0.00 57.97 62.07 3fef h PHE 228 Cb 0.66 -0.28 -0.06 0.00 2.56 0.00 0.00 35.95 38.83 3fef h PHE 228 CO 0.08 0.43 0.29 -0.09 -2.02 0.00 0.00 178.31 177.00 3fef h ARG 229 N 0.83 0.51 -0.13 1.11 2.43 -1.03 0.54 114.38 118.64 3fef h ARG 229 Ca 0.36 -0.03 -0.04 0.00 -0.81 0.00 0.00 59.98 59.46 3fef h ARG 229 Cb 0.32 -0.12 -0.00 0.00 -0.42 0.00 0.00 29.97 29.75 3fef h ARG 229 CO -0.13 0.34 -0.06 0.93 -1.51 0.00 0.00 179.97 179.53 3fef h GLU 230 N 0.53 0.27 -0.71 0.20 5.08 -1.01 -1.31 114.58 117.62 3fef h GLU 230 Ca 0.29 -0.12 0.10 0.00 -1.00 0.00 0.00 59.36 58.64 3fef h GLU 230 Cb 0.27 -0.01 -0.08 0.00 0.50 0.00 0.00 28.75 29.44 3fef h GLU 230 CO -0.23 0.61 0.34 0.35 -1.00 0.00 0.00 179.01 179.07 3fef h PHE 231 N -0.08 0.60 -0.31 4.33 3.57 -0.69 -0.13 116.94 124.23 3fef h PHE 231 Ca 0.03 0.03 -0.06 0.00 3.53 0.00 0.00 57.97 61.49 3fef h PHE 231 Cb 0.53 -0.16 -0.01 0.00 2.79 0.00 0.00 35.95 39.10 3fef h PHE 231 CO 0.07 0.19 -0.06 1.03 -2.23 0.00 0.00 178.31 177.31 3fef h SER 232 N 0.56 0.59 -0.81 0.41 0.87 0.16 -1.63 113.55 113.70 3fef h SER 232 Ca 0.36 -0.35 -0.03 0.00 -1.23 0.00 0.00 61.79 60.54 3fef h SER 232 Cb 0.42 -0.16 -0.04 0.00 -0.44 0.00 0.00 62.40 62.19 3fef h SER 232 CO -0.30 0.80 0.38 0.00 -0.53 0.00 0.00 176.83 177.18 3fef h ALA 233 N 0.80 1.05 -0.09 6.23 0.00 -0.72 -0.67 119.26 125.87 3fef h ALA 233 Ca 0.08 -0.16 -0.24 0.00 0.00 0.00 0.00 54.91 54.59 3fef h ALA 233 Cb 0.53 -0.32 0.01 0.00 0.00 0.00 0.00 17.79 18.02 3fef h ALA 233 CO 0.03 0.62 -0.89 1.25 0.00 0.00 0.00 179.25 180.26 3fef h HIS 234 N 1.15 1.04 -0.35 0.00 6.17 -0.91 -3.35 115.15 118.91 3fef h HIS 234 Ca 0.28 -0.50 0.00 0.00 0.71 0.00 0.00 60.37 60.85 3fef h HIS 234 Cb 0.13 -0.14 0.00 0.00 2.52 0.00 0.00 27.41 29.92 3fef h HIS 234 CO 0.01 1.34 0.00 0.66 0.71 0.00 0.00 177.93 180.65 3fef n TYR 235 N -3.89 0.46 -0.20 5.26 4.01 -0.62 -4.70 117.16 117.47 3fef n TYR 235 Ca -0.09 -0.37 0.01 0.00 -0.16 0.00 0.00 57.90 57.29 3fef n TYR 235 Cb 0.80 -0.01 0.11 0.00 -0.31 0.00 0.00 39.34 39.93 3fef n TYR 235 CO 0.00 0.00 0.00 0.78 -0.46 0.00 0.00 176.86 177.18 3fef h GLY 236 N 2.74 0.74 0.20 2.72 0.00 -1.26 0.41 103.07 108.62 3fef h GLY 236 Ca 0.00 0.01 -0.03 0.00 0.00 0.00 0.00 47.33 47.31 3fef h GLY 236 CO 0.00 -0.15 -0.12 0.83 0.00 0.00 0.00 176.54 177.10 3fef h GLU 237 N 0.21 0.06 0.00 4.80 4.39 -1.86 -3.34 114.58 118.84 3fef h GLU 237 Ca 0.32 -0.08 -0.10 0.00 0.34 0.00 0.00 59.36 59.84 3fef h GLU 237 Cb 0.50 0.03 -0.01 0.00 -0.10 0.00 0.00 28.75 29.16 3fef h GLU 237 CO -0.45 0.96 -0.49 0.66 -1.16 0.00 0.00 179.01 178.53 3fef h SER 238 N -0.80 0.00 -4.26 1.42 4.64 -1.85 -3.50 113.55 109.20 3fef h SER 238 Ca -0.02 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.30 3fef h SER 238 Cb 1.01 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.10 3fef h SER 238 CO 0.02 0.49 0.00 0.61 -0.87 0.00 0.00 176.83 177.09 3fef n GLY 239 N 0.34 -1.04 2.86 -0.77 0.00 0.14 -4.98 105.19 101.74 3fef n GLY 239 Ca -0.00 -1.64 -0.19 0.00 0.00 0.00 0.00 46.02 44.19 3fef n GLY 239 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 3fef s TYR 240 N -1.76 0.56 -0.08 1.61 5.04 0.19 -4.79 117.35 118.12 3fef s TYR 240 Ca 0.00 -0.12 -0.00 0.00 -2.44 0.00 0.00 57.07 54.51 3fef s TYR 240 Cb 0.00 -0.56 -0.03 0.00 0.35 0.00 0.00 41.96 41.72 3fef s TYR 240 CO 0.00 -0.17 -0.05 -1.21 -1.34 0.00 0.00 175.55 172.78 3fef s GLU 241 N 0.98 2.93 0.51 4.97 2.02 -1.26 -4.20 118.70 124.64 3fef s GLU 241 Ca -0.10 -0.52 -0.23 0.00 0.02 0.00 0.00 54.97 54.14 3fef s GLU 241 Cb -0.14 -2.68 -0.06 0.00 0.10 0.00 0.00 34.13 31.35 3fef s GLU 241 CO -0.01 0.61 1.40 -0.51 0.02 0.00 0.00 175.26 176.77 3fef s LEU 242 N -0.66 3.96 0.22 1.80 1.43 -1.26 -4.84 118.68 119.33 3fef s LEU 242 Ca 0.10 2.85 -0.31 0.00 -1.03 0.00 0.00 54.13 55.75 3fef s LEU 242 Cb -0.12 -4.13 -0.15 0.00 0.03 0.00 0.00 46.19 41.83 3fef s LEU 242 CO 0.02 -1.43 1.06 1.21 0.23 0.00 0.00 176.35 177.44 3fef n GLU 243 N -0.69 1.17 -1.69 1.70 0.00 -1.26 -0.47 120.64 119.40 3fef n GLU 243 Ca 0.08 0.41 -0.16 0.00 0.00 0.00 0.00 57.16 57.49 3fef n GLU 243 Cb 0.43 -1.83 -0.05 0.00 0.00 0.00 0.00 31.44 29.99 3fef n GLU 243 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 3fef n GLY 244 N 1.70 1.12 3.24 8.31 0.00 -1.26 -4.99 105.19 113.31 3fef n GLY 244 Ca 0.13 -0.24 -0.16 0.00 0.00 0.00 0.00 46.02 45.75 3fef n GLY 244 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3fef s GLU 245 N -3.74 1.02 -0.04 1.61 2.02 0.38 -5.15 118.70 114.81 3fef s GLU 245 Ca 0.00 -1.31 0.02 0.00 0.02 0.00 0.00 54.97 53.70 3fef s GLU 245 Cb 0.00 -0.77 0.01 0.00 0.10 0.00 0.00 34.13 33.47 3fef s GLU 245 CO 0.00 0.13 -0.07 0.00 0.02 0.00 0.00 175.26 175.34 3fef h TRP 247 N 6.84 0.00 0.00 0.00 5.08 -1.92 0.21 115.95 126.16 3fef h TRP 247 Ca -0.36 0.00 0.00 0.00 1.08 0.00 0.00 58.89 59.61 3fef h TRP 247 Cb 1.16 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 27.32 3fef h TRP 247 CO 0.48 0.00 0.00 0.54 -1.28 0.00 0.00 178.44 178.18 3fef n ARG 248 N -3.60 0.78 -0.06 0.12 1.74 -1.26 -4.12 116.66 110.27 3fef n ARG 248 Ca -0.00 0.01 -0.00 0.00 -0.77 0.00 0.00 57.85 57.08 3fef n ARG 248 Cb 0.27 -1.50 0.28 0.00 -1.02 0.00 0.00 32.46 30.48 3fef n ARG 248 CO 0.00 0.00 0.00 -0.44 -1.52 0.00 0.00 177.63 175.67 3fef h ASP 249 N 0.00 0.61 -5.04 0.55 3.32 -0.96 -3.46 116.42 111.44 3fef h ASP 249 Ca 0.00 -0.09 0.08 0.00 0.02 0.00 0.00 57.03 57.04 3fef h ASP 249 Cb 0.03 -0.16 -0.06 0.00 0.22 0.00 0.00 39.33 39.36 3fef h ASP 249 CO 0.00 0.60 0.27 -0.94 -1.72 0.00 0.00 179.24 177.45 3fef s SER 250 N -6.65 -0.27 0.42 6.45 1.04 -1.26 -5.02 113.70 108.41 3fef s SER 250 Ca -0.09 -0.53 0.29 0.00 0.48 0.00 0.00 55.95 56.11 3fef s SER 250 Cb 0.16 0.68 1.27 0.00 0.10 0.00 0.00 66.02 68.23 3fef s SER 250 CO 0.77 -1.25 1.87 -0.37 0.98 0.00 0.00 173.24 175.25 3fef h VAL 251 N 2.00 0.00 -0.00 5.02 -1.51 -1.89 -2.04 116.25 117.83 3fef h VAL 251 Ca -0.21 -0.31 0.00 0.00 -1.23 0.00 0.00 66.70 64.95 3fef h VAL 251 Cb 1.25 1.16 0.00 0.00 -2.13 0.00 0.00 31.29 31.57 3fef h VAL 251 CO 0.25 0.00 -0.16 0.49 -1.23 0.00 0.00 177.57 176.91 3fef n PHE 252 N -2.66 0.00 -3.44 5.19 3.72 -1.26 -4.35 117.46 114.66 3fef n PHE 252 Ca 0.01 0.00 -0.26 0.00 -0.05 0.00 0.00 57.45 57.14 3fef n PHE 252 Cb 0.23 -0.35 -0.02 0.00 -0.94 0.00 0.00 39.48 38.40 3fef n PHE 252 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3fef s SER 254 N -3.51 0.13 -0.12 0.00 1.04 -1.26 -4.30 113.70 105.68 3fef s SER 254 Ca 0.41 -1.06 0.15 0.00 0.48 0.00 0.00 55.95 55.93 3fef s SER 254 Cb -0.10 0.71 0.52 0.00 0.10 0.00 0.00 66.02 67.25 3fef s SER 254 CO 0.32 -1.39 1.44 0.00 0.98 0.00 0.00 173.24 174.59 3fef n ALA 255 N -0.48 2.86 -1.48 5.32 0.00 -0.73 -4.59 120.51 121.41 3fef n ALA 255 Ca -0.04 -1.85 -0.16 0.00 0.00 0.00 0.00 53.44 51.39 3fef n ALA 255 Cb 0.61 -0.72 -0.07 0.00 0.00 0.00 0.00 19.45 19.27 3fef n ALA 255 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 3fef n HIS 256 N 0.12 0.00 -0.11 0.00 -0.00 -1.26 -0.63 115.22 113.34 3fef n HIS 256 Ca 0.20 0.00 -0.03 0.00 -0.00 0.00 0.00 57.72 57.89 3fef n HIS 256 Cb 0.79 -2.97 0.21 0.00 -0.00 0.00 0.00 29.99 28.01 3fef n HIS 256 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 3fef h ARG 257 N 0.01 0.79 -0.25 -0.41 3.08 -1.89 -1.12 114.38 114.60 3fef h ARG 257 Ca -0.34 -0.16 -0.04 0.00 0.07 0.00 0.00 59.98 59.51 3fef h ARG 257 Cb 1.16 -0.12 -0.01 0.00 0.08 0.00 0.00 29.97 31.08 3fef h ARG 257 CO 0.49 0.72 -0.01 0.28 -1.07 0.00 0.00 179.97 180.39 3fef h VAL 258 N 0.76 1.26 -0.69 2.04 2.07 -1.90 0.24 116.25 120.03 3fef h VAL 258 Ca 0.17 -0.92 0.01 0.00 0.82 0.00 0.00 66.70 66.78 3fef h VAL 258 Cb 0.30 1.38 -0.04 0.00 -1.52 0.00 0.00 31.29 31.41 3fef h VAL 258 CO 0.00 0.29 0.45 0.00 0.02 0.00 0.00 177.57 178.33 3fef h ALA 259 N 0.80 0.88 -0.71 1.67 0.00 -1.88 0.21 119.26 120.23 3fef h ALA 259 Ca 0.07 -0.04 -0.04 0.00 0.00 0.00 0.00 54.91 54.90 3fef h ALA 259 Cb 0.42 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 17.92 3fef h ALA 259 CO 0.01 0.28 0.30 0.74 0.00 0.00 0.00 179.25 180.58 3fef h PHE 260 N 0.91 1.07 -0.54 0.00 0.04 -1.06 0.81 116.94 118.17 3fef h PHE 260 Ca 0.26 -0.07 -0.04 0.00 2.80 0.00 0.00 57.97 60.91 3fef h PHE 260 Cb -0.08 -0.32 -0.02 0.00 2.20 0.00 0.00 35.95 37.72 3fef h PHE 260 CO -0.03 0.82 0.18 0.22 -0.60 0.00 0.00 178.31 178.90 3fef h ASP 261 N 1.01 0.78 -0.44 2.17 3.58 0.06 -1.90 116.42 121.69 3fef h ASP 261 Ca 0.24 -0.20 -0.09 0.00 0.42 0.00 0.00 57.03 57.40 3fef h ASP 261 Cb 0.19 -0.20 -0.02 0.00 1.72 0.00 0.00 39.33 41.02 3fef h ASP 261 CO -0.02 0.77 -0.06 -0.07 -2.88 0.00 0.00 179.24 176.98 3fef h LEU 262 N 0.75 0.86 -0.06 2.28 3.38 -0.33 -2.72 115.31 119.46 3fef h LEU 262 Ca 0.18 -0.25 -0.00 0.00 0.09 0.00 0.00 57.88 57.90 3fef h LEU 262 Cb 0.26 -0.23 -0.00 0.00 0.09 0.00 0.00 40.66 40.78 3fef h LEU 262 CO -0.01 0.96 0.04 0.15 0.09 0.00 0.00 178.44 179.67 3fef h PHE 263 N 0.80 0.08 -0.91 1.13 3.57 -0.64 -0.56 116.94 120.40 3fef h PHE 263 Ca 0.14 0.00 0.07 0.00 3.53 0.00 0.00 57.97 61.71 3fef h PHE 263 Cb 0.56 -0.03 -0.06 0.00 2.79 0.00 0.00 35.95 39.21 3fef h PHE 263 CO 0.03 0.08 0.59 0.93 -2.23 0.00 0.00 178.31 177.71 3fef h GLU 264 N 0.06 0.98 -0.11 1.11 4.39 -1.22 0.29 114.58 120.08 3fef h GLU 264 Ca 0.02 -0.06 -0.13 0.00 0.34 0.00 0.00 59.36 59.53 3fef h GLU 264 Cb 0.02 -0.22 0.01 0.00 -0.10 0.00 0.00 28.75 28.46 3fef h GLU 264 CO -0.00 0.65 -0.44 1.15 -1.16 0.00 0.00 179.01 179.20 3fef h THR 265 N 1.01 1.37 0.00 1.13 2.02 -1.25 -3.40 112.91 113.80 3fef h THR 265 Ca 0.40 -1.77 -0.17 0.00 0.77 0.00 0.00 66.41 65.64 3fef h THR 265 Cb 0.25 2.18 -0.03 0.00 -1.74 0.00 0.00 68.15 68.81 3fef h THR 265 CO -0.16 0.53 -1.83 -1.22 0.37 0.00 0.00 175.52 173.21 3fef n TYR 266 N -4.28 0.00 -0.72 3.16 4.01 -0.24 -5.03 117.16 114.06 3fef n TYR 266 Ca -0.08 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.66 3fef n TYR 266 Cb 0.57 -0.56 0.00 0.00 -0.31 0.00 0.00 39.34 39.04 3fef n TYR 266 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3fef n GLY 267 N 2.03 0.70 3.43 2.72 0.00 0.10 -4.83 105.19 109.34 3fef n GLY 267 Ca -0.16 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.61 3fef n GLY 267 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3fef s ALA 268 N -2.37 2.56 -0.32 4.61 0.00 -1.26 -5.00 121.76 119.98 3fef s ALA 268 Ca 0.00 -1.71 -0.25 0.00 0.00 0.00 0.00 51.96 50.00 3fef s ALA 268 Cb 0.00 -0.29 0.01 0.00 0.00 0.00 0.00 23.12 22.84 3fef s ALA 268 CO 0.00 0.36 0.87 0.42 0.00 0.00 0.00 175.76 177.41 3fef s ILE 269 N -2.00 4.70 0.31 0.00 1.01 -0.48 -4.20 121.20 120.54 3fef s ILE 269 Ca 0.24 1.28 -0.29 0.00 0.00 0.00 0.00 60.65 61.88 3fef s ILE 269 Cb -0.07 -4.23 -0.11 0.00 0.01 0.00 0.00 42.46 38.07 3fef s ILE 269 CO 0.11 -0.34 1.45 -2.84 0.00 0.00 0.00 174.94 173.31 3fef s PRO 270 N 3.17 4.22 -0.44 2.79 0.02 -1.26 -0.82 135.00 142.68 3fef s PRO 270 Ca 0.36 2.40 0.07 0.00 0.02 0.00 0.00 61.00 63.85 3fef s PRO 270 Cb -0.13 -3.05 0.41 0.00 0.02 0.00 0.00 34.50 31.75 3fef s PRO 270 CO 0.14 -0.43 1.04 0.00 -0.33 0.00 0.00 177.00 177.42 3fef n ALA 271 N 1.42 4.62 -2.85 -1.55 0.00 0.60 -4.87 120.51 117.88 3fef n ALA 271 Ca 0.04 -4.17 -0.10 0.00 0.00 0.00 0.00 53.44 49.21 3fef n ALA 271 Cb 0.40 -0.65 -0.06 0.00 0.00 0.00 0.00 19.45 19.14 3fef n ALA 271 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3fef s ALA 272 N -3.42 -0.48 0.53 0.00 0.00 -1.26 -3.86 121.76 113.27 3fef s ALA 272 Ca 0.45 -0.46 -0.21 0.00 0.00 0.00 0.00 51.96 51.73 3fef s ALA 272 Cb 0.39 0.71 -0.06 0.00 0.00 0.00 0.00 23.12 24.15 3fef s ALA 272 CO -0.14 -0.64 1.15 0.41 0.00 0.00 0.00 175.76 176.54 3fef n GLY 273 N -0.20 0.19 0.31 0.00 0.00 -1.26 -4.72 105.19 99.50 3fef n GLY 273 Ca -0.12 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.02 3fef n GLY 273 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3fef h ASP 274 N 1.17 0.14 -0.29 1.61 5.19 -1.96 -0.02 116.42 122.26 3fef h ASP 274 Ca -0.49 0.17 0.08 0.00 -0.62 0.00 0.00 57.03 56.18 3fef h ASP 274 Cb 1.33 0.20 -0.01 0.00 0.18 0.00 0.00 39.33 41.03 3fef h ASP 274 CO 0.55 -0.08 0.21 0.08 -3.12 0.00 0.00 179.24 176.88 3fef h ARG 275 N 0.29 0.00 0.13 3.56 0.11 -1.89 -1.47 114.38 115.10 3fef h ARG 275 Ca 0.54 0.00 -0.28 0.00 0.10 0.00 0.00 59.98 60.34 3fef h ARG 275 Cb 1.05 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.13 3fef h ARG 275 CO -0.59 0.00 -1.39 0.45 0.10 0.00 0.00 179.97 178.55 3fef h HIS 276 N 0.00 0.49 -0.83 4.08 3.86 -1.37 -3.38 115.15 118.00 3fef h HIS 276 Ca 0.14 -0.36 0.06 0.00 -1.16 0.00 0.00 60.37 59.05 3fef h HIS 276 Cb 0.55 -0.02 -0.06 0.00 1.06 0.00 0.00 27.41 28.94 3fef h HIS 276 CO 0.00 1.54 0.51 -0.07 0.86 0.00 0.00 177.93 180.77 3fef h LEU 277 N -0.26 0.79 -2.65 2.43 3.38 -0.98 -2.14 115.31 115.89 3fef h LEU 277 Ca -0.29 0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.70 3fef h LEU 277 Cb 1.79 -0.14 -0.00 0.00 0.09 0.00 0.00 40.66 42.39 3fef h LEU 277 CO 0.08 0.50 0.03 0.00 0.09 0.00 0.00 178.44 179.14 3fef h ALA 278 N 1.40 1.33 -0.00 1.53 0.00 -1.46 -1.57 119.26 120.49 3fef h ALA 278 Ca 0.37 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.27 3fef h ALA 278 Cb 0.18 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.97 3fef h ALA 278 CO -0.18 -0.04 -0.07 0.39 0.00 0.00 0.00 179.25 179.36 3fef n GLU 279 N -3.50 0.40 0.01 0.00 1.02 -0.80 -4.24 120.64 113.52 3fef n GLU 279 Ca -0.03 -0.07 0.08 0.00 -0.02 0.00 0.00 57.16 57.13 3fef n GLU 279 Cb 0.11 -1.50 -0.13 0.00 -0.02 0.00 0.00 31.44 29.90 3fef n GLU 279 CO 0.00 0.00 0.00 1.19 1.18 0.00 0.00 177.13 179.50 3fef n PHE 280 N -1.24 0.25 -4.11 -0.32 3.72 -0.59 -4.59 117.46 110.57 3fef n PHE 280 Ca 0.12 0.07 -0.08 0.00 -0.05 0.00 0.00 57.45 57.52 3fef n PHE 280 Cb 0.28 -0.67 -0.10 0.00 -0.94 0.00 0.00 39.48 38.04 3fef n PHE 280 CO 0.00 0.00 0.00 -0.48 -0.05 0.00 0.00 176.76 176.23 3fef s LEU 281 N -4.85 2.27 0.37 4.37 0.05 -1.26 -4.86 118.68 114.77 3fef s LEU 281 Ca -0.06 -1.07 -0.28 0.00 0.05 0.00 0.00 54.13 52.77 3fef s LEU 281 Cb 0.12 0.22 -0.10 0.00 -2.05 0.00 0.00 46.19 44.38 3fef s LEU 281 CO 0.87 -0.63 1.36 -2.84 -0.55 0.00 0.00 176.35 174.56 3fef s PRO 282 N -3.96 4.17 0.00 1.48 0.02 -1.26 -4.96 135.00 130.49 3fef s PRO 282 Ca 0.13 2.31 0.00 0.00 0.02 0.00 0.00 61.00 63.45 3fef s PRO 282 Cb 0.08 -2.95 0.00 0.00 0.02 0.00 0.00 34.50 31.65 3fef s PRO 282 CO -0.06 -0.38 0.00 0.41 -0.33 0.00 0.00 177.00 176.64 3fef n GLY 283 N 0.67 0.81 0.19 0.52 0.00 -1.26 -4.99 105.19 101.13 3fef n GLY 283 Ca 0.01 -0.89 0.04 0.00 0.00 0.00 0.00 46.02 45.18 3fef n GLY 283 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3fef n PRO 284 N -0.27 1.25 0.17 1.61 -0.04 -1.26 -4.42 135.00 132.03 3fef n PRO 284 Ca 0.00 -0.38 -0.14 0.00 -0.04 0.00 0.00 63.50 62.94 3fef n PRO 284 Cb 0.00 -1.15 -0.08 0.00 -0.04 0.00 0.00 33.50 32.23 3fef n PRO 284 CO 0.00 0.00 0.00 1.88 -0.04 0.00 0.00 175.50 177.34 3fef h TYR 285 N 0.65 -0.38 0.00 0.54 0.05 -1.93 -2.00 116.97 113.90 3fef h TYR 285 Ca 0.00 -0.01 -0.04 0.00 0.05 0.00 0.00 58.73 58.73 3fef h TYR 285 Cb 0.15 0.13 -0.01 0.00 1.01 0.00 0.00 36.73 38.01 3fef h TYR 285 CO 0.06 -0.11 -0.19 -0.07 -1.05 0.00 0.00 178.16 176.81 3fef h LEU 286 N -0.61 0.00 -0.56 3.88 3.38 -1.87 -2.34 115.31 117.18 3fef h LEU 286 Ca -0.04 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.93 3fef h LEU 286 Cb 0.44 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.19 3fef h LEU 286 CO 0.07 0.19 -0.68 0.29 0.09 0.00 0.00 178.44 178.40 3fef n LYS 287 N -3.79 0.84 -3.03 1.13 5.02 -1.20 -4.34 118.16 112.78 3fef n LYS 287 Ca -0.02 -0.56 -0.22 0.00 -2.02 0.00 0.00 58.31 55.50 3fef n LYS 287 Cb 0.29 -1.46 -0.03 0.00 -0.02 0.00 0.00 35.03 33.81 3fef n LYS 287 CO 0.00 0.00 0.00 1.04 -0.52 0.00 0.00 177.40 177.92 3fef n GLN 288 N -0.65 2.00 0.05 1.97 6.02 -0.76 -4.96 117.38 121.05 3fef n GLN 288 Ca 0.07 -4.02 0.01 0.00 -0.01 0.00 0.00 57.00 53.04 3fef n GLN 288 Cb 0.40 -1.92 0.33 0.00 1.02 0.00 0.00 30.24 30.07 3fef n GLN 288 CO 0.00 0.00 0.00 -1.00 -1.01 0.00 0.00 177.06 175.05 3fef h PRO 289 N 2.97 0.41 -0.28 -1.09 0.13 -1.65 -2.33 132.00 130.17 3fef h PRO 289 Ca 0.11 -0.09 -0.16 0.00 -0.87 0.00 0.00 66.00 64.99 3fef h PRO 289 Cb 0.79 -0.06 -0.01 0.00 0.13 0.00 0.00 31.00 31.85 3fef h PRO 289 CO 0.64 0.48 -0.46 1.05 -0.23 0.00 0.00 178.00 179.49 3fef h GLU 290 N 0.39 0.72 -0.26 0.86 9.09 -1.88 0.22 114.58 123.73 3fef h GLU 290 Ca 0.08 -0.41 -0.01 0.00 0.05 0.00 0.00 59.36 59.08 3fef h GLU 290 Cb 0.35 0.03 -0.01 0.00 -1.65 0.00 0.00 28.75 27.46 3fef h GLU 290 CO 0.02 1.03 0.14 0.28 0.05 0.00 0.00 179.01 180.52 3fef h VAL 291 N 0.58 1.09 -0.15 -1.06 2.07 -1.87 -2.47 116.25 114.43 3fef h VAL 291 Ca 0.04 -0.23 0.00 0.00 0.82 0.00 0.00 66.70 67.32 3fef h VAL 291 Cb 1.01 0.74 0.00 0.00 -1.52 0.00 0.00 31.29 31.53 3fef h VAL 291 CO 0.10 0.10 0.00 0.79 0.02 0.00 0.00 177.57 178.57 3fef n TRP 292 N -4.46 0.18 -3.73 1.57 7.02 -0.81 -4.97 117.44 112.24 3fef n TRP 292 Ca 0.01 -0.09 -0.22 0.00 -1.02 0.00 0.00 57.50 56.17 3fef n TRP 292 Cb 0.10 0.00 0.03 0.00 -2.42 0.00 0.00 31.31 29.02 3fef n TRP 292 CO 0.00 0.00 0.00 1.63 -2.02 0.00 0.00 177.69 177.30 3fef n LYS 293 N 0.93 -4.96 -4.14 -0.99 5.02 0.72 -4.29 118.16 110.45 3fef n LYS 293 Ca 0.17 0.61 -0.15 0.00 -2.02 0.00 0.00 58.31 56.92 3fef n LYS 293 Cb 0.49 -5.20 -0.06 0.00 -0.02 0.00 0.00 35.03 30.25 3fef n LYS 293 CO 0.00 0.00 0.00 -0.59 -0.52 0.00 0.00 177.40 176.29 3fef s PHE 294 N -3.64 1.17 0.22 2.13 -0.71 -0.87 -1.77 117.98 114.52 3fef s PHE 294 Ca 0.08 -1.34 0.10 0.00 -1.04 0.00 0.00 56.93 54.74 3fef s PHE 294 Cb -0.04 -0.27 -0.05 0.00 -1.21 0.00 0.00 43.02 41.46 3fef s PHE 294 CO 0.82 -0.99 -0.20 -1.01 -1.34 0.00 0.00 175.22 172.49 3fef s HIS 295 N -3.39 2.09 0.29 3.49 3.76 -1.26 -4.32 115.29 115.95 3fef s HIS 295 Ca 0.33 -0.41 -0.10 0.00 -0.15 0.00 0.00 55.06 54.74 3fef s HIS 295 Cb 0.01 -0.98 -0.07 0.00 1.11 0.00 0.00 32.58 32.65 3fef s HIS 295 CO 0.20 0.52 0.62 -0.51 -0.85 0.00 0.00 174.74 174.72 3fef s LEU 296 N -3.08 4.07 -0.43 0.89 1.43 -1.26 -4.77 118.68 115.53 3fef s LEU 296 Ca 0.23 0.99 -0.10 0.00 -1.03 0.00 0.00 54.13 54.22 3fef s LEU 296 Cb -0.05 -3.79 0.08 0.00 0.03 0.00 0.00 46.19 42.46 3fef s LEU 296 CO 0.11 -0.17 0.28 -0.89 0.23 0.00 0.00 176.35 175.90 3fef s THR 297 N -1.99 4.31 0.58 5.49 2.01 0.90 -4.96 115.64 121.97 3fef s THR 297 Ca 0.49 -1.42 -0.17 0.00 0.31 0.00 0.00 61.69 60.90 3fef s THR 297 Cb -0.11 -3.65 -0.04 0.00 0.01 0.00 0.00 72.50 68.71 3fef s THR 297 CO 0.24 -0.54 1.06 -2.16 -0.69 0.00 0.00 174.62 172.52 3fef s PRO 298 N 1.43 3.36 0.33 4.92 0.04 -1.26 -4.73 135.00 139.09 3fef s PRO 298 Ca 0.03 1.26 0.26 0.00 0.04 0.00 0.00 61.00 62.59 3fef s PRO 298 Cb -0.23 -2.04 1.13 0.00 0.04 0.00 0.00 34.50 33.40 3fef s PRO 298 CO 0.02 -0.78 1.77 0.82 0.04 0.00 0.00 177.00 178.87 3fef h ILE 299 N 0.63 0.00 -0.12 0.56 1.08 -1.97 -1.88 117.51 115.81 3fef h ILE 299 Ca -0.47 -0.23 -0.10 0.00 -0.39 0.00 0.00 64.86 63.67 3fef h ILE 299 Cb 1.22 0.97 -0.01 0.00 -3.07 0.00 0.00 36.82 35.93 3fef h ILE 299 CO 0.57 0.00 -0.38 0.77 -0.69 0.00 0.00 178.15 178.42 3fef h SER 300 N 0.00 0.26 -0.47 1.72 4.64 -1.98 -1.93 113.55 115.79 3fef h SER 300 Ca 0.00 -0.10 -0.12 0.00 -0.47 0.00 0.00 61.79 61.10 3fef h SER 300 Cb 0.31 -0.07 -0.01 0.00 -0.31 0.00 0.00 62.40 62.32 3fef h SER 300 CO 0.00 0.63 -0.17 0.15 -0.87 0.00 0.00 176.83 176.56 3fef h PHE 301 N 0.21 1.08 -0.49 4.77 3.57 -1.72 -1.65 116.94 122.73 3fef h PHE 301 Ca 0.02 -0.25 -0.06 0.00 3.53 0.00 0.00 57.97 61.21 3fef h PHE 301 Cb 0.78 -0.26 -0.02 0.00 2.79 0.00 0.00 35.95 39.24 3fef h PHE 301 CO 0.01 1.06 0.07 0.00 -2.23 0.00 0.00 178.31 177.22 3fef h ARG 302 N 0.80 0.77 -0.20 1.11 3.08 -1.53 0.50 114.38 118.92 3fef h ARG 302 Ca 0.11 -0.17 -0.06 0.00 0.07 0.00 0.00 59.98 59.93 3fef h ARG 302 Cb 0.74 -0.11 -0.00 0.00 0.08 0.00 0.00 29.97 30.68 3fef h ARG 302 CO 0.06 0.73 -0.13 0.87 -1.07 0.00 0.00 179.97 180.43 3fef h LYS 303 N 0.73 0.43 -0.65 0.04 1.57 -1.22 -1.10 116.57 116.37 3fef h LYS 303 Ca 0.15 -0.20 0.04 0.00 -1.87 0.00 0.00 60.65 58.77 3fef h LYS 303 Cb 0.35 -0.00 -0.04 0.00 0.08 0.00 0.00 32.23 32.61 3fef h LYS 303 CO 0.01 0.75 0.39 0.37 -0.57 0.00 0.00 179.45 180.40 3fef h GLN 304 N 0.11 0.74 -0.54 3.15 4.15 -1.17 -2.28 115.11 119.27 3fef h GLN 304 Ca 0.04 -0.04 -0.07 0.00 0.77 0.00 0.00 58.65 59.35 3fef h GLN 304 Cb 0.64 -0.17 -0.02 0.00 0.21 0.00 0.00 27.48 28.14 3fef h GLN 304 CO 0.04 0.49 0.06 0.22 -1.93 0.00 0.00 178.83 177.70 3fef h ASP 305 N 0.76 0.83 -0.27 -0.69 3.58 -0.70 -2.28 116.42 117.65 3fef h ASP 305 Ca 0.27 -0.19 -0.10 0.00 0.42 0.00 0.00 57.03 57.44 3fef h ASP 305 Cb 0.06 -0.22 -0.02 0.00 1.72 0.00 0.00 39.33 40.88 3fef h ASP 305 CO -0.12 0.86 -0.16 -0.09 -2.88 0.00 0.00 179.24 176.84 3fef h ARG 306 N 0.82 0.71 -0.51 0.28 2.43 -0.87 -2.32 114.38 114.92 3fef h ARG 306 Ca 0.17 -0.25 -0.06 0.00 -0.81 0.00 0.00 59.98 59.02 3fef h ARG 306 Cb 0.41 -0.05 -0.02 0.00 -0.42 0.00 0.00 29.97 29.89 3fef h ARG 306 CO 0.01 0.83 0.07 0.00 -1.51 0.00 0.00 179.97 179.38 3fef h ALA 307 N 1.18 0.68 -0.33 2.80 0.00 -0.86 -1.43 119.26 121.30 3fef h ALA 307 Ca 0.10 -0.24 -0.06 0.00 0.00 0.00 0.00 54.91 54.71 3fef h ALA 307 Cb 0.63 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.22 3fef h ALA 307 CO 0.04 0.42 -0.01 1.05 0.00 0.00 0.00 179.25 180.75 3fef h GLU 308 N 0.72 0.59 -0.70 0.00 4.11 -1.38 -1.84 114.58 116.09 3fef h GLU 308 Ca 0.15 -0.19 0.14 0.00 0.07 0.00 0.00 59.36 59.53 3fef h GLU 308 Cb 0.41 -0.05 -0.04 0.00 0.50 0.00 0.00 28.75 29.57 3fef h GLU 308 CO 0.01 0.73 0.47 0.87 0.07 0.00 0.00 179.01 181.16 3fef h LYS 309 N 0.39 0.32 -0.13 1.06 1.57 -1.25 0.35 116.57 118.89 3fef h LYS 309 Ca 0.09 -0.02 -0.15 0.00 -1.87 0.00 0.00 60.65 58.70 3fef h LYS 309 Cb 0.47 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.70 3fef h LYS 309 CO 0.02 0.21 -0.58 0.00 -0.57 0.00 0.00 179.45 178.54 3fef h ARG 310 N 0.33 0.40 -0.19 3.15 3.08 -0.76 0.68 114.38 121.07 3fef h ARG 310 Ca 0.34 -0.26 -0.14 0.00 0.07 0.00 0.00 59.98 59.99 3fef h ARG 310 Cb 0.85 0.03 0.00 0.00 0.08 0.00 0.00 29.97 30.94 3fef h ARG 310 CO -0.09 0.87 -0.41 1.96 -1.07 0.00 0.00 179.97 181.22 3fef h GLN 311 N 0.31 0.62 -0.31 0.04 4.20 -0.19 -2.40 115.11 117.37 3fef h GLN 311 Ca -0.00 -0.41 0.04 0.00 0.06 0.00 0.00 58.65 58.35 3fef h GLN 311 Cb 1.10 0.05 -0.04 0.00 0.30 0.00 0.00 27.48 28.89 3fef h GLN 311 CO 0.10 1.02 0.07 1.49 -0.67 0.00 0.00 178.83 180.84 3fef h GLU 312 N 0.29 0.17 -0.20 1.46 4.81 -0.34 -0.38 114.58 120.40 3fef h GLU 312 Ca 0.00 -0.01 0.02 0.00 -0.13 0.00 0.00 59.36 59.25 3fef h GLU 312 Cb 1.02 -0.04 -0.04 0.00 0.63 0.00 0.00 28.75 30.32 3fef h GLU 312 CO 0.09 0.12 -0.27 1.15 -0.73 0.00 0.00 179.01 179.36 3fef h THR 313 N 0.18 0.00 -0.09 0.32 2.02 -0.79 -1.06 112.91 113.50 3fef h THR 313 Ca 0.14 0.00 0.03 0.00 0.77 0.00 0.00 66.41 67.35 3fef h THR 313 Cb 0.15 0.00 -0.00 0.00 -1.74 0.00 0.00 68.15 66.56 3fef h THR 313 CO -0.19 0.00 0.08 -0.33 0.37 0.00 0.00 175.52 175.46 3fef h GLU 314 N -0.20 0.00 0.27 6.66 4.39 -1.11 -0.45 114.58 124.14 3fef h GLU 314 Ca 0.03 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.72 3fef h GLU 314 Cb 0.29 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.95 3fef h GLU 314 CO -0.29 0.00 -0.13 -0.09 -1.16 0.00 0.00 179.01 177.34 3fef h ARG 315 N 0.00 -0.35 -0.54 2.33 2.43 0.11 -1.51 114.38 116.84 3fef h ARG 315 Ca 0.04 0.02 0.03 0.00 -0.81 0.00 0.00 59.98 59.27 3fef h ARG 315 Cb 0.21 0.08 -0.04 0.00 -0.42 0.00 0.00 29.97 29.80 3fef h ARG 315 CO -0.00 -0.16 0.31 -0.07 -1.51 0.00 0.00 179.97 178.55 3fef h LEU 316 N -0.48 0.50 -0.97 3.80 3.38 0.08 -1.61 115.31 120.01 3fef h LEU 316 Ca -0.04 0.01 -0.00 0.00 0.09 0.00 0.00 57.88 57.94 3fef h LEU 316 Cb 0.36 -0.09 -0.05 0.00 0.09 0.00 0.00 40.66 40.97 3fef h LEU 316 CO 0.06 0.35 0.57 0.40 0.09 0.00 0.00 178.44 179.91 3fef h ILE 317 N 0.62 1.26 -0.38 1.22 2.04 -1.33 -0.58 117.51 120.36 3fef h ILE 317 Ca 0.22 -0.56 -0.13 0.00 1.00 0.00 0.00 64.86 65.40 3fef h ILE 317 Cb 0.05 -0.08 -0.01 0.00 -0.74 0.00 0.00 36.82 36.04 3fef h ILE 317 CO -0.11 0.27 -0.28 0.58 0.00 0.00 0.00 178.15 178.61 3fef h VAL 318 N 1.30 1.28 -0.52 1.67 2.07 -0.81 -3.08 116.25 118.15 3fef h VAL 318 Ca 0.34 -1.43 0.00 0.00 0.82 0.00 0.00 66.70 66.43 3fef h VAL 318 Cb -0.06 1.29 0.00 0.00 -1.52 0.00 0.00 31.29 31.00 3fef h VAL 318 CO -0.06 0.47 0.00 0.00 0.02 0.00 0.00 177.57 178.00 3fef n GLN 319 N -4.09 2.88 -3.84 1.57 6.02 -0.65 -4.92 117.38 114.35 3fef n GLN 319 Ca -0.01 -2.15 -0.30 0.00 -0.01 0.00 0.00 57.00 54.53 3fef n GLN 319 Cb 0.47 -1.66 -0.01 0.00 1.02 0.00 0.00 30.24 30.06 3fef n GLN 319 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 177.06 177.09 3fef n GLN 320 N 0.91 -3.45 -4.08 -1.09 3.00 -0.74 -4.96 117.38 106.97 3fef n GLN 320 Ca 0.20 0.42 -0.27 0.00 -0.01 0.00 0.00 57.00 57.33 3fef n GLN 320 Cb 0.65 -5.16 -0.06 0.00 0.00 0.00 0.00 30.24 25.67 3fef n GLN 320 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.06 178.09 3fef s ARG 321 N -6.52 2.87 0.00 -1.09 0.52 -0.30 -4.96 118.95 109.47 3fef s ARG 321 Ca 0.60 -0.84 0.00 0.00 -0.52 0.00 0.00 55.73 54.97 3fef s ARG 321 Cb -0.32 -2.65 0.00 0.00 0.52 0.00 0.00 34.95 32.50 3fef s ARG 321 CO 0.74 0.50 0.00 0.41 0.02 0.00 0.00 175.30 176.97 3fef n GLY 322 N -0.16 3.01 3.65 -3.53 0.00 -1.23 -4.51 105.19 102.42 3fef n GLY 322 Ca -0.08 -2.16 -0.30 0.00 0.00 0.00 0.00 46.02 43.48 3fef n GLY 322 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3fef s VAL 323 N 0.23 1.64 0.08 1.61 -7.23 -1.26 -5.00 120.40 110.47 3fef s VAL 323 Ca 0.00 0.00 -0.22 0.00 -1.81 0.00 0.00 61.98 59.95 3fef s VAL 323 Cb 0.00 -2.58 -0.07 0.00 0.56 0.00 0.00 36.38 34.30 3fef s VAL 323 CO 0.00 0.00 0.65 0.00 -0.31 0.00 0.00 175.10 175.44 3fef s ALA 324 N -3.16 3.51 -1.36 1.32 0.00 -1.26 -4.90 121.76 115.91 3fef s ALA 324 Ca 0.72 0.14 -0.16 0.00 0.00 0.00 0.00 51.96 52.66 3fef s ALA 324 Cb -0.08 -2.77 0.06 0.00 0.00 0.00 0.00 23.12 20.33 3fef s ALA 324 CO 0.55 0.30 1.91 0.39 0.00 0.00 0.00 175.76 178.91 3fef n GLU 325 N 1.97 3.08 -3.75 0.00 1.02 -1.26 -4.57 120.64 117.13 3fef n GLU 325 Ca -0.08 -3.05 -0.12 0.00 -0.02 0.00 0.00 57.16 53.89 3fef n GLU 325 Cb 0.50 -3.40 -0.12 0.00 -0.02 0.00 0.00 31.44 28.40 3fef n GLU 325 CO 0.00 0.00 0.00 0.21 1.18 0.00 0.00 177.13 178.52 3fef s LYS 326 N 3.73 0.27 0.17 3.49 2.20 -1.26 -4.98 119.74 123.36 3fef s LYS 326 Ca 0.51 0.46 -0.33 0.00 -0.36 0.00 0.00 55.97 56.24 3fef s LYS 326 Cb 0.08 0.02 -0.14 0.00 -1.51 0.00 0.00 37.83 36.28 3fef s LYS 326 CO 0.02 -0.10 1.58 0.00 -0.36 0.00 0.00 175.35 176.48 3fef n ALA 327 N 3.57 1.48 0.12 3.13 0.00 -1.26 -4.47 120.51 123.09 3fef n ALA 327 Ca -0.19 0.44 0.02 0.00 0.00 0.00 0.00 53.44 53.71 3fef n ALA 327 Cb 0.56 -2.36 0.00 0.00 0.00 0.00 0.00 19.45 17.65 3fef n ALA 327 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 3fef h SER 328 N 5.84 0.00 0.00 0.00 4.64 -1.94 -3.48 113.55 118.62 3fef h SER 328 Ca -0.45 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.87 3fef h SER 328 Cb 1.25 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.34 3fef h SER 328 CO 0.88 0.53 0.00 0.61 -0.87 0.00 0.00 176.83 177.98 3fef n GLY 329 N 1.26 1.63 3.83 -0.77 0.00 -1.26 -5.09 105.19 104.79 3fef n GLY 329 Ca 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.72 3fef n GLY 329 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3fef s GLU 330 N -0.75 2.34 0.00 1.61 0.41 -1.26 -5.00 118.70 116.06 3fef s GLU 330 Ca 0.00 0.59 0.17 0.00 -0.41 0.00 0.00 54.97 55.33 3fef s GLU 330 Cb 0.00 -1.95 0.16 0.00 -1.78 0.00 0.00 34.13 30.56 3fef s GLU 330 CO 0.00 -1.43 1.08 0.39 -0.49 0.00 0.00 175.26 174.81 3fef n GLU 331 N -3.30 1.52 0.04 1.61 -0.58 -1.26 -4.77 120.64 113.91 3fef n GLU 331 Ca 0.07 -1.60 -0.14 0.00 -0.42 0.00 0.00 57.16 55.07 3fef n GLU 331 Cb 0.56 -1.34 -0.09 0.00 -0.57 0.00 0.00 31.44 30.00 3fef n GLU 331 CO 0.00 0.00 0.00 0.78 -0.48 0.00 0.00 177.13 177.43 3fef h GLY 332 N 3.41 -1.16 1.48 0.62 0.00 -1.99 0.30 103.07 105.74 3fef h GLY 332 Ca 0.00 0.66 -0.03 0.00 0.00 0.00 0.00 47.33 47.96 3fef h GLY 332 CO 0.00 -0.26 0.17 -2.08 0.00 0.00 0.00 176.54 174.36 3fef h VAL 333 N -0.59 1.18 -0.04 4.60 2.07 -1.95 -0.56 116.25 120.97 3fef h VAL 333 Ca 0.01 -0.59 -0.08 0.00 0.82 0.00 0.00 66.70 66.86 3fef h VAL 333 Cb 0.64 0.65 -0.01 0.00 -1.52 0.00 0.00 31.29 31.05 3fef h VAL 333 CO -0.33 0.23 -0.36 -1.13 0.02 0.00 0.00 177.57 175.99 3fef h ASN 334 N 0.66 0.08 -0.15 0.57 -0.73 -1.68 -0.82 115.58 113.52 3fef h ASN 334 Ca 0.16 -0.03 -0.14 0.00 1.87 0.00 0.00 56.30 58.16 3fef h ASN 334 Cb 0.17 -0.02 0.00 0.00 0.27 0.00 0.00 38.32 38.74 3fef h ASN 334 CO -0.01 0.44 -0.45 0.40 -0.37 0.00 0.00 177.43 177.43 3fef h ILE 335 N 0.07 1.35 -0.29 2.57 2.04 0.52 -2.30 117.51 121.47 3fef h ILE 335 Ca 0.01 -1.73 0.05 0.00 1.00 0.00 0.00 64.86 64.18 3fef h ILE 335 Cb 0.68 2.03 -0.04 0.00 -0.74 0.00 0.00 36.82 38.75 3fef h ILE 335 CO 0.05 0.53 0.02 0.40 0.00 0.00 0.00 178.15 179.15 3fef h ILE 336 N 0.21 0.82 -0.82 -0.67 2.04 -0.89 0.17 117.51 118.36 3fef h ILE 336 Ca -0.01 -0.04 0.04 0.00 1.00 0.00 0.00 64.86 65.84 3fef h ILE 336 Cb 1.08 0.70 -0.05 0.00 -0.74 0.00 0.00 36.82 37.80 3fef h ILE 336 CO 0.10 0.02 0.52 0.00 0.00 0.00 0.00 178.15 178.79 3fef h ALA 337 N 1.23 1.09 -0.60 1.87 0.00 -1.15 -0.56 119.26 121.14 3fef h ALA 337 Ca 0.14 -0.03 -0.08 0.00 0.00 0.00 0.00 54.91 54.94 3fef h ALA 337 Cb 0.17 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.66 3fef h ALA 337 CO -0.21 0.34 0.07 0.00 0.00 0.00 0.00 179.25 179.44 3fef h ALA 338 N 1.35 0.80 0.00 0.00 0.00 -0.81 0.14 119.26 120.74 3fef h ALA 338 Ca 0.33 -0.27 -0.03 0.00 0.00 0.00 0.00 54.91 54.94 3fef h ALA 338 Cb 0.03 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 17.59 3fef h ALA 338 CO -0.12 0.58 -0.14 -0.07 0.00 0.00 0.00 179.25 179.50 3fef h LEU 339 N 0.92 0.00 -0.27 0.00 3.38 0.17 -2.04 115.31 117.47 3fef h LEU 339 Ca 0.18 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.15 3fef h LEU 339 Cb 0.47 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.22 3fef h LEU 339 CO 0.02 0.14 -0.25 0.18 0.09 0.00 0.00 178.44 178.62 3fef n LEU 340 N -4.03 0.67 0.00 1.67 4.77 -0.30 0.54 117.00 120.32 3fef n LEU 340 Ca -0.02 -0.07 0.00 0.00 -0.03 0.00 0.00 56.01 55.89 3fef n LEU 340 Cb 0.23 -0.20 0.00 0.00 -2.33 0.00 0.00 43.42 41.12 3fef n LEU 340 CO 0.33 0.13 0.00 0.61 -1.33 0.00 0.00 177.39 177.14 3fef n GLY 341 N 1.37 0.78 1.59 -0.72 0.00 -0.79 -4.90 105.19 102.52 3fef n GLY 341 Ca 0.11 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 46.07 3fef n GLY 341 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3fef n LEU 342 N 0.00 4.72 0.00 0.99 4.77 -0.01 -4.88 117.00 122.59 3fef n LEU 342 Ca 0.00 -2.45 0.00 0.00 -0.03 0.00 0.00 56.01 53.53 3fef n LEU 342 Cb 0.00 -0.67 0.00 0.00 -2.33 0.00 0.00 43.42 40.42 3fef n LEU 342 CO 0.00 0.68 0.00 0.61 -1.33 0.00 0.00 177.39 177.35 3fef n GLY 343 N -0.10 3.26 3.32 -0.72 0.00 -1.26 -4.76 105.19 104.93 3fef n GLY 343 Ca 0.28 -1.09 -0.18 0.00 0.00 0.00 0.00 46.02 45.03 3fef n GLY 343 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 3fef s GLU 344 N -2.21 1.25 -0.22 1.61 -1.05 -1.26 -4.22 118.70 112.61 3fef s GLU 344 Ca 0.00 -1.50 -0.19 0.00 -0.15 0.00 0.00 54.97 53.12 3fef s GLU 344 Cb 0.00 -1.07 0.06 0.00 -0.44 0.00 0.00 34.13 32.68 3fef s GLU 344 CO 0.00 0.18 0.58 -1.17 0.95 0.00 0.00 175.26 175.80 3fef s LEU 345 N -3.10 -0.25 -0.24 1.83 2.96 -0.55 -5.00 118.68 114.34 3fef s LEU 345 Ca 0.19 1.17 0.01 0.00 -0.22 0.00 0.00 54.13 55.29 3fef s LEU 345 Cb -0.02 1.98 0.04 0.00 0.50 0.00 0.00 46.19 48.70 3fef s LEU 345 CO 0.06 -0.20 -0.12 -0.69 -1.32 0.00 0.00 176.35 174.07 3fef s VAL 346 N 0.43 2.32 0.18 1.68 1.01 -1.26 0.99 120.40 125.75 3fef s VAL 346 Ca -0.01 -1.32 -0.13 0.00 0.00 0.00 0.00 61.98 60.52 3fef s VAL 346 Cb -0.04 -2.23 0.01 0.00 0.00 0.00 0.00 36.38 34.12 3fef s VAL 346 CO -0.01 0.16 0.40 0.28 0.00 0.00 0.00 175.10 175.93 3fef s THR 347 N 1.20 0.05 0.17 3.92 -1.32 -0.95 -4.93 115.64 113.78 3fef s THR 347 Ca -0.03 -1.09 -0.30 0.00 -1.21 0.00 0.00 61.69 59.06 3fef s THR 347 Cb -0.17 -1.70 -0.07 0.00 -1.51 0.00 0.00 72.50 69.04 3fef s THR 347 CO -0.07 -0.22 0.98 0.54 -2.21 0.00 0.00 174.62 173.65 3fef s ASN 348 N -2.92 7.51 0.10 8.08 4.22 -1.26 -1.07 114.94 129.60 3fef s ASN 348 Ca 0.13 1.91 -0.06 0.00 -2.14 0.00 0.00 52.86 52.71 3fef s ASN 348 Cb 0.01 -2.60 -0.02 0.00 1.28 0.00 0.00 41.25 39.92 3fef s ASN 348 CO -0.02 -0.01 0.14 0.68 -2.04 0.00 0.00 177.10 175.85 3fef s VAL 349 N -0.50 0.14 -0.07 3.54 -7.23 0.24 -4.78 120.40 111.74 3fef s VAL 349 Ca 0.45 -1.47 -0.04 0.00 -1.81 0.00 0.00 61.98 59.11 3fef s VAL 349 Cb -0.26 -1.59 -0.04 0.00 0.56 0.00 0.00 36.38 35.05 3fef s VAL 349 CO 0.32 -0.62 0.12 0.20 -0.31 0.00 0.00 175.10 174.81 3fef s ASN 350 N -2.92 6.13 0.23 4.85 0.01 0.12 -1.82 114.94 121.52 3fef s ASN 350 Ca 0.11 0.35 -0.29 0.00 -0.71 0.00 0.00 52.86 52.31 3fef s ASN 350 Cb 0.06 -1.91 -0.09 0.00 0.41 0.00 0.00 41.25 39.72 3fef s ASN 350 CO -0.07 0.35 0.91 -2.84 -1.51 0.00 0.00 177.10 173.94 3fef s PRO 352 N -1.35 4.81 -0.16 -0.60 0.02 -1.26 -0.77 135.00 135.68 3fef s PRO 352 Ca 0.19 1.43 -0.29 0.00 0.02 0.00 0.00 61.00 62.35 3fef s PRO 352 Cb -0.12 -3.28 -0.01 0.00 0.02 0.00 0.00 34.50 31.11 3fef s PRO 352 CO 0.09 0.52 1.17 1.21 -0.33 0.00 0.00 177.00 179.66 3fef s ASN 353 N -1.16 7.03 -0.18 2.53 2.47 0.59 -4.79 114.94 121.43 3fef s ASN 353 Ca 0.40 1.61 0.14 0.00 0.42 0.00 0.00 52.86 55.43 3fef s ASN 353 Cb -0.25 -2.54 0.43 0.00 -1.45 0.00 0.00 41.25 37.44 3fef s ASN 353 CO 0.31 -0.68 1.20 0.00 -3.72 0.00 0.00 177.10 174.21 3fef n GLN 354 N 6.16 1.59 0.00 0.43 1.13 -1.26 -0.24 117.38 125.18 3fef n GLN 354 Ca 0.12 -3.18 0.00 0.00 -1.94 0.00 0.00 57.00 52.01 3fef n GLN 354 Cb 0.46 -1.37 0.00 0.00 0.11 0.00 0.00 30.24 29.43 3fef n GLN 354 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3fef n GLY 355 N -0.66 1.17 0.22 1.08 0.00 -1.26 -4.99 105.19 100.75 3fef n GLY 355 Ca 0.20 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.30 3fef n GLY 355 CO 0.00 0.00 0.00 0.06 0.00 0.00 0.00 173.32 173.38 3fef h GLN 356 N 1.07 0.00 -5.15 1.61 -0.00 -1.91 -3.37 115.11 107.35 3fef h GLN 356 Ca 0.00 0.00 -0.67 0.00 -0.00 0.00 0.00 58.65 57.98 3fef h GLN 356 Cb 0.00 0.00 -0.33 0.00 -0.00 0.00 0.00 27.48 27.15 3fef h GLN 356 CO 0.00 0.25 -0.84 0.08 -0.00 0.00 0.00 178.83 178.33 3fef s VAL 357 N -3.93 2.34 0.47 1.86 1.01 -1.26 -1.39 120.40 119.50 3fef s VAL 357 Ca -0.01 -0.87 -0.23 0.00 0.00 0.00 0.00 61.98 60.86 3fef s VAL 357 Cb 0.12 -1.97 -0.07 0.00 0.00 0.00 0.00 36.38 34.46 3fef s VAL 357 CO 0.65 0.53 1.21 -0.76 0.00 0.00 0.00 175.10 176.73 3fef s LEU 358 N 0.97 4.00 -1.30 3.92 1.43 -0.39 -3.94 118.68 123.37 3fef s LEU 358 Ca -0.03 2.42 0.00 0.00 -1.03 0.00 0.00 54.13 55.50 3fef s LEU 358 Cb -0.15 -4.21 0.00 0.00 0.03 0.00 0.00 46.19 41.86 3fef s LEU 358 CO -0.04 -1.03 0.00 0.59 0.23 0.00 0.00 176.35 176.10 3fef n ASN 359 N -0.52 -4.41 -4.25 2.29 3.02 -1.26 -4.72 115.26 105.41 3fef n ASN 359 Ca 0.07 0.22 -0.24 0.00 -0.03 0.00 0.00 54.58 54.61 3fef n ASN 359 Cb 0.47 -3.21 -0.13 0.00 -0.61 0.00 0.00 39.78 36.30 3fef n ASN 359 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 3fef s LEU 360 N -3.17 2.24 0.68 3.41 1.02 -1.25 -4.97 118.68 116.63 3fef s LEU 360 Ca 0.00 -0.60 -0.17 0.00 0.02 0.00 0.00 54.13 53.38 3fef s LEU 360 Cb 0.00 -0.86 -0.01 0.00 0.02 0.00 0.00 46.19 45.34 3fef s LEU 360 CO 0.00 0.08 0.96 -2.65 0.02 0.00 0.00 176.35 174.76 3fef n PRO 361 N 1.44 0.65 -2.66 1.29 -0.02 -1.26 -4.95 135.00 129.50 3fef n PRO 361 Ca -0.19 0.27 -0.33 0.00 -2.02 0.00 0.00 63.50 61.24 3fef n PRO 361 Cb 0.54 -2.20 -0.05 0.00 -0.02 0.00 0.00 33.50 31.76 3fef n PRO 361 CO 0.00 0.00 0.00 0.96 1.98 0.00 0.00 175.50 178.44 3fef s ILE 362 N -1.70 4.46 0.00 4.25 -4.36 -1.26 -3.58 121.20 119.02 3fef s ILE 362 Ca 0.75 1.35 0.00 0.00 -0.26 0.00 0.00 60.65 62.49 3fef s ILE 362 Cb -0.37 -3.65 0.00 0.00 1.25 0.00 0.00 42.46 39.69 3fef s ILE 362 CO 0.49 -0.47 0.00 0.00 0.24 0.00 0.00 174.94 175.20 3fef n GLN 363 N -1.02 0.00 -1.91 0.37 1.13 0.66 -4.86 117.38 111.75 3fef n GLN 363 Ca 0.07 0.00 -0.40 0.00 -1.94 0.00 0.00 57.00 54.73 3fef n GLN 363 Cb 0.54 -0.79 0.00 0.00 0.11 0.00 0.00 30.24 30.11 3fef n GLN 363 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 3fef s ALA 364 N -1.00 3.31 -0.26 -1.58 0.00 -1.23 -4.22 121.76 116.77 3fef s ALA 364 Ca 0.00 1.38 -0.29 0.00 0.00 0.00 0.00 51.96 53.05 3fef s ALA 364 Cb 0.00 -3.55 -0.01 0.00 0.00 0.00 0.00 23.12 19.57 3fef s ALA 364 CO 0.00 -1.00 1.38 0.42 0.00 0.00 0.00 175.76 176.55 3fef s ILE 365 N -1.21 4.04 0.24 0.00 -1.09 -1.26 -0.30 121.20 121.63 3fef s ILE 365 Ca 0.58 1.19 0.11 0.00 -2.23 0.00 0.00 60.65 60.29 3fef s ILE 365 Cb -0.42 -4.02 -0.05 0.00 -1.58 0.00 0.00 42.46 36.39 3fef s ILE 365 CO 0.54 -0.39 -0.19 0.68 -1.23 0.00 0.00 174.94 174.36 3fef s VAL 366 N 4.46 2.21 -0.25 2.92 -7.23 -1.26 -4.76 120.40 116.50 3fef s VAL 366 Ca 0.60 -2.27 -0.06 0.00 -1.81 0.00 0.00 61.98 58.43 3fef s VAL 366 Cb -0.19 -2.17 -0.02 0.00 0.56 0.00 0.00 36.38 34.55 3fef s VAL 366 CO 0.24 -0.41 0.04 -0.70 -0.31 0.00 0.00 175.10 173.96 3fef s GLU 367 N -3.38 3.56 0.20 4.82 2.12 0.10 -4.19 118.70 121.94 3fef s GLU 367 Ca 0.26 -0.53 -0.05 0.00 0.36 0.00 0.00 54.97 55.00 3fef s GLU 367 Cb -0.04 -3.26 -0.03 0.00 0.26 0.00 0.00 34.13 31.06 3fef s GLU 367 CO 0.12 -0.21 0.24 0.95 -0.54 0.00 0.00 175.26 175.82 3fef s THR 368 N 1.58 0.01 0.46 -1.70 -4.23 -0.76 -2.46 115.64 108.54 3fef s THR 368 Ca 0.06 -1.77 -0.24 0.00 -1.18 0.00 0.00 61.69 58.57 3fef s THR 368 Cb -0.15 -2.32 -0.09 0.00 1.34 0.00 0.00 72.50 71.29 3fef s THR 368 CO 0.02 -0.07 1.17 0.59 -0.54 0.00 0.00 174.62 175.79 3fef n ASN 369 N -0.28 1.98 -4.10 3.99 3.02 -1.25 -0.59 115.26 118.03 3fef n ASN 369 Ca -0.01 1.03 -0.10 0.00 -0.03 0.00 0.00 54.58 55.48 3fef n ASN 369 Cb 0.64 -1.46 -0.10 0.00 -0.61 0.00 0.00 39.78 38.25 3fef n ASN 369 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3fef s ALA 370 N -1.27 0.64 -0.21 5.41 0.00 -0.23 -1.35 121.76 124.74 3fef s ALA 370 Ca 0.65 -1.06 -0.17 0.00 0.00 0.00 0.00 51.96 51.38 3fef s ALA 370 Cb -0.50 0.16 -0.04 0.00 0.00 0.00 0.00 23.12 22.74 3fef s ALA 370 CO 0.55 -0.20 0.45 0.12 0.00 0.00 0.00 175.76 176.67 3fef s PHE 371 N -2.84 3.35 -0.10 0.00 5.36 0.13 -2.25 117.98 121.63 3fef s PHE 371 Ca 0.01 0.65 0.04 0.00 -0.96 0.00 0.00 56.93 56.67 3fef s PHE 371 Cb 0.00 -2.60 -0.00 0.00 -0.34 0.00 0.00 43.02 40.08 3fef s PHE 371 CO -0.04 -0.09 -0.23 0.42 -1.46 0.00 0.00 175.22 173.82 3fef s ILE 372 N 1.59 2.16 0.00 3.12 1.01 0.28 -0.68 121.20 128.69 3fef s ILE 372 Ca 0.20 -0.98 -0.00 0.00 0.00 0.00 0.00 60.65 59.87 3fef s ILE 372 Cb -0.15 -1.83 0.00 0.00 0.01 0.00 0.00 42.46 40.48 3fef s ILE 372 CO 0.09 0.56 0.00 1.07 0.00 0.00 0.00 174.94 176.66 3fef n THR 373 N 3.54 0.00 -1.62 2.92 5.66 0.14 -1.49 114.28 123.43 3fef n THR 373 Ca -0.19 -0.01 -0.55 0.00 -3.05 0.00 0.00 64.05 60.26 3fef n THR 373 Cb 0.53 0.00 -0.07 0.00 -1.55 0.00 0.00 70.33 69.24 3fef n THR 373 CO 0.00 0.00 0.00 -1.14 -3.05 0.00 0.00 175.07 170.88 3fef n ARG 374 N -0.00 1.24 -3.91 1.09 0.63 -1.07 -1.25 116.66 113.38 3fef n ARG 374 Ca -0.00 0.43 -0.31 0.00 -0.92 0.00 0.00 57.85 57.05 3fef n ARG 374 Cb 0.00 -2.25 0.01 0.00 0.45 0.00 0.00 32.46 30.67 3fef n ARG 374 CO 0.00 0.00 0.00 -1.71 -2.51 0.00 0.00 177.63 173.41 3fef n ASN 375 N 6.81 -4.46 -3.66 6.15 5.15 0.19 -4.94 115.26 120.50 3fef n ASN 375 Ca 0.31 -0.78 -0.07 0.00 -0.60 0.00 0.00 54.58 53.44 3fef n ASN 375 Cb 0.17 -3.58 -0.08 0.00 -0.53 0.00 0.00 39.78 35.76 3fef n ASN 375 CO 0.00 0.00 0.00 -0.13 1.40 0.00 0.00 177.26 178.53 3fef s ARG 376 N -6.62 0.43 -0.18 1.20 0.52 -0.38 -5.11 118.95 108.81 3fef s ARG 376 Ca 0.66 1.13 0.01 0.00 -0.52 0.00 0.00 55.73 57.00 3fef s ARG 376 Cb -0.34 0.41 0.03 0.00 0.52 0.00 0.00 34.95 35.58 3fef s ARG 376 CO 0.81 -0.22 -0.13 0.08 0.02 0.00 0.00 175.30 175.87 3fef s VAL 377 N 2.44 1.68 -0.18 3.52 1.01 -1.26 -0.69 120.40 126.92 3fef s VAL 377 Ca -0.05 -0.89 -0.00 0.00 0.00 0.00 0.00 61.98 61.04 3fef s VAL 377 Cb -0.11 -1.67 0.04 0.00 0.00 0.00 0.00 36.38 34.65 3fef s VAL 377 CO -0.15 0.30 -0.06 -1.10 0.00 0.00 0.00 175.10 174.09 3fef s GLN 378 N 1.41 1.56 0.68 2.72 -0.21 0.14 -4.94 119.66 121.01 3fef s GLN 378 Ca 0.01 -0.61 -0.16 0.00 0.02 0.00 0.00 55.36 54.63 3fef s GLN 378 Cb -0.15 -2.13 0.01 0.00 1.00 0.00 0.00 33.01 31.75 3fef s GLN 378 CO -0.09 -0.44 1.16 -2.14 -2.12 0.00 0.00 175.29 171.65 3fef s PRO 379 N 1.58 2.58 -0.15 2.91 0.02 -1.26 0.19 135.00 140.87 3fef s PRO 379 Ca -0.00 1.58 -0.05 0.00 0.02 0.00 0.00 61.00 62.55 3fef s PRO 379 Cb -0.16 -1.91 -0.03 0.00 0.02 0.00 0.00 34.50 32.42 3fef s PRO 379 CO -0.08 -1.46 0.01 0.42 -0.33 0.00 0.00 177.00 175.57 3fef s ILE 380 N -2.11 4.37 0.08 2.83 1.01 -0.46 -4.79 121.20 122.13 3fef s ILE 380 Ca 0.71 -0.20 -0.31 0.00 0.00 0.00 0.00 60.65 60.86 3fef s ILE 380 Cb -0.25 -2.91 -0.09 0.00 0.01 0.00 0.00 42.46 39.22 3fef s ILE 380 CO 0.41 0.52 1.86 -0.76 0.00 0.00 0.00 174.94 176.97 3fef s LEU 381 N -0.01 4.41 0.00 2.97 1.43 -1.26 -4.77 118.68 121.45 3fef s LEU 381 Ca 0.04 2.68 0.01 0.00 -1.03 0.00 0.00 54.13 55.82 3fef s LEU 381 Cb -0.13 -3.55 0.02 0.00 0.03 0.00 0.00 46.19 42.56 3fef s LEU 381 CO 0.02 -1.01 0.75 -1.20 0.23 0.00 0.00 176.35 175.13 3fef n SER 382 N 6.50 1.52 0.00 2.29 7.64 -0.48 -5.06 113.62 126.03 3fef n SER 382 Ca 0.18 -1.46 0.00 0.00 1.01 0.00 0.00 58.87 58.60 3fef n SER 382 Cb 0.40 -0.01 0.00 0.00 -1.01 0.00 0.00 64.21 63.59 3fef n SER 382 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3fef n GLY 383 N -0.14 -0.45 3.73 0.23 0.00 -1.24 -4.95 105.19 102.37 3fef n GLY 383 Ca 0.01 -1.12 -0.27 0.00 0.00 0.00 0.00 46.02 44.64 3fef n GLY 383 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3fef s ALA 384 N -1.03 3.39 0.57 4.61 0.00 -1.26 -1.26 121.76 126.78 3fef s ALA 384 Ca 0.00 -1.27 -0.09 0.00 0.00 0.00 0.00 51.96 50.60 3fef s ALA 384 Cb 0.00 -1.19 -0.04 0.00 0.00 0.00 0.00 23.12 21.89 3fef s ALA 384 CO 0.00 0.52 0.95 -0.51 0.00 0.00 0.00 175.76 176.71 3fef s LEU 385 N -2.95 3.37 0.70 0.00 1.43 -1.26 -5.00 118.68 114.96 3fef s LEU 385 Ca 0.29 1.26 -0.16 0.00 -1.03 0.00 0.00 54.13 54.48 3fef s LEU 385 Cb -0.10 -4.27 0.00 0.00 0.03 0.00 0.00 46.19 41.85 3fef s LEU 385 CO 0.21 -0.77 1.06 -2.65 0.23 0.00 0.00 176.35 174.43 3fef n PRO 386 N -2.57 0.66 -0.13 1.29 -0.02 -1.26 -4.67 135.00 128.31 3fef n PRO 386 Ca 0.04 0.28 -0.04 0.00 -2.02 0.00 0.00 63.50 61.76 3fef n PRO 386 Cb 0.54 -2.30 0.04 0.00 -0.02 0.00 0.00 33.50 31.76 3fef n PRO 386 CO 0.00 0.00 0.00 -0.22 1.98 0.00 0.00 175.50 177.26 3fef h LYS 387 N -0.04 0.22 0.00 -0.52 1.63 -1.96 -0.55 116.57 115.34 3fef h LYS 387 Ca -0.48 -0.01 -0.04 0.00 -0.85 0.00 0.00 60.65 59.26 3fef h LYS 387 Cb 1.34 -0.05 -0.01 0.00 -0.60 0.00 0.00 32.23 32.91 3fef h LYS 387 CO 0.49 0.15 -0.20 0.78 -3.45 0.00 0.00 179.45 177.21 3fef h GLY 388 N 0.23 0.00 1.26 5.01 0.00 -1.96 -2.49 103.07 105.12 3fef h GLY 388 Ca 0.20 0.00 -0.32 0.00 0.00 0.00 0.00 47.33 47.21 3fef h GLY 388 CO -0.26 0.00 -1.40 -2.08 0.00 0.00 0.00 176.54 172.80 3fef h VAL 389 N 0.00 1.28 0.00 4.60 2.07 -1.68 -2.78 116.25 119.74 3fef h VAL 389 Ca -0.00 -2.61 0.00 0.00 0.82 0.00 0.00 66.70 64.91 3fef h VAL 389 Cb 0.43 2.91 0.00 0.00 -1.52 0.00 0.00 31.29 33.12 3fef h VAL 389 CO 0.03 0.79 0.00 1.21 0.02 0.00 0.00 177.57 179.61 3fef n GLU 390 N -3.74 0.07 0.00 1.57 2.13 -0.30 -1.04 120.64 119.34 3fef n GLU 390 Ca -0.16 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.66 3fef n GLU 390 Cb 1.06 -1.39 0.00 0.00 0.27 0.00 0.00 31.44 31.38 3fef n GLU 390 CO 0.00 0.00 0.00 1.28 -0.41 0.00 0.00 177.13 178.00 3fef n LEU 392 N 0.88 0.00 -0.15 4.31 4.77 -1.05 -1.11 117.00 124.65 3fef n LEU 392 Ca 0.00 0.00 -0.11 0.00 -0.03 0.00 0.00 56.01 55.87 3fef n LEU 392 Cb 0.03 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 41.12 3fef n LEU 392 CO 0.00 0.00 0.72 0.00 -1.33 0.00 0.00 177.39 176.78 3fef h ALA 393 N 0.00 0.62 -0.69 -1.18 0.00 -1.38 -0.37 119.26 116.25 3fef h ALA 393 Ca 0.00 -0.34 0.07 0.00 0.00 0.00 0.00 54.91 54.64 3fef h ALA 393 Cb 0.00 -0.16 -0.06 0.00 0.00 0.00 0.00 17.79 17.57 3fef h ALA 393 CO 0.00 0.52 0.38 0.00 0.00 0.00 0.00 179.25 180.15 3fef h ALA 394 N 0.87 0.94 -0.28 0.00 0.00 -1.37 0.42 119.26 119.84 3fef h ALA 394 Ca 0.11 0.02 -0.02 0.00 0.00 0.00 0.00 54.91 55.03 3fef h ALA 394 Cb 0.66 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.32 3fef h ALA 394 CO 0.05 0.05 0.11 -0.09 0.00 0.00 0.00 179.25 179.36 3fef h ARG 395 N 0.69 0.42 -0.55 0.00 2.43 -1.63 0.02 114.38 115.77 3fef h ARG 395 Ca 0.32 -0.08 0.00 0.00 -0.81 0.00 0.00 59.98 59.41 3fef h ARG 395 Cb 0.22 -0.07 -0.03 0.00 -0.42 0.00 0.00 29.97 29.68 3fef h ARG 395 CO -0.20 0.46 0.36 0.45 -1.51 0.00 0.00 179.97 179.53 3fef h HIS 396 N 0.30 0.70 -0.54 2.20 3.86 -0.71 -2.38 115.15 118.59 3fef h HIS 396 Ca 0.09 0.01 0.05 0.00 -1.16 0.00 0.00 60.37 59.36 3fef h HIS 396 Cb 0.19 -0.24 -0.05 0.00 1.06 0.00 0.00 27.41 28.38 3fef h HIS 396 CO -0.00 0.45 0.28 0.82 0.86 0.00 0.00 177.93 180.34 3fef h ILE 397 N 0.75 0.95 -0.57 2.45 2.04 0.08 0.12 117.51 123.32 3fef h ILE 397 Ca 0.20 -0.18 0.11 0.00 1.00 0.00 0.00 64.86 65.99 3fef h ILE 397 Cb -0.07 0.37 -0.11 0.00 -0.74 0.00 0.00 36.82 36.27 3fef h ILE 397 CO -0.04 0.10 -0.18 0.28 0.00 0.00 0.00 178.15 178.31 3fef h SER 398 N 0.53 -0.65 -0.69 1.72 0.02 -0.75 0.98 113.55 114.71 3fef h SER 398 Ca 0.24 0.18 -0.05 0.00 -0.84 0.00 0.00 61.79 61.32 3fef h SER 398 Cb 0.15 0.40 -0.03 0.00 0.14 0.00 0.00 62.40 63.06 3fef h SER 398 CO -0.17 -0.22 0.24 0.78 -1.14 0.00 0.00 176.83 176.32 3fef h ASN 399 N -0.04 1.00 -0.39 3.07 2.35 -0.76 -2.37 115.58 118.44 3fef h ASN 399 Ca 0.27 -0.17 -0.03 0.00 -0.55 0.00 0.00 56.30 55.82 3fef h ASN 399 Cb 0.46 -0.26 -0.02 0.00 0.05 0.00 0.00 38.32 38.55 3fef h ASN 399 CO -0.61 0.92 0.13 1.56 -1.65 0.00 0.00 177.43 177.77 3fef h GLN 400 N 1.04 0.60 -0.65 0.81 4.20 0.26 -0.12 115.11 121.25 3fef h GLN 400 Ca 0.23 -0.13 -0.06 0.00 0.06 0.00 0.00 58.65 58.76 3fef h GLN 400 Cb 0.26 -0.09 -0.03 0.00 0.30 0.00 0.00 27.48 27.93 3fef h GLN 400 CO -0.01 0.60 0.18 0.93 -0.67 0.00 0.00 178.83 179.86 3fef h GLU 401 N 0.49 1.03 -0.70 1.46 4.39 -0.78 -1.42 114.58 119.05 3fef h GLU 401 Ca 0.13 -0.23 -0.07 0.00 0.34 0.00 0.00 59.36 59.53 3fef h GLU 401 Cb 0.25 -0.14 -0.03 0.00 -0.10 0.00 0.00 28.75 28.73 3fef h GLU 401 CO -0.00 0.91 0.17 0.00 -1.16 0.00 0.00 179.01 178.92 3fef h ALA 402 N 1.07 0.98 -0.12 3.43 0.00 -1.23 -1.05 119.26 122.34 3fef h ALA 402 Ca 0.21 -0.25 -0.00 0.00 0.00 0.00 0.00 54.91 54.87 3fef h ALA 402 Cb 0.33 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 3fef h ALA 402 CO -0.00 0.66 0.05 0.28 0.00 0.00 0.00 179.25 180.24 3fef h VAL 403 N 1.05 1.13 -0.29 0.00 2.07 -0.72 0.17 116.25 119.66 3fef h VAL 403 Ca 0.22 -0.37 0.06 0.00 0.82 0.00 0.00 66.70 67.43 3fef h VAL 403 Cb 0.37 1.16 -0.06 0.00 -1.52 0.00 0.00 31.29 31.24 3fef h VAL 403 CO 0.00 0.11 -0.08 0.00 0.02 0.00 0.00 177.57 177.62 3fef h ALA 404 N 0.92 0.18 -0.35 1.67 0.00 -1.01 0.73 119.26 121.41 3fef h ALA 404 Ca 0.04 0.11 -0.04 0.00 0.00 0.00 0.00 54.91 55.02 3fef h ALA 404 Cb 0.13 0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 3fef h ALA 404 CO -0.00 -0.47 0.05 -0.44 0.00 0.00 0.00 179.25 178.38 3fef h ASP 405 N -0.01 0.56 -0.37 0.00 3.32 -1.13 -1.95 116.42 116.83 3fef h ASP 405 Ca 0.14 -0.26 0.05 0.00 0.02 0.00 0.00 57.03 56.97 3fef h ASP 405 Cb 0.23 -0.15 -0.04 0.00 0.22 0.00 0.00 39.33 39.59 3fef h ASP 405 CO -0.31 0.68 0.12 0.00 -1.72 0.00 0.00 179.24 178.02 3fef h ALA 406 N 0.90 0.43 -0.42 3.45 0.00 -0.20 -1.28 119.26 122.13 3fef h ALA 406 Ca 0.10 0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.07 3fef h ALA 406 Cb 0.36 0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.16 3fef h ALA 406 CO 0.01 -0.27 0.28 0.78 0.00 0.00 0.00 179.25 180.05 3fef h GLY 407 N 0.27 0.60 1.63 0.00 0.00 -0.79 0.12 103.07 104.90 3fef h GLY 407 Ca 0.17 -0.22 -0.05 0.00 0.00 0.00 0.00 47.33 47.23 3fef h GLY 407 CO -0.18 0.22 -0.05 1.41 0.00 0.00 0.00 176.54 177.93 3fef h LEU 408 N 0.57 0.43 -2.54 3.11 3.38 -0.97 -3.12 115.31 116.17 3fef h LEU 408 Ca 0.16 -0.09 0.00 0.00 0.09 0.00 0.00 57.88 58.04 3fef h LEU 408 Cb -0.07 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 40.57 3fef h LEU 408 CO -0.03 0.54 0.00 0.35 0.09 0.00 0.00 178.44 179.39 3fef n THR 409 N -4.26 0.76 -3.71 0.22 -2.24 -0.52 -5.00 114.28 99.53 3fef n THR 409 Ca 0.01 -0.88 -0.31 0.00 -2.27 0.00 0.00 64.05 60.60 3fef n THR 409 Cb 0.27 0.70 0.04 0.00 -2.10 0.00 0.00 70.33 69.23 3fef n THR 409 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 3fef n LYS 410 N 0.91 -1.50 -3.93 -0.78 5.02 0.31 -4.96 118.16 113.22 3fef n LYS 410 Ca 0.15 0.45 -0.30 0.00 -2.02 0.00 0.00 58.31 56.59 3fef n LYS 410 Cb 0.47 -4.17 -0.13 0.00 -0.02 0.00 0.00 35.03 31.18 3fef n LYS 410 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 3fef s ASP 411 N -3.57 4.46 0.34 4.39 -1.08 -0.54 -4.95 116.67 115.71 3fef s ASP 411 Ca 0.42 -3.19 0.01 0.00 -0.52 0.00 0.00 52.55 49.27 3fef s ASP 411 Cb -0.15 -1.65 0.59 0.00 -1.46 0.00 0.00 42.92 40.25 3fef s ASP 411 CO 0.86 -0.20 2.00 0.71 0.52 0.00 0.00 175.17 179.06 3fef h THR 412 N 5.25 1.17 -0.65 1.71 1.35 -1.93 -1.59 112.91 118.22 3fef h THR 412 Ca -0.03 -0.32 0.14 0.00 -0.55 0.00 0.00 66.41 65.65 3fef h THR 412 Cb 0.86 0.16 -0.11 0.00 -1.73 0.00 0.00 68.15 67.33 3fef h THR 412 CO 0.70 0.17 0.03 1.23 -0.25 0.00 0.00 175.52 177.40 3fef h GLY 413 N 0.93 0.74 1.14 5.82 0.00 -1.99 0.12 103.07 109.83 3fef h GLY 413 Ca 0.26 0.06 -0.14 0.00 0.00 0.00 0.00 47.33 47.51 3fef h GLY 413 CO -0.06 -0.21 -0.28 -2.00 0.00 0.00 0.00 176.54 174.00 3fef h LEU 414 N 0.14 1.01 -0.82 3.11 5.85 -1.70 -2.76 115.31 120.15 3fef h LEU 414 Ca 0.35 -0.41 0.05 0.00 0.84 0.00 0.00 57.88 58.71 3fef h LEU 414 Cb 0.58 -0.28 -0.06 0.00 0.37 0.00 0.00 40.66 41.27 3fef h LEU 414 CO -0.54 1.21 0.51 0.00 -0.34 0.00 0.00 178.44 179.27 3fef h ALA 415 N 0.85 1.11 -0.47 1.25 0.00 -0.71 -2.21 119.26 119.07 3fef h ALA 415 Ca 0.09 -0.01 -0.07 0.00 0.00 0.00 0.00 54.91 54.92 3fef h ALA 415 Cb 0.86 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 18.40 3fef h ALA 415 CO 0.08 0.26 -0.01 0.35 0.00 0.00 0.00 179.25 179.93 3fef h PHE 416 N 0.94 0.84 -0.69 0.00 3.57 -0.66 -1.14 116.94 119.81 3fef h PHE 416 Ca 0.35 -0.12 0.03 0.00 3.53 0.00 0.00 57.97 61.76 3fef h PHE 416 Cb 0.13 -0.23 -0.04 0.00 2.79 0.00 0.00 35.95 38.59 3fef h PHE 416 CO -0.04 0.79 0.43 1.96 -2.23 0.00 0.00 178.31 179.22 3fef h GLN 417 N 0.74 0.81 -0.51 1.11 1.08 -1.13 0.93 115.11 118.14 3fef h GLN 417 Ca 0.14 -0.05 -0.05 0.00 -1.45 0.00 0.00 58.65 57.24 3fef h GLN 417 Cb 0.46 -0.18 -0.02 0.00 -0.05 0.00 0.00 27.48 27.69 3fef h GLN 417 CO 0.02 0.54 0.10 0.00 -0.95 0.00 0.00 178.83 178.54 3fef h ALA 418 N 1.30 0.67 -0.54 3.87 0.00 -1.10 -1.97 119.26 121.49 3fef h ALA 418 Ca 0.28 -0.22 0.05 0.00 0.00 0.00 0.00 54.91 55.01 3fef h ALA 418 Cb 0.02 -0.19 -0.05 0.00 0.00 0.00 0.00 17.79 17.57 3fef h ALA 418 CO -0.11 0.39 0.27 0.35 0.00 0.00 0.00 179.25 180.15 3fef h PHE 419 N 0.71 0.50 0.00 0.00 3.04 -0.70 -0.73 116.94 119.76 3fef h PHE 419 Ca 0.16 0.02 -0.04 0.00 3.98 0.00 0.00 57.97 62.09 3fef h PHE 419 Cb 0.36 -0.15 -0.01 0.00 2.56 0.00 0.00 35.95 38.72 3fef h PHE 419 CO 0.03 0.24 -0.18 -0.07 -2.02 0.00 0.00 178.31 176.31 3fef h LEU 420 N 0.53 0.00 -0.95 0.59 3.38 -0.64 -2.75 115.31 115.47 3fef h LEU 420 Ca 0.24 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.21 3fef h LEU 420 Cb 0.15 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.90 3fef h LEU 420 CO -0.17 0.18 0.00 -3.20 0.09 0.00 0.00 178.44 175.34 3fef n ASN 421 N -4.29 1.45 -4.71 -0.43 5.15 -0.31 -4.90 115.26 107.22 3fef n ASN 421 Ca -0.02 -1.56 -0.41 0.00 -0.60 0.00 0.00 54.58 51.99 3fef n ASN 421 Cb 0.24 -0.04 -0.04 0.00 -0.53 0.00 0.00 39.78 39.41 3fef n ASN 421 CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04 3fef s ASP 422 N -1.81 7.21 0.57 1.20 -1.08 -1.02 -4.94 116.67 116.80 3fef s ASP 422 Ca 0.36 1.46 0.27 0.00 -0.52 0.00 0.00 52.55 54.11 3fef s ASP 422 Cb 0.19 -2.50 1.55 0.00 -1.46 0.00 0.00 42.92 40.70 3fef s ASP 422 CO 0.30 -0.18 2.07 -0.65 0.52 0.00 0.00 175.17 177.23 3fef h PRO 423 N 6.70 0.00 0.00 4.34 0.11 -1.90 0.82 132.00 142.07 3fef h PRO 423 Ca -0.41 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.70 3fef h PRO 423 Cb 1.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.32 3fef h PRO 423 CO 0.75 0.00 -0.09 1.28 -0.21 0.00 0.00 178.00 179.73 3fef n LEU 424 N -4.00 0.10 -4.16 2.35 4.77 -1.26 -4.43 117.00 110.37 3fef n LEU 424 Ca 0.03 0.42 -0.44 0.00 -0.03 0.00 0.00 56.01 55.99 3fef n LEU 424 Cb 0.38 -0.45 0.00 0.00 -2.33 0.00 0.00 43.42 41.03 3fef n LEU 424 CO 0.30 0.02 1.19 0.52 -1.33 0.00 0.00 177.39 178.09 3fef n VAL 425 N -1.51 4.78 -2.73 4.08 0.31 0.28 -4.86 118.33 118.68 3fef n VAL 425 Ca 0.07 -5.34 -0.39 0.00 -0.01 0.00 0.00 64.34 58.67 3fef n VAL 425 Cb 0.34 -2.34 0.01 0.00 -0.91 0.00 0.00 33.84 30.94 3fef n VAL 425 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3fef n GLN 426 N 2.79 5.03 -4.47 5.55 6.02 -1.26 -4.85 117.38 126.19 3fef n GLN 426 Ca 0.29 -4.68 -0.23 0.00 -0.01 0.00 0.00 57.00 52.37 3fef n GLN 426 Cb 0.37 -2.44 -0.10 0.00 1.02 0.00 0.00 30.24 29.09 3fef n GLN 426 CO 0.00 0.00 0.00 0.96 -1.01 0.00 0.00 177.06 177.01 3fef s ILE 427 N -4.16 0.92 0.57 5.09 -4.36 -1.26 -5.10 121.20 112.89 3fef s ILE 427 Ca 0.39 -2.00 -0.21 0.00 -0.26 0.00 0.00 60.65 58.57 3fef s ILE 427 Cb 0.19 -2.60 -0.04 0.00 1.25 0.00 0.00 42.46 41.26 3fef s ILE 427 CO -0.10 0.00 1.35 -1.81 0.24 0.00 0.00 174.94 174.62 3fef s ASP 428 N -3.53 5.11 0.19 4.36 1.01 -1.26 -4.80 116.67 117.75 3fef s ASP 428 Ca 0.31 2.75 -0.12 0.00 0.71 0.00 0.00 52.55 56.20 3fef s ASP 428 Cb 0.06 -2.63 0.19 0.00 1.01 0.00 0.00 42.92 41.54 3fef s ASP 428 CO 0.15 -1.68 1.78 -0.09 0.21 0.00 0.00 175.17 175.53 3fef h ARG 429 N 1.25 0.48 -0.29 8.23 2.43 -1.98 -0.33 114.38 124.17 3fef h ARG 429 Ca -0.51 -0.03 -0.10 0.00 -0.81 0.00 0.00 59.98 58.53 3fef h ARG 429 Cb 1.31 -0.11 -0.01 0.00 -0.42 0.00 0.00 29.97 30.74 3fef h ARG 429 CO 0.56 0.32 -0.25 0.66 -1.51 0.00 0.00 179.97 179.75 3fef h SER 430 N 0.49 0.56 -0.80 -3.80 4.64 -1.99 0.26 113.55 112.92 3fef h SER 430 Ca 0.25 -0.20 -0.02 0.00 -0.47 0.00 0.00 61.79 61.36 3fef h SER 430 Cb 0.21 -0.15 -0.04 0.00 -0.31 0.00 0.00 62.40 62.10 3fef h SER 430 CO -0.20 0.80 0.41 0.44 -0.87 0.00 0.00 176.83 177.42 3fef h ASP 431 N 0.49 1.03 -0.02 4.97 3.32 -1.79 -2.38 116.42 122.04 3fef h ASP 431 Ca 0.07 -0.12 -0.12 0.00 0.02 0.00 0.00 57.03 56.88 3fef h ASP 431 Cb 0.69 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 39.97 3fef h ASP 431 CO 0.05 0.85 -0.38 0.00 -1.72 0.00 0.00 179.24 178.04 3fef h ALA 432 N 1.22 0.91 -0.06 3.45 0.00 -0.02 -1.00 119.26 123.76 3fef h ALA 432 Ca 0.28 -0.42 -0.01 0.00 0.00 0.00 0.00 54.91 54.76 3fef h ALA 432 Cb 0.07 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 17.75 3fef h ALA 432 CO -0.04 0.63 0.01 1.49 0.00 0.00 0.00 179.25 181.34 3fef h GLU 433 N 0.43 0.09 -0.60 0.00 4.81 -0.38 0.18 114.58 119.12 3fef h GLU 433 Ca 0.04 -0.02 0.05 0.00 -0.13 0.00 0.00 59.36 59.30 3fef h GLU 433 Cb 0.86 -0.01 -0.05 0.00 0.63 0.00 0.00 28.75 30.18 3fef h GLU 433 CO 0.07 0.31 0.33 0.37 -0.73 0.00 0.00 179.01 179.37 3fef h GLN 434 N -0.14 0.61 -0.06 1.92 5.75 -1.38 -0.64 115.11 121.18 3fef h GLN 434 Ca 0.02 -0.04 -0.00 0.00 -0.15 0.00 0.00 58.65 58.48 3fef h GLN 434 Cb 0.26 -0.14 -0.00 0.00 1.07 0.00 0.00 27.48 28.67 3fef h GLN 434 CO 0.00 0.41 0.03 1.25 -2.65 0.00 0.00 178.83 177.87 3fef h LEU 435 N 0.63 0.07 -0.10 -2.39 5.85 -0.89 -1.05 115.31 117.44 3fef h LEU 435 Ca 0.26 -0.08 0.03 0.00 0.84 0.00 0.00 57.88 58.93 3fef h LEU 435 Cb 0.14 -0.02 -0.03 0.00 0.37 0.00 0.00 40.66 41.12 3fef h LEU 435 CO -0.16 0.14 -0.09 0.15 -0.34 0.00 0.00 178.44 178.14 3fef h PHE 436 N 0.01 -0.22 -0.83 1.25 3.57 -0.22 -2.59 116.94 117.91 3fef h PHE 436 Ca 0.02 0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.52 3fef h PHE 436 Cb 0.08 0.11 -0.04 0.00 2.79 0.00 0.00 35.95 38.89 3fef h PHE 436 CO -0.05 -0.14 0.47 -0.91 -2.23 0.00 0.00 178.31 175.45 3fef h ASN 437 N -0.11 1.02 0.00 0.41 2.35 -1.02 0.11 115.58 118.34 3fef h ASN 437 Ca 0.07 -0.08 0.00 0.00 -0.55 0.00 0.00 56.30 55.74 3fef h ASN 437 Cb 0.21 -0.26 0.00 0.00 0.05 0.00 0.00 38.32 38.32 3fef h ASN 437 CO -0.16 0.81 0.00 0.47 -1.65 0.00 0.00 177.43 176.90 3fef n ASP 438 N -4.35 0.16 0.00 5.81 8.00 -0.41 -5.11 116.55 120.65 3fef n ASP 438 Ca 0.09 -0.26 0.00 0.00 0.71 0.00 0.00 54.79 55.33 3fef n ASP 438 Cb 0.09 -0.07 0.00 0.00 -0.02 0.00 0.00 41.12 41.12 3fef n ASP 438 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99